diff --git a/compounds/MCL1_ligands/lig_27.mol2 b/compounds/MCL1_ligands/lig_27.mol2 new file mode 100644 index 0000000..3a4a41a --- /dev/null +++ b/compounds/MCL1_ligands/lig_27.mol2 @@ -0,0 +1,89 @@ +@MOLECULE +lig_27.pdbqt +38 40 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 CA 4.9403 2.2329 1.0039 C.ar 1 UNL1 0.0413 + 2 N 4.0972 2.8649 1.9162 N.ar 1 UNL1 -0.2154 + 3 C 3.5010 3.8738 1.1872 C.ar 1 UNL1 -0.0403 + 4 C 2.5716 4.8239 1.6268 C.2 1 UNL1 -0.1500 + 5 C 2.1093 5.7703 0.6898 C.2 1 UNL1 -0.1430 + 6 C 2.5806 5.7478 -0.6429 C.2 1 UNL1 -0.1780 + 7 C 3.5190 4.7792 -1.0582 C.2 1 UNL1 -0.0960 + 8 C 3.9658 3.8424 -0.1151 C.ar 1 UNL1 -0.0710 + 9 C 4.8736 2.8070 -0.2477 C.ar 1 UNL1 -0.1802 + 10 C 5.6331 2.4022 -1.4956 C.3 1 UNL1 -0.0042 + 11 C 7.0990 2.8957 -1.4481 C.3 1 UNL1 -0.0944 + 12 C 8.1106 1.8901 -2.0416 C.3 1 UNL1 0.1114 + 13 O 8.0778 1.9234 -3.4868 O.2 1 UNL1 -0.3519 + 14 C 7.0824 1.3420 -4.2400 C.2 1 UNL1 0.1341 + 15 C 6.4818 0.1224 -3.8774 C.2 1 UNL1 -0.1815 + 16 C 5.4809 -0.4381 -4.6893 C.2 1 UNL1 -0.1105 + 17 C 5.0896 0.2121 -5.8716 C.2 1 UNL1 -0.1850 + 18 C 5.6996 1.4213 -6.2439 C.2 1 UNL1 -0.1105 + 19 C 6.6977 1.9803 -5.4277 C.2 1 UNL1 -0.1815 + 20 C 5.7947 1.0765 1.4177 C.2 1 UNL1 0.8433 + 21 O 5.7001 0.7272 2.5865 O.co2 1 UNL1 -0.8208 + 22 OXT 6.5521 0.5300 0.6283 O.co2 1 UNL1 -0.8208 + 23 H 3.9983 2.6102 2.8870 H 1 UNL1 0.3097 + 24 HC 2.2216 4.8307 2.6539 H 1 UNL1 0.1170 + 25 HC1 1.3884 6.5226 0.9949 H 1 UNL1 0.1070 + 26 HC2 2.2196 6.4839 -1.3545 H 1 UNL1 0.1070 + 27 HC3 3.8879 4.7605 -2.0782 H 1 UNL1 0.1210 + 28 HC4 5.1431 2.7796 -2.4009 H 1 UNL1 0.0542 + 29 HC5 5.6007 1.3098 -1.5747 H 1 UNL1 0.0542 + 30 HC6 7.1858 3.8692 -1.9464 H 1 UNL1 0.0342 + 31 HC7 7.3846 3.0601 -0.4011 H 1 UNL1 0.0342 + 32 HC8 7.9289 0.8847 -1.6396 H 1 UNL1 0.0852 + 33 HC9 9.1126 2.1887 -1.7117 H 1 UNL1 0.0852 + 34 HC10 6.7776 -0.3858 -2.9647 H 1 UNL1 0.1695 + 35 HC11 5.0081 -1.3723 -4.3979 H 1 UNL1 0.1210 + 36 HC12 4.3133 -0.2204 -6.4962 H 1 UNL1 0.1140 + 37 HC13 5.3982 1.9246 -7.1580 H 1 UNL1 0.1210 + 38 HC14 7.1744 2.9149 -5.7012 H 1 UNL1 0.1695 +@BOND + 1 18 17 2 + 2 18 19 1 + 3 17 16 1 + 4 19 14 2 + 5 16 15 2 + 6 14 15 1 + 7 14 13 1 + 8 7 6 2 + 9 7 8 1 + 10 6 5 1 + 11 10 11 1 + 12 10 9 1 + 13 13 12 1 + 14 11 12 1 + 15 8 9 ar + 16 8 3 ar + 17 5 4 2 + 18 9 1 ar + 19 3 4 1 + 20 3 2 ar + 21 1 20 1 + 22 1 2 ar + 23 21 20 ar + 24 20 22 ar + 25 2 23 1 + 26 24 4 1 + 27 25 5 1 + 28 26 6 1 + 29 27 7 1 + 30 28 10 1 + 31 29 10 1 + 32 30 11 1 + 33 31 11 1 + 34 32 12 1 + 35 33 12 1 + 36 34 15 1 + 37 35 16 1 + 38 36 17 1 + 39 37 18 1 + 40 38 19 1 +@SUBSTRUCTURE + 1 UNL1 1 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_27.pdbqt b/compounds/MCL1_ligands/lig_27.pdbqt new file mode 100644 index 0000000..b825f82 --- /dev/null +++ b/compounds/MCL1_ligands/lig_27.pdbqt @@ -0,0 +1,49 @@ +REMARK Name = lig_27.pdbqt +REMARK 6 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: CA_1 and C_20 +REMARK 2 A between atoms: C_9 and C_10 +REMARK 3 A between atoms: C_10 and C_11 +REMARK 4 A between atoms: C_11 and C_12 +REMARK 5 A between atoms: C_12 and O_13 +REMARK 6 A between atoms: O_13 and C_14 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 CA UNL A 1 4.940 2.233 1.004 0.00 0.00 +0.041 A +ATOM 2 N UNL A 1 4.097 2.865 1.916 0.00 0.00 -0.215 N +ATOM 3 C UNL A 1 3.501 3.874 1.187 0.00 0.00 -0.040 A +ATOM 4 C UNL A 1 2.572 4.824 1.627 0.00 0.00 -0.033 C +ATOM 5 C UNL A 1 2.109 5.770 0.690 0.00 0.00 -0.036 C +ATOM 6 C UNL A 1 2.581 5.748 -0.643 0.00 0.00 -0.071 C +ATOM 7 C UNL A 1 3.519 4.779 -1.058 0.00 0.00 +0.025 C +ATOM 8 C UNL A 1 3.966 3.842 -0.115 0.00 0.00 -0.071 A +ATOM 9 C UNL A 1 4.874 2.807 -0.248 0.00 0.00 -0.180 A +ATOM 10 H UNL A 1 3.998 2.610 2.887 0.00 0.00 +0.310 HD +ENDROOT +BRANCH 1 11 +ATOM 11 C UNL A 1 5.795 1.077 1.418 0.00 0.00 +0.843 C +ATOM 12 O UNL A 1 5.700 0.727 2.587 0.00 0.00 -0.821 OA +ATOM 13 OXT UNL A 1 6.552 0.530 0.628 0.00 0.00 -0.821 OA +ENDBRANCH 1 11 +BRANCH 9 14 +ATOM 14 C UNL A 1 5.633 2.402 -1.496 0.00 0.00 +0.104 C +BRANCH 14 15 +ATOM 15 C UNL A 1 7.099 2.896 -1.448 0.00 0.00 -0.026 C +BRANCH 15 16 +ATOM 16 C UNL A 1 8.111 1.890 -2.042 0.00 0.00 +0.282 C +BRANCH 16 17 +ATOM 17 O UNL A 1 8.078 1.923 -3.487 0.00 0.00 -0.352 OA +BRANCH 17 18 +ATOM 18 C UNL A 1 7.082 1.342 -4.240 0.00 0.00 +0.134 C +ATOM 19 C UNL A 1 6.482 0.122 -3.877 0.00 0.00 -0.012 C +ATOM 20 C UNL A 1 5.481 -0.438 -4.689 0.00 0.00 +0.010 C +ATOM 21 C UNL A 1 5.090 0.212 -5.872 0.00 0.00 -0.071 C +ATOM 22 C UNL A 1 5.700 1.421 -6.244 0.00 0.00 +0.010 C +ATOM 23 C UNL A 1 6.698 1.980 -5.428 0.00 0.00 -0.012 C +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 14 15 +ENDBRANCH 9 14 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_28.mol2 b/compounds/MCL1_ligands/lig_28.mol2 new file mode 100644 index 0000000..7e08130 --- /dev/null +++ b/compounds/MCL1_ligands/lig_28.mol2 @@ -0,0 +1,95 @@ +@MOLECULE +lig_28.pdbqt +41 43 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 7.1234 1.9823 -0.3641 C.ar 1 UNL1 -0.1862 + 2 CA 7.4252 3.3754 -0.6455 C.ar 1 UNL1 0.0483 + 3 N 8.3000 3.4696 -1.7323 N.ar 1 UNL1 -0.2144 + 4 C 8.5715 2.1793 -2.1456 C.ar 1 UNL1 -0.0433 + 5 C 9.4022 1.7752 -3.1982 C.2 1 UNL1 -0.1490 + 6 C 9.5409 0.3918 -3.4334 C.2 1 UNL1 -0.1450 + 7 C 8.8633 -0.5442 -2.6192 C.2 1 UNL1 -0.1800 + 8 C 8.0360 -0.1081 -1.5637 C.2 1 UNL1 -0.1050 + 9 C 7.9008 1.2699 -1.3543 C.ar 1 UNL1 -0.0730 + 10 C 6.1607 1.5021 0.6935 C.3 1 UNL1 0.0138 + 11 C 4.6803 1.7195 0.2977 C.3 1 UNL1 -0.1134 + 12 C 4.2487 0.9938 -0.9981 C.3 1 UNL1 0.1314 + 13 O 3.6817 -0.2974 -0.6922 O.2 1 UNL1 -0.3679 + 14 C 4.4859 -1.3765 -0.4112 C.2 1 UNL1 0.1201 + 15 C 4.6344 -1.7717 0.9271 C.2 1 UNL1 -0.1380 + 16 C 5.4407 -2.8736 1.2548 C.2 1 UNL1 -0.1300 + 17 C 6.0881 -3.5907 0.2362 C.2 1 UNL1 -0.1500 + 18 C 5.9232 -3.2105 -1.1064 C.2 1 UNL1 -0.1270 + 19 C 5.1168 -2.1060 -1.4420 C.2 1 UNL1 -0.0963 + 20 C 4.9551 -1.7122 -2.9045 C.3 1 UNL1 -0.0598 + 21 C 6.9319 4.6012 0.0484 C.2 1 UNL1 0.8383 + 22 OXT 6.1801 4.5215 1.0064 O.co2 1 UNL1 -0.8153 + 23 O 7.3229 5.6700 -0.4009 O.co2 1 UNL1 -0.8153 + 24 H 8.6456 4.3435 -2.0989 H 1 UNL1 0.3097 + 25 HC 9.9227 2.5042 -3.8108 H 1 UNL1 0.1160 + 26 HC1 10.1774 0.0436 -4.2412 H 1 UNL1 0.1060 + 27 HC2 8.9818 -1.6075 -2.8031 H 1 UNL1 0.1070 + 28 HC3 7.5183 -0.8160 -0.9249 H 1 UNL1 0.1250 + 29 HC4 6.3609 2.0191 1.6404 H 1 UNL1 0.0422 + 30 HC5 6.3359 0.4392 0.8921 H 1 UNL1 0.0422 + 31 HC6 4.0284 1.4186 1.1261 H 1 UNL1 0.0692 + 32 HC7 4.5135 2.7942 0.1588 H 1 UNL1 0.0692 + 33 HC8 5.0851 0.9094 -1.7028 H 1 UNL1 0.0562 + 34 HC9 3.4724 1.5997 -1.4811 H 1 UNL1 0.0562 + 35 HC10 4.1337 -1.2061 1.7061 H 1 UNL1 0.1450 + 36 HC11 5.5671 -3.1654 2.2935 H 1 UNL1 0.1220 + 37 HC12 6.7184 -4.4393 0.4862 H 1 UNL1 0.1190 + 38 HC13 6.4296 -3.7693 -1.8881 H 1 UNL1 0.1230 + 39 HC14 3.9342 -1.3699 -3.1146 H 1 UNL1 0.0500 + 40 HC15 5.6443 -0.9003 -3.1680 H 1 UNL1 0.0500 + 41 HC16 5.1627 -2.5560 -3.5732 H 1 UNL1 0.0500 +@BOND + 1 23 21 ar + 2 5 4 2 + 3 5 6 1 + 4 3 4 ar + 5 3 2 ar + 6 21 2 1 + 7 21 22 ar + 8 4 9 ar + 9 6 7 2 + 10 2 1 ar + 11 20 19 1 + 12 19 18 1 + 13 19 14 2 + 14 18 17 2 + 15 17 16 1 + 16 9 1 ar + 17 9 8 2 + 18 16 15 2 + 19 14 15 1 + 20 14 13 1 + 21 7 8 1 + 22 12 13 1 + 23 12 11 1 + 24 1 10 1 + 25 11 10 1 + 26 3 24 1 + 27 25 5 1 + 28 26 6 1 + 29 27 7 1 + 30 28 8 1 + 31 29 10 1 + 32 30 10 1 + 33 31 11 1 + 34 32 11 1 + 35 33 12 1 + 36 34 12 1 + 37 35 15 1 + 38 36 16 1 + 39 37 17 1 + 40 38 18 1 + 41 39 20 1 + 42 40 20 1 + 43 41 20 1 +@SUBSTRUCTURE + 1 UNL1 2 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_28.pdbqt b/compounds/MCL1_ligands/lig_28.pdbqt new file mode 100644 index 0000000..53bbb2b --- /dev/null +++ b/compounds/MCL1_ligands/lig_28.pdbqt @@ -0,0 +1,51 @@ +REMARK Name = lig_28.pdbqt +REMARK 7 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_10 +REMARK 2 A between atoms: CA_2 and C_21 +REMARK 3 A between atoms: C_10 and C_11 +REMARK 4 A between atoms: C_11 and C_12 +REMARK 5 A between atoms: C_12 and O_13 +REMARK 6 A between atoms: O_13 and C_14 +REMARK 7 A between atoms: C_19 and C_20 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 7.123 1.982 -0.364 0.00 0.00 -0.186 A +ATOM 2 CA UNL A 1 7.425 3.375 -0.645 0.00 0.00 +0.048 A +ATOM 3 N UNL A 1 8.300 3.470 -1.732 0.00 0.00 -0.214 N +ATOM 4 C UNL A 1 8.572 2.179 -2.146 0.00 0.00 -0.043 A +ATOM 5 C UNL A 1 9.402 1.775 -3.198 0.00 0.00 -0.033 C +ATOM 6 C UNL A 1 9.541 0.392 -3.433 0.00 0.00 -0.039 C +ATOM 7 C UNL A 1 8.863 -0.544 -2.619 0.00 0.00 -0.073 C +ATOM 8 C UNL A 1 8.036 -0.108 -1.564 0.00 0.00 +0.020 C +ATOM 9 C UNL A 1 7.901 1.270 -1.354 0.00 0.00 -0.073 A +ATOM 10 H UNL A 1 8.646 4.343 -2.099 0.00 0.00 +0.310 HD +ENDROOT +BRANCH 2 11 +ATOM 11 C UNL A 1 6.932 4.601 0.048 0.00 0.00 +0.838 C +ATOM 12 OXT UNL A 1 6.180 4.521 1.006 0.00 0.00 -0.815 OA +ATOM 13 O UNL A 1 7.323 5.670 -0.401 0.00 0.00 -0.815 OA +ENDBRANCH 2 11 +BRANCH 1 14 +ATOM 14 C UNL A 1 6.161 1.502 0.694 0.00 0.00 +0.098 C +BRANCH 14 15 +ATOM 15 C UNL A 1 4.680 1.720 0.298 0.00 0.00 +0.025 C +BRANCH 15 16 +ATOM 16 C UNL A 1 4.249 0.994 -0.998 0.00 0.00 +0.244 C +BRANCH 16 17 +ATOM 17 O UNL A 1 3.682 -0.297 -0.692 0.00 0.00 -0.368 OA +BRANCH 17 18 +ATOM 18 C UNL A 1 4.486 -1.377 -0.411 0.00 0.00 +0.120 C +ATOM 19 C UNL A 1 4.634 -1.772 0.927 0.00 0.00 +0.007 C +ATOM 20 C UNL A 1 5.441 -2.874 1.255 0.00 0.00 -0.008 C +ATOM 21 C UNL A 1 6.088 -3.591 0.236 0.00 0.00 -0.031 C +ATOM 22 C UNL A 1 5.923 -3.211 -1.106 0.00 0.00 -0.004 C +ATOM 23 C UNL A 1 5.117 -2.106 -1.442 0.00 0.00 -0.096 C +ATOM 24 C UNL A 1 4.955 -1.712 -2.905 0.00 0.00 +0.090 C +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 14 15 +ENDBRANCH 1 14 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_30.mol2 b/compounds/MCL1_ligands/lig_30.mol2 new file mode 100644 index 0000000..56d88cd --- /dev/null +++ b/compounds/MCL1_ligands/lig_30.mol2 @@ -0,0 +1,95 @@ +@MOLECULE +lig_30.pdbqt +41 43 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 2.9853 2.3369 -0.2136 C.ar 1 UNL1 -0.1932 + 2 CA 1.6653 2.8089 -0.2456 C.ar 1 UNL1 -0.0372 + 3 N 1.5043 3.5462 -1.4325 N.ar 1 UNL1 -0.2144 + 4 C 2.6930 3.5340 -2.1284 C.ar 1 UNL1 -0.0423 + 5 C 2.9885 4.1298 -3.3603 C.2 1 UNL1 -0.1470 + 6 C 4.2942 3.9672 -3.8679 C.2 1 UNL1 -0.1450 + 7 C 5.2563 3.2266 -3.1427 C.2 1 UNL1 -0.1750 + 8 C 4.9237 2.6398 -1.9037 C.2 1 UNL1 -0.1040 + 9 C 3.6188 2.8144 -1.4221 C.ar 1 UNL1 -0.0730 + 10 C 3.5719 1.4708 0.8736 C.3 1 UNL1 0.0148 + 11 C 3.1881 -0.0189 0.7248 C.3 1 UNL1 -0.1124 + 12 C 3.4618 -0.5637 -0.6968 C.3 1 UNL1 0.1284 + 13 O 3.5991 -2.0000 -0.6560 O.2 1 UNL1 -0.3399 + 14 C 4.6975 -2.6567 -0.1388 C.2 1 UNL1 0.1531 + 15 C 4.6036 -4.0454 0.0287 C.2 1 UNL1 -0.1770 + 16 C 5.6900 -4.7746 0.5387 C.2 1 UNL1 -0.1040 + 17 C 6.8792 -4.1108 0.8811 C.2 1 UNL1 -0.1850 + 18 C 6.9861 -2.7187 0.7159 C.2 1 UNL1 -0.0453 + 19 C 8.2714 -1.9958 1.0815 C.3 1 UNL1 -0.0528 + 20 C 5.8948 -1.9963 0.2018 C.2 1 UNL1 -0.2050 + 21 C 0.5617 2.6150 0.7403 C.2 1 UNL1 0.9268 + 22 OXT 0.7350 1.9674 1.7601 O.co2 1 UNL1 -0.8143 + 23 O -0.5067 3.1393 0.4579 O.co2 1 UNL1 -0.8143 + 24 H 0.6369 3.9921 -1.6926 H 1 UNL1 0.3097 + 25 HC 2.2384 4.6948 -3.9038 H 1 UNL1 0.1170 + 26 HC1 4.5616 4.4133 -4.8208 H 1 UNL1 0.1070 + 27 HC2 6.2590 3.1080 -3.5418 H 1 UNL1 0.1080 + 28 HC3 5.6542 2.0707 -1.3389 H 1 UNL1 0.1170 + 29 HC4 3.2666 1.8330 1.8633 H 1 UNL1 0.0422 + 30 HC5 4.6650 1.5566 0.8537 H 1 UNL1 0.0422 + 31 HC6 3.7369 -0.5995 1.4752 H 1 UNL1 0.0672 + 32 HC7 2.1221 -0.1452 0.9529 H 1 UNL1 0.0672 + 33 HC8 4.3635 -0.1088 -1.1237 H 1 UNL1 0.0627 + 34 HC9 2.6203 -0.2889 -1.3462 H 1 UNL1 0.0627 + 35 HC10 3.6802 -4.5494 -0.2375 H 1 UNL1 0.1400 + 36 HC11 5.6089 -5.8498 0.6685 H 1 UNL1 0.1180 + 37 HC12 7.7170 -4.6781 1.2758 H 1 UNL1 0.1190 + 38 HC13 5.9855 -0.9243 0.0742 H 1 UNL1 0.1550 + 39 HC14 8.8485 -2.5567 1.8269 H 1 UNL1 0.0407 + 40 HC15 8.0611 -1.0049 1.5033 H 1 UNL1 0.0407 + 41 HC16 8.9048 -1.8577 0.1971 H 1 UNL1 0.0407 +@BOND + 1 6 5 1 + 2 6 7 2 + 3 5 4 2 + 4 7 8 1 + 5 4 3 ar + 6 4 9 ar + 7 3 2 ar + 8 8 9 2 + 9 23 21 ar + 10 9 1 ar + 11 2 21 1 + 12 2 1 ar + 13 21 22 ar + 14 1 10 1 + 15 13 12 1 + 16 13 14 1 + 17 15 14 2 + 18 15 16 1 + 19 12 11 1 + 20 14 20 1 + 21 20 18 2 + 22 16 17 2 + 23 17 18 1 + 24 18 19 1 + 25 10 11 1 + 26 3 24 1 + 27 25 5 1 + 28 26 6 1 + 29 27 7 1 + 30 28 8 1 + 31 29 10 1 + 32 30 10 1 + 33 31 11 1 + 34 32 11 1 + 35 33 12 1 + 36 34 12 1 + 37 35 15 1 + 38 36 16 1 + 39 37 17 1 + 40 38 20 1 + 41 39 19 1 + 42 40 19 1 + 43 41 19 1 +@SUBSTRUCTURE + 1 UNL1 2 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_30.pdbqt b/compounds/MCL1_ligands/lig_30.pdbqt new file mode 100644 index 0000000..ee2c9a3 --- /dev/null +++ b/compounds/MCL1_ligands/lig_30.pdbqt @@ -0,0 +1,51 @@ +REMARK Name = lig_30.pdbqt +REMARK 7 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_10 +REMARK 2 A between atoms: CA_2 and C_21 +REMARK 3 A between atoms: C_10 and C_11 +REMARK 4 A between atoms: C_11 and C_12 +REMARK 5 A between atoms: C_12 and O_13 +REMARK 6 A between atoms: O_13 and C_14 +REMARK 7 A between atoms: C_18 and C_19 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 2.985 2.337 -0.214 0.00 0.00 -0.193 A +ATOM 2 CA UNL A 1 1.665 2.809 -0.246 0.00 0.00 -0.037 A +ATOM 3 N UNL A 1 1.504 3.546 -1.433 0.00 0.00 -0.214 N +ATOM 4 C UNL A 1 2.693 3.534 -2.128 0.00 0.00 -0.042 A +ATOM 5 C UNL A 1 2.989 4.130 -3.360 0.00 0.00 -0.030 C +ATOM 6 C UNL A 1 4.294 3.967 -3.868 0.00 0.00 -0.038 C +ATOM 7 C UNL A 1 5.256 3.227 -3.143 0.00 0.00 -0.067 C +ATOM 8 C UNL A 1 4.924 2.640 -1.904 0.00 0.00 +0.013 C +ATOM 9 C UNL A 1 3.619 2.814 -1.422 0.00 0.00 -0.073 A +ATOM 10 H UNL A 1 0.637 3.992 -1.693 0.00 0.00 +0.310 HD +ENDROOT +BRANCH 2 11 +ATOM 11 C UNL A 1 0.562 2.615 0.740 0.00 0.00 +0.927 C +ATOM 12 OXT UNL A 1 0.735 1.967 1.760 0.00 0.00 -0.814 OA +ATOM 13 O UNL A 1 -0.507 3.139 0.458 0.00 0.00 -0.814 OA +ENDBRANCH 2 11 +BRANCH 1 14 +ATOM 14 C UNL A 1 3.572 1.471 0.874 0.00 0.00 +0.099 C +BRANCH 14 15 +ATOM 15 C UNL A 1 3.188 -0.019 0.725 0.00 0.00 +0.022 C +BRANCH 15 16 +ATOM 16 C UNL A 1 3.462 -0.564 -0.697 0.00 0.00 +0.254 C +BRANCH 16 17 +ATOM 17 O UNL A 1 3.599 -2.000 -0.656 0.00 0.00 -0.340 OA +BRANCH 17 18 +ATOM 18 C UNL A 1 4.697 -2.657 -0.139 0.00 0.00 +0.153 C +ATOM 19 C UNL A 1 4.604 -4.045 0.029 0.00 0.00 -0.037 C +ATOM 20 C UNL A 1 5.690 -4.775 0.539 0.00 0.00 +0.014 C +ATOM 21 C UNL A 1 6.879 -4.111 0.881 0.00 0.00 -0.066 C +ATOM 22 C UNL A 1 6.986 -2.719 0.716 0.00 0.00 -0.045 C +ATOM 23 C UNL A 1 8.271 -1.996 1.081 0.00 0.00 +0.069 C +ATOM 24 C UNL A 1 5.895 -1.996 0.202 0.00 0.00 -0.050 C +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 14 15 +ENDBRANCH 1 14 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_31.mol2 b/compounds/MCL1_ligands/lig_31.mol2 new file mode 100644 index 0000000..d76e70b --- /dev/null +++ b/compounds/MCL1_ligands/lig_31.mol2 @@ -0,0 +1,95 @@ +@MOLECULE +lig_31.pdbqt +41 43 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 7.1930 1.9889 1.7773 C.3 1 UNL1 -0.0042 + 2 C 8.4314 1.4231 1.1213 C.ar 1 UNL1 -0.1822 + 3 C 9.7993 1.8361 1.3376 C.ar 1 UNL1 -0.0710 + 4 C 10.3293 2.8486 2.1489 C.2 1 UNL1 -0.0960 + 5 C 10.6127 1.0338 0.5847 C.ar 1 UNL1 -0.0393 + 6 C 11.7303 3.0177 2.1675 C.2 1 UNL1 -0.1770 + 7 C 12.5642 2.1838 1.3873 C.2 1 UNL1 -0.1410 + 8 C 12.0058 1.1716 0.5802 C.2 1 UNL1 -0.1490 + 9 N 9.8370 0.1297 -0.1050 N.ar 1 UNL1 -0.2144 + 10 CA 8.4847 0.3488 0.2179 C.ar 1 UNL1 -0.0482 + 11 C 7.3882 -0.4801 -0.3616 C.2 1 UNL1 0.9328 + 12 OXT 7.7302 -1.3554 -1.1422 O.co2 1 UNL1 -0.8228 + 13 O 6.2193 -0.2580 -0.0941 O.co2 1 UNL1 -0.8228 + 14 C 6.7609 3.3348 1.1511 C.3 1 UNL1 -0.0964 + 15 C 6.0416 3.1761 -0.2115 C.3 1 UNL1 0.1104 + 16 O 4.6825 3.6563 -0.0994 O.2 1 UNL1 -0.3459 + 17 C 3.7594 3.0336 0.7111 C.2 1 UNL1 0.1331 + 18 C 3.6188 1.6371 0.7274 C.2 1 UNL1 -0.1550 + 19 C 2.6854 1.0357 1.5852 C.2 1 UNL1 -0.1040 + 20 C 1.8875 1.8306 2.4250 C.2 1 UNL1 -0.1370 + 21 C 2.0131 3.2367 2.4154 C.2 1 UNL1 -0.1543 + 22 C 2.9505 3.8266 1.5387 C.2 1 UNL1 -0.1330 + 23 C 1.1371 4.1011 3.3294 C.3 1 UNL1 0.6872 + 24 F -0.0692 4.3453 2.7736 F 1 UNL1 -0.2486 + 25 F 0.9002 3.5128 4.5236 F 1 UNL1 -0.2486 + 26 F 1.6879 5.3054 3.6027 F 1 UNL1 -0.2486 + 27 H 10.1432 -0.5971 -0.7348 H 1 UNL1 0.3107 + 28 HC2 6.3575 1.2804 1.7801 H 1 UNL1 0.0542 + 29 HC3 7.4195 2.1637 2.8363 H 1 UNL1 0.0542 + 30 HC 9.6781 3.4802 2.7445 H 1 UNL1 0.1210 + 31 HC1 12.1696 3.7927 2.7888 H 1 UNL1 0.1090 + 32 HC4 13.6408 2.3231 1.4108 H 1 UNL1 0.1080 + 33 HC5 12.6315 0.5202 -0.0210 H 1 UNL1 0.1180 + 34 HC6 7.6452 3.9698 1.0187 H 1 UNL1 0.0362 + 35 HC7 6.1123 3.8652 1.8596 H 1 UNL1 0.0362 + 36 HC8 6.5714 3.7719 -0.9637 H 1 UNL1 0.0887 + 37 HC9 6.0674 2.1353 -0.5526 H 1 UNL1 0.0887 + 38 HC10 4.2361 1.0167 0.0834 H 1 UNL1 0.2210 + 39 HC11 2.5905 -0.0474 1.6000 H 1 UNL1 0.1430 + 40 HC12 1.1693 1.3517 3.0860 H 1 UNL1 0.1350 + 41 HC13 3.0722 4.9047 1.5027 H 1 UNL1 0.1520 +@BOND + 1 15 16 1 + 2 15 14 1 + 3 13 11 ar + 4 16 17 1 + 5 14 1 1 + 6 17 18 2 + 7 17 22 1 + 8 18 19 1 + 9 11 12 ar + 10 11 10 1 + 11 1 2 1 + 12 10 2 ar + 13 10 9 ar + 14 19 20 2 + 15 22 21 2 + 16 2 3 ar + 17 9 5 ar + 18 20 21 1 + 19 21 23 1 + 20 3 5 ar + 21 3 4 1 + 22 5 8 1 + 23 26 23 1 + 24 23 24 1 + 25 23 25 1 + 26 4 6 2 + 27 8 7 2 + 28 6 7 1 + 29 9 27 1 + 30 28 1 1 + 31 29 1 1 + 32 30 4 1 + 33 31 6 1 + 34 32 7 1 + 35 33 8 1 + 36 34 14 1 + 37 35 14 1 + 38 36 15 1 + 39 37 15 1 + 40 38 18 1 + 41 39 19 1 + 42 40 20 1 + 43 41 22 1 +@SUBSTRUCTURE + 1 UNL1 10 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_31.pdbqt b/compounds/MCL1_ligands/lig_31.pdbqt new file mode 100644 index 0000000..130c266 --- /dev/null +++ b/compounds/MCL1_ligands/lig_31.pdbqt @@ -0,0 +1,56 @@ +REMARK Name = lig_31.pdbqt +REMARK 7 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_2 +REMARK 2 A between atoms: C_1 and C_14 +REMARK 3 A between atoms: CA_10 and C_11 +REMARK 4 A between atoms: C_14 and C_15 +REMARK 5 A between atoms: C_15 and O_16 +REMARK 6 A between atoms: O_16 and C_17 +REMARK 7 A between atoms: C_21 and C_23 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 7.193 1.989 1.777 0.00 0.00 +0.104 C +ENDROOT +BRANCH 1 2 +ATOM 2 C UNL A 1 8.431 1.423 1.121 0.00 0.00 -0.182 A +ATOM 3 C UNL A 1 9.799 1.836 1.338 0.00 0.00 -0.071 A +ATOM 4 C UNL A 1 10.329 2.849 2.149 0.00 0.00 +0.025 C +ATOM 5 C UNL A 1 10.613 1.034 0.585 0.00 0.00 -0.039 A +ATOM 6 C UNL A 1 11.730 3.018 2.167 0.00 0.00 -0.068 C +ATOM 7 C UNL A 1 12.564 2.184 1.387 0.00 0.00 -0.033 C +ATOM 8 C UNL A 1 12.006 1.172 0.580 0.00 0.00 -0.031 C +ATOM 9 N UNL A 1 9.837 0.130 -0.105 0.00 0.00 -0.214 N +ATOM 10 CA UNL A 1 8.485 0.349 0.218 0.00 0.00 -0.048 A +ATOM 11 H UNL A 1 10.143 -0.597 -0.735 0.00 0.00 +0.311 HD +BRANCH 10 12 +ATOM 12 C UNL A 1 7.388 -0.480 -0.362 0.00 0.00 +0.933 C +ATOM 13 OXT UNL A 1 7.730 -1.355 -1.142 0.00 0.00 -0.823 OA +ATOM 14 O UNL A 1 6.219 -0.258 -0.094 0.00 0.00 -0.823 OA +ENDBRANCH 10 12 +ENDBRANCH 1 2 +BRANCH 1 15 +ATOM 15 C UNL A 1 6.761 3.335 1.151 0.00 0.00 -0.024 C +BRANCH 15 16 +ATOM 16 C UNL A 1 6.042 3.176 -0.211 0.00 0.00 +0.288 C +BRANCH 16 17 +ATOM 17 O UNL A 1 4.683 3.656 -0.099 0.00 0.00 -0.346 OA +BRANCH 17 18 +ATOM 18 C UNL A 1 3.759 3.034 0.711 0.00 0.00 +0.133 C +ATOM 19 C UNL A 1 3.619 1.637 0.727 0.00 0.00 +0.066 C +ATOM 20 C UNL A 1 2.685 1.036 1.585 0.00 0.00 +0.039 C +ATOM 21 C UNL A 1 1.887 1.831 2.425 0.00 0.00 -0.002 C +ATOM 22 C UNL A 1 2.013 3.237 2.415 0.00 0.00 -0.154 C +ATOM 23 C UNL A 1 2.950 3.827 1.539 0.00 0.00 +0.019 C +BRANCH 22 24 +ATOM 24 C UNL A 1 1.137 4.101 3.329 0.00 0.00 +0.687 C +ATOM 25 F UNL A 1 -0.069 4.345 2.774 0.00 0.00 -0.249 F +ATOM 26 F UNL A 1 0.900 3.513 4.524 0.00 0.00 -0.249 F +ATOM 27 F UNL A 1 1.688 5.305 3.603 0.00 0.00 -0.249 F +ENDBRANCH 22 24 +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 1 15 +TORSDOF 7 diff --git a/compounds/MCL1_ligands/lig_32.mol2 b/compounds/MCL1_ligands/lig_32.mol2 new file mode 100644 index 0000000..10c043d --- /dev/null +++ b/compounds/MCL1_ligands/lig_32.mol2 @@ -0,0 +1,95 @@ +@MOLECULE +lig_32.pdbqt +41 43 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 0.5822 -2.0398 0.4318 C.ar 1 UNL1 -0.1932 + 2 CA -0.4995 -2.8070 -0.0244 C.ar 1 UNL1 -0.0372 + 3 N -0.8168 -2.3676 -1.3229 N.ar 1 UNL1 -0.2144 + 4 C 0.0605 -1.3678 -1.6809 C.ar 1 UNL1 -0.0433 + 5 C 0.1419 -0.6695 -2.8918 C.2 1 UNL1 -0.1470 + 6 C 1.1566 0.3019 -3.0185 C.2 1 UNL1 -0.1450 + 7 C 2.0510 0.5453 -1.9505 C.2 1 UNL1 -0.1750 + 8 C 1.9393 -0.1771 -0.7438 C.2 1 UNL1 -0.1030 + 9 C 0.9221 -1.1355 -0.6430 C.ar 1 UNL1 -0.0720 + 10 C 1.2690 -2.2111 1.7652 C.3 1 UNL1 0.0148 + 11 C 2.2539 -3.4028 1.7696 C.3 1 UNL1 -0.1134 + 12 C 3.3706 -3.2711 0.7135 C.3 1 UNL1 0.1284 + 13 O 4.2537 -2.2017 1.1041 O.2 1 UNL1 -0.3389 + 14 C 5.2972 -1.8143 0.2982 C.2 1 UNL1 0.1481 + 15 C 5.1345 -1.6378 -1.0869 C.2 1 UNL1 -0.1865 + 16 C 6.2212 -1.2252 -1.8764 C.2 1 UNL1 -0.0985 + 17 C 7.4750 -0.9827 -1.2861 C.2 1 UNL1 -0.1373 + 18 C 8.6492 -0.5380 -2.1428 C.3 1 UNL1 -0.0378 + 19 C 7.6315 -1.1519 0.1018 C.2 1 UNL1 -0.0985 + 20 C 6.5423 -1.5610 0.8901 C.2 1 UNL1 -0.1865 + 21 C -1.2332 -3.9159 0.6540 C.2 1 UNL1 0.9268 + 22 OXT -0.9174 -4.2912 1.7717 O.co2 1 UNL1 -0.8148 + 23 O -2.1393 -4.4295 0.0124 O.co2 1 UNL1 -0.8148 + 24 H -1.5609 -2.7672 -1.8748 H 1 UNL1 0.3097 + 25 HC -0.5490 -0.8728 -3.7034 H 1 UNL1 0.1170 + 26 HC1 1.2535 0.8634 -3.9427 H 1 UNL1 0.1070 + 27 HC2 2.8335 1.2903 -2.0583 H 1 UNL1 0.1080 + 28 HC3 2.6275 -0.0084 0.0791 H 1 UNL1 0.1170 + 29 HC4 1.8125 -1.2936 2.0218 H 1 UNL1 0.0417 + 30 HC5 0.5260 -2.3469 2.5608 H 1 UNL1 0.0417 + 31 HC6 1.6942 -4.3272 1.5810 H 1 UNL1 0.0682 + 32 HC7 2.7001 -3.5051 2.7657 H 1 UNL1 0.0682 + 33 HC8 3.9337 -4.2109 0.6582 H 1 UNL1 0.0617 + 34 HC9 2.9241 -3.0833 -0.2703 H 1 UNL1 0.0617 + 35 HC10 4.1646 -1.7973 -1.5485 H 1 UNL1 0.1475 + 36 HC11 6.0844 -1.0874 -2.9455 H 1 UNL1 0.1220 + 37 HC12 8.5936 -0.9632 0.5694 H 1 UNL1 0.1220 + 38 HC13 6.6550 -1.6868 1.9617 H 1 UNL1 0.1475 + 39 HC14 9.1763 -1.4049 -2.5599 H 1 UNL1 0.0327 + 40 HC15 9.3710 0.0473 -1.5595 H 1 UNL1 0.0327 + 41 HC16 8.3154 0.0884 -2.9796 H 1 UNL1 0.0327 +@BOND + 1 6 5 1 + 2 6 7 2 + 3 5 4 2 + 4 7 8 1 + 5 4 3 ar + 6 4 9 ar + 7 8 9 2 + 8 3 2 ar + 9 9 1 ar + 10 2 1 ar + 11 2 21 1 + 12 1 10 1 + 13 18 17 1 + 14 12 13 1 + 15 12 11 1 + 16 16 15 1 + 17 16 17 2 + 18 15 14 2 + 19 17 19 1 + 20 13 14 1 + 21 14 20 1 + 22 23 21 ar + 23 19 20 2 + 24 21 22 ar + 25 11 10 1 + 26 3 24 1 + 27 25 5 1 + 28 26 6 1 + 29 27 7 1 + 30 28 8 1 + 31 29 10 1 + 32 30 10 1 + 33 31 11 1 + 34 32 11 1 + 35 33 12 1 + 36 34 12 1 + 37 35 15 1 + 38 36 16 1 + 39 37 19 1 + 40 38 20 1 + 41 39 18 1 + 42 40 18 1 + 43 41 18 1 +@SUBSTRUCTURE + 1 UNL1 2 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_32.pdbqt b/compounds/MCL1_ligands/lig_32.pdbqt new file mode 100644 index 0000000..c12f953 --- /dev/null +++ b/compounds/MCL1_ligands/lig_32.pdbqt @@ -0,0 +1,51 @@ +REMARK Name = lig_32.pdbqt +REMARK 7 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_10 +REMARK 2 A between atoms: CA_2 and C_21 +REMARK 3 A between atoms: C_10 and C_11 +REMARK 4 A between atoms: C_11 and C_12 +REMARK 5 A between atoms: C_12 and O_13 +REMARK 6 A between atoms: O_13 and C_14 +REMARK 7 A between atoms: C_17 and C_18 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 0.582 -2.040 0.432 0.00 0.00 -0.193 A +ATOM 2 CA UNL A 1 -0.499 -2.807 -0.024 0.00 0.00 -0.037 A +ATOM 3 N UNL A 1 -0.817 -2.368 -1.323 0.00 0.00 -0.214 N +ATOM 4 C UNL A 1 0.060 -1.368 -1.681 0.00 0.00 -0.043 A +ATOM 5 C UNL A 1 0.142 -0.669 -2.892 0.00 0.00 -0.030 C +ATOM 6 C UNL A 1 1.157 0.302 -3.018 0.00 0.00 -0.038 C +ATOM 7 C UNL A 1 2.051 0.545 -1.950 0.00 0.00 -0.067 C +ATOM 8 C UNL A 1 1.939 -0.177 -0.744 0.00 0.00 +0.014 C +ATOM 9 C UNL A 1 0.922 -1.135 -0.643 0.00 0.00 -0.072 A +ATOM 10 H UNL A 1 -1.561 -2.767 -1.875 0.00 0.00 +0.310 HD +ENDROOT +BRANCH 2 11 +ATOM 11 C UNL A 1 -1.233 -3.916 0.654 0.00 0.00 +0.927 C +ATOM 12 OXT UNL A 1 -0.917 -4.291 1.772 0.00 0.00 -0.815 OA +ATOM 13 O UNL A 1 -2.139 -4.429 0.012 0.00 0.00 -0.815 OA +ENDBRANCH 2 11 +BRANCH 1 14 +ATOM 14 C UNL A 1 1.269 -2.211 1.765 0.00 0.00 +0.098 C +BRANCH 14 15 +ATOM 15 C UNL A 1 2.254 -3.403 1.770 0.00 0.00 +0.023 C +BRANCH 15 16 +ATOM 16 C UNL A 1 3.371 -3.271 0.714 0.00 0.00 +0.252 C +BRANCH 16 17 +ATOM 17 O UNL A 1 4.254 -2.202 1.104 0.00 0.00 -0.339 OA +BRANCH 17 18 +ATOM 18 C UNL A 1 5.297 -1.814 0.298 0.00 0.00 +0.148 C +ATOM 19 C UNL A 1 5.135 -1.638 -1.087 0.00 0.00 -0.039 C +ATOM 20 C UNL A 1 6.221 -1.225 -1.876 0.00 0.00 +0.023 C +ATOM 21 C UNL A 1 7.475 -0.983 -1.286 0.00 0.00 -0.137 C +ATOM 22 C UNL A 1 8.649 -0.538 -2.143 0.00 0.00 +0.060 C +ATOM 23 C UNL A 1 7.631 -1.152 0.102 0.00 0.00 +0.023 C +ATOM 24 C UNL A 1 6.542 -1.561 0.890 0.00 0.00 -0.039 C +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 14 15 +ENDBRANCH 1 14 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_33.mol2 b/compounds/MCL1_ligands/lig_33.mol2 new file mode 100644 index 0000000..d71b235 --- /dev/null +++ b/compounds/MCL1_ligands/lig_33.mol2 @@ -0,0 +1,89 @@ +@MOLECULE +lig_33.pdbqt +38 40 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 CA 4.6031 2.2877 -1.4854 C.ar 1 UNL1 -0.0482 + 2 N 3.4996 2.9960 -1.9950 N.ar 1 UNL1 -0.2144 + 3 C 3.8774 3.6270 -3.1607 C.ar 1 UNL1 -0.0403 + 4 C 3.1099 4.4468 -3.9968 C.2 1 UNL1 -0.1490 + 5 C 3.7374 4.9834 -5.1404 C.2 1 UNL1 -0.1420 + 6 C 5.0942 4.6934 -5.4146 C.2 1 UNL1 -0.1780 + 7 C 5.8387 3.8634 -4.5493 C.2 1 UNL1 -0.0960 + 8 C 5.1913 3.3416 -3.4215 C.ar 1 UNL1 -0.0710 + 9 C 5.6760 2.4825 -2.3667 C.ar 1 UNL1 -0.1812 + 10 C 7.0460 1.8867 -2.1732 C.3 1 UNL1 -0.0042 + 11 C 7.8644 2.6650 -1.1148 C.3 1 UNL1 -0.0954 + 12 C 8.7032 1.7635 -0.1811 C.3 1 UNL1 0.1094 + 13 O 9.8670 1.2518 -0.8701 O.2 1 UNL1 -0.3479 + 14 C 9.8378 0.1898 -1.7468 C.2 1 UNL1 0.1391 + 15 C 10.7630 0.1874 -2.8010 C.2 1 UNL1 -0.1760 + 16 C 10.8010 -0.8835 -3.7113 C.2 1 UNL1 -0.1010 + 17 C 9.9128 -1.9599 -3.5595 C.2 1 UNL1 -0.0306 + 18 CL 9.9605 -3.2956 -4.6902 Cl 1 UNL1 -0.1374 + 19 C 8.9901 -1.9678 -2.5009 C.2 1 UNL1 -0.1010 + 20 C 8.9572 -0.8976 -1.5891 C.2 1 UNL1 -0.1760 + 21 C 4.5532 1.5028 -0.2149 C.2 1 UNL1 0.9318 + 22 O 3.4817 1.5030 0.3736 O.co2 1 UNL1 -0.8213 + 23 OXT 5.5382 0.9135 0.2065 O.co2 1 UNL1 -0.8213 + 24 H 2.5995 3.0203 -1.5401 H 1 UNL1 0.3097 + 25 HC 2.0703 4.6608 -3.7711 H 1 UNL1 0.1180 + 26 HC1 3.1751 5.6235 -5.8134 H 1 UNL1 0.1070 + 27 HC2 5.5682 5.1122 -6.2967 H 1 UNL1 0.1080 + 28 HC3 6.8808 3.6340 -4.7459 H 1 UNL1 0.1210 + 29 HC4 7.5980 1.8654 -3.1205 H 1 UNL1 0.0552 + 30 HC5 6.9281 0.8396 -1.8768 H 1 UNL1 0.0552 + 31 HC6 8.5059 3.4056 -1.6078 H 1 UNL1 0.0352 + 32 HC7 7.1738 3.2340 -0.4789 H 1 UNL1 0.0352 + 33 HC8 8.0812 0.9652 0.2424 H 1 UNL1 0.0872 + 34 HC9 9.0429 2.3797 0.6596 H 1 UNL1 0.0872 + 35 HC10 11.4436 1.0252 -2.9064 H 1 UNL1 0.1770 + 36 HC11 11.5129 -0.8820 -4.5312 H 1 UNL1 0.1390 + 37 HC12 8.3007 -2.7999 -2.3883 H 1 UNL1 0.1390 + 38 HC13 8.2392 -0.9129 -0.7738 H 1 UNL1 0.1770 +@BOND + 1 5 6 2 + 2 5 4 1 + 3 6 7 1 + 4 4 3 2 + 5 7 8 2 + 6 18 17 1 + 7 3 8 ar + 8 3 2 ar + 9 8 9 ar + 10 2 1 ar + 11 16 17 2 + 12 16 15 1 + 13 17 19 1 + 14 9 1 ar + 15 9 10 1 + 16 1 21 1 + 17 10 11 1 + 18 15 14 2 + 19 19 20 2 + 20 22 21 ar + 21 21 23 ar + 22 14 20 1 + 23 14 13 1 + 24 11 12 1 + 25 12 13 1 + 26 2 24 1 + 27 25 4 1 + 28 26 5 1 + 29 27 6 1 + 30 28 7 1 + 31 29 10 1 + 32 30 10 1 + 33 31 11 1 + 34 32 11 1 + 35 33 12 1 + 36 34 12 1 + 37 35 15 1 + 38 36 16 1 + 39 37 19 1 + 40 38 20 1 +@SUBSTRUCTURE + 1 UNL1 1 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_33.pdbqt b/compounds/MCL1_ligands/lig_33.pdbqt new file mode 100644 index 0000000..56cf984 --- /dev/null +++ b/compounds/MCL1_ligands/lig_33.pdbqt @@ -0,0 +1,50 @@ +REMARK Name = lig_33.pdbqt +REMARK 6 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: CA_1 and C_21 +REMARK 2 A between atoms: C_9 and C_10 +REMARK 3 A between atoms: C_10 and C_11 +REMARK 4 A between atoms: C_11 and C_12 +REMARK 5 A between atoms: C_12 and O_13 +REMARK 6 A between atoms: O_13 and C_14 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 CA UNL A 1 4.603 2.288 -1.485 0.00 0.00 -0.048 A +ATOM 2 N UNL A 1 3.500 2.996 -1.995 0.00 0.00 -0.214 N +ATOM 3 C UNL A 1 3.877 3.627 -3.161 0.00 0.00 -0.040 A +ATOM 4 C UNL A 1 3.110 4.447 -3.997 0.00 0.00 -0.031 C +ATOM 5 C UNL A 1 3.737 4.983 -5.140 0.00 0.00 -0.035 C +ATOM 6 C UNL A 1 5.094 4.693 -5.415 0.00 0.00 -0.070 C +ATOM 7 C UNL A 1 5.839 3.863 -4.549 0.00 0.00 +0.025 C +ATOM 8 C UNL A 1 5.191 3.342 -3.421 0.00 0.00 -0.071 A +ATOM 9 C UNL A 1 5.676 2.482 -2.367 0.00 0.00 -0.181 A +ATOM 10 H UNL A 1 2.599 3.020 -1.540 0.00 0.00 +0.310 HD +ENDROOT +BRANCH 1 11 +ATOM 11 C UNL A 1 4.553 1.503 -0.215 0.00 0.00 +0.932 C +ATOM 12 O UNL A 1 3.482 1.503 0.374 0.00 0.00 -0.821 OA +ATOM 13 OXT UNL A 1 5.538 0.913 0.206 0.00 0.00 -0.821 OA +ENDBRANCH 1 11 +BRANCH 9 14 +ATOM 14 C UNL A 1 7.046 1.887 -2.173 0.00 0.00 +0.106 C +BRANCH 14 15 +ATOM 15 C UNL A 1 7.864 2.665 -1.115 0.00 0.00 -0.025 C +BRANCH 15 16 +ATOM 16 C UNL A 1 8.703 1.764 -0.181 0.00 0.00 +0.284 C +BRANCH 16 17 +ATOM 17 O UNL A 1 9.867 1.252 -0.870 0.00 0.00 -0.348 OA +BRANCH 17 18 +ATOM 18 C UNL A 1 9.838 0.190 -1.747 0.00 0.00 +0.139 C +ATOM 19 C UNL A 1 10.763 0.187 -2.801 0.00 0.00 +0.001 C +ATOM 20 C UNL A 1 10.801 -0.883 -3.711 0.00 0.00 +0.038 C +ATOM 21 C UNL A 1 9.913 -1.960 -3.559 0.00 0.00 -0.031 C +ATOM 22 CL UNL A 1 9.960 -3.296 -4.690 0.00 0.00 -0.137 Cl +ATOM 23 C UNL A 1 8.990 -1.968 -2.501 0.00 0.00 +0.038 C +ATOM 24 C UNL A 1 8.957 -0.898 -1.589 0.00 0.00 +0.001 C +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 14 15 +ENDBRANCH 9 14 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_34.mol2 b/compounds/MCL1_ligands/lig_34.mol2 new file mode 100644 index 0000000..ab7c5d1 --- /dev/null +++ b/compounds/MCL1_ligands/lig_34.mol2 @@ -0,0 +1,95 @@ +@MOLECULE +lig_34.pdbqt +41 43 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 8.2252 1.5006 1.3401 C.3 1 UNL1 -0.0042 + 2 C 9.0987 1.1723 0.1519 C.ar 1 UNL1 -0.1822 + 3 C 10.3778 1.7570 -0.1820 C.ar 1 UNL1 -0.0710 + 4 C 11.1126 2.7673 0.4534 C.2 1 UNL1 -0.0960 + 5 C 10.8514 1.1367 -1.3059 C.ar 1 UNL1 -0.0393 + 6 C 12.3592 3.1284 -0.0997 C.2 1 UNL1 -0.1770 + 7 C 12.8437 2.4810 -1.2595 C.2 1 UNL1 -0.1410 + 8 C 12.0845 1.4670 -1.8801 C.2 1 UNL1 -0.1490 + 9 N 9.9410 0.1873 -1.7118 N.ar 1 UNL1 -0.2144 + 10 CA 8.8536 0.1865 -0.8179 C.ar 1 UNL1 -0.0482 + 11 C 7.6980 -0.7450 -0.9736 C.2 1 UNL1 0.9328 + 12 OXT 7.7420 -1.5015 -1.9310 O.co2 1 UNL1 -0.8228 + 13 O 6.7514 -0.7105 -0.2042 O.co2 1 UNL1 -0.8228 + 14 C 7.4188 2.8035 1.1374 C.3 1 UNL1 -0.0964 + 15 C 6.2448 2.6520 0.1370 C.3 1 UNL1 0.1104 + 16 O 5.0035 3.0050 0.7892 O.2 1 UNL1 -0.3459 + 17 C 4.4917 2.2710 1.8377 C.2 1 UNL1 0.1331 + 18 C 4.5697 0.8686 1.8779 C.2 1 UNL1 -0.1550 + 19 C 4.0661 0.1627 2.9842 C.2 1 UNL1 -0.1040 + 20 C 3.4693 0.8497 4.0636 C.2 1 UNL1 -0.1370 + 21 C 3.3835 2.2571 4.0073 C.2 1 UNL1 -0.1543 + 22 C 3.8871 2.9593 2.8987 C.2 1 UNL1 -0.1330 + 23 C 2.9320 0.1014 5.2902 C.3 1 UNL1 0.6872 + 24 F 1.6672 0.4720 5.5906 F 1 UNL1 -0.2486 + 25 F 2.9066 -1.2417 5.1384 F 1 UNL1 -0.2486 + 26 F 3.6763 0.3535 6.3893 F 1 UNL1 -0.2486 + 27 H 10.0086 -0.4411 -2.4984 H 1 UNL1 0.3107 + 28 HC2 7.5560 0.6764 1.6073 H 1 UNL1 0.0542 + 29 HC3 8.8730 1.6330 2.2145 H 1 UNL1 0.0542 + 30 HC 10.7312 3.2518 1.3469 H 1 UNL1 0.1210 + 31 HC1 12.9516 3.9059 0.3726 H 1 UNL1 0.1090 + 32 HC4 13.8070 2.7644 -1.6737 H 1 UNL1 0.1080 + 33 HC5 12.4445 0.9577 -2.7685 H 1 UNL1 0.1180 + 34 HC6 7.0446 3.1399 2.1122 H 1 UNL1 0.0362 + 35 HC7 8.0926 3.5939 0.7837 H 1 UNL1 0.0362 + 36 HC8 6.1975 1.6360 -0.2677 H 1 UNL1 0.0887 + 37 HC9 6.4131 3.3233 -0.7131 H 1 UNL1 0.0887 + 38 HC10 5.0248 0.3202 1.0573 H 1 UNL1 0.2210 + 39 HC11 4.1515 -0.9219 2.9950 H 1 UNL1 0.1430 + 40 HC12 2.9311 2.8060 4.8299 H 1 UNL1 0.1350 + 41 HC13 3.8294 4.0420 2.8616 H 1 UNL1 0.1520 +@BOND + 1 13 11 ar + 2 15 16 1 + 3 15 14 1 + 4 16 17 1 + 5 11 12 ar + 6 11 10 1 + 7 14 1 1 + 8 10 9 ar + 9 10 2 ar + 10 9 5 ar + 11 17 18 2 + 12 17 22 1 + 13 2 1 1 + 14 2 3 ar + 15 18 19 1 + 16 5 3 ar + 17 5 8 1 + 18 3 4 1 + 19 22 21 2 + 20 8 7 2 + 21 19 20 2 + 22 4 6 2 + 23 7 6 1 + 24 21 20 1 + 25 20 23 1 + 26 23 25 1 + 27 23 24 1 + 28 23 26 1 + 29 9 27 1 + 30 28 1 1 + 31 29 1 1 + 32 30 4 1 + 33 31 6 1 + 34 32 7 1 + 35 33 8 1 + 36 34 14 1 + 37 35 14 1 + 38 36 15 1 + 39 37 15 1 + 40 38 18 1 + 41 39 19 1 + 42 40 21 1 + 43 41 22 1 +@SUBSTRUCTURE + 1 UNL1 10 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_34.pdbqt b/compounds/MCL1_ligands/lig_34.pdbqt new file mode 100644 index 0000000..8dc2810 --- /dev/null +++ b/compounds/MCL1_ligands/lig_34.pdbqt @@ -0,0 +1,56 @@ +REMARK Name = lig_34.pdbqt +REMARK 7 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_2 +REMARK 2 A between atoms: C_1 and C_14 +REMARK 3 A between atoms: CA_10 and C_11 +REMARK 4 A between atoms: C_14 and C_15 +REMARK 5 A between atoms: C_15 and O_16 +REMARK 6 A between atoms: O_16 and C_17 +REMARK 7 A between atoms: C_20 and C_23 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 8.225 1.501 1.340 0.00 0.00 +0.104 C +ENDROOT +BRANCH 1 2 +ATOM 2 C UNL A 1 9.099 1.172 0.152 0.00 0.00 -0.182 A +ATOM 3 C UNL A 1 10.378 1.757 -0.182 0.00 0.00 -0.071 A +ATOM 4 C UNL A 1 11.113 2.767 0.453 0.00 0.00 +0.025 C +ATOM 5 C UNL A 1 10.851 1.137 -1.306 0.00 0.00 -0.039 A +ATOM 6 C UNL A 1 12.359 3.128 -0.100 0.00 0.00 -0.068 C +ATOM 7 C UNL A 1 12.844 2.481 -1.260 0.00 0.00 -0.033 C +ATOM 8 C UNL A 1 12.085 1.467 -1.880 0.00 0.00 -0.031 C +ATOM 9 N UNL A 1 9.941 0.187 -1.712 0.00 0.00 -0.214 N +ATOM 10 CA UNL A 1 8.854 0.186 -0.818 0.00 0.00 -0.048 A +ATOM 11 H UNL A 1 10.009 -0.441 -2.498 0.00 0.00 +0.311 HD +BRANCH 10 12 +ATOM 12 C UNL A 1 7.698 -0.745 -0.974 0.00 0.00 +0.933 C +ATOM 13 OXT UNL A 1 7.742 -1.502 -1.931 0.00 0.00 -0.823 OA +ATOM 14 O UNL A 1 6.751 -0.711 -0.204 0.00 0.00 -0.823 OA +ENDBRANCH 10 12 +ENDBRANCH 1 2 +BRANCH 1 15 +ATOM 15 C UNL A 1 7.419 2.804 1.137 0.00 0.00 -0.024 C +BRANCH 15 16 +ATOM 16 C UNL A 1 6.245 2.652 0.137 0.00 0.00 +0.288 C +BRANCH 16 17 +ATOM 17 O UNL A 1 5.003 3.005 0.789 0.00 0.00 -0.346 OA +BRANCH 17 18 +ATOM 18 C UNL A 1 4.492 2.271 1.838 0.00 0.00 +0.133 C +ATOM 19 C UNL A 1 4.570 0.869 1.878 0.00 0.00 +0.066 C +ATOM 20 C UNL A 1 4.066 0.163 2.984 0.00 0.00 +0.039 C +ATOM 21 C UNL A 1 3.469 0.850 4.064 0.00 0.00 -0.137 C +ATOM 22 C UNL A 1 3.384 2.257 4.007 0.00 0.00 -0.019 C +ATOM 23 C UNL A 1 3.887 2.959 2.899 0.00 0.00 +0.019 C +BRANCH 21 24 +ATOM 24 C UNL A 1 2.932 0.101 5.290 0.00 0.00 +0.687 C +ATOM 25 F UNL A 1 1.667 0.472 5.591 0.00 0.00 -0.249 F +ATOM 26 F UNL A 1 2.907 -1.242 5.138 0.00 0.00 -0.249 F +ATOM 27 F UNL A 1 3.676 0.353 6.389 0.00 0.00 -0.249 F +ENDBRANCH 21 24 +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 1 15 +TORSDOF 7 diff --git a/compounds/MCL1_ligands/lig_35.mol2 b/compounds/MCL1_ligands/lig_35.mol2 new file mode 100644 index 0000000..8b7735d --- /dev/null +++ b/compounds/MCL1_ligands/lig_35.mol2 @@ -0,0 +1,95 @@ +@MOLECULE +lig_35.pdbqt +41 43 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 0.3450 -2.4746 0.3744 C.ar 1 UNL1 -0.1952 + 2 CA -0.8398 -3.1395 0.0269 C.ar 1 UNL1 -0.0372 + 3 N -1.1830 -2.7452 -1.2794 N.ar 1 UNL1 -0.2144 + 4 C -0.2174 -1.8840 -1.7520 C.ar 1 UNL1 -0.0423 + 5 C -0.1243 -1.2847 -3.0140 C.2 1 UNL1 -0.1470 + 6 C 0.9923 -0.4602 -3.2644 C.2 1 UNL1 -0.1450 + 7 C 1.9739 -0.2627 -2.2657 C.2 1 UNL1 -0.1740 + 8 C 1.8481 -0.8830 -1.0050 C.2 1 UNL1 -0.1040 + 9 C 0.7265 -1.6922 -0.7793 C.ar 1 UNL1 -0.0740 + 10 C 1.0785 -2.6332 1.6839 C.3 1 UNL1 0.0158 + 11 C 1.9437 -3.9137 1.7171 C.3 1 UNL1 -0.1154 + 12 C 3.0191 -3.9435 0.6118 C.3 1 UNL1 0.1284 + 13 O 4.0014 -2.9296 0.8993 O.2 1 UNL1 -0.3379 + 14 C 5.0142 -2.5943 0.0284 C.2 1 UNL1 0.1581 + 15 C 5.8882 -1.5698 0.4180 C.2 1 UNL1 -0.2020 + 16 C 6.9418 -1.1617 -0.4212 C.2 1 UNL1 -0.0303 + 17 C 7.8697 -0.0394 0.0204 C.3 1 UNL1 -0.0548 + 18 C 7.1143 -1.7994 -1.6670 C.2 1 UNL1 -0.0356 + 19 C 6.2389 -2.8235 -2.0636 C.2 1 UNL1 -0.0960 + 20 CL 8.4096 -1.3353 -2.7550 Cl 1 UNL1 -0.1284 + 21 C 5.1887 -3.2220 -1.2196 C.2 1 UNL1 -0.1720 + 22 C -1.6478 -4.1173 0.8138 C.2 1 UNL1 0.9268 + 23 OXT -1.3017 -4.4675 1.9307 O.co2 1 UNL1 -0.8138 + 24 O -2.6423 -4.5613 0.2572 O.co2 1 UNL1 -0.8138 + 25 H -1.9970 -3.0910 -1.7649 H 1 UNL1 0.3107 + 26 HC -0.8814 -1.4544 -3.7724 H 1 UNL1 0.1180 + 27 HC1 1.1023 0.0205 -4.2317 H 1 UNL1 0.1080 + 28 HC2 2.8357 0.3656 -2.4700 H 1 UNL1 0.1080 + 29 HC3 2.6011 -0.7484 -0.2347 H 1 UNL1 0.1150 + 30 HC4 1.7182 -1.7591 1.8573 H 1 UNL1 0.0412 + 31 HC5 0.3677 -2.6486 2.5194 H 1 UNL1 0.0412 + 32 HC6 2.4220 -4.0066 2.6990 H 1 UNL1 0.0707 + 33 HC7 1.2892 -4.7869 1.6027 H 1 UNL1 0.0707 + 34 HC8 3.4968 -4.9308 0.5913 H 1 UNL1 0.0657 + 35 HC9 2.5482 -3.7654 -0.3638 H 1 UNL1 0.0657 + 36 HC10 5.7301 -1.0904 1.3783 H 1 UNL1 0.1620 + 37 HC11 6.3717 -3.3026 -3.0294 H 1 UNL1 0.1350 + 38 HC12 4.5140 -4.0051 -1.5469 H 1 UNL1 0.1460 + 39 HC13 8.9073 -0.3901 0.0790 H 1 UNL1 0.0487 + 40 HC14 7.5941 0.3504 1.0078 H 1 UNL1 0.0487 + 41 HC15 7.8337 0.7976 -0.6878 H 1 UNL1 0.0487 +@BOND + 1 6 5 1 + 2 6 7 2 + 3 5 4 2 + 4 7 8 1 + 5 4 3 ar + 6 4 9 ar + 7 8 9 2 + 8 3 2 ar + 9 9 1 ar + 10 2 1 ar + 11 2 22 1 + 12 1 10 1 + 13 20 18 1 + 14 12 13 1 + 15 12 11 1 + 16 19 21 1 + 17 19 18 2 + 18 21 14 2 + 19 13 14 1 + 20 24 22 ar + 21 17 16 1 + 22 18 16 1 + 23 14 15 1 + 24 16 15 2 + 25 22 23 ar + 26 11 10 1 + 27 3 25 1 + 28 26 5 1 + 29 27 6 1 + 30 28 7 1 + 31 29 8 1 + 32 30 10 1 + 33 31 10 1 + 34 32 11 1 + 35 33 11 1 + 36 34 12 1 + 37 35 12 1 + 38 36 15 1 + 39 37 19 1 + 40 38 21 1 + 41 39 17 1 + 42 40 17 1 + 43 41 17 1 +@SUBSTRUCTURE + 1 UNL1 2 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_35.pdbqt b/compounds/MCL1_ligands/lig_35.pdbqt new file mode 100644 index 0000000..9bbf7e9 --- /dev/null +++ b/compounds/MCL1_ligands/lig_35.pdbqt @@ -0,0 +1,52 @@ +REMARK Name = lig_35.pdbqt +REMARK 7 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_10 +REMARK 2 A between atoms: CA_2 and C_22 +REMARK 3 A between atoms: C_10 and C_11 +REMARK 4 A between atoms: C_11 and C_12 +REMARK 5 A between atoms: C_12 and O_13 +REMARK 6 A between atoms: O_13 and C_14 +REMARK 7 A between atoms: C_16 and C_17 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 0.345 -2.475 0.374 0.00 0.00 -0.195 A +ATOM 2 CA UNL A 1 -0.840 -3.139 0.027 0.00 0.00 -0.037 A +ATOM 3 N UNL A 1 -1.183 -2.745 -1.279 0.00 0.00 -0.214 N +ATOM 4 C UNL A 1 -0.217 -1.884 -1.752 0.00 0.00 -0.042 A +ATOM 5 C UNL A 1 -0.124 -1.285 -3.014 0.00 0.00 -0.029 C +ATOM 6 C UNL A 1 0.992 -0.460 -3.264 0.00 0.00 -0.037 C +ATOM 7 C UNL A 1 1.974 -0.263 -2.266 0.00 0.00 -0.066 C +ATOM 8 C UNL A 1 1.848 -0.883 -1.005 0.00 0.00 +0.011 C +ATOM 9 C UNL A 1 0.727 -1.692 -0.779 0.00 0.00 -0.074 A +ATOM 10 H UNL A 1 -1.997 -3.091 -1.765 0.00 0.00 +0.311 HD +ENDROOT +BRANCH 2 11 +ATOM 11 C UNL A 1 -1.648 -4.117 0.814 0.00 0.00 +0.927 C +ATOM 12 OXT UNL A 1 -1.302 -4.468 1.931 0.00 0.00 -0.814 OA +ATOM 13 O UNL A 1 -2.642 -4.561 0.257 0.00 0.00 -0.814 OA +ENDBRANCH 2 11 +BRANCH 1 14 +ATOM 14 C UNL A 1 1.079 -2.633 1.684 0.00 0.00 +0.098 C +BRANCH 14 15 +ATOM 15 C UNL A 1 1.944 -3.914 1.717 0.00 0.00 +0.026 C +BRANCH 15 16 +ATOM 16 C UNL A 1 3.019 -3.943 0.612 0.00 0.00 +0.260 C +BRANCH 16 17 +ATOM 17 O UNL A 1 4.001 -2.930 0.899 0.00 0.00 -0.338 OA +BRANCH 17 18 +ATOM 18 C UNL A 1 5.014 -2.594 0.028 0.00 0.00 +0.158 C +ATOM 19 C UNL A 1 5.888 -1.570 0.418 0.00 0.00 -0.040 C +ATOM 20 C UNL A 1 6.942 -1.162 -0.421 0.00 0.00 -0.030 C +ATOM 21 C UNL A 1 7.870 -0.039 0.020 0.00 0.00 +0.091 C +ATOM 22 C UNL A 1 7.114 -1.799 -1.667 0.00 0.00 -0.036 C +ATOM 23 C UNL A 1 6.239 -2.824 -2.064 0.00 0.00 +0.039 C +ATOM 24 CL UNL A 1 8.410 -1.335 -2.755 0.00 0.00 -0.128 Cl +ATOM 25 C UNL A 1 5.189 -3.222 -1.220 0.00 0.00 -0.026 C +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 14 15 +ENDBRANCH 1 14 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_36.mol2 b/compounds/MCL1_ligands/lig_36.mol2 new file mode 100644 index 0000000..683f6e8 --- /dev/null +++ b/compounds/MCL1_ligands/lig_36.mol2 @@ -0,0 +1,101 @@ +@MOLECULE +lig_36.pdbqt +44 46 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C -0.3362 3.3942 3.9265 C.ar 1 UNL1 -0.1822 + 2 CA -0.3996 2.3050 4.8892 C.ar 1 UNL1 0.0403 + 3 N -1.0475 2.7281 6.0539 N.ar 1 UNL1 -0.2144 + 4 C -1.4009 4.0494 5.8646 C.ar 1 UNL1 -0.0403 + 5 C -2.0719 4.8915 6.7599 C.2 1 UNL1 -0.1490 + 6 C -2.3279 6.2163 6.3512 C.2 1 UNL1 -0.1420 + 7 C -1.9145 6.6642 5.0759 C.2 1 UNL1 -0.1780 + 8 C -1.2399 5.7936 4.1944 C.2 1 UNL1 -0.0960 + 9 C -0.9960 4.4806 4.6187 C.ar 1 UNL1 -0.0700 + 10 C 0.2777 3.3359 2.5474 C.3 1 UNL1 -0.0042 + 11 C 1.7042 3.9353 2.5203 C.3 1 UNL1 -0.0944 + 12 C 2.8041 2.8739 2.7272 C.3 1 UNL1 0.1104 + 13 O 3.0955 2.2808 1.4464 O.2 1 UNL1 -0.3479 + 14 C 3.9239 1.1908 1.3625 C.2 1 UNL1 0.1411 + 15 C 5.0538 1.2554 0.5350 C.2 1 UNL1 -0.1720 + 16 C 5.9190 0.1506 0.4117 C.2 1 UNL1 -0.0573 + 17 C 5.6258 -1.0325 1.1269 C.2 1 UNL1 -0.0256 + 18 C 4.4842 -1.0991 1.9445 C.2 1 UNL1 -0.0900 + 19 CL 6.6443 -2.4571 1.0130 Cl 1 UNL1 -0.1374 + 20 C 3.6315 0.0107 2.0609 C.2 1 UNL1 -0.1800 + 21 C 7.1346 0.2597 -0.5030 C.3 1 UNL1 -0.0321 + 22 C 6.8414 -0.2711 -1.9204 C.3 1 UNL1 -0.0881 + 23 C 0.1109 0.9079 4.7791 C.2 1 UNL1 0.8433 + 24 O 0.6915 0.5267 3.7773 O.co2 1 UNL1 -0.8208 + 25 OXT -0.0522 0.1922 5.7569 O.co2 1 UNL1 -0.8208 + 26 H -1.2026 2.1344 6.8551 H 1 UNL1 0.3097 + 27 HC -2.3835 4.5343 7.7362 H 1 UNL1 0.1180 + 28 HC1 -2.8454 6.8964 7.0211 H 1 UNL1 0.1070 + 29 HC2 -2.1176 7.6864 4.7711 H 1 UNL1 0.1080 + 30 HC3 -0.9165 6.1265 3.2136 H 1 UNL1 0.1210 + 31 HC4 0.2732 2.3209 2.1320 H 1 UNL1 0.0547 + 32 HC5 -0.3537 3.9259 1.8725 H 1 UNL1 0.0547 + 33 HC6 1.7904 4.7088 3.2938 H 1 UNL1 0.0347 + 34 HC7 1.8716 4.4396 1.5599 H 1 UNL1 0.0347 + 35 HC8 3.7099 3.3522 3.1185 H 1 UNL1 0.0877 + 36 HC9 2.4740 2.1263 3.4581 H 1 UNL1 0.0877 + 37 HC10 5.2498 2.1703 -0.0131 H 1 UNL1 0.1380 + 38 HC11 4.2528 -2.0146 2.4814 H 1 UNL1 0.1480 + 39 HC12 2.7327 -0.0480 2.6729 H 1 UNL1 0.2160 + 40 HC13 7.4534 1.3072 -0.5767 H 1 UNL1 0.0447 + 41 HC14 7.9891 -0.2816 -0.0788 H 1 UNL1 0.0447 + 42 HC15 7.7266 -0.1725 -2.5608 H 1 UNL1 0.0330 + 43 HC16 6.5570 -1.3303 -1.8887 H 1 UNL1 0.0330 + 44 HC17 6.0186 0.2898 -2.3815 H 1 UNL1 0.0330 +@BOND + 1 22 21 1 + 2 10 11 1 + 3 10 1 1 + 4 19 17 1 + 5 18 17 2 + 6 18 20 1 + 7 11 12 1 + 8 17 16 1 + 9 20 14 2 + 10 16 21 1 + 11 16 15 2 + 12 8 7 2 + 13 8 9 1 + 14 14 15 1 + 15 14 13 1 + 16 1 9 ar + 17 1 2 ar + 18 7 6 1 + 19 13 12 1 + 20 9 4 ar + 21 2 3 ar + 22 2 23 1 + 23 6 5 2 + 24 4 3 ar + 25 4 5 1 + 26 23 24 ar + 27 23 25 ar + 28 3 26 1 + 29 27 5 1 + 30 28 6 1 + 31 29 7 1 + 32 30 8 1 + 33 31 10 1 + 34 32 10 1 + 35 33 11 1 + 36 34 11 1 + 37 35 12 1 + 38 36 12 1 + 39 37 15 1 + 40 38 18 1 + 41 39 20 1 + 42 40 21 1 + 43 41 21 1 + 44 42 22 1 + 45 43 22 1 + 46 44 22 1 +@SUBSTRUCTURE + 1 UNL1 2 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_36.pdbqt b/compounds/MCL1_ligands/lig_36.pdbqt new file mode 100644 index 0000000..0c44b04 --- /dev/null +++ b/compounds/MCL1_ligands/lig_36.pdbqt @@ -0,0 +1,56 @@ +REMARK Name = lig_36.pdbqt +REMARK 8 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_10 +REMARK 2 A between atoms: CA_2 and C_23 +REMARK 3 A between atoms: C_10 and C_11 +REMARK 4 A between atoms: C_11 and C_12 +REMARK 5 A between atoms: C_12 and O_13 +REMARK 6 A between atoms: O_13 and C_14 +REMARK 7 A between atoms: C_16 and C_21 +REMARK 8 A between atoms: C_21 and C_22 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 -0.336 3.394 3.926 0.00 0.00 -0.182 A +ATOM 2 CA UNL A 1 -0.400 2.305 4.889 0.00 0.00 +0.040 A +ATOM 3 N UNL A 1 -1.048 2.728 6.054 0.00 0.00 -0.214 N +ATOM 4 C UNL A 1 -1.401 4.049 5.865 0.00 0.00 -0.040 A +ATOM 5 C UNL A 1 -2.072 4.891 6.760 0.00 0.00 -0.031 C +ATOM 6 C UNL A 1 -2.328 6.216 6.351 0.00 0.00 -0.035 C +ATOM 7 C UNL A 1 -1.915 6.664 5.076 0.00 0.00 -0.070 C +ATOM 8 C UNL A 1 -1.240 5.794 4.194 0.00 0.00 +0.025 C +ATOM 9 C UNL A 1 -0.996 4.481 4.619 0.00 0.00 -0.070 A +ATOM 10 H UNL A 1 -1.203 2.134 6.855 0.00 0.00 +0.310 HD +ENDROOT +BRANCH 2 11 +ATOM 11 C UNL A 1 0.111 0.908 4.779 0.00 0.00 +0.843 C +ATOM 12 O UNL A 1 0.692 0.527 3.777 0.00 0.00 -0.821 OA +ATOM 13 OXT UNL A 1 -0.052 0.192 5.757 0.00 0.00 -0.821 OA +ENDBRANCH 2 11 +BRANCH 1 14 +ATOM 14 C UNL A 1 0.278 3.336 2.547 0.00 0.00 +0.105 C +BRANCH 14 15 +ATOM 15 C UNL A 1 1.704 3.935 2.520 0.00 0.00 -0.025 C +BRANCH 15 16 +ATOM 16 C UNL A 1 2.804 2.874 2.727 0.00 0.00 +0.286 C +BRANCH 16 17 +ATOM 17 O UNL A 1 3.095 2.281 1.446 0.00 0.00 -0.348 OA +BRANCH 17 18 +ATOM 18 C UNL A 1 3.924 1.191 1.363 0.00 0.00 +0.141 C +ATOM 19 C UNL A 1 5.054 1.255 0.535 0.00 0.00 -0.034 C +ATOM 20 C UNL A 1 5.919 0.151 0.412 0.00 0.00 -0.057 C +ATOM 21 C UNL A 1 5.626 -1.032 1.127 0.00 0.00 -0.026 C +ATOM 22 C UNL A 1 4.484 -1.099 1.944 0.00 0.00 +0.058 C +ATOM 23 CL UNL A 1 6.644 -2.457 1.013 0.00 0.00 -0.137 Cl +ATOM 24 C UNL A 1 3.631 0.011 2.061 0.00 0.00 +0.036 C +BRANCH 20 25 +ATOM 25 C UNL A 1 7.135 0.260 -0.503 0.00 0.00 +0.057 C +ATOM 26 C UNL A 1 6.841 -0.271 -1.920 0.00 0.00 +0.011 C +ENDBRANCH 20 25 +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 14 15 +ENDBRANCH 1 14 +TORSDOF 7 diff --git a/compounds/MCL1_ligands/lig_37.mol2 b/compounds/MCL1_ligands/lig_37.mol2 new file mode 100644 index 0000000..9137f35 --- /dev/null +++ b/compounds/MCL1_ligands/lig_37.mol2 @@ -0,0 +1,101 @@ +@MOLECULE +lig_37.pdbqt +44 46 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 2.6742 2.9546 1.2802 C.ar 1 UNL1 -0.2012 + 2 CA 2.7672 2.4785 2.6505 C.ar 1 UNL1 0.0733 + 3 N 1.9349 3.2376 3.4797 N.ar 1 UNL1 -0.2224 + 4 C 1.3250 4.1867 2.6812 C.ar 1 UNL1 -0.0433 + 5 C 0.4146 5.1756 3.0739 C.2 1 UNL1 -0.1470 + 6 C -0.0794 6.0469 2.0815 C.2 1 UNL1 -0.1460 + 7 C 0.3414 5.9148 0.7384 C.2 1 UNL1 -0.1720 + 8 C 1.2606 4.9098 0.3709 C.2 1 UNL1 -0.1020 + 9 C 1.7379 4.0529 1.3713 C.ar 1 UNL1 -0.0560 + 10 C 3.4480 2.3807 0.1215 C.3 1 UNL1 0.0058 + 11 C 4.8759 2.9739 0.0235 C.3 1 UNL1 -0.1004 + 12 C 5.9588 1.8884 -0.1337 C.3 1 UNL1 0.1084 + 13 O 5.7056 1.1486 -1.3459 O.2 1 UNL1 -0.3529 + 14 C 6.0691 -0.1724 -1.4423 C.2 1 UNL1 0.1401 + 15 C 5.7284 -1.0946 -0.4401 C.2 1 UNL1 -0.1830 + 16 C 6.0958 -2.4464 -0.5641 C.2 1 UNL1 -0.0398 + 17 C 5.7204 -3.4220 0.5430 C.3 1 UNL1 -0.0598 + 18 C 6.7999 -2.8731 -1.7117 C.2 1 UNL1 -0.0286 + 19 C 7.1271 -1.9503 -2.7296 C.2 1 UNL1 -0.0398 + 20 CL 7.2624 -4.5614 -1.8796 Cl 1 UNL1 -0.1384 + 21 C 6.7523 -0.6018 -2.5859 C.2 1 UNL1 -0.1830 + 22 C 7.8754 -2.3924 -3.9796 C.3 1 UNL1 -0.0598 + 23 C 3.5975 1.3652 3.2039 C.2 1 UNL1 0.8303 + 24 O 4.3322 0.7050 2.4853 O.co2 1 UNL1 -0.8098 + 25 OXT 3.5067 1.1671 4.4077 O.co2 1 UNL1 -0.8098 + 26 H 1.8429 3.0875 4.4729 H 1 UNL1 0.2977 + 27 HC 0.1010 5.2670 4.1088 H 1 UNL1 0.1160 + 28 HC1 -0.7871 6.8249 2.3515 H 1 UNL1 0.1080 + 29 HC2 -0.0449 6.5918 -0.0174 H 1 UNL1 0.1080 + 30 HC3 1.5929 4.7985 -0.6561 H 1 UNL1 0.1210 + 31 HC4 3.4833 1.2875 0.2042 H 1 UNL1 0.0442 + 32 HC5 2.9151 2.5796 -0.8161 H 1 UNL1 0.0442 + 33 HC6 5.0997 3.5484 0.9316 H 1 UNL1 0.0402 + 34 HC7 4.9282 3.6799 -0.8143 H 1 UNL1 0.0402 + 35 HC8 6.9523 2.3495 -0.1768 H 1 UNL1 0.0842 + 36 HC9 5.9350 1.2400 0.7499 H 1 UNL1 0.0842 + 37 HC10 5.1679 -0.7611 0.4330 H 1 UNL1 0.1735 + 38 HC11 6.9871 0.1248 -3.3550 H 1 UNL1 0.1735 + 39 HC12 5.0631 -4.2132 0.1626 H 1 UNL1 0.0504 + 40 HC13 5.1920 -2.9191 1.3634 H 1 UNL1 0.0504 + 41 HC14 6.6136 -3.8950 0.9688 H 1 UNL1 0.0504 + 42 HC15 8.0495 -1.5554 -4.6664 H 1 UNL1 0.0504 + 43 HC16 8.8530 -2.8170 -3.7201 H 1 UNL1 0.0504 + 44 HC17 7.3075 -3.1561 -4.5252 H 1 UNL1 0.0504 +@BOND + 1 11 10 1 + 2 11 12 1 + 3 10 1 1 + 4 8 7 2 + 5 8 9 1 + 6 14 15 2 + 7 14 13 1 + 8 14 21 1 + 9 15 16 1 + 10 16 18 2 + 11 16 17 1 + 12 13 12 1 + 13 21 19 2 + 14 18 19 1 + 15 18 20 1 + 16 19 22 1 + 17 7 6 1 + 18 1 9 ar + 19 1 2 ar + 20 9 4 ar + 21 6 5 2 + 22 2 3 ar + 23 2 23 1 + 24 4 5 1 + 25 4 3 ar + 26 24 23 ar + 27 23 25 ar + 28 3 26 1 + 29 27 5 1 + 30 28 6 1 + 31 29 7 1 + 32 30 8 1 + 33 31 10 1 + 34 32 10 1 + 35 33 11 1 + 36 34 11 1 + 37 35 12 1 + 38 36 12 1 + 39 37 15 1 + 40 38 21 1 + 41 39 17 1 + 42 40 17 1 + 43 41 17 1 + 44 42 22 1 + 45 43 22 1 + 46 44 22 1 +@SUBSTRUCTURE + 1 UNL1 2 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_37.pdbqt b/compounds/MCL1_ligands/lig_37.pdbqt new file mode 100644 index 0000000..d70e370 --- /dev/null +++ b/compounds/MCL1_ligands/lig_37.pdbqt @@ -0,0 +1,54 @@ +REMARK Name = lig_37.pdbqt +REMARK 8 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_10 +REMARK 2 A between atoms: CA_2 and C_23 +REMARK 3 A between atoms: C_10 and C_11 +REMARK 4 A between atoms: C_11 and C_12 +REMARK 5 A between atoms: C_12 and O_13 +REMARK 6 A between atoms: O_13 and C_14 +REMARK 7 A between atoms: C_16 and C_17 +REMARK 8 A between atoms: C_19 and C_22 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 2.674 2.955 1.280 0.00 0.00 -0.201 A +ATOM 2 CA UNL A 1 2.767 2.478 2.651 0.00 0.00 +0.073 A +ATOM 3 N UNL A 1 1.935 3.238 3.480 0.00 0.00 -0.222 N +ATOM 4 C UNL A 1 1.325 4.187 2.681 0.00 0.00 -0.043 A +ATOM 5 C UNL A 1 0.415 5.176 3.074 0.00 0.00 -0.031 C +ATOM 6 C UNL A 1 -0.079 6.047 2.082 0.00 0.00 -0.038 C +ATOM 7 C UNL A 1 0.341 5.915 0.738 0.00 0.00 -0.064 C +ATOM 8 C UNL A 1 1.261 4.910 0.371 0.00 0.00 +0.019 C +ATOM 9 C UNL A 1 1.738 4.053 1.371 0.00 0.00 -0.056 A +ATOM 10 H UNL A 1 1.843 3.087 4.473 0.00 0.00 +0.298 HD +ENDROOT +BRANCH 2 11 +ATOM 11 C UNL A 1 3.598 1.365 3.204 0.00 0.00 +0.830 C +ATOM 12 O UNL A 1 4.332 0.705 2.485 0.00 0.00 -0.810 OA +ATOM 13 OXT UNL A 1 3.507 1.167 4.408 0.00 0.00 -0.810 OA +ENDBRANCH 2 11 +BRANCH 1 14 +ATOM 14 C UNL A 1 3.448 2.381 0.121 0.00 0.00 +0.094 C +BRANCH 14 15 +ATOM 15 C UNL A 1 4.876 2.974 0.024 0.00 0.00 -0.020 C +BRANCH 15 16 +ATOM 16 C UNL A 1 5.959 1.888 -0.134 0.00 0.00 +0.277 C +BRANCH 16 17 +ATOM 17 O UNL A 1 5.706 1.149 -1.346 0.00 0.00 -0.353 OA +BRANCH 17 18 +ATOM 18 C UNL A 1 6.069 -0.172 -1.442 0.00 0.00 +0.140 C +ATOM 19 C UNL A 1 5.728 -1.095 -0.440 0.00 0.00 -0.010 C +ATOM 20 C UNL A 1 6.096 -2.446 -0.564 0.00 0.00 -0.040 C +ATOM 21 C UNL A 1 5.720 -3.422 0.543 0.00 0.00 +0.091 C +ATOM 22 C UNL A 1 6.800 -2.873 -1.712 0.00 0.00 -0.029 C +ATOM 23 C UNL A 1 7.127 -1.950 -2.730 0.00 0.00 -0.040 C +ATOM 24 CL UNL A 1 7.262 -4.561 -1.880 0.00 0.00 -0.138 Cl +ATOM 25 C UNL A 1 6.752 -0.602 -2.586 0.00 0.00 -0.010 C +ATOM 26 C UNL A 1 7.875 -2.392 -3.980 0.00 0.00 +0.091 C +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 14 15 +ENDBRANCH 1 14 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_43.mol2 b/compounds/MCL1_ligands/lig_43.mol2 new file mode 100644 index 0000000..eaee8a3 --- /dev/null +++ b/compounds/MCL1_ligands/lig_43.mol2 @@ -0,0 +1,102 @@ +@MOLECULE +lig_43.pdbqt +44 47 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 4.3747 2.9370 -1.7411 C.3 1 UNL1 -0.0062 + 2 C 4.2783 3.0125 -0.2351 C.ar 1 UNL1 -0.1802 + 3 C 4.0237 4.1885 0.5656 C.ar 1 UNL1 -0.0710 + 4 C 3.8422 5.5264 0.1903 C.2 1 UNL1 -0.0960 + 5 C 3.9581 3.8059 1.8775 C.ar 1 UNL1 -0.0403 + 6 C 3.5895 6.4720 1.2070 C.2 1 UNL1 -0.1780 + 7 C 3.5230 6.0689 2.5608 C.2 1 UNL1 -0.1420 + 8 C 3.7076 4.7158 2.9118 C.2 1 UNL1 -0.1500 + 9 N 4.1613 2.4475 1.9598 N.ar 1 UNL1 -0.2144 + 10 CA 4.3478 1.9343 0.6628 C.ar 1 UNL1 -0.0482 + 11 C 4.5646 0.4792 0.4116 C.2 1 UNL1 0.9318 + 12 O 4.5803 -0.2390 1.4000 O.co2 1 UNL1 -0.8218 + 13 OXT 4.7410 0.0496 -0.7162 O.co2 1 UNL1 -0.8218 + 14 C 5.7275 3.4626 -2.2740 C.3 1 UNL1 -0.0944 + 15 C 6.9167 2.5143 -1.9779 C.3 1 UNL1 0.1134 + 16 O 7.5698 2.1520 -3.2174 O.2 1 UNL1 -0.3509 + 17 C 6.9373 1.3977 -4.1835 C.2 1 UNL1 0.1231 + 18 C 7.1885 1.6843 -5.5338 C.2 1 UNL1 -0.1430 + 19 C 6.5263 0.9683 -6.5476 C.2 1 UNL1 -0.1210 + 20 C 5.6064 -0.0411 -6.2088 C.2 1 UNL1 -0.0700 + 21 C 4.9201 -0.7528 -7.2098 C.2 1 UNL1 -0.1220 + 22 C 5.3640 -0.3379 -4.8514 C.2 1 UNL1 -0.0050 + 23 C 3.9960 -1.7517 -6.8573 C.2 1 UNL1 -0.1470 + 24 C 3.7539 -2.0421 -5.5037 C.2 1 UNL1 -0.1470 + 25 C 4.4377 -1.3347 -4.5007 C.2 1 UNL1 -0.1020 + 26 C 6.0384 0.3724 -3.8465 C.2 1 UNL1 -0.1870 + 27 H 4.1559 1.8684 2.7870 H 1 UNL1 0.3097 + 28 HC2 3.5768 3.5587 -2.1653 H 1 UNL1 0.0557 + 29 HC3 4.1809 1.9299 -2.1239 H 1 UNL1 0.0557 + 30 HC 3.8934 5.8220 -0.8524 H 1 UNL1 0.1210 + 31 HC1 3.4429 7.5158 0.9461 H 1 UNL1 0.1080 + 32 HC4 3.3283 6.8052 3.3345 H 1 UNL1 0.1070 + 33 HC5 3.6555 4.3889 3.9446 H 1 UNL1 0.1170 + 34 HC6 5.9338 4.4438 -1.8297 H 1 UNL1 0.0352 + 35 HC7 5.6376 3.6323 -3.3541 H 1 UNL1 0.0352 + 36 HC8 6.5834 1.6230 -1.4324 H 1 UNL1 0.0832 + 37 HC9 7.6319 3.0338 -1.3296 H 1 UNL1 0.0832 + 38 HC10 7.8858 2.4756 -5.7870 H 1 UNL1 0.1340 + 39 HC11 6.7187 1.2048 -7.5893 H 1 UNL1 0.1170 + 40 HC12 5.0972 -0.5273 -8.2566 H 1 UNL1 0.1150 + 41 HC13 3.4627 -2.2953 -7.6315 H 1 UNL1 0.1140 + 42 HC14 3.0348 -2.8088 -5.2289 H 1 UNL1 0.1220 + 43 HC15 4.2465 -1.5466 -3.4492 H 1 UNL1 0.1630 + 44 HC16 5.8497 0.1295 -2.8069 H 1 UNL1 0.2130 +@BOND + 1 23 21 2 + 2 23 24 1 + 3 21 20 1 + 4 24 25 2 + 5 20 19 2 + 6 20 22 1 + 7 19 18 1 + 8 25 22 1 + 9 22 26 2 + 10 18 17 2 + 11 26 17 1 + 12 17 16 1 + 13 4 6 1 + 14 4 3 2 + 15 1 14 1 + 16 1 2 1 + 17 6 7 2 + 18 16 15 1 + 19 14 15 1 + 20 3 2 ar + 21 3 5 ar + 22 2 10 ar + 23 7 8 1 + 24 5 8 2 + 25 5 9 ar + 26 10 11 1 + 27 10 9 ar + 28 12 11 ar + 29 11 13 ar + 30 9 27 1 + 31 28 1 1 + 32 29 1 1 + 33 30 4 1 + 34 31 6 1 + 35 32 7 1 + 36 33 8 1 + 37 34 14 1 + 38 35 14 1 + 39 36 15 1 + 40 37 15 1 + 41 38 18 1 + 42 39 19 1 + 43 40 21 1 + 44 41 23 1 + 45 42 24 1 + 46 43 25 1 + 47 44 26 1 +@SUBSTRUCTURE + 1 UNL1 10 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_43.pdbqt b/compounds/MCL1_ligands/lig_43.pdbqt new file mode 100644 index 0000000..b257521 --- /dev/null +++ b/compounds/MCL1_ligands/lig_43.pdbqt @@ -0,0 +1,53 @@ +REMARK Name = lig_43.pdbqt +REMARK 6 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_2 +REMARK 2 A between atoms: C_1 and C_14 +REMARK 3 A between atoms: CA_10 and C_11 +REMARK 4 A between atoms: C_14 and C_15 +REMARK 5 A between atoms: C_15 and O_16 +REMARK 6 A between atoms: O_16 and C_17 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 4.375 2.937 -1.741 0.00 0.00 +0.105 C +ENDROOT +BRANCH 1 2 +ATOM 2 C UNL A 1 4.278 3.013 -0.235 0.00 0.00 -0.180 A +ATOM 3 C UNL A 1 4.024 4.189 0.566 0.00 0.00 -0.071 A +ATOM 4 C UNL A 1 3.842 5.526 0.190 0.00 0.00 +0.025 C +ATOM 5 C UNL A 1 3.958 3.806 1.877 0.00 0.00 -0.040 A +ATOM 6 C UNL A 1 3.590 6.472 1.207 0.00 0.00 -0.070 C +ATOM 7 C UNL A 1 3.523 6.069 2.561 0.00 0.00 -0.035 C +ATOM 8 C UNL A 1 3.708 4.716 2.912 0.00 0.00 -0.033 C +ATOM 9 N UNL A 1 4.161 2.447 1.960 0.00 0.00 -0.214 N +ATOM 10 CA UNL A 1 4.348 1.934 0.663 0.00 0.00 -0.048 A +ATOM 11 H UNL A 1 4.156 1.868 2.787 0.00 0.00 +0.310 HD +BRANCH 10 12 +ATOM 12 C UNL A 1 4.565 0.479 0.412 0.00 0.00 +0.932 C +ATOM 13 O UNL A 1 4.580 -0.239 1.400 0.00 0.00 -0.822 OA +ATOM 14 OXT UNL A 1 4.741 0.050 -0.716 0.00 0.00 -0.822 OA +ENDBRANCH 10 12 +ENDBRANCH 1 2 +BRANCH 1 15 +ATOM 15 C UNL A 1 5.728 3.463 -2.274 0.00 0.00 -0.024 C +BRANCH 15 16 +ATOM 16 C UNL A 1 6.917 2.514 -1.978 0.00 0.00 +0.280 C +BRANCH 16 17 +ATOM 17 O UNL A 1 7.570 2.152 -3.217 0.00 0.00 -0.351 OA +BRANCH 17 18 +ATOM 18 C UNL A 1 6.937 1.398 -4.184 0.00 0.00 +0.123 C +ATOM 19 C UNL A 1 7.189 1.684 -5.534 0.00 0.00 -0.009 C +ATOM 20 C UNL A 1 6.526 0.968 -6.548 0.00 0.00 -0.004 C +ATOM 21 C UNL A 1 5.606 -0.041 -6.209 0.00 0.00 -0.070 C +ATOM 22 C UNL A 1 4.920 -0.753 -7.210 0.00 0.00 -0.007 C +ATOM 23 C UNL A 1 5.364 -0.338 -4.851 0.00 0.00 -0.005 C +ATOM 24 C UNL A 1 3.996 -1.752 -6.857 0.00 0.00 -0.033 C +ATOM 25 C UNL A 1 3.754 -2.042 -5.504 0.00 0.00 -0.025 C +ATOM 26 C UNL A 1 4.438 -1.335 -4.501 0.00 0.00 +0.061 C +ATOM 27 C UNL A 1 6.038 0.372 -3.846 0.00 0.00 +0.026 C +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 1 15 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_46.mol2 b/compounds/MCL1_ligands/lig_46.mol2 new file mode 100644 index 0000000..21f6dcd --- /dev/null +++ b/compounds/MCL1_ligands/lig_46.mol2 @@ -0,0 +1,104 @@ +@MOLECULE +lig_46.pdbqt +45 48 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 CA 6.2233 1.1690 2.0372 C.ar 1 UNL1 0.0413 + 2 N 7.3378 1.1448 2.8742 N.ar 1 UNL1 -0.2154 + 3 C 7.4247 2.4300 3.3664 C.ar 1 UNL1 -0.0403 + 4 C 8.3708 2.9532 4.2558 C.2 1 UNL1 -0.1500 + 5 C 8.2515 4.3112 4.6141 C.2 1 UNL1 -0.1430 + 6 C 7.2063 5.1024 4.0851 C.2 1 UNL1 -0.1780 + 7 C 6.2671 4.5474 3.1898 C.2 1 UNL1 -0.0960 + 8 C 6.3994 3.1950 2.8439 C.ar 1 UNL1 -0.0710 + 9 C 5.6272 2.4143 2.0016 C.ar 1 UNL1 -0.1802 + 10 C 4.3940 2.8751 1.2428 C.3 1 UNL1 -0.0042 + 11 C 4.7379 3.6680 -0.0378 C.3 1 UNL1 -0.0954 + 12 C 5.6969 2.9112 -0.9907 C.3 1 UNL1 0.1114 + 13 O 5.3213 3.1702 -2.3612 O.2 1 UNL1 -0.3519 + 14 C 4.1744 2.6522 -2.9288 C.2 1 UNL1 0.1361 + 15 C 3.6522 3.3058 -4.0629 C.2 1 UNL1 -0.1850 + 16 C 2.4781 2.8404 -4.6871 C.2 1 UNL1 -0.1030 + 17 C 1.8434 1.7086 -4.1564 C.2 1 UNL1 -0.1443 + 18 C 2.3590 1.0561 -3.0465 C.2 1 UNL1 -0.0523 + 19 C 0.5833 1.0417 -4.6546 C.3 1 UNL1 -0.0231 + 20 C 3.5257 1.5075 -2.4155 C.2 1 UNL1 -0.1710 + 21 C 1.5189 -0.1342 -2.6559 C.3 1 UNL1 -0.0361 + 22 C 0.5231 -0.2793 -3.8391 C.3 1 UNL1 -0.0784 + 23 C 5.8068 -0.0644 1.3014 C.2 1 UNL1 0.8433 + 24 OXT 6.4912 -1.0603 1.4871 O.co2 1 UNL1 -0.8208 + 25 O 4.8633 -0.0519 0.5263 O.co2 1 UNL1 -0.8208 + 26 H 7.9181 0.3369 3.0437 H 1 UNL1 0.3097 + 27 HC 9.1675 2.3333 4.6546 H 1 UNL1 0.1170 + 28 HC1 8.9678 4.7524 5.3009 H 1 UNL1 0.1070 + 29 HC2 7.1240 6.1467 4.3695 H 1 UNL1 0.1070 + 30 HC3 5.4639 5.1504 2.7796 H 1 UNL1 0.1210 + 31 HC4 3.7453 2.0308 0.9865 H 1 UNL1 0.0542 + 32 HC5 3.7852 3.5110 1.8967 H 1 UNL1 0.0542 + 33 HC6 3.8001 3.9135 -0.5515 H 1 UNL1 0.0352 + 34 HC7 5.1988 4.6246 0.2375 H 1 UNL1 0.0352 + 35 HC8 5.6887 1.8347 -0.7928 H 1 UNL1 0.0847 + 36 HC9 6.7219 3.2576 -0.8105 H 1 UNL1 0.0847 + 37 HC10 4.1630 4.1812 -4.4489 H 1 UNL1 0.1310 + 38 HC11 2.0723 3.3472 -5.5572 H 1 UNL1 0.1150 + 39 HC12 0.6182 0.8434 -5.7332 H 1 UNL1 0.0362 + 40 HC13 -0.2921 1.6677 -4.4404 H 1 UNL1 0.0362 + 41 HC14 3.9104 0.9700 -1.5515 H 1 UNL1 0.2110 + 42 HC15 2.1252 -1.0396 -2.5244 H 1 UNL1 0.0622 + 43 HC16 0.9860 0.0674 -1.7183 H 1 UNL1 0.0622 + 44 HC17 -0.4943 -0.4936 -3.4882 H 1 UNL1 0.0322 + 45 HC18 0.8427 -1.1127 -4.4779 H 1 UNL1 0.0322 +@BOND + 1 22 21 1 + 2 22 19 1 + 3 21 18 1 + 4 15 14 2 + 5 15 16 1 + 6 20 18 2 + 7 20 14 1 + 8 18 17 1 + 9 14 13 1 + 10 13 12 1 + 11 17 16 2 + 12 17 19 1 + 13 12 11 1 + 14 11 10 1 + 15 10 9 1 + 16 25 23 ar + 17 23 24 ar + 18 23 1 1 + 19 9 1 ar + 20 9 8 ar + 21 1 2 ar + 22 8 7 1 + 23 8 3 ar + 24 7 6 2 + 25 2 3 ar + 26 3 4 1 + 27 6 5 1 + 28 4 5 2 + 29 2 26 1 + 30 27 4 1 + 31 28 5 1 + 32 29 6 1 + 33 30 7 1 + 34 31 10 1 + 35 32 10 1 + 36 33 11 1 + 37 34 11 1 + 38 35 12 1 + 39 36 12 1 + 40 37 15 1 + 41 38 16 1 + 42 39 19 1 + 43 40 19 1 + 44 41 20 1 + 45 42 21 1 + 46 43 21 1 + 47 44 22 1 + 48 45 22 1 +@SUBSTRUCTURE + 1 UNL1 1 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_46.pdbqt b/compounds/MCL1_ligands/lig_46.pdbqt new file mode 100644 index 0000000..c081971 --- /dev/null +++ b/compounds/MCL1_ligands/lig_46.pdbqt @@ -0,0 +1,52 @@ +REMARK Name = lig_46.pdbqt +REMARK 6 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: CA_1 and C_23 +REMARK 2 A between atoms: C_9 and C_10 +REMARK 3 A between atoms: C_10 and C_11 +REMARK 4 A between atoms: C_11 and C_12 +REMARK 5 A between atoms: C_12 and O_13 +REMARK 6 A between atoms: O_13 and C_14 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 CA UNL A 1 6.223 1.169 2.037 0.00 0.00 +0.041 A +ATOM 2 N UNL A 1 7.338 1.145 2.874 0.00 0.00 -0.215 N +ATOM 3 C UNL A 1 7.425 2.430 3.366 0.00 0.00 -0.040 A +ATOM 4 C UNL A 1 8.371 2.953 4.256 0.00 0.00 -0.033 C +ATOM 5 C UNL A 1 8.252 4.311 4.614 0.00 0.00 -0.036 C +ATOM 6 C UNL A 1 7.206 5.102 4.085 0.00 0.00 -0.071 C +ATOM 7 C UNL A 1 6.267 4.547 3.190 0.00 0.00 +0.025 C +ATOM 8 C UNL A 1 6.399 3.195 2.844 0.00 0.00 -0.071 A +ATOM 9 C UNL A 1 5.627 2.414 2.002 0.00 0.00 -0.180 A +ATOM 10 H UNL A 1 7.918 0.337 3.044 0.00 0.00 +0.310 HD +ENDROOT +BRANCH 1 11 +ATOM 11 C UNL A 1 5.807 -0.064 1.301 0.00 0.00 +0.843 C +ATOM 12 OXT UNL A 1 6.491 -1.060 1.487 0.00 0.00 -0.821 OA +ATOM 13 O UNL A 1 4.863 -0.052 0.526 0.00 0.00 -0.821 OA +ENDBRANCH 1 11 +BRANCH 9 14 +ATOM 14 C UNL A 1 4.394 2.875 1.243 0.00 0.00 +0.104 C +BRANCH 14 15 +ATOM 15 C UNL A 1 4.738 3.668 -0.038 0.00 0.00 -0.025 C +BRANCH 15 16 +ATOM 16 C UNL A 1 5.697 2.911 -0.991 0.00 0.00 +0.281 C +BRANCH 16 17 +ATOM 17 O UNL A 1 5.321 3.170 -2.361 0.00 0.00 -0.352 OA +BRANCH 17 18 +ATOM 18 C UNL A 1 4.174 2.652 -2.929 0.00 0.00 +0.136 C +ATOM 19 C UNL A 1 3.652 3.306 -4.063 0.00 0.00 -0.054 C +ATOM 20 C UNL A 1 2.478 2.840 -4.687 0.00 0.00 +0.012 C +ATOM 21 C UNL A 1 1.843 1.709 -4.156 0.00 0.00 -0.144 C +ATOM 22 C UNL A 1 2.359 1.056 -3.046 0.00 0.00 -0.052 C +ATOM 23 C UNL A 1 0.583 1.042 -4.655 0.00 0.00 +0.049 C +ATOM 24 C UNL A 1 3.526 1.508 -2.416 0.00 0.00 +0.040 C +ATOM 25 C UNL A 1 1.519 -0.134 -2.656 0.00 0.00 +0.088 C +ATOM 26 C UNL A 1 0.523 -0.279 -3.839 0.00 0.00 -0.014 C +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 14 15 +ENDBRANCH 9 14 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_47.mol2 b/compounds/MCL1_ligands/lig_47.mol2 new file mode 100644 index 0000000..932f3e1 --- /dev/null +++ b/compounds/MCL1_ligands/lig_47.mol2 @@ -0,0 +1,100 @@ +@MOLECULE +lig_47.pdbqt +43 46 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 9.2836 0.7699 -0.1111 C.3 1 UNL1 0.0048 + 2 C 9.1201 0.9557 -1.6029 C.ar 1 UNL1 -0.1992 + 3 C 9.9184 1.7914 -2.4718 C.ar 1 UNL1 -0.0570 + 4 C 11.0159 2.6178 -2.1917 C.2 1 UNL1 -0.1010 + 5 C 9.4455 1.6549 -3.7480 C.ar 1 UNL1 -0.0423 + 6 C 11.6140 3.3138 -3.2635 C.2 1 UNL1 -0.1720 + 7 C 11.1155 3.1709 -4.5786 C.2 1 UNL1 -0.1450 + 8 C 10.0155 2.3272 -4.8355 C.2 1 UNL1 -0.1470 + 9 N 8.3897 0.7726 -3.7443 N.ar 1 UNL1 -0.2234 + 10 CA 8.1846 0.3090 -2.4310 C.ar 1 UNL1 -0.0142 + 11 C 7.1293 -0.6999 -2.1072 C.2 1 UNL1 0.9178 + 12 OXT 6.4425 -1.0792 -3.0435 O.co2 1 UNL1 -0.8123 + 13 O 6.9547 -1.1037 -0.9690 O.co2 1 UNL1 -0.8123 + 14 C 8.9005 2.0362 0.6910 C.3 1 UNL1 -0.0994 + 15 C 7.4102 2.4360 0.5459 C.3 1 UNL1 0.1094 + 16 O 6.7919 2.5056 1.8533 O.2 1 UNL1 -0.3529 + 17 C 6.6055 1.3873 2.6381 C.2 1 UNL1 0.1181 + 18 C 6.6410 1.5205 4.0344 C.2 1 UNL1 -0.1420 + 19 C 6.4975 0.3859 4.8575 C.2 1 UNL1 -0.1703 + 20 C 6.3242 -0.8937 4.3019 C.2 1 UNL1 0.3576 + 21 N 6.2107 -1.9670 5.1111 N.2 1 UNL1 -0.6790 + 22 C 6.2801 -1.0137 2.8936 C.2 1 UNL1 -0.1173 + 23 C 6.0617 -3.1816 4.5508 C.2 1 UNL1 0.3912 + 24 C 6.0194 -3.3871 3.1633 C.2 1 UNL1 -0.2733 + 25 C 6.1313 -2.2802 2.3079 C.2 1 UNL1 -0.0600 + 26 C 6.4001 0.1192 2.0736 C.2 1 UNL1 -0.1760 + 27 H 7.8505 0.4512 -4.5351 H 1 UNL1 0.2967 + 28 HC2 10.3361 0.5384 0.0950 H 1 UNL1 0.0442 + 29 HC3 8.7258 -0.0894 0.2705 H 1 UNL1 0.0442 + 30 HC 11.3957 2.7131 -1.1802 H 1 UNL1 0.1220 + 31 HC1 12.4664 3.9607 -3.0760 H 1 UNL1 0.1080 + 32 HC4 11.5843 3.7104 -5.3958 H 1 UNL1 0.1080 + 33 HC5 9.6254 2.1995 -5.8397 H 1 UNL1 0.1170 + 34 HC6 9.1514 1.8737 1.7467 H 1 UNL1 0.0402 + 35 HC7 9.5219 2.8756 0.3583 H 1 UNL1 0.0402 + 36 HC8 7.3540 3.4206 0.0668 H 1 UNL1 0.0827 + 37 HC9 6.8772 1.7344 -0.1084 H 1 UNL1 0.0827 + 38 HC10 6.7941 2.5015 4.4721 H 1 UNL1 0.1340 + 39 HC11 6.5336 0.4864 5.9364 H 1 UNL1 0.1320 + 40 HC12 5.9797 -4.0216 5.2389 H 1 UNL1 -0.0019 + 41 HC13 5.9080 -4.3881 2.7617 H 1 UNL1 0.1340 + 42 HC14 6.1208 -2.3909 1.2201 H 1 UNL1 0.2050 + 43 HC15 6.3449 0.0028 0.9989 H 1 UNL1 0.2100 +@BOND + 1 8 5 1 + 2 8 7 2 + 3 9 5 ar + 4 9 10 ar + 5 13 11 ar + 6 5 3 ar + 7 11 12 ar + 8 11 10 1 + 9 7 6 1 + 10 10 2 ar + 11 3 2 ar + 12 3 4 1 + 13 2 1 1 + 14 6 4 2 + 15 15 14 1 + 16 15 16 1 + 17 14 1 1 + 18 16 17 1 + 19 26 17 2 + 20 26 22 1 + 21 17 18 1 + 22 22 25 1 + 23 22 20 2 + 24 25 24 2 + 25 18 19 2 + 26 20 19 1 + 27 20 21 1 + 28 24 23 1 + 29 21 23 2 + 30 9 27 1 + 31 28 1 1 + 32 29 1 1 + 33 30 4 1 + 34 31 6 1 + 35 32 7 1 + 36 33 8 1 + 37 34 14 1 + 38 35 14 1 + 39 36 15 1 + 40 37 15 1 + 41 38 18 1 + 42 39 19 1 + 43 40 23 1 + 44 41 24 1 + 45 42 25 1 + 46 43 26 1 +@SUBSTRUCTURE + 1 UNL1 10 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_47.pdbqt b/compounds/MCL1_ligands/lig_47.pdbqt new file mode 100644 index 0000000..baa88aa --- /dev/null +++ b/compounds/MCL1_ligands/lig_47.pdbqt @@ -0,0 +1,53 @@ +REMARK Name = lig_47.pdbqt +REMARK 6 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_2 +REMARK 2 A between atoms: C_1 and C_14 +REMARK 3 A between atoms: CA_10 and C_11 +REMARK 4 A between atoms: C_14 and C_15 +REMARK 5 A between atoms: C_15 and O_16 +REMARK 6 A between atoms: O_16 and C_17 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 9.284 0.770 -0.111 0.00 0.00 +0.093 C +ENDROOT +BRANCH 1 2 +ATOM 2 C UNL A 1 9.120 0.956 -1.603 0.00 0.00 -0.199 A +ATOM 3 C UNL A 1 9.918 1.791 -2.472 0.00 0.00 -0.057 A +ATOM 4 C UNL A 1 11.016 2.618 -2.192 0.00 0.00 +0.021 C +ATOM 5 C UNL A 1 9.445 1.655 -3.748 0.00 0.00 -0.042 A +ATOM 6 C UNL A 1 11.614 3.314 -3.264 0.00 0.00 -0.064 C +ATOM 7 C UNL A 1 11.116 3.171 -4.579 0.00 0.00 -0.037 C +ATOM 8 C UNL A 1 10.015 2.327 -4.835 0.00 0.00 -0.030 C +ATOM 9 N UNL A 1 8.390 0.773 -3.744 0.00 0.00 -0.223 N +ATOM 10 CA UNL A 1 8.185 0.309 -2.431 0.00 0.00 -0.014 A +ATOM 11 H UNL A 1 7.851 0.451 -4.535 0.00 0.00 +0.297 HD +BRANCH 10 12 +ATOM 12 C UNL A 1 7.129 -0.700 -2.107 0.00 0.00 +0.918 C +ATOM 13 OXT UNL A 1 6.442 -1.079 -3.043 0.00 0.00 -0.812 OA +ATOM 14 O UNL A 1 6.955 -1.104 -0.969 0.00 0.00 -0.812 OA +ENDBRANCH 10 12 +ENDBRANCH 1 2 +BRANCH 1 15 +ATOM 15 C UNL A 1 8.900 2.036 0.691 0.00 0.00 -0.019 C +BRANCH 15 16 +ATOM 16 C UNL A 1 7.410 2.436 0.546 0.00 0.00 +0.275 C +BRANCH 16 17 +ATOM 17 O UNL A 1 6.792 2.506 1.853 0.00 0.00 -0.353 OA +BRANCH 17 18 +ATOM 18 C UNL A 1 6.606 1.387 2.638 0.00 0.00 +0.118 C +ATOM 19 C UNL A 1 6.641 1.520 4.034 0.00 0.00 -0.008 C +ATOM 20 C UNL A 1 6.497 0.386 4.857 0.00 0.00 -0.038 C +ATOM 21 C UNL A 1 6.324 -0.894 4.302 0.00 0.00 +0.358 C +ATOM 22 N UNL A 1 6.211 -1.967 5.111 0.00 0.00 -0.679 NA +ATOM 23 C UNL A 1 6.280 -1.014 2.894 0.00 0.00 -0.117 C +ATOM 24 C UNL A 1 6.062 -3.182 4.551 0.00 0.00 +0.389 C +ATOM 25 C UNL A 1 6.019 -3.387 3.163 0.00 0.00 -0.139 C +ATOM 26 C UNL A 1 6.131 -2.280 2.308 0.00 0.00 +0.145 C +ATOM 27 C UNL A 1 6.400 0.119 2.074 0.00 0.00 +0.034 C +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 1 15 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_48.mol2 b/compounds/MCL1_ligands/lig_48.mol2 new file mode 100644 index 0000000..276c68e --- /dev/null +++ b/compounds/MCL1_ligands/lig_48.mol2 @@ -0,0 +1,98 @@ +@MOLECULE +lig_48.pdbqt +42 45 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 5.3027 2.5756 -1.2057 C.3 1 UNL1 -0.0032 + 2 C 5.0538 2.6827 0.2765 C.ar 1 UNL1 -0.1802 + 3 C 4.3756 3.6776 1.0775 C.ar 1 UNL1 -0.0710 + 4 C 3.7295 4.8569 0.6848 C.2 1 UNL1 -0.0950 + 5 C 4.4423 3.3095 2.4059 C.ar 1 UNL1 -0.0403 + 6 C 3.1446 5.6603 1.6862 C.2 1 UNL1 -0.1780 + 7 C 3.2148 5.2785 3.0455 C.2 1 UNL1 -0.1430 + 8 C 3.8713 4.0883 3.4201 C.2 1 UNL1 -0.1500 + 9 N 5.1310 2.1191 2.5435 N.ar 1 UNL1 -0.2154 + 10 CA 5.5191 1.7201 1.2607 C.ar 1 UNL1 0.0423 + 11 C 6.3067 0.4673 1.0534 C.2 1 UNL1 0.8443 + 12 O 6.5839 -0.1690 2.0605 O.co2 1 UNL1 -0.8223 + 13 OXT 6.6626 0.1165 -0.0615 O.co2 1 UNL1 -0.8223 + 14 C 6.6978 3.1200 -1.6025 C.3 1 UNL1 -0.0954 + 15 C 7.5380 2.1417 -2.4565 C.3 1 UNL1 0.1174 + 16 O 7.1699 2.2022 -3.8517 O.3 1 UNL1 -0.3499 + 17 C 5.9366 1.8442 -4.3549 C.3 1 UNL1 0.1941 + 18 C 5.3188 2.7359 -5.2539 C.3 1 UNL1 -0.2140 + 19 C 4.0745 2.4321 -5.8492 C.3 1 UNL1 -0.0930 + 20 C 3.4304 1.2136 -5.5632 C.3 1 UNL1 -0.2010 + 21 C 4.0643 0.3311 -4.6821 C.2 1 UNL1 -0.0073 + 22 N 3.6052 -0.9066 -4.2689 N.pl3 1 UNL1 -0.2534 + 23 C 5.2847 0.6218 -4.0883 C.2 1 UNL1 -0.1320 + 24 C 4.5931 -1.3345 -3.3916 C.2 1 UNL1 0.0072 + 25 C 5.6173 -0.4457 -3.2735 C.2 1 UNL1 -0.1500 + 26 H 5.3507 1.6020 3.3813 H 1 UNL1 0.3097 + 27 H 2.7267 -1.3484 -4.4834 H 1 UNL1 0.2767 + 28 HC2 4.5310 3.1258 -1.7574 H 1 UNL1 0.0552 + 29 HC3 5.1863 1.5321 -1.5096 H 1 UNL1 0.0552 + 30 HC 3.6839 5.1393 -0.3620 H 1 UNL1 0.1210 + 31 HC1 2.6372 6.5792 1.4091 H 1 UNL1 0.1070 + 32 HC4 2.7608 5.9059 3.8066 H 1 UNL1 0.1070 + 33 HC5 3.9337 3.7843 4.4601 H 1 UNL1 0.1170 + 34 HC6 6.5913 4.0789 -2.1248 H 1 UNL1 0.0347 + 35 HC7 7.2681 3.3329 -0.6891 H 1 UNL1 0.0347 + 36 HC8 8.5893 2.4401 -2.3716 H 1 UNL1 0.0857 + 37 HC9 7.4743 1.1278 -2.0581 H 1 UNL1 0.0857 + 38 HC10 5.8134 3.6735 -5.4827 H 1 UNL1 0.1350 + 39 HC11 3.6140 3.1406 -6.5315 H 1 UNL1 0.1140 + 40 HC12 2.4734 0.9667 -6.0113 H 1 UNL1 0.1180 + 41 HC13 4.5238 -2.2667 -2.8468 H 1 UNL1 0.0328 + 42 HC14 6.4515 -0.5826 -2.5862 H 1 UNL1 0.2240 +@BOND + 1 20 19 1 + 2 20 21 1 + 3 19 18 1 + 4 22 21 1 + 5 22 24 1 + 6 21 23 2 + 7 18 17 1 + 8 24 25 2 + 9 23 17 1 + 10 23 25 1 + 11 17 16 1 + 12 16 15 1 + 13 14 1 1 + 14 14 15 1 + 15 1 2 1 + 16 4 3 2 + 17 4 6 1 + 18 2 3 ar + 19 2 10 ar + 20 3 5 ar + 21 12 11 ar + 22 11 10 1 + 23 11 13 ar + 24 10 9 ar + 25 6 7 2 + 26 5 9 ar + 27 5 8 2 + 28 7 8 1 + 29 9 26 1 + 30 22 27 1 + 31 28 1 1 + 32 29 1 1 + 33 30 4 1 + 34 31 6 1 + 35 32 7 1 + 36 33 8 1 + 37 34 14 1 + 38 35 14 1 + 39 36 15 1 + 40 37 15 1 + 41 38 18 1 + 42 39 19 1 + 43 40 20 1 + 44 41 24 1 + 45 42 25 1 +@SUBSTRUCTURE + 1 UNL1 10 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_48.pdbqt b/compounds/MCL1_ligands/lig_48.pdbqt new file mode 100644 index 0000000..988ace9 --- /dev/null +++ b/compounds/MCL1_ligands/lig_48.pdbqt @@ -0,0 +1,53 @@ +REMARK Name = lig_48.pdbqt +REMARK 6 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_2 +REMARK 2 A between atoms: C_1 and C_14 +REMARK 3 A between atoms: CA_10 and C_11 +REMARK 4 A between atoms: C_14 and C_15 +REMARK 5 A between atoms: C_15 and O_16 +REMARK 6 A between atoms: O_16 and C_17 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 5.303 2.576 -1.206 0.00 0.00 +0.107 C +ENDROOT +BRANCH 1 2 +ATOM 2 C UNL A 1 5.054 2.683 0.277 0.00 0.00 -0.180 A +ATOM 3 C UNL A 1 4.376 3.678 1.077 0.00 0.00 -0.071 A +ATOM 4 C UNL A 1 3.729 4.857 0.685 0.00 0.00 +0.026 C +ATOM 5 C UNL A 1 4.442 3.309 2.406 0.00 0.00 -0.040 A +ATOM 6 C UNL A 1 3.145 5.660 1.686 0.00 0.00 -0.071 C +ATOM 7 C UNL A 1 3.215 5.279 3.046 0.00 0.00 -0.036 C +ATOM 8 C UNL A 1 3.871 4.088 3.420 0.00 0.00 -0.033 C +ATOM 9 N UNL A 1 5.131 2.119 2.543 0.00 0.00 -0.215 N +ATOM 10 CA UNL A 1 5.519 1.720 1.261 0.00 0.00 +0.042 A +ATOM 11 H UNL A 1 5.351 1.602 3.381 0.00 0.00 +0.310 HD +BRANCH 10 12 +ATOM 12 C UNL A 1 6.307 0.467 1.053 0.00 0.00 +0.844 C +ATOM 13 O UNL A 1 6.584 -0.169 2.061 0.00 0.00 -0.822 OA +ATOM 14 OXT UNL A 1 6.663 0.117 -0.061 0.00 0.00 -0.822 OA +ENDBRANCH 10 12 +ENDBRANCH 1 2 +BRANCH 1 15 +ATOM 15 C UNL A 1 6.698 3.120 -1.603 0.00 0.00 -0.026 C +BRANCH 15 16 +ATOM 16 C UNL A 1 7.538 2.142 -2.457 0.00 0.00 +0.289 C +BRANCH 16 17 +ATOM 17 O UNL A 1 7.170 2.202 -3.852 0.00 0.00 -0.350 OA +BRANCH 17 18 +ATOM 18 C UNL A 1 5.937 1.844 -4.355 0.00 0.00 +0.194 C +ATOM 19 C UNL A 1 5.319 2.736 -5.254 0.00 0.00 -0.079 C +ATOM 20 C UNL A 1 4.074 2.432 -5.849 0.00 0.00 +0.021 C +ATOM 21 C UNL A 1 3.430 1.214 -5.563 0.00 0.00 -0.083 C +ATOM 22 C UNL A 1 4.064 0.331 -4.682 0.00 0.00 -0.007 C +ATOM 23 N UNL A 1 3.605 -0.907 -4.269 0.00 0.00 -0.253 N +ATOM 24 C UNL A 1 5.285 0.622 -4.088 0.00 0.00 -0.132 C +ATOM 25 C UNL A 1 4.593 -1.335 -3.392 0.00 0.00 +0.040 C +ATOM 26 C UNL A 1 5.617 -0.446 -3.273 0.00 0.00 +0.074 C +ATOM 27 H UNL A 1 2.727 -1.348 -4.483 0.00 0.00 +0.277 HD +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 1 15 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_49.mol2 b/compounds/MCL1_ligands/lig_49.mol2 new file mode 100644 index 0000000..744b389 --- /dev/null +++ b/compounds/MCL1_ligands/lig_49.mol2 @@ -0,0 +1,95 @@ +@MOLECULE +lig_49.pdbqt +41 43 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 0.3432 -1.9840 0.0758 C.ar 1 UNL1 -0.1742 + 2 CA -0.9519 -2.4051 0.5806 C.ar 1 UNL1 0.0513 + 3 N -1.9688 -1.9600 -0.2627 N.ar 1 UNL1 -0.2094 + 4 C -1.3627 -1.3002 -1.3125 C.ar 1 UNL1 -0.0403 + 5 C -2.0044 -0.7214 -2.4138 C.2 1 UNL1 -0.1450 + 6 C -1.2042 -0.1149 -3.3998 C.2 1 UNL1 -0.1420 + 7 C 0.2013 -0.1066 -3.2664 C.2 1 UNL1 -0.1710 + 8 C 0.8276 -0.6973 -2.1490 C.2 1 UNL1 0.0564 + 9 CL 2.5787 -0.6738 -2.0694 Cl 1 UNL1 -0.1434 + 10 C 0.0139 -1.2927 -1.1633 C.ar 1 UNL1 -0.0600 + 11 C 1.6449 -2.2863 0.7788 C.3 1 UNL1 -0.0002 + 12 C 2.1449 -3.7215 0.4835 C.3 1 UNL1 -0.0904 + 13 C 3.5850 -3.7634 -0.0637 C.3 1 UNL1 0.1304 + 14 O 4.4813 -3.2629 0.9439 O.2 1 UNL1 -0.3329 + 15 C 5.8036 -3.0570 0.6474 C.2 1 UNL1 0.1531 + 16 C 6.1793 -2.1909 -0.3920 C.2 1 UNL1 -0.1910 + 17 C 7.5398 -1.9731 -0.6807 C.2 1 UNL1 -0.0343 + 18 C 7.9312 -1.0259 -1.8057 C.3 1 UNL1 -0.0558 + 19 C 8.5216 -2.6329 0.0890 C.2 1 UNL1 -0.0276 + 20 C 8.1428 -3.4898 1.1365 C.2 1 UNL1 -0.1000 + 21 CL 10.2316 -2.3995 -0.2244 Cl 1 UNL1 -0.1264 + 22 C 6.7825 -3.6975 1.4183 C.2 1 UNL1 -0.1640 + 23 C -1.2740 -3.2061 1.7973 C.2 1 UNL1 0.8393 + 24 O -2.4618 -3.4225 1.9967 O.co2 1 UNL1 -0.8098 + 25 OXT -0.3906 -3.6370 2.5194 O.co2 1 UNL1 -0.8098 + 26 H -2.9473 -2.1502 -0.1047 H 1 UNL1 0.3137 + 27 HC -3.0858 -0.7443 -2.5051 H 1 UNL1 0.1220 + 28 HC1 -1.6689 0.3410 -4.2690 H 1 UNL1 0.1140 + 29 HC2 0.8125 0.3550 -4.0355 H 1 UNL1 0.1240 + 30 HC3 1.5311 -2.1584 1.8626 H 1 UNL1 0.0582 + 31 HC4 2.4035 -1.5493 0.4963 H 1 UNL1 0.0582 + 32 HC5 2.0786 -4.3228 1.3994 H 1 UNL1 0.0657 + 33 HC6 1.4793 -4.2007 -0.2451 H 1 UNL1 0.0657 + 34 HC7 3.6434 -3.1587 -0.9764 H 1 UNL1 0.0407 + 35 HC8 3.8530 -4.7966 -0.3179 H 1 UNL1 0.0407 + 36 HC9 5.4090 -1.6782 -0.9596 H 1 UNL1 0.1610 + 37 HC10 8.9042 -3.9866 1.7306 H 1 UNL1 0.1370 + 38 HC11 6.4780 -4.3517 2.2294 H 1 UNL1 0.1480 + 39 HC12 8.5345 -0.1937 -1.4225 H 1 UNL1 0.0490 + 40 HC13 8.5197 -1.5480 -2.5701 H 1 UNL1 0.0490 + 41 HC14 7.0512 -0.5976 -2.3011 H 1 UNL1 0.0490 +@BOND + 1 6 5 1 + 2 6 7 2 + 3 5 4 2 + 4 7 8 1 + 5 8 9 1 + 6 8 10 2 + 7 4 3 ar + 8 4 10 ar + 9 3 2 ar + 10 10 1 ar + 11 2 1 ar + 12 2 23 1 + 13 1 11 1 + 14 21 19 1 + 15 13 14 1 + 16 13 12 1 + 17 18 17 1 + 18 24 23 ar + 19 14 15 1 + 20 20 19 1 + 21 20 22 2 + 22 19 17 2 + 23 17 16 1 + 24 16 15 2 + 25 22 15 1 + 26 23 25 ar + 27 12 11 1 + 28 3 26 1 + 29 27 5 1 + 30 28 6 1 + 31 29 7 1 + 32 30 11 1 + 33 31 11 1 + 34 32 12 1 + 35 33 12 1 + 36 34 13 1 + 37 35 13 1 + 38 36 16 1 + 39 37 20 1 + 40 38 22 1 + 41 39 18 1 + 42 40 18 1 + 43 41 18 1 +@SUBSTRUCTURE + 1 UNL1 2 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_49.pdbqt b/compounds/MCL1_ligands/lig_49.pdbqt new file mode 100644 index 0000000..1c3595b --- /dev/null +++ b/compounds/MCL1_ligands/lig_49.pdbqt @@ -0,0 +1,53 @@ +REMARK Name = lig_49.pdbqt +REMARK 7 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_11 +REMARK 2 A between atoms: CA_2 and C_23 +REMARK 3 A between atoms: C_11 and C_12 +REMARK 4 A between atoms: C_12 and C_13 +REMARK 5 A between atoms: C_13 and O_14 +REMARK 6 A between atoms: O_14 and C_15 +REMARK 7 A between atoms: C_17 and C_18 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 0.343 -1.984 0.076 0.00 0.00 -0.174 A +ATOM 2 CA UNL A 1 -0.952 -2.405 0.581 0.00 0.00 +0.051 A +ATOM 3 N UNL A 1 -1.969 -1.960 -0.263 0.00 0.00 -0.209 N +ATOM 4 C UNL A 1 -1.363 -1.300 -1.312 0.00 0.00 -0.040 A +ATOM 5 C UNL A 1 -2.004 -0.721 -2.414 0.00 0.00 -0.023 C +ATOM 6 C UNL A 1 -1.204 -0.115 -3.400 0.00 0.00 -0.028 C +ATOM 7 C UNL A 1 0.201 -0.107 -3.266 0.00 0.00 -0.047 C +ATOM 8 C UNL A 1 0.828 -0.697 -2.149 0.00 0.00 +0.056 C +ATOM 9 CL UNL A 1 2.579 -0.674 -2.069 0.00 0.00 -0.143 Cl +ATOM 10 C UNL A 1 0.014 -1.293 -1.163 0.00 0.00 -0.060 A +ATOM 11 H UNL A 1 -2.947 -2.150 -0.105 0.00 0.00 +0.314 HD +ENDROOT +BRANCH 2 12 +ATOM 12 C UNL A 1 -1.274 -3.206 1.797 0.00 0.00 +0.839 C +ATOM 13 O UNL A 1 -2.462 -3.422 1.997 0.00 0.00 -0.810 OA +ATOM 14 OXT UNL A 1 -0.391 -3.637 2.519 0.00 0.00 -0.810 OA +ENDBRANCH 2 12 +BRANCH 1 15 +ATOM 15 C UNL A 1 1.645 -2.286 0.779 0.00 0.00 +0.116 C +BRANCH 15 16 +ATOM 16 C UNL A 1 2.145 -3.721 0.483 0.00 0.00 +0.041 C +BRANCH 16 17 +ATOM 17 C UNL A 1 3.585 -3.763 -0.064 0.00 0.00 +0.212 C +BRANCH 17 18 +ATOM 18 O UNL A 1 4.481 -3.263 0.944 0.00 0.00 -0.333 OA +BRANCH 18 19 +ATOM 19 C UNL A 1 5.804 -3.057 0.647 0.00 0.00 +0.153 C +ATOM 20 C UNL A 1 6.179 -2.191 -0.392 0.00 0.00 -0.030 C +ATOM 21 C UNL A 1 7.540 -1.973 -0.681 0.00 0.00 -0.034 C +ATOM 22 C UNL A 1 7.931 -1.026 -1.806 0.00 0.00 +0.091 C +ATOM 23 C UNL A 1 8.522 -2.633 0.089 0.00 0.00 -0.028 C +ATOM 24 C UNL A 1 8.143 -3.490 1.137 0.00 0.00 +0.037 C +ATOM 25 CL UNL A 1 10.232 -2.400 -0.224 0.00 0.00 -0.126 Cl +ATOM 26 C UNL A 1 6.782 -3.697 1.418 0.00 0.00 -0.016 C +ENDBRANCH 18 19 +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 1 15 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_50.mol2 b/compounds/MCL1_ligands/lig_50.mol2 new file mode 100644 index 0000000..6167249 --- /dev/null +++ b/compounds/MCL1_ligands/lig_50.mol2 @@ -0,0 +1,101 @@ +@MOLECULE +lig_50.pdbqt +44 46 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 2.5623 2.9546 1.2836 C.ar 1 UNL1 -0.1642 + 2 CA 2.6375 2.3935 2.5682 C.ar 1 UNL1 -0.0502 + 3 N 1.8646 3.1878 3.4288 N.ar 1 UNL1 -0.2094 + 4 C 1.3406 4.2392 2.7140 C.ar 1 UNL1 -0.0363 + 5 C 0.5363 5.2789 3.1947 C.2 1 UNL1 -0.1470 + 6 C 0.1326 6.2706 2.2811 C.2 1 UNL1 -0.1370 + 7 C 0.5466 6.2018 0.9325 C.2 1 UNL1 -0.1730 + 8 C 1.3605 5.1430 0.4773 C.2 1 UNL1 0.0594 + 9 CL 1.8617 5.1434 -1.2025 Cl 1 UNL1 -0.1274 + 10 C 1.7428 4.1511 1.4040 C.ar 1 UNL1 -0.0630 + 11 C 3.2304 2.3655 0.0624 C.3 1 UNL1 -0.0102 + 12 C 4.6500 2.9432 -0.1670 C.3 1 UNL1 -0.0954 + 13 C 5.7302 1.8461 -0.2386 C.3 1 UNL1 0.1114 + 14 O 5.4842 1.0331 -1.4035 O.2 1 UNL1 -0.3479 + 15 C 5.9730 -0.2478 -1.4690 C.2 1 UNL1 0.1431 + 16 C 5.7334 -1.1670 -0.4363 C.2 1 UNL1 -0.1815 + 17 C 6.2273 -2.4809 -0.5261 C.2 1 UNL1 -0.0428 + 18 C 5.9561 -3.4558 0.6115 C.3 1 UNL1 -0.0533 + 19 C 6.9580 -2.8719 -1.6700 C.2 1 UNL1 -0.0296 + 20 C 7.1847 -1.9529 -2.7184 C.2 1 UNL1 -0.0428 + 21 CL 7.5793 -4.5123 -1.7950 Cl 1 UNL1 -0.1384 + 22 C 6.6830 -0.6430 -2.6086 C.2 1 UNL1 -0.1815 + 23 C 7.9582 -2.3582 -3.9655 C.3 1 UNL1 -0.0533 + 24 C 3.3723 1.1882 3.0551 C.2 1 UNL1 0.9328 + 25 OXT 3.2514 0.9394 4.2460 O.co2 1 UNL1 -0.8183 + 26 O 4.0704 0.5192 2.3107 O.co2 1 UNL1 -0.8183 + 27 H 1.7626 2.9923 4.4140 H 1 UNL1 0.3137 + 28 HC 0.2380 5.3191 4.2374 H 1 UNL1 0.1230 + 29 HC1 -0.4913 7.0939 2.6156 H 1 UNL1 0.1150 + 30 HC2 0.2412 6.9749 0.2348 H 1 UNL1 0.1250 + 31 HC3 2.6189 2.5485 -0.8270 H 1 UNL1 0.0607 + 32 HC4 3.2637 1.2723 0.1349 H 1 UNL1 0.0607 + 33 HC5 4.9057 3.6305 0.6495 H 1 UNL1 0.0392 + 34 HC6 4.6644 3.5367 -1.0895 H 1 UNL1 0.0392 + 35 HC7 6.7252 2.3013 -0.3059 H 1 UNL1 0.0832 + 36 HC8 5.6965 1.2538 0.6829 H 1 UNL1 0.0832 + 37 HC9 5.1504 -0.8613 0.4317 H 1 UNL1 0.1760 + 38 HC10 6.8380 0.0794 -3.4017 H 1 UNL1 0.1760 + 39 HC11 5.3867 -2.9831 1.4224 H 1 UNL1 0.0462 + 40 HC12 5.3762 -4.3175 0.2598 H 1 UNL1 0.0462 + 41 HC13 6.8938 -3.8278 1.0416 H 1 UNL1 0.0462 + 42 HC14 8.0451 -1.5286 -4.6773 H 1 UNL1 0.0462 + 43 HC15 8.9745 -2.6810 -3.7074 H 1 UNL1 0.0462 + 44 HC16 7.4596 -3.1873 -4.4825 H 1 UNL1 0.0462 +@BOND + 1 9 8 1 + 2 11 12 1 + 3 11 1 1 + 4 12 13 1 + 5 8 7 2 + 6 8 10 1 + 7 15 16 2 + 8 15 14 1 + 9 15 22 1 + 10 16 17 1 + 11 14 13 1 + 12 17 19 2 + 13 17 18 1 + 14 22 20 2 + 15 19 20 1 + 16 19 21 1 + 17 20 23 1 + 18 7 6 1 + 19 1 10 ar + 20 1 2 ar + 21 10 4 ar + 22 6 5 2 + 23 2 3 ar + 24 2 24 1 + 25 4 5 1 + 26 4 3 ar + 27 26 24 ar + 28 24 25 ar + 29 3 27 1 + 30 28 5 1 + 31 29 6 1 + 32 30 7 1 + 33 31 11 1 + 34 32 11 1 + 35 33 12 1 + 36 34 12 1 + 37 35 13 1 + 38 36 13 1 + 39 37 16 1 + 40 38 22 1 + 41 39 18 1 + 42 40 18 1 + 43 41 18 1 + 44 42 23 1 + 45 43 23 1 + 46 44 23 1 +@SUBSTRUCTURE + 1 UNL1 2 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_50.pdbqt b/compounds/MCL1_ligands/lig_50.pdbqt new file mode 100644 index 0000000..2e59530 --- /dev/null +++ b/compounds/MCL1_ligands/lig_50.pdbqt @@ -0,0 +1,55 @@ +REMARK Name = lig_50.pdbqt +REMARK 8 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_11 +REMARK 2 A between atoms: CA_2 and C_24 +REMARK 3 A between atoms: C_11 and C_12 +REMARK 4 A between atoms: C_12 and C_13 +REMARK 5 A between atoms: C_13 and O_14 +REMARK 6 A between atoms: O_14 and C_15 +REMARK 7 A between atoms: C_17 and C_18 +REMARK 8 A between atoms: C_20 and C_23 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 2.562 2.955 1.284 0.00 0.00 -0.164 A +ATOM 2 CA UNL A 1 2.638 2.393 2.568 0.00 0.00 -0.050 A +ATOM 3 N UNL A 1 1.865 3.188 3.429 0.00 0.00 -0.209 N +ATOM 4 C UNL A 1 1.341 4.239 2.714 0.00 0.00 -0.036 A +ATOM 5 C UNL A 1 0.536 5.279 3.195 0.00 0.00 -0.024 C +ATOM 6 C UNL A 1 0.133 6.271 2.281 0.00 0.00 -0.022 C +ATOM 7 C UNL A 1 0.547 6.202 0.932 0.00 0.00 -0.048 C +ATOM 8 C UNL A 1 1.361 5.143 0.477 0.00 0.00 +0.059 C +ATOM 9 CL UNL A 1 1.862 5.143 -1.202 0.00 0.00 -0.127 Cl +ATOM 10 C UNL A 1 1.743 4.151 1.404 0.00 0.00 -0.063 A +ATOM 11 H UNL A 1 1.763 2.992 4.414 0.00 0.00 +0.314 HD +ENDROOT +BRANCH 2 12 +ATOM 12 C UNL A 1 3.372 1.188 3.055 0.00 0.00 +0.933 C +ATOM 13 OXT UNL A 1 3.251 0.939 4.246 0.00 0.00 -0.818 OA +ATOM 14 O UNL A 1 4.070 0.519 2.311 0.00 0.00 -0.818 OA +ENDBRANCH 2 12 +BRANCH 1 15 +ATOM 15 C UNL A 1 3.230 2.365 0.062 0.00 0.00 +0.111 C +BRANCH 15 16 +ATOM 16 C UNL A 1 4.650 2.943 -0.167 0.00 0.00 -0.017 C +BRANCH 16 17 +ATOM 17 C UNL A 1 5.730 1.846 -0.239 0.00 0.00 +0.278 C +BRANCH 17 18 +ATOM 18 O UNL A 1 5.484 1.033 -1.403 0.00 0.00 -0.348 OA +BRANCH 18 19 +ATOM 19 C UNL A 1 5.973 -0.248 -1.469 0.00 0.00 +0.143 C +ATOM 20 C UNL A 1 5.733 -1.167 -0.436 0.00 0.00 -0.006 C +ATOM 21 C UNL A 1 6.227 -2.481 -0.526 0.00 0.00 -0.043 C +ATOM 22 C UNL A 1 5.956 -3.456 0.612 0.00 0.00 +0.085 C +ATOM 23 C UNL A 1 6.958 -2.872 -1.670 0.00 0.00 -0.030 C +ATOM 24 C UNL A 1 7.185 -1.953 -2.718 0.00 0.00 -0.043 C +ATOM 25 CL UNL A 1 7.579 -4.512 -1.795 0.00 0.00 -0.138 Cl +ATOM 26 C UNL A 1 6.683 -0.643 -2.609 0.00 0.00 -0.006 C +ATOM 27 C UNL A 1 7.958 -2.358 -3.966 0.00 0.00 +0.085 C +ENDBRANCH 18 19 +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 1 15 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_52.mol2 b/compounds/MCL1_ligands/lig_52.mol2 new file mode 100644 index 0000000..7d03b96 --- /dev/null +++ b/compounds/MCL1_ligands/lig_52.mol2 @@ -0,0 +1,95 @@ +@MOLECULE +lig_52.pdbqt +41 43 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 0.3584 -2.4292 0.4251 C.ar 1 UNL1 -0.1742 + 2 CA -0.8551 -3.1193 0.0257 C.ar 1 UNL1 0.0513 + 3 N -1.2097 -2.7606 -1.2785 N.ar 1 UNL1 -0.2094 + 4 C -0.2310 -1.9001 -1.7386 C.ar 1 UNL1 -0.0403 + 5 C -0.1271 -1.3265 -3.0124 C.2 1 UNL1 -0.1450 + 6 C 0.9856 -0.5025 -3.2739 C.2 1 UNL1 -0.1420 + 7 CL 1.1700 0.2338 -4.8508 Cl 1 UNL1 -0.1434 + 8 C 1.9592 -0.2735 -2.2767 C.2 1 UNL1 -0.1710 + 9 C 1.8300 -0.8637 -1.0026 C.2 1 UNL1 0.0564 + 10 C 0.7149 -1.6771 -0.7588 C.ar 1 UNL1 -0.0600 + 11 C 1.0732 -2.6349 1.7375 C.3 1 UNL1 -0.0002 + 12 C 1.9369 -3.9182 1.7395 C.3 1 UNL1 -0.0904 + 13 C 3.0024 -3.9331 0.6236 C.3 1 UNL1 0.1304 + 14 O 3.9254 -2.8522 0.8593 O.2 1 UNL1 -0.3329 + 15 C 4.9188 -2.4992 -0.0265 C.2 1 UNL1 0.1531 + 16 C 5.8936 -1.5970 0.4226 C.2 1 UNL1 -0.1910 + 17 C 6.9281 -1.1691 -0.4303 C.2 1 UNL1 -0.0343 + 18 C 7.9711 -0.1846 0.0786 C.3 1 UNL1 -0.0558 + 19 C 6.9748 -1.6574 -1.7523 C.2 1 UNL1 -0.0276 + 20 C 5.9945 -2.5529 -2.2099 C.2 1 UNL1 -0.1000 + 21 CL 8.2400 -1.1606 -2.8608 Cl 1 UNL1 -0.1264 + 22 C 4.9658 -2.9741 -1.3509 C.2 1 UNL1 -0.1640 + 23 C -1.6617 -4.1055 0.8004 C.2 1 UNL1 0.8393 + 24 OXT -1.3261 -4.4371 1.9256 O.co2 1 UNL1 -0.8098 + 25 O -2.6421 -4.5662 0.2336 O.co2 1 UNL1 -0.8098 + 26 H -2.0101 -3.1341 -1.7673 H 1 UNL1 0.3137 + 27 HC -0.8741 -1.5149 -3.7768 H 1 UNL1 0.1220 + 28 HC1 2.8166 0.3558 -2.4947 H 1 UNL1 0.1140 + 29 HC2 2.5782 -0.7027 -0.2335 H 1 UNL1 0.1240 + 30 HC3 1.7112 -1.7677 1.9472 H 1 UNL1 0.0582 + 31 HC4 0.3512 -2.6773 2.5628 H 1 UNL1 0.0582 + 32 HC5 1.2819 -4.7903 1.6182 H 1 UNL1 0.0657 + 33 HC6 2.4258 -4.0277 2.7147 H 1 UNL1 0.0657 + 34 HC7 2.5076 -3.8224 -0.3490 H 1 UNL1 0.0407 + 35 HC8 3.5370 -4.8913 0.6339 H 1 UNL1 0.0407 + 36 HC9 5.8333 -1.2307 1.4421 H 1 UNL1 0.1610 + 37 HC10 6.0283 -2.9127 -3.2347 H 1 UNL1 0.1370 + 38 HC11 4.2068 -3.6512 -1.7273 H 1 UNL1 0.1480 + 39 HC12 8.9770 -0.6187 0.0261 H 1 UNL1 0.0490 + 40 HC13 7.7861 0.1005 1.1214 H 1 UNL1 0.0490 + 41 HC14 7.9661 0.7337 -0.5215 H 1 UNL1 0.0490 +@BOND + 1 7 6 1 + 2 6 5 1 + 3 6 8 2 + 4 5 4 2 + 5 8 9 1 + 6 4 3 ar + 7 4 10 ar + 8 9 10 2 + 9 3 2 ar + 10 10 1 ar + 11 2 1 ar + 12 2 23 1 + 13 1 11 1 + 14 21 19 1 + 15 13 14 1 + 16 13 12 1 + 17 20 22 1 + 18 20 19 2 + 19 22 15 2 + 20 14 15 1 + 21 25 23 ar + 22 18 17 1 + 23 19 17 1 + 24 15 16 1 + 25 17 16 2 + 26 23 24 ar + 27 12 11 1 + 28 3 26 1 + 29 27 5 1 + 30 28 8 1 + 31 29 9 1 + 32 30 11 1 + 33 31 11 1 + 34 32 12 1 + 35 33 12 1 + 36 34 13 1 + 37 35 13 1 + 38 36 16 1 + 39 37 20 1 + 40 38 22 1 + 41 39 18 1 + 42 40 18 1 + 43 41 18 1 +@SUBSTRUCTURE + 1 UNL1 2 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_52.pdbqt b/compounds/MCL1_ligands/lig_52.pdbqt new file mode 100644 index 0000000..e9f58ef --- /dev/null +++ b/compounds/MCL1_ligands/lig_52.pdbqt @@ -0,0 +1,53 @@ +REMARK Name = lig_52.pdbqt +REMARK 7 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_11 +REMARK 2 A between atoms: CA_2 and C_23 +REMARK 3 A between atoms: C_11 and C_12 +REMARK 4 A between atoms: C_12 and C_13 +REMARK 5 A between atoms: C_13 and O_14 +REMARK 6 A between atoms: O_14 and C_15 +REMARK 7 A between atoms: C_17 and C_18 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 0.358 -2.429 0.425 0.00 0.00 -0.174 A +ATOM 2 CA UNL A 1 -0.855 -3.119 0.026 0.00 0.00 +0.051 A +ATOM 3 N UNL A 1 -1.210 -2.761 -1.278 0.00 0.00 -0.209 N +ATOM 4 C UNL A 1 -0.231 -1.900 -1.739 0.00 0.00 -0.040 A +ATOM 5 C UNL A 1 -0.127 -1.327 -3.012 0.00 0.00 -0.023 C +ATOM 6 C UNL A 1 0.986 -0.502 -3.274 0.00 0.00 -0.142 C +ATOM 7 CL UNL A 1 1.170 0.234 -4.851 0.00 0.00 -0.143 Cl +ATOM 8 C UNL A 1 1.959 -0.274 -2.277 0.00 0.00 -0.057 C +ATOM 9 C UNL A 1 1.830 -0.864 -1.003 0.00 0.00 +0.180 C +ATOM 10 C UNL A 1 0.715 -1.677 -0.759 0.00 0.00 -0.060 A +ATOM 11 H UNL A 1 -2.010 -3.134 -1.767 0.00 0.00 +0.314 HD +ENDROOT +BRANCH 2 12 +ATOM 12 C UNL A 1 -1.662 -4.106 0.800 0.00 0.00 +0.839 C +ATOM 13 OXT UNL A 1 -1.326 -4.437 1.926 0.00 0.00 -0.810 OA +ATOM 14 O UNL A 1 -2.642 -4.566 0.234 0.00 0.00 -0.810 OA +ENDBRANCH 2 12 +BRANCH 1 15 +ATOM 15 C UNL A 1 1.073 -2.635 1.738 0.00 0.00 +0.116 C +BRANCH 15 16 +ATOM 16 C UNL A 1 1.937 -3.918 1.740 0.00 0.00 +0.041 C +BRANCH 16 17 +ATOM 17 C UNL A 1 3.002 -3.933 0.624 0.00 0.00 +0.212 C +BRANCH 17 18 +ATOM 18 O UNL A 1 3.925 -2.852 0.859 0.00 0.00 -0.333 OA +BRANCH 18 19 +ATOM 19 C UNL A 1 4.919 -2.499 -0.026 0.00 0.00 +0.153 C +ATOM 20 C UNL A 1 5.894 -1.597 0.423 0.00 0.00 -0.030 C +ATOM 21 C UNL A 1 6.928 -1.169 -0.430 0.00 0.00 -0.034 C +ATOM 22 C UNL A 1 7.971 -0.185 0.079 0.00 0.00 +0.091 C +ATOM 23 C UNL A 1 6.975 -1.657 -1.752 0.00 0.00 -0.028 C +ATOM 24 C UNL A 1 5.995 -2.553 -2.210 0.00 0.00 +0.037 C +ATOM 25 CL UNL A 1 8.240 -1.161 -2.861 0.00 0.00 -0.126 Cl +ATOM 26 C UNL A 1 4.966 -2.974 -1.351 0.00 0.00 -0.016 C +ENDBRANCH 18 19 +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 1 15 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_53.mol2 b/compounds/MCL1_ligands/lig_53.mol2 new file mode 100644 index 0000000..db1bdc3 --- /dev/null +++ b/compounds/MCL1_ligands/lig_53.mol2 @@ -0,0 +1,101 @@ +@MOLECULE +lig_53.pdbqt +44 46 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 2.6960 2.9095 1.4417 C.ar 1 UNL1 -0.1642 + 2 CA 2.7515 2.3719 2.7357 C.ar 1 UNL1 -0.0502 + 3 N 1.9177 3.1514 3.5589 N.ar 1 UNL1 -0.2094 + 4 C 1.3634 4.1596 2.8012 C.ar 1 UNL1 -0.0363 + 5 C 0.4863 5.1745 3.2044 C.2 1 UNL1 -0.1470 + 6 C 0.0658 6.0998 2.2276 C.2 1 UNL1 -0.1370 + 7 CL -1.0298 7.3920 2.6676 Cl 1 UNL1 -0.1274 + 8 C 0.5242 5.9931 0.8952 C.2 1 UNL1 -0.1730 + 9 C 1.4089 4.9582 0.5243 C.2 1 UNL1 0.0594 + 10 C 1.8108 4.0490 1.5117 C.ar 1 UNL1 -0.0630 + 11 C 3.4572 2.3773 0.2535 C.3 1 UNL1 -0.0102 + 12 C 4.9033 2.9313 0.1917 C.3 1 UNL1 -0.0954 + 13 C 5.9529 1.8220 -0.0168 C.3 1 UNL1 0.1114 + 14 O 5.6728 1.1466 -1.2598 O.2 1 UNL1 -0.3479 + 15 C 6.0315 -0.1681 -1.4293 C.2 1 UNL1 0.1431 + 16 C 5.6895 -1.1417 -0.4773 C.2 1 UNL1 -0.1815 + 17 C 6.0518 -2.4862 -0.6753 C.2 1 UNL1 -0.0428 + 18 C 5.6750 -3.5203 0.3771 C.3 1 UNL1 -0.0533 + 19 C 6.7527 -2.8522 -1.8457 C.2 1 UNL1 -0.0296 + 20 C 7.0815 -1.8770 -2.8128 C.2 1 UNL1 -0.0428 + 21 CL 7.2092 -4.5304 -2.1056 Cl 1 UNL1 -0.1384 + 22 C 6.7114 -0.5371 -2.5957 C.2 1 UNL1 -0.1815 + 23 C 7.8269 -2.2532 -4.0861 C.3 1 UNL1 -0.0533 + 24 C 3.5270 1.2029 3.2451 C.2 1 UNL1 0.9328 + 25 O 4.2509 0.5542 2.5059 O.co2 1 UNL1 -0.8183 + 26 OXT 3.4009 0.9542 4.4346 O.co2 1 UNL1 -0.8183 + 27 H 1.7864 2.9727 4.5440 H 1 UNL1 0.3137 + 28 HC 0.1430 5.2476 4.2313 H 1 UNL1 0.1230 + 29 HC1 0.1938 6.7133 0.1536 H 1 UNL1 0.1150 + 30 HC2 1.7706 4.8669 -0.4941 H 1 UNL1 0.1250 + 31 HC3 2.9356 2.6389 -0.6746 H 1 UNL1 0.0607 + 32 HC4 3.4601 1.2804 0.2747 H 1 UNL1 0.0607 + 33 HC5 5.1402 3.4520 1.1286 H 1 UNL1 0.0392 + 34 HC6 4.9823 3.6767 -0.6092 H 1 UNL1 0.0392 + 35 HC7 6.9604 2.2537 -0.0422 H 1 UNL1 0.0832 + 36 HC8 5.9101 1.1340 0.8357 H 1 UNL1 0.0832 + 37 HC9 5.1320 -0.8538 0.4137 H 1 UNL1 0.1760 + 38 HC10 6.9479 0.2288 -3.3253 H 1 UNL1 0.1760 + 39 HC11 5.0177 -4.2895 -0.0462 H 1 UNL1 0.0462 + 40 HC12 6.5677 -4.0166 0.7770 H 1 UNL1 0.0462 + 41 HC13 5.1463 -3.0629 1.2233 H 1 UNL1 0.0462 + 42 HC14 8.0026 -1.3809 -4.7272 H 1 UNL1 0.0462 + 43 HC15 8.8038 -2.6939 -3.8517 H 1 UNL1 0.0462 + 44 HC16 7.2561 -2.9847 -4.6716 H 1 UNL1 0.0462 +@BOND + 1 12 11 1 + 2 12 13 1 + 3 11 1 1 + 4 9 8 2 + 5 9 10 1 + 6 15 16 2 + 7 15 14 1 + 8 15 22 1 + 9 16 17 1 + 10 17 19 2 + 11 17 18 1 + 12 14 13 1 + 13 22 20 2 + 14 19 20 1 + 15 19 21 1 + 16 20 23 1 + 17 8 6 1 + 18 1 10 ar + 19 1 2 ar + 20 10 4 ar + 21 6 7 1 + 22 6 5 2 + 23 2 3 ar + 24 2 24 1 + 25 4 5 1 + 26 4 3 ar + 27 25 24 ar + 28 24 26 ar + 29 3 27 1 + 30 28 5 1 + 31 29 8 1 + 32 30 9 1 + 33 31 11 1 + 34 32 11 1 + 35 33 12 1 + 36 34 12 1 + 37 35 13 1 + 38 36 13 1 + 39 37 16 1 + 40 38 22 1 + 41 39 18 1 + 42 40 18 1 + 43 41 18 1 + 44 42 23 1 + 45 43 23 1 + 46 44 23 1 +@SUBSTRUCTURE + 1 UNL1 2 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_53.pdbqt b/compounds/MCL1_ligands/lig_53.pdbqt new file mode 100644 index 0000000..c7c6a71 --- /dev/null +++ b/compounds/MCL1_ligands/lig_53.pdbqt @@ -0,0 +1,55 @@ +REMARK Name = lig_53.pdbqt +REMARK 8 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_11 +REMARK 2 A between atoms: CA_2 and C_24 +REMARK 3 A between atoms: C_11 and C_12 +REMARK 4 A between atoms: C_12 and C_13 +REMARK 5 A between atoms: C_13 and O_14 +REMARK 6 A between atoms: O_14 and C_15 +REMARK 7 A between atoms: C_17 and C_18 +REMARK 8 A between atoms: C_20 and C_23 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 2.696 2.909 1.442 0.00 0.00 -0.164 A +ATOM 2 CA UNL A 1 2.752 2.372 2.736 0.00 0.00 -0.050 A +ATOM 3 N UNL A 1 1.918 3.151 3.559 0.00 0.00 -0.209 N +ATOM 4 C UNL A 1 1.363 4.160 2.801 0.00 0.00 -0.036 A +ATOM 5 C UNL A 1 0.486 5.175 3.204 0.00 0.00 -0.024 C +ATOM 6 C UNL A 1 0.066 6.100 2.228 0.00 0.00 -0.137 C +ATOM 7 CL UNL A 1 -1.030 7.392 2.668 0.00 0.00 -0.127 Cl +ATOM 8 C UNL A 1 0.524 5.993 0.895 0.00 0.00 -0.058 C +ATOM 9 C UNL A 1 1.409 4.958 0.524 0.00 0.00 +0.184 C +ATOM 10 C UNL A 1 1.811 4.049 1.512 0.00 0.00 -0.063 A +ATOM 11 H UNL A 1 1.786 2.973 4.544 0.00 0.00 +0.314 HD +ENDROOT +BRANCH 2 12 +ATOM 12 C UNL A 1 3.527 1.203 3.245 0.00 0.00 +0.933 C +ATOM 13 O UNL A 1 4.251 0.554 2.506 0.00 0.00 -0.818 OA +ATOM 14 OXT UNL A 1 3.401 0.954 4.435 0.00 0.00 -0.818 OA +ENDBRANCH 2 12 +BRANCH 1 15 +ATOM 15 C UNL A 1 3.457 2.377 0.254 0.00 0.00 +0.111 C +BRANCH 15 16 +ATOM 16 C UNL A 1 4.903 2.931 0.192 0.00 0.00 -0.017 C +BRANCH 16 17 +ATOM 17 C UNL A 1 5.953 1.822 -0.017 0.00 0.00 +0.278 C +BRANCH 17 18 +ATOM 18 O UNL A 1 5.673 1.147 -1.260 0.00 0.00 -0.348 OA +BRANCH 18 19 +ATOM 19 C UNL A 1 6.032 -0.168 -1.429 0.00 0.00 +0.143 C +ATOM 20 C UNL A 1 5.689 -1.142 -0.477 0.00 0.00 -0.006 C +ATOM 21 C UNL A 1 6.052 -2.486 -0.675 0.00 0.00 -0.043 C +ATOM 22 C UNL A 1 5.675 -3.520 0.377 0.00 0.00 +0.085 C +ATOM 23 C UNL A 1 6.753 -2.852 -1.846 0.00 0.00 -0.030 C +ATOM 24 C UNL A 1 7.082 -1.877 -2.813 0.00 0.00 -0.043 C +ATOM 25 CL UNL A 1 7.209 -4.530 -2.106 0.00 0.00 -0.138 Cl +ATOM 26 C UNL A 1 6.711 -0.537 -2.596 0.00 0.00 -0.006 C +ATOM 27 C UNL A 1 7.827 -2.253 -4.086 0.00 0.00 +0.085 C +ENDBRANCH 18 19 +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 1 15 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_56.mol2 b/compounds/MCL1_ligands/lig_56.mol2 new file mode 100644 index 0000000..2b95126 --- /dev/null +++ b/compounds/MCL1_ligands/lig_56.mol2 @@ -0,0 +1,107 @@ +@MOLECULE +lig_56.pdbqt +47 49 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 2.7927 3.0140 0.8151 C.ar 1 UNL1 -0.1972 + 2 C 2.8291 4.2119 1.6441 C.ar 1 UNL1 0.0663 + 3 N 2.9753 3.8453 3.0007 N.ar 1 UNL1 -0.0974 + 4 C 3.0131 4.7327 4.1729 C.3 1 UNL1 0.0156 + 5 C 3.0723 2.4579 3.0309 C.ar 1 UNL1 -0.0463 + 6 C 3.2748 1.6215 4.1421 C.2 1 UNL1 -0.1410 + 7 C 3.3668 0.2317 3.9243 C.2 1 UNL1 -0.1480 + 8 C 3.2628 -0.2966 2.6193 C.2 1 UNL1 -0.1720 + 9 C 3.0615 0.5597 1.5193 C.2 1 UNL1 -0.1070 + 10 C 2.9667 1.9372 1.7584 C.ar 1 UNL1 -0.0690 + 11 C 2.6522 2.9912 -0.6876 C.3 1 UNL1 0.0188 + 12 C 3.9896 3.2723 -1.4094 C.3 1 UNL1 -0.1164 + 13 C 5.0846 2.2327 -1.0946 C.3 1 UNL1 0.1284 + 14 O 4.6912 0.9664 -1.6571 O.2 1 UNL1 -0.3369 + 15 C 5.3982 -0.1917 -1.4302 C.2 1 UNL1 0.1611 + 16 C 4.7043 -1.4056 -1.5003 C.2 1 UNL1 -0.1890 + 17 C 5.3674 -2.6259 -1.2797 C.2 1 UNL1 -0.0348 + 18 C 4.5817 -3.9284 -1.3433 C.3 1 UNL1 -0.0528 + 19 C 6.7507 -2.6211 -0.9992 C.2 1 UNL1 -0.0346 + 20 C 7.4588 -1.4013 -0.9346 C.2 1 UNL1 -0.0348 + 21 CL 7.5952 -4.1401 -0.7318 Cl 1 UNL1 -0.1284 + 22 C 6.7753 -0.1903 -1.1497 C.2 1 UNL1 -0.1890 + 23 C 8.9518 -1.3756 -0.6357 C.3 1 UNL1 -0.0528 + 24 C 2.7418 5.6335 1.1615 C.2 1 UNL1 0.8403 + 25 O 2.6424 5.8723 -0.0317 O.co2 1 UNL1 -0.8118 + 26 O 2.8022 6.5416 1.9776 O.co2 1 UNL1 -0.8118 + 27 HC 3.3660 2.0244 5.1443 H 1 UNL1 0.1180 + 28 HC1 3.5257 -0.4364 4.7653 H 1 UNL1 0.1070 + 29 HC2 3.3450 -1.3675 2.4591 H 1 UNL1 0.1080 + 30 HC3 2.9910 0.1675 0.5099 H 1 UNL1 0.1160 + 31 HC4 2.2714 2.0127 -1.0046 H 1 UNL1 0.0397 + 32 HC5 1.8959 3.7152 -1.0139 H 1 UNL1 0.0397 + 33 HC6 4.3494 4.2674 -1.1200 H 1 UNL1 0.0717 + 34 HC7 3.8179 3.3056 -2.4915 H 1 UNL1 0.0717 + 35 HC8 6.0308 2.5657 -1.5377 H 1 UNL1 0.0637 + 36 HC9 5.2201 2.1469 -0.0082 H 1 UNL1 0.0637 + 37 HC10 3.6411 -1.3860 -1.7160 H 1 UNL1 0.1535 + 38 HC11 7.3175 0.7466 -1.1035 H 1 UNL1 0.1535 + 39 HC12 3.0408 4.1583 5.1035 H 1 UNL1 0.0530 + 40 HC13 2.1185 5.3676 4.1740 H 1 UNL1 0.0530 + 41 HC14 3.9027 5.3717 4.1138 H 1 UNL1 0.0530 + 42 HC15 3.5205 -3.7524 -1.5579 H 1 UNL1 0.0460 + 43 HC16 4.9744 -4.5852 -2.1291 H 1 UNL1 0.0460 + 44 HC17 4.6399 -4.4670 -0.3892 H 1 UNL1 0.0460 + 45 HC18 9.3471 -0.3526 -0.6252 H 1 UNL1 0.0460 + 46 HC19 9.5122 -1.9386 -1.3921 H 1 UNL1 0.0460 + 47 HC20 9.1623 -1.8209 0.3446 H 1 UNL1 0.0460 +@BOND + 1 25 24 ar + 2 11 12 1 + 3 11 1 1 + 4 12 13 1 + 5 24 26 ar + 6 24 2 1 + 7 16 15 2 + 8 16 17 1 + 9 15 14 1 + 10 15 22 1 + 11 17 19 2 + 12 17 18 1 + 13 14 13 1 + 14 19 20 1 + 15 19 21 1 + 16 22 20 2 + 17 20 23 1 + 18 1 2 ar + 19 1 10 ar + 20 2 3 ar + 21 10 9 1 + 22 10 5 ar + 23 3 4 1 + 24 3 5 ar + 25 9 8 2 + 26 5 6 1 + 27 8 7 1 + 28 6 7 2 + 29 27 6 1 + 30 28 7 1 + 31 29 8 1 + 32 30 9 1 + 33 31 11 1 + 34 32 11 1 + 35 33 12 1 + 36 34 12 1 + 37 35 13 1 + 38 36 13 1 + 39 37 16 1 + 40 38 22 1 + 41 39 4 1 + 42 40 4 1 + 43 41 4 1 + 44 42 18 1 + 45 43 18 1 + 46 44 18 1 + 47 45 23 1 + 48 46 23 1 + 49 47 23 1 +@SUBSTRUCTURE + 1 UNL1 1 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_56.pdbqt b/compounds/MCL1_ligands/lig_56.pdbqt new file mode 100644 index 0000000..adf2da2 --- /dev/null +++ b/compounds/MCL1_ligands/lig_56.pdbqt @@ -0,0 +1,55 @@ +REMARK Name = lig_56.pdbqt +REMARK 9 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_11 +REMARK 2 A between atoms: C_2 and C_24 +REMARK 3 A between atoms: N_3 and C_4 +REMARK 4 A between atoms: C_11 and C_12 +REMARK 5 A between atoms: C_12 and C_13 +REMARK 6 A between atoms: C_13 and O_14 +REMARK 7 A between atoms: O_14 and C_15 +REMARK 8 A between atoms: C_17 and C_18 +REMARK 9 A between atoms: C_20 and C_23 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 2.793 3.014 0.815 0.00 0.00 -0.197 A +ATOM 2 C UNL A 1 2.829 4.212 1.644 0.00 0.00 +0.066 A +ATOM 3 N UNL A 1 2.975 3.845 3.001 0.00 0.00 -0.097 N +ATOM 4 C UNL A 1 3.013 4.733 4.173 0.00 0.00 +0.175 C +ATOM 5 C UNL A 1 3.072 2.458 3.031 0.00 0.00 -0.046 A +ATOM 6 C UNL A 1 3.275 1.621 4.142 0.00 0.00 -0.023 C +ATOM 7 C UNL A 1 3.367 0.232 3.924 0.00 0.00 -0.041 C +ATOM 8 C UNL A 1 3.263 -0.297 2.619 0.00 0.00 -0.064 C +ATOM 9 C UNL A 1 3.062 0.560 1.519 0.00 0.00 +0.009 C +ATOM 10 C UNL A 1 2.967 1.937 1.758 0.00 0.00 -0.069 A +ENDROOT +BRANCH 2 11 +ATOM 11 C UNL A 1 2.742 5.633 1.161 0.00 0.00 +0.840 C +ATOM 12 O UNL A 1 2.642 5.872 -0.032 0.00 0.00 -0.812 OA +ATOM 13 O UNL A 1 2.802 6.542 1.978 0.00 0.00 -0.812 OA +ENDBRANCH 2 11 +BRANCH 1 14 +ATOM 14 C UNL A 1 2.652 2.991 -0.688 0.00 0.00 +0.098 C +BRANCH 14 15 +ATOM 15 C UNL A 1 3.990 3.272 -1.409 0.00 0.00 +0.027 C +BRANCH 15 16 +ATOM 16 C UNL A 1 5.085 2.233 -1.095 0.00 0.00 +0.256 C +BRANCH 16 17 +ATOM 17 O UNL A 1 4.691 0.966 -1.657 0.00 0.00 -0.337 OA +BRANCH 17 18 +ATOM 18 C UNL A 1 5.398 -0.192 -1.430 0.00 0.00 +0.161 C +ATOM 19 C UNL A 1 4.704 -1.406 -1.500 0.00 0.00 -0.036 C +ATOM 20 C UNL A 1 5.367 -2.626 -1.280 0.00 0.00 -0.035 C +ATOM 21 C UNL A 1 4.582 -3.928 -1.343 0.00 0.00 +0.085 C +ATOM 22 C UNL A 1 6.751 -2.621 -0.999 0.00 0.00 -0.035 C +ATOM 23 C UNL A 1 7.459 -1.401 -0.935 0.00 0.00 -0.035 C +ATOM 24 CL UNL A 1 7.595 -4.140 -0.732 0.00 0.00 -0.128 Cl +ATOM 25 C UNL A 1 6.775 -0.190 -1.150 0.00 0.00 -0.036 C +ATOM 26 C UNL A 1 8.952 -1.376 -0.636 0.00 0.00 +0.085 C +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 14 15 +ENDBRANCH 1 14 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_58.mol2 b/compounds/MCL1_ligands/lig_58.mol2 new file mode 100644 index 0000000..633654b --- /dev/null +++ b/compounds/MCL1_ligands/lig_58.mol2 @@ -0,0 +1,107 @@ +@MOLECULE +lig_58.pdbqt +47 49 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 2.9449 2.7442 1.4018 C.ar 1 UNL1 -0.1802 + 2 C 3.0302 2.1822 2.7436 C.ar 1 UNL1 0.0603 + 3 N 2.1891 2.9084 3.6160 N.ar 1 UNL1 -0.0934 + 4 C 1.9623 2.6707 5.0499 C.3 1 UNL1 0.0136 + 5 C 1.6004 3.9143 2.8564 C.ar 1 UNL1 -0.0423 + 6 C 0.6999 4.9093 3.2745 C.2 1 UNL1 -0.1350 + 7 C 0.2399 5.8355 2.3184 C.2 1 UNL1 0.0124 + 8 CL -0.8822 7.0912 2.7970 Cl 1 UNL1 -0.1504 + 9 C 0.6772 5.7628 0.9789 C.2 1 UNL1 -0.1670 + 10 C 1.5823 4.7590 0.5801 C.2 1 UNL1 -0.0910 + 11 C 2.0257 3.8453 1.5457 C.ar 1 UNL1 -0.0650 + 12 C 3.7144 2.2473 0.2036 C.3 1 UNL1 -0.0122 + 13 C 5.1525 2.8223 0.1555 C.3 1 UNL1 -0.0994 + 14 C 6.2106 1.7494 -0.1685 C.3 1 UNL1 0.1224 + 15 O 5.8869 1.1397 -1.4352 O.2 1 UNL1 -0.3489 + 16 C 6.1874 -0.1804 -1.6674 C.2 1 UNL1 0.1361 + 17 C 5.8429 -1.1785 -0.7417 C.2 1 UNL1 -0.1795 + 18 C 6.1461 -2.5263 -1.0048 C.2 1 UNL1 -0.0418 + 19 C 5.7695 -3.5864 0.0214 C.3 1 UNL1 -0.0558 + 20 C 6.7892 -2.8711 -2.2142 C.2 1 UNL1 -0.0276 + 21 C 7.1196 -1.8707 -3.1547 C.2 1 UNL1 -0.0418 + 22 CL 7.1716 -4.5532 -2.5555 Cl 1 UNL1 -0.1374 + 23 C 6.8094 -0.5277 -2.8722 C.2 1 UNL1 -0.1795 + 24 C 7.8035 -2.2229 -4.4686 C.3 1 UNL1 -0.0558 + 25 C 3.8790 1.0160 3.1705 C.2 1 UNL1 0.8393 + 26 O 3.8564 0.6644 4.3402 O.co2 1 UNL1 -0.8143 + 27 O 4.5868 0.4365 2.3608 O.co2 1 UNL1 -0.8143 + 28 HC 0.3617 4.9753 4.3017 H 1 UNL1 0.1360 + 29 HC1 0.3150 6.4852 0.2546 H 1 UNL1 0.1260 + 30 HC2 1.9309 4.6923 -0.4455 H 1 UNL1 0.1280 + 31 HC3 3.7280 1.1509 0.1953 H 1 UNL1 0.0612 + 32 HC4 3.1908 2.5264 -0.7183 H 1 UNL1 0.0612 + 33 HC5 5.4060 3.2627 1.1284 H 1 UNL1 0.0382 + 34 HC6 5.2034 3.6353 -0.5791 H 1 UNL1 0.0382 + 35 HC7 6.2220 1.0133 0.6438 H 1 UNL1 0.0757 + 36 HC8 7.2073 2.2037 -0.2140 H 1 UNL1 0.0757 + 37 HC9 5.3306 -0.9066 0.1811 H 1 UNL1 0.1765 + 38 HC10 7.0485 0.2578 -3.5798 H 1 UNL1 0.1765 + 39 HC11 1.2245 3.3685 5.4568 H 1 UNL1 0.0557 + 40 HC12 2.9097 2.7909 5.5896 H 1 UNL1 0.0557 + 41 HC13 1.6015 1.6446 5.1927 H 1 UNL1 0.0557 + 42 HC14 5.2903 -3.1433 0.9040 H 1 UNL1 0.0482 + 43 HC15 5.0680 -4.3138 -0.4049 H 1 UNL1 0.0482 + 44 HC16 6.6568 -4.1302 0.3677 H 1 UNL1 0.0482 + 45 HC17 7.9880 -1.3328 -5.0822 H 1 UNL1 0.0482 + 46 HC18 7.1850 -2.9098 -5.0594 H 1 UNL1 0.0482 + 47 HC19 8.7712 -2.7071 -4.2882 H 1 UNL1 0.0482 +@BOND + 1 12 13 1 + 2 12 1 1 + 3 13 14 1 + 4 10 9 2 + 5 10 11 1 + 6 16 17 2 + 7 16 15 1 + 8 16 23 1 + 9 17 18 1 + 10 15 14 1 + 11 23 21 2 + 12 18 20 2 + 13 18 19 1 + 14 20 21 1 + 15 20 22 1 + 16 21 24 1 + 17 9 7 1 + 18 1 11 ar + 19 1 2 ar + 20 11 5 ar + 21 7 8 1 + 22 7 6 2 + 23 2 3 ar + 24 2 25 1 + 25 5 6 1 + 26 5 3 ar + 27 27 25 ar + 28 3 4 1 + 29 25 26 ar + 30 28 6 1 + 31 29 9 1 + 32 30 10 1 + 33 31 12 1 + 34 32 12 1 + 35 33 13 1 + 36 34 13 1 + 37 35 14 1 + 38 36 14 1 + 39 37 17 1 + 40 38 23 1 + 41 39 4 1 + 42 40 4 1 + 43 41 4 1 + 44 42 19 1 + 45 43 19 1 + 46 44 19 1 + 47 45 24 1 + 48 46 24 1 + 49 47 24 1 +@SUBSTRUCTURE + 1 UNL1 1 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_58.pdbqt b/compounds/MCL1_ligands/lig_58.pdbqt new file mode 100644 index 0000000..6853785 --- /dev/null +++ b/compounds/MCL1_ligands/lig_58.pdbqt @@ -0,0 +1,56 @@ +REMARK Name = lig_58.pdbqt +REMARK 9 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_12 +REMARK 2 A between atoms: C_2 and C_25 +REMARK 3 A between atoms: N_3 and C_4 +REMARK 4 A between atoms: C_12 and C_13 +REMARK 5 A between atoms: C_13 and C_14 +REMARK 6 A between atoms: C_14 and O_15 +REMARK 7 A between atoms: O_15 and C_16 +REMARK 8 A between atoms: C_18 and C_19 +REMARK 9 A between atoms: C_21 and C_24 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 2.945 2.744 1.402 0.00 0.00 -0.180 A +ATOM 2 C UNL A 1 3.030 2.182 2.744 0.00 0.00 +0.060 A +ATOM 3 N UNL A 1 2.189 2.908 3.616 0.00 0.00 -0.093 N +ATOM 4 C UNL A 1 1.962 2.671 5.050 0.00 0.00 +0.181 C +ATOM 5 C UNL A 1 1.600 3.914 2.856 0.00 0.00 -0.042 A +ATOM 6 C UNL A 1 0.700 4.909 3.275 0.00 0.00 +0.001 C +ATOM 7 C UNL A 1 0.240 5.835 2.318 0.00 0.00 +0.012 C +ATOM 8 CL UNL A 1 -0.882 7.091 2.797 0.00 0.00 -0.150 Cl +ATOM 9 C UNL A 1 0.677 5.763 0.979 0.00 0.00 -0.041 C +ATOM 10 C UNL A 1 1.582 4.759 0.580 0.00 0.00 +0.037 C +ATOM 11 C UNL A 1 2.026 3.845 1.546 0.00 0.00 -0.065 A +ENDROOT +BRANCH 2 12 +ATOM 12 C UNL A 1 3.879 1.016 3.171 0.00 0.00 +0.839 C +ATOM 13 O UNL A 1 3.856 0.664 4.340 0.00 0.00 -0.814 OA +ATOM 14 O UNL A 1 4.587 0.436 2.361 0.00 0.00 -0.814 OA +ENDBRANCH 2 12 +BRANCH 1 15 +ATOM 15 C UNL A 1 3.714 2.247 0.204 0.00 0.00 +0.110 C +BRANCH 15 16 +ATOM 16 C UNL A 1 5.152 2.822 0.155 0.00 0.00 -0.023 C +BRANCH 16 17 +ATOM 17 C UNL A 1 6.211 1.749 -0.169 0.00 0.00 +0.274 C +BRANCH 17 18 +ATOM 18 O UNL A 1 5.887 1.140 -1.435 0.00 0.00 -0.349 OA +BRANCH 18 19 +ATOM 19 C UNL A 1 6.187 -0.180 -1.667 0.00 0.00 +0.136 C +ATOM 20 C UNL A 1 5.843 -1.179 -0.742 0.00 0.00 -0.003 C +ATOM 21 C UNL A 1 6.146 -2.526 -1.005 0.00 0.00 -0.042 C +ATOM 22 C UNL A 1 5.769 -3.586 0.021 0.00 0.00 +0.089 C +ATOM 23 C UNL A 1 6.789 -2.871 -2.214 0.00 0.00 -0.028 C +ATOM 24 C UNL A 1 7.120 -1.871 -3.155 0.00 0.00 -0.042 C +ATOM 25 CL UNL A 1 7.172 -4.553 -2.555 0.00 0.00 -0.137 Cl +ATOM 26 C UNL A 1 6.809 -0.528 -2.872 0.00 0.00 -0.003 C +ATOM 27 C UNL A 1 7.803 -2.223 -4.469 0.00 0.00 +0.089 C +ENDBRANCH 18 19 +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 1 15 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_60.mol2 b/compounds/MCL1_ligands/lig_60.mol2 new file mode 100644 index 0000000..78a9ed6 --- /dev/null +++ b/compounds/MCL1_ligands/lig_60.mol2 @@ -0,0 +1,99 @@ +@MOLECULE +lig_60.pdbqt +43 45 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 3.0206 3.3053 -0.3656 C.3 1 UNL1 0.0008 + 2 C 4.2397 3.4608 -1.3073 C.3 1 UNL1 -0.1144 + 3 C 5.2807 2.3343 -1.1496 C.3 1 UNL1 0.1254 + 4 O 4.6947 1.1065 -1.6225 O.2 1 UNL1 -0.3349 + 5 C 5.3003 -0.1169 -1.4545 C.2 1 UNL1 0.1601 + 6 C 4.4797 -1.2498 -1.4186 C.2 1 UNL1 -0.1885 + 7 C 5.0310 -2.5310 -1.2400 C.2 1 UNL1 -0.0343 + 8 C 4.1102 -3.7419 -1.1827 C.3 1 UNL1 -0.0528 + 9 C 6.4300 -2.6698 -1.1113 C.2 1 UNL1 -0.0336 + 10 C 7.2643 -1.5321 -1.1560 C.2 1 UNL1 -0.0343 + 11 CL 7.1340 -4.2671 -0.8953 Cl 1 UNL1 -0.1274 + 12 C 6.6926 -0.2576 -1.3257 C.2 1 UNL1 -0.1885 + 13 C 8.7759 -1.6635 -1.0210 C.3 1 UNL1 -0.0528 + 14 C 3.3935 3.4276 1.0970 C.ar 1 UNL1 -0.1174 + 15 C 3.5651 4.6540 1.7553 C.ar 1 UNL1 -0.0734 + 16 S 3.9751 4.4750 3.4836 S.2 1 UNL1 0.0585 + 17 C 3.9636 2.7212 3.2922 C.ar 1 UNL1 -0.1181 + 18 C 4.2533 1.7914 4.3017 C.2 1 UNL1 -0.0930 + 19 C 3.6434 2.3198 2.0087 C.ar 1 UNL1 -0.0688 + 20 C 4.2217 0.4193 3.9911 C.2 1 UNL1 -0.1540 + 21 C 3.8990 0.0008 2.6854 C.2 1 UNL1 -0.1510 + 22 C 3.6056 0.9509 1.6890 C.2 1 UNL1 -0.1080 + 23 C 3.4515 6.0254 1.1812 C.2 1 UNL1 0.9086 + 24 O 3.2119 6.1927 -0.0040 O.co2 1 UNL1 -0.8138 + 25 O 3.6403 6.9667 1.9342 O.co2 1 UNL1 -0.8138 + 26 HC2 2.2559 4.0449 -0.6291 H 1 UNL1 0.0487 + 27 HC3 2.5399 2.3385 -0.5543 H 1 UNL1 0.0487 + 28 HC4 3.8925 3.4927 -2.3469 H 1 UNL1 0.0742 + 29 HC5 4.7238 4.4254 -1.1123 H 1 UNL1 0.0742 + 30 HC6 5.5757 2.2428 -0.0956 H 1 UNL1 0.0627 + 31 HC7 6.1716 2.5797 -1.7404 H 1 UNL1 0.0627 + 32 HC 3.4069 -1.1204 -1.5176 H 1 UNL1 0.1525 + 33 HC1 7.3310 0.6170 -1.3611 H 1 UNL1 0.1525 + 34 HC8 4.5032 2.1288 5.3031 H 1 UNL1 0.1200 + 35 HC9 4.4485 -0.3161 4.7574 H 1 UNL1 0.1120 + 36 HC10 3.8806 -1.0573 2.4426 H 1 UNL1 0.1120 + 37 HC11 3.3629 0.6242 0.6841 H 1 UNL1 0.1210 + 38 HC12 3.0569 -3.4561 -1.2918 H 1 UNL1 0.0464 + 39 HC13 4.3442 -4.4518 -1.9857 H 1 UNL1 0.0464 + 40 HC14 4.2112 -4.2658 -0.2238 H 1 UNL1 0.0464 + 41 HC15 9.2768 -0.6902 -1.0894 H 1 UNL1 0.0464 + 42 HC16 9.1864 -2.3013 -1.8138 H 1 UNL1 0.0464 + 43 HC17 9.0456 -2.1067 -0.0541 H 1 UNL1 0.0464 +@BOND + 1 24 23 ar + 2 1 2 1 + 3 1 14 1 + 4 2 3 1 + 5 23 25 ar + 6 23 15 1 + 7 6 5 2 + 8 6 7 1 + 9 5 4 1 + 10 5 12 1 + 11 7 9 2 + 12 7 8 1 + 13 4 3 1 + 14 12 10 2 + 15 9 10 1 + 16 9 11 1 + 17 10 13 1 + 18 14 15 ar + 19 14 19 ar + 20 15 16 ar + 21 19 22 1 + 22 19 17 ar + 23 16 17 ar + 24 22 21 2 + 25 17 18 1 + 26 21 20 1 + 27 18 20 2 + 28 26 1 1 + 29 27 1 1 + 30 28 2 1 + 31 29 2 1 + 32 30 3 1 + 33 31 3 1 + 34 32 6 1 + 35 33 12 1 + 36 34 18 1 + 37 35 20 1 + 38 36 21 1 + 39 37 22 1 + 40 38 8 1 + 41 39 8 1 + 42 40 8 1 + 43 41 13 1 + 44 42 13 1 + 45 43 13 1 +@SUBSTRUCTURE + 1 UNL1 1 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_60.pdbqt b/compounds/MCL1_ligands/lig_60.pdbqt new file mode 100644 index 0000000..ba244de --- /dev/null +++ b/compounds/MCL1_ligands/lig_60.pdbqt @@ -0,0 +1,53 @@ +REMARK Name = lig_60.pdbqt +REMARK 8 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_2 +REMARK 2 A between atoms: C_1 and C_14 +REMARK 3 A between atoms: C_2 and C_3 +REMARK 4 A between atoms: C_3 and O_4 +REMARK 5 A between atoms: O_4 and C_5 +REMARK 6 A between atoms: C_7 and C_8 +REMARK 7 A between atoms: C_10 and C_13 +REMARK 8 A between atoms: C_15 and C_23 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 3.021 3.305 -0.366 0.00 0.00 +0.098 C +ENDROOT +BRANCH 1 2 +ATOM 2 C UNL A 1 3.393 3.428 1.097 0.00 0.00 -0.117 A +ATOM 3 C UNL A 1 3.565 4.654 1.755 0.00 0.00 -0.073 A +ATOM 4 S UNL A 1 3.975 4.475 3.484 0.00 0.00 +0.059 S +ATOM 5 C UNL A 1 3.964 2.721 3.292 0.00 0.00 -0.118 A +ATOM 6 C UNL A 1 4.253 1.791 4.302 0.00 0.00 +0.027 C +ATOM 7 C UNL A 1 3.643 2.320 2.009 0.00 0.00 -0.069 A +ATOM 8 C UNL A 1 4.222 0.419 3.991 0.00 0.00 -0.042 C +ATOM 9 C UNL A 1 3.899 0.001 2.685 0.00 0.00 -0.039 C +ATOM 10 C UNL A 1 3.606 0.951 1.689 0.00 0.00 +0.013 C +BRANCH 3 11 +ATOM 11 C UNL A 1 3.451 6.025 1.181 0.00 0.00 +0.909 C +ATOM 12 O UNL A 1 3.212 6.193 -0.004 0.00 0.00 -0.814 OA +ATOM 13 O UNL A 1 3.640 6.967 1.934 0.00 0.00 -0.814 OA +ENDBRANCH 3 11 +ENDBRANCH 1 2 +BRANCH 1 14 +ATOM 14 C UNL A 1 4.240 3.461 -1.307 0.00 0.00 +0.034 C +BRANCH 14 15 +ATOM 15 C UNL A 1 5.281 2.334 -1.150 0.00 0.00 +0.251 C +BRANCH 15 16 +ATOM 16 O UNL A 1 4.695 1.107 -1.623 0.00 0.00 -0.335 OA +BRANCH 16 17 +ATOM 17 C UNL A 1 5.300 -0.117 -1.454 0.00 0.00 +0.160 C +ATOM 18 C UNL A 1 4.480 -1.250 -1.419 0.00 0.00 -0.036 C +ATOM 19 C UNL A 1 5.031 -2.531 -1.240 0.00 0.00 -0.034 C +ATOM 20 C UNL A 1 4.110 -3.742 -1.183 0.00 0.00 +0.086 C +ATOM 21 C UNL A 1 6.430 -2.670 -1.111 0.00 0.00 -0.034 C +ATOM 22 C UNL A 1 7.264 -1.532 -1.156 0.00 0.00 -0.034 C +ATOM 23 CL UNL A 1 7.134 -4.267 -0.895 0.00 0.00 -0.127 Cl +ATOM 24 C UNL A 1 6.693 -0.258 -1.326 0.00 0.00 -0.036 C +ATOM 25 C UNL A 1 8.776 -1.663 -1.021 0.00 0.00 +0.086 C +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 14 15 +ENDBRANCH 1 14 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_61.mol2 b/compounds/MCL1_ligands/lig_61.mol2 new file mode 100644 index 0000000..2d28ef2 --- /dev/null +++ b/compounds/MCL1_ligands/lig_61.mol2 @@ -0,0 +1,99 @@ +@MOLECULE +lig_61.pdbqt +43 45 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 2.7419 2.9932 1.5279 C.ar 1 UNL1 -0.1212 + 2 C 2.8685 2.5253 2.8449 C.ar 1 UNL1 -0.3282 + 3 S 1.7823 3.3151 3.9987 S.2 1 UNL1 0.2481 + 4 C 1.1976 4.3555 2.7013 C.ar 1 UNL1 -0.0671 + 5 C 0.2470 5.3707 2.8857 C.2 1 UNL1 -0.0920 + 6 C -0.1208 6.1671 1.7910 C.2 1 UNL1 -0.1500 + 7 C 0.4787 5.9455 0.5389 C.2 1 UNL1 -0.1460 + 8 C 1.4341 4.9252 0.3647 C.2 1 UNL1 0.0494 + 9 CL 2.1402 4.8018 -1.2359 Cl 1 UNL1 -0.1184 + 10 C 1.7849 4.1046 1.4675 C.ar 1 UNL1 -0.0270 + 11 C 3.5007 2.3461 0.3894 C.3 1 UNL1 -0.0172 + 12 C 4.9050 2.9700 0.1910 C.3 1 UNL1 -0.0984 + 13 C 5.9828 1.9095 -0.1044 C.3 1 UNL1 0.1074 + 14 O 5.6129 1.1818 -1.2940 O.2 1 UNL1 -0.3519 + 15 C 5.9580 -0.1398 -1.4360 C.2 1 UNL1 0.1361 + 16 C 5.7130 -1.0693 -0.4125 C.2 1 UNL1 -0.1785 + 17 C 6.0600 -2.4215 -0.5837 C.2 1 UNL1 -0.0398 + 18 C 5.7911 -3.4065 0.5457 C.3 1 UNL1 -0.0613 + 19 C 6.6460 -2.8405 -1.7987 C.2 1 UNL1 -0.0276 + 20 C 6.8754 -1.9102 -2.8363 C.2 1 UNL1 -0.0398 + 21 CL 7.0829 -4.5287 -2.0254 Cl 1 UNL1 -0.1394 + 22 C 6.5228 -0.5618 -2.6450 C.2 1 UNL1 -0.1785 + 23 C 7.4947 -2.3437 -4.1578 C.3 1 UNL1 -0.0613 + 24 C 3.7665 1.4740 3.3900 C.2 1 UNL1 0.9218 + 25 O 3.6603 1.2360 4.5807 O.co2 1 UNL1 -0.8088 + 26 O 4.5872 0.9080 2.6885 O.co2 1 UNL1 -0.8088 + 27 HC -0.1911 5.5396 3.8648 H 1 UNL1 0.1250 + 28 HC1 -0.8531 6.9598 1.9136 H 1 UNL1 0.1190 + 29 HC2 0.2105 6.5734 -0.3052 H 1 UNL1 0.1280 + 30 HC3 2.9373 2.3926 -0.5459 H 1 UNL1 0.0597 + 31 HC4 3.5815 1.2680 0.5642 H 1 UNL1 0.0597 + 32 HC5 5.1990 3.5007 1.1056 H 1 UNL1 0.0432 + 33 HC6 4.8767 3.7162 -0.6118 H 1 UNL1 0.0432 + 34 HC7 6.9577 2.3905 -0.2446 H 1 UNL1 0.0842 + 35 HC8 6.0641 1.2478 0.7663 H 1 UNL1 0.0842 + 36 HC9 5.2427 -0.7399 0.5139 H 1 UNL1 0.1730 + 37 HC10 6.6835 0.1711 -3.4275 H 1 UNL1 0.1730 + 38 HC11 5.3441 -2.9110 1.4172 H 1 UNL1 0.0507 + 39 HC12 6.7204 -3.8837 0.8796 H 1 UNL1 0.0507 + 40 HC13 5.0996 -4.1942 0.2229 H 1 UNL1 0.0507 + 41 HC14 7.6020 -1.5014 -4.8519 H 1 UNL1 0.0507 + 42 HC15 8.4920 -2.7723 -4.0000 H 1 UNL1 0.0507 + 43 HC16 6.8732 -3.1015 -4.6505 H 1 UNL1 0.0507 +@BOND + 1 9 8 1 + 2 12 11 1 + 3 12 13 1 + 4 11 1 1 + 5 8 7 2 + 6 8 10 1 + 7 15 16 2 + 8 15 14 1 + 9 15 22 1 + 10 16 17 1 + 11 14 13 1 + 12 17 19 2 + 13 17 18 1 + 14 22 20 2 + 15 19 20 1 + 16 19 21 1 + 17 20 23 1 + 18 7 6 1 + 19 1 10 ar + 20 1 2 ar + 21 10 4 ar + 22 6 5 2 + 23 4 5 1 + 24 4 3 ar + 25 2 24 1 + 26 2 3 ar + 27 26 24 ar + 28 24 25 ar + 29 27 5 1 + 30 28 6 1 + 31 29 7 1 + 32 30 11 1 + 33 31 11 1 + 34 32 12 1 + 35 33 12 1 + 36 34 13 1 + 37 35 13 1 + 38 36 16 1 + 39 37 22 1 + 40 38 18 1 + 41 39 18 1 + 42 40 18 1 + 43 41 23 1 + 44 42 23 1 + 45 43 23 1 +@SUBSTRUCTURE + 1 UNL1 1 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_61.pdbqt b/compounds/MCL1_ligands/lig_61.pdbqt new file mode 100644 index 0000000..a232dbc --- /dev/null +++ b/compounds/MCL1_ligands/lig_61.pdbqt @@ -0,0 +1,54 @@ +REMARK Name = lig_61.pdbqt +REMARK 8 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_11 +REMARK 2 A between atoms: C_2 and C_24 +REMARK 3 A between atoms: C_11 and C_12 +REMARK 4 A between atoms: C_12 and C_13 +REMARK 5 A between atoms: C_13 and O_14 +REMARK 6 A between atoms: O_14 and C_15 +REMARK 7 A between atoms: C_17 and C_18 +REMARK 8 A between atoms: C_20 and C_23 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 2.742 2.993 1.528 0.00 0.00 -0.121 A +ATOM 2 C UNL A 1 2.869 2.525 2.845 0.00 0.00 -0.328 A +ATOM 3 S UNL A 1 1.782 3.315 3.999 0.00 0.00 +0.248 S +ATOM 4 C UNL A 1 1.198 4.356 2.701 0.00 0.00 -0.067 A +ATOM 5 C UNL A 1 0.247 5.371 2.886 0.00 0.00 +0.033 C +ATOM 6 C UNL A 1 -0.121 6.167 1.791 0.00 0.00 -0.031 C +ATOM 7 C UNL A 1 0.479 5.946 0.539 0.00 0.00 -0.018 C +ATOM 8 C UNL A 1 1.434 4.925 0.365 0.00 0.00 +0.049 C +ATOM 9 CL UNL A 1 2.140 4.802 -1.236 0.00 0.00 -0.118 Cl +ATOM 10 C UNL A 1 1.785 4.105 1.468 0.00 0.00 -0.027 A +ENDROOT +BRANCH 2 11 +ATOM 11 C UNL A 1 3.767 1.474 3.390 0.00 0.00 +0.922 C +ATOM 12 O UNL A 1 3.660 1.236 4.581 0.00 0.00 -0.809 OA +ATOM 13 O UNL A 1 4.587 0.908 2.688 0.00 0.00 -0.809 OA +ENDBRANCH 2 11 +BRANCH 1 14 +ATOM 14 C UNL A 1 3.501 2.346 0.389 0.00 0.00 +0.102 C +BRANCH 14 15 +ATOM 15 C UNL A 1 4.905 2.970 0.191 0.00 0.00 -0.012 C +BRANCH 15 16 +ATOM 16 C UNL A 1 5.983 1.909 -0.104 0.00 0.00 +0.276 C +BRANCH 16 17 +ATOM 17 O UNL A 1 5.613 1.182 -1.294 0.00 0.00 -0.352 OA +BRANCH 17 18 +ATOM 18 C UNL A 1 5.958 -0.140 -1.436 0.00 0.00 +0.136 C +ATOM 19 C UNL A 1 5.713 -1.069 -0.412 0.00 0.00 -0.006 C +ATOM 20 C UNL A 1 6.060 -2.421 -0.584 0.00 0.00 -0.040 C +ATOM 21 C UNL A 1 5.791 -3.406 0.546 0.00 0.00 +0.091 C +ATOM 22 C UNL A 1 6.646 -2.841 -1.799 0.00 0.00 -0.028 C +ATOM 23 C UNL A 1 6.875 -1.910 -2.836 0.00 0.00 -0.040 C +ATOM 24 CL UNL A 1 7.083 -4.529 -2.025 0.00 0.00 -0.139 Cl +ATOM 25 C UNL A 1 6.523 -0.562 -2.645 0.00 0.00 -0.006 C +ATOM 26 C UNL A 1 7.495 -2.344 -4.158 0.00 0.00 +0.091 C +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 14 15 +ENDBRANCH 1 14 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_63.mol2 b/compounds/MCL1_ligands/lig_63.mol2 new file mode 100644 index 0000000..aa586b5 --- /dev/null +++ b/compounds/MCL1_ligands/lig_63.mol2 @@ -0,0 +1,99 @@ +@MOLECULE +lig_63.pdbqt +43 45 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 3.1500 3.3403 2.2251 C.ar 1 UNL1 -0.1212 + 2 C 3.7129 3.7643 3.4347 C.ar 1 UNL1 -0.3282 + 3 S 2.8547 5.1262 4.1884 S.2 1 UNL1 0.2481 + 4 C 1.7390 5.1535 2.8184 C.ar 1 UNL1 -0.0671 + 5 C 0.6774 6.0561 2.6465 C.2 1 UNL1 -0.0920 + 6 C -0.1159 5.9583 1.4892 C.2 1 UNL1 -0.1500 + 7 CL -1.4455 7.0700 1.2442 Cl 1 UNL1 -0.1184 + 8 C 0.1607 4.9713 0.5244 C.2 1 UNL1 -0.1460 + 9 C 1.2305 4.0755 0.7150 C.2 1 UNL1 0.0494 + 10 C 2.0128 4.1766 1.8780 C.ar 1 UNL1 -0.0270 + 11 C 3.6909 2.1795 1.4241 C.3 1 UNL1 -0.0172 + 12 C 4.9059 2.5959 0.5651 C.3 1 UNL1 -0.0984 + 13 C 5.7209 1.3819 0.0844 C.3 1 UNL1 0.1074 + 14 O 4.9142 0.6169 -0.8312 O.2 1 UNL1 -0.3519 + 15 C 5.4133 -0.5420 -1.3651 C.2 1 UNL1 0.1361 + 16 C 4.7846 -1.7553 -1.0654 C.2 1 UNL1 -0.1785 + 17 C 5.2726 -2.9609 -1.6014 C.2 1 UNL1 -0.0398 + 18 C 4.5817 -4.2717 -1.2511 C.3 1 UNL1 -0.0613 + 19 C 6.3993 -2.9345 -2.4527 C.2 1 UNL1 -0.0276 + 20 C 7.0309 -1.7095 -2.7619 C.2 1 UNL1 -0.0398 + 21 CL 7.0178 -4.4337 -3.1321 Cl 1 UNL1 -0.1394 + 22 C 6.5292 -0.5154 -2.2125 C.2 1 UNL1 -0.1785 + 23 C 8.2451 -1.6609 -3.6794 C.3 1 UNL1 -0.0613 + 24 C 4.9080 3.2331 4.1343 C.2 1 UNL1 0.9218 + 25 O 5.2028 3.7690 5.1882 O.co2 1 UNL1 -0.8088 + 26 O 5.5633 2.3246 3.6536 O.co2 1 UNL1 -0.8088 + 27 HC 0.4742 6.8177 3.3932 H 1 UNL1 0.1250 + 28 HC1 -0.4512 4.9024 -0.3695 H 1 UNL1 0.1190 + 29 HC2 1.4487 3.3196 -0.0314 H 1 UNL1 0.1280 + 30 HC3 2.9155 1.7620 0.7725 H 1 UNL1 0.0597 + 31 HC4 3.9639 1.3572 2.0965 H 1 UNL1 0.0597 + 32 HC5 5.5683 3.2362 1.1612 H 1 UNL1 0.0432 + 33 HC6 4.5741 3.1967 -0.2906 H 1 UNL1 0.0432 + 34 HC7 6.6360 1.7321 -0.4078 H 1 UNL1 0.0842 + 35 HC8 6.0091 0.7722 0.9524 H 1 UNL1 0.0842 + 36 HC9 3.9237 -1.7480 -0.4046 H 1 UNL1 0.1730 + 37 HC10 6.9949 0.4360 -2.4442 H 1 UNL1 0.1730 + 38 HC11 3.7297 -4.1150 -0.5782 H 1 UNL1 0.0507 + 39 HC12 5.2759 -4.9573 -0.7496 H 1 UNL1 0.0507 + 40 HC13 4.2046 -4.7694 -2.1530 H 1 UNL1 0.0507 + 41 HC14 8.6104 -0.6359 -3.8167 H 1 UNL1 0.0507 + 42 HC15 9.0710 -2.2530 -3.2662 H 1 UNL1 0.0507 + 43 HC16 8.0029 -2.0619 -4.6714 H 1 UNL1 0.0507 +@BOND + 1 12 11 1 + 2 12 13 1 + 3 11 1 1 + 4 9 8 2 + 5 9 10 1 + 6 15 16 2 + 7 15 14 1 + 8 15 22 1 + 9 16 17 1 + 10 14 13 1 + 11 17 19 2 + 12 17 18 1 + 13 22 20 2 + 14 19 20 1 + 15 19 21 1 + 16 8 6 1 + 17 20 23 1 + 18 1 10 ar + 19 1 2 ar + 20 10 4 ar + 21 6 7 1 + 22 6 5 2 + 23 2 24 1 + 24 2 3 ar + 25 4 5 1 + 26 4 3 ar + 27 26 24 ar + 28 24 25 ar + 29 27 5 1 + 30 28 8 1 + 31 29 9 1 + 32 30 11 1 + 33 31 11 1 + 34 32 12 1 + 35 33 12 1 + 36 34 13 1 + 37 35 13 1 + 38 36 16 1 + 39 37 22 1 + 40 38 18 1 + 41 39 18 1 + 42 40 18 1 + 43 41 23 1 + 44 42 23 1 + 45 43 23 1 +@SUBSTRUCTURE + 1 UNL1 1 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_63.pdbqt b/compounds/MCL1_ligands/lig_63.pdbqt new file mode 100644 index 0000000..7b6f965 --- /dev/null +++ b/compounds/MCL1_ligands/lig_63.pdbqt @@ -0,0 +1,54 @@ +REMARK Name = lig_63.pdbqt +REMARK 8 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_11 +REMARK 2 A between atoms: C_2 and C_24 +REMARK 3 A between atoms: C_11 and C_12 +REMARK 4 A between atoms: C_12 and C_13 +REMARK 5 A between atoms: C_13 and O_14 +REMARK 6 A between atoms: O_14 and C_15 +REMARK 7 A between atoms: C_17 and C_18 +REMARK 8 A between atoms: C_20 and C_23 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 3.150 3.340 2.225 0.00 0.00 -0.121 A +ATOM 2 C UNL A 1 3.713 3.764 3.435 0.00 0.00 -0.328 A +ATOM 3 S UNL A 1 2.855 5.126 4.188 0.00 0.00 +0.248 S +ATOM 4 C UNL A 1 1.739 5.154 2.818 0.00 0.00 -0.067 A +ATOM 5 C UNL A 1 0.677 6.056 2.647 0.00 0.00 +0.033 C +ATOM 6 C UNL A 1 -0.116 5.958 1.489 0.00 0.00 -0.150 C +ATOM 7 CL UNL A 1 -1.446 7.070 1.244 0.00 0.00 -0.118 Cl +ATOM 8 C UNL A 1 0.161 4.971 0.524 0.00 0.00 -0.027 C +ATOM 9 C UNL A 1 1.230 4.075 0.715 0.00 0.00 +0.177 C +ATOM 10 C UNL A 1 2.013 4.177 1.878 0.00 0.00 -0.027 A +ENDROOT +BRANCH 2 11 +ATOM 11 C UNL A 1 4.908 3.233 4.134 0.00 0.00 +0.922 C +ATOM 12 O UNL A 1 5.203 3.769 5.188 0.00 0.00 -0.809 OA +ATOM 13 O UNL A 1 5.563 2.325 3.654 0.00 0.00 -0.809 OA +ENDBRANCH 2 11 +BRANCH 1 14 +ATOM 14 C UNL A 1 3.691 2.179 1.424 0.00 0.00 +0.102 C +BRANCH 14 15 +ATOM 15 C UNL A 1 4.906 2.596 0.565 0.00 0.00 -0.012 C +BRANCH 15 16 +ATOM 16 C UNL A 1 5.721 1.382 0.084 0.00 0.00 +0.276 C +BRANCH 16 17 +ATOM 17 O UNL A 1 4.914 0.617 -0.831 0.00 0.00 -0.352 OA +BRANCH 17 18 +ATOM 18 C UNL A 1 5.413 -0.542 -1.365 0.00 0.00 +0.136 C +ATOM 19 C UNL A 1 4.785 -1.755 -1.065 0.00 0.00 -0.006 C +ATOM 20 C UNL A 1 5.273 -2.961 -1.601 0.00 0.00 -0.040 C +ATOM 21 C UNL A 1 4.582 -4.272 -1.251 0.00 0.00 +0.091 C +ATOM 22 C UNL A 1 6.399 -2.934 -2.453 0.00 0.00 -0.028 C +ATOM 23 C UNL A 1 7.031 -1.710 -2.762 0.00 0.00 -0.040 C +ATOM 24 CL UNL A 1 7.018 -4.434 -3.132 0.00 0.00 -0.139 Cl +ATOM 25 C UNL A 1 6.529 -0.515 -2.212 0.00 0.00 -0.006 C +ATOM 26 C UNL A 1 8.245 -1.661 -3.679 0.00 0.00 +0.091 C +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 14 15 +ENDBRANCH 1 14 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_65.mol2 b/compounds/MCL1_ligands/lig_65.mol2 new file mode 100644 index 0000000..3a6a168 --- /dev/null +++ b/compounds/MCL1_ligands/lig_65.mol2 @@ -0,0 +1,99 @@ +@MOLECULE +lig_65.pdbqt +43 45 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 3.2274 3.3494 2.2580 C.ar 1 UNL1 -0.1212 + 2 C 3.8287 3.8422 3.4219 C.ar 1 UNL1 -0.3282 + 3 S 2.9472 5.1958 4.1655 S.2 1 UNL1 0.2481 + 4 C 1.7663 5.1274 2.8491 C.ar 1 UNL1 -0.0671 + 5 C 0.6583 5.9772 2.6845 C.2 1 UNL1 -0.0920 + 6 CL 0.3084 7.2469 3.8395 Cl 1 UNL1 -0.1184 + 7 C -0.1767 5.8012 1.5669 C.2 1 UNL1 -0.1500 + 8 C 0.1041 4.7876 0.6299 C.2 1 UNL1 -0.1460 + 9 C 1.2188 3.9465 0.8104 C.2 1 UNL1 0.0494 + 10 C 2.0418 4.1257 1.9346 C.ar 1 UNL1 -0.0270 + 11 C 3.7783 2.1818 1.4736 C.3 1 UNL1 -0.0172 + 12 C 4.9262 2.6177 0.5359 C.3 1 UNL1 -0.0984 + 13 C 5.7518 1.4211 0.0306 C.3 1 UNL1 0.1074 + 14 O 4.9218 0.6185 -0.8319 O.2 1 UNL1 -0.3519 + 15 C 5.4076 -0.5419 -1.3789 C.2 1 UNL1 0.1361 + 16 C 4.6800 -1.7243 -1.2045 C.2 1 UNL1 -0.1785 + 17 C 5.1403 -2.9335 -1.7568 C.2 1 UNL1 -0.0398 + 18 C 4.3393 -4.2102 -1.5406 C.3 1 UNL1 -0.0613 + 19 C 6.3412 -2.9428 -2.4999 C.2 1 UNL1 -0.0276 + 20 C 7.0732 -1.7492 -2.6855 C.2 1 UNL1 -0.0398 + 21 CL 6.9261 -4.4462 -3.1996 Cl 1 UNL1 -0.1394 + 22 C 6.5975 -0.5513 -2.1213 C.2 1 UNL1 -0.1785 + 23 C 8.3679 -1.7385 -3.4869 C.3 1 UNL1 -0.0613 + 24 C 5.0786 3.3867 4.0795 C.2 1 UNL1 0.9218 + 25 O 5.4031 3.9697 5.0989 O.co2 1 UNL1 -0.8088 + 26 O 5.7485 2.4892 3.5972 O.co2 1 UNL1 -0.8088 + 27 HC -1.0339 6.4534 1.4270 H 1 UNL1 0.1250 + 28 HC1 -0.5378 4.6562 -0.2356 H 1 UNL1 0.1190 + 29 HC2 1.4417 3.1725 0.0842 H 1 UNL1 0.1280 + 30 HC3 4.1244 1.3997 2.1599 H 1 UNL1 0.0597 + 31 HC4 2.9897 1.7040 0.8821 H 1 UNL1 0.0597 + 32 HC5 5.6006 3.2925 1.0785 H 1 UNL1 0.0432 + 33 HC6 4.5241 3.1881 -0.3102 H 1 UNL1 0.0432 + 34 HC7 6.6281 1.7944 -0.5119 H 1 UNL1 0.0842 + 35 HC8 6.1029 0.8337 0.8908 H 1 UNL1 0.0842 + 36 HC9 3.7626 -1.6914 -0.6262 H 1 UNL1 0.1730 + 37 HC10 7.1423 0.3747 -2.2652 H 1 UNL1 0.1730 + 38 HC11 3.4398 -4.0291 -0.9396 H 1 UNL1 0.0507 + 39 HC12 4.0175 -4.6380 -2.4981 H 1 UNL1 0.0507 + 40 HC13 4.9397 -4.9641 -1.0165 H 1 UNL1 0.0507 + 41 HC14 8.8080 -0.7350 -3.5361 H 1 UNL1 0.0507 + 42 HC15 9.1134 -2.4039 -3.0341 H 1 UNL1 0.0507 + 43 HC16 8.1940 -2.0746 -4.5166 H 1 UNL1 0.0507 +@BOND + 1 12 11 1 + 2 12 13 1 + 3 11 1 1 + 4 9 8 2 + 5 9 10 1 + 6 15 16 2 + 7 15 14 1 + 8 15 22 1 + 9 16 17 1 + 10 14 13 1 + 11 17 19 2 + 12 17 18 1 + 13 22 20 2 + 14 19 20 1 + 15 19 21 1 + 16 8 7 1 + 17 20 23 1 + 18 1 10 ar + 19 1 2 ar + 20 10 4 ar + 21 7 5 2 + 22 2 24 1 + 23 2 3 ar + 24 4 5 1 + 25 4 3 ar + 26 26 24 ar + 27 5 6 1 + 28 24 25 ar + 29 27 7 1 + 30 28 8 1 + 31 29 9 1 + 32 30 11 1 + 33 31 11 1 + 34 32 12 1 + 35 33 12 1 + 36 34 13 1 + 37 35 13 1 + 38 36 16 1 + 39 37 22 1 + 40 38 18 1 + 41 39 18 1 + 42 40 18 1 + 43 41 23 1 + 44 42 23 1 + 45 43 23 1 +@SUBSTRUCTURE + 1 UNL1 1 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_65.pdbqt b/compounds/MCL1_ligands/lig_65.pdbqt new file mode 100644 index 0000000..c00ebc5 --- /dev/null +++ b/compounds/MCL1_ligands/lig_65.pdbqt @@ -0,0 +1,54 @@ +REMARK Name = lig_65.pdbqt +REMARK 8 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_11 +REMARK 2 A between atoms: C_2 and C_24 +REMARK 3 A between atoms: C_11 and C_12 +REMARK 4 A between atoms: C_12 and C_13 +REMARK 5 A between atoms: C_13 and O_14 +REMARK 6 A between atoms: O_14 and C_15 +REMARK 7 A between atoms: C_17 and C_18 +REMARK 8 A between atoms: C_20 and C_23 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 3.227 3.349 2.258 0.00 0.00 -0.121 A +ATOM 2 C UNL A 1 3.829 3.842 3.422 0.00 0.00 -0.328 A +ATOM 3 S UNL A 1 2.947 5.196 4.165 0.00 0.00 +0.248 S +ATOM 4 C UNL A 1 1.766 5.127 2.849 0.00 0.00 -0.067 A +ATOM 5 C UNL A 1 0.658 5.977 2.684 0.00 0.00 -0.092 C +ATOM 6 CL UNL A 1 0.308 7.247 3.840 0.00 0.00 -0.118 Cl +ATOM 7 C UNL A 1 -0.177 5.801 1.567 0.00 0.00 -0.025 C +ATOM 8 C UNL A 1 0.104 4.788 0.630 0.00 0.00 -0.027 C +ATOM 9 C UNL A 1 1.219 3.946 0.810 0.00 0.00 +0.177 C +ATOM 10 C UNL A 1 2.042 4.126 1.935 0.00 0.00 -0.027 A +ENDROOT +BRANCH 2 11 +ATOM 11 C UNL A 1 5.079 3.387 4.080 0.00 0.00 +0.922 C +ATOM 12 O UNL A 1 5.403 3.970 5.099 0.00 0.00 -0.809 OA +ATOM 13 O UNL A 1 5.748 2.489 3.597 0.00 0.00 -0.809 OA +ENDBRANCH 2 11 +BRANCH 1 14 +ATOM 14 C UNL A 1 3.778 2.182 1.474 0.00 0.00 +0.102 C +BRANCH 14 15 +ATOM 15 C UNL A 1 4.926 2.618 0.536 0.00 0.00 -0.012 C +BRANCH 15 16 +ATOM 16 C UNL A 1 5.752 1.421 0.031 0.00 0.00 +0.276 C +BRANCH 16 17 +ATOM 17 O UNL A 1 4.922 0.619 -0.832 0.00 0.00 -0.352 OA +BRANCH 17 18 +ATOM 18 C UNL A 1 5.408 -0.542 -1.379 0.00 0.00 +0.136 C +ATOM 19 C UNL A 1 4.680 -1.724 -1.204 0.00 0.00 -0.006 C +ATOM 20 C UNL A 1 5.140 -2.933 -1.757 0.00 0.00 -0.040 C +ATOM 21 C UNL A 1 4.339 -4.210 -1.541 0.00 0.00 +0.091 C +ATOM 22 C UNL A 1 6.341 -2.943 -2.500 0.00 0.00 -0.028 C +ATOM 23 C UNL A 1 7.073 -1.749 -2.686 0.00 0.00 -0.040 C +ATOM 24 CL UNL A 1 6.926 -4.446 -3.200 0.00 0.00 -0.139 Cl +ATOM 25 C UNL A 1 6.598 -0.551 -2.121 0.00 0.00 -0.006 C +ATOM 26 C UNL A 1 8.368 -1.738 -3.487 0.00 0.00 +0.091 C +ENDBRANCH 17 18 +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 14 15 +ENDBRANCH 1 14 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/lig_67.mol2 b/compounds/MCL1_ligands/lig_67.mol2 new file mode 100644 index 0000000..07c0c5e --- /dev/null +++ b/compounds/MCL1_ligands/lig_67.mol2 @@ -0,0 +1,99 @@ +@MOLECULE +lig_67.pdbqt +43 45 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C 3.3059 2.4042 0.1068 C.3 1 UNL1 0.0028 + 2 C 4.7285 2.9954 -0.0595 C.3 1 UNL1 -0.1014 + 3 C 5.8145 1.9070 -0.1676 C.3 1 UNL1 0.1084 + 4 O 5.5633 1.1162 -1.3471 O.2 1 UNL1 -0.3529 + 5 C 5.9930 -0.1862 -1.4116 C.2 1 UNL1 0.1351 + 6 C 5.7045 -1.0957 -0.3822 C.2 1 UNL1 -0.1795 + 7 C 6.1388 -2.4302 -0.4710 C.2 1 UNL1 -0.0398 + 8 C 5.8179 -3.3926 0.6645 C.3 1 UNL1 -0.0613 + 9 C 6.8581 -2.8527 -1.6108 C.2 1 UNL1 -0.0266 + 10 C 7.1333 -1.9434 -2.6560 C.2 1 UNL1 -0.0398 + 11 CL 7.4048 -4.5194 -1.7347 Cl 1 UNL1 -0.1374 + 12 C 6.6916 -0.6120 -2.5472 C.2 1 UNL1 -0.1795 + 13 C 7.8968 -2.3821 -3.8979 C.3 1 UNL1 -0.0613 + 14 C 2.5847 2.9864 1.2953 C.ar 1 UNL1 -0.2122 + 15 C 2.7037 2.5055 2.6627 C.ar 1 UNL1 0.0088 + 16 O 1.9345 3.2600 3.5287 O.2 1 UNL1 0.0588 + 17 C 1.3286 4.2224 2.7599 C.ar 1 UNL1 -0.1548 + 18 C 0.4563 5.2294 3.1940 C.2 1 UNL1 -0.1230 + 19 C 1.6827 4.1031 1.4315 C.ar 1 UNL1 -0.0580 + 20 C -0.0554 6.1260 2.2336 C.2 1 UNL1 -0.1470 + 21 C 0.3093 6.0039 0.8737 C.2 1 UNL1 -0.1600 + 22 C 1.1893 4.9828 0.4601 C.2 1 UNL1 -0.1080 + 23 C 3.5099 1.3784 3.2059 C.2 1 UNL1 0.9358 + 24 O 4.2052 0.7018 2.4621 O.co2 1 UNL1 -0.7973 + 25 O 3.4599 1.1688 4.4080 O.co2 1 UNL1 -0.7973 + 26 HC2 2.7306 2.6036 -0.8054 H 1 UNL1 0.0477 + 27 HC3 3.3424 1.3108 0.1882 H 1 UNL1 0.0477 + 28 HC4 4.7602 3.6413 -0.9455 H 1 UNL1 0.0407 + 29 HC5 4.9661 3.6341 0.8009 H 1 UNL1 0.0407 + 30 HC6 5.7926 1.2959 0.7419 H 1 UNL1 0.0852 + 31 HC7 6.8067 2.3688 -0.2318 H 1 UNL1 0.0852 + 32 HC 5.1318 -0.7658 0.4839 H 1 UNL1 0.1725 + 33 HC1 6.8859 0.1040 -3.3376 H 1 UNL1 0.1725 + 34 HC8 0.1861 5.3116 4.2423 H 1 UNL1 0.1360 + 35 HC9 -0.7334 6.9156 2.5421 H 1 UNL1 0.1140 + 36 HC10 -0.0897 6.6995 0.1421 H 1 UNL1 0.1120 + 37 HC11 1.4800 4.8759 -0.5797 H 1 UNL1 0.1260 + 38 HC12 5.2681 -2.8946 1.4737 H 1 UNL1 0.0514 + 39 HC13 5.2001 -4.2263 0.3095 H 1 UNL1 0.0514 + 40 HC14 6.7357 -3.8079 1.0980 H 1 UNL1 0.0514 + 41 HC15 8.0253 -1.5568 -4.6086 H 1 UNL1 0.0514 + 42 HC16 7.3652 -3.1880 -4.4187 H 1 UNL1 0.0514 + 43 HC17 8.8956 -2.7499 -3.6328 H 1 UNL1 0.0514 +@BOND + 1 2 1 1 + 2 2 3 1 + 3 1 14 1 + 4 22 21 2 + 5 22 19 1 + 6 5 6 2 + 7 5 4 1 + 8 5 12 1 + 9 6 7 1 + 10 4 3 1 + 11 7 9 2 + 12 7 8 1 + 13 12 10 2 + 14 9 10 1 + 15 9 11 1 + 16 10 13 1 + 17 21 20 1 + 18 14 19 ar + 19 14 15 ar + 20 19 17 ar + 21 20 18 2 + 22 15 16 ar + 23 15 23 1 + 24 17 18 1 + 25 17 16 ar + 26 24 23 ar + 27 23 25 ar + 28 26 1 1 + 29 27 1 1 + 30 28 2 1 + 31 29 2 1 + 32 30 3 1 + 33 31 3 1 + 34 32 6 1 + 35 33 12 1 + 36 34 18 1 + 37 35 20 1 + 38 36 21 1 + 39 37 22 1 + 40 38 8 1 + 41 39 8 1 + 42 40 8 1 + 43 41 13 1 + 44 42 13 1 + 45 43 13 1 +@SUBSTRUCTURE + 1 UNL1 1 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/lig_67.pdbqt b/compounds/MCL1_ligands/lig_67.pdbqt new file mode 100644 index 0000000..b9dcba8 --- /dev/null +++ b/compounds/MCL1_ligands/lig_67.pdbqt @@ -0,0 +1,53 @@ +REMARK Name = lig_67.pdbqt +REMARK 8 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_1 and C_2 +REMARK 2 A between atoms: C_1 and C_14 +REMARK 3 A between atoms: C_2 and C_3 +REMARK 4 A between atoms: C_3 and O_4 +REMARK 5 A between atoms: O_4 and C_5 +REMARK 6 A between atoms: C_7 and C_8 +REMARK 7 A between atoms: C_10 and C_13 +REMARK 8 A between atoms: C_15 and C_23 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 3.306 2.404 0.107 0.00 0.00 +0.098 C +ENDROOT +BRANCH 1 2 +ATOM 2 C UNL A 1 2.585 2.986 1.295 0.00 0.00 -0.212 A +ATOM 3 C UNL A 1 2.704 2.506 2.663 0.00 0.00 +0.009 A +ATOM 4 O UNL A 1 1.935 3.260 3.529 0.00 0.00 +0.059 OA +ATOM 5 C UNL A 1 1.329 4.222 2.760 0.00 0.00 -0.155 A +ATOM 6 C UNL A 1 0.456 5.229 3.194 0.00 0.00 +0.013 C +ATOM 7 C UNL A 1 1.683 4.103 1.431 0.00 0.00 -0.058 A +ATOM 8 C UNL A 1 -0.055 6.126 2.234 0.00 0.00 -0.033 C +ATOM 9 C UNL A 1 0.309 6.004 0.874 0.00 0.00 -0.048 C +ATOM 10 C UNL A 1 1.189 4.983 0.460 0.00 0.00 +0.018 C +BRANCH 3 11 +ATOM 11 C UNL A 1 3.510 1.378 3.206 0.00 0.00 +0.936 C +ATOM 12 O UNL A 1 4.205 0.702 2.462 0.00 0.00 -0.797 OA +ATOM 13 O UNL A 1 3.460 1.169 4.408 0.00 0.00 -0.797 OA +ENDBRANCH 3 11 +ENDBRANCH 1 2 +BRANCH 1 14 +ATOM 14 C UNL A 1 4.729 2.995 -0.059 0.00 0.00 -0.020 C +BRANCH 14 15 +ATOM 15 C UNL A 1 5.814 1.907 -0.168 0.00 0.00 +0.279 C +BRANCH 15 16 +ATOM 16 O UNL A 1 5.563 1.116 -1.347 0.00 0.00 -0.353 OA +BRANCH 16 17 +ATOM 17 C UNL A 1 5.993 -0.186 -1.412 0.00 0.00 +0.135 C +ATOM 18 C UNL A 1 5.705 -1.096 -0.382 0.00 0.00 -0.007 C +ATOM 19 C UNL A 1 6.139 -2.430 -0.471 0.00 0.00 -0.040 C +ATOM 20 C UNL A 1 5.818 -3.393 0.664 0.00 0.00 +0.093 C +ATOM 21 C UNL A 1 6.858 -2.853 -1.611 0.00 0.00 -0.027 C +ATOM 22 C UNL A 1 7.133 -1.943 -2.656 0.00 0.00 -0.040 C +ATOM 23 CL UNL A 1 7.405 -4.519 -1.735 0.00 0.00 -0.137 Cl +ATOM 24 C UNL A 1 6.692 -0.612 -2.547 0.00 0.00 -0.007 C +ATOM 25 C UNL A 1 7.897 -2.382 -3.898 0.00 0.00 +0.093 C +ENDBRANCH 16 17 +ENDBRANCH 15 16 +ENDBRANCH 14 15 +ENDBRANCH 1 14 +TORSDOF 6 diff --git a/compounds/MCL1_ligands/ligand.mol2 b/compounds/MCL1_ligands/ligand.mol2 new file mode 100644 index 0000000..a369db3 --- /dev/null +++ b/compounds/MCL1_ligands/ligand.mol2 @@ -0,0 +1,117 @@ +@MOLECULE +ligand.pdbqt +51 55 1 0 0 +SMALL +AMBER ff14SB + + +@ATOM + 1 C -2.7154 -32.9562 -19.6228 C.2 1 UNL1 -0.1310 + 2 C -3.3528 -34.1388 -20.0501 C.2 1 UNL1 0.0124 + 3 C -4.2516 -34.1140 -21.1323 C.2 1 UNL1 -0.1240 + 4 C -5.0870 -25.9593 -21.7197 C.2 1 UNL1 -0.1420 + 5 C -4.2200 -24.8777 -21.4552 C.2 1 UNL1 -0.1146 + 6 C -2.8605 -25.1470 -21.2118 C.2 1 UNL1 -0.1150 + 7 C -2.3813 -26.4644 -21.2510 C.2 1 UNL1 -0.1480 + 8 C -3.0808 -29.6805 -22.6664 C.3 1 UNL1 0.1504 + 9 C -5.2847 -29.6758 -21.3591 C.3 1 UNL1 0.2078 + 10 C -4.6346 -27.2976 -21.7493 C.2 1 UNL1 0.0746 + 11 C -3.2479 -27.5331 -21.5270 C.2 1 UNL1 0.0311 + 12 C -4.2890 -30.5248 -22.1892 C.3 1 UNL1 -0.0407 + 13 C -5.4145 -32.6350 -22.9408 C.3 1 UNL1 -0.0391 + 14 N -5.5469 -28.3526 -21.9605 N.pl3 1 UNL1 -0.6510 + 15 O -2.6584 -28.7793 -21.6291 O.2 1 UNL1 -0.3509 + 16 C -4.4937 -32.8911 -21.7745 C.2 1 UNL1 -0.0813 + 17 C -3.8626 -31.7247 -21.3612 C.2 1 UNL1 -0.0683 + 18 C -2.9699 -31.7354 -20.2779 C.2 1 UNL1 -0.0980 + 19 CL -3.0282 -35.6485 -19.2258 Cl 1 UNL1 -0.1224 + 20 C -4.9924 -31.2163 -23.4014 C.3 1 UNL1 -0.0694 + 21 C -6.9212 -28.1461 -22.4649 C.3 1 UNL1 0.2108 + 22 C -7.9474 -27.8757 -21.3451 C.3 1 UNL1 -0.1157 + 23 C -9.4320 -27.6160 -21.7668 C.3 1 UNL1 -0.0894 + 24 C -9.8104 -28.2094 -20.3722 C.3 1 UNL1 -0.0994 + 25 C -8.5274 -29.0849 -20.5355 C.3 1 UNL1 -0.0894 + 26 C -4.7417 -23.4564 -21.4269 C.2 1 UNL1 0.9092 + 27 O -3.9471 -22.5592 -21.1919 O.co2 1 UNL1 -0.8298 + 28 O -5.9294 -23.2751 -21.6473 O.co2 1 UNL1 -0.8298 + 29 HC -2.0280 -32.9875 -18.7828 H 1 UNL1 0.1420 + 30 HC1 -4.7470 -35.0223 -21.4601 H 1 UNL1 0.1400 + 31 HC2 -6.1311 -25.7232 -21.8847 H 1 UNL1 0.1610 + 32 HC3 -2.1828 -24.3216 -21.0056 H 1 UNL1 0.1560 + 33 HC4 -1.3270 -26.6603 -21.0876 H 1 UNL1 0.1230 + 34 HC5 -3.3516 -29.1043 -23.5612 H 1 UNL1 0.0537 + 35 HC6 -2.2548 -30.3501 -22.9354 H 1 UNL1 0.0537 + 36 HC7 -4.8703 -29.5235 -20.3535 H 1 UNL1 0.0467 + 37 HC8 -6.2129 -30.2449 -21.2313 H 1 UNL1 0.0467 + 38 HC9 -5.2922 -33.3723 -23.7441 H 1 UNL1 0.0492 + 39 HC10 -6.4612 -32.6390 -22.6112 H 1 UNL1 0.0492 + 40 HC11 -2.4898 -30.8148 -19.9525 H 1 UNL1 0.1640 + 41 HC12 -5.8417 -30.6387 -23.7848 H 1 UNL1 0.0522 + 42 HC13 -4.2768 -31.3243 -24.2272 H 1 UNL1 0.0522 + 43 HC14 -7.2560 -29.0263 -23.0266 H 1 UNL1 0.0512 + 44 HC15 -6.9402 -27.3003 -23.1641 H 1 UNL1 0.0512 + 45 HC16 -7.5444 -27.0848 -20.6996 H 1 UNL1 0.0887 + 46 HC17 -9.7029 -26.5668 -21.9304 H 1 UNL1 0.0490 + 47 HC18 -9.7772 -28.2073 -22.6237 H 1 UNL1 0.0490 + 48 HC19 -9.7697 -27.4902 -19.5448 H 1 UNL1 0.0392 + 49 HC20 -10.7600 -28.7529 -20.3231 H 1 UNL1 0.0392 + 50 HC21 -7.9976 -29.3351 -19.6097 H 1 UNL1 0.0490 + 51 HC22 -8.6734 -30.0023 -21.1186 H 1 UNL1 0.0490 +@BOND + 1 28 26 ar + 2 23 22 1 + 3 23 24 1 + 4 20 13 1 + 5 20 12 1 + 6 21 22 1 + 7 21 14 1 + 8 13 16 1 + 9 22 25 1 + 10 4 10 2 + 11 4 5 1 + 12 26 5 1 + 13 26 27 ar + 14 14 10 1 + 15 14 9 1 + 16 10 11 1 + 17 5 6 2 + 18 8 12 1 + 19 8 15 1 + 20 24 25 1 + 21 12 9 1 + 22 12 17 1 + 23 16 17 2 + 24 16 3 1 + 25 11 15 1 + 26 11 7 2 + 27 6 7 1 + 28 17 18 1 + 29 3 2 2 + 30 18 1 2 + 31 2 1 1 + 32 2 19 1 + 33 29 1 1 + 34 30 3 1 + 35 31 4 1 + 36 32 6 1 + 37 33 7 1 + 38 34 8 1 + 39 35 8 1 + 40 36 9 1 + 41 37 9 1 + 42 38 13 1 + 43 39 13 1 + 44 40 18 1 + 45 41 20 1 + 46 42 20 1 + 47 43 21 1 + 48 44 21 1 + 49 45 22 1 + 50 46 23 1 + 51 47 23 1 + 52 48 24 1 + 53 49 24 1 + 54 50 25 1 + 55 51 25 1 +@SUBSTRUCTURE + 1 UNL1 1 RESIDUE 4 A UNL1 0 ROOT diff --git a/compounds/MCL1_ligands/ligand.pdbqt b/compounds/MCL1_ligands/ligand.pdbqt new file mode 100644 index 0000000..dd9aeb7 --- /dev/null +++ b/compounds/MCL1_ligands/ligand.pdbqt @@ -0,0 +1,45 @@ +REMARK Name = ligand.pdbqt +REMARK 3 active torsions: +REMARK status: ('A' for Active; 'I' for Inactive) +REMARK 1 A between atoms: C_5 and C_26 +REMARK 2 A between atoms: N_14 and C_21 +REMARK 3 A between atoms: C_21 and C_22 +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ROOT +ATOM 1 C UNL A 1 -2.715 -32.956 -19.623 0.00 0.00 +0.011 C +ATOM 2 C UNL A 1 -3.353 -34.139 -20.050 0.00 0.00 +0.012 C +ATOM 3 C UNL A 1 -4.252 -34.114 -21.132 0.00 0.00 +0.016 C +ATOM 4 C UNL A 1 -5.087 -25.959 -21.720 0.00 0.00 +0.019 C +ATOM 5 C UNL A 1 -4.220 -24.878 -21.455 0.00 0.00 -0.115 C +ATOM 6 C UNL A 1 -2.861 -25.147 -21.212 0.00 0.00 +0.041 C +ATOM 7 C UNL A 1 -2.381 -26.464 -21.251 0.00 0.00 -0.025 C +ATOM 8 C UNL A 1 -3.081 -29.680 -22.666 0.00 0.00 +0.258 C +ATOM 9 C UNL A 1 -5.285 -29.676 -21.359 0.00 0.00 +0.301 C +ATOM 10 C UNL A 1 -4.635 -27.298 -21.749 0.00 0.00 +0.075 C +ATOM 11 C UNL A 1 -3.248 -27.533 -21.527 0.00 0.00 +0.031 C +ATOM 12 C UNL A 1 -4.289 -30.525 -22.189 0.00 0.00 -0.041 C +ATOM 13 C UNL A 1 -5.415 -32.635 -22.941 0.00 0.00 +0.059 C +ATOM 14 N UNL A 1 -5.547 -28.353 -21.960 0.00 0.00 -0.651 N +ATOM 15 O UNL A 1 -2.658 -28.779 -21.629 0.00 0.00 -0.351 OA +ATOM 16 C UNL A 1 -4.494 -32.891 -21.774 0.00 0.00 -0.081 C +ATOM 17 C UNL A 1 -3.863 -31.725 -21.361 0.00 0.00 -0.068 C +ATOM 18 C UNL A 1 -2.970 -31.735 -20.278 0.00 0.00 +0.066 C +ATOM 19 CL UNL A 1 -3.028 -35.648 -19.226 0.00 0.00 -0.122 Cl +ATOM 20 C UNL A 1 -4.992 -31.216 -23.401 0.00 0.00 +0.035 C +ENDROOT +BRANCH 5 21 +ATOM 21 C UNL A 1 -4.742 -23.456 -21.427 0.00 0.00 +0.909 C +ATOM 22 O UNL A 1 -3.947 -22.559 -21.192 0.00 0.00 -0.830 OA +ATOM 23 O UNL A 1 -5.929 -23.275 -21.647 0.00 0.00 -0.830 OA +ENDBRANCH 5 21 +BRANCH 14 24 +ATOM 24 C UNL A 1 -6.921 -28.146 -22.465 0.00 0.00 +0.313 C +BRANCH 24 25 +ATOM 25 C UNL A 1 -7.947 -27.876 -21.345 0.00 0.00 -0.027 C +ATOM 26 C UNL A 1 -9.432 -27.616 -21.767 0.00 0.00 +0.009 C +ATOM 27 C UNL A 1 -9.810 -28.209 -20.372 0.00 0.00 -0.021 C +ATOM 28 C UNL A 1 -8.527 -29.085 -20.535 0.00 0.00 +0.009 C +ENDBRANCH 24 25 +ENDBRANCH 14 24 +TORSDOF 3 diff --git a/docking_mcl1/MTH_Docking_Part1_Prepare_2.0.ipynb b/docking_mcl1/MTH_Docking_Part1_Prepare_2.0.ipynb new file mode 100644 index 0000000..f6451e6 --- /dev/null +++ b/docking_mcl1/MTH_Docking_Part1_Prepare_2.0.ipynb @@ -0,0 +1,278 @@ +{ + "cells": [ + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# **The Molecular Treasure Hunt: Part 1: In the beginning - making your life easier and preparing your input files carefully**" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "*An Ångstrom sized adventure by Sarah Harris (Leeds Physics) and Geoff Wells (UCL Pharmacy)*" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "\"*It's a dangerous business, going out your door. You step onto the road, and if you don't keep your feet, there's no knowing where you might be swept off to.*\" J.R.R. Tolkien, The Fellowship of the Ring." + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# References and weblinks\n", + "These are links to software used for preparing docking files, running the docking and visualising the output.\n", + "\n", + "## Autodock Vina:\n", + "\n", + "For version 1.1.0: O. Trott, A. J. Olson. AutoDock Vina: improving the speed and accuracy of docking with a new scoring function, efficient optimization and multithreading, Journal of Computational Chemistry 2010, 31, 455-461. doi:10.1002/jcc.21334\n", + "Download: http://vina.scripps.edu/download.html\n", + "\n", + "For version 1.2.0: J. Eberhardt, D. Santos-Martins, A.F. Tillack, S. Forli. AutoDock Vina 1.2.0: New Docking Methods, Expanded Force Field, and Python Bindings. Journal of Chemical Information and Modeling 2021, 61, 8, 3891–3898. doi:10.1021/acs.jcim.1c00203\n", + "\n", + "\n", + "## Open Drug Discovery Toolkit:\n", + "Incorporating openbabel\n", + "\n", + "N. M. O'Boyle, M. Banck, C. A. James, C. Morley, T. Vandermeersch, G. R. Hutchison. Open Babel: An open chemical toolbox. Journal of Cheminformatics, 2011, 3, 33. doi:10.1186/1758-2946-3-33\n", + "\n", + "M. Wójcikowski, P. Zielenkiewicz, P. Siedlecki. Open Drug Discovery Toolkit (ODDT): a new open-source player in the drug discovery field. Journal of Cheminformatics 2015, 7, 26. doi:10.1186/s13321-015-0078-2\n", + "\n", + "\n", + "## UCSF Chimera:\n", + "\n", + "E. F. Pettersen, T. D. Goddard, C. C. Huang, G. S. Couch, D. M. Greenblatt, E. C. Meng, T. E. Ferrin. UCSF Chimera - a visualization system for exploratory research and analysis. J Comput Chem 2004, 25, 1605-12. doi:10.1002/jcc.20084\n", + "\n", + "**This is not preinstalled, so you need to download it!**\n", + "\n", + "Download: https://www.cgl.ucsf.edu/chimera/download.html\n", + "\n", + "\n", + "### MGL Tools (integrated within Chimera):\n", + "S. Forli, R. Huey, M. E. Pique, M. Sanner, D. S. Goodsell, and A. J. Olson Computational protein-ligand docking and virtual drug screening with the AutoDock suite. Nat Protoc. 2016, 11, 905–919. doi:10.1038/nprot.2016.051\n", + "\n", + "\n", + "## DataWarrior (fun for chemists - but optional for everyone else!!):\n", + "\n", + "Thomas Sander, Joel Freyss, Modest von Korff, Christian Rufener. DataWarrior: An Open-Source Program For Chemistry Aware Data Visualization And Analysis. J Chem Inf Model 2015, 55, 460-473, doi:10.1021/ci500588j\n", + "\n", + "**This is not preinstalled, so you need to download it!**\n", + "\n", + "Download: http://www.openmolecules.org/datawarrior/download.html\n", + "\n", + "## Editorial Notes: \n", + "You may want to save a pdf version of this notebook for your records. You can do this from the File > Download as > PDF via Latex menu." + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# What we hope to learn\n", + "The focus of these notebooks (and associated code) is the evaluation of ligand binding to multiple protein structures. The workflow is designed to make this as user friendly as possible, but in order to achieve this your files should ideally be organised and set up very carefully. This is a research project, so it is not a simple exercise that you can work through blindly. You need to think about:\n", + "\n", + "- Your initial biological question or hypothesis.\n", + "- How your protein/receptor may interact with ligands at the atomic level (always look carefully at your structures and complexes using Chimera - we really mean at every possible stage!).\n", + "- The thermodynamics, the computational and chemical steps you perform during your analysis, how these may be interrelated and the approximations that are made.\n", + "- The significance of what your results might mean e.g. are you trying to design a drug, or understand a biological interaction, or think about the physical interactions and dynamics that influence molecular recognition.\n", + "\n", + "All of these points are important to getting the most out of your project!\n", + "\n", + "You may feel that you only understand one or two of these areas, but by going through this process you should hopefully appreciate the spectrum of different disciplines that are necessary to address the problem as a whole. You should also know that the most difficult problems are solved through collaboration with people from different disciplines and by combining theoretical studies such as this with experimental observations.\n", + "\n", + "**You do not need to know or understand everything!!! This project is about finding out - not about what you might already know!! It has been the same for us while we wrote it.**\n", + "\n", + "## Protein targets you could dock against\n", + "As long as your protein conformers are properly aligned (we tell you how to do this below), you have the freedom to dock against structures from, for example:\n", + "\n", + "- an MD trajectory\n", + "- NMR conformers\n", + "- Variants or mutants of a protein\n", + "- Subtypes of a particular receptor\n", + "- X-ray crystal structures from different sources, species, of different resolutions or obtained after re-refinement (e.g. PDB-redo)\n", + "- Cryo-EM structures at 'atomistic' resolution\n", + "\n", + "**Caveat**: when you come to analyse your results in Part 5 ('Saving Your Greatest Hits') we have the option of 'animating' our docking results for particular ligands to see how protein conformation affects binding. In order to do this your protein structures should contain **exactly** the same atoms and atom types (so the files should preferably come from the same source e.g. an MD trajectory or an ensemble from an NMR experiment or careful choice of your protein conformers!). This is a limitation, but we are thinking about ways to get around it.\n", + "\n", + "\n", + "# Preparing our input files\n", + "First of all we need to check that the protein files that we are working with contain all of the necessary information for the docking and scoring calculations. We are also going to define a single grid box that describes where on or within the protein our ligands will be 'allowed' to dock (often a cavity or groove or an experimentally observed binding pocket). Therefore our proteins must be very carefully aligned to make sure that this box is always in the right place.\n", + "\n", + "We use Chimera to prepare and visualise our input and output structures because they have been designed to be compatible with Autodock Vina. In fact, if you explore the Tools menu in Chimera you will see that you can run simple single docking calculations using the Surface/Binding Analysis > Autodock Vina menu. You may wish to use one of your protein structures and ligands to explore this. However, this quickly becomes impractical with multiple protein conformations and many ligands, so the automated approach that we use here is important for feasibility.\n", + "\n", + "We will use some of this Chimera/Autodock Vina functionality to build our docking 'gridbox' configuration file a little later in this notebook. \n", + "\n", + "\n", + "## Prerequisites for your protein .pdb files\n", + "Your protein files **must** be protonated i.e. have H atoms added. This might be necessary if your protein conformer(s) came from a crystal structure which do not resolve hydrogen atoms. We discuss how to add hydrogen atoms below if this is necessary. If you have a series of structures from an NMR experiment or a series of protein conformers from a molecular dynamics (MD) simulation, the protein structures should already be protonated.\n", + "\n", + "## How to align your protein structures\n", + "You can align proteins using Chimera as follows:\n", + "\n", + "- Open Chimera.\n", + "- Open your pdb files (all of them!) using the File > Open menu.\n", + "- If necessary you can protonate your pdb files at this stage by using the Tools > Structure Editing > AddH menu and following the instructions.\n", + "\n", + "Chimera will ask you a lot of annoying questions. Just agree to everything, unless you think you know better. If you have done something ambitious, like including post-translational modifications (e.g. glycosylation or phosphorylation sites), cofactors, metal coordination sites, etc. then it is likely that you will have to think carefully at this stage. \n", + "\n", + "- Align your files using the Tools > Structure Comparison > Match Maker.\n", + "- From the Match Maker menu pick the protein that you would like to use as the template then select all of the other structures to align to it (using cntrl-click to select them).\n", + "- Click OK to align the structures.\n", + "- You will then need to save each structure into a separate pdb file, you can do this by opening the File > Save PDB menu.\n", + "- Enter a file name for the first file that you would like to save and select the matching file from the Save Models list. Make sure that the 'Save relative to model:' box is ticked. Then click on Save at the bottom of the window.\n", + "- You will need to do this for each file in turn giving each file a new name and picking the next model in the sequence to save.\n", + "- It would be a **very** good idea to give your pdb files a consistent name e.g. myprotein_00.pdb for the first file then myprotein_01.pdb for the second etc. if they come from a group of related (MD or NMR) stuctures. This will make life much easier later!!\n", + "\n", + "If you are fortunate enough to have many more protein conformers, e.g. around 100, then you will need an automated method to protonate and/or align pdb files. This is possible within Chimera, but we haven't done it for you. However, for you to be lucky enough to have this amount of protein receptor dynamics information, then you have probably obtained this from an MD simulation. If this is the case, then the MD simulation software will have it's own facilties for performing the alignment, that are far more computationally efficient (which becomes increasingly important for large data sets). And of course your structures must already be chemically correct (e.g. protontated) for the simulation to have been peformed." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "import sys\n", + "import os\n", + "from glob import glob" + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "#This defines our receptor structures (all of these files happen to have the same prefix, the starting structure (xal structure) is xxx_00.pdb)\n", + "receptor_filenames = glob('../receptor/*.pdb')\n", + "receptor_filenames.sort()\n", + "print(receptor_filenames)\n", + "print(\"Number of proteins is\", len(receptor_filenames))" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "## How to define and visualise your protein receptor binding site (the 'gridbox')\n", + "We will use Chimera to help us define the position and size of the space on or within the protein structures into which we will dock our ligands:\n", + "\n", + "- First open one or more of your protein structures in Chimera using the File > Open menu\n", + "- Then open the Tools > Surface/Binding Analysis > Autodock Vina menu\n", + "- Tick the box 'Resize search volume using button 2' (this is the middle button of your mouse - change this using the dropdown menu if you have a minimalist mouse or a laptop trackpad!)\n", + "- When you press the middle button of your mouse in the molecule display window you will see a green edged box appear.\n", + "- You can rotate the protein using the left button of your mouse and resize the box using the middle button. To adjust the box size and position, place your cursor over the side of the box you wish to move and press the middle button of your mouse while you drag the box to make it bigger or smaller. **This might take some practice and a bit of trial and error!**\n", + "- It may be helpful to show the protein in a surface representation as you do this so that you can check that the gridbox covers all of your binding site (you need to know where your binding site is!!)\n", + "- Your gridbox should be large enough to cover your binding site (and a margin either side), but large box sizes will slow your calculations down (a lot!) and may result in ligands binding at multiple sites (which you might not want).\n", + "- As you adjust the box size and position you will see that the numbers for the center and size of the gridbox will change in the Chimera Autodock Vina window.\n", + "- It is a **good idea** to load in a few of your protein structures to check that your grid box covers the binding site in all of your protein conformers!\n", + "- Once you are happy with your gridbox you can read off the numbers for the grid center (these are x, y and z coordinates) and the grid size (these are x, y and z dimensions in Å). These numbers should be inserted below e.g. the center_x number should be the first grid center value and the size_x value should be the first grid size number.\n", + "- When you have done this you can execute the piece of code below!\n", + "\n", + "### What to do if you don't know where your binding site is\n", + "You have a few options:\n", + "\n", + "- You could run a docking calculation using the whole protein by making your gridbox cover the entire volume of the protein (this could be very slow and result in poor sampling of the search space, but there is a version of Autodock Vina that is optimised for this type of calculation called qvina-w). This approach is called 'blind docking'.\n", + "- You could use a webserver to identify cavities within your protein that may be potential ligand binding sites. For example FTMap (https://ftmap.bu.edu/login.php), is a web server that provides you with information on how a series of probe ligands are predicted to interact with your protein. The clusters of sites that the probes occupy can help you to identify potential binding sites on your protein. This will provide you with a pdb file that you can download and visualise using Chimera. You can then try to match your grid box position with the location of the probe ligand clusters.\n", + "- You could use software to identify cavities within your protein that may be potential ligand binding sites. Examples include fpocket (https://github.com/Discngine/fpocket) a command line program, or CAVER (https://caver.cz/) a Pymol plugin. You will need to read the manuals, webpages and articles if you wish to use these approaches.\n", + "- You could use the sites at which co-factors or substrates bind to your protein (e.g. ATP binding sites in molecular motors or kinase enzymes). You may be able to infer the location of substrate or ligand binding sites from bioinformatics, mutation studies or by analogy with related proteins." + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "## Where to put your files\n", + "Your aligned protein files should be in a folder called 'receptor' in the parent folder for all of your docking calculations for a particular protein (the parent folder is the one below this one!).\n", + "The conf.txt file that we make in the next part will also be stored here." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "#We write out our docking configuration file here - this is read by Autodock Vina and defines the gridbox and some other parameters\n", + "#It is called conf.txt\n", + "\n", + "center_x = 7.3\n", + "center_y = 17.7\n", + "center_z = 1.5\n", + "size_x = 15\n", + "size_y = 17\n", + "size_z = 17\n", + "#Probably best not to play around with these unless you know what you are doing!\n", + "energy_range = 4\n", + "exhaustiveness = 20\n", + "#Fixing the number of docked poses to 1 (num_modes = 1) will give us only the lowest energy docked conformation of each ligand in our output file\n", + "num_modes = 1\n", + "\n", + "with open(\"../receptor/conf.txt\",'w') as contents:\n", + " contents.write(\"center_x = \" + str(center_x) + '\\n' + \"center_y = \" + str(center_y) + '\\n' + \"center_z = \" + str(center_z) + '\\n' + '\\n' + \"size_x = \" + str(size_x) + '\\n' + \"size_y = \" + str(size_y) + '\\n' + \"size_z = \" + str(size_z) + '\\n' + '\\n' + \"energy_range = \" + str(energy_range) + '\\n' + \"exhaustiveness = \" + str(exhaustiveness) + '\\n' \"num_modes = \" + str(num_modes) + '\\n')" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Your conf.txt file that contains the grid box information and a few other parameters will look like this:" + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": { + "scrolled": true + }, + "outputs": [], + "source": [ + "with open(\"../receptor/conf.txt\", 'r') as f:\n", + " for line in f:\n", + " print(line)\n", + "f.close()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "The first part is finished. You are now ready to move on to Part 2, which is the biggest step in your journey!\n", + "\n", + "\"*And here I have found what I sought not indeed, but finding I would possess for ever. For it is above all gold and silver, and beyond all jewels. Neither rock, nor steel, nor the fires of Morgoth, nor all the powers of the Elf-kingdoms, shall keep from me the treasure that I desire.*\" J.R.R. Tolkien, The Silmarillion.\n", + "\n", + "It is very important to prepare carefully before any big adventure!\n", + "\n", + "Sarah and Geoff\n", + "\n", + "(an \"out-of-office studios\" $O^{3}S$ production)" + ] + } + ], + "metadata": { + "kernelspec": { + "display_name": "Python 3 (ipykernel)", + "language": "python", + "name": "python3" + }, + "language_info": { + "codemirror_mode": { + "name": "ipython", + "version": 3 + }, + "file_extension": ".py", + "mimetype": "text/x-python", + "name": "python", + "nbconvert_exporter": "python", + "pygments_lexer": "ipython3", + "version": "3.10.16" + } + }, + "nbformat": 4, + "nbformat_minor": 4 +} diff --git a/docking_mcl1/MTH_Docking_Part2_Dock-Vina_2.0.ipynb b/docking_mcl1/MTH_Docking_Part2_Dock-Vina_2.0.ipynb new file mode 100644 index 0000000..3b8931d --- /dev/null +++ b/docking_mcl1/MTH_Docking_Part2_Dock-Vina_2.0.ipynb @@ -0,0 +1,384 @@ +{ + "cells": [ + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# **The Molecular Treasure Hunt: Part 2: Docking a ligand library against each of your protein receptors**" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "*An Ångstrom sized adventure by Sarah Harris (Leeds Physics) and Geoff Wells (UCL Pharmacy)*" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "\"*You cannot pass! I am a servant of the Secret Fire, wielder of the flame of Anor. The dark fire will not avail you, flame of Udûn.*\" J.R.R. Tolkien, The Fellowship of the Ring.\n", + "\n", + "This procedure for understanding the amazing phenomenon of molecular recognition between biomolecules has been designed with a strong agenda. We believe that including the effect of biomolecular dynamics is key to improving our ability to make predictions about how biomolecules will interact. We can see these multiple conformational states either using NMR or cryo-EM experiments, or assessing the diversity of X-ray crystal structures, or using theoretical tools such as atomistic molecular dynamics. You will therefore (we hope!!) include a number of protein structures in your \"receptor\" directory.\n", + "\n", + "How drugs bind to multiple protein conformations depends upon the underlying physics and chemistry of proteins. In a real biological context (*in vivo*), of course, this will also depend on the environment of the protein - e.g. whether it located in a large complex or in a membrane environment. For molecules to be orally bioavailable drugs, there are more stringent criteria (e.g. Lipinski's rule of 5). \n", + "\n", + "Thermal fluctuations (physics) drive conformational changes, but within the constraints imposed by the chemical structure of the proteins and the ligands. The requirement for the drug to reach the target site imposes additional criteria which depend on the physicochemical properties (e.g. clogP). Other considerations, such as the specificity of the compound, its toxicity (related to specificity), synthetic accessibilty (e.g. can a chemist make it) and ease of formulation (e.g. can this be made into a safe and effective medicine, and is it feasible to make large quantities of it) are essential in practise, and can be non-trivial to overcome. \n", + "\n", + "In this part we also take our docking results and do a few further things:\n", + "- We calculate interactions between the ligands and the protein\n", + "- We produce some .sdf files that we can use with other chemoinformatics software (e.g. DataWarrior)\n", + "\n", + "There are a number of features to protein-ligand interactions that we can quantify and use to identify our 'best' or most promising compounds. Here is a list of the features that we calculate:\n", + "- Close contacts\n", + "- Hydrophobic interactions\n", + "- Hydrogen bonds\n", + "- Salt bridges\n", + "- Halogen bonds\n", + "- Pi-stacking interactions (parallel and perpendicular)\n", + "- Pi-cation interactions\n", + "\n", + "The importance of each of these will depend on the chemistry of your ligands and their interaction with the protein. For example, halogen bonds are only relevant to compounds that contain halogens (F, Cl, Br, I) and salt bridge interactions are only relevant to ligands with charges complementary to the protein within the binding site.\n", + "\n", + "Enjoy your Treasure Hunt!! Your search space encompasses the vast possibilities offered by the combinatorics of multiple protein conformations and enormous chemical diversity, particularly if you have embarked on a fragment library dock. Your limits imposed by pharmaceutical requirements though, are stringent, and in many ways unknown. Good luck!! \n", + "\n", + "We start by importing a number of python modules to run our calculations:" + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "import sys\n", + "import os\n", + "import subprocess\n", + "#Importing glob is important for recursive filename searches - we use this to find all of our protein and ligand files!\n", + "from glob import glob\n", + "from pathlib import Path\n", + "from termcolor import colored\n", + "import multiprocessing as mp\n", + "\n", + "import numpy as np\n", + "\n", + "import oddt\n", + "from oddt.interactions import (close_contacts,\n", + " hbonds,\n", + " distance,\n", + " halogenbonds,\n", + " halogenbond_acceptor_halogen,\n", + " pi_stacking,\n", + " salt_bridges,\n", + " pi_cation,\n", + " hydrophobic_contacts)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# Setting your ligand library and the protein receptors for your docking\n", + "Your parent folder is the directory that contains the various docking folders and your receptor folder. The Jupyter notebooks are opened in each of the docking folders. Your proteins should be located in the \"receptor\" folder. This notebook will dock every single ligand in your chosen compound library against all of the protein structures (e.g. pdb files) that are in the \"receptor\" directory.\n", + "\n", + "### Protein and ligand files\n", + "Before you start your treasure hunt, you must make sure that your proteins are **aligned** to each other, that they are **protonated** correctly and that you are happy with the position of the **grid box** that defines your receptor site for each protein structure. Check this by visualising in Chimera!!\n", + "Your ligand files need to have 3D coordinates and be saved as individual molecule files in pdbqt format. They should be have hydrogens added and be in the correct ionisation state. The compound libraries provided are a good template for the format and naming conventions of the ligand files." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "#This defines our receptor structures (all of these files happen to have the same prefix, the starting structure (xal structure) is xxx_00.pdb)\n", + "receptor_filenames = glob('../receptor/*.pdb')\n", + "#This defines where the ligand files are found\n", + "ligand_filenames = glob('../compounds/Minifrag/*.pdbqt')\n", + "\n", + "#The sort command is *really* important for organising the output in the right order (the protein files are mixed up otherwise)\n", + "receptor_filenames.sort()\n", + "print(colored('Receptor filenames', 'blue', attrs=['bold']))\n", + "print(receptor_filenames)\n", + "print(\"Number of proteins is\", len(receptor_filenames))\n", + "\n", + "ligand_filenames.sort()\n", + "print(\"Number of ligands is\", len(ligand_filenames))" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "### Number of processors and number of docking steps per processor\n", + "This tells us about how many processors we have available (or lets us set that number) and helps us to get an estimate of how long the this step of the Molecular Treasure Hunt will take to run. Larger molecules are slower to dock (e.g the FDA library compared to fragment libraries) because they have more rotatable bonds. But the number of docking steps per cpu will give a rough guide to how long the docking will take." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "num_cpu = mp.cpu_count()\n", + "print(\"Number of processors:\", num_cpu)\n", + "#If necessary we can set the number of processors to be less than the mp.cpu_count()\n", + "#by commenting out the top line (by adding a # at the start of the line)\n", + "#and uncommenting the line below (by removing the # from the line) using a number you chose.\n", + "#only one of the two lines (EITHER the top or the bottom one) should be uncommented.\n", + "#num_cpu = 4\n", + "\n", + "docking_steps = len(ligand_filenames) * len(receptor_filenames)\n", + "print(\"Number of individual docking_steps is\", docking_steps)\n", + "docking_steps_per_cpu = round((docking_steps / num_cpu), 2)\n", + "print(\"Number of docking steps per cpu is \", docking_steps_per_cpu)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "### Results folder location\n", + "Here we create a folder to store the results in - you can change the name of this, although it is best not to! (do not use spaces or puctuation other than underscores or hypens in your file name)!" + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": { + "scrolled": true + }, + "outputs": [], + "source": [ + "Results_Folder = 'MTH_Results'\n", + "rf = Path(Results_Folder)\n", + "try:\n", + " rf.mkdir()\n", + "except FileExistsError as exc:\n", + " print(colored('The results folder is already present - check that it is empty before starting!', 'blue', attrs=['bold']))" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "## Making the protein files that we need for the docking calculations\n", + "### Preparing the protein .pdbqt files\n", + "The structures that we start with and align are .pdb files - these contain information on the atoms that are in the protein, the residue names and the x, y and z coordinates of each atom. For the docking calculations a modified version of the .pdb file is necessary that contains additional atom charge (q) and atom type (t) information - this is called a .pdbqt file. **Note**: the .pdbqt files do not contain non-polar hydrogens (this is a requirement for Autodock Vina-based docking calculations).\n", + "\n", + "The next piece of code generates a .pdbqt file for each of your protein .pdb files. As long as your proteins don't contain very weird atoms or residues, this should work!!" + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "#Let's use oddt to make the pdbqt files that we need...\n", + "print(colored('Making pdbqt files', 'blue', attrs=['bold']))\n", + "for receptor_filename in receptor_filenames:\n", + " receptor_prefix = receptor_filename.removesuffix('.pdb')\n", + " receptor_name = receptor_prefix.split(\"/\")[-1]\n", + " receptor_pdbqt_file = receptor_prefix + '.pdbqt'\n", + " rec = next(oddt.toolkit.readfile('pdb', receptor_filename))\n", + " rec.write('pdbqt', receptor_pdbqt_file, overwrite=True, opt={'r': None, 'c': None, 'h': None})\n", + "print(colored('Finished making pdbqt files', 'blue', attrs=['bold']))" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "This defines a procedure for docking a series of ligands to a protein. It's horribly complicated - so only change this if you are feeling python-tastic!!" + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "def dock_ligands(filename):\n", + " #This line removes the filename suffix (.pdbqt)\n", + " dock_input = filename.removesuffix('.pdbqt')\n", + " #This line removes the filename prefix \n", + " dock_name = dock_input.split(\"/\")[-1]\n", + " vina_receptor = PDBFile + '.pdbqt'\n", + " vina_config = \"../receptor/conf.txt\"\n", + " vina_ligand = dock_input + '.pdbqt'\n", + " vina_out = dock_name + '_out.pdbqt'\n", + " #The next line runs a local docking experiment...\n", + " vina_run = subprocess.run([\"vina\", \"--receptor\", vina_receptor, \"--config\", vina_config, \"--ligand\", vina_ligand, \"--out\", vina_out], stdout=subprocess.DEVNULL)\n", + " \n", + " #The input file for vina \"conf.txt\" contains instructions to only output the top docked pose. However, it is \n", + " #also necessary to run the \"vina_split\" command to produce a single ligand conformer, because of the flags that \n", + " #are present at the start and end of the pdbqt output file.\n", + "\n", + " try:\n", + " vina_split = subprocess.run([\"vina_split\", \"--input\", vina_out], stdout=subprocess.DEVNULL)\n", + " \n", + " #This extracts the Vina binding energy from the output file and prints it while the docking is running\n", + " with open(dock_name + '_out.pdbqt', 'r') as contents:\n", + " for line in contents:\n", + " if line.startswith(\"REMARK VINA RESULT:\"):\n", + " dock_energy = round(float(line.split()[3]),4)\n", + " contents.close()\n", + " \n", + " #We use oddt to process the results files and calculate interactions between the ligand and protein\n", + " top_pose = next(oddt.toolkit.readfile('pdbqt', dock_name + '_out.pdbqt'))\n", + " top_pose_out = top_pose.write('mol2')\n", + " mol = top_pose\n", + " protein = PDBFile + '.pdb'\n", + " rec = next(oddt.toolkit.readfile('pdb', protein))\n", + " rec.protein=True\n", + " mols = list(oddt.toolkit.readfile('mol2', filename))\n", + " nonHatoms = int(len(mol.atoms))\n", + " properties = (mol.calcdesc([\"MW\", \"logP\"]))\n", + " s=properties.values()\n", + " MW = round(float([x for x in s][0]),3)\n", + " clogP = round(float([x for x in s][1]),3)\n", + " #Then use these properties to calculate some ligand efficiencies\n", + " LE = round(float(dock_energy/nonHatoms),3)\n", + " LipE = round(float(dock_energy-clogP),3)\n", + " #Now use oddt to calculate the interactions\n", + " cc_count = int(len(np.asarray(close_contacts(rec.atom_dict[rec.atom_dict['atomicnum'] != 1], mol.atom_dict[mol.atom_dict['atomicnum'] != 1], cutoff=3)[0])))\n", + " hbonds_count = int(hbonds(rec, mol, cutoff=3.5, tolerance=30)[2].sum())\n", + " pi1, pi2, strict_parallel, strict_perpendicular = pi_stacking(rec, mol, tolerance=30)\n", + " pipi_par=str(strict_parallel.sum())\n", + " pipi_perp=str(strict_perpendicular.sum())\n", + " pi_cation_count = int(len(pi_cation(rec, mol)[2]))\n", + " #Need to check whether the pi cation count is reversible or in order...\n", + " halogenbonds_count = int(len(halogenbonds(rec, mol)[2]))\n", + " salt_bridges_count = int(len(salt_bridges(rec, mol)[0]))\n", + " hyd_contacts_count = int(len(hydrophobic_contacts(rec, mol)[0]))\n", + " \n", + " print(\"Autodock Vina Score =\", dock_energy, \" KCal/mol,\", 'Hydrogen bonds =', hbonds_count)\n", + " \n", + " #This writes an output file for each ligand\n", + " with open(PDBFile_name + \"_\" + dock_name + \".mol2\",'w') as contents:\n", + " contents.write(\"########## Name: \" + dock_name + '\\n' + \n", + " \"########## Vina_BE: \" + str(dock_energy) + '\\n' + \n", + " \"########## MW: \" + str(MW) + '\\n' + \n", + " \"########## clogP: \" + str(clogP) + '\\n' + \n", + " \"########## nonHatoms: \" + str(nonHatoms) + '\\n' + \n", + " \"########## Vina_LE: \" + str(LE) + '\\n' + \n", + " \"########## Vina_LipE: \" + str(LipE) + '\\n' + \n", + " \"########## Close_contacts: \" + str(cc_count) + '\\n' + \n", + " \"########## Hydrophob_contacts: \" + str(hyd_contacts_count) + '\\n' + \n", + " \"########## HBonds: \" + str(hbonds_count) + '\\n' + \n", + " \"########## Salt_Bridges: \" + str(salt_bridges_count) + '\\n' + \n", + " \"########## Pi-Pi_Parallel: \" + pipi_par + '\\n' + \n", + " \"########## Pi-Pi_Perpendicular: \" + pipi_perp + '\\n' + \n", + " \"########## Pi-Cation: \" + str(pi_cation_count) + '\\n' + \n", + " \"########## Halogen_Bonds: \" + str(halogenbonds_count) + '\\n' + \n", + " top_pose_out)\n", + " contents.close()\n", + " except Exception as e:\n", + " print(f\"Warning: Skipping vina_split and processing due to an error: {e}\")\n", + " \n", + " !'/bin/rm' '{dock_name}'_out*" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Here we are performing the dock. We have the option to dock against multiple protein conformers, because we know that dynamics is important!!\n", + "You should not need to change this section, unless you want to do something special. " + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": { + "scrolled": true + }, + "outputs": [], + "source": [ + "#This runs a series of docking calculations on protein conformations found in the receptor folder\n", + "for receptor_filename in receptor_filenames:\n", + " PDBFile = receptor_filename.removesuffix('.pdb')\n", + " PDBFile_name = PDBFile.split(\"/\")[-1]\n", + " print(colored('Docking for protein started', 'blue', attrs=['bold']))\n", + " print(PDBFile_name)\n", + " \n", + " #Here we run the script that executes the docking procedure for our ligand list...\n", + " #for ligand_filename in ligand_filenames:\n", + " pool = mp.Pool(mp.cpu_count())\n", + " pool.map(dock_ligands, [ligand_filename for ligand_filename in ligand_filenames])\n", + " pool.close()\n", + " print('Docking is complete for:',PDBFile_name)\n", + " #This combines our output files together for each protein conformer and deletes the intermediate files\n", + " !'/bin/cat' '{PDBFile_name}'*.mol2 >> '{Results_Folder}'/VinaResults_'{PDBFile_name}'.mol2\n", + " !'/bin/rm' '{PDBFile_name}'*.mol2\n", + "\n", + "print(colored('All of the docking is complete!', 'blue', attrs=['bold']))\n" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# What to do next\n", + "Your new Treasure Hunt results are stored in the MTH_Results folder (unless you renamed it). You have a set of .mol2 files and .sdf files for each protein conformer. These have a VinaResults prefix. They contain the docked poses of all of your ligands in your library for each separate protein receptor configuration and the scores, and interactions.\n", + "\n", + "You can analyse the data using the next Jupyter notebook, Chimera (for the .mol2 files) and/or DataWarrior (.sdf files) here. \n", + "## Opening the results in Chimera:\n", + "- File > Open > Choose the correct protein/receptor .pdb file (you should have these files on your own computer from when you aligned the proteins in Part 1) this will have the same 'number' as the ligand .mol2 file, e.g. if you load in VinaResultsxxx00.mol2 then the protein file would be proteinxxx00.pdb.\n", + "\n", + "- Tools > Surface/Binding Analysis > ViewDock > Choose the VinaResultsxxx.mol2 file (the file is a Dock 4,5,6 file type)\n", + "\n", + "- This opens a new window. You can select columns to view from the Columns > Show menu and pick the Vina_BE or other scoring/properties lists.\n", + "\n", + "- You can scroll through the ligands in the list and examine how they interact with the protein.\n", + "\n", + "- The presets menu allows you to view the protein as a surface coloured by hydrophbicity.\n", + "\n", + "- The Chimera menus provide a number of other ways to adapt the representation.\n", + "\n", + "\n", + "## Opening the results in DataWarrior:\n", + "- The .sdf files can be viewed in DataWarrior, where you can explore the chemoinformatics of your results (if that is your thing!!). \n", + "- You can also visualise the bound conformations with Pymol using these sdf files (but you will need to download and install Pymol to the VirtualBox yourself!)." + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# Congratulations!!!\n", + "When you have these files you have made a big step on your quest - you are now ready for the next stage - have fun!\n", + "\n", + "\"*None shall remember the deeds that are done in the last defence of your homes. Yet the deeds will not be less valiant because they are unpraised.*\" J.R.R. Tolkien, The Return of the King.\n", + "\n", + "Sarah and Geoff\n", + "\n", + "(an \"out-of-office studios\" $O^{3}S$ production)" + ] + } + ], + "metadata": { + "kernelspec": { + "display_name": "Python 3 (ipykernel)", + "language": "python", + "name": "python3" + }, + "language_info": { + "codemirror_mode": { + "name": "ipython", + "version": 3 + }, + "file_extension": ".py", + "mimetype": "text/x-python", + "name": "python", + "nbconvert_exporter": "python", + "pygments_lexer": "ipython3", + "version": "3.10.16" + } + }, + "nbformat": 4, + "nbformat_minor": 4 +} diff --git a/docking_mcl1/MTH_Docking_Part3_Analysis_2.0.ipynb b/docking_mcl1/MTH_Docking_Part3_Analysis_2.0.ipynb new file mode 100644 index 0000000..408123d --- /dev/null +++ b/docking_mcl1/MTH_Docking_Part3_Analysis_2.0.ipynb @@ -0,0 +1,561 @@ +{ + "cells": [ + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# **The Molecular Treasure Hunt: Part 3: Understanding the meaning of your docking scores**" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "*An Ångstrom sized adventure by Sarah Harris (Leeds Physics) and Geoff Wells (UCL Pharmacy)*" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "\"*Space is big. You just won't believe how vastly, hugely, mind-bogglingly big it is.”* Douglas Adams, The Hitchhiker's Guide to the Galaxy." + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# Introduction\n", + "In Part 2 of your treasure hunt, you obtained poses for your ligand library against a selection of protein conformers. This is a huge amount of data, and to make any sense of it we need to make decisions about which are the \"best\" hits. This is currently a somewhat subjective (and flawed) process, and is the subject of international docking competitions in which research groups attempt to predict experimentally determined protein-ligand complexes, and their affinities (see https://www.capri-docking.org/)." + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# What Part 3 will reveal to you!\n", + "You will probably find that you have far too much information to analyse visually. In this part we process and manipulate our results, to take us closer to the heart of our quest!!" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "## A few things to think about before we start...\n", + "\n", + "## Drug design considerations\n", + "In drug design programmes, \"fragment hits\" typically have high $\\mu M$ to low $m M$ $K_{i}$ values, where the $K_{i}$ is the equilibrium dissociation constant for the ligand, and represents the probability that the ligand is bound or unbound at a given concentration:\n", + "\n", + "\\begin{equation*}\n", + "K_{i} = \\frac{[L][P]}{[LP]}\n", + "\\end{equation*}\n", + "\n", + "where [L] is the concentration of the ligand, [P] is the concentration of the protein and [LP] is the concentration of the ligand-protein complex.\n", + "\n", + "Fragment hits then need to undergo further chemical refinement to produce a putative drug (e.g. via fragment growth or linking).\n", + "\n", + "\"Hit\" compounds tend to be larger molecules that we consider promising and worthy of further structure-activity relationship studies. For these, we might expect $K_{i}$ values in the low $\\mu M$ range. Further along the development pipeline, we have \"lead\" compounds, which may progress to preclinical development. We may expect $K_{i}$ values in the low $n M$ range for these molecules (depending on the target and its tractability).\n", + "\n", + "How close do we get in our virtual study???\n", + "\n", + "## Why thermodynamics matters\n", + "One of the major uncertainties is how we interpret our docking scores in terms of a dissociation constant between the protein and the ligand. This is due to the difficulty in calculating thermodynamic properties (which are ensemble averages over around Avogadro's number of molecular entities) from single snapshots obtained by a dock. Moreover, there are additional complications such as induced fit of the receptor, environmental conditions (e.g. salt concentration) and interactions with water. The problem is that what we need for affinity is **free energy**, whereas what we can calculate from a single static protein structure is just the **energy** because the **entropy** term is missing when we don't include all possible protein, ligand and solvent conformations. This is currently impossible to compute. \n", + "\n", + "If you find this difficult to understand, you are not alone, and this issue is one of the concepts we explore in our treasure hunt when we consider multiple protein receptor conformations. Vina_BE is in the units of KCal/mol (http://autodock.scripps.edu/faqs-help/faq/how-autodock-4-converts-binding-energy-kcal-mol-into-ki). \n", + "\n", + "To convert from Vina_BE to an estimate of the ligand dissociation constant ($K_{i}$), that we call Vina_Ki in this notebook, we use the following equation:\n", + "\n", + "\n", + "\\begin{equation*}\n", + "K_{i} = e^{\\Delta G/RT}\n", + "\\end{equation*}\n", + "\n", + "Here we interpret $\\Delta$G as being equivalent to the Vina_BE, R is the ideal gas constant and T is the temperature. We need the temperature to be in Kelvin (K) and R to be in Kcal/mol/K. Because the $K_{i}$ is a function of the free energy, $\\Delta$G, it tells us about probabilities. For example, a dissociation constant ($K_{i}$) of $10^{-3} M$ means that for each unbound ligand, 1000 are bound to the protein. Conversely, a dissociation constant of $10^{3} M$ means that for each 1000 unbound ligand molecules only one is bound to the protein receptor. Note that below we quote Vina_Ki values in $\\mu M$ because ligand $K_{i}$ values often span the $m M$ to $n M$ range of concentrations.\n", + "\n", + "It would also be possible to consider the association constant ($K_{a}$) where:\n", + "\n", + "\\begin{equation*}\n", + "K_{a} = \\frac{1}{K_{i}}\n", + "\\end{equation*}\n", + "\n", + "Which of course, from thermodynamics, implies that:\n", + "\n", + "\\begin{equation*}\n", + "K_{a} = e^{-\\Delta G/RT}\n", + "\\end{equation*}\n", + "\n", + "**Generally, all docking scores should be viewed as a rank, rather than a prediction of binding free energy.**\n", + "\n", + "**A note on experimental binding assays**: IC$_{50}$ values (the ligand concentration producing a 50% change in an assay) are more prevalent than $K_{i}$ values in the literature because they can be measured in high-throughput experiments, sometimes using liquid handling robotics. An important distinction between $K_{i}$ and IC$_{50}$ is that the latter are assay dependent and affected by, for example, the concentration of the protein and ligand. While equilibrium dissociation constants ($K_{d}$) can be determined using direct binding techniques such as isothermal titration calorimetry, microscale thermophoresis or surface plasmon resonance methods, these methods can be lower throughput and more time consuming." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "#This imports the python modules that we need for the notebook...\n", + "import math\n", + "import numpy as np\n", + "import pandas as pd\n", + "import matplotlib.pyplot as plt\n", + "import mpl_toolkits\n", + "from mpl_toolkits.mplot3d import Axes3D\n", + "from glob import glob\n", + "import seaborn as sns\n", + "import scipy.cluster.hierarchy as shc" + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "#This function extracts the docking and properties info from the various results files in our directory\n", + "def extract_docking_results_from_mol2(filename):\n", + " \n", + " DockedFilePath = filename\n", + " DockedFilePrefix = DockedFilePath.split(\".\")[0]\n", + " DockedFile = DockedFilePrefix.split(\"VinaResults_\")[1]\n", + " Protein_conf = []\n", + " Name = []\n", + " Vina_BE = []\n", + " MW = []\n", + " clogP = []\n", + " nonHatoms = []\n", + " Vina_LE = []\n", + " Vina_LipE = []\n", + " Vina_Ki = []\n", + " CC = []\n", + " HydroC = []\n", + " HBonds = []\n", + " SaltB = []\n", + " PiPi_Par = []\n", + " PiPi_Perp = []\n", + " Pi_Cat = []\n", + " HalB = []\n", + "\n", + " with open(DockedFilePath, 'r') as f:\n", + " for line in f:\n", + " if line.startswith(\"########## Name:\"):\n", + " Name.append(str(line.split()[2]))\n", + " Protein_conf.append(DockedFile) \n", + " if line.startswith(\"########## Vina_BE:\"):\n", + " if float(line.split()[2])<0:\n", + " Vina_BE.append(float(line.split()[2]))\n", + " #Here the gas constant R is in the units Kcal/mol/K and the temperature is 300 K \n", + " #Ki (the inhibitor dissociation constant) is in micromolar units\n", + " Vina_Ki.append((math.exp((float(line.split()[2]))/(0.001987*300))*1000000))\n", + " else:\n", + " #Here we set the Vina_BE and Vina_Ki to 0 if the values are greater than 0 (which may be an indication that the compound does not fit in the binding site and/or grid box)\n", + " #You should look out for these zero values in your graphs!\n", + " Vina_BE.append(0)\n", + " Vina_Ki.append(0)\n", + " \n", + " \n", + " \n", + " if line.startswith(\"########## MW:\"):\n", + " MW.append(float(line.split()[2]))\n", + " if line.startswith(\"########## clogP:\"):\n", + " clogP.append(float(line.split()[2]))\n", + " if line.startswith(\"########## nonHatoms:\"):\n", + " nonHatoms.append(int(line.split()[2]))\n", + " if line.startswith(\"########## Vina_LE:\"):\n", + " Vina_LE.append(float(line.split()[2]))\n", + " if line.startswith(\"########## Vina_LipE:\"):\n", + " Vina_LipE.append(float(line.split()[2]))\n", + " if line.startswith(\"########## Close_contacts:\"):\n", + " CC.append(int(line.split()[2]))\n", + " if line.startswith(\"########## Hydrophob_contacts:\"):\n", + " HydroC.append(int(line.split()[2]))\n", + " if line.startswith(\"########## HBonds:\"):\n", + " HBonds.append(int(line.split()[2]))\n", + " if line.startswith(\"########## Salt_Bridges:\"):\n", + " SaltB.append(int(line.split()[2]))\n", + " if line.startswith(\"########## Pi-Pi_Parallel:\"):\n", + " PiPi_Par.append(int(line.split()[2]))\n", + " if line.startswith(\"########## Pi-Pi_Perpendicular:\"):\n", + " PiPi_Perp.append(int(line.split()[2]))\n", + " if line.startswith(\"########## Pi-Cation:\"):\n", + " Pi_Cat.append(int(line.split()[2]))\n", + " if line.startswith(\"########## Halogen_Bonds:\"):\n", + " HalB.append(int(line.split()[2]))\n", + " \n", + " \n", + " #The units of Vina_BE are kcal/mol. R = 1.987 cal/mol/K.\n", + " df = pd.DataFrame(list(zip(Protein_conf, \n", + " Name, \n", + " Vina_BE, \n", + " Vina_Ki, \n", + " MW, \n", + " nonHatoms, \n", + " clogP, \n", + " Vina_LE, \n", + " Vina_LipE, \n", + " CC, \n", + " HydroC, \n", + " HBonds, \n", + " SaltB, \n", + " PiPi_Par, \n", + " PiPi_Perp, \n", + " Pi_Cat, \n", + " HalB)), \n", + " columns =['Protein_Conf', \n", + " 'Ligand_Name', \n", + " 'Vina_BE', \n", + " 'Vina_Ki', \n", + " 'MW', \n", + " 'nonHatoms', \n", + " 'clogP', \n", + " 'Vina_LE', \n", + " 'Vina_LipE', \n", + " 'Close_Contacts', \n", + " 'Hphob_Contacts', \n", + " 'HBonds', \n", + " 'Salt_Bridges', \n", + " 'Pi-Pi_Par', \n", + " 'Pi-Pi_Perp', \n", + " 'Pi-Cation', \n", + " 'Hal_Bonds'])\n", + " \n", + " return(df)\n", + " f.close()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# Creating 'pandas dataframes' from our docking data\n", + "Here we are going to read in the results from our results folder, and process them to produce a special python object called a **pandas dataframe**. This python data structure effectively represents your data in a table, which then helps us to extract the information we need and to make plots of our data." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "# This defines our receptor structures (all of these files happen to have the same prefix, the starting structure (xal structure) is xxx_00.pdb)\n", + "path_results_filenames = glob('MTH_Results/VinaResults_*.mol2')\n", + "path_results_filenames.sort()\n", + "dataframes_list = []\n", + "for path_results_filename in path_results_filenames:\n", + " df_out = extract_docking_results_from_mol2(path_results_filename)\n", + " dataframes_list.append(df_out)\n", + "total_dataframes = pd.concat(dataframes_list, ignore_index=True) " + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Here we take a look at the Pandas dataframe - it looks neat and it is easy to understand, but it is large. The aim of this stage is to visualise and understand what you have discovered." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "#Save the data frame in a csv file format\n", + "total_dataframes.to_csv('rescored_docking_results.csv', index=False)" + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": { + "scrolled": true + }, + "outputs": [], + "source": [ + "#This lists all of our results...\n", + "total_dataframes" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# Plotting our data and saving our graphs\n", + "Now we try to understand our docking results by plotting some summary graphs and charts. This is important, because it is impossible to know how we should best choose hits unless we first assess the trends across the whole data set. Notice that we consider data distributions in our treasure hunt more often than averages.\n", + "\n", + "In the first example we save the graphical output as a picture file that you can use in presentations and reports. There is a line in the code: \"plt.savefig('Vina_BE_vs_compounds.png')\" that you can paste into other cells in the notebook if you want to save the chart or graph. Remember to change the file name to something relevant to your output!\n", + "\n", + "## Looking at the whole dataset\n", + "First we will look at the Vina_BE for each ligand, across each of the protein conformers. Having around 2000 ligands means that this graph is very busy. We concluded this this representation of our data wasn't very informative." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "#We are plotting binding energy for each ligand: each point represents one ligand and one protein conformation.\n", + "plt.figure(figsize=(16,12), dpi= 80)\n", + "plt.plot(total_dataframes.index, total_dataframes.Vina_BE, 'o', color='black');\n", + "plt.title('Vina_BE (in KCal/mol) for each ligand', fontsize=22)\n", + "plt.xticks(fontsize=12, rotation=90)\n", + "plt.xlabel('Ligand Index', fontsize=12)\n", + "plt.ylabel('Vina_BE (KCal/mol)', fontsize=12)\n", + "plt.yticks(fontsize=12)\n", + "#The next line saves this graph as a png file in the current folder\n", + "plt.savefig('Vina_BE_vs_compounds.png')\n", + "plt.show()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "## Looking at distributions\n", + "As we have so much data, it is probably best to take a look at distributions, rather than the actual values (as we tried above). Here we plot:\n", + "- Vina_BE (KCal/mol)\n", + "- Number of hydrogen bonds formed between the protein and the ligand\n", + "- Number of hydrophobic contacts between the protein and the ligand \n", + "\n", + "If you see a lot of Vina_BE values close to 0 KCal/mol it may tell you that your grid box is too small and the ligands are protruding from the box!" + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "#A series of histograms to tell us about the distributions of our docking results...\n", + "total_dataframes.hist('Vina_BE', bins=20)\n", + "total_dataframes.hist('HBonds', bins=10)\n", + "total_dataframes.hist('Hphob_Contacts', bins=10)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "We can use our special pandas dataframe to sort the results by Vina_BE, putting the lowest (e.g. most favourable) energy first. We can the visualise this version of our dataframe that is \"sorted by Vina_BE\" to check we understand what we are plotting (this may not be included in the pdf version)." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "sort_by_BE = total_dataframes.sort_values('Vina_BE')\n", + "sort_by_BE" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "## We always see this 'S'-shaped profile!\n", + "We can now produce a ranked (waterfall) plot of the Vina_BE vs compound (shown as index in the plot for clarity). We have observed that this has a very characteristic \"S\" shape for all ligand libraries and protein receptors we have tried so far. We think that the best \"hits\" can only be those in the first steep region of the curve, because in the shallow region a small change in binding energy (e.g. Vina_BE in KCal/mol) produces a large change in rank for the compound." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "sort_by_BE.reset_index(drop=True, inplace=True)\n", + "sort_by_BE.reset_index().plot(kind='scatter', x='index', y='Vina_BE', s=10)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Here we plot the Vina_BE as a function of molecular weight (and the points are coloured by the clogP value, that estimates the lipophilicity of the ligand).\n", + "\n", + "You might expect to see that larger ligands have lower (better) Vina_BE scores because they can form more contacts with the protein. *However*, these compounds may also be less *efficient* and have a lower binding energy per unit size (this is measured in the Vina_LE score, which is the Vina_BE divided by the number of non-hydrogen atoms).\n", + "\n", + "These trends might be more obvious for compound libraries that span a large range of molecular weights e.g. the FDA approved drug library." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "plt.figure(figsize=(10,8), dpi= 80)\n", + "plt.title('Vina_BE (in KCal/mol) as a function of molecular weight MW (g/mol)', fontsize=14)\n", + "sns.scatterplot(data=sort_by_BE, x='MW', y='Vina_BE', hue='clogP', s=10, edgecolor=\"black\", linewidth=0.1)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "## Looking at correlations\n", + "This next plot shows correlations in the numerical variables in the docking dataset.\n", + "\n", + "Can you see any interesting correlations, or are there variables that are not as correlated as you might have hoped? Can you explain the correlations that you see?\n", + "\n", + "Sometimes you can see blank rows and columns if there are no data to correlate (e.g. if none of the compounds in the library form a particular type of interaction with the protein)" + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "independent_variables = total_dataframes.drop(['Protein_Conf', 'Ligand_Name', 'MW', 'Vina_LE', 'Vina_LipE', 'Vina_Ki', 'Pi-Pi_Par', 'Pi-Pi_Perp'], axis=1)\n", + "plt.figure(figsize=(12,10), dpi= 80)\n", + "sns.heatmap(independent_variables.corr(), xticklabels=independent_variables.corr().columns, yticklabels=independent_variables.corr().columns, cmap='RdYlGn', center=0, annot=True)\n", + "plt.title('Correlogram of Docking Variables', fontsize=22)\n", + "plt.xticks(fontsize=12)\n", + "plt.yticks(fontsize=12)\n", + "plt.show()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "## Observing the importance of dynamics and protein conformation\n", + "The next very informative plot is a version of our 'waterfall' plot for our ranked compounds, but now seperated so we can see how it depends on the protein receptor conformation.\n", + "\n", + "We will see whether some protein conformations are better or worse at binding ligands. This plot is giving us direct information about the importance of dynamics (or other structural variations of the protein) on our docking results." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "plt.figure(figsize=(10,8), dpi= 80)\n", + "sns.scatterplot(data=sort_by_BE, x='Ligand_Name', y='Vina_BE', hue=sort_by_BE.Protein_Conf.tolist(), s=15, linewidth=0.1)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "## Correlations with physicochemical properties\n", + "As well as binding \"energies\" (Vina_BE), other properties of ligands are known to be important in molecular recognition. Pharmaceutical intution suggests that for a compound to engage in a molecular recognition event it must form some **hydrogen bonds** (which are distance and angle dependent interactions) or **electrostatic** interactions with the target, otherwise they will not be sufficiently chemically specific to the binding site. \n", + "\n", + "We can determine whether H-bonds are important to the Vina_BE, and consider also the other important physicochemical property **clogP**, which is an estimate of the octanol/water partition coefficient (a measure of the lipophilicity of the compound). This is important because how tells you how likely a drug is to cross a cell membrane, which relates to its bioavailability. One of *Lipinski's Rules of 5* is that logP should be no greater than 5 for an orally bioavailable drug. \n", + "\n", + "We can sometimes see that relatively non-polar compounds (clogP > 3-4) form few H-bonds in this type of plot, as expected. These trends can be more apparent with compound libraries that span a wide range of clogP values (e.g. the FDA approved drug library)." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "plt.figure(figsize=(8,6), dpi= 80)\n", + "sns.scatterplot(data=sort_by_BE, x='HBonds', y='Vina_BE', hue='clogP')" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "This next series of plots allow us to correlate the various independent properties of our compounds with each other, and to see how this is affected by protein receptor conformation. *Note: we have to remove H-bonds from this analysis because the large number of compounds with no H-bonds affects the distributions.*\n", + "\n", + "The plots on the diagonals are histograms showing how the property is distributed for each protein conformation. So physicochemical properties should be the same (clogP, non-hydrogen atoms), but the Vina_BE distribution will change for each protein conformer." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "#First drop the columns that contain too many zeros for this type of plot...\n", + "no_HBonds = total_dataframes.drop(['MW', \n", + " 'Vina_LE',\n", + " 'Vina_LipE',\n", + " 'Vina_Ki', \n", + " 'Close_Contacts', \n", + " 'Hphob_Contacts', \n", + " 'HBonds', \n", + " 'Salt_Bridges', \n", + " 'Pi-Pi_Par', \n", + " 'Pi-Pi_Perp', \n", + " 'Pi-Cation', \n", + " 'Hal_Bonds'], axis=1)\n", + "plt.figure(figsize=(16,10), dpi= 80)\n", + "sns.pairplot(no_HBonds, kind=\"scatter\", hue=\"Protein_Conf\", plot_kws=dict(s=10, edgecolor=\"black\", linewidth=0.1))\n", + "plt.show()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "## Distributions and protein conformational dynamics\n", + "We can also use \"violin plots\" to understand the distributions of scored energies for each different protein conformation. Note that the most prestigious scientific journals now insist on graphs that show distributions rather than bar charts, which do not. Why do you think this is so important?\n", + "\n", + "Are there any protein conformers that look like outliers, or are they all the same?" + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "# Draw Violin Plot\n", + "plt.figure(figsize=(13,10), dpi= 80)\n", + "sns.violinplot(x='Protein_Conf', y='Vina_BE', data=total_dataframes, density_norm='width', inner='quartile')\n", + "\n", + "# Decoration\n", + "plt.title('Violin Plot of Vina_BE by Protein Conformation', fontsize=22)\n", + "plt.xticks(fontsize=10, rotation=90)\n", + "plt.yticks(fontsize=10)\n", + "plt.show()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# Congratulations!!\n", + "You have completed the third part of your treasure hunt, in the next part we will save your greatest 'hits' and make files that help us to look at the docked conformations and how the ligands are predicted to bind to the protein.\n", + "\n", + "\"*Forty-two, said Deep Thought, with infinite majesty and calm.*\" Douglas Adams, The Hitchhiker's Guide to the Galaxy\n", + "\n", + "Good luck!!\n", + "\n", + "Sarah and Geoff\n", + "\n", + "(an \"out-of-offices studios\" $O^{3}S$ production)" + ] + } + ], + "metadata": { + "kernelspec": { + "display_name": "Python 3 (ipykernel)", + "language": "python", + "name": "python3" + }, + "language_info": { + "codemirror_mode": { + "name": "ipython", + "version": 3 + }, + "file_extension": ".py", + "mimetype": "text/x-python", + "name": "python", + "nbconvert_exporter": "python", + "pygments_lexer": "ipython3", + "version": "3.10.16" + } + }, + "nbformat": 4, + "nbformat_minor": 4 +} diff --git a/docking_mcl1/MTH_Docking_Part4_Selecting_Hits_2.0.ipynb b/docking_mcl1/MTH_Docking_Part4_Selecting_Hits_2.0.ipynb new file mode 100644 index 0000000..cd6b482 --- /dev/null +++ b/docking_mcl1/MTH_Docking_Part4_Selecting_Hits_2.0.ipynb @@ -0,0 +1,271 @@ +{ + "cells": [ + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# **The Molecular Treasure Hunt: Part 4: Selecting your \"hits_list\"**" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "*An Ångstrom sized adventure by Sarah Harris (Leeds Physics) and Geoff Wells (UCL Pharmacy)*" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "\"*The chances of finding out what's really going on in the universe are so remote, the only thing to do is hang the sense of it and keep yourself occupied.*\" Douglas Adams, The Hitchhiker's Guide to the Galaxy" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# Selecting and refining our list of 'hit' compounds\n", + "Now it is time to make decisions about which ligands you think are the best, based on your physical, chemical and pharmacological understanding of the results. We have made a few suggestions, but now it's up to you to make your own choices.\n", + "\n", + "We recommend that you identify criteria that exclude all but the \"best\" ~1% of unique ligands (which here would be ~20 from a 2000 ligand data set, assuming a single protein receptor conformer). This quantity is very subjective.\n", + "\n", + "How you decide to proceed depends upon the ligand library you have docked. If you have docked FDA approved drugs, then you have limited chemical freedom to modify these, and your decisions should reflect this. Conversely, if you have docked a fragment library, your chemical opportunities are immense. You are likely to find a strong correlation between Vina_BE and the size of your ligand (e.g. MW or non-H atoms). However, because you want to use your fragment dock to inspire new molecular design, you may be best choosing the most **efficient** fragments (e.g. those with the best ligand efficiency (Vina_LE)), rather than those with the best absolute docking score." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "#This imports the python modules that we need for the notebook...\n", + "import pandas as pd" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# Recreating the 'pandas dataframes' from our docking data\n", + "We need our pandas dataframe again to help us select molecules to save." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "#Read in the pandas dataframe from the csv file created in the previous notebook\n", + "total_dataframes = pd.read_csv(\"rescored_docking_results.csv\")" + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "#This lists all of our results...\n", + "total_dataframes" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "### Selections based on means\n", + "Here we calculate the mean of each quantity we are interested in across all protein conformers and we rank the results by the (mean) Vina_BE, so it tells us about the binding of the compounds averaged across all protein conformations. This is only useful in the context of the distributions you observe in Part 3, for example it is not possible to have a non-integral number of hydrogen bonds! So use with care!!" + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "mean_over_conformers = total_dataframes.groupby(['Ligand_Name']).mean(numeric_only=True).reset_index()\n", + "mean_over_conformers" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Arguably the simplest criteria for selecting compounds would be based on the docking score (Vina_BE), but this can often gives us compounds which are large and that form few specific interactions (e.g. HBonds) with the protein receptor target." + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "This is is how we display the top 10 compounds based on our selected parameter (in this case mean Vina_BE)." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "Vina_BE_mean_over_conformers = total_dataframes.groupby(['Ligand_Name']).mean(numeric_only=True).sort_values('Vina_BE').reset_index()\n", + "Vina_BE_mean_over_conformers_top10 = Vina_BE_mean_over_conformers.head(10)\n", + "Vina_BE_mean_over_conformers_top10" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "We can also rank the results based on the ligand efficiency, this scales our Vina_BE by the size of the molecule, so we prioritise more *efficient* molecules in which more of the atoms that compose the compound contribute to the binding. This can be an important consideration when developing fragment-based 'hit' compounds, because as drugs go through a development process their size increases and their ligand efficiency reduces (so starting with ligand efficient molecules is generally regarded as a 'good thing')." + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Here we select our top 5 compounds by chosing those with the best Vina_LE averaged across all protein conformers." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "Vina_LE_mean_over_conformers = total_dataframes.groupby(['Ligand_Name']).mean(numeric_only=True).sort_values('Vina_LE').reset_index()\n", + "Vina_LE_mean_over_conformers_top5 = Vina_LE_mean_over_conformers.head(5)\n", + "Vina_LE_mean_over_conformers_top5" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "### This is the part where you make some choices and need to edit the python code!\n", + "In this cell we select compounds based on a series of average criteria calculated across all of the conformers. We use three criteria in this case, but it could be more (or fewer). Below we have used the mean Vina_LE, mean Vina_BE and mean number of HBonds (a reflection of HBond occupancy across the protein conformers). Initially we don't know how many ligand results this will give us, but we can tune our selection criteria (by changing the numbers in the python code below) to give us a manageable number of ligands. You can look at the dataframes above and the graphs in Part 3 to give you an idea of which values to use here." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "Vina_LE_Vina_BE_HBonds_mean_over_conformers = mean_over_conformers[(mean_over_conformers.Vina_LE < -0.4) & (mean_over_conformers.Vina_BE < -4) & (mean_over_conformers.HBonds > 0.8)]\n", + "Vina_LE_Vina_BE_HBonds_mean_over_conformers" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "### Selections based on the best overall properties\n", + "However, we don't have to deal with the averaged properties of our ligands, we can select those with the best absolute 'activity' from *any* protein conformer and apply similar selection criteria. This might be important if some protein conformers are outliers (i.e. if they demonstrate particularly low or high binding scores for the ligand set).\n", + "In this example we use two criteria to select our compounds (Vina_BE and number of HBonds). \n", + "\n", + "You can change these numbers by editing the python code to increase or decrease the number of molecules you select. You can also add or substitue the properties that you use for your selection by editing the python code." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "sort_by_Ligand_Name = total_dataframes.sort_values('Ligand_Name')\n", + "Vina_BE_HBonds_best_overall = sort_by_Ligand_Name[(sort_by_Ligand_Name.Vina_BE < -4.5) & (sort_by_Ligand_Name.HBonds > 0) & (sort_by_Ligand_Name.Vina_LE < -0.4)]\n", + "Vina_BE_HBonds_best_overall" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "## Writing the output files for our 'best' ligands\n", + "Now that we have decided on some criteria for selecting our ligands, we write out a series of files that contain the bound conformation of the ligand for each of the protein structures.\n", + "**Make sure that you execute the cell that picks your 'selected_hits' directly before executing the 'hit_ligands' selection below!!**\n", + "\n", + "**Bear in mind that the size of the results folder will be *very* large if you select too many ligands (e.g. more than 20) - this could rapidly fill up your computer hard drive.**\n", + "\n", + "Here we print out the list of \"hit_ligands\" you have chosen for visual analysis in Chimera. Be careful to check that these are the ones you really want to keep!!" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "To use one of our other selection sets from above we would replace the 'Vina_BE_HBonds_best_overall' with the corresponding variable name. e.g. we could replace 'selection_set = Vina_BE_HBonds_best_overall' with 'selection_set = Vina_LE_Vina_BE_HBonds_mean_over_conformers'" + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": { + "scrolled": true + }, + "outputs": [], + "source": [ + "selection_set = Vina_BE_HBonds_best_overall\n", + "#The next lines make your hit list and prints the output so that you can check the number of compounds\n", + "#before making the results files in the next step.\n", + "hit_ligands = selection_set.drop_duplicates(subset='Ligand_Name', keep='first')\n", + "Ligand_Names = hit_ligands['Ligand_Name'].tolist()\n", + "print('Number of ligands:', len(Ligand_Names))\n", + "print(hit_ligands[['Ligand_Name']])\n", + "with open('hit_ligands.txt', 'w') as f:\n", + " for item in Ligand_Names:\n", + " f.write(\"%s\\n\" % item)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "In the cell above we wrote out a list file called \"hit_ligands.txt\". This will tell the next part which results files you want to save. It will produce two types of result file for you:\n", + "- A series of .mol2 and .sdf files for each protein conformer that contain only the 'hit' compounds you define here. These files will be in a folder called \"MTH_Hits\".\n", + "- A series of .pdb files for each ligand that you define here with its corresponding docked pose for each protein conformer. These files will be in a folder called \"MTH_Protein_Hits\". You can use these files to see how the ligand pose changes as the protein conformation changes - a movie!" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# Congratulations!!\n", + "You have completed the fourth part of your treasure hunt, and you are soon to open your first boxes of treasure! Please do not be disheartend if on your first attempt you find that your box is empty, or that the contents are disappointing. You will be more lucky next time, or the time after!! Perseverance is key to any successful quest.\n", + "\n", + "Also beware of false optimism! Even though your results may look beautifully convincing, you should assess them with a skeptical eye. Others will scrutinse them carefully for their true value when you present them in the future. **Ultimately all predictions of this type need to be tested by experiment.**\n", + "\n", + "\"*All that is gold does not glitter, not all those who wander are lost.*\" J.R.R. Tolkien, The Fellowship of the Ring\n", + "\n", + "Good luck!!\n", + "\n", + "Sarah and Geoff\n", + "\n", + "(an \"out-of-office studios\" $O^{3}S$ production)" + ] + } + ], + "metadata": { + "kernelspec": { + "display_name": "Python 3 (ipykernel)", + "language": "python", + "name": "python3" + }, + "language_info": { + "codemirror_mode": { + "name": "ipython", + "version": 3 + }, + "file_extension": ".py", + "mimetype": "text/x-python", + "name": "python", + "nbconvert_exporter": "python", + "pygments_lexer": "ipython3", + "version": "3.10.16" + } + }, + "nbformat": 4, + "nbformat_minor": 4 +} diff --git a/docking_mcl1/MTH_Docking_Part5_Saving_Hits_2.0.ipynb b/docking_mcl1/MTH_Docking_Part5_Saving_Hits_2.0.ipynb new file mode 100644 index 0000000..0340e7c --- /dev/null +++ b/docking_mcl1/MTH_Docking_Part5_Saving_Hits_2.0.ipynb @@ -0,0 +1,292 @@ +{ + "cells": [ + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# **The Molecular Treasure Hunt: Part 5: Saving your greatest \"hits\"**" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "*An Ångstrom sized adventure by Sarah Harris (Leeds Physics) and Geoff Wells (UCL Pharmacy)*" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "\"*It is known that there are an infinte number of worlds, simply because there is an infinite amount of space for them to be in. However, not every one of them is inhabited.*\" Douglas Adams, The Restaurant at the End of the Universe" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# A few things to think about\n", + "## Dynamical considerations\n", + "In the molecular treasure hunt, we are interested in protein dynamics. We have therefore structured the output so that for each ligand you identify as a \"hit\", you obtain the pose of that ligand complexed with each protein conformation. It may be that some of the structures you obtain did not score well in terms of Vina_BE, but in spite of this, those complexes will be included in your dataset, because we have decided not to elimate any information about dynamics from your results. \n", + "\n", + "You may find that the ligand pose changes when the protein conformation changes. We are very interested to know how often and why this happens. We are also curious to see whether more flexible binding sites are more \"promiscious\" with respect to ligand pose." + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# Saving our 'best' results\n", + "Now we are ready to save our 'best' hit results into new folders (defined below as 'MTH_Hits' and 'MTH_Protein_Hits'), and we use the compound selection that we made in Part 4." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "#This imports the python modules that we need for the notebook...\n", + "from pathlib import Path\n", + "from termcolor import colored\n", + "from glob import glob\n", + "import oddt" + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "#We load the hit ligand list that we made in Part 4\n", + "hits_file = 'hit_ligands.txt'\n", + "hits_folder = ('MTH_Hits')\n", + "protein_hits_folder = ('MTH_Protein_Hits')\n", + "\n", + "#Then we make the two results folders\n", + "rf = Path(hits_folder)\n", + "try:\n", + " rf.mkdir()\n", + "except FileExistsError as exc:\n", + " print(colored('The hits folder is already present - check that it is empty before starting!', 'blue', attrs=['bold']))\n", + "\n", + "rf1 = Path(protein_hits_folder)\n", + "try:\n", + " rf1.mkdir()\n", + "except FileExistsError as exc:\n", + " print(colored('The protein hits folder is already present - check that it is empty before starting!', 'blue', attrs=['bold']))" + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "#We find our chosen molecules in our previously saved results files and save them in new files\n", + "path_results_filenames = glob('MTH_Results/VinaResults*.mol2')\n", + "path_results_filenames.sort()\n", + "hit_ligands=[]\n", + "with open(hits_file, 'r') as f:\n", + " for line in f:\n", + " line=line.rsplit()\n", + " hit_ligands.append(line)\n", + "f.close()\n", + "for path_results_filename in path_results_filenames:\n", + " results_filename=path_results_filename.split('/')[-1]\n", + " results_filename_prefix=results_filename.removesuffix('.mol2')\n", + " protein=results_filename_prefix.split('_')[1]\n", + " all_mols = list(oddt.toolkit.readfile('mol2', path_results_filename))\n", + " hits_out_filename=hits_folder + '/' + results_filename_prefix + '_hit_ligands.mol2'\n", + " with open(hits_out_filename, 'w') as contents:\n", + " with open(hits_out_filename, 'a') as contents:\n", + " for mol in all_mols:\n", + " for hit_ligand in hit_ligands:\n", + " if mol.data['Name'] in hit_ligand:\n", + " hit=mol.write('mol2')\n", + " contents.write(\"########## Name: \" + mol.data['Name'] + '\\n' + \n", + " \"########## Vina_BE: \" + mol.data['Vina_BE'] + '\\n' + \n", + " \"########## MW: \" + mol.data['MW'] + '\\n' + \n", + " \"########## clogP: \" + mol.data['clogP'] + '\\n' + \n", + " \"########## nonHatoms: \" + mol.data['nonHatoms'] + '\\n' + \n", + " \"########## Vina_LE: \" + mol.data['Vina_LE'] + '\\n' + \n", + " \"########## Vina_LipE: \" + mol.data['Vina_LipE'] + '\\n' + \n", + " \"########## Close_contacts: \" + mol.data['Close_contacts'] + '\\n' + \n", + " \"########## Hydrophob_contacts: \" + mol.data['Hydrophob_contacts'] + '\\n' + \n", + " \"########## HBonds: \" + mol.data['HBonds'] + '\\n' + \n", + " \"########## Salt_Bridges: \" + mol.data['Salt_Bridges'] + '\\n' + \n", + " \"########## Pi-Pi_Parallel: \" + mol.data['Pi-Pi_Parallel'] + '\\n' + \n", + " \"########## Pi-Pi_Perpendicular: \" + mol.data['Pi-Pi_Perpendicular'] + '\\n' + \n", + " \"########## Pi-Cation: \" + mol.data['Pi-Cation'] + '\\n' + \n", + " \"########## Halogen_Bonds: \" + mol.data['Halogen_Bonds'] + '\\n' + \n", + " hit)\n", + " contents.close()\n", + "\n" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "### Aminating outputs for docking runs against multiple proteins that are the same (e.g. from MD)\n", + "We can run the cell below if we have docking data for several protein conformers that are the from an MD simulation. If we only have one protein or our proteins are not identical (e.g. mutants, isoforms, etc.) DO NOT run the cell below and proceed to run the final cell only." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": { + "scrolled": true + }, + "outputs": [], + "source": [ + "#Here we write out the files to the MTH_Protein_Hits folder\n", + "for hit_ligand in hit_ligands:\n", + " lig=\"\"\n", + " for ele in hit_ligand: \n", + " lig += ele\n", + " print(lig)\n", + " \n", + " protein_hits_out_filename=protein_hits_folder + '/' + lig + '_all_protein_poses.pdb'\n", + " with open(protein_hits_out_filename, 'w') as contents:\n", + " with open(protein_hits_out_filename, 'a') as contents:\n", + " for path_results_filename in path_results_filenames:\n", + " results_filename=path_results_filename.split('/')[-1]\n", + " results_filename_prefix=results_filename.removesuffix('.mol2')\n", + " protein_suffix=results_filename_prefix.split('VinaResults_')[1]\n", + " protein=protein_suffix.split('_rescored')[0]\n", + " print(protein)\n", + " protein_file='../receptor/'+ protein + '.pdb'\n", + " protein_in=next(oddt.toolkit.readfile('pdb', protein_file))\n", + " protein_out=protein_in.write('pdb')\n", + " protein_number=protein.split('_')[-1]\n", + " all_mols = list(oddt.toolkit.readfile('mol2', path_results_filename))\n", + " for mol in all_mols:\n", + " if mol.data['Name'] in hit_ligand:\n", + " hit=mol.write('pdb')\n", + " contents.write(\"MODEL \" + protein_number + '\\n' +\n", + " str(protein_out) + '\\n' + 'TER' + '\\n' +\n", + " hit +\n", + " \"ENDMDL\" + '\\n')\n", + " contents.close()\n", + "\n", + "out_pdb_files=glob(protein_hits_folder + '/*.pdb')\n", + "for file in out_pdb_files:\n", + " with open(file, 'r') as f:\n", + " lines = f.readlines()\n", + " f.close()\n", + " with open(file, 'w') as contents: \n", + " for line in lines:\n", + " if \"MODEL\" in line or \"ATOM\" in line or \"HETATM\" in line or \"TER\" in line or \"ENDMDL\" in line:\n", + " contents.write(line)\n", + " contents.close()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "To visualise how your ligand pose changes as the protein conformation changes, you need to read these pdb files into Chimera. Please watch the video accompanying this notebook to see how to do this.\n", + "\n", + "If you wish, you can visualise the .sdf files in either Data Warrior or Pymol (but this is not essential to your mission!)." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "#Write sdf files for use in DataWarrior etc.\n", + "mol2_files = glob('MTH_Hits/VinaResults_*.mol2')\n", + "for mol2_file in mol2_files:\n", + " mol2_prefix = mol2_file.removesuffix('.mol2')\n", + " sdf_out = mol2_prefix + '.sdf'\n", + " mols = list(oddt.toolkit.readfile('mol2', mol2_file))\n", + " with open (sdf_out, 'w') as contents:\n", + " for mol in mols:\n", + " sdf = mol.write('sdf')\n", + " with open (sdf_out, 'a') as contents:\n", + " contents.write(sdf)\n", + " contents.close()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "# Caveats, Confessions and Future Work\n", + "\n", + "## Ligand pose issues\n", + "You may remember that one of the details of the protocol in Part 1 of your treasure hunt was that for each ligand we selected only the single \"best\" docked conformer for each receptor structure, to reduce the complexity of our dataset. Our ligand libraries contain between 80 and ~2000 ligands and hopefully you have considered around 10 protein conformers, but if we additionally include all ligand poses from the docking we increase this by an order of magnitude. Subsequent experience has shown that when these multiple ligand conformers (for a single protein receptor) are energy minimised, the scores can swap in rank order. Although the differences in energy are small, the difference in ligand pose can be disturbingly large. We are thinking about this very carefully.\n", + "\n", + "## Problems with protons\n", + "Protons generally make up around half of the total number of atoms in a biomolecular structure, but are frequently conveniently overlooked because they cannot be resolved by X-ray crystallography. This is a problem if you would like to run a molecular dynamics simulation, because these sophisticated biomolecular models explicitly require input structures that are chemically correct.\n", + "\n", + "The original ligand libraries, which generally contain 2D chemical structures (e.g. when you download them from the ZINC database, Enamine or other sources), have been lovingly inflated into 3D and protonated by Geoff (using the molconvert software https://docs.chemaxon.com/display/docs/Molecule_file_conversion_with_Molconverter.html), who can view the structure of a drug and know whether it violates fundamental chemical laws. This is not a common skill, and so as far as possible we want to automate this decision making process. The structures are named according to their reference numbers so can be easily searched (and researched) online if they are of interest!\n", + "\n", + "The original .mol2 files in your ligand libraries are correctly protonated (there may still be some horrors that Geoff just hasn't seen yet in the structures - please let us know if you see an issue!). However, in Part 2, you use a pdbqt file that contains only the polar hydrogens to perform the Vina docking and minimisation steps.\n", + "\n", + "Ligands and proteins contain *titratable groups* (e.g. acids and bases) which change their protonation state due to the local electrostatic environment, which here is determined by the biochemistry and solvent accessibility of the site. This means that the protonation state of your ligand may change when it binds to the protein (this is called a *pKa shift*), and may also be dependent on protein conformer, because this changes charge-charge interactions. This has not been included at the docking stage.\n", + "\n", + "We propose that the treatment of protontation states is key to successful rational drug design. This is because protonation states often determine the ability of biomolecules to form hydrogen bonds and electrostatic interactions, which are vital for specificity. You will notice that Hbonds are a particular column that we use for selecting hits in Parts 3 and 4. It may also be possible to design compounds that are sufficiently lipophilic to cross a biological membrane, but which become more polar when exposed to the electrostatic environment of your protein receptor binding site through shifts in pka. \n", + "\n", + "Moreover, some very successful drugs make explicit use of changes in acidity as part of their function, and this is especially true for anti-cancer drugs where the tumour environment is more acidic than healthy tissues. \n", + "\n", + "## Complications involving the solvent (water)\n", + "Many protein-ligand structures show that specific interactions with the solvent can be important for stabilising the bound conformation of the ligand. This can be due to the formation of hydrogen bond networks in which water molecules 'bridge' gaps between the ligand and the protein. Such interactions can be missed in docking calculations, because many protocols strip the solvent and ions from the systems before running the docking calculations. However, water residues can be included in the calculations. Indeed, in one of our case studies, water residues that coordinate to a magnesium ion are included as part of the protein pdb file.\n", + "\n", + "## Difficulties with induced fit\n", + "When we measure binding events in experiments we \"record\" an ensemble of strong/durable and weak/transient binding events that contribute to our measurement. In contrast, during docking studies we focus on the *best* docked conformations that we can determine. This is important because it directs us towards the highest affinity interaction that a ligand could form, but it doesn't account for the *ensemble* of ways and timescales over which a ligand could bind to a protein. This is partly why disappointments are frequent in computational docking studies! Hang in there - it could be a bumpy ride because free energy landscapes contain multiple minima!\n", + "\n", + "One of the most elegant aspects of molecular recognition is that the protein receptor target undergoes a conformational change when the ligand binds. This is because proteins are \"soft matter\" physical systems, which can explore multiple free energy minima at an ambient temperature (300 K). This provides an exquiste \"fine tuning\" of biomolecular interactions that is (arguably) one of the key thermodynamics signatures of life. It is impossible to consider these effects unless we allow the receptor to adapt to our ligand pose. The Vina software is capable of performing a flexible dock where you can specify the residues that are mobile. Ideally, you would do this using distance based criteria from the ligand, but in practise this is so slow that manual intervention is required to reduce the number of flexible residues. We have therefore not attempted this in the workflow here. \n", + "\n", + "Our current approach partially considers protein receptor conformational flexibility by considering multiple protein conformations. However, protein conformational changes due to thermal fluctuations are inherently multi-scale. This means that over short (e.g. ps-ns) timescales changes in protein and ligand structure involve merely local rotations in bond and dihedral angles. Over longer (e.g $\\mu$s) timescales, flexible proteins may undergo global conformational changes in shape that modify the binding site. As yet, we have a poor understanding of the relative importance of local versus global conformational changes, or the timescales over which these occur. We hope that by using computation these notebooks will address some of these fundamental biochemical-physical questions. \n", + "\n", + "Please note that this question is not independent of the issue with protonation, as you may have guessed!!\n", + "\n", + "**Future work:** If the presence of the ligand modifies the conformational landscape that the protein explores, we need a physics-based (e.g. molecular dynamics forcefield) to predict the resulting protein-ligand complexes and their binding energies. One method to assess the importance of induced fit, certainly at the local (e.g. side-chain) level, is to perform a molecular dynamics simulation of your receptor-ligand complex. In our experience, these simulations based on docking poses often result in ligands diffusing out of the binding pocket. We are very interested to know whether the quality of the structure based on docking score correlates with the stability of a complex subjected to molecular dynamics. We are confident that much of this workflow can be extended to automate the simulation construction and launching process. " + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "\"*Little did I know where the chief peril lay! ... Torment in the dark was the danger that I feared, and it did not hold me back. But I would have never come, had I known the danger of light and joy.*\" J.R.R. Tolkien, The Fellowship of the Ring." + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Good luck!!\n", + "\n", + "Sarah and Geoff\n", + "\n", + "(an \"out-of-office studios\" $O^{3}S$ production)" + ] + } + ], + "metadata": { + "kernelspec": { + "display_name": "Python 3 (ipykernel)", + "language": "python", + "name": "python3" + }, + "language_info": { + "codemirror_mode": { + "name": "ipython", + "version": 3 + }, + "file_extension": ".py", + "mimetype": "text/x-python", + "name": "python", + "nbconvert_exporter": "python", + "pygments_lexer": "ipython3", + "version": "3.10.16" + } + }, + "nbformat": 4, + "nbformat_minor": 4 +} diff --git a/docking_mcl1/MTH_Results_all/VinaResults_6o6f_A227V_H.mol2 b/docking_mcl1/MTH_Results_all/VinaResults_6o6f_A227V_H.mol2 new file mode 100644 index 0000000..3d7b13a --- /dev/null +++ b/docking_mcl1/MTH_Results_all/VinaResults_6o6f_A227V_H.mol2 @@ -0,0 +1,2000 @@ +########## Name: lig_27 +########## Vina_BE: -8.532 +########## MW: 279.205 +########## clogP: -0.331 +########## nonHatoms: 23 +########## Vina_LE: -0.371 +########## Vina_LipE: -8.201 +########## Close_contacts: 0 +########## Hydrophob_contacts: 23 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_27.pdbqt + 23 25 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 CA -26.4920 -7.8620 -20.0570 C.ar 1 UNL1 0.0410 + 2 N -26.4490 -6.5280 -20.4580 N.ar 1 UNL1 -0.2150 + 3 C -27.7550 -6.0960 -20.3430 C.ar 1 UNL1 -0.0400 + 4 C -28.2740 -4.8290 -20.6350 C.2 1 UNL1 -0.0330 + 5 C -29.6560 -4.6270 -20.4450 C.2 1 UNL1 -0.0360 + 6 C -30.4760 -5.6820 -19.9800 C.2 1 UNL1 -0.0710 + 7 C -29.9250 -6.9490 -19.6950 C.2 1 UNL1 0.0250 + 8 C -28.5480 -7.1320 -19.8840 C.ar 1 UNL1 -0.0710 + 9 C -27.7630 -8.2550 -19.6950 C.ar 1 UNL1 -0.1800 + 10 H -25.6220 -6.0420 -20.7700 H 1 UNL1 0.3100 + 11 C -25.2570 -8.7070 -20.0590 C.2 1 UNL1 0.8430 + 12 O -25.1950 -9.5710 -20.9230 O.co2 1 UNL1 -0.8210 + 13 OXT -24.3720 -8.5430 -19.2300 O.co2 1 UNL1 -0.8210 + 14 C -28.2080 -9.6180 -19.2040 C.3 1 UNL1 0.1040 + 15 C -28.8060 -10.4630 -20.3550 C.3 1 UNL1 -0.0260 + 16 C -30.3510 -10.5100 -20.3500 C.3 1 UNL1 0.2820 + 17 O -30.8700 -10.1590 -19.0470 O.2 1 UNL1 -0.3520 + 18 C -32.1200 -10.5260 -18.6010 C.2 1 UNL1 0.1340 + 19 C -33.2500 -10.5110 -19.4390 C.2 1 UNL1 -0.0120 + 20 C -34.5080 -10.8790 -18.9310 C.2 1 UNL1 0.0100 + 21 C -34.6400 -11.2460 -17.5810 C.2 1 UNL1 -0.0710 + 22 C -33.5160 -11.2450 -16.7390 C.2 1 UNL1 0.0100 + 23 C -32.2600 -10.8800 -17.2520 C.2 1 UNL1 -0.0120 +@BOND + 1 12 11 ar + 2 10 2 1 + 3 4 5 1 + 4 4 3 2 + 5 2 3 ar + 6 2 1 ar + 7 5 6 2 + 8 15 16 1 + 9 15 14 1 + 10 16 17 1 + 11 3 8 ar + 12 11 1 1 + 13 11 13 ar + 14 1 9 ar + 15 6 7 1 + 16 8 7 2 + 17 8 9 ar + 18 9 14 1 + 19 19 20 1 + 20 19 18 2 + 21 17 18 1 + 22 20 21 2 + 23 18 23 1 + 24 21 22 1 + 25 23 22 2 +########## Name: lig_28 +########## Vina_BE: -8.904 +########## MW: 291.216 +########## clogP: -0.176 +########## nonHatoms: 24 +########## Vina_LE: -0.371 +########## Vina_LipE: -8.728 +########## Close_contacts: 0 +########## Hydrophob_contacts: 23 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_28.pdbqt + 24 26 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.8720 -8.1110 -19.6990 C.ar 1 UNL1 -0.1860 + 2 CA -26.5220 -7.7010 -20.0420 C.ar 1 UNL1 0.0480 + 3 N -26.5030 -6.3470 -20.3930 N.ar 1 UNL1 -0.2140 + 4 C -27.8020 -5.8850 -20.2930 C.ar 1 UNL1 -0.0430 + 5 C -28.2730 -4.5930 -20.5520 C.2 1 UNL1 -0.0330 + 6 C -29.6530 -4.3510 -20.3940 C.2 1 UNL1 -0.0390 + 7 C -30.5210 -5.3920 -19.9940 C.2 1 UNL1 -0.0730 + 8 C -30.0190 -6.6860 -19.7440 C.2 1 UNL1 0.0200 + 9 C -28.6440 -6.9030 -19.8940 C.ar 1 UNL1 -0.0730 + 10 H -25.6700 -5.8510 -20.6700 H 1 UNL1 0.3100 + 11 C -25.2680 -8.5090 -20.0490 C.2 1 UNL1 0.8380 + 12 OXT -24.3850 -8.3050 -19.2320 O.co2 1 UNL1 -0.8150 + 13 O -25.1860 -9.3720 -20.9130 O.co2 1 UNL1 -0.8150 + 14 C -28.2610 -9.4830 -19.2050 C.3 1 UNL1 0.0980 + 15 C -28.4930 -10.4890 -20.3590 C.3 1 UNL1 0.0250 + 16 C -29.9720 -10.8840 -20.5770 C.3 1 UNL1 0.2440 + 17 O -30.8510 -9.9360 -19.9370 O.2 1 UNL1 -0.3680 + 18 C -31.8270 -10.3510 -19.0620 C.2 1 UNL1 0.1200 + 19 C -31.4790 -10.5630 -17.7190 C.2 1 UNL1 0.0070 + 20 C -32.4480 -10.9810 -16.7930 C.2 1 UNL1 -0.0080 + 21 C -33.7750 -11.1720 -17.2120 C.2 1 UNL1 -0.0310 + 22 C -34.1310 -10.9390 -18.5510 C.2 1 UNL1 -0.0040 + 23 C -33.1630 -10.5210 -19.4850 C.2 1 UNL1 -0.0960 + 24 C -33.5730 -10.2770 -20.9320 C.3 1 UNL1 0.0900 +@BOND + 1 24 23 1 + 2 13 11 ar + 3 10 3 1 + 4 16 15 1 + 5 16 17 1 + 6 5 6 1 + 7 5 4 2 + 8 6 7 2 + 9 3 4 ar + 10 3 2 ar + 11 15 14 1 + 12 4 9 ar + 13 11 2 1 + 14 11 12 ar + 15 2 1 ar + 16 7 8 1 + 17 17 18 1 + 18 9 8 2 + 19 9 1 ar + 20 1 14 1 + 21 23 18 2 + 22 23 22 1 + 23 18 19 1 + 24 22 21 2 + 25 19 20 2 + 26 21 20 1 +########## Name: lig_30 +########## Vina_BE: -9.081 +########## MW: 291.216 +########## clogP: -0.176 +########## nonHatoms: 24 +########## Vina_LE: -0.378 +########## Vina_LipE: -8.905 +########## Close_contacts: 1 +########## Hydrophob_contacts: 31 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_30.pdbqt + 24 26 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.7160 -8.0950 -19.8260 C.ar 1 UNL1 -0.1930 + 2 CA -26.4690 -7.6520 -20.2880 C.ar 1 UNL1 -0.0370 + 3 N -26.6250 -6.3270 -20.7330 N.ar 1 UNL1 -0.2140 + 4 C -27.9370 -5.9490 -20.5520 C.ar 1 UNL1 -0.0420 + 5 C -28.5390 -4.7190 -20.8460 C.2 1 UNL1 -0.0300 + 6 C -29.9130 -4.5790 -20.5600 C.2 1 UNL1 -0.0380 + 7 C -30.6390 -5.6550 -19.9990 C.2 1 UNL1 -0.0670 + 8 C -30.0010 -6.8800 -19.7150 C.2 1 UNL1 0.0130 + 9 C -28.6340 -6.9930 -20.0060 C.ar 1 UNL1 -0.0730 + 10 H -25.8680 -5.7790 -21.1150 H 1 UNL1 0.3100 + 11 C -25.1620 -8.3700 -20.3360 C.2 1 UNL1 0.9270 + 12 OXT -24.2000 -7.9730 -19.6980 O.co2 1 UNL1 -0.8140 + 13 O -25.1240 -9.3650 -21.0460 O.co2 1 UNL1 -0.8140 + 14 C -27.9880 -9.4540 -19.2290 C.3 1 UNL1 0.0990 + 15 C -28.4430 -10.4900 -20.2820 C.3 1 UNL1 0.0220 + 16 C -29.9790 -10.5160 -20.4670 C.3 1 UNL1 0.2540 + 17 O -30.6310 -10.3690 -19.1880 O.2 1 UNL1 -0.3400 + 18 C -31.9860 -10.5330 -18.9880 C.2 1 UNL1 0.1530 + 19 C -32.8310 -10.3600 -20.0920 C.2 1 UNL1 -0.0370 + 20 C -34.2200 -10.5240 -19.9600 C.2 1 UNL1 0.0140 + 21 C -34.7660 -10.8670 -18.7120 C.2 1 UNL1 -0.0660 + 22 C -33.9300 -11.0440 -17.5970 C.2 1 UNL1 -0.0450 + 23 C -34.5150 -11.4190 -16.2460 C.3 1 UNL1 0.0690 + 24 C -32.5400 -10.8810 -17.7390 C.2 1 UNL1 -0.0500 +@BOND + 1 10 3 1 + 2 13 11 ar + 3 5 6 1 + 4 5 4 2 + 5 3 4 ar + 6 3 2 ar + 7 6 7 2 + 8 4 9 ar + 9 16 15 1 + 10 16 17 1 + 11 11 2 1 + 12 11 12 ar + 13 2 1 ar + 14 15 14 1 + 15 19 20 1 + 16 19 18 2 + 17 9 1 ar + 18 9 8 2 + 19 7 8 1 + 20 20 21 2 + 21 1 14 1 + 22 17 18 1 + 23 18 24 1 + 24 21 22 1 + 25 24 22 2 + 26 22 23 1 +########## Name: lig_31 +########## Vina_BE: -9.567 +########## MW: 348.211 +########## clogP: 2.342 +########## nonHatoms: 27 +########## Vina_LE: -0.354 +########## Vina_LipE: -11.909 +########## Close_contacts: 0 +########## Hydrophob_contacts: 22 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 2 +@MOLECULE +lig_31.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -28.0000 -8.9440 -19.0460 C.3 1 UNL1 0.1040 + 2 C -27.7070 -7.6410 -19.7530 C.ar 1 UNL1 -0.1820 + 3 C -28.6120 -6.5320 -19.9490 C.ar 1 UNL1 -0.0710 + 4 C -29.9570 -6.3760 -19.5870 C.2 1 UNL1 0.0250 + 5 C -27.9330 -5.5330 -20.5920 C.ar 1 UNL1 -0.0390 + 6 C -30.5920 -5.1570 -19.9050 C.2 1 UNL1 -0.0680 + 7 C -29.8830 -4.1300 -20.5690 C.2 1 UNL1 -0.0330 + 8 C -28.5300 -4.3110 -20.9220 C.2 1 UNL1 -0.0310 + 9 N -26.6400 -5.9470 -20.8220 N.ar 1 UNL1 -0.2140 + 10 CA -26.4770 -7.2450 -20.3040 C.ar 1 UNL1 -0.0480 + 11 H -25.8940 -5.4330 -21.2670 H 1 UNL1 0.3110 + 12 C -25.1770 -7.9730 -20.3860 C.2 1 UNL1 0.9330 + 13 OXT -24.8180 -8.3080 -21.5040 O.co2 1 UNL1 -0.8230 + 14 O -24.5410 -8.2460 -19.3810 O.co2 1 UNL1 -0.8230 + 15 C -27.8660 -10.1640 -19.9860 C.3 1 UNL1 -0.0240 + 16 C -29.2110 -10.8830 -20.2550 C.3 1 UNL1 0.2880 + 17 O -30.2700 -9.9040 -20.3580 O.2 1 UNL1 -0.3460 + 18 C -31.5750 -10.2120 -20.0420 C.2 1 UNL1 0.1330 + 19 C -32.5820 -10.2300 -21.0200 C.2 1 UNL1 0.0660 + 20 C -33.8960 -10.5730 -20.6660 C.2 1 UNL1 0.0390 + 21 C -34.2050 -10.8960 -19.3340 C.2 1 UNL1 -0.0020 + 22 C -33.2030 -10.8760 -18.3390 C.2 1 UNL1 -0.1540 + 23 C -31.8880 -10.5180 -18.7090 C.2 1 UNL1 0.0190 + 24 C -33.5450 -11.2230 -16.8860 C.3 1 UNL1 0.6870 + 25 F -34.3500 -12.3050 -16.8110 F 1 UNL1 -0.2490 + 26 F -32.4460 -11.5080 -16.1510 F 1 UNL1 -0.2490 + 27 F -34.1830 -10.2210 -16.2410 F 1 UNL1 -0.2490 +@BOND + 1 13 12 ar + 2 11 9 1 + 3 19 20 1 + 4 19 18 2 + 5 8 5 1 + 6 8 7 2 + 7 9 5 ar + 8 9 10 ar + 9 20 21 2 + 10 5 3 ar + 11 7 6 1 + 12 12 10 1 + 13 12 14 ar + 14 17 16 1 + 15 17 18 1 + 16 10 2 ar + 17 16 15 1 + 18 18 23 1 + 19 15 1 1 + 20 3 2 ar + 21 3 4 1 + 22 6 4 2 + 23 2 1 1 + 24 21 22 1 + 25 23 22 2 + 26 22 24 1 + 27 24 25 1 + 28 24 27 1 + 29 24 26 1 +########## Name: lig_32 +########## Vina_BE: -9.105 +########## MW: 291.216 +########## clogP: -0.176 +########## nonHatoms: 24 +########## Vina_LE: -0.379 +########## Vina_LipE: -8.929 +########## Close_contacts: 0 +########## Hydrophob_contacts: 25 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_32.pdbqt + 24 26 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.7140 -7.7330 -19.8230 C.ar 1 UNL1 -0.1930 + 2 CA -26.4570 -7.3350 -20.2980 C.ar 1 UNL1 -0.0370 + 3 N -26.5620 -5.9950 -20.7170 N.ar 1 UNL1 -0.2140 + 4 C -27.8470 -5.5570 -20.4860 C.ar 1 UNL1 -0.0430 + 5 C -28.3920 -4.2870 -20.7110 C.2 1 UNL1 -0.0300 + 6 C -29.7440 -4.0850 -20.3620 C.2 1 UNL1 -0.0380 + 7 C -30.5040 -5.1390 -19.8050 C.2 1 UNL1 -0.0670 + 8 C -29.9240 -6.4060 -19.5930 C.2 1 UNL1 0.0140 + 9 C -28.5800 -6.5820 -19.9480 C.ar 1 UNL1 -0.0720 + 10 H -25.7880 -5.4720 -21.0980 H 1 UNL1 0.3100 + 11 C -25.1790 -8.1040 -20.3710 C.2 1 UNL1 0.9270 + 12 OXT -24.5400 -8.3630 -19.3640 O.co2 1 UNL1 -0.8150 + 13 O -24.8130 -8.4270 -21.4920 O.co2 1 UNL1 -0.8150 + 14 C -28.0340 -9.0860 -19.2370 C.3 1 UNL1 0.0980 + 15 C -28.1430 -10.1850 -20.3200 C.3 1 UNL1 0.0230 + 16 C -29.5120 -10.8970 -20.3250 C.3 1 UNL1 0.2520 + 17 O -30.5330 -9.9410 -19.9810 O.2 1 UNL1 -0.3390 + 18 C -31.5930 -10.2940 -19.1810 C.2 1 UNL1 0.1480 + 19 C -32.8900 -10.4500 -19.6990 C.2 1 UNL1 -0.0390 + 20 C -33.9460 -10.8270 -18.8530 C.2 1 UNL1 0.0230 + 21 C -33.7120 -11.0520 -17.4840 C.2 1 UNL1 -0.1370 + 22 C -34.8570 -11.4580 -16.5710 C.3 1 UNL1 0.0600 + 23 C -32.4110 -10.9030 -16.9710 C.2 1 UNL1 0.0230 + 24 C -31.3550 -10.5310 -17.8200 C.2 1 UNL1 -0.0390 +@BOND + 1 13 11 ar + 2 10 3 1 + 3 3 4 ar + 4 3 2 ar + 5 5 4 2 + 6 5 6 1 + 7 4 9 ar + 8 11 2 1 + 9 11 12 ar + 10 6 7 2 + 11 16 15 1 + 12 16 17 1 + 13 15 14 1 + 14 2 1 ar + 15 17 18 1 + 16 9 1 ar + 17 9 8 2 + 18 1 14 1 + 19 7 8 1 + 20 19 18 2 + 21 19 20 1 + 22 18 24 1 + 23 20 21 2 + 24 24 23 2 + 25 21 23 1 + 26 21 22 1 +########## Name: lig_33 +########## Vina_BE: -8.814 +########## MW: 314.658 +########## clogP: 0.432 +########## nonHatoms: 24 +########## Vina_LE: -0.367 +########## Vina_LipE: -9.246 +########## Close_contacts: 1 +########## Hydrophob_contacts: 20 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_33.pdbqt + 24 26 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 CA -26.3660 -7.3200 -20.2910 C.ar 1 UNL1 -0.0480 + 2 N -26.5160 -5.9910 -20.7260 N.ar 1 UNL1 -0.2140 + 3 C -27.8180 -5.5960 -20.5080 C.ar 1 UNL1 -0.0400 + 4 C -28.4160 -4.3630 -20.7970 C.2 1 UNL1 -0.0310 + 5 C -29.7800 -4.2090 -20.4800 C.2 1 UNL1 -0.0350 + 6 C -30.5040 -5.2730 -19.8930 C.2 1 UNL1 -0.0700 + 7 C -29.8700 -6.5040 -19.6170 C.2 1 UNL1 0.0250 + 8 C -28.5120 -6.6300 -19.9400 C.ar 1 UNL1 -0.0710 + 9 C -27.6040 -7.7430 -19.7850 C.ar 1 UNL1 -0.1810 + 10 H -25.7650 -5.4550 -21.1370 H 1 UNL1 0.3100 + 11 C -25.0810 -8.0750 -20.3980 C.2 1 UNL1 0.9320 + 12 O -24.8390 -8.5710 -21.4890 O.co2 1 UNL1 -0.8210 + 13 OXT -24.3330 -8.1940 -19.4380 O.co2 1 UNL1 -0.8210 + 14 C -27.8610 -9.1150 -19.2210 C.3 1 UNL1 0.1060 + 15 C -28.0020 -10.1770 -20.3380 C.3 1 UNL1 -0.0250 + 16 C -29.3810 -10.8730 -20.3740 C.3 1 UNL1 0.2840 + 17 O -30.4280 -9.9600 -19.9730 O.2 1 UNL1 -0.3480 + 18 C -31.4560 -10.2940 -19.1190 C.2 1 UNL1 0.1390 + 19 C -32.7370 -10.4540 -19.6670 C.2 1 UNL1 0.0010 + 20 C -33.8190 -10.8230 -18.8510 C.2 1 UNL1 0.0380 + 21 C -33.6160 -11.0400 -17.4790 C.2 1 UNL1 -0.0310 + 22 CL -34.9630 -11.5010 -16.4590 Cl 1 UNL1 -0.1370 + 23 C -32.3350 -10.8890 -16.9240 C.2 1 UNL1 0.0380 + 24 C -31.2530 -10.5250 -17.7440 C.2 1 UNL1 0.0010 +@BOND + 1 12 11 ar + 2 10 2 1 + 3 4 3 2 + 4 4 5 1 + 5 2 3 ar + 6 2 1 ar + 7 3 8 ar + 8 5 6 2 + 9 11 1 1 + 10 11 13 ar + 11 16 15 1 + 12 16 17 1 + 13 15 14 1 + 14 1 9 ar + 15 17 18 1 + 16 8 9 ar + 17 8 7 2 + 18 6 7 1 + 19 9 14 1 + 20 19 18 2 + 21 19 20 1 + 22 18 24 1 + 23 20 21 2 + 24 24 23 2 + 25 21 23 1 + 26 21 22 1 +########## Name: lig_34 +########## Vina_BE: -9.674 +########## MW: 348.211 +########## clogP: 2.342 +########## nonHatoms: 27 +########## Vina_LE: -0.358 +########## Vina_LipE: -12.016 +########## Close_contacts: 1 +########## Hydrophob_contacts: 24 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_34.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.8920 -8.8460 -18.9100 C.3 1 UNL1 0.1040 + 2 C -27.6310 -7.5910 -19.7100 C.ar 1 UNL1 -0.1820 + 3 C -28.5460 -6.4960 -19.9440 C.ar 1 UNL1 -0.0710 + 4 C -29.8770 -6.3180 -19.5430 C.2 1 UNL1 0.0250 + 5 C -27.8910 -5.5410 -20.6720 C.ar 1 UNL1 -0.0390 + 6 C -30.5250 -5.1210 -19.9110 C.2 1 UNL1 -0.0680 + 7 C -29.8420 -4.1360 -20.6600 C.2 1 UNL1 -0.0330 + 8 C -28.5030 -4.3390 -21.0510 C.2 1 UNL1 -0.0310 + 9 N -26.6060 -5.9660 -20.9190 N.ar 1 UNL1 -0.2140 + 10 CA -26.4210 -7.2280 -20.3240 C.ar 1 UNL1 -0.0480 + 11 H -25.8770 -5.4800 -21.4180 H 1 UNL1 0.3110 + 12 C -25.1220 -7.9590 -20.3990 C.2 1 UNL1 0.9330 + 13 OXT -24.8440 -8.4530 -21.4810 O.co2 1 UNL1 -0.8230 + 14 O -24.4090 -8.0830 -19.4160 O.co2 1 UNL1 -0.8230 + 15 C -27.6140 -10.1320 -19.7220 C.3 1 UNL1 -0.0240 + 16 C -28.8850 -10.7390 -20.3680 C.3 1 UNL1 0.2880 + 17 O -29.9850 -9.8080 -20.2440 O.2 1 UNL1 -0.3460 + 18 C -31.1610 -10.1450 -19.6090 C.2 1 UNL1 0.1330 + 19 C -32.3910 -10.1910 -20.2870 C.2 1 UNL1 0.0660 + 20 C -33.5600 -10.5730 -19.6080 C.2 1 UNL1 0.0390 + 21 C -33.5180 -10.9090 -18.2370 C.2 1 UNL1 -0.1370 + 22 C -32.2800 -10.8470 -17.5630 C.2 1 UNL1 -0.0190 + 23 C -31.1140 -10.4620 -18.2440 C.2 1 UNL1 0.0190 + 24 C -34.7780 -11.3490 -17.4820 C.3 1 UNL1 0.6870 + 25 F -35.0150 -12.6720 -17.6290 F 1 UNL1 -0.2490 + 26 F -34.7220 -11.1200 -16.1510 F 1 UNL1 -0.2490 + 27 F -35.8780 -10.7110 -17.9390 F 1 UNL1 -0.2490 +@BOND + 1 13 12 ar + 2 11 9 1 + 3 8 5 1 + 4 8 7 2 + 5 9 5 ar + 6 9 10 ar + 7 5 3 ar + 8 7 6 1 + 9 12 10 1 + 10 12 14 ar + 11 16 17 1 + 12 16 15 1 + 13 10 2 ar + 14 19 18 2 + 15 19 20 1 + 16 17 18 1 + 17 3 2 ar + 18 3 4 1 + 19 6 4 2 + 20 15 1 1 + 21 2 1 1 + 22 18 23 1 + 23 20 21 2 + 24 23 22 2 + 25 21 22 1 + 26 21 24 1 + 27 27 24 1 + 28 25 24 1 + 29 24 26 1 +########## Name: lig_35 +########## Vina_BE: -8.881 +########## MW: 326.669 +########## clogP: 0.587 +########## nonHatoms: 25 +########## Vina_LE: -0.355 +########## Vina_LipE: -9.468 +########## Close_contacts: 0 +########## Hydrophob_contacts: 22 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_35.pdbqt + 25 27 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.7210 -7.6320 -19.8480 C.ar 1 UNL1 -0.1950 + 2 CA -26.4610 -7.2260 -20.3110 C.ar 1 UNL1 -0.0370 + 3 N -26.5700 -5.8870 -20.7260 N.ar 1 UNL1 -0.2140 + 4 C -27.8570 -5.4530 -20.4960 C.ar 1 UNL1 -0.0420 + 5 C -28.4010 -4.1810 -20.7100 C.2 1 UNL1 -0.0290 + 6 C -29.7510 -3.9810 -20.3580 C.2 1 UNL1 -0.0370 + 7 C -30.5100 -5.0370 -19.8030 C.2 1 UNL1 -0.0660 + 8 C -29.9300 -6.3070 -19.6010 C.2 1 UNL1 0.0110 + 9 C -28.5880 -6.4820 -19.9650 C.ar 1 UNL1 -0.0740 + 10 H -25.7940 -5.3580 -21.0950 H 1 UNL1 0.3110 + 11 C -25.1790 -7.9890 -20.3690 C.2 1 UNL1 0.9270 + 12 OXT -24.5330 -8.2170 -19.3590 O.co2 1 UNL1 -0.8140 + 13 O -24.8090 -8.3290 -21.4840 O.co2 1 UNL1 -0.8140 + 14 C -28.0430 -8.9940 -19.2820 C.3 1 UNL1 0.0980 + 15 C -27.8540 -10.1190 -20.3270 C.3 1 UNL1 0.0260 + 16 C -29.1620 -10.8700 -20.6450 C.3 1 UNL1 0.2600 + 17 O -30.2540 -9.9330 -20.5990 O.2 1 UNL1 -0.3380 + 18 C -31.4560 -10.2050 -19.9840 C.2 1 UNL1 0.1580 + 19 C -31.4240 -10.5300 -18.6210 C.2 1 UNL1 -0.0400 + 20 C -32.6090 -10.8310 -17.9230 C.2 1 UNL1 -0.0300 + 21 C -32.5470 -11.1940 -16.4460 C.3 1 UNL1 0.0910 + 22 C -33.8390 -10.8000 -18.6120 C.2 1 UNL1 -0.0360 + 23 C -33.8760 -10.4770 -19.9790 C.2 1 UNL1 0.0390 + 24 CL -35.3490 -11.1640 -17.7960 Cl 1 UNL1 -0.1280 + 25 C -32.6870 -10.1810 -20.6670 C.2 1 UNL1 -0.0260 +@BOND + 1 13 11 ar + 2 10 3 1 + 3 3 4 ar + 4 3 2 ar + 5 5 4 2 + 6 5 6 1 + 7 25 18 2 + 8 25 23 1 + 9 16 17 1 + 10 16 15 1 + 11 17 18 1 + 12 4 9 ar + 13 11 2 1 + 14 11 12 ar + 15 6 7 2 + 16 15 14 1 + 17 2 1 ar + 18 18 19 1 + 19 23 22 2 + 20 9 1 ar + 21 9 8 2 + 22 1 14 1 + 23 7 8 1 + 24 19 20 2 + 25 22 20 1 + 26 22 24 1 + 27 20 21 1 +########## Name: lig_36 +########## Vina_BE: -8.755 +########## MW: 338.68 +########## clogP: 0.668 +########## nonHatoms: 26 +########## Vina_LE: -0.337 +########## Vina_LipE: -9.423 +########## Close_contacts: 2 +########## Hydrophob_contacts: 29 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_36.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.4400 -7.5810 -19.8100 C.ar 1 UNL1 -0.1820 + 2 CA -26.2520 -7.0630 -20.4720 C.ar 1 UNL1 0.0400 + 3 N -26.5140 -5.8010 -21.0160 N.ar 1 UNL1 -0.2140 + 4 C -27.8270 -5.4970 -20.7210 C.ar 1 UNL1 -0.0400 + 5 C -28.5320 -4.3350 -21.0600 C.2 1 UNL1 -0.0310 + 6 C -29.8780 -4.2400 -20.6520 C.2 1 UNL1 -0.0350 + 7 C -30.4820 -5.2900 -19.9230 C.2 1 UNL1 -0.0700 + 8 C -29.7480 -6.4490 -19.5950 C.2 1 UNL1 0.0250 + 9 C -28.4110 -6.5250 -20.0100 C.ar 1 UNL1 -0.0700 + 10 H -25.8300 -5.2570 -21.5210 H 1 UNL1 0.3100 + 11 C -24.9040 -7.6820 -20.6240 C.2 1 UNL1 0.8430 + 12 O -23.9500 -7.2790 -19.9810 O.co2 1 UNL1 -0.8210 + 13 OXT -24.8250 -8.6300 -21.3930 O.co2 1 UNL1 -0.8210 + 14 C -27.5630 -8.9060 -19.0960 C.3 1 UNL1 0.1050 + 15 C -27.8600 -10.0680 -20.0740 C.3 1 UNL1 -0.0250 + 16 C -29.2640 -10.6740 -19.8750 C.3 1 UNL1 0.2860 + 17 O -29.8350 -10.0920 -18.6870 O.2 1 UNL1 -0.3480 + 18 C -31.1070 -10.4250 -18.2980 C.2 1 UNL1 0.1410 + 19 C -32.1270 -10.4620 -19.2590 C.2 1 UNL1 -0.0340 + 20 C -33.4480 -10.7850 -18.8950 C.2 1 UNL1 -0.0570 + 21 C -33.7380 -11.0600 -17.5400 C.2 1 UNL1 -0.0260 + 22 C -32.7170 -11.0080 -16.5750 C.2 1 UNL1 0.0580 + 23 CL -35.3620 -11.4520 -17.0020 Cl 1 UNL1 -0.1370 + 24 C -31.4020 -10.6880 -16.9520 C.2 1 UNL1 0.0360 + 25 C -34.5300 -10.8090 -19.9710 C.3 1 UNL1 0.0570 + 26 C -34.0460 -10.1720 -21.2900 C.3 1 UNL1 0.0110 +@BOND + 1 10 3 1 + 2 13 11 ar + 3 26 25 1 + 4 5 4 2 + 5 5 6 1 + 6 3 4 ar + 7 3 2 ar + 8 4 9 ar + 9 6 7 2 + 10 11 2 1 + 11 11 12 ar + 12 2 1 ar + 13 15 16 1 + 14 15 14 1 + 15 9 1 ar + 16 9 8 2 + 17 25 20 1 + 18 7 8 1 + 19 16 17 1 + 20 1 14 1 + 21 19 20 1 + 22 19 18 2 + 23 20 21 2 + 24 17 18 1 + 25 18 24 1 + 26 21 23 1 + 27 21 22 1 + 28 24 22 2 +########## Name: lig_37 +########## Vina_BE: -8.889 +########## MW: 338.68 +########## clogP: 0.742 +########## nonHatoms: 26 +########## Vina_LE: -0.342 +########## Vina_LipE: -9.631 +########## Close_contacts: 0 +########## Hydrophob_contacts: 26 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_37.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.5350 -7.4600 -19.7120 C.ar 1 UNL1 -0.2010 + 2 CA -26.3310 -7.0070 -20.3920 C.ar 1 UNL1 0.0730 + 3 N -26.5530 -5.7540 -20.9740 N.ar 1 UNL1 -0.2220 + 4 C -27.8600 -5.4030 -20.6950 C.ar 1 UNL1 -0.0430 + 5 C -28.5320 -4.2380 -21.0820 C.2 1 UNL1 -0.0310 + 6 C -29.8770 -4.0910 -20.6860 C.2 1 UNL1 -0.0380 + 7 C -30.5140 -5.0980 -19.9240 C.2 1 UNL1 -0.0640 + 8 C -29.8120 -6.2630 -19.5490 C.2 1 UNL1 0.0190 + 9 C -28.4760 -6.3890 -19.9500 C.ar 1 UNL1 -0.0560 + 10 H -25.8560 -5.2490 -21.5010 H 1 UNL1 0.2980 + 11 C -25.0100 -7.6950 -20.5210 C.2 1 UNL1 0.8300 + 12 O -24.1900 -7.6660 -19.6170 O.co2 1 UNL1 -0.8100 + 13 OXT -24.8100 -8.2910 -21.5710 O.co2 1 UNL1 -0.8100 + 14 C -27.6650 -8.7760 -18.9900 C.3 1 UNL1 0.0940 + 15 C -27.3400 -9.9800 -19.9100 C.3 1 UNL1 -0.0200 + 16 C -28.6020 -10.7520 -20.3430 C.3 1 UNL1 0.2770 + 17 O -29.6890 -9.8180 -20.5020 O.2 1 UNL1 -0.3530 + 18 C -30.9280 -10.1000 -19.9810 C.2 1 UNL1 0.1400 + 19 C -32.0690 -10.1430 -20.7990 C.2 1 UNL1 -0.0100 + 20 C -33.3260 -10.4490 -20.2490 C.2 1 UNL1 -0.0400 + 21 C -34.5470 -10.4790 -21.1590 C.3 1 UNL1 0.0910 + 22 C -33.4330 -10.7270 -18.8680 C.2 1 UNL1 -0.0290 + 23 C -32.2830 -10.7040 -18.0470 C.2 1 UNL1 -0.0400 + 24 CL -34.9990 -11.1150 -18.1700 Cl 1 UNL1 -0.1380 + 25 C -31.0350 -10.3930 -18.6160 C.2 1 UNL1 -0.0100 + 26 C -32.3750 -11.0120 -16.5590 C.3 1 UNL1 0.0910 +@BOND + 1 13 11 ar + 2 10 3 1 + 3 21 20 1 + 4 5 4 2 + 5 5 6 1 + 6 3 4 ar + 7 3 2 ar + 8 19 20 1 + 9 19 18 2 + 10 4 9 ar + 11 6 7 2 + 12 11 2 1 + 13 11 12 ar + 14 17 16 1 + 15 17 18 1 + 16 2 1 ar + 17 16 15 1 + 18 20 22 2 + 19 18 25 1 + 20 9 1 ar + 21 9 8 2 + 22 7 8 1 + 23 15 14 1 + 24 1 14 1 + 25 22 24 1 + 26 22 23 1 + 27 25 23 2 + 28 23 26 1 +########## Name: lig_43 +########## Vina_BE: -10.27 +########## MW: 327.248 +########## clogP: 1.685 +########## nonHatoms: 27 +########## Vina_LE: -0.38 +########## Vina_LipE: -11.955 +########## Close_contacts: 0 +########## Hydrophob_contacts: 33 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_43.pdbqt + 27 30 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.8540 -8.8950 -19.0640 C.3 1 UNL1 0.1050 + 2 C -27.6220 -7.5930 -19.7940 C.ar 1 UNL1 -0.1800 + 3 C -28.5740 -6.5240 -19.9980 C.ar 1 UNL1 -0.0710 + 4 C -29.9200 -6.4190 -19.6250 C.2 1 UNL1 0.0250 + 5 C -27.9390 -5.5070 -20.6550 C.ar 1 UNL1 -0.0400 + 6 C -30.6070 -5.2290 -19.9500 C.2 1 UNL1 -0.0700 + 7 C -29.9430 -4.1810 -20.6300 C.2 1 UNL1 -0.0350 + 8 C -28.5870 -4.3120 -20.9920 C.2 1 UNL1 -0.0330 + 9 N -26.6310 -5.8680 -20.8870 N.ar 1 UNL1 -0.2140 + 10 CA -26.4100 -7.1510 -20.3510 C.ar 1 UNL1 -0.0480 + 11 H -25.9080 -5.3260 -21.3370 H 1 UNL1 0.3100 + 12 C -25.0760 -7.8160 -20.4160 C.2 1 UNL1 0.9320 + 13 O -24.8020 -8.3650 -21.4720 O.co2 1 UNL1 -0.8220 + 14 OXT -24.3240 -7.8240 -19.4560 O.co2 1 UNL1 -0.8220 + 15 C -27.5290 -10.1290 -19.9370 C.3 1 UNL1 -0.0240 + 16 C -28.7830 -10.7830 -20.5700 C.3 1 UNL1 0.2800 + 17 O -29.8750 -9.8340 -20.5770 O.2 1 UNL1 -0.3510 + 18 C -31.1140 -10.1420 -20.0550 C.2 1 UNL1 0.1230 + 19 C -32.2350 -10.0800 -20.8960 C.2 1 UNL1 -0.0090 + 20 C -33.5210 -10.3410 -20.3880 C.2 1 UNL1 -0.0040 + 21 C -33.6860 -10.6670 -19.0290 C.2 1 UNL1 -0.0700 + 22 C -34.9670 -10.9120 -18.5000 C.2 1 UNL1 -0.0070 + 23 C -32.5570 -10.7440 -18.1870 C.2 1 UNL1 -0.0050 + 24 C -35.1190 -11.2270 -17.1390 C.2 1 UNL1 -0.0330 + 25 C -33.9930 -11.2980 -16.3020 C.2 1 UNL1 -0.0250 + 26 C -32.7120 -11.0560 -16.8260 C.2 1 UNL1 0.0610 + 27 C -31.2770 -10.4940 -18.7040 C.2 1 UNL1 0.0260 +@BOND + 1 13 12 ar + 2 11 9 1 + 3 8 5 1 + 4 8 7 2 + 5 19 20 1 + 6 19 18 2 + 7 9 5 ar + 8 9 10 ar + 9 5 3 ar + 10 7 6 1 + 11 17 16 1 + 12 17 18 1 + 13 16 15 1 + 14 12 10 1 + 15 12 14 ar + 16 20 21 2 + 17 10 2 ar + 18 18 27 1 + 19 3 2 ar + 20 3 4 1 + 21 6 4 2 + 22 15 1 1 + 23 2 1 1 + 24 21 22 1 + 25 21 23 1 + 26 27 23 2 + 27 22 24 2 + 28 23 26 1 + 29 24 25 1 + 30 26 25 2 +########## Name: lig_46 +########## Vina_BE: -9.891 +########## MW: 315.238 +########## clogP: 0.06 +########## nonHatoms: 26 +########## Vina_LE: -0.38 +########## Vina_LipE: -9.951 +########## Close_contacts: 0 +########## Hydrophob_contacts: 28 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_46.pdbqt + 26 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 CA -26.4900 -7.2100 -20.3480 C.ar 1 UNL1 0.0410 + 2 N -26.5950 -5.9220 -20.8710 N.ar 1 UNL1 -0.2150 + 3 C -27.9050 -5.5630 -20.6360 C.ar 1 UNL1 -0.0400 + 4 C -28.5450 -4.3610 -20.9640 C.2 1 UNL1 -0.0330 + 5 C -29.9050 -4.2280 -20.6190 C.2 1 UNL1 -0.0360 + 6 C -30.5830 -5.2810 -19.9630 C.2 1 UNL1 -0.0710 + 7 C -29.9130 -6.4810 -19.6450 C.2 1 UNL1 0.0250 + 8 C -28.5600 -6.5980 -19.9950 C.ar 1 UNL1 -0.0710 + 9 C -27.6800 -7.6480 -19.8020 C.ar 1 UNL1 -0.1800 + 10 H -25.8450 -5.4130 -21.3140 H 1 UNL1 0.3100 + 11 C -25.1930 -7.9510 -20.4250 C.2 1 UNL1 0.8430 + 12 OXT -24.8160 -8.2630 -21.5450 O.co2 1 UNL1 -0.8210 + 13 O -24.5780 -8.2590 -19.4150 O.co2 1 UNL1 -0.8210 + 14 C -28.0040 -8.9660 -19.1190 C.3 1 UNL1 0.1040 + 15 C -27.7220 -10.1930 -20.0150 C.3 1 UNL1 -0.0250 + 16 C -29.0070 -10.8480 -20.5830 C.3 1 UNL1 0.2810 + 17 O -30.1020 -9.9100 -20.5070 O.2 1 UNL1 -0.3520 + 18 C -31.3070 -10.2190 -19.9080 C.2 1 UNL1 0.1360 + 19 C -32.4560 -10.2450 -20.7230 C.2 1 UNL1 -0.0540 + 20 C -33.7200 -10.5400 -20.1770 C.2 1 UNL1 0.0120 + 21 C -33.8090 -10.8100 -18.8040 C.2 1 UNL1 -0.1440 + 22 C -32.6780 -10.7960 -18.0000 C.2 1 UNL1 -0.0520 + 23 C -35.0490 -11.1450 -18.0100 C.3 1 UNL1 0.0490 + 24 C -31.4150 -10.5050 -18.5300 C.2 1 UNL1 0.0400 + 25 C -33.0080 -11.1210 -16.5650 C.3 1 UNL1 0.0880 + 26 C -34.4900 -11.5830 -16.6280 C.3 1 UNL1 -0.0140 +@BOND + 1 12 11 ar + 2 10 2 1 + 3 4 3 2 + 4 4 5 1 + 5 2 3 ar + 6 2 1 ar + 7 19 20 1 + 8 19 18 2 + 9 3 8 ar + 10 5 6 2 + 11 16 17 1 + 12 16 15 1 + 13 17 18 1 + 14 11 1 1 + 15 11 13 ar + 16 1 9 ar + 17 20 21 2 + 18 15 14 1 + 19 8 9 ar + 20 8 7 2 + 21 6 7 1 + 22 18 24 1 + 23 9 14 1 + 24 21 23 1 + 25 21 22 1 + 26 24 22 2 + 27 23 26 1 + 28 22 25 1 + 29 26 25 1 +########## Name: lig_47 +########## Vina_BE: -9.612 +########## MW: 329.244 +########## clogP: 0.864 +########## nonHatoms: 27 +########## Vina_LE: -0.356 +########## Vina_LipE: -10.476 +########## Close_contacts: 0 +########## Hydrophob_contacts: 21 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_47.pdbqt + 27 30 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.8520 -8.8280 -18.8890 C.3 1 UNL1 0.0930 + 2 C -27.6130 -7.5730 -19.6990 C.ar 1 UNL1 -0.1990 + 3 C -28.5520 -6.5040 -19.9500 C.ar 1 UNL1 -0.0570 + 4 C -29.8800 -6.3340 -19.5300 C.2 1 UNL1 0.0210 + 5 C -27.9270 -5.5560 -20.7120 C.ar 1 UNL1 -0.0420 + 6 C -30.5560 -5.1590 -19.9240 C.2 1 UNL1 -0.0640 + 7 C -29.9030 -4.1870 -20.7140 C.2 1 UNL1 -0.0370 + 8 C -28.5650 -4.3780 -21.1170 C.2 1 UNL1 -0.0300 + 9 N -26.6350 -5.9580 -20.9580 N.ar 1 UNL1 -0.2230 + 10 CA -26.4100 -7.1930 -20.3210 C.ar 1 UNL1 -0.0140 + 11 H -25.9200 -5.4610 -21.4690 H 1 UNL1 0.2970 + 12 C -25.0790 -7.8740 -20.3690 C.2 1 UNL1 0.9180 + 13 OXT -24.7840 -8.4050 -21.4290 O.co2 1 UNL1 -0.8120 + 14 O -24.3420 -7.9120 -19.3980 O.co2 1 UNL1 -0.8120 + 15 C -27.5560 -10.1180 -19.6900 C.3 1 UNL1 -0.0190 + 16 C -28.7780 -10.6550 -20.4780 C.3 1 UNL1 0.2750 + 17 O -29.8790 -9.7220 -20.3690 O.2 1 UNL1 -0.3530 + 18 C -31.1130 -10.0960 -19.8780 C.2 1 UNL1 0.1180 + 19 C -32.2190 -10.0950 -20.7400 C.2 1 UNL1 -0.0080 + 20 C -33.4970 -10.4310 -20.2520 C.2 1 UNL1 -0.0380 + 21 C -33.6910 -10.7640 -18.9000 C.2 1 UNL1 0.3580 + 22 N -34.9290 -11.0600 -18.4530 N.2 1 UNL1 -0.6790 + 23 C -32.5670 -10.7720 -18.0430 C.2 1 UNL1 -0.1170 + 24 C -35.0870 -11.3610 -17.1500 C.2 1 UNL1 0.3890 + 25 C -34.0240 -11.3800 -16.2330 C.2 1 UNL1 -0.1390 + 26 C -32.7300 -11.0780 -16.6840 C.2 1 UNL1 0.1450 + 27 C -31.2900 -10.4590 -18.5340 C.2 1 UNL1 0.0340 +@BOND + 1 11 9 1 + 2 13 12 ar + 3 8 7 2 + 4 8 5 1 + 5 9 5 ar + 6 9 10 ar + 7 19 20 1 + 8 19 18 2 + 9 7 6 1 + 10 5 3 ar + 11 16 17 1 + 12 16 15 1 + 13 17 18 1 + 14 12 10 1 + 15 12 14 ar + 16 10 2 ar + 17 20 21 2 + 18 3 2 ar + 19 3 4 1 + 20 6 4 2 + 21 18 27 1 + 22 2 1 1 + 23 15 1 1 + 24 21 22 1 + 25 21 23 1 + 26 27 23 2 + 27 22 24 2 + 28 23 26 1 + 29 24 25 1 + 30 26 25 2 +########## Name: lig_48 +########## Vina_BE: -9.152 +########## MW: 318.241 +########## clogP: 1.356 +########## nonHatoms: 27 +########## Vina_LE: -0.339 +########## Vina_LipE: -10.508 +########## Close_contacts: 0 +########## Hydrophob_contacts: 26 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_48.pdbqt + 27 30 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -28.0330 -9.1500 -19.1570 C.3 1 UNL1 0.1070 + 2 C -27.7810 -7.7850 -19.7440 C.ar 1 UNL1 -0.1800 + 3 C -28.6440 -6.6440 -19.9530 C.ar 1 UNL1 -0.0710 + 4 C -30.0010 -6.4770 -19.6480 C.2 1 UNL1 0.0260 + 5 C -27.9170 -5.6320 -20.5490 C.ar 1 UNL1 -0.0400 + 6 C -30.6070 -5.2450 -19.9660 C.2 1 UNL1 -0.0710 + 7 C -29.8600 -4.2110 -20.5770 C.2 1 UNL1 -0.0360 + 8 C -28.4950 -4.3990 -20.8760 C.2 1 UNL1 -0.0330 + 9 N -26.6110 -6.0330 -20.7550 N.ar 1 UNL1 -0.2150 + 10 CA -26.5030 -7.3420 -20.2780 C.ar 1 UNL1 0.0420 + 11 H -25.8460 -5.5250 -21.1740 H 1 UNL1 0.3100 + 12 C -25.2110 -8.0870 -20.3670 C.2 1 UNL1 0.8440 + 13 O -24.8200 -8.3570 -21.4940 O.co2 1 UNL1 -0.8220 + 14 OXT -24.5970 -8.4180 -19.3640 O.co2 1 UNL1 -0.8220 + 15 C -27.9320 -10.2700 -20.2210 C.3 1 UNL1 -0.0260 + 16 C -29.2990 -10.7910 -20.7230 C.3 1 UNL1 0.2890 + 17 O -30.3510 -9.8270 -20.4980 O.2 1 UNL1 -0.3500 + 18 C -31.6320 -10.1420 -20.0980 C.2 1 UNL1 0.1940 + 19 C -32.6320 -10.1760 -21.0900 C.2 1 UNL1 -0.0790 + 20 C -33.9640 -10.5280 -20.7770 C.2 1 UNL1 0.0210 + 21 C -34.3160 -10.8690 -19.4580 C.2 1 UNL1 -0.0830 + 22 C -33.3090 -10.8470 -18.4870 C.2 1 UNL1 -0.0070 + 23 N -33.4410 -11.1440 -17.1420 N.pl3 1 UNL1 -0.2530 + 24 C -31.9980 -10.4980 -18.7830 C.2 1 UNL1 -0.1320 + 25 C -32.1610 -10.9420 -16.6450 C.2 1 UNL1 0.0400 + 26 C -31.2730 -10.5660 -17.6060 C.2 1 UNL1 0.0740 + 27 H -34.2800 -11.3650 -16.6340 H 1 UNL1 0.2770 +@BOND + 1 13 12 ar + 2 11 9 1 + 3 19 20 1 + 4 19 18 2 + 5 8 7 2 + 6 8 5 1 + 7 20 21 2 + 8 9 5 ar + 9 9 10 ar + 10 16 17 1 + 11 16 15 1 + 12 7 6 1 + 13 5 3 ar + 14 17 18 1 + 15 12 10 1 + 16 12 14 ar + 17 10 2 ar + 18 15 1 1 + 19 18 24 1 + 20 6 4 2 + 21 3 2 ar + 22 3 4 1 + 23 2 1 1 + 24 21 22 1 + 25 24 22 2 + 26 24 26 1 + 27 22 23 1 + 28 26 25 2 + 29 23 25 1 + 30 23 27 1 +########## Name: lig_49 +########## Vina_BE: -8.973 +########## MW: 362.122 +########## clogP: 3.003 +########## nonHatoms: 26 +########## Vina_LE: -0.345 +########## Vina_LipE: -11.976 +########## Close_contacts: 1 +########## Hydrophob_contacts: 17 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_49.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -31.1520 -10.1560 -19.7070 C.ar 1 UNL1 -0.1740 + 2 CA -30.1060 -10.1110 -18.7000 C.ar 1 UNL1 0.0510 + 3 N -30.6330 -10.3930 -17.4400 N.ar 1 UNL1 -0.2090 + 4 C -31.9770 -10.6540 -17.6150 C.ar 1 UNL1 -0.0400 + 5 C -32.8910 -11.0190 -16.6190 C.2 1 UNL1 -0.0230 + 6 C -34.2200 -11.2730 -17.0030 C.2 1 UNL1 -0.0280 + 7 C -34.5990 -11.1630 -18.3590 C.2 1 UNL1 -0.0470 + 8 C -33.6630 -10.7960 -19.3470 C.2 1 UNL1 0.0560 + 9 CL -34.2020 -10.7100 -21.0130 Cl 1 UNL1 -0.1430 + 10 C -32.3350 -10.5350 -18.9470 C.ar 1 UNL1 -0.0600 + 11 H -30.0780 -10.4250 -16.5990 H 1 UNL1 0.3140 + 12 C -28.6500 -9.8310 -18.8660 C.2 1 UNL1 0.8390 + 13 O -28.2160 -8.8700 -18.2450 O.co2 1 UNL1 -0.8100 + 14 OXT -27.9470 -10.5470 -19.5580 O.co2 1 UNL1 -0.8100 + 15 C -30.9080 -9.8680 -21.1690 C.3 1 UNL1 0.1160 + 16 C -30.2510 -8.4830 -21.3860 C.3 1 UNL1 0.0410 + 17 C -31.0340 -7.3280 -20.7320 C.3 1 UNL1 0.2120 + 18 O -30.2750 -6.8230 -19.6200 O.2 1 UNL1 -0.3330 + 19 C -29.3950 -5.7870 -19.8010 C.2 1 UNL1 0.1530 + 20 C -28.1100 -6.0200 -20.3160 C.2 1 UNL1 -0.0300 + 21 C -27.2170 -4.9490 -20.5140 C.2 1 UNL1 -0.0340 + 22 C -25.8300 -5.2170 -21.0790 C.3 1 UNL1 0.0910 + 23 C -27.6310 -3.6390 -20.1910 C.2 1 UNL1 -0.0280 + 24 C -28.9230 -3.4070 -19.6870 C.2 1 UNL1 0.0370 + 25 CL -26.5630 -2.2660 -20.4170 Cl 1 UNL1 -0.1260 + 26 C -29.8060 -4.4840 -19.4980 C.2 1 UNL1 -0.0160 +@BOND + 1 16 15 1 + 2 16 17 1 + 3 15 1 1 + 4 22 21 1 + 5 9 8 1 + 6 17 18 1 + 7 21 20 1 + 8 21 23 2 + 9 25 23 1 + 10 20 19 2 + 11 23 24 1 + 12 19 18 1 + 13 19 26 1 + 14 1 10 ar + 15 1 2 ar + 16 24 26 2 + 17 14 12 ar + 18 8 10 1 + 19 8 7 2 + 20 10 4 ar + 21 12 2 1 + 22 12 13 ar + 23 2 3 ar + 24 7 6 1 + 25 4 3 ar + 26 4 5 1 + 27 3 11 1 + 28 6 5 2 +########## Name: lig_50 +########## Vina_BE: -8.657 +########## MW: 374.133 +########## clogP: 3.158 +########## nonHatoms: 27 +########## Vina_LE: -0.321 +########## Vina_LipE: -11.815 +########## Close_contacts: 1 +########## Hydrophob_contacts: 15 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_50.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -31.1780 -10.0000 -19.5280 C.ar 1 UNL1 -0.1640 + 2 CA -30.1760 -9.9050 -18.5500 C.ar 1 UNL1 -0.0500 + 3 N -30.7090 -10.3850 -17.3430 N.ar 1 UNL1 -0.2090 + 4 C -32.0200 -10.7440 -17.5470 C.ar 1 UNL1 -0.0360 + 5 C -32.9230 -11.2440 -16.6010 C.2 1 UNL1 -0.0240 + 6 C -34.2350 -11.5220 -17.0310 C.2 1 UNL1 -0.0220 + 7 C -34.6050 -11.2870 -18.3740 C.2 1 UNL1 -0.0480 + 8 C -33.6730 -10.7790 -19.3040 C.2 1 UNL1 0.0590 + 9 CL -34.2150 -10.4820 -20.9440 Cl 1 UNL1 -0.1270 + 10 C -32.3600 -10.5200 -18.8580 C.ar 1 UNL1 -0.0630 + 11 H -30.1810 -10.4160 -16.4830 H 1 UNL1 0.3140 + 12 C -28.7740 -9.4000 -18.6470 C.2 1 UNL1 0.9330 + 13 OXT -28.5830 -8.2770 -18.2030 O.co2 1 UNL1 -0.8180 + 14 O -27.8900 -10.0620 -19.1650 O.co2 1 UNL1 -0.8180 + 15 C -30.9840 -9.6180 -20.9780 C.3 1 UNL1 0.1110 + 16 C -31.1340 -8.0920 -21.2080 C.3 1 UNL1 -0.0170 + 17 C -29.7890 -7.4050 -21.5130 C.3 1 UNL1 0.2780 + 18 O -29.6270 -6.2900 -20.6150 O.2 1 UNL1 -0.3480 + 19 C -28.4150 -5.6530 -20.5140 C.2 1 UNL1 0.1430 + 20 C -28.3210 -4.3620 -19.9710 C.2 1 UNL1 -0.0060 + 21 C -27.0700 -3.7290 -19.8590 C.2 1 UNL1 -0.0430 + 22 C -26.9980 -2.3260 -19.2710 C.3 1 UNL1 0.0850 + 23 C -25.9070 -4.4060 -20.2880 C.2 1 UNL1 -0.0300 + 24 C -25.9990 -5.7120 -20.8190 C.2 1 UNL1 -0.0430 + 25 CL -24.3380 -3.6260 -20.1520 Cl 1 UNL1 -0.1380 + 26 C -27.2590 -6.3280 -20.9230 C.2 1 UNL1 -0.0060 + 27 C -24.7560 -6.4650 -21.2740 C.3 1 UNL1 0.0850 +@BOND + 1 17 16 1 + 2 17 18 1 + 3 27 24 1 + 4 16 15 1 + 5 15 1 1 + 6 9 8 1 + 7 26 24 1 + 8 26 19 2 + 9 24 23 2 + 10 18 19 1 + 11 19 20 1 + 12 23 25 1 + 13 23 21 1 + 14 20 21 2 + 15 21 22 1 + 16 1 10 ar + 17 1 2 ar + 18 8 10 1 + 19 8 7 2 + 20 14 12 ar + 21 10 4 ar + 22 12 2 1 + 23 12 13 ar + 24 2 3 ar + 25 7 6 1 + 26 4 3 ar + 27 4 5 1 + 28 3 11 1 + 29 6 5 2 +########## Name: lig_52 +########## Vina_BE: -8.799 +########## MW: 362.122 +########## clogP: 1.35 +########## nonHatoms: 26 +########## Vina_LE: -0.338 +########## Vina_LipE: -10.149 +########## Close_contacts: 1 +########## Hydrophob_contacts: 25 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_52.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.3280 -7.8690 -19.8770 C.ar 1 UNL1 -0.1740 + 2 CA -26.1750 -7.2120 -20.4660 C.ar 1 UNL1 0.0510 + 3 N -26.4810 -5.8840 -20.7800 N.ar 1 UNL1 -0.2090 + 4 C -27.7810 -5.6620 -20.3640 C.ar 1 UNL1 -0.0400 + 5 C -28.5020 -4.4630 -20.4150 C.2 1 UNL1 -0.0230 + 6 C -29.8120 -4.4600 -19.8950 C.2 1 UNL1 -0.1420 + 7 CL -30.7560 -2.9870 -19.9270 Cl 1 UNL1 -0.1430 + 8 C -30.3650 -5.6340 -19.3390 C.2 1 UNL1 -0.0570 + 9 C -29.6170 -6.8280 -19.3000 C.2 1 UNL1 0.1800 + 10 C -28.3180 -6.8140 -19.8260 C.ar 1 UNL1 -0.0600 + 11 H -25.8220 -5.2340 -21.1820 H 1 UNL1 0.3140 + 12 C -24.8120 -7.7670 -20.7120 C.2 1 UNL1 0.8390 + 13 OXT -24.0570 -7.9960 -19.7810 O.co2 1 UNL1 -0.8100 + 14 O -24.5050 -7.9470 -21.8800 O.co2 1 UNL1 -0.8100 + 15 C -27.3350 -9.2810 -19.3460 C.3 1 UNL1 0.1160 + 16 C -27.8710 -10.2950 -20.3830 C.3 1 UNL1 0.0410 + 17 C -29.3980 -10.4960 -20.3020 C.3 1 UNL1 0.2120 + 18 O -29.8210 -10.2370 -18.9490 O.2 1 UNL1 -0.3330 + 19 C -31.0870 -10.5160 -18.4850 C.2 1 UNL1 0.1530 + 20 C -32.1380 -10.4790 -19.4120 C.2 1 UNL1 -0.0300 + 21 C -33.4640 -10.7280 -19.0100 C.2 1 UNL1 -0.0340 + 22 C -34.5880 -10.6760 -20.0330 C.3 1 UNL1 0.0910 + 23 C -33.7290 -11.0160 -17.6550 C.2 1 UNL1 -0.0280 + 24 C -32.6800 -11.0450 -16.7200 C.2 1 UNL1 0.0370 + 25 CL -35.3590 -11.3370 -17.0940 Cl 1 UNL1 -0.1260 + 26 C -31.3600 -10.7940 -17.1310 C.2 1 UNL1 -0.0160 +@BOND + 1 14 12 ar + 2 11 3 1 + 3 3 2 ar + 4 3 4 ar + 5 12 2 1 + 6 12 13 ar + 7 2 1 ar + 8 5 4 2 + 9 5 6 1 + 10 16 17 1 + 11 16 15 1 + 12 4 10 ar + 13 17 18 1 + 14 22 21 1 + 15 7 6 1 + 16 6 8 2 + 17 1 10 ar + 18 1 15 1 + 19 10 9 2 + 20 20 21 1 + 21 20 19 2 + 22 8 9 1 + 23 21 23 2 + 24 18 19 1 + 25 19 26 1 + 26 23 25 1 + 27 23 24 1 + 28 26 24 2 +########## Name: lig_53 +########## Vina_BE: -8.861 +########## MW: 374.133 +########## clogP: 1.505 +########## nonHatoms: 27 +########## Vina_LE: -0.328 +########## Vina_LipE: -10.366 +########## Close_contacts: 1 +########## Hydrophob_contacts: 19 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_53.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -26.7870 -7.2990 -20.3940 C.ar 1 UNL1 -0.1640 + 2 CA -25.7740 -6.3910 -20.7320 C.ar 1 UNL1 -0.0500 + 3 N -26.3230 -5.0970 -20.6740 N.ar 1 UNL1 -0.2090 + 4 C -27.6520 -5.1930 -20.3210 C.ar 1 UNL1 -0.0360 + 5 C -28.5900 -4.1660 -20.1580 C.2 1 UNL1 -0.0240 + 6 C -29.9020 -4.5320 -19.7980 C.2 1 UNL1 -0.1370 + 7 CL -31.1210 -3.2960 -19.5780 Cl 1 UNL1 -0.1270 + 8 C -30.2420 -5.8920 -19.6130 C.2 1 UNL1 -0.0580 + 9 C -29.2710 -6.9010 -19.7870 C.2 1 UNL1 0.1840 + 10 C -27.9730 -6.5130 -20.1440 C.ar 1 UNL1 -0.0630 + 11 H -25.7960 -4.2600 -20.8790 H 1 UNL1 0.3140 + 12 C -24.3530 -6.6510 -21.1060 C.2 1 UNL1 0.9330 + 13 O -24.0060 -6.7000 -22.2750 O.co2 1 UNL1 -0.8180 + 14 OXT -23.5720 -6.7930 -20.1760 O.co2 1 UNL1 -0.8180 + 15 C -26.6210 -8.7970 -20.3470 C.3 1 UNL1 0.1110 + 16 C -27.4610 -9.4420 -19.2150 C.3 1 UNL1 -0.0170 + 17 C -28.2880 -10.6470 -19.7040 C.3 1 UNL1 0.2780 + 18 O -29.4140 -10.1590 -20.4620 O.2 1 UNL1 -0.3480 + 19 C -30.6910 -10.3210 -19.9830 C.2 1 UNL1 0.1430 + 20 C -31.8000 -10.2710 -20.8430 C.2 1 UNL1 -0.0060 + 21 C -33.0990 -10.4540 -20.3360 C.2 1 UNL1 -0.0430 + 22 C -34.2850 -10.3860 -21.2900 C.3 1 UNL1 0.0850 + 23 C -33.2800 -10.7010 -18.9570 C.2 1 UNL1 -0.0300 + 24 C -32.1640 -10.7700 -18.0940 C.2 1 UNL1 -0.0430 + 25 CL -34.8990 -10.9350 -18.3130 Cl 1 UNL1 -0.1380 + 26 C -30.8720 -10.5830 -18.6200 C.2 1 UNL1 -0.0060 + 27 C -32.3370 -11.0470 -16.6070 C.3 1 UNL1 0.0850 +@BOND + 1 13 12 ar + 2 22 21 1 + 3 12 2 1 + 4 12 14 ar + 5 11 3 1 + 6 20 21 1 + 7 20 19 2 + 8 2 3 ar + 9 2 1 ar + 10 3 4 ar + 11 18 19 1 + 12 18 17 1 + 13 1 15 1 + 14 1 10 ar + 15 15 16 1 + 16 21 23 2 + 17 4 5 2 + 18 4 10 ar + 19 5 6 1 + 20 10 9 2 + 21 19 26 1 + 22 6 8 2 + 23 6 7 1 + 24 9 8 1 + 25 17 16 1 + 26 23 25 1 + 27 23 24 1 + 28 26 24 2 + 29 24 27 1 +########## Name: lig_56 +########## Vina_BE: -9.061 +########## MW: 349.683 +########## clogP: 0.609 +########## nonHatoms: 26 +########## Vina_LE: -0.348 +########## Vina_LipE: -9.67 +########## Close_contacts: 0 +########## Hydrophob_contacts: 28 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_56.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.4320 -7.3240 -19.8320 C.ar 1 UNL1 -0.1970 + 2 C -26.2840 -6.8300 -20.5810 C.ar 1 UNL1 0.0660 + 3 N -26.5990 -5.5820 -21.1640 N.ar 1 UNL1 -0.0970 + 4 C -25.7490 -4.7550 -22.0340 C.3 1 UNL1 0.1750 + 5 C -27.8940 -5.2700 -20.7630 C.ar 1 UNL1 -0.0460 + 6 C -28.6400 -4.1120 -21.0420 C.2 1 UNL1 -0.0230 + 7 C -29.9360 -4.0050 -20.5010 C.2 1 UNL1 -0.0410 + 8 C -30.4630 -5.0360 -19.6940 C.2 1 UNL1 -0.0640 + 9 C -29.6980 -6.1880 -19.4240 C.2 1 UNL1 0.0090 + 10 C -28.4140 -6.2780 -19.9770 C.ar 1 UNL1 -0.0690 + 11 C -24.9500 -7.5110 -20.7200 C.2 1 UNL1 0.8400 + 12 O -24.0620 -7.2940 -19.9110 O.co2 1 UNL1 -0.8120 + 13 O -24.7630 -8.2590 -21.6700 O.co2 1 UNL1 -0.8120 + 14 C -27.4860 -8.6230 -19.0640 C.3 1 UNL1 0.0980 + 15 C -27.2430 -9.8520 -19.9690 C.3 1 UNL1 0.0270 + 16 C -28.5370 -10.6010 -20.3450 C.3 1 UNL1 0.2560 + 17 O -29.6420 -9.6790 -20.2610 O.2 1 UNL1 -0.3370 + 18 C -30.8880 -10.0620 -19.8200 C.2 1 UNL1 0.1610 + 19 C -31.0310 -10.3840 -18.4650 C.2 1 UNL1 -0.0360 + 20 C -32.2780 -10.7810 -17.9490 C.2 1 UNL1 -0.0350 + 21 C -32.3980 -11.1440 -16.4770 C.3 1 UNL1 0.0850 + 22 C -33.3960 -10.8410 -18.8100 C.2 1 UNL1 -0.0350 + 23 C -33.2600 -10.5100 -20.1760 C.2 1 UNL1 -0.0350 + 24 CL -34.9620 -11.3260 -18.1770 Cl 1 UNL1 -0.1280 + 25 C -32.0020 -10.1230 -20.6740 C.2 1 UNL1 -0.0360 + 26 C -34.4550 -10.5660 -21.1190 C.3 1 UNL1 0.0850 +@BOND + 1 4 3 1 + 2 13 11 ar + 3 3 5 ar + 4 3 2 ar + 5 26 23 1 + 6 6 5 2 + 7 6 7 1 + 8 5 10 ar + 9 11 2 1 + 10 11 12 ar + 11 25 23 1 + 12 25 18 2 + 13 2 1 ar + 14 7 8 2 + 15 16 17 1 + 16 16 15 1 + 17 17 18 1 + 18 23 22 2 + 19 10 1 ar + 20 10 9 2 + 21 15 14 1 + 22 1 14 1 + 23 18 19 1 + 24 8 9 1 + 25 22 24 1 + 26 22 20 1 + 27 19 20 2 + 28 20 21 1 +########## Name: lig_58 +########## Vina_BE: -8.962 +########## MW: 385.136 +########## clogP: 1.372 +########## nonHatoms: 27 +########## Vina_LE: -0.332 +########## Vina_LipE: -10.334 +########## Close_contacts: 2 +########## Hydrophob_contacts: 19 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_58.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -26.7910 -7.2850 -20.3790 C.ar 1 UNL1 -0.1800 + 2 C -25.7520 -6.3230 -20.7240 C.ar 1 UNL1 0.0600 + 3 N -26.2820 -5.0150 -20.6740 N.ar 1 UNL1 -0.0930 + 4 C -25.5780 -3.7490 -20.9350 C.3 1 UNL1 0.1810 + 5 C -27.6230 -5.1410 -20.3260 C.ar 1 UNL1 -0.0420 + 6 C -28.5820 -4.1260 -20.1680 C.2 1 UNL1 0.0010 + 7 C -29.8940 -4.4990 -19.8170 C.2 1 UNL1 0.0120 + 8 CL -31.1200 -3.2660 -19.6100 Cl 1 UNL1 -0.1500 + 9 C -30.2310 -5.8560 -19.6340 C.2 1 UNL1 -0.0410 + 10 C -29.2560 -6.8590 -19.7990 C.2 1 UNL1 0.0370 + 11 C -27.9550 -6.4680 -20.1460 C.ar 1 UNL1 -0.0650 + 12 C -24.3280 -6.6400 -21.0910 C.2 1 UNL1 0.8390 + 13 O -23.5220 -6.8570 -20.1990 O.co2 1 UNL1 -0.8140 + 14 O -23.9820 -6.6720 -22.2620 O.co2 1 UNL1 -0.8140 + 15 C -26.6080 -8.7810 -20.3430 C.3 1 UNL1 0.1100 + 16 C -27.4390 -9.4420 -19.2140 C.3 1 UNL1 -0.0230 + 17 C -28.3000 -10.6180 -19.7190 C.3 1 UNL1 0.2740 + 18 O -29.4150 -10.0930 -20.4660 O.2 1 UNL1 -0.3490 + 19 C -30.6990 -10.2660 -20.0090 C.2 1 UNL1 0.1360 + 20 C -31.7950 -10.2340 -20.8860 C.2 1 UNL1 -0.0030 + 21 C -33.1000 -10.4280 -20.4010 C.2 1 UNL1 -0.0420 + 22 C -34.2700 -10.3780 -21.3750 C.3 1 UNL1 0.0890 + 23 C -33.3010 -10.6680 -19.0240 C.2 1 UNL1 -0.0280 + 24 C -32.2000 -10.7190 -18.1420 C.2 1 UNL1 -0.0420 + 25 CL -34.9290 -10.9130 -18.4050 Cl 1 UNL1 -0.1370 + 26 C -30.9010 -10.5220 -18.6480 C.2 1 UNL1 -0.0030 + 27 C -32.3940 -10.9880 -16.6560 C.3 1 UNL1 0.0890 +@BOND + 1 14 12 ar + 2 22 21 1 + 3 12 2 1 + 4 12 13 ar + 5 4 3 1 + 6 20 21 1 + 7 20 19 2 + 8 2 3 ar + 9 2 1 ar + 10 3 5 ar + 11 18 19 1 + 12 18 17 1 + 13 21 23 2 + 14 1 15 1 + 15 1 11 ar + 16 15 16 1 + 17 5 6 2 + 18 5 11 ar + 19 6 7 1 + 20 11 10 2 + 21 19 26 1 + 22 7 9 2 + 23 7 8 1 + 24 10 9 1 + 25 17 16 1 + 26 23 25 1 + 27 23 24 1 + 28 26 24 2 + 29 24 27 1 +########## Name: lig_60 +########## Vina_BE: -9.012 +########## MW: 355.73 +########## clogP: 1.475 +########## nonHatoms: 25 +########## Vina_LE: -0.36 +########## Vina_LipE: -10.487 +########## Close_contacts: 1 +########## Hydrophob_contacts: 28 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_60.pdbqt + 25 27 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.7020 -8.6080 -18.9470 C.3 1 UNL1 0.0980 + 2 C -27.4520 -7.3600 -19.7670 C.ar 1 UNL1 -0.1170 + 3 C -26.2380 -7.0840 -20.4130 C.ar 1 UNL1 -0.0730 + 4 S -26.2580 -5.5480 -21.3240 S.2 1 UNL1 0.0590 + 5 C -27.9100 -5.2580 -20.7760 C.ar 1 UNL1 -0.1180 + 6 C -28.6800 -4.1250 -21.0780 C.2 1 UNL1 0.0270 + 7 C -28.4030 -6.2770 -19.9830 C.ar 1 UNL1 -0.0690 + 8 C -29.9800 -4.0260 -20.5500 C.2 1 UNL1 -0.0420 + 9 C -30.4890 -5.0590 -19.7380 C.2 1 UNL1 -0.0390 + 10 C -29.7020 -6.1900 -19.4530 C.2 1 UNL1 0.0130 + 11 C -24.9930 -7.9020 -20.4090 C.2 1 UNL1 0.9090 + 12 O -24.2480 -7.9100 -19.4420 O.co2 1 UNL1 -0.8140 + 13 O -24.7320 -8.5330 -21.4220 O.co2 1 UNL1 -0.8140 + 14 C -27.3110 -9.9040 -19.6980 C.3 1 UNL1 0.0340 + 15 C -28.5080 -10.6020 -20.3750 C.3 1 UNL1 0.2510 + 16 O -29.6360 -9.7080 -20.3350 O.2 1 UNL1 -0.3350 + 17 C -30.8520 -10.0730 -19.8040 C.2 1 UNL1 0.1600 + 18 C -31.9520 -10.1170 -20.6670 C.2 1 UNL1 -0.0360 + 19 C -33.2260 -10.4720 -20.1900 C.2 1 UNL1 -0.0340 + 20 C -34.4080 -10.4880 -21.1490 C.3 1 UNL1 0.0860 + 21 C -33.3860 -10.8020 -18.8260 C.2 1 UNL1 -0.0340 + 22 C -32.2780 -10.7700 -17.9530 C.2 1 UNL1 -0.0340 + 23 CL -34.9720 -11.2570 -18.2170 Cl 1 UNL1 -0.1270 + 24 C -31.0140 -10.4030 -18.4470 C.2 1 UNL1 -0.0360 + 25 C -32.4310 -11.1260 -16.4790 C.3 1 UNL1 0.0860 +@BOND + 1 13 11 ar + 2 4 5 ar + 3 4 3 ar + 4 20 19 1 + 5 6 5 2 + 6 6 8 1 + 7 5 7 ar + 8 18 19 1 + 9 18 17 2 + 10 8 9 2 + 11 3 11 1 + 12 3 2 ar + 13 11 12 ar + 14 15 16 1 + 15 15 14 1 + 16 16 17 1 + 17 19 21 2 + 18 7 2 ar + 19 7 10 2 + 20 17 24 1 + 21 2 1 1 + 22 9 10 1 + 23 14 1 1 + 24 21 23 1 + 25 21 22 1 + 26 24 22 2 + 27 22 25 1 +########## Name: lig_61 +########## Vina_BE: -8.64 +########## MW: 391.183 +########## clogP: 3.892 +########## nonHatoms: 26 +########## Vina_LE: -0.332 +########## Vina_LipE: -12.532 +########## Close_contacts: 0 +########## Hydrophob_contacts: 22 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_61.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.4180 -6.8770 -20.5210 C.ar 1 UNL1 -0.1210 + 2 C -26.0990 -6.4220 -20.6710 C.ar 1 UNL1 -0.3280 + 3 S -25.8990 -4.6850 -20.3850 S.2 1 UNL1 0.2480 + 4 C -27.6400 -4.5490 -20.1380 C.ar 1 UNL1 -0.0670 + 5 C -28.2960 -3.3360 -19.8780 C.2 1 UNL1 0.0330 + 6 C -29.6910 -3.3350 -19.7340 C.2 1 UNL1 -0.0310 + 7 C -30.4050 -4.5380 -19.8690 C.2 1 UNL1 -0.0180 + 8 C -29.7360 -5.7500 -20.1330 C.2 1 UNL1 0.0490 + 9 CL -30.7580 -7.1610 -20.3340 Cl 1 UNL1 -0.1180 + 10 C -28.3220 -5.7520 -20.2520 C.ar 1 UNL1 -0.0270 + 11 C -24.8720 -7.1830 -21.0210 C.2 1 UNL1 0.9220 + 12 O -24.1130 -7.4390 -20.1010 O.co2 1 UNL1 -0.8090 + 13 O -24.6250 -7.5030 -22.1710 O.co2 1 UNL1 -0.8090 + 14 C -27.7530 -8.3510 -20.6040 C.3 1 UNL1 0.1020 + 15 C -27.5630 -9.0720 -19.2460 C.3 1 UNL1 -0.0120 + 16 C -28.2850 -10.4330 -19.1970 C.3 1 UNL1 0.2760 + 17 O -29.3760 -10.4190 -20.1410 O.2 1 UNL1 -0.3520 + 18 C -30.6740 -10.5310 -19.7040 C.2 1 UNL1 0.1360 + 19 C -30.9690 -10.7140 -18.3430 C.2 1 UNL1 -0.0060 + 20 C -32.3060 -10.8110 -17.9150 C.2 1 UNL1 -0.0400 + 21 C -32.5980 -11.0180 -16.4350 C.3 1 UNL1 0.0910 + 22 C -33.3500 -10.7100 -18.8620 C.2 1 UNL1 -0.0280 + 23 C -33.0530 -10.5060 -20.2270 C.2 1 UNL1 -0.0400 + 24 CL -35.0240 -10.8280 -18.3380 Cl 1 UNL1 -0.1390 + 25 C -31.7110 -10.4140 -20.6370 C.2 1 UNL1 -0.0060 + 26 C -34.1640 -10.3830 -21.2630 C.3 1 UNL1 0.0910 +@BOND + 1 13 11 ar + 2 26 23 1 + 3 11 2 1 + 4 11 12 ar + 5 2 1 ar + 6 2 3 ar + 7 25 23 1 + 8 25 18 2 + 9 14 1 1 + 10 14 15 1 + 11 1 10 ar + 12 3 4 ar + 13 9 8 1 + 14 10 4 ar + 15 10 8 1 + 16 23 22 2 + 17 17 18 1 + 18 17 16 1 + 19 4 5 1 + 20 8 7 2 + 21 5 6 2 + 22 7 6 1 + 23 18 19 1 + 24 15 16 1 + 25 22 24 1 + 26 22 20 1 + 27 19 20 2 + 28 20 21 1 +########## Name: lig_63 +########## Vina_BE: -8.467 +########## MW: 391.183 +########## clogP: 3.783 +########## nonHatoms: 26 +########## Vina_LE: -0.326 +########## Vina_LipE: -12.25 +########## Close_contacts: 2 +########## Hydrophob_contacts: 21 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_63.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -26.8870 -7.0670 -20.4840 C.ar 1 UNL1 -0.1210 + 2 C -25.7520 -6.2690 -20.6750 C.ar 1 UNL1 -0.3280 + 3 S -26.0640 -4.5270 -20.5100 S.2 1 UNL1 0.2480 + 4 C -27.7710 -4.8810 -20.2230 C.ar 1 UNL1 -0.0670 + 5 C -28.7780 -3.9270 -20.0040 C.2 1 UNL1 0.0330 + 6 C -30.0980 -4.3690 -19.8040 C.2 1 UNL1 -0.1500 + 7 CL -31.3770 -3.2040 -19.5320 Cl 1 UNL1 -0.1180 + 8 C -30.3950 -5.7450 -19.8280 C.2 1 UNL1 -0.0270 + 9 C -29.3710 -6.6850 -20.0480 C.2 1 UNL1 0.1770 + 10 C -28.0530 -6.2350 -20.2410 C.ar 1 UNL1 -0.0270 + 11 C -24.3680 -6.6930 -20.9970 C.2 1 UNL1 0.9220 + 12 O -24.0800 -6.7500 -22.1800 O.co2 1 UNL1 -0.8090 + 13 O -23.5810 -6.9880 -20.1150 O.co2 1 UNL1 -0.8090 + 14 C -26.8540 -8.5770 -20.5440 C.3 1 UNL1 0.1020 + 15 C -27.0940 -9.2080 -19.1540 C.3 1 UNL1 -0.0120 + 16 C -28.0810 -10.3870 -19.2150 C.3 1 UNL1 0.2760 + 17 O -29.1410 -10.0560 -20.1320 O.2 1 UNL1 -0.3520 + 18 C -30.4450 -10.2400 -19.7520 C.2 1 UNL1 0.1360 + 19 C -30.7280 -10.5480 -18.4170 C.2 1 UNL1 -0.0060 + 20 C -32.0570 -10.7390 -17.9970 C.2 1 UNL1 -0.0400 + 21 C -32.3420 -11.0860 -16.5420 C.3 1 UNL1 0.0910 + 22 C -33.1050 -10.6080 -18.9350 C.2 1 UNL1 -0.0280 + 23 C -32.8220 -10.2910 -20.2810 C.2 1 UNL1 -0.0400 + 24 CL -34.7710 -10.8420 -18.4220 Cl 1 UNL1 -0.1390 + 25 C -31.4850 -10.1080 -20.6820 C.2 1 UNL1 -0.0060 + 26 C -33.9380 -10.1450 -21.3060 C.3 1 UNL1 0.0910 +@BOND + 1 12 11 ar + 2 26 23 1 + 3 11 2 1 + 4 11 13 ar + 5 25 23 1 + 6 25 18 2 + 7 2 3 ar + 8 2 1 ar + 9 14 1 1 + 10 14 15 1 + 11 3 4 ar + 12 1 10 ar + 13 23 22 2 + 14 10 4 ar + 15 10 9 1 + 16 4 5 1 + 17 17 18 1 + 18 17 16 1 + 19 9 8 2 + 20 5 6 2 + 21 8 6 1 + 22 6 7 1 + 23 18 19 1 + 24 16 15 1 + 25 22 24 1 + 26 22 20 1 + 27 19 20 2 + 28 20 21 1 +########## Name: lig_65 +########## Vina_BE: -9.043 +########## MW: 391.183 +########## clogP: 2.165 +########## nonHatoms: 26 +########## Vina_LE: -0.348 +########## Vina_LipE: -11.208 +########## Close_contacts: 1 +########## Hydrophob_contacts: 24 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_65.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.4660 -7.6210 -19.6770 C.ar 1 UNL1 -0.1210 + 2 C -26.2170 -7.3970 -20.2690 C.ar 1 UNL1 -0.3280 + 3 S -26.1190 -5.8700 -21.1760 S.2 1 UNL1 0.2480 + 4 C -27.8160 -5.5500 -20.7880 C.ar 1 UNL1 -0.0670 + 5 C -28.5660 -4.4370 -21.2060 C.2 1 UNL1 -0.0920 + 6 CL -27.8500 -3.1780 -22.1930 Cl 1 UNL1 -0.1180 + 7 C -29.9160 -4.3420 -20.8260 C.2 1 UNL1 -0.0250 + 8 C -30.5000 -5.3550 -20.0410 C.2 1 UNL1 -0.0270 + 9 C -29.7340 -6.4640 -19.6320 C.2 1 UNL1 0.1770 + 10 C -28.3830 -6.5440 -20.0110 C.ar 1 UNL1 -0.0270 + 11 C -25.0110 -8.2600 -20.2360 C.2 1 UNL1 0.9220 + 12 O -24.8160 -8.9640 -21.2110 O.co2 1 UNL1 -0.8090 + 13 O -24.2760 -8.2700 -19.2630 O.co2 1 UNL1 -0.8090 + 14 C -27.7740 -8.8340 -18.8320 C.3 1 UNL1 0.1020 + 15 C -27.3850 -10.1440 -19.5540 C.3 1 UNL1 -0.0120 + 16 C -28.5660 -10.7550 -20.3300 C.3 1 UNL1 0.2760 + 17 O -29.6370 -9.7920 -20.3720 O.2 1 UNL1 -0.3520 + 18 C -30.8690 -10.1020 -19.8540 C.2 1 UNL1 0.1360 + 19 C -31.9690 -10.1530 -20.7180 C.2 1 UNL1 -0.0060 + 20 C -33.2470 -10.4770 -20.2270 C.2 1 UNL1 -0.0400 + 21 C -34.4320 -10.5110 -21.1830 C.3 1 UNL1 0.0910 + 22 C -33.4110 -10.7600 -18.8530 C.2 1 UNL1 -0.0280 + 23 C -32.3000 -10.7190 -17.9800 C.2 1 UNL1 -0.0400 + 24 CL -35.0010 -11.1700 -18.2260 Cl 1 UNL1 -0.1390 + 25 C -31.0310 -10.3890 -18.4900 C.2 1 UNL1 -0.0060 + 26 C -32.4550 -11.0250 -16.4970 C.3 1 UNL1 0.0910 +@BOND + 1 6 5 1 + 2 12 11 ar + 3 5 7 1 + 4 5 4 2 + 5 21 20 1 + 6 3 4 ar + 7 3 2 ar + 8 7 8 2 + 9 4 10 ar + 10 19 20 1 + 11 19 18 2 + 12 17 16 1 + 13 17 18 1 + 14 16 15 1 + 15 2 11 1 + 16 2 1 ar + 17 11 13 ar + 18 20 22 2 + 19 8 9 1 + 20 10 1 ar + 21 10 9 2 + 22 18 25 1 + 23 1 14 1 + 24 15 14 1 + 25 22 24 1 + 26 22 23 1 + 27 25 23 2 + 28 23 26 1 +########## Name: lig_67 +########## Vina_BE: -8.875 +########## MW: 339.665 +########## clogP: 1.007 +########## nonHatoms: 25 +########## Vina_LE: -0.355 +########## Vina_LipE: -9.882 +########## Close_contacts: 0 +########## Hydrophob_contacts: 25 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_67.pdbqt + 25 27 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.6650 -8.7690 -19.0410 C.3 1 UNL1 0.0980 + 2 C -27.5650 -7.4380 -19.7390 C.ar 1 UNL1 -0.2120 + 3 C -26.3730 -6.9280 -20.4000 C.ar 1 UNL1 0.0090 + 4 O -26.6030 -5.6880 -20.9650 O.2 1 UNL1 0.0590 + 5 C -27.9150 -5.3860 -20.6970 C.ar 1 UNL1 -0.1550 + 6 C -28.6130 -4.2310 -21.0760 C.2 1 UNL1 0.0130 + 7 C -28.5270 -6.3900 -19.9750 C.ar 1 UNL1 -0.0580 + 8 C -29.9680 -4.1190 -20.7000 C.2 1 UNL1 -0.0330 + 9 C -30.5940 -5.1490 -19.9620 C.2 1 UNL1 -0.0480 + 10 C -29.8720 -6.3020 -19.5920 C.2 1 UNL1 0.0180 + 11 C -25.0260 -7.5470 -20.5370 C.2 1 UNL1 0.9360 + 12 O -24.2040 -7.4430 -19.6380 O.co2 1 UNL1 -0.7970 + 13 O -24.7850 -8.1660 -21.5620 O.co2 1 UNL1 -0.7970 + 14 C -27.3040 -9.9490 -19.9780 C.3 1 UNL1 -0.0200 + 15 C -28.5250 -10.8140 -20.3410 C.3 1 UNL1 0.2790 + 16 O -29.6400 -9.9470 -20.6310 O.2 1 UNL1 -0.3530 + 17 C -30.8740 -10.1970 -20.0840 C.2 1 UNL1 0.1350 + 18 C -32.0220 -10.2700 -20.8890 C.2 1 UNL1 -0.0070 + 19 C -33.2750 -10.5430 -20.3150 C.2 1 UNL1 -0.0400 + 20 C -34.5050 -10.6100 -21.2110 C.3 1 UNL1 0.0930 + 21 C -33.3710 -10.7560 -18.9210 C.2 1 UNL1 -0.0270 + 22 C -32.2140 -10.7010 -18.1130 C.2 1 UNL1 -0.0400 + 23 CL -34.9330 -11.1000 -18.1910 Cl 1 UNL1 -0.1370 + 24 C -30.9690 -10.4240 -18.7060 C.2 1 UNL1 -0.0070 + 25 C -32.2940 -10.9380 -16.6110 C.3 1 UNL1 0.0930 +@BOND + 1 13 11 ar + 2 20 19 1 + 3 6 8 1 + 4 6 5 2 + 5 4 5 ar + 6 4 3 ar + 7 18 19 1 + 8 18 17 2 + 9 8 9 2 + 10 5 7 ar + 11 16 15 1 + 12 16 17 1 + 13 11 3 1 + 14 11 12 ar + 15 3 2 ar + 16 15 14 1 + 17 19 21 2 + 18 17 24 1 + 19 14 1 1 + 20 7 2 ar + 21 7 10 2 + 22 9 10 1 + 23 2 1 1 + 24 21 23 1 + 25 21 22 1 + 26 24 22 2 + 27 22 25 1 +########## Name: ligand +########## Vina_BE: -12.271 +########## MW: 373.704 +########## clogP: 1.841 +########## nonHatoms: 28 +########## Vina_LE: -0.438 +########## Vina_LipE: -14.112 +########## Close_contacts: 0 +########## Hydrophob_contacts: 28 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +ligand.pdbqt + 28 32 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -32.2110 -11.2400 -16.8340 C.2 1 UNL1 0.0110 + 2 C -33.5430 -11.2470 -17.2970 C.2 1 UNL1 0.0120 + 3 C -33.8490 -10.8000 -18.5950 C.2 1 UNL1 0.0160 + 4 C -26.6110 -7.3130 -20.3260 C.2 1 UNL1 0.0190 + 5 C -25.2850 -7.5950 -19.9350 C.2 1 UNL1 -0.1150 + 6 C -25.0220 -8.8030 -19.2640 C.2 1 UNL1 0.0410 + 7 C -26.0590 -9.7110 -19.0070 C.2 1 UNL1 -0.0250 + 8 C -29.2860 -10.7170 -20.1950 C.3 1 UNL1 0.2580 + 9 C -30.1300 -8.3660 -19.6240 C.3 1 UNL1 0.3010 + 10 C -27.6790 -8.2010 -20.0650 C.2 1 UNL1 0.0750 + 11 C -27.3740 -9.4280 -19.4100 C.2 1 UNL1 0.0310 + 12 C -30.5310 -9.8120 -20.0130 C.3 1 UNL1 -0.0410 + 13 C -32.9020 -9.8310 -20.8260 C.3 1 UNL1 0.0590 + 14 N -28.9990 -7.8520 -20.4210 N.pl3 1 UNL1 -0.6510 + 15 O -28.3030 -10.4270 -19.1870 O.2 1 UNL1 -0.3510 + 16 C -32.8020 -10.3540 -19.4140 C.2 1 UNL1 -0.0810 + 17 C -31.4890 -10.3510 -18.9650 C.2 1 UNL1 -0.0680 + 18 C -31.1710 -10.7870 -17.6690 C.2 1 UNL1 0.0660 + 19 CL -34.8250 -11.8110 -16.2480 Cl 1 UNL1 -0.1220 + 20 C -31.4240 -9.8370 -21.2940 C.3 1 UNL1 0.0350 + 21 C -24.1670 -6.6160 -20.2270 C.2 1 UNL1 0.9090 + 22 O -23.5340 -6.1710 -19.2820 O.co2 1 UNL1 -0.8300 + 23 O -23.9480 -6.3230 -21.3920 O.co2 1 UNL1 -0.8300 + 24 C -29.3220 -6.7380 -21.3380 C.3 1 UNL1 0.3130 + 25 C -30.1780 -5.6370 -20.6790 C.3 1 UNL1 -0.0270 + 26 C -29.6920 -5.0610 -19.3070 C.3 1 UNL1 0.0090 + 27 C -30.4190 -3.7460 -19.7330 C.3 1 UNL1 -0.0210 + 28 C -30.0510 -4.1630 -21.1930 C.3 1 UNL1 0.0090 +@BOND + 1 23 21 ar + 2 24 25 1 + 3 24 14 1 + 4 20 13 1 + 5 20 12 1 + 6 28 25 1 + 7 28 27 1 + 8 13 16 1 + 9 25 26 1 + 10 14 10 1 + 11 14 9 1 + 12 4 10 2 + 13 4 5 1 + 14 21 5 1 + 15 21 22 ar + 16 8 12 1 + 17 8 15 1 + 18 10 11 1 + 19 12 9 1 + 20 12 17 1 + 21 5 6 2 + 22 27 26 1 + 23 16 17 2 + 24 16 3 1 + 25 11 15 1 + 26 11 7 2 + 27 6 7 1 + 28 17 18 1 + 29 3 2 2 + 30 18 1 2 + 31 2 1 1 + 32 2 19 1 diff --git a/docking_mcl1/MTH_Results_all/VinaResults_6o6f_K234R_H.mol2 b/docking_mcl1/MTH_Results_all/VinaResults_6o6f_K234R_H.mol2 new file mode 100644 index 0000000..515413e --- /dev/null +++ b/docking_mcl1/MTH_Results_all/VinaResults_6o6f_K234R_H.mol2 @@ -0,0 +1,2000 @@ +########## Name: lig_27 +########## Vina_BE: -8.537 +########## MW: 279.205 +########## clogP: -0.331 +########## nonHatoms: 23 +########## Vina_LE: -0.371 +########## Vina_LipE: -8.206 +########## Close_contacts: 0 +########## Hydrophob_contacts: 23 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_27.pdbqt + 23 25 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 CA -26.5510 -7.8530 -20.0840 C.ar 1 UNL1 0.0410 + 2 N -26.5540 -6.5360 -20.5420 N.ar 1 UNL1 -0.2150 + 3 C -27.8660 -6.1310 -20.4070 C.ar 1 UNL1 -0.0400 + 4 C -28.4250 -4.8910 -20.7360 C.2 1 UNL1 -0.0330 + 5 C -29.8060 -4.7150 -20.5140 C.2 1 UNL1 -0.0360 + 6 C -30.5850 -5.7670 -19.9810 C.2 1 UNL1 -0.0710 + 7 C -29.9950 -7.0080 -19.6600 C.2 1 UNL1 0.0250 + 8 C -28.6190 -7.1650 -19.8820 C.ar 1 UNL1 -0.0710 + 9 C -27.8010 -8.2600 -19.6680 C.ar 1 UNL1 -0.1800 + 10 H -25.7480 -6.0450 -20.8980 H 1 UNL1 0.3100 + 11 C -25.2960 -8.6670 -20.0870 C.2 1 UNL1 0.8430 + 12 O -24.4360 -8.3350 -19.2810 O.co2 1 UNL1 -0.8210 + 13 OXT -25.1440 -9.6000 -20.8640 O.co2 1 UNL1 -0.8210 + 14 C -28.1980 -9.6120 -19.1080 C.3 1 UNL1 0.1040 + 15 C -28.8160 -10.5150 -20.2020 C.3 1 UNL1 -0.0260 + 16 C -30.3590 -10.5850 -20.1480 C.3 1 UNL1 0.2820 + 17 O -30.8350 -10.3580 -18.8010 O.2 1 UNL1 -0.3520 + 18 C -32.1250 -10.6180 -18.3950 C.2 1 UNL1 0.1340 + 19 C -32.4420 -10.9380 -17.0620 C.2 1 UNL1 -0.0120 + 20 C -33.7720 -11.2110 -16.7020 C.2 1 UNL1 0.0100 + 21 C -34.7850 -11.1810 -17.6760 C.2 1 UNL1 -0.0710 + 22 C -34.4680 -10.8780 -19.0100 C.2 1 UNL1 0.0100 + 23 C -33.1370 -10.6010 -19.3660 C.2 1 UNL1 -0.0120 +@BOND + 1 10 2 1 + 2 13 11 ar + 3 4 5 1 + 4 4 3 2 + 5 2 3 ar + 6 2 1 ar + 7 5 6 2 + 8 3 8 ar + 9 15 16 1 + 10 15 14 1 + 11 16 17 1 + 12 11 1 1 + 13 11 12 ar + 14 1 9 ar + 15 6 7 1 + 16 8 9 ar + 17 8 7 2 + 18 9 14 1 + 19 23 22 1 + 20 23 18 2 + 21 22 21 2 + 22 17 18 1 + 23 18 19 1 + 24 21 20 1 + 25 19 20 2 +########## Name: lig_28 +########## Vina_BE: -8.808 +########## MW: 291.216 +########## clogP: -0.176 +########## nonHatoms: 24 +########## Vina_LE: -0.367 +########## Vina_LipE: -8.632 +########## Close_contacts: 0 +########## Hydrophob_contacts: 20 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_28.pdbqt + 24 26 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.8730 -8.1160 -19.6560 C.ar 1 UNL1 -0.1860 + 2 CA -26.5310 -7.7570 -20.0820 C.ar 1 UNL1 0.0480 + 3 N -26.4990 -6.4240 -20.5040 N.ar 1 UNL1 -0.2140 + 4 C -27.7820 -5.9260 -20.3690 C.ar 1 UNL1 -0.0430 + 5 C -28.2360 -4.6370 -20.6730 C.2 1 UNL1 -0.0330 + 6 C -29.6010 -4.3540 -20.4650 C.2 1 UNL1 -0.0390 + 7 C -30.4720 -5.3520 -19.9710 C.2 1 UNL1 -0.0730 + 8 C -29.9870 -6.6420 -19.6770 C.2 1 UNL1 0.0200 + 9 C -28.6260 -6.9010 -19.8790 C.ar 1 UNL1 -0.0730 + 10 H -25.6690 -5.9630 -20.8450 H 1 UNL1 0.3100 + 11 C -25.2970 -8.5950 -20.1040 C.2 1 UNL1 0.8380 + 12 OXT -24.4560 -8.4980 -19.2250 O.co2 1 UNL1 -0.8150 + 13 O -25.1870 -9.3700 -21.0450 O.co2 1 UNL1 -0.8150 + 14 C -28.2670 -9.4500 -19.0730 C.3 1 UNL1 0.0980 + 15 C -28.5510 -10.5160 -20.1600 C.3 1 UNL1 0.0250 + 16 C -30.0460 -10.8730 -20.3330 C.3 1 UNL1 0.2440 + 17 O -30.8770 -9.9540 -19.5940 O.2 1 UNL1 -0.3680 + 18 C -31.9290 -10.4030 -18.8310 C.2 1 UNL1 0.1200 + 19 C -31.6980 -10.7000 -17.4800 C.2 1 UNL1 0.0070 + 20 C -32.7480 -11.1550 -16.6650 C.2 1 UNL1 -0.0080 + 21 C -34.0370 -11.2970 -17.2050 C.2 1 UNL1 -0.0310 + 22 C -34.2750 -10.9790 -18.5520 C.2 1 UNL1 -0.0040 + 23 C -33.2260 -10.5240 -19.3750 C.2 1 UNL1 -0.0960 + 24 C -33.5090 -10.1870 -20.8330 C.3 1 UNL1 0.0900 +@BOND + 1 13 11 ar + 2 10 3 1 + 3 24 23 1 + 4 5 6 1 + 5 5 4 2 + 6 3 4 ar + 7 3 2 ar + 8 6 7 2 + 9 4 9 ar + 10 16 15 1 + 11 16 17 1 + 12 15 14 1 + 13 11 2 1 + 14 11 12 ar + 15 2 1 ar + 16 7 8 1 + 17 9 8 2 + 18 9 1 ar + 19 1 14 1 + 20 17 18 1 + 21 23 18 2 + 22 23 22 1 + 23 18 19 1 + 24 22 21 2 + 25 19 20 2 + 26 21 20 1 +########## Name: lig_30 +########## Vina_BE: -8.987 +########## MW: 291.216 +########## clogP: -0.176 +########## nonHatoms: 24 +########## Vina_LE: -0.374 +########## Vina_LipE: -8.811 +########## Close_contacts: 1 +########## Hydrophob_contacts: 31 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_30.pdbqt + 24 26 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.6510 -8.1000 -19.7110 C.ar 1 UNL1 -0.1930 + 2 CA -26.4190 -7.6810 -20.2330 C.ar 1 UNL1 -0.0370 + 3 N -26.5990 -6.3960 -20.7740 N.ar 1 UNL1 -0.2140 + 4 C -27.9120 -6.0180 -20.5940 C.ar 1 UNL1 -0.0420 + 5 C -28.5340 -4.8210 -20.9670 C.2 1 UNL1 -0.0300 + 6 C -29.9030 -4.6730 -20.6630 C.2 1 UNL1 -0.0380 + 7 C -30.6050 -5.7090 -20.0070 C.2 1 UNL1 -0.0670 + 8 C -29.9470 -6.9040 -19.6450 C.2 1 UNL1 0.0130 + 9 C -28.5850 -7.0250 -19.9560 C.ar 1 UNL1 -0.0730 + 10 H -25.8570 -5.8710 -21.2120 H 1 UNL1 0.3100 + 11 C -25.1050 -8.3890 -20.2530 C.2 1 UNL1 0.9270 + 12 OXT -24.1470 -7.9560 -19.6340 O.co2 1 UNL1 -0.8140 + 13 O -25.0580 -9.4110 -20.9240 O.co2 1 UNL1 -0.8140 + 14 C -27.8950 -9.4130 -19.0070 C.3 1 UNL1 0.0990 + 15 C -28.3210 -10.5400 -19.9750 C.3 1 UNL1 0.0220 + 16 C -29.8450 -10.5490 -20.2430 C.3 1 UNL1 0.2540 + 17 O -30.5640 -10.3320 -19.0110 O.2 1 UNL1 -0.3400 + 18 C -31.9240 -10.5120 -18.8670 C.2 1 UNL1 0.1530 + 19 C -32.7250 -10.3460 -20.0050 C.2 1 UNL1 -0.0370 + 20 C -34.1160 -10.5260 -19.9290 C.2 1 UNL1 0.0140 + 21 C -34.7090 -10.8790 -18.7070 C.2 1 UNL1 -0.0660 + 22 C -33.9170 -11.0510 -17.5580 C.2 1 UNL1 -0.0450 + 23 C -34.5530 -11.4360 -16.2340 C.3 1 UNL1 0.0690 + 24 C -32.5250 -10.8710 -17.6430 C.2 1 UNL1 -0.0500 +@BOND + 1 10 3 1 + 2 5 6 1 + 3 5 4 2 + 4 13 11 ar + 5 3 4 ar + 6 3 2 ar + 7 6 7 2 + 8 4 9 ar + 9 11 2 1 + 10 11 12 ar + 11 16 15 1 + 12 16 17 1 + 13 2 1 ar + 14 7 8 1 + 15 19 20 1 + 16 19 18 2 + 17 15 14 1 + 18 9 1 ar + 19 9 8 2 + 20 20 21 2 + 21 1 14 1 + 22 17 18 1 + 23 18 24 1 + 24 21 22 1 + 25 24 22 2 + 26 22 23 1 +########## Name: lig_31 +########## Vina_BE: -9.431 +########## MW: 348.211 +########## clogP: 2.342 +########## nonHatoms: 27 +########## Vina_LE: -0.349 +########## Vina_LipE: -11.773 +########## Close_contacts: 0 +########## Hydrophob_contacts: 25 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_31.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.8030 -8.9490 -18.9970 C.3 1 UNL1 0.1040 + 2 C -27.6120 -7.6670 -19.7730 C.ar 1 UNL1 -0.1820 + 3 C -28.5940 -6.6320 -20.0030 C.ar 1 UNL1 -0.0710 + 4 C -29.9400 -6.5490 -19.6200 C.2 1 UNL1 0.0250 + 5 C -27.9970 -5.6230 -20.7100 C.ar 1 UNL1 -0.0390 + 6 C -30.6630 -5.3940 -19.9850 C.2 1 UNL1 -0.0680 + 7 C -30.0380 -4.3560 -20.7130 C.2 1 UNL1 -0.0330 + 8 C -28.6830 -4.4630 -21.0860 C.2 1 UNL1 -0.0310 + 9 N -26.6830 -5.9600 -20.9460 N.ar 1 UNL1 -0.2140 + 10 CA -26.4230 -7.2160 -20.3690 C.ar 1 UNL1 -0.0480 + 11 H -25.9820 -5.4200 -21.4330 H 1 UNL1 0.3110 + 12 C -25.0770 -7.8580 -20.4430 C.2 1 UNL1 0.9330 + 13 OXT -24.7390 -8.2720 -21.5410 O.co2 1 UNL1 -0.8230 + 14 O -24.3850 -7.9910 -19.4480 O.co2 1 UNL1 -0.8230 + 15 C -27.7920 -10.1950 -19.9110 C.3 1 UNL1 -0.0240 + 16 C -29.1720 -10.8880 -20.0210 C.3 1 UNL1 0.2880 + 17 O -30.1150 -10.2290 -19.1460 O.2 1 UNL1 -0.3460 + 18 C -31.4740 -10.2990 -19.3600 C.2 1 UNL1 0.1330 + 19 C -32.0520 -9.8580 -20.5610 C.2 1 UNL1 0.0660 + 20 C -33.4370 -9.9690 -20.7550 C.2 1 UNL1 0.0390 + 21 C -34.2470 -10.5190 -19.7460 C.2 1 UNL1 -0.0020 + 22 C -33.6800 -10.9610 -18.5320 C.2 1 UNL1 -0.1540 + 23 C -32.2860 -10.8330 -18.3480 C.2 1 UNL1 0.0190 + 24 C -34.5670 -11.5550 -17.4320 C.3 1 UNL1 0.6870 + 25 F -34.9380 -12.8200 -17.7230 F 1 UNL1 -0.2490 + 26 F -33.9430 -11.6020 -16.2330 F 1 UNL1 -0.2490 + 27 F -35.7070 -10.8530 -17.2370 F 1 UNL1 -0.2490 +@BOND + 1 13 12 ar + 2 11 9 1 + 3 8 7 2 + 4 8 5 1 + 5 9 5 ar + 6 9 10 ar + 7 20 19 1 + 8 20 21 2 + 9 7 6 1 + 10 5 3 ar + 11 19 18 2 + 12 12 10 1 + 13 12 14 ar + 14 10 2 ar + 15 16 15 1 + 16 16 17 1 + 17 3 2 ar + 18 3 4 1 + 19 6 4 2 + 20 15 1 1 + 21 2 1 1 + 22 21 22 1 + 23 18 17 1 + 24 18 23 1 + 25 22 23 2 + 26 22 24 1 + 27 25 24 1 + 28 24 27 1 + 29 24 26 1 +########## Name: lig_32 +########## Vina_BE: -8.931 +########## MW: 291.216 +########## clogP: -0.176 +########## nonHatoms: 24 +########## Vina_LE: -0.372 +########## Vina_LipE: -8.755 +########## Close_contacts: 1 +########## Hydrophob_contacts: 25 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_32.pdbqt + 24 26 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.7570 -7.8720 -19.8160 C.ar 1 UNL1 -0.1930 + 2 CA -26.4820 -7.5060 -20.2660 C.ar 1 UNL1 -0.0370 + 3 N -26.5380 -6.1550 -20.6610 N.ar 1 UNL1 -0.2140 + 4 C -27.8120 -5.6810 -20.4380 C.ar 1 UNL1 -0.0430 + 5 C -28.3130 -4.3900 -20.6460 C.2 1 UNL1 -0.0300 + 6 C -29.6620 -4.1510 -20.3120 C.2 1 UNL1 -0.0380 + 7 C -30.4640 -5.1900 -19.7860 C.2 1 UNL1 -0.0670 + 8 C -29.9270 -6.4790 -19.5910 C.2 1 UNL1 0.0140 + 9 C -28.5850 -6.6910 -19.9310 C.ar 1 UNL1 -0.0720 + 10 H -25.7430 -5.6500 -21.0200 H 1 UNL1 0.3100 + 11 C -25.2280 -8.3140 -20.3370 C.2 1 UNL1 0.9270 + 12 OXT -24.6410 -8.6560 -19.3230 O.co2 1 UNL1 -0.8150 + 13 O -24.8270 -8.5810 -21.4610 O.co2 1 UNL1 -0.8150 + 14 C -28.1290 -9.2250 -19.2610 C.3 1 UNL1 0.0980 + 15 C -28.2360 -10.3030 -20.3640 C.3 1 UNL1 0.0230 + 16 C -29.6660 -10.8560 -20.5360 C.3 1 UNL1 0.2520 + 17 O -30.6000 -9.9010 -19.9960 O.2 1 UNL1 -0.3390 + 18 C -31.6130 -10.2970 -19.1560 C.2 1 UNL1 0.1480 + 19 C -31.3920 -10.5200 -17.7860 C.2 1 UNL1 -0.0390 + 20 C -32.4560 -10.9080 -16.9560 C.2 1 UNL1 0.0230 + 21 C -33.7480 -11.0740 -17.4880 C.2 1 UNL1 -0.1370 + 22 C -34.8970 -11.4960 -16.5870 C.3 1 UNL1 0.0600 + 23 C -33.9660 -10.8410 -18.8590 C.2 1 UNL1 0.0230 + 24 C -32.9010 -10.4490 -19.6860 C.2 1 UNL1 -0.0390 +@BOND + 1 13 11 ar + 2 10 3 1 + 3 3 4 ar + 4 3 2 ar + 5 5 4 2 + 6 5 6 1 + 7 16 15 1 + 8 16 17 1 + 9 4 9 ar + 10 15 14 1 + 11 11 2 1 + 12 11 12 ar + 13 6 7 2 + 14 2 1 ar + 15 17 18 1 + 16 9 1 ar + 17 9 8 2 + 18 1 14 1 + 19 7 8 1 + 20 24 18 2 + 21 24 23 1 + 22 18 19 1 + 23 23 21 2 + 24 19 20 2 + 25 21 20 1 + 26 21 22 1 +########## Name: lig_33 +########## Vina_BE: -8.696 +########## MW: 314.658 +########## clogP: 0.432 +########## nonHatoms: 24 +########## Vina_LE: -0.362 +########## Vina_LipE: -9.128 +########## Close_contacts: 1 +########## Hydrophob_contacts: 20 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_33.pdbqt + 24 26 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 CA -26.4610 -7.5160 -20.2310 C.ar 1 UNL1 -0.0480 + 2 N -26.5630 -6.1870 -20.6800 N.ar 1 UNL1 -0.2140 + 3 C -27.8580 -5.7520 -20.4930 C.ar 1 UNL1 -0.0400 + 4 C -28.4140 -4.5060 -20.8050 C.2 1 UNL1 -0.0310 + 5 C -29.7800 -4.3100 -20.5180 C.2 1 UNL1 -0.0350 + 6 C -30.5460 -5.3480 -19.9370 C.2 1 UNL1 -0.0700 + 7 C -29.9530 -6.5940 -19.6370 C.2 1 UNL1 0.0250 + 8 C -28.5930 -6.7610 -19.9310 C.ar 1 UNL1 -0.0710 + 9 C -27.7210 -7.8980 -19.7470 C.ar 1 UNL1 -0.1810 + 10 H -25.7890 -5.6770 -21.0800 H 1 UNL1 0.3100 + 11 C -25.1970 -8.3070 -20.3040 C.2 1 UNL1 0.9320 + 12 O -24.8270 -8.6260 -21.4240 O.co2 1 UNL1 -0.8210 + 13 OXT -24.5860 -8.6240 -19.2920 O.co2 1 UNL1 -0.8210 + 14 C -28.0290 -9.2570 -19.1760 C.3 1 UNL1 0.1060 + 15 C -28.1430 -10.3310 -20.2840 C.3 1 UNL1 -0.0250 + 16 C -29.5680 -10.9000 -20.4650 C.3 1 UNL1 0.2840 + 17 O -30.5600 -9.9630 -19.9850 O.2 1 UNL1 -0.3480 + 18 C -31.5980 -10.3030 -19.1440 C.2 1 UNL1 0.1390 + 19 C -32.8690 -10.4750 -19.7110 C.2 1 UNL1 0.0010 + 20 C -33.9600 -10.8500 -18.9100 C.2 1 UNL1 0.0380 + 21 C -33.7760 -11.0610 -17.5340 C.2 1 UNL1 -0.0310 + 22 CL -35.1340 -11.5310 -16.5330 Cl 1 UNL1 -0.1370 + 23 C -32.5040 -10.8990 -16.9610 C.2 1 UNL1 0.0380 + 24 C -31.4120 -10.5290 -17.7660 C.2 1 UNL1 0.0010 +@BOND + 1 12 11 ar + 2 10 2 1 + 3 4 5 1 + 4 4 3 2 + 5 2 3 ar + 6 2 1 ar + 7 5 6 2 + 8 3 8 ar + 9 16 15 1 + 10 16 17 1 + 11 11 1 1 + 12 11 13 ar + 13 15 14 1 + 14 1 9 ar + 15 17 18 1 + 16 6 7 1 + 17 8 9 ar + 18 8 7 2 + 19 9 14 1 + 20 19 18 2 + 21 19 20 1 + 22 18 24 1 + 23 20 21 2 + 24 24 23 2 + 25 21 23 1 + 26 21 22 1 +########## Name: lig_34 +########## Vina_BE: -9.496 +########## MW: 348.211 +########## clogP: 2.342 +########## nonHatoms: 27 +########## Vina_LE: -0.352 +########## Vina_LipE: -11.838 +########## Close_contacts: 1 +########## Hydrophob_contacts: 21 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_34.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.8260 -8.8280 -19.0590 C.3 1 UNL1 0.1040 + 2 C -27.5780 -7.5190 -19.7720 C.ar 1 UNL1 -0.1820 + 3 C -28.5070 -6.4240 -19.9380 C.ar 1 UNL1 -0.0710 + 4 C -29.8420 -6.2900 -19.5340 C.2 1 UNL1 0.0250 + 5 C -27.8620 -5.4130 -20.5960 C.ar 1 UNL1 -0.0390 + 6 C -30.5050 -5.0800 -19.8250 C.2 1 UNL1 -0.0680 + 7 C -29.8320 -4.0380 -20.5020 C.2 1 UNL1 -0.0330 + 8 C -28.4880 -4.1970 -20.8980 C.2 1 UNL1 -0.0310 + 9 N -26.5690 -5.8030 -20.8640 N.ar 1 UNL1 -0.2140 + 10 CA -26.3700 -7.1000 -20.3530 C.ar 1 UNL1 -0.0480 + 11 H -25.8440 -5.2750 -21.3250 H 1 UNL1 0.3110 + 12 C -25.0610 -7.8070 -20.4690 C.2 1 UNL1 0.9330 + 13 OXT -24.7800 -8.2400 -21.5760 O.co2 1 UNL1 -0.8230 + 14 O -24.3430 -7.9720 -19.4960 O.co2 1 UNL1 -0.8230 + 15 C -27.5650 -10.0520 -19.9660 C.3 1 UNL1 -0.0240 + 16 C -28.8550 -10.8220 -20.3480 C.3 1 UNL1 0.2880 + 17 O -29.9780 -9.9110 -20.3570 O.2 1 UNL1 -0.3460 + 18 C -31.1600 -10.1990 -19.7070 C.2 1 UNL1 0.1330 + 19 C -32.3920 -10.2410 -20.3790 C.2 1 UNL1 0.0660 + 20 C -33.5670 -10.5730 -19.6830 C.2 1 UNL1 0.0390 + 21 C -33.5270 -10.8600 -18.3010 C.2 1 UNL1 -0.1370 + 22 C -32.2860 -10.8010 -17.6330 C.2 1 UNL1 -0.0190 + 23 C -31.1140 -10.4670 -18.3320 C.2 1 UNL1 0.0190 + 24 C -34.7940 -11.2440 -17.5260 C.3 1 UNL1 0.6870 + 25 F -35.0380 -12.5730 -17.5910 F 1 UNL1 -0.2490 + 26 F -34.7430 -10.9320 -16.2120 F 1 UNL1 -0.2490 + 27 F -35.8870 -10.6300 -18.0290 F 1 UNL1 -0.2490 +@BOND + 1 13 12 ar + 2 11 9 1 + 3 8 5 1 + 4 8 7 2 + 5 9 5 ar + 6 9 10 ar + 7 5 3 ar + 8 7 6 1 + 9 12 10 1 + 10 12 14 ar + 11 19 18 2 + 12 19 20 1 + 13 17 16 1 + 14 17 18 1 + 15 10 2 ar + 16 16 15 1 + 17 15 1 1 + 18 3 2 ar + 19 3 4 1 + 20 6 4 2 + 21 2 1 1 + 22 18 23 1 + 23 20 21 2 + 24 23 22 2 + 25 21 22 1 + 26 21 24 1 + 27 27 24 1 + 28 25 24 1 + 29 24 26 1 +########## Name: lig_35 +########## Vina_BE: -8.701 +########## MW: 326.669 +########## clogP: 0.587 +########## nonHatoms: 25 +########## Vina_LE: -0.348 +########## Vina_LipE: -9.288 +########## Close_contacts: 1 +########## Hydrophob_contacts: 23 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_35.pdbqt + 25 27 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.3090 -7.5160 -19.9720 C.ar 1 UNL1 -0.1950 + 2 CA -26.2790 -6.9920 -20.7670 C.ar 1 UNL1 -0.0370 + 3 N -26.7390 -5.7820 -21.3170 N.ar 1 UNL1 -0.2140 + 4 C -28.0120 -5.5360 -20.8500 C.ar 1 UNL1 -0.0420 + 5 C -28.8330 -4.4290 -21.0960 C.2 1 UNL1 -0.0290 + 6 C -30.0940 -4.4000 -20.4660 C.2 1 UNL1 -0.0370 + 7 C -30.4940 -5.4570 -19.6160 C.2 1 UNL1 -0.0660 + 8 C -29.6400 -6.5570 -19.3910 C.2 1 UNL1 0.0110 + 9 C -28.3950 -6.5660 -20.0330 C.ar 1 UNL1 -0.0740 + 10 H -26.1780 -5.2030 -21.9240 H 1 UNL1 0.3110 + 11 C -24.9090 -7.5280 -21.0240 C.2 1 UNL1 0.9270 + 12 OXT -24.6010 -7.9730 -22.1180 O.co2 1 UNL1 -0.8140 + 13 O -24.1450 -7.5220 -20.0690 O.co2 1 UNL1 -0.8140 + 14 C -27.2260 -8.7950 -19.1730 C.3 1 UNL1 0.0980 + 15 C -27.4280 -10.0480 -20.0560 C.3 1 UNL1 0.0260 + 16 C -28.8880 -10.5440 -20.0720 C.3 1 UNL1 0.2600 + 17 O -29.5740 -9.9910 -18.9330 O.2 1 UNL1 -0.3380 + 18 C -30.8780 -10.3000 -18.6150 C.2 1 UNL1 0.1580 + 19 C -31.8120 -10.3110 -19.6600 C.2 1 UNL1 -0.0400 + 20 C -33.1660 -10.6070 -19.4150 C.2 1 UNL1 -0.0300 + 21 C -34.1640 -10.6000 -20.5650 C.3 1 UNL1 0.0910 + 22 C -33.5780 -10.8980 -18.0980 C.2 1 UNL1 -0.0360 + 23 C -32.6470 -10.8860 -17.0470 C.2 1 UNL1 0.0390 + 24 CL -35.2520 -11.2760 -17.7310 Cl 1 UNL1 -0.1280 + 25 C -31.2980 -10.5870 -17.3020 C.2 1 UNL1 -0.0260 +@BOND + 1 12 11 ar + 2 10 3 1 + 3 3 4 ar + 4 3 2 ar + 5 5 4 2 + 6 5 6 1 + 7 11 2 1 + 8 11 13 ar + 9 4 9 ar + 10 2 1 ar + 11 21 20 1 + 12 6 7 2 + 13 16 15 1 + 14 16 17 1 + 15 15 14 1 + 16 9 1 ar + 17 9 8 2 + 18 1 14 1 + 19 19 20 1 + 20 19 18 2 + 21 7 8 1 + 22 20 22 2 + 23 17 18 1 + 24 18 25 1 + 25 22 24 1 + 26 22 23 1 + 27 25 23 2 +########## Name: lig_36 +########## Vina_BE: -8.537 +########## MW: 338.68 +########## clogP: 0.668 +########## nonHatoms: 26 +########## Vina_LE: -0.328 +########## Vina_LipE: -9.205 +########## Close_contacts: 2 +########## Hydrophob_contacts: 28 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_36.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.3200 -7.6070 -19.9250 C.ar 1 UNL1 -0.1820 + 2 CA -26.2530 -7.0150 -20.7180 C.ar 1 UNL1 0.0400 + 3 N -26.6720 -5.7930 -21.2540 N.ar 1 UNL1 -0.2140 + 4 C -27.9690 -5.5860 -20.8290 C.ar 1 UNL1 -0.0400 + 5 C -28.7980 -4.4940 -21.1140 C.2 1 UNL1 -0.0310 + 6 C -30.0980 -4.4960 -20.5680 C.2 1 UNL1 -0.0350 + 7 C -30.5350 -5.5710 -19.7610 C.2 1 UNL1 -0.0700 + 8 C -29.6780 -6.6580 -19.4910 C.2 1 UNL1 0.0250 + 9 C -28.3900 -6.6380 -20.0420 C.ar 1 UNL1 -0.0700 + 10 H -26.0910 -5.2100 -21.8380 H 1 UNL1 0.3100 + 11 C -24.8810 -7.5280 -20.9990 C.2 1 UNL1 0.8430 + 12 O -24.5580 -7.8790 -22.1210 O.co2 1 UNL1 -0.8210 + 13 OXT -24.1010 -7.5360 -20.0570 O.co2 1 UNL1 -0.8210 + 14 C -27.2590 -8.9190 -19.1780 C.3 1 UNL1 0.1050 + 15 C -27.5610 -10.1260 -20.0970 C.3 1 UNL1 -0.0250 + 16 C -29.0240 -10.6030 -19.9990 C.3 1 UNL1 0.2860 + 17 O -29.5750 -10.0960 -18.7670 O.2 1 UNL1 -0.3480 + 18 C -30.8620 -10.4050 -18.4090 C.2 1 UNL1 0.1410 + 19 C -31.8470 -10.4840 -19.4040 C.2 1 UNL1 -0.0340 + 20 C -33.1820 -10.7830 -19.0720 C.2 1 UNL1 -0.0570 + 21 C -33.5220 -10.9900 -17.7170 C.2 1 UNL1 -0.0260 + 22 C -32.5360 -10.8950 -16.7190 C.2 1 UNL1 0.0580 + 23 CL -35.1660 -11.3490 -17.2200 Cl 1 UNL1 -0.1370 + 24 C -31.2060 -10.5990 -17.0640 C.2 1 UNL1 0.0360 + 25 C -34.2240 -10.8550 -20.1850 C.3 1 UNL1 0.0570 + 26 C -33.9360 -9.8450 -21.3120 C.3 1 UNL1 0.0110 +@BOND + 1 12 11 ar + 2 10 3 1 + 3 26 25 1 + 4 3 4 ar + 5 3 2 ar + 6 5 4 2 + 7 5 6 1 + 8 11 2 1 + 9 11 13 ar + 10 4 9 ar + 11 2 1 ar + 12 6 7 2 + 13 25 20 1 + 14 15 16 1 + 15 15 14 1 + 16 9 1 ar + 17 9 8 2 + 18 16 17 1 + 19 1 14 1 + 20 7 8 1 + 21 19 20 1 + 22 19 18 2 + 23 20 21 2 + 24 17 18 1 + 25 18 24 1 + 26 21 23 1 + 27 21 22 1 + 28 24 22 2 +########## Name: lig_37 +########## Vina_BE: -8.824 +########## MW: 338.68 +########## clogP: 0.742 +########## nonHatoms: 26 +########## Vina_LE: -0.339 +########## Vina_LipE: -9.566 +########## Close_contacts: 0 +########## Hydrophob_contacts: 24 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_37.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.5680 -7.5550 -19.6780 C.ar 1 UNL1 -0.2010 + 2 CA -26.3610 -7.1180 -20.3600 C.ar 1 UNL1 0.0730 + 3 N -26.5800 -5.8810 -20.9760 N.ar 1 UNL1 -0.2220 + 4 C -27.8900 -5.5250 -20.7140 C.ar 1 UNL1 -0.0430 + 5 C -28.5610 -4.3710 -21.1360 C.2 1 UNL1 -0.0310 + 6 C -29.9090 -4.2160 -20.7530 C.2 1 UNL1 -0.0380 + 7 C -30.5490 -5.2040 -19.9690 C.2 1 UNL1 -0.0640 + 8 C -29.8480 -6.3590 -19.5600 C.2 1 UNL1 0.0190 + 9 C -28.5090 -6.4920 -19.9490 C.ar 1 UNL1 -0.0560 + 10 H -25.8800 -5.3880 -21.5100 H 1 UNL1 0.2980 + 11 C -25.0380 -7.8070 -20.4630 C.2 1 UNL1 0.8300 + 12 O -24.2920 -7.8920 -19.5000 O.co2 1 UNL1 -0.8100 + 13 OXT -24.7580 -8.2840 -21.5540 O.co2 1 UNL1 -0.8100 + 14 C -27.7010 -8.8530 -18.9230 C.3 1 UNL1 0.0940 + 15 C -27.3260 -10.0760 -19.7970 C.3 1 UNL1 -0.0200 + 16 C -28.5600 -10.7680 -20.4090 C.3 1 UNL1 0.2770 + 17 O -29.6480 -9.8230 -20.4590 O.2 1 UNL1 -0.3530 + 18 C -30.8720 -10.1440 -19.9250 C.2 1 UNL1 0.1400 + 19 C -31.0220 -10.4010 -18.5530 C.2 1 UNL1 -0.0100 + 20 C -32.2850 -10.7140 -18.0230 C.2 1 UNL1 -0.0400 + 21 C -32.4160 -10.9970 -16.5320 C.3 1 UNL1 0.0910 + 22 C -33.4080 -10.7550 -18.8790 C.2 1 UNL1 -0.0290 + 23 C -33.2630 -10.4780 -20.2560 C.2 1 UNL1 -0.0400 + 24 CL -34.9950 -11.1410 -18.2270 Cl 1 UNL1 -0.1380 + 25 C -31.9890 -10.1690 -20.7680 C.2 1 UNL1 -0.0100 + 26 C -34.4620 -10.5050 -21.1940 C.3 1 UNL1 0.0910 +@BOND + 1 13 11 ar + 2 10 3 1 + 3 26 23 1 + 4 5 6 1 + 5 5 4 2 + 6 3 4 ar + 7 3 2 ar + 8 25 23 1 + 9 25 18 2 + 10 6 7 2 + 11 4 9 ar + 12 11 2 1 + 13 11 12 ar + 14 17 16 1 + 15 17 18 1 + 16 16 15 1 + 17 2 1 ar + 18 23 22 2 + 19 7 8 1 + 20 9 1 ar + 21 9 8 2 + 22 18 19 1 + 23 15 14 1 + 24 1 14 1 + 25 22 24 1 + 26 22 20 1 + 27 19 20 2 + 28 20 21 1 +########## Name: lig_43 +########## Vina_BE: -10.054 +########## MW: 327.248 +########## clogP: 1.685 +########## nonHatoms: 27 +########## Vina_LE: -0.372 +########## Vina_LipE: -11.739 +########## Close_contacts: 0 +########## Hydrophob_contacts: 34 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_43.pdbqt + 27 30 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.7670 -8.8390 -19.0340 C.3 1 UNL1 0.1050 + 2 C -27.5950 -7.5500 -19.8030 C.ar 1 UNL1 -0.1800 + 3 C -28.5870 -6.5200 -20.0150 C.ar 1 UNL1 -0.0710 + 4 C -29.9280 -6.4500 -19.6170 C.2 1 UNL1 0.0250 + 5 C -28.0000 -5.5000 -20.7120 C.ar 1 UNL1 -0.0400 + 6 C -30.6610 -5.2930 -19.9590 C.2 1 UNL1 -0.0700 + 7 C -30.0480 -4.2420 -20.6800 C.2 1 UNL1 -0.0350 + 8 C -28.6950 -4.3370 -21.0670 C.2 1 UNL1 -0.0330 + 9 N -26.6850 -5.8240 -20.9630 N.ar 1 UNL1 -0.2140 + 10 CA -26.4100 -7.0830 -20.3970 C.ar 1 UNL1 -0.0480 + 11 H -25.9900 -5.2700 -21.4420 H 1 UNL1 0.3100 + 12 C -25.0560 -7.7050 -20.4730 C.2 1 UNL1 0.9320 + 13 O -24.8080 -8.3280 -21.4940 O.co2 1 UNL1 -0.8220 + 14 OXT -24.2620 -7.6090 -19.5520 O.co2 1 UNL1 -0.8220 + 15 C -27.4560 -10.0870 -19.8930 C.3 1 UNL1 -0.0240 + 16 C -28.7250 -10.8520 -20.3500 C.3 1 UNL1 0.2800 + 17 O -29.8300 -9.9270 -20.4760 O.2 1 UNL1 -0.3510 + 18 C -31.0830 -10.2130 -19.9740 C.2 1 UNL1 0.1230 + 19 C -32.1920 -10.1050 -20.8260 C.2 1 UNL1 -0.0090 + 20 C -33.4900 -10.3420 -20.3370 C.2 1 UNL1 -0.0040 + 21 C -33.6800 -10.6900 -18.9870 C.2 1 UNL1 -0.0700 + 22 C -34.9720 -10.9110 -18.4770 C.2 1 UNL1 -0.0070 + 23 C -32.5630 -10.8120 -18.1340 C.2 1 UNL1 -0.0050 + 24 C -35.1480 -11.2480 -17.1240 C.2 1 UNL1 -0.0330 + 25 C -34.0340 -11.3650 -16.2760 C.2 1 UNL1 -0.0250 + 26 C -32.7410 -11.1470 -16.7810 C.2 1 UNL1 0.0610 + 27 C -31.2710 -10.5860 -18.6320 C.2 1 UNL1 0.0260 +@BOND + 1 13 12 ar + 2 11 9 1 + 3 8 5 1 + 4 8 7 2 + 5 9 5 ar + 6 9 10 ar + 7 19 20 1 + 8 19 18 2 + 9 5 3 ar + 10 7 6 1 + 11 17 16 1 + 12 17 18 1 + 13 12 10 1 + 14 12 14 ar + 15 10 2 ar + 16 16 15 1 + 17 20 21 2 + 18 3 2 ar + 19 3 4 1 + 20 18 27 1 + 21 6 4 2 + 22 15 1 1 + 23 2 1 1 + 24 21 22 1 + 25 21 23 1 + 26 27 23 2 + 27 22 24 2 + 28 23 26 1 + 29 24 25 1 + 30 26 25 2 +########## Name: lig_46 +########## Vina_BE: -9.734 +########## MW: 315.238 +########## clogP: 0.06 +########## nonHatoms: 26 +########## Vina_LE: -0.374 +########## Vina_LipE: -9.794 +########## Close_contacts: 0 +########## Hydrophob_contacts: 27 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_46.pdbqt + 26 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 CA -26.4480 -7.2240 -20.3220 C.ar 1 UNL1 0.0410 + 2 N -26.5450 -5.9310 -20.8350 N.ar 1 UNL1 -0.2150 + 3 C -27.8460 -5.5560 -20.5770 C.ar 1 UNL1 -0.0400 + 4 C -28.4740 -4.3440 -20.8860 C.2 1 UNL1 -0.0330 + 5 C -29.8270 -4.1950 -20.5190 C.2 1 UNL1 -0.0360 + 6 C -30.5090 -5.2430 -19.8580 C.2 1 UNL1 -0.0710 + 7 C -29.8490 -6.4540 -19.5590 C.2 1 UNL1 0.0250 + 8 C -28.5040 -6.5860 -19.9310 C.ar 1 UNL1 -0.0710 + 9 C -27.6350 -7.6490 -19.7600 C.ar 1 UNL1 -0.1800 + 10 H -25.7950 -5.4290 -21.2870 H 1 UNL1 0.3100 + 11 C -25.1620 -7.9800 -20.4240 C.2 1 UNL1 0.8430 + 12 OXT -24.8330 -8.3350 -21.5470 O.co2 1 UNL1 -0.8210 + 13 O -24.5110 -8.2620 -19.4300 O.co2 1 UNL1 -0.8210 + 14 C -27.9650 -8.9670 -19.0800 C.3 1 UNL1 0.1040 + 15 C -27.6810 -10.1940 -19.9750 C.3 1 UNL1 -0.0250 + 16 C -28.9650 -10.8820 -20.5020 C.3 1 UNL1 0.2810 + 17 O -30.0540 -9.9340 -20.5080 O.2 1 UNL1 -0.3520 + 18 C -31.2830 -10.2070 -19.9390 C.2 1 UNL1 0.1360 + 19 C -32.4120 -10.1970 -20.7820 C.2 1 UNL1 -0.0540 + 20 C -33.6980 -10.4540 -20.2680 C.2 1 UNL1 0.0120 + 21 C -33.8280 -10.7240 -18.8990 C.2 1 UNL1 -0.1440 + 22 C -32.7180 -10.7450 -18.0670 C.2 1 UNL1 -0.0520 + 23 C -35.0980 -11.0220 -18.1370 C.3 1 UNL1 0.0490 + 24 C -31.4330 -10.4910 -18.5650 C.2 1 UNL1 0.0400 + 25 C -33.0930 -11.0620 -16.6410 C.3 1 UNL1 0.0880 + 26 C -34.5860 -11.4800 -16.7430 C.3 1 UNL1 -0.0140 +@BOND + 1 12 11 ar + 2 10 2 1 + 3 4 3 2 + 4 4 5 1 + 5 2 3 ar + 6 2 1 ar + 7 19 20 1 + 8 19 18 2 + 9 3 8 ar + 10 5 6 2 + 11 17 16 1 + 12 17 18 1 + 13 16 15 1 + 14 11 1 1 + 15 11 13 ar + 16 1 9 ar + 17 20 21 2 + 18 15 14 1 + 19 18 24 1 + 20 8 9 ar + 21 8 7 2 + 22 6 7 1 + 23 9 14 1 + 24 21 23 1 + 25 21 22 1 + 26 24 22 2 + 27 23 26 1 + 28 22 25 1 + 29 26 25 1 +########## Name: lig_47 +########## Vina_BE: -9.526 +########## MW: 329.244 +########## clogP: 0.864 +########## nonHatoms: 27 +########## Vina_LE: -0.353 +########## Vina_LipE: -10.39 +########## Close_contacts: 1 +########## Hydrophob_contacts: 19 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_47.pdbqt + 27 30 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.9140 -8.8790 -18.8600 C.3 1 UNL1 0.0930 + 2 C -27.6450 -7.6400 -19.6840 C.ar 1 UNL1 -0.1990 + 3 C -28.5520 -6.5430 -19.9350 C.ar 1 UNL1 -0.0570 + 4 C -29.8690 -6.3280 -19.5040 C.2 1 UNL1 0.0210 + 5 C -27.9050 -5.6210 -20.7110 C.ar 1 UNL1 -0.0420 + 6 C -30.5120 -5.1360 -19.9010 C.2 1 UNL1 -0.0640 + 7 C -29.8370 -4.1910 -20.7060 C.2 1 UNL1 -0.0370 + 8 C -28.5100 -4.4280 -21.1210 C.2 1 UNL1 -0.0300 + 9 N -26.6290 -6.0660 -20.9660 N.ar 1 UNL1 -0.2230 + 10 CA -26.4370 -7.3030 -20.3210 C.ar 1 UNL1 -0.0140 + 11 H -25.9030 -5.5960 -21.4880 H 1 UNL1 0.2970 + 12 C -25.1280 -8.0260 -20.3760 C.2 1 UNL1 0.9180 + 13 OXT -24.8250 -8.5070 -21.4570 O.co2 1 UNL1 -0.8120 + 14 O -24.4170 -8.1420 -19.3920 O.co2 1 UNL1 -0.8120 + 15 C -27.6000 -10.1840 -19.6300 C.3 1 UNL1 -0.0190 + 16 C -28.7960 -10.7220 -20.4560 C.3 1 UNL1 0.2750 + 17 O -29.9000 -9.7880 -20.3860 O.2 1 UNL1 -0.3530 + 18 C -31.1370 -10.1500 -19.8950 C.2 1 UNL1 0.1180 + 19 C -32.2430 -10.1360 -20.7580 C.2 1 UNL1 -0.0080 + 20 C -33.5250 -10.4600 -20.2710 C.2 1 UNL1 -0.0380 + 21 C -33.7230 -10.7940 -18.9200 C.2 1 UNL1 0.3580 + 22 N -34.9630 -11.0780 -18.4730 N.2 1 UNL1 -0.6790 + 23 C -32.5990 -10.8150 -18.0630 C.2 1 UNL1 -0.1170 + 24 C -35.1240 -11.3790 -17.1710 C.2 1 UNL1 0.3890 + 25 C -34.0630 -11.4110 -16.2540 C.2 1 UNL1 -0.1390 + 26 C -32.7650 -11.1220 -16.7040 C.2 1 UNL1 0.1450 + 27 C -31.3180 -10.5150 -18.5530 C.2 1 UNL1 0.0340 +@BOND + 1 11 9 1 + 2 13 12 ar + 3 8 5 1 + 4 8 7 2 + 5 9 5 ar + 6 9 10 ar + 7 19 20 1 + 8 19 18 2 + 9 5 3 ar + 10 7 6 1 + 11 16 17 1 + 12 16 15 1 + 13 17 18 1 + 14 12 10 1 + 15 12 14 ar + 16 10 2 ar + 17 20 21 2 + 18 3 2 ar + 19 3 4 1 + 20 6 4 2 + 21 18 27 1 + 22 2 1 1 + 23 15 1 1 + 24 21 22 1 + 25 21 23 1 + 26 27 23 2 + 27 22 24 2 + 28 23 26 1 + 29 24 25 1 + 30 26 25 2 +########## Name: lig_48 +########## Vina_BE: -9.041 +########## MW: 318.241 +########## clogP: 1.356 +########## nonHatoms: 27 +########## Vina_LE: -0.335 +########## Vina_LipE: -10.397 +########## Close_contacts: 1 +########## Hydrophob_contacts: 24 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_48.pdbqt + 27 30 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -28.2170 -9.2990 -19.1190 C.3 1 UNL1 0.1070 + 2 C -27.8560 -7.9430 -19.6700 C.ar 1 UNL1 -0.1800 + 3 C -28.6240 -6.7310 -19.8460 C.ar 1 UNL1 -0.0710 + 4 C -29.9630 -6.4640 -19.5340 C.2 1 UNL1 0.0260 + 5 C -27.8180 -5.7650 -20.4150 C.ar 1 UNL1 -0.0400 + 6 C -30.4690 -5.1790 -19.8180 C.2 1 UNL1 -0.0710 + 7 C -29.6410 -4.1920 -20.4010 C.2 1 UNL1 -0.0360 + 8 C -28.2950 -4.4810 -20.7080 C.2 1 UNL1 -0.0330 + 9 N -26.5480 -6.2640 -20.6340 N.ar 1 UNL1 -0.2150 + 10 CA -26.5470 -7.5900 -20.1940 C.ar 1 UNL1 0.0420 + 11 H -25.7450 -5.8080 -21.0410 H 1 UNL1 0.3100 + 12 C -25.3180 -8.4340 -20.3050 C.2 1 UNL1 0.8440 + 13 O -24.8310 -8.5330 -21.4230 O.co2 1 UNL1 -0.8220 + 14 OXT -24.8460 -9.0020 -19.3320 O.co2 1 UNL1 -0.8220 + 15 C -28.1750 -10.4000 -20.2080 C.3 1 UNL1 -0.0260 + 16 C -29.5480 -10.7100 -20.8470 C.3 1 UNL1 0.2890 + 17 O -30.5560 -9.7650 -20.4280 O.2 1 UNL1 -0.3500 + 18 C -31.8310 -10.1030 -20.0240 C.2 1 UNL1 0.1940 + 19 C -32.8500 -10.0680 -20.9970 C.2 1 UNL1 -0.0790 + 20 C -34.1770 -10.4370 -20.6820 C.2 1 UNL1 0.0210 + 21 C -34.5040 -10.8660 -19.3820 C.2 1 UNL1 -0.0830 + 22 C -33.4780 -10.9120 -18.4320 C.2 1 UNL1 -0.0070 + 23 N -33.5850 -11.2990 -17.1080 N.pl3 1 UNL1 -0.2530 + 24 C -32.1720 -10.5460 -18.7300 C.2 1 UNL1 -0.1320 + 25 C -32.2940 -11.1330 -16.6240 C.2 1 UNL1 0.0400 + 26 C -31.4240 -10.6950 -17.5750 C.2 1 UNL1 0.0740 + 27 H -34.4150 -11.5520 -16.5990 H 1 UNL1 0.2770 +@BOND + 1 13 12 ar + 2 11 9 1 + 3 19 20 1 + 4 19 18 2 + 5 16 17 1 + 6 16 15 1 + 7 8 5 1 + 8 8 7 2 + 9 20 21 2 + 10 9 5 ar + 11 9 10 ar + 12 17 18 1 + 13 5 3 ar + 14 7 6 1 + 15 12 10 1 + 16 12 14 ar + 17 15 1 1 + 18 10 2 ar + 19 18 24 1 + 20 3 2 ar + 21 3 4 1 + 22 6 4 2 + 23 2 1 1 + 24 21 22 1 + 25 24 22 2 + 26 24 26 1 + 27 22 23 1 + 28 26 25 2 + 29 23 25 1 + 30 23 27 1 +########## Name: lig_49 +########## Vina_BE: -8.901 +########## MW: 362.122 +########## clogP: 3.003 +########## nonHatoms: 26 +########## Vina_LE: -0.342 +########## Vina_LipE: -11.904 +########## Close_contacts: 1 +########## Hydrophob_contacts: 18 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_49.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -31.1140 -10.1250 -19.7080 C.ar 1 UNL1 -0.1740 + 2 CA -30.0860 -10.0790 -18.6840 C.ar 1 UNL1 0.0510 + 3 N -30.6310 -10.3800 -17.4360 N.ar 1 UNL1 -0.2090 + 4 C -31.9680 -10.6540 -17.6350 C.ar 1 UNL1 -0.0400 + 5 C -32.8940 -11.0400 -16.6590 C.2 1 UNL1 -0.0230 + 6 C -34.2140 -11.3040 -17.0680 C.2 1 UNL1 -0.0280 + 7 C -34.5720 -11.1840 -18.4280 C.2 1 UNL1 -0.0470 + 8 C -33.6230 -10.7960 -19.3970 C.2 1 UNL1 0.0560 + 9 CL -34.1360 -10.6990 -21.0710 Cl 1 UNL1 -0.1430 + 10 C -32.3060 -10.5250 -18.9720 C.ar 1 UNL1 -0.0600 + 11 H -30.0900 -10.4140 -16.5860 H 1 UNL1 0.3140 + 12 C -28.6310 -9.7810 -18.8220 C.2 1 UNL1 0.8390 + 13 O -28.2350 -8.7710 -18.2570 O.co2 1 UNL1 -0.8100 + 14 OXT -27.8920 -10.5290 -19.4400 O.co2 1 UNL1 -0.8100 + 15 C -30.8500 -9.8190 -21.1630 C.3 1 UNL1 0.1160 + 16 C -30.2670 -8.3990 -21.3610 C.3 1 UNL1 0.0410 + 17 C -31.0980 -7.2990 -20.6730 C.3 1 UNL1 0.2120 + 18 O -30.3290 -6.7410 -19.5930 O.2 1 UNL1 -0.3330 + 19 C -29.6060 -5.5920 -19.7860 C.2 1 UNL1 0.1530 + 20 C -28.2360 -5.6490 -20.0870 C.2 1 UNL1 -0.0300 + 21 C -27.5040 -4.4640 -20.2980 C.2 1 UNL1 -0.0340 + 22 C -26.0210 -4.5420 -20.6310 C.3 1 UNL1 0.0910 + 23 C -28.1650 -3.2200 -20.2070 C.2 1 UNL1 -0.0280 + 24 C -29.5390 -3.1670 -19.9170 C.2 1 UNL1 0.0370 + 25 CL -27.3050 -1.7130 -20.4610 Cl 1 UNL1 -0.1260 + 26 C -30.2600 -4.3560 -19.7110 C.2 1 UNL1 -0.0160 +@BOND + 1 16 15 1 + 2 16 17 1 + 3 15 1 1 + 4 9 8 1 + 5 17 18 1 + 6 22 21 1 + 7 25 23 1 + 8 21 23 2 + 9 21 20 1 + 10 23 24 1 + 11 20 19 2 + 12 24 26 2 + 13 19 26 1 + 14 19 18 1 + 15 1 10 ar + 16 1 2 ar + 17 14 12 ar + 18 8 10 1 + 19 8 7 2 + 20 10 4 ar + 21 12 2 1 + 22 12 13 ar + 23 2 3 ar + 24 7 6 1 + 25 4 3 ar + 26 4 5 1 + 27 3 11 1 + 28 6 5 2 +########## Name: lig_50 +########## Vina_BE: -8.542 +########## MW: 374.133 +########## clogP: 3.158 +########## nonHatoms: 27 +########## Vina_LE: -0.316 +########## Vina_LipE: -11.7 +########## Close_contacts: 0 +########## Hydrophob_contacts: 22 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_50.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.3250 -6.5050 -20.5670 C.ar 1 UNL1 -0.1640 + 2 CA -26.0290 -6.0180 -20.8000 C.ar 1 UNL1 -0.0500 + 3 N -26.0690 -4.6200 -20.6760 N.ar 1 UNL1 -0.2090 + 4 C -27.3600 -4.2340 -20.4020 C.ar 1 UNL1 -0.0360 + 5 C -27.8400 -2.9300 -20.2310 C.2 1 UNL1 -0.0240 + 6 C -29.2160 -2.7660 -19.9830 C.2 1 UNL1 -0.0220 + 7 C -30.0640 -3.8950 -19.9220 C.2 1 UNL1 -0.0480 + 8 C -29.5510 -5.1970 -20.1020 C.2 1 UNL1 0.0590 + 9 CL -30.6700 -6.5450 -20.0460 Cl 1 UNL1 -0.1270 + 10 C -28.1680 -5.3420 -20.3350 C.ar 1 UNL1 -0.0630 + 11 H -25.2560 -4.0350 -20.8030 H 1 UNL1 0.3140 + 12 C -24.7680 -6.7440 -21.1320 C.2 1 UNL1 0.9330 + 13 OXT -24.1000 -7.1100 -20.1760 O.co2 1 UNL1 -0.8180 + 14 O -24.4200 -6.9290 -22.2860 O.co2 1 UNL1 -0.8180 + 15 C -27.6910 -7.9720 -20.5690 C.3 1 UNL1 0.1110 + 16 C -27.4960 -8.6280 -19.1780 C.3 1 UNL1 -0.0170 + 17 C -28.4140 -9.8470 -18.9660 C.3 1 UNL1 0.2780 + 18 O -29.4860 -9.7900 -19.9270 O.2 1 UNL1 -0.3480 + 19 C -30.7690 -10.1010 -19.5530 C.2 1 UNL1 0.1430 + 20 C -31.8180 -10.0860 -20.4860 C.2 1 UNL1 -0.0060 + 21 C -33.1250 -10.4230 -20.0910 C.2 1 UNL1 -0.0430 + 22 C -34.2440 -10.3930 -21.1230 C.3 1 UNL1 0.0850 + 23 C -33.3720 -10.7890 -18.7490 C.2 1 UNL1 -0.0300 + 24 C -32.3150 -10.8230 -17.8130 C.2 1 UNL1 -0.0430 + 25 CL -35.0010 -11.2150 -18.2430 Cl 1 UNL1 -0.1380 + 26 C -31.0140 -10.4810 -18.2280 C.2 1 UNL1 -0.0060 + 27 C -32.5570 -11.2280 -16.3660 C.3 1 UNL1 0.0850 +@BOND + 1 14 12 ar + 2 12 2 1 + 3 12 13 ar + 4 22 21 1 + 5 11 3 1 + 6 2 3 ar + 7 2 1 ar + 8 3 4 ar + 9 15 1 1 + 10 15 16 1 + 11 1 10 ar + 12 20 21 1 + 13 20 19 2 + 14 4 10 ar + 15 4 5 1 + 16 10 8 1 + 17 5 6 2 + 18 8 9 1 + 19 8 7 2 + 20 21 23 2 + 21 6 7 1 + 22 18 19 1 + 23 18 17 1 + 24 19 26 1 + 25 16 17 1 + 26 23 25 1 + 27 23 24 1 + 28 26 24 2 + 29 24 27 1 +########## Name: lig_52 +########## Vina_BE: -8.957 +########## MW: 362.122 +########## clogP: 1.35 +########## nonHatoms: 26 +########## Vina_LE: -0.345 +########## Vina_LipE: -10.307 +########## Close_contacts: 1 +########## Hydrophob_contacts: 22 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_52.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.8520 -8.1180 -19.7580 C.ar 1 UNL1 -0.1740 + 2 CA -26.4980 -7.7530 -20.1310 C.ar 1 UNL1 0.0510 + 3 N -26.4490 -6.4140 -20.5320 N.ar 1 UNL1 -0.2090 + 4 C -27.7250 -5.9020 -20.3780 C.ar 1 UNL1 -0.0400 + 5 C -28.1490 -4.5860 -20.5970 C.2 1 UNL1 -0.0230 + 6 C -29.5010 -4.2790 -20.3370 C.2 1 UNL1 -0.1420 + 7 CL -30.0840 -2.6480 -20.5860 Cl 1 UNL1 -0.1430 + 8 C -30.3840 -5.2740 -19.8680 C.2 1 UNL1 -0.0570 + 9 C -29.9300 -6.5920 -19.6560 C.2 1 UNL1 0.1800 + 10 C -28.5850 -6.8810 -19.9230 C.ar 1 UNL1 -0.0600 + 11 H -25.6040 -5.9420 -20.8160 H 1 UNL1 0.3140 + 12 C -25.2650 -8.5920 -20.0980 C.2 1 UNL1 0.8390 + 13 OXT -24.4890 -8.5190 -19.1590 O.co2 1 UNL1 -0.8100 + 14 O -25.0800 -9.3190 -21.0620 O.co2 1 UNL1 -0.8100 + 15 C -28.2600 -9.4600 -19.2020 C.3 1 UNL1 0.1160 + 16 C -28.2300 -10.5730 -20.2760 C.3 1 UNL1 0.0410 + 17 C -29.5990 -10.8060 -20.9460 C.3 1 UNL1 0.2120 + 18 O -30.5310 -9.8360 -20.4290 O.2 1 UNL1 -0.3330 + 19 C -31.6760 -10.1770 -19.7440 C.2 1 UNL1 0.1530 + 20 C -31.5360 -10.5720 -18.4060 C.2 1 UNL1 -0.0300 + 21 C -32.6560 -10.9590 -17.6470 C.2 1 UNL1 -0.0340 + 22 C -32.4770 -11.3900 -16.1990 C.3 1 UNL1 0.0910 + 23 C -33.9310 -10.9470 -18.2480 C.2 1 UNL1 -0.0280 + 24 C -34.0760 -10.5610 -19.5910 C.2 1 UNL1 0.0370 + 25 CL -35.3640 -11.4160 -17.3520 Cl 1 UNL1 -0.1260 + 26 C -32.9520 -10.1770 -20.3410 C.2 1 UNL1 -0.0160 +@BOND + 1 14 12 ar + 2 17 18 1 + 3 17 16 1 + 4 11 3 1 + 5 5 4 2 + 6 5 6 1 + 7 7 6 1 + 8 3 4 ar + 9 3 2 ar + 10 18 19 1 + 11 4 10 ar + 12 26 19 2 + 13 26 24 1 + 14 6 8 2 + 15 16 15 1 + 16 2 12 1 + 17 2 1 ar + 18 12 13 ar + 19 10 1 ar + 20 10 9 2 + 21 8 9 1 + 22 1 15 1 + 23 19 20 1 + 24 24 23 2 + 25 20 21 2 + 26 23 21 1 + 27 23 25 1 + 28 21 22 1 +########## Name: lig_53 +########## Vina_BE: -8.884 +########## MW: 374.133 +########## clogP: 1.505 +########## nonHatoms: 27 +########## Vina_LE: -0.329 +########## Vina_LipE: -10.389 +########## Close_contacts: 1 +########## Hydrophob_contacts: 19 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_53.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.4930 -7.5630 -19.7060 C.ar 1 UNL1 -0.1640 + 2 CA -26.2640 -7.2710 -20.3140 C.ar 1 UNL1 -0.0500 + 3 N -26.3850 -6.0200 -20.9450 N.ar 1 UNL1 -0.2090 + 4 C -27.6650 -5.5450 -20.7490 C.ar 1 UNL1 -0.0360 + 5 C -28.2340 -4.3510 -21.2080 C.2 1 UNL1 -0.0240 + 6 C -29.5800 -4.0990 -20.8750 C.2 1 UNL1 -0.1370 + 7 CL -30.3500 -2.6240 -21.4180 Cl 1 UNL1 -0.1270 + 8 C -30.3140 -5.0310 -20.1060 C.2 1 UNL1 -0.0580 + 9 C -29.7090 -6.2260 -19.6620 C.2 1 UNL1 0.1840 + 10 C -28.3690 -6.4530 -20.0040 C.ar 1 UNL1 -0.0630 + 11 H -25.6350 -5.5820 -21.4600 H 1 UNL1 0.3140 + 12 C -25.0080 -8.0750 -20.3470 C.2 1 UNL1 0.9330 + 13 O -24.2970 -8.1800 -19.3590 O.co2 1 UNL1 -0.8180 + 14 OXT -24.7520 -8.6250 -21.4080 O.co2 1 UNL1 -0.8180 + 15 C -27.7950 -8.8210 -18.9320 C.3 1 UNL1 0.1110 + 16 C -27.4140 -10.0980 -19.7220 C.3 1 UNL1 -0.0170 + 17 C -28.6280 -10.7510 -20.4130 C.3 1 UNL1 0.2780 + 18 O -29.7140 -9.8020 -20.4340 O.2 1 UNL1 -0.3480 + 19 C -30.9370 -10.1390 -19.9090 C.2 1 UNL1 0.1430 + 20 C -31.0870 -10.4170 -18.5400 C.2 1 UNL1 -0.0060 + 21 C -32.3510 -10.7460 -18.0180 C.2 1 UNL1 -0.0430 + 22 C -32.4840 -11.0510 -16.5320 C.3 1 UNL1 0.0850 + 23 C -33.4710 -10.7810 -18.8770 C.2 1 UNL1 -0.0300 + 24 C -33.3250 -10.4840 -20.2500 C.2 1 UNL1 -0.0430 + 25 CL -35.0570 -11.1870 -18.2350 Cl 1 UNL1 -0.1380 + 26 C -32.0520 -10.1580 -20.7540 C.2 1 UNL1 -0.0060 + 27 C -34.5220 -10.5060 -21.1910 C.3 1 UNL1 0.0850 +@BOND + 1 11 3 1 + 2 7 6 1 + 3 14 12 ar + 4 5 6 1 + 5 5 4 2 + 6 27 24 1 + 7 3 4 ar + 8 3 2 ar + 9 6 8 2 + 10 26 24 1 + 11 26 19 2 + 12 4 10 ar + 13 18 17 1 + 14 18 19 1 + 15 17 16 1 + 16 12 2 1 + 17 12 13 ar + 18 2 1 ar + 19 24 23 2 + 20 8 9 1 + 21 10 1 ar + 22 10 9 2 + 23 19 20 1 + 24 16 15 1 + 25 1 15 1 + 26 23 25 1 + 27 23 21 1 + 28 20 21 2 + 29 21 22 1 +########## Name: lig_56 +########## Vina_BE: -8.925 +########## MW: 349.683 +########## clogP: 0.609 +########## nonHatoms: 26 +########## Vina_LE: -0.343 +########## Vina_LipE: -9.534 +########## Close_contacts: 0 +########## Hydrophob_contacts: 24 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_56.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.4550 -7.3340 -19.8560 C.ar 1 UNL1 -0.1970 + 2 C -26.3090 -6.8700 -20.6270 C.ar 1 UNL1 0.0660 + 3 N -26.6100 -5.6230 -21.2190 N.ar 1 UNL1 -0.0970 + 4 C -25.7570 -4.8220 -22.1110 C.3 1 UNL1 0.1750 + 5 C -27.8930 -5.2830 -20.8030 C.ar 1 UNL1 -0.0460 + 6 C -28.6200 -4.1140 -21.0850 C.2 1 UNL1 -0.0230 + 7 C -29.9070 -3.9760 -20.5260 C.2 1 UNL1 -0.0410 + 8 C -30.4410 -4.9890 -19.7000 C.2 1 UNL1 -0.0640 + 9 C -29.6930 -6.1520 -19.4280 C.2 1 UNL1 0.0090 + 10 C -28.4200 -6.2720 -19.9990 C.ar 1 UNL1 -0.0690 + 11 C -24.9910 -7.5780 -20.7780 C.2 1 UNL1 0.8400 + 12 O -24.1440 -7.4930 -19.9030 O.co2 1 UNL1 -0.8120 + 13 O -24.7720 -8.2130 -21.8000 O.co2 1 UNL1 -0.8120 + 14 C -27.5220 -8.6230 -19.0730 C.3 1 UNL1 0.0980 + 15 C -27.2500 -9.8630 -19.9550 C.3 1 UNL1 0.0270 + 16 C -28.5290 -10.6320 -20.3420 C.3 1 UNL1 0.2560 + 17 O -29.6450 -9.7220 -20.2950 O.2 1 UNL1 -0.3370 + 18 C -30.8630 -10.0770 -19.7660 C.2 1 UNL1 0.1610 + 19 C -31.9630 -10.1270 -20.6310 C.2 1 UNL1 -0.0360 + 20 C -33.2360 -10.4850 -20.1550 C.2 1 UNL1 -0.0350 + 21 C -34.4160 -10.5110 -21.1160 C.3 1 UNL1 0.0850 + 22 C -33.3990 -10.8090 -18.7900 C.2 1 UNL1 -0.0350 + 23 C -32.2930 -10.7690 -17.9130 C.2 1 UNL1 -0.0350 + 24 CL -34.9840 -11.2690 -18.1840 Cl 1 UNL1 -0.1280 + 25 C -31.0290 -10.4000 -18.4080 C.2 1 UNL1 -0.0360 + 26 C -32.4490 -11.1180 -16.4390 C.3 1 UNL1 0.0850 +@BOND + 1 4 3 1 + 2 13 11 ar + 3 3 5 ar + 4 3 2 ar + 5 21 20 1 + 6 6 5 2 + 7 6 7 1 + 8 5 10 ar + 9 11 2 1 + 10 11 12 ar + 11 19 20 1 + 12 19 18 2 + 13 2 1 ar + 14 7 8 2 + 15 16 17 1 + 16 16 15 1 + 17 17 18 1 + 18 20 22 2 + 19 10 1 ar + 20 10 9 2 + 21 15 14 1 + 22 1 14 1 + 23 18 25 1 + 24 8 9 1 + 25 22 24 1 + 26 22 23 1 + 27 25 23 2 + 28 23 26 1 +########## Name: lig_58 +########## Vina_BE: -8.891 +########## MW: 385.136 +########## clogP: 1.372 +########## nonHatoms: 27 +########## Vina_LE: -0.329 +########## Vina_LipE: -10.263 +########## Close_contacts: 1 +########## Hydrophob_contacts: 22 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_58.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.5310 -7.6030 -19.6140 C.ar 1 UNL1 -0.1800 + 2 C -26.2640 -7.2590 -20.2470 C.ar 1 UNL1 0.0600 + 3 N -26.3800 -6.0060 -20.8880 N.ar 1 UNL1 -0.0930 + 4 C -25.3410 -5.2780 -21.6330 C.3 1 UNL1 0.1810 + 5 C -27.6870 -5.5730 -20.6850 C.ar 1 UNL1 -0.0420 + 6 C -28.2950 -4.3920 -21.1450 C.2 1 UNL1 0.0010 + 7 C -29.6480 -4.1710 -20.8180 C.2 1 UNL1 0.0120 + 8 CL -30.4450 -2.7130 -21.3710 Cl 1 UNL1 -0.1500 + 9 C -30.3670 -5.1130 -20.0540 C.2 1 UNL1 -0.0410 + 10 C -29.7390 -6.2920 -19.6050 C.2 1 UNL1 0.0370 + 11 C -28.3920 -6.4930 -19.9380 C.ar 1 UNL1 -0.0650 + 12 C -25.0110 -8.0910 -20.2460 C.2 1 UNL1 0.8390 + 13 O -24.8200 -8.8740 -21.1620 O.co2 1 UNL1 -0.8140 + 14 O -24.2010 -7.9890 -19.3360 O.co2 1 UNL1 -0.8140 + 15 C -27.8010 -8.8740 -18.8490 C.3 1 UNL1 0.1100 + 16 C -27.4320 -10.1360 -19.6680 C.3 1 UNL1 -0.0230 + 17 C -28.6470 -10.7550 -20.3880 C.3 1 UNL1 0.2740 + 18 O -29.7260 -9.7980 -20.3900 O.2 1 UNL1 -0.3490 + 19 C -30.9550 -10.1370 -19.8790 C.2 1 UNL1 0.1360 + 20 C -32.0990 -10.1650 -20.6930 C.2 1 UNL1 -0.0030 + 21 C -33.3450 -10.5290 -20.1550 C.2 1 UNL1 -0.0420 + 22 C -34.5700 -10.5420 -21.0590 C.3 1 UNL1 0.0890 + 23 C -33.4380 -10.8800 -18.7900 C.2 1 UNL1 -0.0280 + 24 C -32.2860 -10.8700 -17.9730 C.2 1 UNL1 -0.0420 + 25 CL -34.9910 -11.3380 -18.1050 Cl 1 UNL1 -0.1370 + 26 C -31.0480 -10.5010 -18.5310 C.2 1 UNL1 -0.0030 + 27 C -32.3620 -11.2550 -16.5020 C.3 1 UNL1 0.0890 +@BOND + 1 4 3 1 + 2 8 7 1 + 3 13 12 ar + 4 6 7 1 + 5 6 5 2 + 6 22 21 1 + 7 3 5 ar + 8 3 2 ar + 9 7 9 2 + 10 20 21 1 + 11 20 19 2 + 12 5 11 ar + 13 18 17 1 + 14 18 19 1 + 15 17 16 1 + 16 2 12 1 + 17 2 1 ar + 18 12 14 ar + 19 21 23 2 + 20 9 10 1 + 21 11 1 ar + 22 11 10 2 + 23 19 26 1 + 24 16 15 1 + 25 1 15 1 + 26 23 25 1 + 27 23 24 1 + 28 26 24 2 + 29 24 27 1 +########## Name: lig_60 +########## Vina_BE: -8.707 +########## MW: 355.73 +########## clogP: 1.475 +########## nonHatoms: 25 +########## Vina_LE: -0.348 +########## Vina_LipE: -10.182 +########## Close_contacts: 1 +########## Hydrophob_contacts: 25 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_60.pdbqt + 25 27 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.3450 -8.4870 -19.2570 C.3 1 UNL1 0.0980 + 2 C -27.2570 -7.1770 -20.0130 C.ar 1 UNL1 -0.1170 + 3 C -26.1280 -6.7730 -20.7390 C.ar 1 UNL1 -0.0730 + 4 S -26.3360 -5.1930 -21.5450 S.2 1 UNL1 0.0590 + 5 C -27.9490 -5.0610 -20.8420 C.ar 1 UNL1 -0.1180 + 6 C -28.8200 -3.9730 -21.0040 C.2 1 UNL1 0.0270 + 7 C -28.2960 -6.1590 -20.0780 C.ar 1 UNL1 -0.0690 + 8 C -30.0720 -4.0040 -20.3630 C.2 1 UNL1 -0.0420 + 9 C -30.4340 -5.1180 -19.5800 C.2 1 UNL1 -0.0390 + 10 C -29.5470 -6.2010 -19.4360 C.2 1 UNL1 0.0130 + 11 C -24.8320 -7.4940 -20.8930 C.2 1 UNL1 0.9090 + 12 O -24.0730 -7.6330 -19.9480 O.co2 1 UNL1 -0.8140 + 13 O -24.5480 -7.9080 -22.0060 O.co2 1 UNL1 -0.8140 + 14 C -27.1660 -9.7200 -20.1760 C.3 1 UNL1 0.0340 + 15 C -28.4310 -10.5960 -20.2750 C.3 1 UNL1 0.2510 + 16 O -29.5780 -9.7290 -20.3540 O.2 1 UNL1 -0.3350 + 17 C -30.8040 -10.0720 -19.8320 C.2 1 UNL1 0.1600 + 18 C -31.8990 -10.0950 -20.7030 C.2 1 UNL1 -0.0360 + 19 C -33.1820 -10.4270 -20.2340 C.2 1 UNL1 -0.0340 + 20 C -34.3580 -10.4210 -21.2010 C.3 1 UNL1 0.0860 + 21 C -33.3580 -10.7560 -18.8730 C.2 1 UNL1 -0.0340 + 22 C -32.2550 -10.7450 -17.9910 C.2 1 UNL1 -0.0340 + 23 CL -34.9560 -11.1820 -18.2740 Cl 1 UNL1 -0.1270 + 24 C -30.9810 -10.4000 -18.4770 C.2 1 UNL1 -0.0360 + 25 C -32.4250 -11.0990 -16.5190 C.3 1 UNL1 0.0860 +@BOND + 1 13 11 ar + 2 4 5 ar + 3 4 3 ar + 4 20 19 1 + 5 6 5 2 + 6 6 8 1 + 7 11 3 1 + 8 11 12 ar + 9 5 7 ar + 10 3 2 ar + 11 18 19 1 + 12 18 17 2 + 13 8 9 2 + 14 16 15 1 + 15 16 17 1 + 16 15 14 1 + 17 19 21 2 + 18 14 1 1 + 19 7 2 ar + 20 7 10 2 + 21 2 1 1 + 22 17 24 1 + 23 9 10 1 + 24 21 23 1 + 25 21 22 1 + 26 24 22 2 + 27 22 25 1 +########## Name: lig_61 +########## Vina_BE: -8.688 +########## MW: 391.183 +########## clogP: 3.892 +########## nonHatoms: 26 +########## Vina_LE: -0.334 +########## Vina_LipE: -12.58 +########## Close_contacts: 0 +########## Hydrophob_contacts: 21 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_61.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.3600 -6.4920 -20.5530 C.ar 1 UNL1 -0.1210 + 2 C -26.0360 -6.0820 -20.7720 C.ar 1 UNL1 -0.3280 + 3 S -25.7810 -4.3390 -20.5890 S.2 1 UNL1 0.2480 + 4 C -27.5080 -4.1410 -20.2920 C.ar 1 UNL1 -0.0670 + 5 C -28.1230 -2.8980 -20.0770 C.2 1 UNL1 0.0330 + 6 C -29.5120 -2.8500 -19.8860 C.2 1 UNL1 -0.0310 + 7 C -30.2610 -4.0390 -19.9320 C.2 1 UNL1 -0.0180 + 8 C -29.6330 -5.2810 -20.1500 C.2 1 UNL1 0.0490 + 9 CL -30.6980 -6.6720 -20.2390 Cl 1 UNL1 -0.1180 + 10 C -28.2250 -5.3300 -20.3170 C.ar 1 UNL1 -0.0270 + 11 C -24.8420 -6.8960 -21.1200 C.2 1 UNL1 0.9220 + 12 O -24.1310 -7.2370 -20.1910 O.co2 1 UNL1 -0.8090 + 13 O -24.5750 -7.1750 -22.2760 O.co2 1 UNL1 -0.8090 + 14 C -27.7360 -7.9590 -20.5430 C.3 1 UNL1 0.1020 + 15 C -27.4750 -8.6210 -19.1670 C.3 1 UNL1 -0.0120 + 16 C -28.4030 -9.8240 -18.9090 C.3 1 UNL1 0.2760 + 17 O -29.4700 -9.8110 -19.8810 O.2 1 UNL1 -0.3520 + 18 C -30.7520 -10.1340 -19.5090 C.2 1 UNL1 0.1360 + 19 C -31.7980 -10.1510 -20.4460 C.2 1 UNL1 -0.0060 + 20 C -33.1010 -10.4990 -20.0470 C.2 1 UNL1 -0.0400 + 21 C -34.2190 -10.5010 -21.0820 C.3 1 UNL1 0.0910 + 22 C -33.3490 -10.8440 -18.6990 C.2 1 UNL1 -0.0280 + 23 C -32.2930 -10.8450 -17.7610 C.2 1 UNL1 -0.0400 + 24 CL -34.9740 -11.2820 -18.1900 Cl 1 UNL1 -0.1390 + 25 C -30.9970 -10.4920 -18.1780 C.2 1 UNL1 -0.0060 + 26 C -32.5360 -11.2250 -16.3060 C.3 1 UNL1 0.0910 +@BOND + 1 13 11 ar + 2 11 2 1 + 3 11 12 ar + 4 21 20 1 + 5 2 3 ar + 6 2 1 ar + 7 3 4 ar + 8 1 14 1 + 9 1 10 ar + 10 14 15 1 + 11 19 20 1 + 12 19 18 2 + 13 10 4 ar + 14 10 8 1 + 15 4 5 1 + 16 9 8 1 + 17 8 7 2 + 18 5 6 2 + 19 20 22 2 + 20 7 6 1 + 21 17 18 1 + 22 17 16 1 + 23 18 25 1 + 24 15 16 1 + 25 22 24 1 + 26 22 23 1 + 27 25 23 2 + 28 23 26 1 +########## Name: lig_63 +########## Vina_BE: -8.721 +########## MW: 391.183 +########## clogP: 2.239 +########## nonHatoms: 26 +########## Vina_LE: -0.335 +########## Vina_LipE: -10.96 +########## Close_contacts: 1 +########## Hydrophob_contacts: 19 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_63.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.3630 -7.4980 -19.7430 C.ar 1 UNL1 -0.1210 + 2 C -26.0950 -7.3840 -20.3260 C.ar 1 UNL1 -0.3280 + 3 S -25.8790 -5.9080 -21.2920 S.2 1 UNL1 0.2480 + 4 C -27.5510 -5.4570 -20.9390 C.ar 1 UNL1 -0.0670 + 5 C -28.2040 -4.3080 -21.4120 C.2 1 UNL1 0.0330 + 6 C -29.5480 -4.0960 -21.0530 C.2 1 UNL1 -0.1500 + 7 CL -30.3930 -2.6750 -21.6300 Cl 1 UNL1 -0.1180 + 8 C -30.2170 -5.0280 -20.2360 C.2 1 UNL1 -0.0270 + 9 C -29.5430 -6.1730 -19.7710 C.2 1 UNL1 0.1770 + 10 C -28.1990 -6.3730 -20.1300 C.ar 1 UNL1 -0.0270 + 11 C -24.9520 -8.3240 -20.2420 C.2 1 UNL1 0.9220 + 12 O -24.1630 -8.1390 -19.3320 O.co2 1 UNL1 -0.8090 + 13 O -24.8110 -9.2140 -21.0610 O.co2 1 UNL1 -0.8090 + 14 C -27.7630 -8.6520 -18.8540 C.3 1 UNL1 0.1020 + 15 C -27.4470 -10.0140 -19.5120 C.3 1 UNL1 -0.0120 + 16 C -28.6240 -10.5390 -20.3550 C.3 1 UNL1 0.2760 + 17 O -29.7130 -9.6010 -20.2620 O.2 1 UNL1 -0.3520 + 18 C -30.9210 -10.0170 -19.7660 C.2 1 UNL1 0.1360 + 19 C -32.0180 -10.1020 -20.6290 C.2 1 UNL1 -0.0060 + 20 C -33.2700 -10.5280 -20.1500 C.2 1 UNL1 -0.0400 + 21 C -34.4540 -10.6010 -21.1040 C.3 1 UNL1 0.0910 + 22 C -33.4070 -10.8780 -18.7880 C.2 1 UNL1 -0.0280 + 23 C -32.2990 -10.7990 -17.9160 C.2 1 UNL1 -0.0400 + 24 CL -34.9660 -11.4150 -18.1760 Cl 1 UNL1 -0.1390 + 25 C -31.0560 -10.3660 -18.4160 C.2 1 UNL1 -0.0060 + 26 C -32.4270 -11.1730 -16.4460 C.3 1 UNL1 0.0910 +@BOND + 1 7 6 1 + 2 5 6 1 + 3 5 4 2 + 4 3 4 ar + 5 3 2 ar + 6 21 20 1 + 7 13 11 ar + 8 6 8 2 + 9 4 10 ar + 10 19 20 1 + 11 19 18 2 + 12 16 17 1 + 13 16 15 1 + 14 2 11 1 + 15 2 1 ar + 16 17 18 1 + 17 11 12 ar + 18 8 9 1 + 19 20 22 2 + 20 10 9 2 + 21 10 1 ar + 22 18 25 1 + 23 1 14 1 + 24 15 14 1 + 25 22 24 1 + 26 22 23 1 + 27 25 23 2 + 28 23 26 1 +########## Name: lig_65 +########## Vina_BE: -8.838 +########## MW: 391.183 +########## clogP: 2.165 +########## nonHatoms: 26 +########## Vina_LE: -0.34 +########## Vina_LipE: -11.003 +########## Close_contacts: 0 +########## Hydrophob_contacts: 26 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_65.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.2600 -7.2720 -19.9340 C.ar 1 UNL1 -0.1210 + 2 C -26.1240 -6.8400 -20.6280 C.ar 1 UNL1 -0.3280 + 3 S -26.2810 -5.2050 -21.3100 S.2 1 UNL1 0.2480 + 4 C -27.9340 -5.1210 -20.6860 C.ar 1 UNL1 -0.0670 + 5 C -28.8290 -4.0490 -20.8500 C.2 1 UNL1 -0.0920 + 6 CL -28.3620 -2.6010 -21.7200 Cl 1 UNL1 -0.1180 + 7 C -30.1210 -4.1490 -20.3050 C.2 1 UNL1 -0.0250 + 8 C -30.5060 -5.3130 -19.6120 C.2 1 UNL1 -0.0270 + 9 C -29.5970 -6.3780 -19.4590 C.2 1 UNL1 0.1770 + 10 C -28.3050 -6.2640 -20.0000 C.ar 1 UNL1 -0.0270 + 11 C -24.8500 -7.5660 -20.8600 C.2 1 UNL1 0.9220 + 12 O -24.6180 -7.9070 -22.0060 O.co2 1 UNL1 -0.8090 + 13 O -24.0990 -7.8210 -19.9340 O.co2 1 UNL1 -0.8090 + 14 C -27.3460 -8.6110 -19.2430 C.3 1 UNL1 0.1020 + 15 C -27.2660 -9.7780 -20.2520 C.3 1 UNL1 -0.0120 + 16 C -28.5610 -10.6100 -20.2860 C.3 1 UNL1 0.2760 + 17 O -29.6840 -9.7100 -20.3670 O.2 1 UNL1 -0.3520 + 18 C -30.8990 -10.0680 -19.8390 C.2 1 UNL1 0.1360 + 19 C -32.0070 -10.1440 -20.6910 C.2 1 UNL1 -0.0060 + 20 C -33.2670 -10.5170 -20.1890 C.2 1 UNL1 -0.0400 + 21 C -34.4620 -10.5780 -21.1320 C.3 1 UNL1 0.0910 + 22 C -33.4050 -10.8230 -18.8180 C.2 1 UNL1 -0.0280 + 23 C -32.2870 -10.7560 -17.9570 C.2 1 UNL1 -0.0400 + 24 CL -34.9740 -11.2940 -18.1780 Cl 1 UNL1 -0.1390 + 25 C -31.0350 -10.3780 -18.4780 C.2 1 UNL1 -0.0060 + 26 C -32.4140 -11.0870 -16.4760 C.3 1 UNL1 0.0910 +@BOND + 1 12 11 ar + 2 6 5 1 + 3 3 4 ar + 4 3 2 ar + 5 21 20 1 + 6 11 2 1 + 7 11 13 ar + 8 5 4 2 + 9 5 7 1 + 10 19 20 1 + 11 19 18 2 + 12 4 10 ar + 13 2 1 ar + 14 17 16 1 + 15 17 18 1 + 16 7 8 2 + 17 16 15 1 + 18 15 14 1 + 19 20 22 2 + 20 10 1 ar + 21 10 9 2 + 22 1 14 1 + 23 18 25 1 + 24 8 9 1 + 25 22 24 1 + 26 22 23 1 + 27 25 23 2 + 28 23 26 1 +########## Name: lig_67 +########## Vina_BE: -8.697 +########## MW: 339.665 +########## clogP: 1.007 +########## nonHatoms: 25 +########## Vina_LE: -0.348 +########## Vina_LipE: -9.704 +########## Close_contacts: 0 +########## Hydrophob_contacts: 25 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_67.pdbqt + 25 27 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.6910 -8.8360 -19.0340 C.3 1 UNL1 0.0980 + 2 C -27.6050 -7.5050 -19.7340 C.ar 1 UNL1 -0.2120 + 3 C -26.4190 -6.9830 -20.3950 C.ar 1 UNL1 0.0090 + 4 O -26.6620 -5.7470 -20.9620 O.2 1 UNL1 0.0590 + 5 C -27.9770 -5.4580 -20.6940 C.ar 1 UNL1 -0.1550 + 6 C -28.6880 -4.3110 -21.0740 C.2 1 UNL1 0.0130 + 7 C -28.5790 -6.4680 -19.9710 C.ar 1 UNL1 -0.0580 + 8 C -30.0430 -4.2140 -20.6990 C.2 1 UNL1 -0.0330 + 9 C -30.6580 -5.2490 -19.9600 C.2 1 UNL1 -0.0480 + 10 C -29.9240 -6.3940 -19.5890 C.2 1 UNL1 0.0180 + 11 C -25.0650 -7.5880 -20.5320 C.2 1 UNL1 0.9360 + 12 O -24.7780 -8.2410 -21.5240 O.co2 1 UNL1 -0.7970 + 13 O -24.2610 -7.3950 -19.6330 O.co2 1 UNL1 -0.7970 + 14 C -27.3170 -10.0130 -19.9700 C.3 1 UNL1 -0.0200 + 15 C -28.5310 -10.8850 -20.3420 C.3 1 UNL1 0.2790 + 16 O -29.6380 -10.0230 -20.6750 O.2 1 UNL1 -0.3530 + 17 C -30.8780 -10.2470 -20.1310 C.2 1 UNL1 0.1350 + 18 C -32.0270 -10.2850 -20.9370 C.2 1 UNL1 -0.0070 + 19 C -33.2880 -10.5310 -20.3670 C.2 1 UNL1 -0.0400 + 20 C -34.5170 -10.5590 -21.2650 C.3 1 UNL1 0.0930 + 21 C -33.3900 -10.7530 -18.9760 C.2 1 UNL1 -0.0270 + 22 C -32.2330 -10.7330 -18.1650 C.2 1 UNL1 -0.0400 + 23 CL -34.9610 -11.0640 -18.2500 Cl 1 UNL1 -0.1370 + 24 C -30.9810 -10.4830 -18.7550 C.2 1 UNL1 -0.0070 + 25 C -32.3210 -10.9810 -16.6660 C.3 1 UNL1 0.0930 +@BOND + 1 12 11 ar + 2 20 19 1 + 3 6 8 1 + 4 6 5 2 + 5 4 5 ar + 6 4 3 ar + 7 18 19 1 + 8 18 17 2 + 9 8 9 2 + 10 5 7 ar + 11 16 15 1 + 12 16 17 1 + 13 11 3 1 + 14 11 13 ar + 15 3 2 ar + 16 19 21 2 + 17 15 14 1 + 18 17 24 1 + 19 7 2 ar + 20 7 10 2 + 21 14 1 1 + 22 9 10 1 + 23 2 1 1 + 24 21 23 1 + 25 21 22 1 + 26 24 22 2 + 27 22 25 1 +########## Name: ligand +########## Vina_BE: -12.089 +########## MW: 373.704 +########## clogP: 1.841 +########## nonHatoms: 28 +########## Vina_LE: -0.432 +########## Vina_LipE: -13.93 +########## Close_contacts: 0 +########## Hydrophob_contacts: 26 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +ligand.pdbqt + 28 32 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -32.2190 -11.2460 -16.8320 C.2 1 UNL1 0.0110 + 2 C -33.5520 -11.2480 -17.2920 C.2 1 UNL1 0.0120 + 3 C -33.8610 -10.7960 -18.5880 C.2 1 UNL1 0.0160 + 4 C -26.6210 -7.3160 -20.3240 C.2 1 UNL1 0.0190 + 5 C -25.2940 -7.6020 -19.9380 C.2 1 UNL1 -0.1150 + 6 C -25.0320 -8.8130 -19.2720 C.2 1 UNL1 0.0410 + 7 C -26.0700 -9.7210 -19.0160 C.2 1 UNL1 -0.0250 + 8 C -29.3020 -10.7160 -20.1990 C.3 1 UNL1 0.2580 + 9 C -30.1400 -8.3650 -19.6170 C.3 1 UNL1 0.3010 + 10 C -27.6900 -8.2030 -20.0640 C.2 1 UNL1 0.0750 + 11 C -27.3850 -9.4330 -19.4140 C.2 1 UNL1 0.0310 + 12 C -30.5440 -9.8090 -20.0100 C.3 1 UNL1 -0.0410 + 13 C -32.9170 -9.8210 -20.8180 C.3 1 UNL1 0.0590 + 14 N -29.0090 -7.8510 -20.4150 N.pl3 1 UNL1 -0.6510 + 15 O -28.3150 -10.4320 -19.1930 O.2 1 UNL1 -0.3510 + 16 C -32.8150 -10.3480 -19.4080 C.2 1 UNL1 -0.0810 + 17 C -31.5000 -10.3500 -18.9620 C.2 1 UNL1 -0.0680 + 18 C -31.1800 -10.7920 -17.6680 C.2 1 UNL1 0.0660 + 19 CL -34.8330 -11.8140 -16.2420 Cl 1 UNL1 -0.1220 + 20 C -31.4400 -9.8280 -21.2890 C.3 1 UNL1 0.0350 + 21 C -24.1750 -6.6240 -20.2290 C.2 1 UNL1 0.9090 + 22 O -23.5440 -6.1780 -19.2830 O.co2 1 UNL1 -0.8300 + 23 O -23.9540 -6.3330 -21.3940 O.co2 1 UNL1 -0.8300 + 24 C -29.3330 -6.7330 -21.3270 C.3 1 UNL1 0.3130 + 25 C -30.1880 -5.6340 -20.6630 C.3 1 UNL1 -0.0270 + 26 C -29.7040 -5.0680 -19.2860 C.3 1 UNL1 0.0090 + 27 C -30.4270 -3.7490 -19.7060 C.3 1 UNL1 -0.0210 + 28 C -30.0580 -4.1570 -21.1680 C.3 1 UNL1 0.0090 +@BOND + 1 23 21 ar + 2 24 25 1 + 3 24 14 1 + 4 20 13 1 + 5 20 12 1 + 6 28 25 1 + 7 28 27 1 + 8 13 16 1 + 9 25 26 1 + 10 14 10 1 + 11 14 9 1 + 12 4 10 2 + 13 4 5 1 + 14 21 5 1 + 15 21 22 ar + 16 8 12 1 + 17 8 15 1 + 18 10 11 1 + 19 12 9 1 + 20 12 17 1 + 21 5 6 2 + 22 27 26 1 + 23 11 15 1 + 24 11 7 2 + 25 16 17 2 + 26 16 3 1 + 27 6 7 1 + 28 17 18 1 + 29 3 2 2 + 30 18 1 2 + 31 2 1 1 + 32 2 19 1 diff --git a/docking_mcl1/MTH_Results_all/VinaResults_6o6f_M231L_H.mol2 b/docking_mcl1/MTH_Results_all/VinaResults_6o6f_M231L_H.mol2 new file mode 100644 index 0000000..5f7a2a2 --- /dev/null +++ b/docking_mcl1/MTH_Results_all/VinaResults_6o6f_M231L_H.mol2 @@ -0,0 +1,2000 @@ +########## Name: lig_27 +########## Vina_BE: -8.183 +########## MW: 279.205 +########## clogP: -0.331 +########## nonHatoms: 23 +########## Vina_LE: -0.356 +########## Vina_LipE: -7.852 +########## Close_contacts: 0 +########## Hydrophob_contacts: 23 +########## HBonds: 0 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_27.pdbqt + 23 25 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 CA -28.0420 -6.3140 -20.9130 C.ar 1 UNL1 0.0410 + 2 N -26.6580 -6.2460 -21.0530 N.ar 1 UNL1 -0.2150 + 3 C -26.1940 -7.3770 -20.4150 C.ar 1 UNL1 -0.0400 + 4 C -24.8670 -7.7920 -20.2480 C.2 1 UNL1 -0.0330 + 5 C -24.6400 -8.9920 -19.5440 C.2 1 UNL1 -0.0360 + 6 C -25.7260 -9.7360 -19.0270 C.2 1 UNL1 -0.0710 + 7 C -27.0530 -9.2930 -19.2090 C.2 1 UNL1 0.0250 + 8 C -27.2630 -8.1000 -19.9160 C.ar 1 UNL1 -0.0710 + 9 C -28.4390 -7.4420 -20.2260 C.ar 1 UNL1 -0.1800 + 10 H -26.1580 -5.5000 -21.5140 H 1 UNL1 0.3100 + 11 C -28.9270 -5.2400 -21.4630 C.2 1 UNL1 0.8430 + 12 O -29.2600 -5.3630 -22.6340 O.co2 1 UNL1 -0.8210 + 13 OXT -29.2790 -4.2910 -20.7760 O.co2 1 UNL1 -0.8210 + 14 C -29.8520 -7.8680 -19.8790 C.3 1 UNL1 0.1040 + 15 C -30.3890 -8.9130 -20.8870 C.3 1 UNL1 -0.0260 + 16 C -30.5480 -10.3280 -20.2870 C.3 1 UNL1 0.2820 + 17 O -30.9270 -10.2540 -18.8940 O.2 1 UNL1 -0.3520 + 18 C -32.1770 -10.5940 -18.4250 C.2 1 UNL1 0.1340 + 19 C -32.4040 -10.9420 -17.0800 C.2 1 UNL1 -0.0120 + 20 C -33.6950 -11.2990 -16.6550 C.2 1 UNL1 0.0100 + 21 C -34.7570 -11.3220 -17.5760 C.2 1 UNL1 -0.0710 + 22 C -34.5280 -10.9910 -18.9210 C.2 1 UNL1 0.0100 + 23 C -33.2360 -10.6320 -19.3420 C.2 1 UNL1 -0.0120 +@BOND + 1 12 11 ar + 2 10 2 1 + 3 11 1 1 + 4 11 13 ar + 5 2 1 ar + 6 2 3 ar + 7 1 9 ar + 8 15 16 1 + 9 15 14 1 + 10 3 4 2 + 11 3 8 ar + 12 16 17 1 + 13 4 5 1 + 14 9 8 ar + 15 9 14 1 + 16 8 7 2 + 17 5 6 2 + 18 23 22 1 + 19 23 18 2 + 20 7 6 1 + 21 22 21 2 + 22 17 18 1 + 23 18 19 1 + 24 21 20 1 + 25 19 20 2 +########## Name: lig_28 +########## Vina_BE: -8.78 +########## MW: 291.216 +########## clogP: -0.176 +########## nonHatoms: 24 +########## Vina_LE: -0.366 +########## Vina_LipE: -8.604 +########## Close_contacts: 0 +########## Hydrophob_contacts: 27 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_28.pdbqt + 24 26 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.6470 -7.8010 -19.7670 C.ar 1 UNL1 -0.1860 + 2 CA -26.3950 -7.4970 -20.4370 C.ar 1 UNL1 0.0480 + 3 N -26.3220 -6.1300 -20.7280 N.ar 1 UNL1 -0.2140 + 4 C -27.4950 -5.5570 -20.2720 C.ar 1 UNL1 -0.0430 + 5 C -27.8750 -4.2120 -20.3470 C.2 1 UNL1 -0.0330 + 6 C -29.1340 -3.8540 -19.8220 C.2 1 UNL1 -0.0390 + 7 C -29.9750 -4.8340 -19.2480 C.2 1 UNL1 -0.0730 + 8 C -29.5670 -6.1820 -19.1900 C.2 1 UNL1 0.0200 + 9 C -28.3090 -6.5170 -19.7050 C.ar 1 UNL1 -0.0730 + 10 H -25.5410 -5.6970 -21.1960 H 1 UNL1 0.3100 + 11 C -25.2790 -8.4160 -20.8060 C.2 1 UNL1 0.8380 + 12 OXT -24.8940 -9.2780 -20.0320 O.co2 1 UNL1 -0.8150 + 13 O -24.7850 -8.2500 -21.9130 O.co2 1 UNL1 -0.8150 + 14 C -28.0390 -9.1600 -19.2420 C.3 1 UNL1 0.0980 + 15 C -28.5680 -10.1000 -20.3540 C.3 1 UNL1 0.0250 + 16 C -29.7720 -10.9750 -19.9340 C.3 1 UNL1 0.2440 + 17 O -30.9570 -10.1680 -19.7780 O.2 1 UNL1 -0.3680 + 18 C -31.9490 -10.5250 -18.8940 C.2 1 UNL1 0.1200 + 19 C -31.6080 -10.7160 -17.5470 C.2 1 UNL1 0.0070 + 20 C -32.5930 -11.0750 -16.6110 C.2 1 UNL1 -0.0080 + 21 C -33.9250 -11.2270 -17.0270 C.2 1 UNL1 -0.0310 + 22 C -34.2720 -11.0150 -18.3710 C.2 1 UNL1 -0.0040 + 23 C -33.2900 -10.6560 -19.3150 C.2 1 UNL1 -0.0960 + 24 C -33.6900 -10.4330 -20.7680 C.3 1 UNL1 0.0900 +@BOND + 1 13 11 ar + 2 10 3 1 + 3 11 2 1 + 4 11 12 ar + 5 24 23 1 + 6 3 2 ar + 7 3 4 ar + 8 2 1 ar + 9 15 16 1 + 10 15 14 1 + 11 5 4 2 + 12 5 6 1 + 13 4 9 ar + 14 16 17 1 + 15 6 7 2 + 16 17 18 1 + 17 1 9 ar + 18 1 14 1 + 19 9 8 2 + 20 23 18 2 + 21 23 22 1 + 22 7 8 1 + 23 18 19 1 + 24 22 21 2 + 25 19 20 2 + 26 21 20 1 +########## Name: lig_30 +########## Vina_BE: -8.871 +########## MW: 291.216 +########## clogP: -0.176 +########## nonHatoms: 24 +########## Vina_LE: -0.37 +########## Vina_LipE: -8.695 +########## Close_contacts: 1 +########## Hydrophob_contacts: 29 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_30.pdbqt + 24 26 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.5630 -7.7470 -19.7800 C.ar 1 UNL1 -0.1930 + 2 CA -26.3600 -7.4680 -20.4460 C.ar 1 UNL1 -0.0370 + 3 N -26.3590 -6.0990 -20.7690 N.ar 1 UNL1 -0.2140 + 4 C -27.5300 -5.5340 -20.3150 C.ar 1 UNL1 -0.0420 + 5 C -27.9490 -4.2020 -20.4100 C.2 1 UNL1 -0.0300 + 6 C -29.2030 -3.8700 -19.8570 C.2 1 UNL1 -0.0380 + 7 C -29.9950 -4.8630 -19.2350 C.2 1 UNL1 -0.0670 + 8 C -29.5410 -6.1960 -19.1570 C.2 1 UNL1 0.0130 + 9 C -28.2900 -6.5000 -19.7120 C.ar 1 UNL1 -0.0730 + 10 H -25.5980 -5.6470 -21.2540 H 1 UNL1 0.3100 + 11 C -25.2300 -8.3800 -20.7880 C.2 1 UNL1 0.9270 + 12 OXT -24.8170 -9.2010 -19.9850 O.co2 1 UNL1 -0.8140 + 13 O -24.7550 -8.2480 -21.9080 O.co2 1 UNL1 -0.8140 + 14 C -27.9580 -9.0950 -19.2280 C.3 1 UNL1 0.0990 + 15 C -28.2990 -10.1180 -20.3350 C.3 1 UNL1 0.0220 + 16 C -29.5210 -10.9960 -19.9770 C.3 1 UNL1 0.2540 + 17 O -30.3900 -10.2850 -19.0700 O.2 1 UNL1 -0.3400 + 18 C -31.7600 -10.4440 -19.0290 C.2 1 UNL1 0.1530 + 19 C -32.4730 -10.2520 -20.2200 C.2 1 UNL1 -0.0370 + 20 C -33.8680 -10.4100 -20.2490 C.2 1 UNL1 0.0140 + 21 C -34.5550 -10.7650 -19.0770 C.2 1 UNL1 -0.0660 + 22 C -33.8520 -10.9610 -17.8750 C.2 1 UNL1 -0.0450 + 23 C -34.5890 -11.3490 -16.6050 C.3 1 UNL1 0.0690 + 24 C -32.4550 -10.8040 -17.8560 C.2 1 UNL1 -0.0500 +@BOND + 1 13 11 ar + 2 10 3 1 + 3 11 2 1 + 4 11 12 ar + 5 3 2 ar + 6 3 4 ar + 7 2 1 ar + 8 5 4 2 + 9 5 6 1 + 10 15 16 1 + 11 15 14 1 + 12 4 9 ar + 13 20 19 1 + 14 20 21 2 + 15 19 18 2 + 16 16 17 1 + 17 6 7 2 + 18 1 9 ar + 19 1 14 1 + 20 9 8 2 + 21 7 8 1 + 22 21 22 1 + 23 17 18 1 + 24 18 24 1 + 25 22 24 2 + 26 22 23 1 +########## Name: lig_31 +########## Vina_BE: -9.36 +########## MW: 348.211 +########## clogP: 2.342 +########## nonHatoms: 27 +########## Vina_LE: -0.347 +########## Vina_LipE: -11.702 +########## Close_contacts: 1 +########## Hydrophob_contacts: 23 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 2 +@MOLECULE +lig_31.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -28.0010 -8.9420 -19.0850 C.3 1 UNL1 0.1040 + 2 C -27.5750 -7.6320 -19.7060 C.ar 1 UNL1 -0.1820 + 3 C -28.3110 -6.3880 -19.7090 C.ar 1 UNL1 -0.0710 + 4 C -29.5770 -6.0750 -19.1940 C.2 1 UNL1 0.0250 + 5 C -27.5470 -5.4400 -20.3340 C.ar 1 UNL1 -0.0390 + 6 C -30.0410 -4.7500 -19.3390 C.2 1 UNL1 -0.0680 + 7 C -29.2450 -3.7760 -19.9850 C.2 1 UNL1 -0.0330 + 8 C -27.9750 -4.1170 -20.4940 C.2 1 UNL1 -0.0310 + 9 N -26.3610 -6.0130 -20.7340 N.ar 1 UNL1 -0.2140 + 10 CA -26.3550 -7.3660 -20.3490 C.ar 1 UNL1 -0.0480 + 11 H -25.5880 -5.5710 -21.2110 H 1 UNL1 0.3110 + 12 C -25.1970 -8.2640 -20.6300 C.2 1 UNL1 0.9330 + 13 OXT -24.6180 -8.7170 -19.6550 O.co2 1 UNL1 -0.8230 + 14 O -24.8370 -8.4920 -21.7730 O.co2 1 UNL1 -0.8230 + 15 C -27.8930 -10.1230 -20.0760 C.3 1 UNL1 -0.0240 + 16 C -29.2600 -10.7640 -20.4190 C.3 1 UNL1 0.2880 + 17 O -30.3060 -9.7760 -20.2810 O.2 1 UNL1 -0.3460 + 18 C -31.6070 -10.1310 -20.0000 C.2 1 UNL1 0.1330 + 19 C -32.5920 -10.1620 -21.0000 C.2 1 UNL1 0.0660 + 20 C -33.9010 -10.5550 -20.6820 C.2 1 UNL1 0.0390 + 21 C -34.2280 -10.9120 -19.3630 C.2 1 UNL1 -0.0020 + 22 C -33.2490 -10.8800 -18.3460 C.2 1 UNL1 -0.1540 + 23 C -31.9390 -10.4730 -18.6800 C.2 1 UNL1 0.0190 + 24 C -33.6110 -11.2660 -16.9080 C.3 1 UNL1 0.6870 + 25 F -32.5170 -11.6080 -16.1960 F 1 UNL1 -0.2490 + 26 F -34.2080 -10.2540 -16.2360 F 1 UNL1 -0.2490 + 27 F -34.4600 -12.3160 -16.8410 F 1 UNL1 -0.2490 +@BOND + 1 14 12 ar + 2 11 9 1 + 3 19 20 1 + 4 19 18 2 + 5 9 10 ar + 6 9 5 ar + 7 20 21 2 + 8 12 10 1 + 9 12 13 ar + 10 8 5 1 + 11 8 7 2 + 12 16 17 1 + 13 16 15 1 + 14 10 2 ar + 15 5 3 ar + 16 17 18 1 + 17 15 1 1 + 18 18 23 1 + 19 7 6 1 + 20 3 2 ar + 21 3 4 1 + 22 2 1 1 + 23 21 22 1 + 24 6 4 2 + 25 23 22 2 + 26 22 24 1 + 27 24 27 1 + 28 24 26 1 + 29 24 25 1 +########## Name: lig_32 +########## Vina_BE: -8.905 +########## MW: 291.216 +########## clogP: -0.176 +########## nonHatoms: 24 +########## Vina_LE: -0.371 +########## Vina_LipE: -8.729 +########## Close_contacts: 1 +########## Hydrophob_contacts: 26 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_32.pdbqt + 24 26 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.5910 -7.6910 -19.7450 C.ar 1 UNL1 -0.1930 + 2 CA -26.3580 -7.4220 -20.3540 C.ar 1 UNL1 -0.0370 + 3 N -26.3470 -6.0610 -20.7150 N.ar 1 UNL1 -0.2140 + 4 C -27.5350 -5.4870 -20.3170 C.ar 1 UNL1 -0.0430 + 5 C -27.9430 -4.1530 -20.4350 C.2 1 UNL1 -0.0300 + 6 C -29.2110 -3.8100 -19.9210 C.2 1 UNL1 -0.0380 + 7 C -30.0250 -4.7920 -19.3110 C.2 1 UNL1 -0.0670 + 8 C -29.5820 -6.1270 -19.2100 C.2 1 UNL1 0.0140 + 9 C -28.3200 -6.4430 -19.7290 C.ar 1 UNL1 -0.0720 + 10 H -25.5640 -5.6150 -21.1680 H 1 UNL1 0.3100 + 11 C -25.2010 -8.3310 -20.6040 C.2 1 UNL1 0.9270 + 12 OXT -24.6630 -8.9350 -19.6890 O.co2 1 UNL1 -0.8150 + 13 O -24.8200 -8.4060 -21.7640 O.co2 1 UNL1 -0.8150 + 14 C -28.0040 -9.0240 -19.1690 C.3 1 UNL1 0.0980 + 15 C -28.0580 -10.1370 -20.2410 C.3 1 UNL1 0.0230 + 16 C -29.4180 -10.8640 -20.2920 C.3 1 UNL1 0.2520 + 17 O -30.4590 -9.9240 -19.9640 O.2 1 UNL1 -0.3390 + 18 C -31.5150 -10.2870 -19.1630 C.2 1 UNL1 0.1480 + 19 C -32.8140 -10.4440 -19.6780 C.2 1 UNL1 -0.0390 + 20 C -33.8650 -10.8310 -18.8300 C.2 1 UNL1 0.0230 + 21 C -33.6250 -11.0650 -17.4640 C.2 1 UNL1 -0.1370 + 22 C -34.7650 -11.4820 -16.5490 C.3 1 UNL1 0.0600 + 23 C -32.3220 -10.9160 -16.9550 C.2 1 UNL1 0.0230 + 24 C -31.2710 -10.5330 -17.8050 C.2 1 UNL1 -0.0390 +@BOND + 1 13 11 ar + 2 10 3 1 + 3 3 2 ar + 4 3 4 ar + 5 11 2 1 + 6 11 12 ar + 7 5 4 2 + 8 5 6 1 + 9 2 1 ar + 10 4 9 ar + 11 16 15 1 + 12 16 17 1 + 13 15 14 1 + 14 17 18 1 + 15 6 7 2 + 16 1 9 ar + 17 1 14 1 + 18 9 8 2 + 19 19 18 2 + 20 19 20 1 + 21 7 8 1 + 22 18 24 1 + 23 20 21 2 + 24 24 23 2 + 25 21 23 1 + 26 21 22 1 +########## Name: lig_33 +########## Vina_BE: -8.553 +########## MW: 314.658 +########## clogP: 0.432 +########## nonHatoms: 24 +########## Vina_LE: -0.356 +########## Vina_LipE: -8.985 +########## Close_contacts: 0 +########## Hydrophob_contacts: 23 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_33.pdbqt + 24 26 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 CA -26.3420 -7.3000 -20.3580 C.ar 1 UNL1 -0.0480 + 2 N -26.3520 -5.9370 -20.7030 N.ar 1 UNL1 -0.2140 + 3 C -27.5520 -5.3860 -20.3060 C.ar 1 UNL1 -0.0400 + 4 C -27.9990 -4.0690 -20.4570 C.2 1 UNL1 -0.0310 + 5 C -29.2830 -3.7550 -19.9660 C.2 1 UNL1 -0.0350 + 6 C -30.0760 -4.7490 -19.3480 C.2 1 UNL1 -0.0700 + 7 C -29.5940 -6.0700 -19.2140 C.2 1 UNL1 0.0250 + 8 C -28.3140 -6.3540 -19.7090 C.ar 1 UNL1 -0.0710 + 9 C -27.5600 -7.5860 -19.7240 C.ar 1 UNL1 -0.1810 + 10 H -25.5860 -5.4800 -21.1770 H 1 UNL1 0.3100 + 11 C -25.1970 -8.2110 -20.6600 C.2 1 UNL1 0.9320 + 12 O -24.8230 -8.2340 -21.8240 O.co2 1 UNL1 -0.8210 + 13 OXT -24.6850 -8.8990 -19.7880 O.co2 1 UNL1 -0.8210 + 14 C -27.9410 -8.9460 -19.2010 C.3 1 UNL1 0.1060 + 15 C -28.0380 -9.9900 -20.3390 C.3 1 UNL1 -0.0250 + 16 C -29.3430 -10.8180 -20.3230 C.3 1 UNL1 0.2840 + 17 O -30.4860 -9.9710 -20.0620 O.2 1 UNL1 -0.3480 + 18 C -31.5000 -10.2940 -19.1870 C.2 1 UNL1 0.1390 + 19 C -32.7850 -10.4790 -19.7150 C.2 1 UNL1 0.0010 + 20 C -33.8540 -10.8370 -18.8770 C.2 1 UNL1 0.0380 + 21 C -33.6320 -11.0200 -17.5020 C.2 1 UNL1 -0.0310 + 22 CL -34.9620 -11.4690 -16.4550 Cl 1 UNL1 -0.1370 + 23 C -32.3460 -10.8450 -16.9670 C.2 1 UNL1 0.0380 + 24 C -31.2770 -10.4900 -17.8100 C.2 1 UNL1 0.0010 +@BOND + 1 12 11 ar + 2 10 2 1 + 3 2 1 ar + 4 2 3 ar + 5 11 1 1 + 6 11 13 ar + 7 4 3 2 + 8 4 5 1 + 9 1 9 ar + 10 15 16 1 + 11 15 14 1 + 12 16 17 1 + 13 3 8 ar + 14 17 18 1 + 15 5 6 2 + 16 9 8 ar + 17 9 14 1 + 18 19 18 2 + 19 19 20 1 + 20 8 7 2 + 21 6 7 1 + 22 18 24 1 + 23 20 21 2 + 24 24 23 2 + 25 21 23 1 + 26 21 22 1 +########## Name: lig_34 +########## Vina_BE: -9.378 +########## MW: 348.211 +########## clogP: 2.342 +########## nonHatoms: 27 +########## Vina_LE: -0.347 +########## Vina_LipE: -11.72 +########## Close_contacts: 0 +########## Hydrophob_contacts: 25 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_34.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.4860 -8.6250 -19.1750 C.3 1 UNL1 0.1040 + 2 C -27.2810 -7.2760 -19.8250 C.ar 1 UNL1 -0.1820 + 3 C -28.1790 -6.1440 -19.7940 C.ar 1 UNL1 -0.0710 + 4 C -29.4450 -6.0000 -19.2100 C.2 1 UNL1 0.0250 + 5 C -27.5850 -5.1090 -20.4620 C.ar 1 UNL1 -0.0390 + 6 C -30.0920 -4.7520 -19.3290 C.2 1 UNL1 -0.0680 + 7 C -29.4710 -3.6850 -20.0180 C.2 1 UNL1 -0.0330 + 8 C -28.1970 -3.8560 -20.5970 C.2 1 UNL1 -0.0310 + 9 N -26.3540 -5.5180 -20.9220 N.ar 1 UNL1 -0.2140 + 10 CA -26.1420 -6.8530 -20.5310 C.ar 1 UNL1 -0.0480 + 11 H -25.6750 -4.9810 -21.4380 H 1 UNL1 0.3110 + 12 C -24.8880 -7.5900 -20.8650 C.2 1 UNL1 0.9330 + 13 OXT -24.7430 -7.9020 -22.0360 O.co2 1 UNL1 -0.8230 + 14 O -24.0820 -7.8910 -19.9980 O.co2 1 UNL1 -0.8230 + 15 C -27.3670 -9.7900 -20.1830 C.3 1 UNL1 -0.0240 + 16 C -28.6810 -10.5920 -20.3550 C.3 1 UNL1 0.2880 + 17 O -29.8150 -9.7150 -20.1620 O.2 1 UNL1 -0.3460 + 18 C -30.9500 -10.1210 -19.4930 C.2 1 UNL1 0.1330 + 19 C -30.9310 -10.4800 -18.1360 C.2 1 UNL1 0.0660 + 20 C -32.1190 -10.8560 -17.4850 C.2 1 UNL1 0.0390 + 21 C -33.3440 -10.8840 -18.1870 C.2 1 UNL1 -0.1370 + 22 C -33.3500 -10.5340 -19.5540 C.2 1 UNL1 -0.0190 + 23 C -32.1600 -10.1610 -20.2010 C.2 1 UNL1 0.0190 + 24 C -34.6560 -11.2700 -17.4920 C.3 1 UNL1 0.6870 + 25 F -34.9390 -12.5830 -17.6470 F 1 UNL1 -0.2490 + 26 F -34.6540 -11.0370 -16.1610 F 1 UNL1 -0.2490 + 27 F -35.7050 -10.5900 -18.0030 F 1 UNL1 -0.2490 +@BOND + 1 13 12 ar + 2 11 9 1 + 3 9 10 ar + 4 9 5 ar + 5 12 10 1 + 6 12 14 ar + 7 8 5 1 + 8 8 7 2 + 9 10 2 ar + 10 5 3 ar + 11 16 15 1 + 12 16 17 1 + 13 23 22 1 + 14 23 18 2 + 15 15 1 1 + 16 17 18 1 + 17 7 6 1 + 18 2 3 ar + 19 2 1 1 + 20 3 4 1 + 21 22 21 2 + 22 18 19 1 + 23 6 4 2 + 24 21 24 1 + 25 21 20 1 + 26 19 20 2 + 27 27 24 1 + 28 25 24 1 + 29 24 26 1 +########## Name: lig_35 +########## Vina_BE: -8.66 +########## MW: 326.669 +########## clogP: 0.587 +########## nonHatoms: 25 +########## Vina_LE: -0.346 +########## Vina_LipE: -9.247 +########## Close_contacts: 0 +########## Hydrophob_contacts: 27 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_35.pdbqt + 25 27 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.1990 -7.2800 -19.9070 C.ar 1 UNL1 -0.1950 + 2 CA -26.1300 -6.7880 -20.6700 C.ar 1 UNL1 -0.0370 + 3 N -26.4550 -5.4760 -21.0600 N.ar 1 UNL1 -0.2140 + 4 C -27.6790 -5.1420 -20.5240 C.ar 1 UNL1 -0.0420 + 5 C -28.3680 -3.9260 -20.6110 C.2 1 UNL1 -0.0290 + 6 C -29.6040 -3.8270 -19.9400 C.2 1 UNL1 -0.0370 + 7 C -30.1090 -4.9240 -19.2040 C.2 1 UNL1 -0.0660 + 8 C -29.3870 -6.1340 -19.1380 C.2 1 UNL1 0.0110 + 9 C -28.1660 -6.2100 -19.8190 C.ar 1 UNL1 -0.0740 + 10 H -25.8420 -4.8960 -21.6140 H 1 UNL1 0.3110 + 11 C -24.8400 -7.4430 -21.0340 C.2 1 UNL1 0.9270 + 12 OXT -24.6490 -7.8800 -22.1580 O.co2 1 UNL1 -0.8140 + 13 O -24.0170 -7.5420 -20.1350 O.co2 1 UNL1 -0.8140 + 14 C -27.2520 -8.6460 -19.2650 C.3 1 UNL1 0.0980 + 15 C -27.4790 -9.7700 -20.3020 C.3 1 UNL1 0.0260 + 16 C -28.8690 -10.4260 -20.1830 C.3 1 UNL1 0.2600 + 17 O -29.5620 -9.8370 -19.0670 O.2 1 UNL1 -0.3380 + 18 C -30.8360 -10.2040 -18.6920 C.2 1 UNL1 0.1580 + 19 C -31.8190 -10.2360 -19.6910 C.2 1 UNL1 -0.0400 + 20 C -33.1470 -10.5900 -19.3860 C.2 1 UNL1 -0.0300 + 21 C -34.1990 -10.6050 -20.4860 C.3 1 UNL1 0.0910 + 22 C -33.4820 -10.9180 -18.0560 C.2 1 UNL1 -0.0360 + 23 C -32.5010 -10.8850 -17.0510 C.2 1 UNL1 0.0390 + 24 CL -35.1190 -11.3690 -17.6150 Cl 1 UNL1 -0.1280 + 25 C -31.1790 -10.5270 -17.3660 C.2 1 UNL1 -0.0260 +@BOND + 1 12 11 ar + 2 10 3 1 + 3 3 2 ar + 4 3 4 ar + 5 11 2 1 + 6 11 13 ar + 7 2 1 ar + 8 5 4 2 + 9 5 6 1 + 10 4 9 ar + 11 21 20 1 + 12 15 16 1 + 13 15 14 1 + 14 16 17 1 + 15 6 7 2 + 16 1 9 ar + 17 1 14 1 + 18 9 8 2 + 19 19 20 1 + 20 19 18 2 + 21 20 22 2 + 22 7 8 1 + 23 17 18 1 + 24 18 25 1 + 25 22 24 1 + 26 22 23 1 + 27 25 23 2 +########## Name: lig_36 +########## Vina_BE: -8.533 +########## MW: 338.68 +########## clogP: 0.668 +########## nonHatoms: 26 +########## Vina_LE: -0.328 +########## Vina_LipE: -9.201 +########## Close_contacts: 1 +########## Hydrophob_contacts: 30 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_36.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.1690 -7.4690 -19.8100 C.ar 1 UNL1 -0.1820 + 2 CA -26.1080 -6.9800 -20.6780 C.ar 1 UNL1 0.0400 + 3 N -26.4080 -5.6910 -21.1280 N.ar 1 UNL1 -0.2140 + 4 C -27.6230 -5.3400 -20.5750 C.ar 1 UNL1 -0.0400 + 5 C -28.3230 -4.1390 -20.7400 C.2 1 UNL1 -0.0310 + 6 C -29.5590 -4.0010 -20.0750 C.2 1 UNL1 -0.0350 + 7 C -30.0600 -5.0490 -19.2700 C.2 1 UNL1 -0.0700 + 8 C -29.3330 -6.2490 -19.1210 C.2 1 UNL1 0.0250 + 9 C -28.1070 -6.3660 -19.7900 C.ar 1 UNL1 -0.0700 + 10 H -25.8090 -5.1590 -21.7420 H 1 UNL1 0.3100 + 11 C -24.8460 -7.6500 -21.1060 C.2 1 UNL1 0.8430 + 12 O -24.1410 -8.2370 -20.3020 O.co2 1 UNL1 -0.8210 + 13 OXT -24.5870 -7.6080 -22.3000 O.co2 1 UNL1 -0.8210 + 14 C -27.2150 -8.8120 -19.1200 C.3 1 UNL1 0.1050 + 15 C -27.4640 -9.9690 -20.1160 C.3 1 UNL1 -0.0250 + 16 C -28.8810 -10.5680 -19.9970 C.3 1 UNL1 0.2860 + 17 O -29.4930 -10.0270 -18.8100 O.2 1 UNL1 -0.3480 + 18 C -30.7940 -10.3360 -18.5030 C.2 1 UNL1 0.1410 + 19 C -31.7570 -10.3210 -19.5220 C.2 1 UNL1 -0.0340 + 20 C -33.1050 -10.6170 -19.2420 C.2 1 UNL1 -0.0570 + 21 C -33.4780 -10.9180 -17.9130 C.2 1 UNL1 -0.0260 + 22 C -32.5130 -10.9170 -16.8900 C.2 1 UNL1 0.0580 + 23 CL -35.1400 -11.2800 -17.4790 Cl 1 UNL1 -0.1370 + 24 C -31.1710 -10.6230 -17.1840 C.2 1 UNL1 0.0360 + 25 C -34.1220 -10.5860 -20.3780 C.3 1 UNL1 0.0570 + 26 C -33.8020 -9.4860 -21.4100 C.3 1 UNL1 0.0110 +@BOND + 1 13 11 ar + 2 10 3 1 + 3 26 25 1 + 4 3 2 ar + 5 3 4 ar + 6 11 2 1 + 7 11 12 ar + 8 5 4 2 + 9 5 6 1 + 10 2 1 ar + 11 4 9 ar + 12 25 20 1 + 13 15 16 1 + 14 15 14 1 + 15 6 7 2 + 16 16 17 1 + 17 1 9 ar + 18 1 14 1 + 19 9 8 2 + 20 19 20 1 + 21 19 18 2 + 22 7 8 1 + 23 20 21 2 + 24 17 18 1 + 25 18 24 1 + 26 21 23 1 + 27 21 22 1 + 28 24 22 2 +########## Name: lig_37 +########## Vina_BE: -8.852 +########## MW: 338.68 +########## clogP: 0.742 +########## nonHatoms: 26 +########## Vina_LE: -0.34 +########## Vina_LipE: -9.594 +########## Close_contacts: 0 +########## Hydrophob_contacts: 25 +########## HBonds: 0 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_37.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -31.3410 -10.4380 -18.7450 C.ar 1 UNL1 -0.2010 + 2 CA -31.7520 -10.2090 -20.1210 C.ar 1 UNL1 0.0730 + 3 N -33.1370 -10.3690 -20.2400 N.ar 1 UNL1 -0.2220 + 4 C -33.6150 -10.7020 -18.9870 C.ar 1 UNL1 -0.0430 + 5 C -34.9410 -10.9680 -18.6220 C.2 1 UNL1 -0.0310 + 6 C -35.2000 -11.2960 -17.2760 C.2 1 UNL1 -0.0380 + 7 C -34.1450 -11.3520 -16.3360 C.2 1 UNL1 -0.0640 + 8 C -32.8180 -11.0810 -16.7320 C.2 1 UNL1 0.0190 + 9 C -32.5820 -10.7550 -18.0740 C.ar 1 UNL1 -0.0560 + 10 H -33.6410 -10.2620 -21.1070 H 1 UNL1 0.2980 + 11 C -30.9110 -9.8610 -21.3070 C.2 1 UNL1 0.8300 + 12 O -31.0490 -8.7980 -21.8920 O.co2 1 UNL1 -0.8100 + 13 OXT -30.0790 -10.6930 -21.6440 O.co2 1 UNL1 -0.8100 + 14 C -29.9170 -10.3680 -18.2550 C.3 1 UNL1 0.0940 + 15 C -29.3740 -8.9170 -18.2500 C.3 1 UNL1 -0.0200 + 16 C -28.0190 -8.7890 -18.9740 C.3 1 UNL1 0.2770 + 17 O -28.2150 -8.0650 -20.2060 O.2 1 UNL1 -0.3530 + 18 C -28.1660 -6.6930 -20.2200 C.2 1 UNL1 0.1400 + 19 C -29.2870 -5.9210 -19.8740 C.2 1 UNL1 -0.0100 + 20 C -29.2130 -4.5180 -19.8800 C.2 1 UNL1 -0.0400 + 21 C -30.4480 -3.7070 -19.5100 C.3 1 UNL1 0.0910 + 22 C -27.9960 -3.8870 -20.2220 C.2 1 UNL1 -0.0290 + 23 C -26.8610 -4.6610 -20.5510 C.2 1 UNL1 -0.0400 + 24 CL -27.8890 -2.1320 -20.2290 Cl 1 UNL1 -0.1380 + 25 C -26.9570 -6.0640 -20.5420 C.2 1 UNL1 -0.0100 + 26 C -25.5370 -4.0010 -20.9110 C.3 1 UNL1 0.0910 +@BOND + 1 12 11 ar + 2 13 11 ar + 3 11 2 1 + 4 10 3 1 + 5 26 23 1 + 6 23 25 1 + 7 23 22 2 + 8 25 18 2 + 9 3 2 ar + 10 3 4 ar + 11 24 22 1 + 12 22 20 1 + 13 18 17 1 + 14 18 19 1 + 15 17 16 1 + 16 2 1 ar + 17 20 19 2 + 18 20 21 1 + 19 4 5 2 + 20 4 9 ar + 21 16 15 1 + 22 1 14 1 + 23 1 9 ar + 24 5 6 1 + 25 14 15 1 + 26 9 8 2 + 27 6 7 2 + 28 8 7 1 +########## Name: lig_43 +########## Vina_BE: -10.099 +########## MW: 327.248 +########## clogP: 1.685 +########## nonHatoms: 27 +########## Vina_LE: -0.374 +########## Vina_LipE: -11.784 +########## Close_contacts: 0 +########## Hydrophob_contacts: 31 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_43.pdbqt + 27 30 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.7820 -8.6430 -19.0680 C.3 1 UNL1 0.1050 + 2 C -27.4520 -7.3220 -19.7230 C.ar 1 UNL1 -0.1800 + 3 C -28.2660 -6.1270 -19.7390 C.ar 1 UNL1 -0.0710 + 4 C -29.5400 -5.8860 -19.2100 C.2 1 UNL1 0.0250 + 5 C -27.5700 -5.1460 -20.3880 C.ar 1 UNL1 -0.0400 + 6 C -30.0890 -4.5950 -19.3680 C.2 1 UNL1 -0.0700 + 7 C -29.3640 -3.5840 -20.0400 C.2 1 UNL1 -0.0350 + 8 C -28.0820 -3.8530 -20.5610 C.2 1 UNL1 -0.0330 + 9 N -26.3540 -5.6480 -20.7930 N.ar 1 UNL1 -0.2140 + 10 CA -26.2550 -6.9900 -20.3790 C.ar 1 UNL1 -0.0480 + 11 H -25.6140 -5.1650 -21.2800 H 1 UNL1 0.3100 + 12 C -25.0360 -7.8100 -20.6430 C.2 1 UNL1 0.9320 + 13 O -24.3100 -8.0160 -19.6830 O.co2 1 UNL1 -0.8220 + 14 OXT -24.7800 -8.2220 -21.7620 O.co2 1 UNL1 -0.8220 + 15 C -27.4630 -9.8510 -19.9790 C.3 1 UNL1 -0.0240 + 16 C -28.7170 -10.6690 -20.3770 C.3 1 UNL1 0.2800 + 17 O -29.8600 -9.7890 -20.4770 O.2 1 UNL1 -0.3510 + 18 C -31.0960 -10.1360 -19.9710 C.2 1 UNL1 0.1230 + 19 C -32.2050 -10.1230 -20.8310 C.2 1 UNL1 -0.0090 + 20 C -33.4890 -10.4250 -20.3400 C.2 1 UNL1 -0.0040 + 21 C -33.6640 -10.7430 -18.9810 C.2 1 UNL1 -0.0700 + 22 C -34.9440 -11.0290 -18.4700 C.2 1 UNL1 -0.0070 + 23 C -32.5470 -10.7710 -18.1200 C.2 1 UNL1 -0.0050 + 24 C -35.1070 -11.3360 -17.1080 C.2 1 UNL1 -0.0330 + 25 C -33.9930 -11.3580 -16.2520 C.2 1 UNL1 -0.0250 + 26 C -32.7130 -11.0750 -16.7580 C.2 1 UNL1 0.0610 + 27 C -31.2690 -10.4800 -18.6190 C.2 1 UNL1 0.0260 +@BOND + 1 14 12 ar + 2 11 9 1 + 3 19 20 1 + 4 19 18 2 + 5 9 5 ar + 6 9 10 ar + 7 12 10 1 + 8 12 13 ar + 9 8 5 1 + 10 8 7 2 + 11 17 16 1 + 12 17 18 1 + 13 5 3 ar + 14 10 2 ar + 15 16 15 1 + 16 20 21 2 + 17 7 6 1 + 18 15 1 1 + 19 18 27 1 + 20 3 2 ar + 21 3 4 1 + 22 2 1 1 + 23 6 4 2 + 24 21 22 1 + 25 21 23 1 + 26 27 23 2 + 27 22 24 2 + 28 23 26 1 + 29 24 25 1 + 30 26 25 2 +########## Name: lig_46 +########## Vina_BE: -9.589 +########## MW: 315.238 +########## clogP: 0.06 +########## nonHatoms: 26 +########## Vina_LE: -0.369 +########## Vina_LipE: -9.649 +########## Close_contacts: 0 +########## Hydrophob_contacts: 32 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_46.pdbqt + 26 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 CA -26.2730 -7.1880 -20.3760 C.ar 1 UNL1 0.0410 + 2 N -26.2870 -5.8470 -20.7590 N.ar 1 UNL1 -0.2150 + 3 C -27.5170 -5.3850 -20.3430 C.ar 1 UNL1 -0.0400 + 4 C -28.0480 -4.0960 -20.4800 C.2 1 UNL1 -0.0330 + 5 C -29.3410 -3.8640 -19.9700 C.2 1 UNL1 -0.0360 + 6 C -30.0620 -4.9060 -19.3430 C.2 1 UNL1 -0.0710 + 7 C -29.5000 -6.1950 -19.2190 C.2 1 UNL1 0.0250 + 8 C -28.2130 -6.4100 -19.7310 C.ar 1 UNL1 -0.0710 + 9 C -27.4420 -7.5590 -19.7410 C.ar 1 UNL1 -0.1800 + 10 H -25.5340 -5.3730 -21.2350 H 1 UNL1 0.3100 + 11 C -25.0820 -8.0430 -20.6700 C.2 1 UNL1 0.8430 + 12 OXT -24.8190 -8.2130 -21.8520 O.co2 1 UNL1 -0.8210 + 13 O -24.4450 -8.5740 -19.7740 O.co2 1 UNL1 -0.8210 + 14 C -27.8390 -8.9020 -19.1530 C.3 1 UNL1 0.1040 + 15 C -27.6790 -10.0680 -20.1550 C.3 1 UNL1 -0.0250 + 16 C -28.9990 -10.8340 -20.4230 C.3 1 UNL1 0.2810 + 17 O -30.1070 -9.9080 -20.4070 O.2 1 UNL1 -0.3520 + 18 C -31.3190 -10.2080 -19.8170 C.2 1 UNL1 0.1360 + 19 C -32.4650 -10.2020 -20.6360 C.2 1 UNL1 -0.0540 + 20 C -33.7360 -10.4870 -20.0990 C.2 1 UNL1 0.0120 + 21 C -33.8340 -10.7780 -18.7320 C.2 1 UNL1 -0.1440 + 22 C -32.7070 -10.7950 -17.9240 C.2 1 UNL1 -0.0520 + 23 C -35.0830 -11.1060 -17.9480 C.3 1 UNL1 0.0490 + 24 C -31.4370 -10.5150 -18.4440 C.2 1 UNL1 0.0400 + 25 C -33.0470 -11.1390 -16.4950 C.3 1 UNL1 0.0880 + 26 C -34.5360 -11.5770 -16.5720 C.3 1 UNL1 -0.0140 +@BOND + 1 12 11 ar + 2 10 2 1 + 3 2 1 ar + 4 2 3 ar + 5 11 1 1 + 6 11 13 ar + 7 19 20 1 + 8 19 18 2 + 9 4 3 2 + 10 4 5 1 + 11 16 17 1 + 12 16 15 1 + 13 17 18 1 + 14 1 9 ar + 15 3 8 ar + 16 15 14 1 + 17 20 21 2 + 18 5 6 2 + 19 18 24 1 + 20 9 8 ar + 21 9 14 1 + 22 8 7 2 + 23 6 7 1 + 24 21 23 1 + 25 21 22 1 + 26 24 22 2 + 27 23 26 1 + 28 22 25 1 + 29 26 25 1 +########## Name: lig_47 +########## Vina_BE: -9.406 +########## MW: 329.244 +########## clogP: 0.864 +########## nonHatoms: 27 +########## Vina_LE: -0.348 +########## Vina_LipE: -10.27 +########## Close_contacts: 0 +########## Hydrophob_contacts: 25 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_47.pdbqt + 27 30 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.5930 -8.6040 -19.1230 C.3 1 UNL1 0.0930 + 2 C -27.3490 -7.2630 -19.7790 C.ar 1 UNL1 -0.1990 + 3 C -28.2250 -6.1130 -19.7670 C.ar 1 UNL1 -0.0570 + 4 C -29.4800 -5.9240 -19.1710 C.2 1 UNL1 0.0210 + 5 C -27.6160 -5.1050 -20.4630 C.ar 1 UNL1 -0.0420 + 6 C -30.1030 -4.6670 -19.3180 C.2 1 UNL1 -0.0640 + 7 C -29.4690 -3.6320 -20.0420 C.2 1 UNL1 -0.0370 + 8 C -28.2020 -3.8450 -20.6260 C.2 1 UNL1 -0.0300 + 9 N -26.3940 -5.5460 -20.9150 N.ar 1 UNL1 -0.2230 + 10 CA -26.1970 -6.8710 -20.4840 C.ar 1 UNL1 -0.0140 + 11 H -25.7040 -5.0250 -21.4360 H 1 UNL1 0.2970 + 12 C -24.9360 -7.6190 -20.7830 C.2 1 UNL1 0.9180 + 13 OXT -24.7890 -7.9850 -21.9390 O.co2 1 UNL1 -0.8120 + 14 O -24.1120 -7.8620 -19.9160 O.co2 1 UNL1 -0.8120 + 15 C -27.4050 -9.7870 -20.1020 C.3 1 UNL1 -0.0190 + 16 C -28.7080 -10.5770 -20.3800 C.3 1 UNL1 0.2750 + 17 O -29.8400 -9.6750 -20.3730 O.2 1 UNL1 -0.3530 + 18 C -31.0800 -10.0560 -19.9040 C.2 1 UNL1 0.1180 + 19 C -32.1740 -10.0420 -20.7810 C.2 1 UNL1 -0.0080 + 20 C -33.4590 -10.3850 -20.3150 C.2 1 UNL1 -0.0380 + 21 C -33.6710 -10.7380 -18.9710 C.2 1 UNL1 0.3580 + 22 N -34.9150 -11.0400 -18.5450 N.2 1 UNL1 -0.6790 + 23 C -32.5590 -10.7580 -18.0990 C.2 1 UNL1 -0.1170 + 24 C -35.0900 -11.3590 -17.2490 C.2 1 UNL1 0.3890 + 25 C -34.0400 -11.3920 -16.3170 C.2 1 UNL1 -0.1390 + 26 C -32.7400 -11.0840 -16.7470 C.2 1 UNL1 0.1450 + 27 C -31.2750 -10.4390 -18.5680 C.2 1 UNL1 0.0340 +@BOND + 1 13 12 ar + 2 11 9 1 + 3 9 10 ar + 4 9 5 ar + 5 12 10 1 + 6 12 14 ar + 7 19 20 1 + 8 19 18 2 + 9 8 5 1 + 10 8 7 2 + 11 10 2 ar + 12 5 3 ar + 13 16 17 1 + 14 16 15 1 + 15 17 18 1 + 16 20 21 2 + 17 15 1 1 + 18 7 6 1 + 19 18 27 1 + 20 2 3 ar + 21 2 1 1 + 22 3 4 1 + 23 6 4 2 + 24 21 22 1 + 25 21 23 1 + 26 27 23 2 + 27 22 24 2 + 28 23 26 1 + 29 24 25 1 + 30 26 25 2 +########## Name: lig_48 +########## Vina_BE: -8.906 +########## MW: 318.241 +########## clogP: 1.356 +########## nonHatoms: 27 +########## Vina_LE: -0.33 +########## Vina_LipE: -10.262 +########## Close_contacts: 1 +########## Hydrophob_contacts: 19 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_48.pdbqt + 27 30 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -28.1790 -8.7050 -20.2450 C.3 1 UNL1 0.1070 + 2 C -27.6090 -7.3120 -20.3260 C.ar 1 UNL1 -0.1800 + 3 C -28.1900 -6.0110 -20.0770 C.ar 1 UNL1 -0.0710 + 4 C -29.4850 -5.6690 -19.6670 C.2 1 UNL1 0.0260 + 5 C -27.2370 -5.0400 -20.3130 C.ar 1 UNL1 -0.0400 + 6 C -29.7920 -4.3030 -19.5020 C.2 1 UNL1 -0.0710 + 7 C -28.8130 -3.3120 -19.7450 C.2 1 UNL1 -0.0360 + 8 C -27.5150 -3.6770 -20.1570 C.2 1 UNL1 -0.0330 + 9 N -26.0460 -5.6180 -20.7100 N.ar 1 UNL1 -0.2150 + 10 CA -26.2490 -7.0010 -20.7310 C.ar 1 UNL1 0.0420 + 11 H -25.1750 -5.1760 -20.9600 H 1 UNL1 0.3100 + 12 C -25.1520 -7.9310 -21.1390 C.2 1 UNL1 0.8440 + 13 O -24.5400 -7.6300 -22.1550 O.co2 1 UNL1 -0.8220 + 14 OXT -24.9010 -8.9390 -20.4970 O.co2 1 UNL1 -0.8220 + 15 C -28.2010 -9.2420 -18.7920 C.3 1 UNL1 -0.0260 + 16 C -29.5800 -9.1350 -18.1000 C.3 1 UNL1 0.2890 + 17 O -30.3530 -10.3440 -18.2640 O.2 1 UNL1 -0.3500 + 18 C -31.6300 -10.3950 -18.7820 C.2 1 UNL1 0.1940 + 19 C -31.7920 -10.0620 -20.1410 C.2 1 UNL1 -0.0790 + 20 C -33.0580 -10.1250 -20.7660 C.2 1 UNL1 0.0210 + 21 C -34.1880 -10.5410 -20.0370 C.2 1 UNL1 -0.0830 + 22 C -34.0080 -10.8850 -18.6930 C.2 1 UNL1 -0.0070 + 23 N -34.9780 -11.3140 -17.8050 N.pl3 1 UNL1 -0.2530 + 24 C -32.7690 -10.8220 -18.0680 C.2 1 UNL1 -0.1320 + 25 C -34.2720 -11.4870 -16.6220 C.2 1 UNL1 0.0400 + 26 C -32.9450 -11.2120 -16.7520 C.2 1 UNL1 0.0740 + 27 H -35.9690 -11.3940 -17.9570 H 1 UNL1 0.2770 +@BOND + 1 13 12 ar + 2 12 10 1 + 3 12 14 ar + 4 11 9 1 + 5 20 19 1 + 6 20 21 2 + 7 10 9 ar + 8 10 2 ar + 9 9 5 ar + 10 2 1 1 + 11 2 3 ar + 12 5 8 1 + 13 5 3 ar + 14 1 15 1 + 15 8 7 2 + 16 19 18 2 + 17 3 4 1 + 18 21 22 1 + 19 7 6 1 + 20 4 6 2 + 21 15 16 1 + 22 18 17 1 + 23 18 24 1 + 24 22 24 2 + 25 22 23 1 + 26 17 16 1 + 27 24 26 1 + 28 27 23 1 + 29 23 25 1 + 30 26 25 2 +########## Name: lig_49 +########## Vina_BE: -8.388 +########## MW: 362.122 +########## clogP: 1.276 +########## nonHatoms: 26 +########## Vina_LE: -0.323 +########## Vina_LipE: -9.664 +########## Close_contacts: 1 +########## Hydrophob_contacts: 23 +########## HBonds: 0 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_49.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -28.4280 -7.2910 -20.3840 C.ar 1 UNL1 -0.1740 + 2 CA -28.0510 -5.9750 -20.8700 C.ar 1 UNL1 0.0510 + 3 N -26.6700 -5.8020 -20.7770 N.ar 1 UNL1 -0.2090 + 4 C -26.1480 -6.9790 -20.2830 C.ar 1 UNL1 -0.0400 + 5 C -24.7950 -7.2630 -20.0620 C.2 1 UNL1 -0.0230 + 6 C -24.4580 -8.5400 -19.5780 C.2 1 UNL1 -0.0280 + 7 C -25.4690 -9.4940 -19.3330 C.2 1 UNL1 -0.0470 + 8 C -26.8270 -9.1900 -19.5620 C.2 1 UNL1 0.0560 + 9 CL -28.0210 -10.4370 -19.2640 Cl 1 UNL1 -0.1430 + 10 C -27.1520 -7.9020 -20.0400 C.ar 1 UNL1 -0.0600 + 11 H -26.1930 -4.9630 -21.0700 H 1 UNL1 0.3140 + 12 C -28.9140 -4.8920 -21.4210 C.2 1 UNL1 0.8390 + 13 O -29.1800 -3.9760 -20.6540 O.co2 1 UNL1 -0.8100 + 14 OXT -29.2970 -4.9190 -22.5790 O.co2 1 UNL1 -0.8100 + 15 C -29.8570 -7.7760 -20.3280 C.3 1 UNL1 0.1160 + 16 C -30.2930 -8.4500 -21.6510 C.3 1 UNL1 0.0410 + 17 C -30.8220 -9.8850 -21.4580 C.3 1 UNL1 0.2120 + 18 O -32.2480 -9.8360 -21.2770 O.2 1 UNL1 -0.3330 + 19 C -32.8070 -10.2630 -20.1000 C.2 1 UNL1 0.1530 + 20 C -32.0100 -10.4750 -18.9640 C.2 1 UNL1 -0.0300 + 21 C -32.5940 -10.8990 -17.7540 C.2 1 UNL1 -0.0340 + 22 C -31.7180 -11.1180 -16.5290 C.3 1 UNL1 0.0910 + 23 C -33.9890 -11.1040 -17.6970 C.2 1 UNL1 -0.0280 + 24 C -34.7860 -10.8780 -18.8330 C.2 1 UNL1 0.0370 + 25 CL -34.7720 -11.6300 -16.2180 Cl 1 UNL1 -0.1260 + 26 C -34.1920 -10.4520 -20.0340 C.2 1 UNL1 -0.0160 +@BOND + 1 14 12 ar + 2 16 17 1 + 3 16 15 1 + 4 17 18 1 + 5 12 2 1 + 6 12 13 ar + 7 18 19 1 + 8 11 3 1 + 9 2 3 ar + 10 2 1 ar + 11 3 4 ar + 12 1 15 1 + 13 1 10 ar + 14 4 5 2 + 15 4 10 ar + 16 19 26 2 + 17 19 20 1 + 18 5 6 1 + 19 10 8 2 + 20 26 24 1 + 21 6 7 2 + 22 8 7 1 + 23 8 9 1 + 24 20 21 2 + 25 24 23 2 + 26 21 23 1 + 27 21 22 1 + 28 23 25 1 +########## Name: lig_50 +########## Vina_BE: -8.295 +########## MW: 374.133 +########## clogP: 3.158 +########## nonHatoms: 27 +########## Vina_LE: -0.307 +########## Vina_LipE: -11.453 +########## Close_contacts: 1 +########## Hydrophob_contacts: 16 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_50.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -31.1690 -10.2790 -19.6050 C.ar 1 UNL1 -0.1640 + 2 CA -30.1970 -10.0790 -18.6120 C.ar 1 UNL1 -0.0500 + 3 N -30.7990 -10.3280 -17.3680 N.ar 1 UNL1 -0.2090 + 4 C -32.1220 -10.6460 -17.5700 C.ar 1 UNL1 -0.0360 + 5 C -33.0860 -10.9370 -16.5960 C.2 1 UNL1 -0.0240 + 6 C -34.3960 -11.2100 -17.0330 C.2 1 UNL1 -0.0220 + 7 C -34.7040 -11.1760 -18.4110 C.2 1 UNL1 -0.0480 + 8 C -33.7120 -10.8770 -19.3690 C.2 1 UNL1 0.0590 + 9 CL -34.1780 -10.8210 -21.0570 Cl 1 UNL1 -0.1270 + 10 C -32.4030 -10.6200 -18.9130 C.ar 1 UNL1 -0.0630 + 11 H -30.3040 -10.2480 -16.4920 H 1 UNL1 0.3140 + 12 C -28.7660 -9.6730 -18.7270 C.2 1 UNL1 0.9330 + 13 OXT -28.4560 -8.6500 -18.1330 O.co2 1 UNL1 -0.8180 + 14 O -27.9710 -10.3110 -19.3980 O.co2 1 UNL1 -0.8180 + 15 C -30.9020 -10.1480 -21.0880 C.3 1 UNL1 0.1110 + 16 C -31.1020 -8.6960 -21.5940 C.3 1 UNL1 -0.0170 + 17 C -29.7720 -7.9300 -21.7330 C.3 1 UNL1 0.2780 + 18 O -29.6760 -6.9760 -20.6570 O.2 1 UNL1 -0.3480 + 19 C -28.5930 -6.1370 -20.5700 C.2 1 UNL1 0.1430 + 20 C -28.7420 -4.8050 -20.1560 C.2 1 UNL1 -0.0060 + 21 C -27.6200 -3.9620 -20.0560 C.2 1 UNL1 -0.0430 + 22 C -27.8120 -2.5190 -19.6090 C.3 1 UNL1 0.0850 + 23 C -26.3390 -4.4710 -20.3660 C.2 1 UNL1 -0.0300 + 24 C -26.1860 -5.8170 -20.7660 C.2 1 UNL1 -0.0430 + 25 CL -24.9280 -3.4290 -20.2440 Cl 1 UNL1 -0.1380 + 26 C -27.3200 -6.6440 -20.8600 C.2 1 UNL1 -0.0060 + 27 C -24.8120 -6.3900 -21.0910 C.3 1 UNL1 0.0850 +@BOND + 1 17 16 1 + 2 17 18 1 + 3 16 15 1 + 4 27 24 1 + 5 15 1 1 + 6 9 8 1 + 7 26 24 1 + 8 26 19 2 + 9 24 23 2 + 10 18 19 1 + 11 19 20 1 + 12 23 25 1 + 13 23 21 1 + 14 20 21 2 + 15 21 22 1 + 16 1 10 ar + 17 1 2 ar + 18 14 12 ar + 19 8 10 1 + 20 8 7 2 + 21 10 4 ar + 22 12 2 1 + 23 12 13 ar + 24 2 3 ar + 25 7 6 1 + 26 4 3 ar + 27 4 5 1 + 28 3 11 1 + 29 6 5 2 +########## Name: lig_52 +########## Vina_BE: -8.812 +########## MW: 362.122 +########## clogP: 1.35 +########## nonHatoms: 26 +########## Vina_LE: -0.339 +########## Vina_LipE: -10.162 +########## Close_contacts: 2 +########## Hydrophob_contacts: 23 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_52.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.1550 -7.6460 -19.9010 C.ar 1 UNL1 -0.1740 + 2 CA -26.1230 -7.1240 -20.7780 C.ar 1 UNL1 0.0510 + 3 N -26.4700 -5.8480 -21.2310 N.ar 1 UNL1 -0.2090 + 4 C -27.6710 -5.5210 -20.6290 C.ar 1 UNL1 -0.0400 + 5 C -28.3800 -4.3180 -20.7330 C.2 1 UNL1 -0.0230 + 6 C -29.5740 -4.1910 -19.9950 C.2 1 UNL1 -0.1420 + 7 CL -30.4960 -2.7060 -20.0820 Cl 1 UNL1 -0.1430 + 8 C -30.0260 -5.2490 -19.1770 C.2 1 UNL1 -0.0570 + 9 C -29.2930 -6.4500 -19.0900 C.2 1 UNL1 0.1800 + 10 C -28.1110 -6.5610 -19.8350 C.ar 1 UNL1 -0.0600 + 11 H -25.8900 -5.2880 -21.8380 H 1 UNL1 0.3140 + 12 C -24.8320 -7.7580 -21.1760 C.2 1 UNL1 0.8390 + 13 OXT -24.5570 -7.9210 -22.3540 O.co2 1 UNL1 -0.8100 + 14 O -24.1010 -8.1140 -20.2640 O.co2 1 UNL1 -0.8100 + 15 C -27.0780 -8.9620 -19.1680 C.3 1 UNL1 0.1160 + 16 C -27.4690 -10.1580 -20.0670 C.3 1 UNL1 0.0410 + 17 C -28.9940 -10.3590 -20.1780 C.3 1 UNL1 0.2120 + 18 O -29.5980 -9.9700 -18.9300 O.2 1 UNL1 -0.3330 + 19 C -30.8800 -10.3180 -18.5670 C.2 1 UNL1 0.1530 + 20 C -31.8560 -10.3290 -19.5740 C.2 1 UNL1 -0.0300 + 21 C -33.1940 -10.6510 -19.2780 C.2 1 UNL1 -0.0340 + 22 C -34.2360 -10.6510 -20.3870 C.3 1 UNL1 0.0910 + 23 C -33.5490 -10.9620 -17.9500 C.2 1 UNL1 -0.0280 + 24 C -32.5770 -10.9420 -16.9350 C.2 1 UNL1 0.0370 + 25 CL -35.1990 -11.3710 -17.5200 Cl 1 UNL1 -0.1260 + 26 C -31.2440 -10.6190 -17.2400 C.2 1 UNL1 -0.0160 +@BOND + 1 13 12 ar + 2 11 3 1 + 3 3 2 ar + 4 3 4 ar + 5 12 2 1 + 6 12 14 ar + 7 2 1 ar + 8 5 4 2 + 9 5 6 1 + 10 4 10 ar + 11 22 21 1 + 12 17 16 1 + 13 17 18 1 + 14 7 6 1 + 15 16 15 1 + 16 6 8 2 + 17 1 10 ar + 18 1 15 1 + 19 10 9 2 + 20 20 21 1 + 21 20 19 2 + 22 21 23 2 + 23 8 9 1 + 24 18 19 1 + 25 19 26 1 + 26 23 25 1 + 27 23 24 1 + 28 26 24 2 +########## Name: lig_53 +########## Vina_BE: -8.278 +########## MW: 374.133 +########## clogP: 3.049 +########## nonHatoms: 27 +########## Vina_LE: -0.307 +########## Vina_LipE: -11.327 +########## Close_contacts: 1 +########## Hydrophob_contacts: 16 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_53.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -25.4450 -6.4820 -20.4800 C.ar 1 UNL1 -0.1640 + 2 CA -24.4850 -5.5520 -20.0580 C.ar 1 UNL1 -0.0500 + 3 N -25.0960 -4.2850 -20.0370 N.ar 1 UNL1 -0.2090 + 4 C -26.4050 -4.4160 -20.4490 C.ar 1 UNL1 -0.0360 + 5 C -27.3790 -3.4210 -20.5940 C.2 1 UNL1 -0.0240 + 6 C -28.6540 -3.8170 -21.0440 C.2 1 UNL1 -0.1370 + 7 CL -29.9160 -2.6210 -21.2460 Cl 1 UNL1 -0.1270 + 8 C -28.9220 -5.1740 -21.3360 C.2 1 UNL1 -0.0580 + 9 C -27.9150 -6.1500 -21.1800 C.2 1 UNL1 0.1840 + 10 C -26.6560 -5.7330 -20.7280 C.ar 1 UNL1 -0.0630 + 11 H -24.6130 -3.4390 -19.7690 H 1 UNL1 0.3140 + 12 C -23.0550 -5.7670 -19.6870 C.2 1 UNL1 0.9330 + 13 O -22.7320 -6.0190 -18.5360 O.co2 1 UNL1 -0.8180 + 14 OXT -22.2470 -5.6910 -20.6010 O.co2 1 UNL1 -0.8180 + 15 C -25.1980 -7.9590 -20.6530 C.3 1 UNL1 0.1110 + 16 C -25.2550 -8.7210 -19.3050 C.3 1 UNL1 -0.0170 + 17 C -26.4860 -9.6440 -19.1980 C.3 1 UNL1 0.2780 + 18 O -27.5970 -8.8770 -18.6930 O.2 1 UNL1 -0.3480 + 19 C -28.8840 -9.2130 -19.0380 C.2 1 UNL1 0.1430 + 20 C -29.3550 -9.0260 -20.3480 C.2 1 UNL1 -0.0060 + 21 C -30.6710 -9.3900 -20.6870 C.2 1 UNL1 -0.0430 + 22 C -31.1590 -9.1690 -22.1120 C.3 1 UNL1 0.0850 + 23 C -31.5100 -9.9590 -19.7030 C.2 1 UNL1 -0.0300 + 24 C -31.0310 -10.1640 -18.3900 C.2 1 UNL1 -0.0430 + 25 CL -33.1550 -10.4210 -20.1160 Cl 1 UNL1 -0.1380 + 26 C -29.7120 -9.7920 -18.0710 C.2 1 UNL1 -0.0060 + 27 C -31.9170 -10.7860 -17.3190 C.3 1 UNL1 0.0850 +@BOND + 1 22 21 1 + 2 8 9 2 + 3 8 6 1 + 4 7 6 1 + 5 9 10 1 + 6 6 5 2 + 7 10 1 ar + 8 10 4 ar + 9 21 20 1 + 10 21 23 2 + 11 15 1 1 + 12 15 16 1 + 13 14 12 ar + 14 5 4 1 + 15 1 2 ar + 16 4 3 ar + 17 20 19 2 + 18 25 23 1 + 19 2 3 ar + 20 2 12 1 + 21 3 11 1 + 22 23 24 1 + 23 12 13 ar + 24 16 17 1 + 25 17 18 1 + 26 19 18 1 + 27 19 26 1 + 28 24 26 2 + 29 24 27 1 +########## Name: lig_56 +########## Vina_BE: -8.819 +########## MW: 349.683 +########## clogP: 0.609 +########## nonHatoms: 26 +########## Vina_LE: -0.339 +########## Vina_LipE: -9.428 +########## Close_contacts: 0 +########## Hydrophob_contacts: 29 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_56.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.2350 -7.2500 -19.8400 C.ar 1 UNL1 -0.1970 + 2 C -26.1130 -6.7450 -20.6200 C.ar 1 UNL1 0.0660 + 3 N -26.3860 -5.4230 -21.0410 N.ar 1 UNL1 -0.0970 + 4 C -25.5460 -4.5570 -21.8830 C.3 1 UNL1 0.1750 + 5 C -27.6240 -5.0830 -20.5090 C.ar 1 UNL1 -0.0460 + 6 C -28.3090 -3.8580 -20.6050 C.2 1 UNL1 -0.0230 + 7 C -29.5530 -3.7360 -19.9550 C.2 1 UNL1 -0.0410 + 8 C -30.0890 -4.8180 -19.2230 C.2 1 UNL1 -0.0640 + 9 C -29.3850 -6.0350 -19.1380 C.2 1 UNL1 0.0090 + 10 C -28.1530 -6.1390 -19.7960 C.ar 1 UNL1 -0.0690 + 11 C -24.8420 -7.4830 -20.9350 C.2 1 UNL1 0.8400 + 12 O -24.6440 -7.9150 -22.0590 O.co2 1 UNL1 -0.8120 + 13 O -24.0260 -7.6680 -20.0410 O.co2 1 UNL1 -0.8120 + 14 C -27.3210 -8.6200 -19.2120 C.3 1 UNL1 0.0980 + 15 C -27.2440 -9.7540 -20.2600 C.3 1 UNL1 0.0270 + 16 C -28.5350 -10.5920 -20.3500 C.3 1 UNL1 0.2560 + 17 O -29.6670 -9.7020 -20.2860 O.2 1 UNL1 -0.3370 + 18 C -30.8730 -10.0830 -19.7470 C.2 1 UNL1 0.1610 + 19 C -31.9800 -10.1480 -20.6010 C.2 1 UNL1 -0.0360 + 20 C -33.2420 -10.5310 -20.1150 C.2 1 UNL1 -0.0350 + 21 C -34.4310 -10.5730 -21.0640 C.3 1 UNL1 0.0850 + 22 C -33.3850 -10.8670 -18.7510 C.2 1 UNL1 -0.0350 + 23 C -32.2720 -10.8130 -17.8840 C.2 1 UNL1 -0.0350 + 24 CL -34.9560 -11.3590 -18.1310 Cl 1 UNL1 -0.1280 + 25 C -31.0190 -10.4180 -18.3890 C.2 1 UNL1 -0.0360 + 26 C -32.4060 -11.1740 -16.4110 C.3 1 UNL1 0.0850 +@BOND + 1 12 11 ar + 2 4 3 1 + 3 21 20 1 + 4 3 2 ar + 5 3 5 ar + 6 11 2 1 + 7 11 13 ar + 8 2 1 ar + 9 6 5 2 + 10 6 7 1 + 11 19 20 1 + 12 19 18 2 + 13 5 10 ar + 14 16 17 1 + 15 16 15 1 + 16 17 18 1 + 17 15 14 1 + 18 20 22 2 + 19 7 8 2 + 20 1 10 ar + 21 1 14 1 + 22 10 9 2 + 23 18 25 1 + 24 8 9 1 + 25 22 24 1 + 26 22 23 1 + 27 25 23 2 + 28 23 26 1 +########## Name: lig_58 +########## Vina_BE: -8.394 +########## MW: 385.136 +########## clogP: 2.916 +########## nonHatoms: 27 +########## Vina_LE: -0.311 +########## Vina_LipE: -11.31 +########## Close_contacts: 0 +########## Hydrophob_contacts: 15 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_58.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -25.4710 -6.4880 -20.4910 C.ar 1 UNL1 -0.1800 + 2 C -24.5050 -5.4940 -20.0390 C.ar 1 UNL1 0.0600 + 3 N -25.1120 -4.2190 -20.0160 N.ar 1 UNL1 -0.0930 + 4 C -24.5040 -2.9420 -19.6100 C.3 1 UNL1 0.1810 + 5 C -26.4200 -4.3930 -20.4570 C.ar 1 UNL1 -0.0420 + 6 C -27.4180 -3.4180 -20.6280 C.2 1 UNL1 0.0010 + 7 C -28.6790 -3.8330 -21.1010 C.2 1 UNL1 0.0120 + 8 CL -29.9510 -2.6520 -21.3280 Cl 1 UNL1 -0.1500 + 9 C -28.9250 -5.1900 -21.3960 C.2 1 UNL1 -0.0410 + 10 C -27.9090 -6.1510 -21.2200 C.2 1 UNL1 0.0370 + 11 C -26.6630 -5.7190 -20.7460 C.ar 1 UNL1 -0.0650 + 12 C -23.0720 -5.7520 -19.6580 C.2 1 UNL1 0.8390 + 13 O -22.8060 -6.0060 -18.4930 O.co2 1 UNL1 -0.8140 + 14 O -22.1880 -5.6980 -20.5000 O.co2 1 UNL1 -0.8140 + 15 C -25.1850 -7.9580 -20.6620 C.3 1 UNL1 0.1100 + 16 C -25.2270 -8.7210 -19.3150 C.3 1 UNL1 -0.0230 + 17 C -26.4700 -9.6250 -19.1800 C.3 1 UNL1 0.2740 + 18 O -27.5880 -8.8200 -18.7560 O.2 1 UNL1 -0.3490 + 19 C -28.8730 -9.2130 -19.0420 C.2 1 UNL1 0.1360 + 20 C -29.7030 -9.7660 -18.0540 C.2 1 UNL1 -0.0030 + 21 C -31.0200 -10.1480 -18.3630 C.2 1 UNL1 -0.0420 + 22 C -31.8930 -10.7540 -17.2730 C.3 1 UNL1 0.0890 + 23 C -31.5080 -9.9590 -19.6750 C.2 1 UNL1 -0.0280 + 24 C -30.6830 -9.3860 -20.6670 C.2 1 UNL1 -0.0420 + 25 CL -33.1550 -10.4320 -20.0740 Cl 1 UNL1 -0.1370 + 26 C -29.3670 -9.0110 -20.3370 C.2 1 UNL1 -0.0030 + 27 C -31.1940 -9.1640 -22.0830 C.3 1 UNL1 0.0890 +@BOND + 1 27 24 1 + 2 9 10 2 + 3 9 7 1 + 4 8 7 1 + 5 10 11 1 + 6 7 6 2 + 7 11 1 ar + 8 11 5 ar + 9 24 26 1 + 10 24 23 2 + 11 15 1 1 + 12 15 16 1 + 13 6 5 1 + 14 14 12 ar + 15 1 2 ar + 16 5 3 ar + 17 26 19 2 + 18 25 23 1 + 19 2 3 ar + 20 2 12 1 + 21 3 4 1 + 22 23 21 1 + 23 12 13 ar + 24 16 17 1 + 25 17 18 1 + 26 19 18 1 + 27 19 20 1 + 28 21 20 2 + 29 21 22 1 +########## Name: lig_60 +########## Vina_BE: -8.781 +########## MW: 355.73 +########## clogP: 1.475 +########## nonHatoms: 25 +########## Vina_LE: -0.351 +########## Vina_LipE: -10.256 +########## Close_contacts: 0 +########## Hydrophob_contacts: 25 +########## HBonds: 0 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_60.pdbqt + 25 27 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -29.9450 -10.4220 -18.3760 C.3 1 UNL1 0.0980 + 2 C -31.3510 -10.4980 -18.9320 C.ar 1 UNL1 -0.1170 + 3 C -31.6670 -10.2830 -20.2810 C.ar 1 UNL1 -0.0730 + 4 S -33.4070 -10.4680 -20.6360 S.2 1 UNL1 0.0590 + 5 C -33.7090 -10.7860 -18.9270 C.ar 1 UNL1 -0.1180 + 6 C -34.9690 -11.0210 -18.3540 C.2 1 UNL1 0.0270 + 7 C -32.5570 -10.7760 -18.1640 C.ar 1 UNL1 -0.0690 + 8 C -35.0530 -11.2410 -16.9670 C.2 1 UNL1 -0.0420 + 9 C -33.8850 -11.2290 -16.1800 C.2 1 UNL1 -0.0390 + 10 C -32.6310 -10.9980 -16.7770 C.2 1 UNL1 0.0130 + 11 C -30.7400 -9.9270 -21.3920 C.2 1 UNL1 0.9090 + 12 O -30.9160 -8.9210 -22.0610 O.co2 1 UNL1 -0.8140 + 13 O -29.8220 -10.6970 -21.6270 O.co2 1 UNL1 -0.8140 + 14 C -29.4540 -8.9650 -18.1900 C.3 1 UNL1 0.0340 + 15 C -28.1200 -8.6740 -18.9080 C.3 1 UNL1 0.2510 + 16 O -28.4020 -7.9110 -20.0950 O.2 1 UNL1 -0.3350 + 17 C -28.2930 -6.5400 -20.1380 C.2 1 UNL1 0.1600 + 18 C -27.0470 -5.9950 -20.4640 C.2 1 UNL1 -0.0360 + 19 C -26.8630 -4.6020 -20.5170 C.2 1 UNL1 -0.0340 + 20 C -25.4880 -4.0390 -20.8510 C.3 1 UNL1 0.0860 + 21 C -27.9570 -3.7490 -20.2530 C.2 1 UNL1 -0.0340 + 22 C -29.2200 -4.2930 -19.9350 C.2 1 UNL1 -0.0340 + 23 CL -27.7440 -2.0050 -20.3240 Cl 1 UNL1 -0.1270 + 24 C -29.3820 -5.6890 -19.8770 C.2 1 UNL1 -0.0360 + 25 C -30.4130 -3.3890 -19.6500 C.3 1 UNL1 0.0860 +@BOND + 1 12 11 ar + 2 13 11 ar + 3 11 3 1 + 4 20 19 1 + 5 4 3 ar + 6 4 5 ar + 7 19 18 1 + 8 19 21 2 + 9 18 17 2 + 10 23 21 1 + 11 3 2 ar + 12 21 22 1 + 13 17 16 1 + 14 17 24 1 + 15 16 15 1 + 16 22 24 2 + 17 22 25 1 + 18 2 1 1 + 19 2 7 ar + 20 5 6 2 + 21 5 7 ar + 22 15 14 1 + 23 1 14 1 + 24 6 8 1 + 25 7 10 2 + 26 8 9 2 + 27 10 9 1 +########## Name: lig_61 +########## Vina_BE: -8.416 +########## MW: 391.183 +########## clogP: 2.165 +########## nonHatoms: 26 +########## Vina_LE: -0.324 +########## Vina_LipE: -10.581 +########## Close_contacts: 1 +########## Hydrophob_contacts: 27 +########## HBonds: 0 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_61.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -31.4970 -10.4900 -19.0430 C.ar 1 UNL1 -0.1210 + 2 C -31.8000 -10.1700 -20.3760 C.ar 1 UNL1 -0.3280 + 3 S -33.5350 -10.1080 -20.7260 S.2 1 UNL1 0.2480 + 4 C -33.8640 -10.6010 -19.0650 C.ar 1 UNL1 -0.0670 + 5 C -35.1550 -10.8190 -18.5600 C.2 1 UNL1 0.0330 + 6 C -35.3030 -11.2460 -17.2320 C.2 1 UNL1 -0.0310 + 7 C -34.1610 -11.4630 -16.4410 C.2 1 UNL1 -0.0180 + 8 C -32.8700 -11.2420 -16.9590 C.2 1 UNL1 0.0490 + 9 CL -31.5380 -11.6090 -15.8780 Cl 1 UNL1 -0.1180 + 10 C -32.7250 -10.7860 -18.2940 C.ar 1 UNL1 -0.0270 + 11 C -30.8820 -9.8770 -21.5070 C.2 1 UNL1 0.9220 + 12 O -30.0870 -10.7530 -21.8000 O.co2 1 UNL1 -0.8090 + 13 O -30.9050 -8.8040 -22.0850 O.co2 1 UNL1 -0.8090 + 14 C -30.0710 -10.4650 -18.5350 C.3 1 UNL1 0.1020 + 15 C -29.5600 -9.0220 -18.2930 C.3 1 UNL1 -0.0120 + 16 C -28.1840 -8.7700 -18.9410 C.3 1 UNL1 0.2760 + 17 O -28.3710 -8.0430 -20.1730 O.2 1 UNL1 -0.3520 + 18 C -28.2770 -6.6730 -20.1920 C.2 1 UNL1 0.1360 + 19 C -29.3800 -5.8640 -19.8770 C.2 1 UNL1 -0.0060 + 20 C -29.2580 -4.4630 -19.8880 C.2 1 UNL1 -0.0400 + 21 C -30.4730 -3.6090 -19.5510 C.3 1 UNL1 0.0910 + 22 C -28.0130 -3.8750 -20.2070 C.2 1 UNL1 -0.0280 + 23 C -26.8990 -4.6890 -20.5050 C.2 1 UNL1 -0.0400 + 24 CL -27.8490 -2.1240 -20.2230 Cl 1 UNL1 -0.1390 + 25 C -27.0410 -6.0880 -20.4910 C.2 1 UNL1 -0.0060 + 26 C -25.5450 -4.0750 -20.8400 C.3 1 UNL1 0.0910 +@BOND + 1 13 11 ar + 2 12 11 ar + 3 11 2 1 + 4 26 23 1 + 5 3 2 ar + 6 3 4 ar + 7 23 25 1 + 8 23 22 2 + 9 25 18 2 + 10 2 1 ar + 11 24 22 1 + 12 22 20 1 + 13 18 17 1 + 14 18 19 1 + 15 17 16 1 + 16 20 19 2 + 17 20 21 1 + 18 4 5 2 + 19 4 10 ar + 20 1 14 1 + 21 1 10 ar + 22 16 15 1 + 23 5 6 1 + 24 14 15 1 + 25 10 8 2 + 26 6 7 2 + 27 8 7 1 + 28 8 9 1 +########## Name: lig_63 +########## Vina_BE: -8.228 +########## MW: 391.183 +########## clogP: 3.783 +########## nonHatoms: 26 +########## Vina_LE: -0.316 +########## Vina_LipE: -12.011 +########## Close_contacts: 1 +########## Hydrophob_contacts: 16 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_63.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -25.2980 -6.2830 -20.4540 C.ar 1 UNL1 -0.1210 + 2 C -24.2850 -5.4360 -19.9870 C.ar 1 UNL1 -0.3280 + 3 S -24.8020 -3.7500 -19.7710 S.2 1 UNL1 0.2480 + 4 C -26.4080 -4.1870 -20.3660 C.ar 1 UNL1 -0.0670 + 5 C -27.4880 -3.3060 -20.5280 C.2 1 UNL1 0.0330 + 6 C -28.7030 -3.8070 -21.0300 C.2 1 UNL1 -0.1500 + 7 CL -30.0690 -2.7330 -21.2460 Cl 1 UNL1 -0.1180 + 8 C -28.8220 -5.1700 -21.3630 C.2 1 UNL1 -0.0270 + 9 C -27.7270 -6.0380 -21.1920 C.2 1 UNL1 0.1770 + 10 C -26.5190 -5.5290 -20.6840 C.ar 1 UNL1 -0.0270 + 11 C -22.8750 -5.7690 -19.6720 C.2 1 UNL1 0.9220 + 12 O -22.6300 -6.0510 -18.5120 O.co2 1 UNL1 -0.8090 + 13 O -22.0140 -5.7320 -20.5340 O.co2 1 UNL1 -0.8090 + 14 C -25.0970 -7.7630 -20.6810 C.3 1 UNL1 0.1020 + 15 C -25.1760 -8.5590 -19.3580 C.3 1 UNL1 -0.0120 + 16 C -26.4190 -9.4660 -19.2990 C.3 1 UNL1 0.2760 + 17 O -27.5320 -8.6940 -18.8110 O.2 1 UNL1 -0.3520 + 18 C -28.8100 -9.1010 -19.0900 C.2 1 UNL1 0.1360 + 19 C -29.3100 -8.9330 -20.3860 C.2 1 UNL1 -0.0060 + 20 C -30.6180 -9.3440 -20.7030 C.2 1 UNL1 -0.0400 + 21 C -31.1470 -9.1410 -22.1160 C.3 1 UNL1 0.0910 + 22 C -31.4190 -9.9360 -19.7010 C.2 1 UNL1 -0.0280 + 23 C -30.9140 -10.1110 -18.3950 C.2 1 UNL1 -0.0400 + 24 CL -33.0550 -10.4570 -20.0850 Cl 1 UNL1 -0.1390 + 25 C -29.6040 -9.6900 -18.0970 C.2 1 UNL1 -0.0060 + 26 C -31.7620 -10.7480 -17.3030 C.3 1 UNL1 0.0910 +@BOND + 1 21 20 1 + 2 8 9 2 + 3 8 6 1 + 4 7 6 1 + 5 9 10 1 + 6 6 5 2 + 7 20 19 1 + 8 20 22 2 + 9 10 1 ar + 10 10 4 ar + 11 14 1 1 + 12 14 15 1 + 13 13 11 ar + 14 5 4 1 + 15 1 2 ar + 16 19 18 2 + 17 4 3 ar + 18 24 22 1 + 19 2 3 ar + 20 2 11 1 + 21 22 23 1 + 22 11 12 ar + 23 15 16 1 + 24 16 17 1 + 25 18 17 1 + 26 18 25 1 + 27 23 25 2 + 28 23 26 1 +########## Name: lig_65 +########## Vina_BE: -8.705 +########## MW: 391.183 +########## clogP: 2.165 +########## nonHatoms: 26 +########## Vina_LE: -0.335 +########## Vina_LipE: -10.87 +########## Close_contacts: 0 +########## Hydrophob_contacts: 31 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_65.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.1940 -7.2390 -19.7650 C.ar 1 UNL1 -0.1210 + 2 C -26.0360 -6.9130 -20.4830 C.ar 1 UNL1 -0.3280 + 3 S -26.0300 -5.2500 -21.1130 S.2 1 UNL1 0.2480 + 4 C -27.6460 -5.0040 -20.4350 C.ar 1 UNL1 -0.0670 + 5 C -28.4200 -3.8350 -20.5390 C.2 1 UNL1 -0.0920 + 6 CL -27.8190 -2.4210 -21.3820 Cl 1 UNL1 -0.1180 + 7 C -29.6990 -3.8090 -19.9570 C.2 1 UNL1 -0.0250 + 8 C -30.1910 -4.9450 -19.2860 C.2 1 UNL1 -0.0270 + 9 C -29.4030 -6.1090 -19.1920 C.2 1 UNL1 0.1770 + 10 C -28.1220 -6.1200 -19.7700 C.ar 1 UNL1 -0.0270 + 11 C -24.8590 -7.7680 -20.7750 C.2 1 UNL1 0.9220 + 12 O -24.7590 -8.1880 -21.9140 O.co2 1 UNL1 -0.8090 + 13 O -24.0550 -8.0440 -19.9010 O.co2 1 UNL1 -0.8090 + 14 C -27.4090 -8.5820 -19.1110 C.3 1 UNL1 0.1020 + 15 C -27.2300 -9.7410 -20.1170 C.3 1 UNL1 -0.0120 + 16 C -28.5450 -10.5000 -20.3710 C.3 1 UNL1 0.2760 + 17 O -29.6430 -9.5740 -20.2520 O.2 1 UNL1 -0.3520 + 18 C -30.8630 -10.0000 -19.7910 C.2 1 UNL1 0.1360 + 19 C -30.9880 -10.3440 -18.4400 C.2 1 UNL1 -0.0060 + 20 C -32.2240 -10.7760 -17.9260 C.2 1 UNL1 -0.0400 + 21 C -32.3330 -11.1590 -16.4560 C.3 1 UNL1 0.0910 + 22 C -33.3430 -10.8530 -18.7840 C.2 1 UNL1 -0.0280 + 23 C -33.2210 -10.4980 -20.1460 C.2 1 UNL1 -0.0400 + 24 CL -34.8950 -11.3880 -18.1540 Cl 1 UNL1 -0.1390 + 25 C -31.9750 -10.0720 -20.6410 C.2 1 UNL1 -0.0060 + 26 C -34.4170 -10.5690 -21.0860 C.3 1 UNL1 0.0910 +@BOND + 1 12 11 ar + 2 6 5 1 + 3 3 2 ar + 4 3 4 ar + 5 26 23 1 + 6 11 2 1 + 7 11 13 ar + 8 25 23 1 + 9 25 18 2 + 10 5 4 2 + 11 5 7 1 + 12 2 1 ar + 13 4 10 ar + 14 16 17 1 + 15 16 15 1 + 16 17 18 1 + 17 23 22 2 + 18 15 14 1 + 19 7 8 2 + 20 18 19 1 + 21 10 1 ar + 22 10 9 2 + 23 1 14 1 + 24 8 9 1 + 25 22 24 1 + 26 22 20 1 + 27 19 20 2 + 28 20 21 1 +########## Name: lig_67 +########## Vina_BE: -8.738 +########## MW: 339.665 +########## clogP: 1.007 +########## nonHatoms: 25 +########## Vina_LE: -0.35 +########## Vina_LipE: -9.745 +########## Close_contacts: 0 +########## Hydrophob_contacts: 25 +########## HBonds: 0 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_67.pdbqt + 25 27 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -29.9090 -10.4450 -18.2200 C.3 1 UNL1 0.0980 + 2 C -31.3460 -10.4980 -18.6680 C.ar 1 UNL1 -0.2120 + 3 C -31.8050 -10.2840 -20.0320 C.ar 1 UNL1 0.0090 + 4 O -33.1770 -10.4190 -20.1280 O.2 1 UNL1 0.0590 + 5 C -33.6180 -10.7250 -18.8650 C.ar 1 UNL1 -0.1550 + 6 C -34.9390 -10.9630 -18.4620 C.2 1 UNL1 0.0130 + 7 C -32.5720 -10.7840 -17.9650 C.ar 1 UNL1 -0.0580 + 8 C -35.1770 -11.2690 -17.1070 C.2 1 UNL1 -0.0330 + 9 C -34.1060 -11.3310 -16.1870 C.2 1 UNL1 -0.0480 + 10 C -32.7840 -11.0880 -16.6150 C.2 1 UNL1 0.0180 + 11 C -31.0220 -9.9660 -21.2580 C.2 1 UNL1 0.9360 + 12 O -31.2620 -8.9530 -21.8980 O.co2 1 UNL1 -0.7970 + 13 O -30.1340 -10.7380 -21.5830 O.co2 1 UNL1 -0.7970 + 14 C -29.3760 -8.9920 -18.1350 C.3 1 UNL1 -0.0200 + 15 C -28.0500 -8.8010 -18.8940 C.3 1 UNL1 0.2790 + 16 O -28.3170 -8.1110 -20.1310 O.2 1 UNL1 -0.3530 + 17 C -28.1910 -6.7460 -20.2040 C.2 1 UNL1 0.1350 + 18 C -27.0030 -6.1520 -20.6580 C.2 1 UNL1 -0.0070 + 19 C -26.8950 -4.7530 -20.7420 C.2 1 UNL1 -0.0400 + 20 C -25.5920 -4.1360 -21.2310 C.3 1 UNL1 0.0930 + 21 C -27.9970 -3.9470 -20.3770 C.2 1 UNL1 -0.0270 + 22 C -29.1990 -4.5440 -19.9370 C.2 1 UNL1 -0.0400 + 23 CL -27.8750 -2.1960 -20.4780 Cl 1 UNL1 -0.1370 + 24 C -29.2860 -5.9460 -19.8580 C.2 1 UNL1 -0.0070 + 25 C -30.4010 -3.6940 -19.5490 C.3 1 UNL1 0.0930 +@BOND + 1 12 11 ar + 2 13 11 ar + 3 11 3 1 + 4 20 19 1 + 5 19 18 1 + 6 19 21 2 + 7 18 17 2 + 8 23 21 1 + 9 21 22 1 + 10 17 16 1 + 11 17 24 1 + 12 16 15 1 + 13 4 3 ar + 14 4 5 ar + 15 3 2 ar + 16 22 24 2 + 17 22 25 1 + 18 15 14 1 + 19 5 6 2 + 20 5 7 ar + 21 2 1 1 + 22 2 7 ar + 23 6 8 1 + 24 1 14 1 + 25 7 10 2 + 26 8 9 2 + 27 10 9 1 +########## Name: ligand +########## Vina_BE: -11.873 +########## MW: 373.704 +########## clogP: 1.841 +########## nonHatoms: 28 +########## Vina_LE: -0.424 +########## Vina_LipE: -13.714 +########## Close_contacts: 0 +########## Hydrophob_contacts: 27 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +ligand.pdbqt + 28 32 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -32.2590 -11.0940 -17.1050 C.2 1 UNL1 0.0110 + 2 C -33.5690 -11.0510 -17.6260 C.2 1 UNL1 0.0120 + 3 C -33.8040 -10.5620 -18.9250 C.2 1 UNL1 0.0160 + 4 C -26.4020 -7.2420 -20.2410 C.2 1 UNL1 0.0190 + 5 C -25.1030 -7.5730 -19.8000 C.2 1 UNL1 -0.1150 + 6 C -24.9040 -8.8050 -19.1510 C.2 1 UNL1 0.0410 + 7 C -25.9760 -9.6890 -18.9650 C.2 1 UNL1 -0.0250 + 8 C -29.1740 -10.5700 -20.3190 C.3 1 UNL1 0.2580 + 9 C -29.9770 -8.2110 -19.7230 C.3 1 UNL1 0.3010 + 10 C -27.5050 -8.1060 -20.0520 C.2 1 UNL1 0.0750 + 11 C -27.2640 -9.3570 -19.4170 C.2 1 UNL1 0.0310 + 12 C -30.3990 -9.6340 -20.1680 C.3 1 UNL1 -0.0410 + 13 C -32.7320 -9.5640 -21.0850 C.3 1 UNL1 0.0590 + 14 N -28.7970 -7.7100 -20.4560 N.pl3 1 UNL1 -0.6510 + 15 O -28.2290 -10.3350 -19.2620 O.2 1 UNL1 -0.3510 + 16 C -32.7100 -10.1250 -19.6850 C.2 1 UNL1 -0.0810 + 17 C -31.4180 -10.1720 -19.1780 C.2 1 UNL1 -0.0680 + 18 C -31.1710 -10.6500 -17.8810 C.2 1 UNL1 0.0660 + 19 CL -34.9120 -11.6040 -16.6510 Cl 1 UNL1 -0.1220 + 20 C -31.2350 -9.6000 -21.4870 C.3 1 UNL1 0.0350 + 21 C -23.9460 -6.6190 -20.0170 C.2 1 UNL1 0.9090 + 22 O -23.7300 -6.2300 -21.1540 O.co2 1 UNL1 -0.8300 + 23 O -23.2920 -6.2800 -19.0440 O.co2 1 UNL1 -0.8300 + 24 C -29.0480 -6.5640 -21.3550 C.3 1 UNL1 0.3130 + 25 C -28.8320 -5.1970 -20.6740 C.3 1 UNL1 -0.0270 + 26 C -29.4290 -3.9320 -21.3770 C.3 1 UNL1 0.0090 + 27 C -29.5250 -3.3230 -19.9420 C.3 1 UNL1 -0.0210 + 28 C -29.7460 -4.7940 -19.4660 C.3 1 UNL1 0.0090 +@BOND + 1 20 13 1 + 2 20 12 1 + 3 26 25 1 + 4 26 27 1 + 5 24 25 1 + 6 24 14 1 + 7 22 21 ar + 8 13 16 1 + 9 25 28 1 + 10 14 10 1 + 11 14 9 1 + 12 8 12 1 + 13 8 15 1 + 14 4 10 2 + 15 4 5 1 + 16 12 9 1 + 17 12 17 1 + 18 10 11 1 + 19 21 5 1 + 20 21 23 ar + 21 27 28 1 + 22 5 6 2 + 23 16 17 2 + 24 16 3 1 + 25 11 15 1 + 26 11 7 2 + 27 17 18 1 + 28 6 7 1 + 29 3 2 2 + 30 18 1 2 + 31 2 1 1 + 32 2 19 1 diff --git a/docking_mcl1/MTH_Results_all/VinaResults_6o6f_wt_H.mol2 b/docking_mcl1/MTH_Results_all/VinaResults_6o6f_wt_H.mol2 new file mode 100644 index 0000000..219218e --- /dev/null +++ b/docking_mcl1/MTH_Results_all/VinaResults_6o6f_wt_H.mol2 @@ -0,0 +1,2000 @@ +########## Name: lig_27 +########## Vina_BE: -8.54 +########## MW: 279.205 +########## clogP: -0.331 +########## nonHatoms: 23 +########## Vina_LE: -0.371 +########## Vina_LipE: -8.209 +########## Close_contacts: 0 +########## Hydrophob_contacts: 22 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_27.pdbqt + 23 25 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 CA -26.4810 -7.8770 -20.0700 C.ar 1 UNL1 0.0410 + 2 N -26.4970 -6.5500 -20.4940 N.ar 1 UNL1 -0.2150 + 3 C -27.8150 -6.1640 -20.3590 C.ar 1 UNL1 -0.0400 + 4 C -28.3870 -4.9230 -20.6610 C.2 1 UNL1 -0.0330 + 5 C -29.7720 -4.7700 -20.4450 C.2 1 UNL1 -0.0360 + 6 C -30.5420 -5.8450 -19.9440 C.2 1 UNL1 -0.0710 + 7 C -29.9380 -7.0860 -19.6490 C.2 1 UNL1 0.0250 + 8 C -28.5590 -7.2210 -19.8650 C.ar 1 UNL1 -0.0710 + 9 C -27.7290 -8.3100 -19.6730 C.ar 1 UNL1 -0.1800 + 10 H -25.6950 -6.0400 -20.8330 H 1 UNL1 0.3100 + 11 C -25.2160 -8.6760 -20.0830 C.2 1 UNL1 0.8430 + 12 O -24.2920 -8.2340 -19.4130 O.co2 1 UNL1 -0.8210 + 13 OXT -25.1180 -9.7020 -20.7420 O.co2 1 UNL1 -0.8210 + 14 C -28.1130 -9.6800 -19.1490 C.3 1 UNL1 0.1040 + 15 C -28.6690 -10.5790 -20.2790 C.3 1 UNL1 -0.0260 + 16 C -30.2140 -10.6250 -20.3290 C.3 1 UNL1 0.2820 + 17 O -30.7800 -10.2290 -19.0590 O.2 1 UNL1 -0.3520 + 18 C -32.0430 -10.5860 -18.6430 C.2 1 UNL1 0.1340 + 19 C -33.1390 -10.6310 -19.5250 C.2 1 UNL1 -0.0120 + 20 C -34.4110 -10.9860 -19.0460 C.2 1 UNL1 0.0100 + 21 C -34.5940 -11.2810 -17.6840 C.2 1 UNL1 -0.0710 + 22 C -33.5040 -11.2200 -16.8000 C.2 1 UNL1 0.0100 + 23 C -32.2320 -10.8680 -17.2830 C.2 1 UNL1 -0.0120 +@BOND + 1 10 2 1 + 2 13 11 ar + 3 4 5 1 + 4 4 3 2 + 5 2 3 ar + 6 2 1 ar + 7 5 6 2 + 8 3 8 ar + 9 16 15 1 + 10 16 17 1 + 11 15 14 1 + 12 11 1 1 + 13 11 12 ar + 14 1 9 ar + 15 6 7 1 + 16 8 9 ar + 17 8 7 2 + 18 9 14 1 + 19 19 20 1 + 20 19 18 2 + 21 17 18 1 + 22 20 21 2 + 23 18 23 1 + 24 21 22 1 + 25 23 22 2 +########## Name: lig_28 +########## Vina_BE: -8.816 +########## MW: 291.216 +########## clogP: -0.176 +########## nonHatoms: 24 +########## Vina_LE: -0.367 +########## Vina_LipE: -8.64 +########## Close_contacts: 0 +########## Hydrophob_contacts: 21 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_28.pdbqt + 24 26 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.8390 -8.0000 -19.6870 C.ar 1 UNL1 -0.1860 + 2 CA -26.5150 -7.6240 -20.1540 C.ar 1 UNL1 0.0480 + 3 N -26.5150 -6.2940 -20.5860 N.ar 1 UNL1 -0.2140 + 4 C -27.8020 -5.8140 -20.4180 C.ar 1 UNL1 -0.0430 + 5 C -28.2840 -4.5350 -20.7180 C.2 1 UNL1 -0.0330 + 6 C -29.6470 -4.2710 -20.4730 C.2 1 UNL1 -0.0390 + 7 C -30.4880 -5.2780 -19.9480 C.2 1 UNL1 -0.0730 + 8 C -29.9750 -6.5590 -19.6590 C.2 1 UNL1 0.0200 + 9 C -28.6160 -6.7990 -19.8980 C.ar 1 UNL1 -0.0730 + 10 H -25.7030 -5.8230 -20.9540 H 1 UNL1 0.3100 + 11 C -25.2690 -8.4430 -20.2050 C.2 1 UNL1 0.8380 + 12 OXT -25.1780 -9.3990 -20.9580 O.co2 1 UNL1 -0.8150 + 13 O -24.3650 -8.1000 -19.4550 O.co2 1 UNL1 -0.8150 + 14 C -28.1960 -9.3360 -19.0850 C.3 1 UNL1 0.0980 + 15 C -28.4620 -10.4220 -20.1560 C.3 1 UNL1 0.0250 + 16 C -29.9390 -10.8680 -20.2630 C.3 1 UNL1 0.2440 + 17 O -30.8010 -9.9450 -19.5650 O.2 1 UNL1 -0.3680 + 18 C -31.9000 -10.3890 -18.8680 C.2 1 UNL1 0.1200 + 19 C -31.7450 -10.7270 -17.5160 C.2 1 UNL1 0.0070 + 20 C -32.8450 -11.1780 -16.7670 C.2 1 UNL1 -0.0080 + 21 C -34.1080 -11.2740 -17.3740 C.2 1 UNL1 -0.0310 + 22 C -34.2700 -10.9140 -18.7220 C.2 1 UNL1 -0.0040 + 23 C -33.1710 -10.4630 -19.4790 C.2 1 UNL1 -0.0960 + 24 C -33.3720 -10.0810 -20.9400 C.3 1 UNL1 0.0900 +@BOND + 1 12 11 ar + 2 10 3 1 + 3 24 23 1 + 4 5 6 1 + 5 5 4 2 + 6 3 4 ar + 7 3 2 ar + 8 6 7 2 + 9 4 9 ar + 10 16 15 1 + 11 16 17 1 + 12 11 2 1 + 13 11 13 ar + 14 15 14 1 + 15 2 1 ar + 16 7 8 1 + 17 9 1 ar + 18 9 8 2 + 19 1 14 1 + 20 17 18 1 + 21 23 18 2 + 22 23 22 1 + 23 18 19 1 + 24 22 21 2 + 25 19 20 2 + 26 21 20 1 +########## Name: lig_30 +########## Vina_BE: -8.927 +########## MW: 291.216 +########## clogP: -0.176 +########## nonHatoms: 24 +########## Vina_LE: -0.372 +########## Vina_LipE: -8.751 +########## Close_contacts: 1 +########## Hydrophob_contacts: 33 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_30.pdbqt + 24 26 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.7360 -8.0930 -19.8080 C.ar 1 UNL1 -0.1930 + 2 CA -26.4910 -7.6450 -20.2720 C.ar 1 UNL1 -0.0370 + 3 N -26.6560 -6.3250 -20.7300 N.ar 1 UNL1 -0.2140 + 4 C -27.9720 -5.9560 -20.5560 C.ar 1 UNL1 -0.0420 + 5 C -28.5820 -4.7340 -20.8630 C.2 1 UNL1 -0.0300 + 6 C -29.9580 -4.6020 -20.5820 C.2 1 UNL1 -0.0380 + 7 C -30.6780 -5.6780 -20.0130 C.2 1 UNL1 -0.0670 + 8 C -30.0310 -6.8960 -19.7160 C.2 1 UNL1 0.0130 + 9 C -28.6620 -7.0010 -20.0020 C.ar 1 UNL1 -0.0730 + 10 H -25.9030 -5.7750 -21.1140 H 1 UNL1 0.3100 + 11 C -25.1790 -8.3540 -20.3080 C.2 1 UNL1 0.9270 + 12 OXT -24.5660 -8.5990 -19.2820 O.co2 1 UNL1 -0.8140 + 13 O -24.7680 -8.6640 -21.4190 O.co2 1 UNL1 -0.8140 + 14 C -28.0000 -9.4490 -19.1990 C.3 1 UNL1 0.0990 + 15 C -28.4430 -10.4980 -20.2440 C.3 1 UNL1 0.0220 + 16 C -29.9770 -10.5290 -20.4420 C.3 1 UNL1 0.2540 + 17 O -30.6410 -10.3100 -19.1800 O.2 1 UNL1 -0.3400 + 18 C -31.9950 -10.4860 -18.9770 C.2 1 UNL1 0.1530 + 19 C -32.8460 -10.2890 -20.0730 C.2 1 UNL1 -0.0370 + 20 C -34.2330 -10.4640 -19.9370 C.2 1 UNL1 0.0140 + 21 C -34.7710 -10.8410 -18.6960 C.2 1 UNL1 -0.0660 + 22 C -33.9280 -11.0430 -17.5900 C.2 1 UNL1 -0.0450 + 23 C -34.5050 -11.4550 -16.2460 C.3 1 UNL1 0.0690 + 24 C -32.5400 -10.8690 -17.7350 C.2 1 UNL1 -0.0500 +@BOND + 1 13 11 ar + 2 10 3 1 + 3 5 6 1 + 4 5 4 2 + 5 3 4 ar + 6 3 2 ar + 7 6 7 2 + 8 4 9 ar + 9 16 15 1 + 10 16 17 1 + 11 11 2 1 + 12 11 12 ar + 13 2 1 ar + 14 15 14 1 + 15 19 20 1 + 16 19 18 2 + 17 7 8 1 + 18 9 1 ar + 19 9 8 2 + 20 20 21 2 + 21 1 14 1 + 22 17 18 1 + 23 18 24 1 + 24 21 22 1 + 25 24 22 2 + 26 22 23 1 +########## Name: lig_31 +########## Vina_BE: -9.435 +########## MW: 348.211 +########## clogP: 2.342 +########## nonHatoms: 27 +########## Vina_LE: -0.349 +########## Vina_LipE: -11.777 +########## Close_contacts: 1 +########## Hydrophob_contacts: 24 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_31.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.6040 -8.9740 -18.8630 C.3 1 UNL1 0.1040 + 2 C -27.4800 -7.7550 -19.7470 C.ar 1 UNL1 -0.1820 + 3 C -28.4980 -6.7640 -20.0130 C.ar 1 UNL1 -0.0710 + 4 C -29.8280 -6.6810 -19.5770 C.2 1 UNL1 0.0250 + 5 C -27.9590 -5.8030 -20.8240 C.ar 1 UNL1 -0.0390 + 6 C -30.5960 -5.5750 -19.9990 C.2 1 UNL1 -0.0680 + 7 C -30.0300 -4.5850 -20.8360 C.2 1 UNL1 -0.0330 + 8 C -28.6900 -4.6920 -21.2600 C.2 1 UNL1 -0.0310 + 9 N -26.6480 -6.1280 -21.0930 N.ar 1 UNL1 -0.2140 + 10 CA -26.3300 -7.3280 -20.4300 C.ar 1 UNL1 -0.0480 + 11 H -25.9830 -5.6140 -21.6520 H 1 UNL1 0.3110 + 12 C -24.9740 -7.9430 -20.5140 C.2 1 UNL1 0.9330 + 13 OXT -24.9010 -9.0060 -21.1120 O.co2 1 UNL1 -0.8230 + 14 O -24.0100 -7.4240 -19.9770 O.co2 1 UNL1 -0.8230 + 15 C -27.7270 -10.2810 -19.6800 C.3 1 UNL1 -0.0240 + 16 C -29.1590 -10.5440 -20.2060 C.3 1 UNL1 0.2880 + 17 O -30.1220 -10.1410 -19.2060 O.2 1 UNL1 -0.3460 + 18 C -31.4780 -10.2520 -19.4200 C.2 1 UNL1 0.1330 + 19 C -32.0660 -9.8520 -20.6300 C.2 1 UNL1 0.0660 + 20 C -33.4480 -10.0050 -20.8230 C.2 1 UNL1 0.0390 + 21 C -34.2440 -10.5550 -19.8040 C.2 1 UNL1 -0.0020 + 22 C -33.6670 -10.9560 -18.5800 C.2 1 UNL1 -0.1540 + 23 C -32.2780 -10.7870 -18.3980 C.2 1 UNL1 0.0190 + 24 C -34.5400 -11.5510 -17.4690 C.3 1 UNL1 0.6870 + 25 F -35.6820 -10.8500 -17.3060 F 1 UNL1 -0.2490 + 26 F -34.9050 -12.8280 -17.7260 F 1 UNL1 -0.2490 + 27 F -33.9220 -11.5700 -16.2660 F 1 UNL1 -0.2490 +@BOND + 1 11 9 1 + 2 8 7 2 + 3 8 5 1 + 4 13 12 ar + 5 9 5 ar + 6 9 10 ar + 7 7 6 1 + 8 5 3 ar + 9 20 19 1 + 10 20 21 2 + 11 19 18 2 + 12 12 10 1 + 13 12 14 ar + 14 10 2 ar + 15 16 15 1 + 16 16 17 1 + 17 3 2 ar + 18 3 4 1 + 19 6 4 2 + 20 21 22 1 + 21 2 1 1 + 22 15 1 1 + 23 18 17 1 + 24 18 23 1 + 25 22 23 2 + 26 22 24 1 + 27 26 24 1 + 28 24 25 1 + 29 24 27 1 +########## Name: lig_32 +########## Vina_BE: -8.969 +########## MW: 291.216 +########## clogP: -0.176 +########## nonHatoms: 24 +########## Vina_LE: -0.374 +########## Vina_LipE: -8.793 +########## Close_contacts: 1 +########## Hydrophob_contacts: 24 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_32.pdbqt + 24 26 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.7050 -7.8680 -19.7900 C.ar 1 UNL1 -0.1930 + 2 CA -26.4420 -7.4880 -20.2650 C.ar 1 UNL1 -0.0370 + 3 N -26.5340 -6.1540 -20.7050 N.ar 1 UNL1 -0.2140 + 4 C -27.8170 -5.7020 -20.4870 C.ar 1 UNL1 -0.0430 + 5 C -28.3510 -4.4310 -20.7350 C.2 1 UNL1 -0.0300 + 6 C -29.7020 -4.2130 -20.3970 C.2 1 UNL1 -0.0380 + 7 C -30.4740 -5.2520 -19.8270 C.2 1 UNL1 -0.0670 + 8 C -29.9050 -6.5200 -19.5920 C.2 1 UNL1 0.0140 + 9 C -28.5610 -6.7120 -19.9380 C.ar 1 UNL1 -0.0720 + 10 H -25.7540 -5.6430 -21.0900 H 1 UNL1 0.3100 + 11 C -25.1700 -8.2680 -20.3200 C.2 1 UNL1 0.9270 + 12 OXT -24.5380 -8.5160 -19.3050 O.co2 1 UNL1 -0.8150 + 13 O -24.8010 -8.6120 -21.4340 O.co2 1 UNL1 -0.8150 + 14 C -28.0390 -9.2100 -19.1850 C.3 1 UNL1 0.0980 + 15 C -28.1420 -10.3260 -20.2510 C.3 1 UNL1 0.0230 + 16 C -29.5730 -10.8800 -20.4110 C.3 1 UNL1 0.2520 + 17 O -30.5080 -9.9010 -19.9190 O.2 1 UNL1 -0.3390 + 18 C -31.5760 -10.2710 -19.1380 C.2 1 UNL1 0.1480 + 19 C -32.8590 -10.4560 -19.6800 C.2 1 UNL1 -0.0390 + 20 C -33.9230 -10.8500 -18.8530 C.2 1 UNL1 0.0230 + 21 C -33.7120 -11.0630 -17.4780 C.2 1 UNL1 -0.1370 + 22 C -34.8660 -11.4870 -16.5850 C.3 1 UNL1 0.0600 + 23 C -32.4240 -10.8850 -16.9410 C.2 1 UNL1 0.0230 + 24 C -31.3600 -10.4950 -17.7710 C.2 1 UNL1 -0.0390 +@BOND + 1 13 11 ar + 2 10 3 1 + 3 5 4 2 + 4 5 6 1 + 5 3 4 ar + 6 3 2 ar + 7 4 9 ar + 8 16 15 1 + 9 16 17 1 + 10 6 7 2 + 11 11 2 1 + 12 11 12 ar + 13 2 1 ar + 14 15 14 1 + 15 9 1 ar + 16 9 8 2 + 17 17 18 1 + 18 7 8 1 + 19 1 14 1 + 20 19 18 2 + 21 19 20 1 + 22 18 24 1 + 23 20 21 2 + 24 24 23 2 + 25 21 23 1 + 26 21 22 1 +########## Name: lig_33 +########## Vina_BE: -8.728 +########## MW: 314.658 +########## clogP: 0.432 +########## nonHatoms: 24 +########## Vina_LE: -0.364 +########## Vina_LipE: -9.16 +########## Close_contacts: 1 +########## Hydrophob_contacts: 20 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_33.pdbqt + 24 26 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 CA -26.4820 -7.5650 -20.2430 C.ar 1 UNL1 -0.0480 + 2 N -26.5660 -6.2350 -20.6940 N.ar 1 UNL1 -0.2140 + 3 C -27.8480 -5.7740 -20.4830 C.ar 1 UNL1 -0.0400 + 4 C -28.3840 -4.5170 -20.7870 C.2 1 UNL1 -0.0310 + 5 C -29.7400 -4.2930 -20.4740 C.2 1 UNL1 -0.0350 + 6 C -30.5160 -5.3140 -19.8770 C.2 1 UNL1 -0.0700 + 7 C -29.9430 -6.5710 -19.5850 C.2 1 UNL1 0.0250 + 8 C -28.5920 -6.7670 -19.9040 C.ar 1 UNL1 -0.0710 + 9 C -27.7400 -7.9200 -19.7350 C.ar 1 UNL1 -0.1810 + 10 H -25.7890 -5.7410 -21.1090 H 1 UNL1 0.3100 + 11 C -25.2360 -8.3820 -20.3390 C.2 1 UNL1 0.9320 + 12 O -24.8080 -8.5780 -21.4670 O.co2 1 UNL1 -0.8210 + 13 OXT -24.6950 -8.8350 -19.3400 O.co2 1 UNL1 -0.8210 + 14 C -28.0650 -9.2720 -19.1560 C.3 1 UNL1 0.1060 + 15 C -28.1490 -10.3600 -20.2530 C.3 1 UNL1 -0.0250 + 16 C -29.5790 -10.8850 -20.5100 C.3 1 UNL1 0.2840 + 17 O -30.5660 -9.9620 -19.9950 O.2 1 UNL1 -0.3480 + 18 C -31.6180 -10.3300 -19.1860 C.2 1 UNL1 0.1390 + 19 C -31.3560 -10.5260 -17.8220 C.2 1 UNL1 0.0010 + 20 C -32.3940 -10.8750 -16.9410 C.2 1 UNL1 0.0380 + 21 C -33.7030 -11.0200 -17.4290 C.2 1 UNL1 -0.0310 + 22 CL -34.9990 -11.4530 -16.3330 Cl 1 UNL1 -0.1370 + 23 C -33.9740 -10.8180 -18.7910 C.2 1 UNL1 0.0380 + 24 C -32.9340 -10.4640 -19.6700 C.2 1 UNL1 0.0010 +@BOND + 1 12 11 ar + 2 10 2 1 + 3 4 3 2 + 4 4 5 1 + 5 2 3 ar + 6 2 1 ar + 7 16 15 1 + 8 16 17 1 + 9 3 8 ar + 10 5 6 2 + 11 11 1 1 + 12 11 13 ar + 13 15 14 1 + 14 1 9 ar + 15 17 18 1 + 16 8 9 ar + 17 8 7 2 + 18 6 7 1 + 19 9 14 1 + 20 24 18 2 + 21 24 23 1 + 22 18 19 1 + 23 23 21 2 + 24 19 20 2 + 25 21 20 1 + 26 21 22 1 +########## Name: lig_34 +########## Vina_BE: -9.469 +########## MW: 348.211 +########## clogP: 2.342 +########## nonHatoms: 27 +########## Vina_LE: -0.351 +########## Vina_LipE: -11.811 +########## Close_contacts: 0 +########## Hydrophob_contacts: 21 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_34.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.6740 -8.8250 -19.0610 C.3 1 UNL1 0.1040 + 2 C -27.4870 -7.5110 -19.7850 C.ar 1 UNL1 -0.1820 + 3 C -28.4490 -6.4400 -19.9150 C.ar 1 UNL1 -0.0710 + 4 C -29.7700 -6.3390 -19.4590 C.2 1 UNL1 0.0250 + 5 C -27.8560 -5.4150 -20.6000 C.ar 1 UNL1 -0.0390 + 6 C -30.4740 -5.1470 -19.7250 C.2 1 UNL1 -0.0680 + 7 C -29.8550 -4.0900 -20.4310 C.2 1 UNL1 -0.0330 + 8 C -28.5240 -4.2160 -20.8790 C.2 1 UNL1 -0.0310 + 9 N -26.5650 -5.7740 -20.9180 N.ar 1 UNL1 -0.2140 + 10 CA -26.3140 -7.0640 -20.4140 C.ar 1 UNL1 -0.0480 + 11 H -25.8730 -5.2290 -21.4080 H 1 UNL1 0.3110 + 12 C -24.9930 -7.7380 -20.5810 C.2 1 UNL1 0.9330 + 13 OXT -24.8470 -8.3910 -21.6020 O.co2 1 UNL1 -0.8230 + 14 O -24.1330 -7.6650 -19.7170 O.co2 1 UNL1 -0.8230 + 15 C -27.4640 -10.0440 -19.9870 C.3 1 UNL1 -0.0240 + 16 C -28.7820 -10.7660 -20.3620 C.3 1 UNL1 0.2880 + 17 O -29.8830 -9.8300 -20.3010 O.2 1 UNL1 -0.3460 + 18 C -31.0720 -10.1380 -19.6740 C.2 1 UNL1 0.1330 + 19 C -32.2960 -10.1670 -20.3630 C.2 1 UNL1 0.0660 + 20 C -33.4790 -10.5190 -19.6910 C.2 1 UNL1 0.0390 + 21 C -33.4560 -10.8400 -18.3160 C.2 1 UNL1 -0.1370 + 22 C -32.2240 -10.7950 -17.6310 C.2 1 UNL1 -0.0190 + 23 C -31.0440 -10.4400 -18.3050 C.2 1 UNL1 0.0190 + 24 C -34.7320 -11.2480 -17.5690 C.3 1 UNL1 0.6870 + 25 F -34.9890 -12.5690 -17.6980 F 1 UNL1 -0.2490 + 26 F -34.6860 -10.9990 -16.2410 F 1 UNL1 -0.2490 + 27 F -35.8150 -10.5990 -18.0480 F 1 UNL1 -0.2490 +@BOND + 1 13 12 ar + 2 11 9 1 + 3 9 5 ar + 4 9 10 ar + 5 8 5 1 + 6 8 7 2 + 7 5 3 ar + 8 12 10 1 + 9 12 14 ar + 10 7 6 1 + 11 10 2 ar + 12 19 20 1 + 13 19 18 2 + 14 16 17 1 + 15 16 15 1 + 16 17 18 1 + 17 15 1 1 + 18 3 2 ar + 19 3 4 1 + 20 2 1 1 + 21 6 4 2 + 22 20 21 2 + 23 18 23 1 + 24 21 22 1 + 25 21 24 1 + 26 23 22 2 + 27 27 24 1 + 28 25 24 1 + 29 24 26 1 +########## Name: lig_35 +########## Vina_BE: -8.758 +########## MW: 326.669 +########## clogP: 0.587 +########## nonHatoms: 25 +########## Vina_LE: -0.35 +########## Vina_LipE: -9.345 +########## Close_contacts: 2 +########## Hydrophob_contacts: 23 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_35.pdbqt + 25 27 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.2950 -7.5120 -19.9840 C.ar 1 UNL1 -0.1950 + 2 CA -26.2580 -6.9940 -20.7720 C.ar 1 UNL1 -0.0370 + 3 N -26.7260 -5.8090 -21.3690 N.ar 1 UNL1 -0.2140 + 4 C -28.0120 -5.5720 -20.9360 C.ar 1 UNL1 -0.0420 + 5 C -28.8460 -4.4870 -21.2320 C.2 1 UNL1 -0.0290 + 6 C -30.1210 -4.4610 -20.6300 C.2 1 UNL1 -0.0370 + 7 C -30.5210 -5.4970 -19.7560 C.2 1 UNL1 -0.0660 + 8 C -29.6540 -6.5750 -19.4800 C.2 1 UNL1 0.0110 + 9 C -28.3960 -6.5820 -20.0960 C.ar 1 UNL1 -0.0740 + 10 H -26.1620 -5.2390 -21.9810 H 1 UNL1 0.3110 + 11 C -24.8740 -7.5130 -20.9840 C.2 1 UNL1 0.9270 + 12 OXT -24.0940 -7.6330 -20.0520 O.co2 1 UNL1 -0.8140 + 13 O -24.5700 -7.7700 -22.1410 O.co2 1 UNL1 -0.8140 + 14 C -27.2070 -8.7640 -19.1440 C.3 1 UNL1 0.0980 + 15 C -27.4260 -10.0440 -19.9820 C.3 1 UNL1 0.0260 + 16 C -28.8990 -10.5000 -20.0130 C.3 1 UNL1 0.2600 + 17 O -29.5590 -10.0000 -18.8350 O.2 1 UNL1 -0.3380 + 18 C -30.8570 -10.3230 -18.5040 C.2 1 UNL1 0.1580 + 19 C -31.7980 -10.3590 -19.5420 C.2 1 UNL1 -0.0400 + 20 C -33.1460 -10.6710 -19.2840 C.2 1 UNL1 -0.0300 + 21 C -34.1520 -10.6920 -20.4260 C.3 1 UNL1 0.0910 + 22 C -33.5450 -10.9510 -17.9600 C.2 1 UNL1 -0.0360 + 23 C -32.6060 -10.9140 -16.9160 C.2 1 UNL1 0.0390 + 24 CL -35.2100 -11.3480 -17.5760 Cl 1 UNL1 -0.1280 + 25 C -31.2630 -10.5990 -17.1850 C.2 1 UNL1 -0.0260 +@BOND + 1 13 11 ar + 2 10 3 1 + 3 3 4 ar + 4 3 2 ar + 5 5 4 2 + 6 5 6 1 + 7 11 2 1 + 8 11 12 ar + 9 4 9 ar + 10 2 1 ar + 11 6 7 2 + 12 21 20 1 + 13 9 1 ar + 14 9 8 2 + 15 16 15 1 + 16 16 17 1 + 17 1 14 1 + 18 15 14 1 + 19 7 8 1 + 20 19 20 1 + 21 19 18 2 + 22 20 22 2 + 23 17 18 1 + 24 18 25 1 + 25 22 24 1 + 26 22 23 1 + 27 25 23 2 +########## Name: lig_36 +########## Vina_BE: -8.683 +########## MW: 338.68 +########## clogP: 0.668 +########## nonHatoms: 26 +########## Vina_LE: -0.334 +########## Vina_LipE: -9.351 +########## Close_contacts: 2 +########## Hydrophob_contacts: 33 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_36.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.4100 -7.8510 -19.8780 C.ar 1 UNL1 -0.1820 + 2 CA -26.2760 -7.2070 -20.5240 C.ar 1 UNL1 0.0400 + 3 N -26.6390 -5.9370 -20.9830 N.ar 1 UNL1 -0.2140 + 4 C -27.9650 -5.7490 -20.6500 C.ar 1 UNL1 -0.0400 + 5 C -28.7590 -4.6240 -20.9050 C.2 1 UNL1 -0.0310 + 6 C -30.1010 -4.6540 -20.4700 C.2 1 UNL1 -0.0350 + 7 C -30.6110 -5.7890 -19.8010 C.2 1 UNL1 -0.0700 + 8 C -29.7880 -6.9090 -19.5570 C.2 1 UNL1 0.0250 + 9 C -28.4580 -6.8590 -19.9960 C.ar 1 UNL1 -0.0700 + 10 H -26.0070 -5.3140 -21.4630 H 1 UNL1 0.3100 + 11 C -24.8890 -7.7140 -20.7350 C.2 1 UNL1 0.8430 + 12 O -24.1550 -7.9520 -19.7910 O.co2 1 UNL1 -0.8210 + 13 OXT -24.5530 -7.9090 -21.8950 O.co2 1 UNL1 -0.8210 + 14 C -27.4210 -9.2230 -19.2470 C.3 1 UNL1 0.1050 + 15 C -27.8410 -10.3220 -20.2520 C.3 1 UNL1 -0.0250 + 16 C -29.2850 -10.8170 -20.0300 C.3 1 UNL1 0.2860 + 17 O -29.8050 -10.1580 -18.8580 O.2 1 UNL1 -0.3480 + 18 C -31.0530 -10.4740 -18.3860 C.2 1 UNL1 0.1410 + 19 C -32.1450 -10.4320 -19.2650 C.2 1 UNL1 -0.0340 + 20 C -33.4440 -10.7350 -18.8140 C.2 1 UNL1 -0.0570 + 21 C -33.6360 -11.0700 -17.4550 C.2 1 UNL1 -0.0260 + 22 C -32.5430 -11.0960 -16.5720 C.2 1 UNL1 0.0580 + 23 CL -35.2260 -11.4420 -16.8100 Cl 1 UNL1 -0.1370 + 24 C -31.2510 -10.7960 -17.0360 C.2 1 UNL1 0.0360 + 25 C -34.6060 -10.6730 -19.8010 C.3 1 UNL1 0.0570 + 26 C -34.1260 -10.3970 -21.2400 C.3 1 UNL1 0.0110 +@BOND + 1 13 11 ar + 2 10 3 1 + 3 26 25 1 + 4 3 4 ar + 5 3 2 ar + 6 5 4 2 + 7 5 6 1 + 8 11 2 1 + 9 11 12 ar + 10 4 9 ar + 11 2 1 ar + 12 6 7 2 + 13 15 16 1 + 14 15 14 1 + 15 16 17 1 + 16 9 1 ar + 17 9 8 2 + 18 1 14 1 + 19 7 8 1 + 20 25 20 1 + 21 19 20 1 + 22 19 18 2 + 23 17 18 1 + 24 20 21 2 + 25 18 24 1 + 26 21 23 1 + 27 21 22 1 + 28 24 22 2 +########## Name: lig_37 +########## Vina_BE: -8.761 +########## MW: 338.68 +########## clogP: 0.742 +########## nonHatoms: 26 +########## Vina_LE: -0.337 +########## Vina_LipE: -9.503 +########## Close_contacts: 0 +########## Hydrophob_contacts: 24 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_37.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.4180 -7.4120 -19.7660 C.ar 1 UNL1 -0.2010 + 2 CA -26.2570 -6.9110 -20.4850 C.ar 1 UNL1 0.0730 + 3 N -26.5340 -5.6480 -21.0190 N.ar 1 UNL1 -0.2220 + 4 C -27.8340 -5.3360 -20.6680 C.ar 1 UNL1 -0.0430 + 5 C -28.5500 -4.1760 -20.9890 C.2 1 UNL1 -0.0310 + 6 C -29.8770 -4.0730 -20.5270 C.2 1 UNL1 -0.0380 + 7 C -30.4550 -5.1160 -19.7670 C.2 1 UNL1 -0.0640 + 8 C -29.7110 -6.2750 -19.4610 C.2 1 UNL1 0.0190 + 9 C -28.3930 -6.3570 -19.9270 C.ar 1 UNL1 -0.0560 + 10 H -25.8740 -5.1110 -21.5610 H 1 UNL1 0.2980 + 11 C -24.9290 -7.5630 -20.6970 C.2 1 UNL1 0.8300 + 12 O -24.0470 -7.4910 -19.8560 O.co2 1 UNL1 -0.8100 + 13 OXT -24.7870 -8.1760 -21.7460 O.co2 1 UNL1 -0.8100 + 14 C -27.4840 -8.7520 -19.0790 C.3 1 UNL1 0.0940 + 15 C -27.2790 -9.9250 -20.0700 C.3 1 UNL1 -0.0200 + 16 C -28.5810 -10.7030 -20.3450 C.3 1 UNL1 0.2770 + 17 O -29.6690 -9.7650 -20.4660 O.2 1 UNL1 -0.3530 + 18 C -30.9110 -10.0740 -19.9690 C.2 1 UNL1 0.1400 + 19 C -32.0330 -10.1500 -20.8100 C.2 1 UNL1 -0.0100 + 20 C -33.2940 -10.4830 -20.2840 C.2 1 UNL1 -0.0400 + 21 C -34.4940 -10.5500 -21.2190 C.3 1 UNL1 0.0910 + 22 C -33.4220 -10.7550 -18.9040 C.2 1 UNL1 -0.0290 + 23 C -32.2910 -10.6980 -18.0590 C.2 1 UNL1 -0.0400 + 24 CL -34.9930 -11.1760 -18.2350 Cl 1 UNL1 -0.1380 + 25 C -31.0390 -10.3600 -18.6050 C.2 1 UNL1 -0.0100 + 26 C -32.4060 -10.9980 -16.5720 C.3 1 UNL1 0.0910 +@BOND + 1 13 11 ar + 2 10 3 1 + 3 21 20 1 + 4 3 4 ar + 5 3 2 ar + 6 5 4 2 + 7 5 6 1 + 8 19 20 1 + 9 19 18 2 + 10 11 2 1 + 11 11 12 ar + 12 4 9 ar + 13 6 7 2 + 14 2 1 ar + 15 17 16 1 + 16 17 18 1 + 17 16 15 1 + 18 20 22 2 + 19 15 14 1 + 20 18 25 1 + 21 9 1 ar + 22 9 8 2 + 23 7 8 1 + 24 1 14 1 + 25 22 24 1 + 26 22 23 1 + 27 25 23 2 + 28 23 26 1 +########## Name: lig_43 +########## Vina_BE: -10.16 +########## MW: 327.248 +########## clogP: 1.685 +########## nonHatoms: 27 +########## Vina_LE: -0.376 +########## Vina_LipE: -11.845 +########## Close_contacts: 0 +########## Hydrophob_contacts: 33 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_43.pdbqt + 27 30 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.9580 -8.9750 -19.0890 C.3 1 UNL1 0.1050 + 2 C -27.6890 -7.6690 -19.7990 C.ar 1 UNL1 -0.1800 + 3 C -28.6140 -6.5750 -19.9960 C.ar 1 UNL1 -0.0710 + 4 C -29.9610 -6.4440 -19.6350 C.2 1 UNL1 0.0250 + 5 C -27.9480 -5.5640 -20.6330 C.ar 1 UNL1 -0.0400 + 6 C -30.6160 -5.2340 -19.9500 C.2 1 UNL1 -0.0700 + 7 C -29.9220 -4.1920 -20.6080 C.2 1 UNL1 -0.0350 + 8 C -28.5660 -4.3500 -20.9590 C.2 1 UNL1 -0.0330 + 9 N -26.6470 -5.9520 -20.8570 N.ar 1 UNL1 -0.2140 + 10 CA -26.4610 -7.2470 -20.3370 C.ar 1 UNL1 -0.0480 + 11 H -25.9070 -5.4210 -21.2920 H 1 UNL1 0.3100 + 12 C -25.1420 -7.9420 -20.3990 C.2 1 UNL1 0.9320 + 13 O -24.7510 -8.2510 -21.5140 O.co2 1 UNL1 -0.8220 + 14 OXT -24.5150 -8.2020 -19.3860 O.co2 1 UNL1 -0.8220 + 15 C -27.6420 -10.2040 -19.9730 C.3 1 UNL1 -0.0240 + 16 C -28.8960 -10.8140 -20.6500 C.3 1 UNL1 0.2800 + 17 O -29.9850 -9.8630 -20.6020 O.2 1 UNL1 -0.3510 + 18 C -31.2100 -10.1810 -20.0520 C.2 1 UNL1 0.1230 + 19 C -32.3460 -10.1530 -20.8740 C.2 1 UNL1 -0.0090 + 20 C -33.6180 -10.4260 -20.3370 C.2 1 UNL1 -0.0040 + 21 C -33.7540 -10.7290 -18.9700 C.2 1 UNL1 -0.0700 + 22 C -35.0210 -10.9840 -18.4140 C.2 1 UNL1 -0.0070 + 23 C -32.6090 -10.7710 -18.1470 C.2 1 UNL1 -0.0050 + 24 C -35.1440 -11.2760 -17.0440 C.2 1 UNL1 -0.0330 + 25 C -34.0020 -11.3130 -16.2270 C.2 1 UNL1 -0.0250 + 26 C -32.7350 -11.0600 -16.7780 C.2 1 UNL1 0.0610 + 27 C -31.3430 -10.5100 -18.6920 C.2 1 UNL1 0.0260 +@BOND + 1 13 12 ar + 2 11 9 1 + 3 8 5 1 + 4 8 7 2 + 5 19 20 1 + 6 19 18 2 + 7 9 5 ar + 8 9 10 ar + 9 16 17 1 + 10 16 15 1 + 11 5 3 ar + 12 7 6 1 + 13 17 18 1 + 14 12 10 1 + 15 12 14 ar + 16 10 2 ar + 17 20 21 2 + 18 18 27 1 + 19 3 2 ar + 20 3 4 1 + 21 15 1 1 + 22 6 4 2 + 23 2 1 1 + 24 21 22 1 + 25 21 23 1 + 26 27 23 2 + 27 22 24 2 + 28 23 26 1 + 29 24 25 1 + 30 26 25 2 +########## Name: lig_46 +########## Vina_BE: -9.728 +########## MW: 315.238 +########## clogP: 0.06 +########## nonHatoms: 26 +########## Vina_LE: -0.374 +########## Vina_LipE: -9.788 +########## Close_contacts: 1 +########## Hydrophob_contacts: 29 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_46.pdbqt + 26 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 CA -26.4570 -7.4440 -20.2500 C.ar 1 UNL1 0.0410 + 2 N -26.5240 -6.1560 -20.7800 N.ar 1 UNL1 -0.2150 + 3 C -27.8310 -5.7690 -20.5770 C.ar 1 UNL1 -0.0400 + 4 C -28.4380 -4.5550 -20.9230 C.2 1 UNL1 -0.0330 + 5 C -29.8020 -4.3930 -20.6090 C.2 1 UNL1 -0.0360 + 6 C -30.5170 -5.4290 -19.9650 C.2 1 UNL1 -0.0710 + 7 C -29.8790 -6.6410 -19.6280 C.2 1 UNL1 0.0250 + 8 C -28.5220 -6.7870 -19.9470 C.ar 1 UNL1 -0.0710 + 9 C -27.6690 -7.8550 -19.7310 C.ar 1 UNL1 -0.1800 + 10 H -25.7530 -5.6650 -21.2080 H 1 UNL1 0.3100 + 11 C -25.1750 -8.2120 -20.2950 C.2 1 UNL1 0.8430 + 12 OXT -24.8310 -8.6240 -21.3940 O.co2 1 UNL1 -0.8210 + 13 O -24.5400 -8.4450 -19.2790 O.co2 1 UNL1 -0.8210 + 14 C -28.0360 -9.1640 -19.0510 C.3 1 UNL1 0.1040 + 15 C -27.8140 -10.3950 -19.9570 C.3 1 UNL1 -0.0250 + 16 C -29.1010 -10.8660 -20.6810 C.3 1 UNL1 0.2810 + 17 O -30.1490 -9.8930 -20.4850 O.2 1 UNL1 -0.3520 + 18 C -31.3510 -10.2050 -19.8820 C.2 1 UNL1 0.1360 + 19 C -32.5050 -10.2250 -20.6920 C.2 1 UNL1 -0.0540 + 20 C -33.7670 -10.5230 -20.1420 C.2 1 UNL1 0.0120 + 21 C -33.8490 -10.8030 -18.7710 C.2 1 UNL1 -0.1440 + 22 C -32.7150 -10.7950 -17.9720 C.2 1 UNL1 -0.0520 + 23 C -35.0860 -11.1430 -17.9730 C.3 1 UNL1 0.0490 + 24 C -31.4530 -10.5010 -18.5050 C.2 1 UNL1 0.0400 + 25 C -33.0380 -11.1300 -16.5370 C.3 1 UNL1 0.0880 + 26 C -34.5200 -11.5920 -16.5980 C.3 1 UNL1 -0.0140 +@BOND + 1 12 11 ar + 2 10 2 1 + 3 4 5 1 + 4 4 3 2 + 5 2 3 ar + 6 2 1 ar + 7 19 20 1 + 8 19 18 2 + 9 16 17 1 + 10 16 15 1 + 11 5 6 2 + 12 3 8 ar + 13 17 18 1 + 14 11 1 1 + 15 11 13 ar + 16 1 9 ar + 17 20 21 2 + 18 6 7 1 + 19 15 14 1 + 20 8 9 ar + 21 8 7 2 + 22 18 24 1 + 23 9 14 1 + 24 21 23 1 + 25 21 22 1 + 26 24 22 2 + 27 23 26 1 + 28 22 25 1 + 29 26 25 1 +########## Name: lig_47 +########## Vina_BE: -9.471 +########## MW: 329.244 +########## clogP: 0.864 +########## nonHatoms: 27 +########## Vina_LE: -0.351 +########## Vina_LipE: -10.335 +########## Close_contacts: 1 +########## Hydrophob_contacts: 18 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_47.pdbqt + 27 30 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.9360 -8.8010 -18.8870 C.3 1 UNL1 0.0930 + 2 C -27.6640 -7.5750 -19.7310 C.ar 1 UNL1 -0.1990 + 3 C -28.5740 -6.4860 -20.0080 C.ar 1 UNL1 -0.0570 + 4 C -29.8950 -6.2690 -19.5900 C.2 1 UNL1 0.0210 + 5 C -27.9240 -5.5760 -20.7950 C.ar 1 UNL1 -0.0420 + 6 C -30.5400 -5.0870 -20.0130 C.2 1 UNL1 -0.0640 + 7 C -29.8620 -4.1530 -20.8300 C.2 1 UNL1 -0.0370 + 8 C -28.5300 -4.3930 -21.2300 C.2 1 UNL1 -0.0300 + 9 N -26.6450 -6.0200 -21.0320 N.ar 1 UNL1 -0.2230 + 10 CA -26.4530 -7.2450 -20.3650 C.ar 1 UNL1 -0.0140 + 11 H -25.9170 -5.5570 -21.5570 H 1 UNL1 0.2970 + 12 C -25.1410 -7.9640 -20.3970 C.2 1 UNL1 0.9180 + 13 OXT -24.8670 -8.5360 -21.4400 O.co2 1 UNL1 -0.8120 + 14 O -24.4000 -7.9900 -19.4280 O.co2 1 UNL1 -0.8120 + 15 C -27.6170 -10.1180 -19.6340 C.3 1 UNL1 -0.0190 + 16 C -28.8060 -10.6680 -20.4610 C.3 1 UNL1 0.2750 + 17 O -29.9200 -9.7470 -20.3900 O.2 1 UNL1 -0.3530 + 18 C -31.1550 -10.1240 -19.9050 C.2 1 UNL1 0.1180 + 19 C -32.2550 -10.1370 -20.7760 C.2 1 UNL1 -0.0080 + 20 C -33.5340 -10.4770 -20.2960 C.2 1 UNL1 -0.0380 + 21 C -33.7370 -10.8010 -18.9430 C.2 1 UNL1 0.3580 + 22 N -34.9760 -11.1010 -18.5030 N.2 1 UNL1 -0.6790 + 23 C -32.6200 -10.7940 -18.0770 C.2 1 UNL1 -0.1170 + 24 C -35.1430 -11.3910 -17.1990 C.2 1 UNL1 0.3890 + 25 C -34.0880 -11.3970 -16.2730 C.2 1 UNL1 -0.1390 + 26 C -32.7920 -11.0910 -16.7160 C.2 1 UNL1 0.1450 + 27 C -31.3400 -10.4780 -18.5600 C.2 1 UNL1 0.0340 +@BOND + 1 11 9 1 + 2 13 12 ar + 3 8 7 2 + 4 8 5 1 + 5 9 5 ar + 6 9 10 ar + 7 7 6 1 + 8 5 3 ar + 9 19 20 1 + 10 19 18 2 + 11 16 17 1 + 12 16 15 1 + 13 12 10 1 + 14 12 14 ar + 15 17 18 1 + 16 10 2 ar + 17 20 21 2 + 18 6 4 2 + 19 3 2 ar + 20 3 4 1 + 21 18 27 1 + 22 2 1 1 + 23 15 1 1 + 24 21 22 1 + 25 21 23 1 + 26 27 23 2 + 27 22 24 2 + 28 23 26 1 + 29 24 25 1 + 30 26 25 2 +########## Name: lig_48 +########## Vina_BE: -9.009 +########## MW: 318.241 +########## clogP: 1.356 +########## nonHatoms: 27 +########## Vina_LE: -0.334 +########## Vina_LipE: -10.365 +########## Close_contacts: 1 +########## Hydrophob_contacts: 21 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_48.pdbqt + 27 30 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -28.0220 -9.2400 -18.9930 C.3 1 UNL1 0.1070 + 2 C -27.7450 -7.9090 -19.6430 C.ar 1 UNL1 -0.1800 + 3 C -28.5830 -6.7570 -19.8910 C.ar 1 UNL1 -0.0710 + 4 C -29.9310 -6.5430 -19.5770 C.2 1 UNL1 0.0260 + 5 C -27.8400 -5.7910 -20.5400 C.ar 1 UNL1 -0.0400 + 6 C -30.5120 -5.3110 -19.9420 C.2 1 UNL1 -0.0710 + 7 C -29.7480 -4.3240 -20.6060 C.2 1 UNL1 -0.0360 + 8 C -28.3920 -4.5590 -20.9140 C.2 1 UNL1 -0.0330 + 9 N -26.5460 -6.2320 -20.7440 N.ar 1 UNL1 -0.2150 + 10 CA -26.4640 -7.5220 -20.2120 C.ar 1 UNL1 0.0420 + 11 H -25.7750 -5.7620 -21.1950 H 1 UNL1 0.3100 + 12 C -25.1920 -8.3020 -20.2830 C.2 1 UNL1 0.8440 + 13 O -24.8460 -8.6680 -21.3990 O.co2 1 UNL1 -0.8220 + 14 OXT -24.5510 -8.5680 -19.2790 O.co2 1 UNL1 -0.8220 + 15 C -27.8970 -10.4150 -19.9950 C.3 1 UNL1 -0.0260 + 16 C -29.2180 -10.7760 -20.7140 C.3 1 UNL1 0.2890 + 17 O -30.2480 -9.7970 -20.4590 O.2 1 UNL1 -0.3500 + 18 C -31.5460 -10.0970 -20.1060 C.2 1 UNL1 0.1940 + 19 C -32.5180 -10.0750 -21.1260 C.2 1 UNL1 -0.0790 + 20 C -33.8660 -10.4080 -20.8630 C.2 1 UNL1 0.0210 + 21 C -34.2620 -10.7870 -19.5670 C.2 1 UNL1 -0.0830 + 22 C -33.2830 -10.8210 -18.5680 C.2 1 UNL1 -0.0070 + 23 N -33.4600 -11.1610 -17.2390 N.pl3 1 UNL1 -0.2530 + 24 C -31.9570 -10.4900 -18.8150 C.2 1 UNL1 -0.1320 + 25 C -32.1900 -11.0030 -16.6990 C.2 1 UNL1 0.0400 + 26 C -31.2670 -10.6150 -17.6220 C.2 1 UNL1 0.0740 + 27 H -34.3180 -11.3800 -16.7620 H 1 UNL1 0.2770 +@BOND + 1 13 12 ar + 2 11 9 1 + 3 19 20 1 + 4 19 18 2 + 5 8 7 2 + 6 8 5 1 + 7 20 21 2 + 8 9 5 ar + 9 9 10 ar + 10 16 17 1 + 11 16 15 1 + 12 7 6 1 + 13 5 3 ar + 14 17 18 1 + 15 12 10 1 + 16 12 14 ar + 17 10 2 ar + 18 18 24 1 + 19 15 1 1 + 20 6 4 2 + 21 3 2 ar + 22 3 4 1 + 23 2 1 1 + 24 21 22 1 + 25 24 22 2 + 26 24 26 1 + 27 22 23 1 + 28 26 25 2 + 29 23 27 1 + 30 23 25 1 +########## Name: lig_49 +########## Vina_BE: -8.875 +########## MW: 362.122 +########## clogP: 3.003 +########## nonHatoms: 26 +########## Vina_LE: -0.341 +########## Vina_LipE: -11.878 +########## Close_contacts: 1 +########## Hydrophob_contacts: 18 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_49.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -31.1150 -10.1290 -19.7050 C.ar 1 UNL1 -0.1740 + 2 CA -30.0840 -10.0690 -18.6830 C.ar 1 UNL1 0.0510 + 3 N -30.6260 -10.3590 -17.4310 N.ar 1 UNL1 -0.2090 + 4 C -31.9630 -10.6390 -17.6250 C.ar 1 UNL1 -0.0400 + 5 C -32.8860 -11.0170 -16.6420 C.2 1 UNL1 -0.0230 + 6 C -34.2050 -11.2900 -17.0460 C.2 1 UNL1 -0.0280 + 7 C -34.5660 -11.1850 -18.4060 C.2 1 UNL1 -0.0470 + 8 C -33.6210 -10.8040 -19.3820 C.2 1 UNL1 0.0560 + 9 CL -34.1370 -10.7270 -21.0550 Cl 1 UNL1 -0.1430 + 10 C -32.3040 -10.5250 -18.9620 C.ar 1 UNL1 -0.0600 + 11 H -30.0830 -10.3820 -16.5810 H 1 UNL1 0.3140 + 12 C -28.6310 -9.7690 -18.8280 C.2 1 UNL1 0.8390 + 13 O -28.2340 -8.7580 -18.2630 O.co2 1 UNL1 -0.8100 + 14 OXT -27.8930 -10.5140 -19.4500 O.co2 1 UNL1 -0.8100 + 15 C -30.8540 -9.8380 -21.1640 C.3 1 UNL1 0.1160 + 16 C -30.2980 -8.4090 -21.3800 C.3 1 UNL1 0.0410 + 17 C -31.1480 -7.3170 -20.7030 C.3 1 UNL1 0.2120 + 18 O -30.4050 -6.7640 -19.6020 O.2 1 UNL1 -0.3330 + 19 C -29.6710 -5.6180 -19.7750 C.2 1 UNL1 0.1530 + 20 C -28.2960 -5.6820 -20.0470 C.2 1 UNL1 -0.0300 + 21 C -27.5520 -4.5010 -20.2380 C.2 1 UNL1 -0.0340 + 22 C -26.0630 -4.5870 -20.5400 C.3 1 UNL1 0.0910 + 23 C -28.2080 -3.2530 -20.1550 C.2 1 UNL1 -0.0280 + 24 C -29.5880 -3.1940 -19.8940 C.2 1 UNL1 0.0370 + 25 CL -27.3340 -1.7500 -20.3840 Cl 1 UNL1 -0.1260 + 26 C -30.3190 -4.3790 -19.7090 C.2 1 UNL1 -0.0160 +@BOND + 1 16 15 1 + 2 16 17 1 + 3 15 1 1 + 4 9 8 1 + 5 17 18 1 + 6 22 21 1 + 7 25 23 1 + 8 21 23 2 + 9 21 20 1 + 10 23 24 1 + 11 20 19 2 + 12 24 26 2 + 13 19 26 1 + 14 19 18 1 + 15 1 10 ar + 16 1 2 ar + 17 14 12 ar + 18 8 10 1 + 19 8 7 2 + 20 10 4 ar + 21 12 2 1 + 22 12 13 ar + 23 2 3 ar + 24 7 6 1 + 25 4 3 ar + 26 4 5 1 + 27 3 11 1 + 28 6 5 2 +########## Name: lig_50 +########## Vina_BE: -8.554 +########## MW: 374.133 +########## clogP: 3.158 +########## nonHatoms: 27 +########## Vina_LE: -0.317 +########## Vina_LipE: -11.712 +########## Close_contacts: 0 +########## Hydrophob_contacts: 22 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_50.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.3470 -6.4840 -20.5220 C.ar 1 UNL1 -0.1640 + 2 CA -26.0480 -5.9930 -20.7220 C.ar 1 UNL1 -0.0500 + 3 N -26.0940 -4.5960 -20.5920 N.ar 1 UNL1 -0.2090 + 4 C -27.3920 -4.2140 -20.3480 C.ar 1 UNL1 -0.0360 + 5 C -27.8800 -2.9120 -20.1810 C.2 1 UNL1 -0.0240 + 6 C -29.2620 -2.7540 -19.9660 C.2 1 UNL1 -0.0220 + 7 C -30.1080 -3.8850 -19.9310 C.2 1 UNL1 -0.0480 + 8 C -29.5880 -5.1850 -20.1050 C.2 1 UNL1 0.0590 + 9 CL -30.7030 -6.5360 -20.0830 Cl 1 UNL1 -0.1270 + 10 C -28.1990 -5.3250 -20.3060 C.ar 1 UNL1 -0.0630 + 11 H -25.2810 -4.0070 -20.6960 H 1 UNL1 0.3140 + 12 C -24.7770 -6.7140 -21.0270 C.2 1 UNL1 0.9330 + 13 OXT -24.4730 -6.7740 -22.2100 O.co2 1 UNL1 -0.8180 + 14 O -24.1080 -7.2330 -20.1490 O.co2 1 UNL1 -0.8180 + 15 C -27.7090 -7.9530 -20.5410 C.3 1 UNL1 0.1110 + 16 C -27.4100 -8.6480 -19.1880 C.3 1 UNL1 -0.0170 + 17 C -28.3660 -9.8220 -18.9030 C.3 1 UNL1 0.2780 + 18 O -29.4540 -9.7690 -19.8460 O.2 1 UNL1 -0.3480 + 19 C -30.7210 -10.1330 -19.4620 C.2 1 UNL1 0.1430 + 20 C -30.9970 -10.4980 -18.1360 C.2 1 UNL1 -0.0060 + 21 C -32.3040 -10.8530 -17.7550 C.2 1 UNL1 -0.0430 + 22 C -32.5740 -11.2500 -16.3090 C.3 1 UNL1 0.0850 + 23 C -33.3390 -10.8290 -18.7160 C.2 1 UNL1 -0.0300 + 24 C -33.0650 -10.4450 -20.0470 C.2 1 UNL1 -0.0430 + 25 CL -34.9770 -11.2690 -18.2520 Cl 1 UNL1 -0.1380 + 26 C -31.7520 -10.0940 -20.4090 C.2 1 UNL1 -0.0060 + 27 C -34.1690 -10.3990 -21.0950 C.3 1 UNL1 0.0850 +@BOND + 1 13 12 ar + 2 27 24 1 + 3 12 2 1 + 4 12 14 ar + 5 2 3 ar + 6 2 1 ar + 7 11 3 1 + 8 3 4 ar + 9 15 1 1 + 10 15 16 1 + 11 1 10 ar + 12 26 24 1 + 13 26 19 2 + 14 4 10 ar + 15 4 5 1 + 16 10 8 1 + 17 5 6 2 + 18 8 9 1 + 19 8 7 2 + 20 24 23 2 + 21 6 7 1 + 22 18 19 1 + 23 18 17 1 + 24 19 20 1 + 25 16 17 1 + 26 23 25 1 + 27 23 21 1 + 28 20 21 2 + 29 21 22 1 +########## Name: lig_52 +########## Vina_BE: -8.984 +########## MW: 362.122 +########## clogP: 1.35 +########## nonHatoms: 26 +########## Vina_LE: -0.346 +########## Vina_LipE: -10.334 +########## Close_contacts: 1 +########## Hydrophob_contacts: 22 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_52.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.8800 -8.1450 -19.7640 C.ar 1 UNL1 -0.1740 + 2 CA -26.5200 -7.7820 -20.1160 C.ar 1 UNL1 0.0510 + 3 N -26.4580 -6.4350 -20.4870 N.ar 1 UNL1 -0.2090 + 4 C -27.7310 -5.9170 -20.3340 C.ar 1 UNL1 -0.0400 + 5 C -28.1440 -4.5940 -20.5280 C.2 1 UNL1 -0.0230 + 6 C -29.4960 -4.2820 -20.2740 C.2 1 UNL1 -0.1420 + 7 CL -30.0650 -2.6420 -20.4930 Cl 1 UNL1 -0.1430 + 8 C -30.3910 -5.2810 -19.8350 C.2 1 UNL1 -0.0570 + 9 C -29.9480 -6.6070 -19.6480 C.2 1 UNL1 0.1800 + 10 C -28.6030 -6.8990 -19.9090 C.ar 1 UNL1 -0.0600 + 11 H -25.6070 -5.9620 -20.7530 H 1 UNL1 0.3140 + 12 C -25.2930 -8.6300 -20.0900 C.2 1 UNL1 0.8390 + 13 OXT -24.5070 -8.5570 -19.1600 O.co2 1 UNL1 -0.8100 + 14 O -25.1230 -9.3650 -21.0510 O.co2 1 UNL1 -0.8100 + 15 C -28.3020 -9.4960 -19.2420 C.3 1 UNL1 0.1160 + 16 C -28.2490 -10.5900 -20.3340 C.3 1 UNL1 0.0410 + 17 C -29.6130 -10.8380 -21.0100 C.3 1 UNL1 0.2120 + 18 O -30.5470 -9.8530 -20.5280 O.2 1 UNL1 -0.3330 + 19 C -31.7100 -10.1730 -19.8630 C.2 1 UNL1 0.1530 + 20 C -31.6020 -10.5470 -18.5160 C.2 1 UNL1 -0.0300 + 21 C -32.7410 -10.9120 -17.7750 C.2 1 UNL1 -0.0340 + 22 C -32.5970 -11.3190 -16.3170 C.3 1 UNL1 0.0910 + 23 C -34.0030 -10.9000 -18.4050 C.2 1 UNL1 -0.0280 + 24 C -34.1150 -10.5360 -19.7570 C.2 1 UNL1 0.0370 + 25 CL -35.4590 -11.3440 -17.5330 Cl 1 UNL1 -0.1260 + 26 C -32.9720 -10.1740 -20.4880 C.2 1 UNL1 -0.0160 +@BOND + 1 14 12 ar + 2 17 18 1 + 3 17 16 1 + 4 11 3 1 + 5 18 19 1 + 6 5 4 2 + 7 5 6 1 + 8 7 6 1 + 9 26 19 2 + 10 26 24 1 + 11 3 4 ar + 12 3 2 ar + 13 4 10 ar + 14 16 15 1 + 15 6 8 2 + 16 2 12 1 + 17 2 1 ar + 18 12 13 ar + 19 10 1 ar + 20 10 9 2 + 21 19 20 1 + 22 8 9 1 + 23 1 15 1 + 24 24 23 2 + 25 20 21 2 + 26 23 21 1 + 27 23 25 1 + 28 21 22 1 +########## Name: lig_53 +########## Vina_BE: -8.87 +########## MW: 374.133 +########## clogP: 1.505 +########## nonHatoms: 27 +########## Vina_LE: -0.329 +########## Vina_LipE: -10.375 +########## Close_contacts: 1 +########## Hydrophob_contacts: 21 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_53.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.4390 -7.5610 -19.6920 C.ar 1 UNL1 -0.1640 + 2 CA -26.2270 -7.2510 -20.3250 C.ar 1 UNL1 -0.0500 + 3 N -26.3790 -6.0000 -20.9510 N.ar 1 UNL1 -0.2090 + 4 C -27.6600 -5.5440 -20.7260 C.ar 1 UNL1 -0.0360 + 5 C -28.2550 -4.3560 -21.1690 C.2 1 UNL1 -0.0240 + 6 C -29.5970 -4.1240 -20.8070 C.2 1 UNL1 -0.1370 + 7 CL -30.3980 -2.6580 -21.3300 Cl 1 UNL1 -0.1270 + 8 C -30.3020 -5.0670 -20.0250 C.2 1 UNL1 -0.0580 + 9 C -29.6710 -6.2550 -19.5960 C.2 1 UNL1 0.1840 + 10 C -28.3350 -6.4630 -19.9680 C.ar 1 UNL1 -0.0630 + 11 H -25.6460 -5.5510 -21.4800 H 1 UNL1 0.3140 + 12 C -24.9610 -8.0390 -20.3870 C.2 1 UNL1 0.9330 + 13 O -24.1990 -8.0880 -19.4330 O.co2 1 UNL1 -0.8180 + 14 OXT -24.7500 -8.6320 -21.4350 O.co2 1 UNL1 -0.8180 + 15 C -27.7070 -8.8250 -18.9140 C.3 1 UNL1 0.1110 + 16 C -27.3680 -10.0970 -19.7320 C.3 1 UNL1 -0.0170 + 17 C -28.5970 -10.6780 -20.4580 C.3 1 UNL1 0.2780 + 18 O -29.6610 -9.7050 -20.4200 O.2 1 UNL1 -0.3480 + 19 C -30.8970 -10.0510 -19.9310 C.2 1 UNL1 0.1430 + 20 C -32.0150 -10.1310 -20.7760 C.2 1 UNL1 -0.0060 + 21 C -33.2700 -10.5020 -20.2600 C.2 1 UNL1 -0.0430 + 22 C -34.4670 -10.5720 -21.1980 C.3 1 UNL1 0.0850 + 23 C -33.3940 -10.8070 -18.8860 C.2 1 UNL1 -0.0300 + 24 C -32.2660 -10.7460 -18.0380 C.2 1 UNL1 -0.0430 + 25 CL -34.9560 -11.2760 -18.2300 Cl 1 UNL1 -0.1380 + 26 C -31.0200 -10.3710 -18.5740 C.2 1 UNL1 -0.0060 + 27 C -32.3770 -11.0810 -16.5580 C.3 1 UNL1 0.0850 +@BOND + 1 11 3 1 + 2 14 12 ar + 3 7 6 1 + 4 22 21 1 + 5 5 6 1 + 6 5 4 2 + 7 3 4 ar + 8 3 2 ar + 9 6 8 2 + 10 20 21 1 + 11 20 19 2 + 12 4 10 ar + 13 17 18 1 + 14 17 16 1 + 15 18 19 1 + 16 12 2 1 + 17 12 13 ar + 18 2 1 ar + 19 21 23 2 + 20 8 9 1 + 21 10 1 ar + 22 10 9 2 + 23 19 26 1 + 24 16 15 1 + 25 1 15 1 + 26 23 25 1 + 27 23 24 1 + 28 26 24 2 + 29 24 27 1 +########## Name: lig_56 +########## Vina_BE: -8.912 +########## MW: 349.683 +########## clogP: 0.609 +########## nonHatoms: 26 +########## Vina_LE: -0.343 +########## Vina_LipE: -9.521 +########## Close_contacts: 0 +########## Hydrophob_contacts: 24 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_56.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.4440 -7.3280 -19.8620 C.ar 1 UNL1 -0.1970 + 2 C -26.3050 -6.8400 -20.6300 C.ar 1 UNL1 0.0660 + 3 N -26.6260 -5.5940 -21.2150 N.ar 1 UNL1 -0.0970 + 4 C -25.7860 -4.7730 -22.1000 C.3 1 UNL1 0.1750 + 5 C -27.9150 -5.2780 -20.7970 C.ar 1 UNL1 -0.0460 + 6 C -28.6620 -4.1190 -21.0720 C.2 1 UNL1 -0.0230 + 7 C -29.9500 -4.0070 -20.5130 C.2 1 UNL1 -0.0410 + 8 C -30.4680 -5.0340 -19.6940 C.2 1 UNL1 -0.0640 + 9 C -29.7010 -6.1860 -19.4290 C.2 1 UNL1 0.0090 + 10 C -28.4260 -6.2810 -19.9990 C.ar 1 UNL1 -0.0690 + 11 C -24.9750 -7.5240 -20.7840 C.2 1 UNL1 0.8400 + 12 O -24.1290 -7.4270 -19.9100 O.co2 1 UNL1 -0.8120 + 13 O -24.7470 -8.1520 -21.8090 O.co2 1 UNL1 -0.8120 + 14 C -27.4890 -8.6230 -19.0870 C.3 1 UNL1 0.0980 + 15 C -27.2290 -9.8550 -19.9840 C.3 1 UNL1 0.0270 + 16 C -28.5120 -10.6300 -20.3460 C.3 1 UNL1 0.2560 + 17 O -29.6230 -9.7120 -20.3310 O.2 1 UNL1 -0.3370 + 18 C -30.8710 -10.0740 -19.8800 C.2 1 UNL1 0.1610 + 19 C -31.0150 -10.3650 -18.5180 C.2 1 UNL1 -0.0360 + 20 C -32.2630 -10.7410 -17.9920 C.2 1 UNL1 -0.0350 + 21 C -32.3840 -11.0700 -16.5110 C.3 1 UNL1 0.0850 + 22 C -33.3830 -10.8100 -18.8490 C.2 1 UNL1 -0.0350 + 23 C -33.2480 -10.5090 -20.2220 C.2 1 UNL1 -0.0350 + 24 CL -34.9530 -11.2670 -18.2020 Cl 1 UNL1 -0.1280 + 25 C -31.9870 -10.1440 -20.7310 C.2 1 UNL1 -0.0360 + 26 C -34.4450 -10.5760 -21.1610 C.3 1 UNL1 0.0850 +@BOND + 1 4 3 1 + 2 13 11 ar + 3 3 5 ar + 4 3 2 ar + 5 26 23 1 + 6 6 5 2 + 7 6 7 1 + 8 5 10 ar + 9 11 2 1 + 10 11 12 ar + 11 25 23 1 + 12 25 18 2 + 13 2 1 ar + 14 7 8 2 + 15 16 17 1 + 16 16 15 1 + 17 17 18 1 + 18 23 22 2 + 19 10 1 ar + 20 10 9 2 + 21 15 14 1 + 22 18 19 1 + 23 1 14 1 + 24 8 9 1 + 25 22 24 1 + 26 22 20 1 + 27 19 20 2 + 28 20 21 1 +########## Name: lig_58 +########## Vina_BE: -8.97 +########## MW: 385.136 +########## clogP: 1.372 +########## nonHatoms: 27 +########## Vina_LE: -0.332 +########## Vina_LipE: -10.342 +########## Close_contacts: 1 +########## Hydrophob_contacts: 19 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_58.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.4980 -7.6150 -19.6120 C.ar 1 UNL1 -0.1800 + 2 C -26.2530 -7.2730 -20.2890 C.ar 1 UNL1 0.0600 + 3 N -26.3770 -6.0040 -20.8970 N.ar 1 UNL1 -0.0930 + 4 C -25.3590 -5.2730 -21.6670 C.3 1 UNL1 0.1810 + 5 C -27.6690 -5.5590 -20.6310 C.ar 1 UNL1 -0.0420 + 6 C -28.2790 -4.3600 -21.0390 C.2 1 UNL1 0.0010 + 7 C -29.6140 -4.1290 -20.6520 C.2 1 UNL1 0.0120 + 8 CL -30.4120 -2.6480 -21.1390 Cl 1 UNL1 -0.1500 + 9 C -30.3140 -5.0780 -19.8800 C.2 1 UNL1 -0.0410 + 10 C -29.6850 -6.2760 -19.4840 C.2 1 UNL1 0.0370 + 11 C -28.3560 -6.4870 -19.8760 C.ar 1 UNL1 -0.0650 + 12 C -25.0130 -8.1210 -20.3580 C.2 1 UNL1 0.8390 + 13 O -24.7660 -8.7260 -21.3890 O.co2 1 UNL1 -0.8140 + 14 O -24.2690 -8.2090 -19.3920 O.co2 1 UNL1 -0.8140 + 15 C -27.7540 -8.9000 -18.8660 C.3 1 UNL1 0.1100 + 16 C -27.3990 -10.1470 -19.7140 C.3 1 UNL1 -0.0230 + 17 C -28.6280 -10.7570 -20.4170 C.3 1 UNL1 0.2740 + 18 O -29.6930 -9.7850 -20.4260 O.2 1 UNL1 -0.3490 + 19 C -30.9300 -10.1050 -19.9240 C.2 1 UNL1 0.1360 + 20 C -32.0550 -10.1930 -20.7590 C.2 1 UNL1 -0.0030 + 21 C -33.3100 -10.5370 -20.2280 C.2 1 UNL1 -0.0420 + 22 C -34.5140 -10.6160 -21.1560 C.3 1 UNL1 0.0890 + 23 C -33.4300 -10.8070 -18.8470 C.2 1 UNL1 -0.0280 + 24 C -32.2970 -10.7370 -18.0060 C.2 1 UNL1 -0.0420 + 25 CL -34.9940 -11.2390 -18.1700 Cl 1 UNL1 -0.1370 + 26 C -31.0500 -10.3900 -18.5580 C.2 1 UNL1 -0.0030 + 27 C -32.4020 -11.0350 -16.5170 C.3 1 UNL1 0.0890 +@BOND + 1 4 3 1 + 2 13 12 ar + 3 22 21 1 + 4 8 7 1 + 5 6 7 1 + 6 6 5 2 + 7 3 5 ar + 8 3 2 ar + 9 20 21 1 + 10 20 19 2 + 11 7 9 2 + 12 5 11 ar + 13 18 17 1 + 14 18 19 1 + 15 17 16 1 + 16 12 2 1 + 17 12 14 ar + 18 2 1 ar + 19 21 23 2 + 20 19 26 1 + 21 9 10 1 + 22 11 1 ar + 23 11 10 2 + 24 16 15 1 + 25 1 15 1 + 26 23 25 1 + 27 23 24 1 + 28 26 24 2 + 29 24 27 1 +########## Name: lig_60 +########## Vina_BE: -8.841 +########## MW: 355.73 +########## clogP: 1.475 +########## nonHatoms: 25 +########## Vina_LE: -0.354 +########## Vina_LipE: -10.316 +########## Close_contacts: 1 +########## Hydrophob_contacts: 24 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_60.pdbqt + 25 27 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.7310 -8.6350 -18.8780 C.3 1 UNL1 0.0980 + 2 C -27.4840 -7.4250 -19.7550 C.ar 1 UNL1 -0.1170 + 3 C -26.2700 -7.1760 -20.4110 C.ar 1 UNL1 -0.0730 + 4 S -26.2920 -5.6850 -21.3920 S.2 1 UNL1 0.0590 + 5 C -27.9460 -5.3740 -20.8600 C.ar 1 UNL1 -0.1180 + 6 C -28.7180 -4.2580 -21.2150 C.2 1 UNL1 0.0270 + 7 C -28.4370 -6.3570 -20.0210 C.ar 1 UNL1 -0.0690 + 8 C -30.0190 -4.1380 -20.6940 C.2 1 UNL1 -0.0420 + 9 C -30.5270 -5.1330 -19.8360 C.2 1 UNL1 -0.0390 + 10 C -29.7370 -6.2480 -19.4980 C.2 1 UNL1 0.0130 + 11 C -25.0220 -7.9910 -20.3680 C.2 1 UNL1 0.9090 + 12 O -24.2900 -7.9690 -19.3920 O.co2 1 UNL1 -0.8140 + 13 O -24.7470 -8.6500 -21.3580 O.co2 1 UNL1 -0.8140 + 14 C -27.3630 -9.9650 -19.5780 C.3 1 UNL1 0.0340 + 15 C -28.5350 -10.5880 -20.3630 C.3 1 UNL1 0.2510 + 16 O -29.6510 -9.6790 -20.3070 O.2 1 UNL1 -0.3350 + 17 C -30.8940 -10.0590 -19.8580 C.2 1 UNL1 0.1600 + 18 C -31.0310 -10.3620 -18.4990 C.2 1 UNL1 -0.0360 + 19 C -32.2710 -10.7660 -17.9730 C.2 1 UNL1 -0.0340 + 20 C -32.3820 -11.1120 -16.4950 C.3 1 UNL1 0.0860 + 21 C -33.3910 -10.8480 -18.8290 C.2 1 UNL1 -0.0340 + 22 C -33.2620 -10.5320 -20.1990 C.2 1 UNL1 -0.0340 + 23 CL -34.9500 -11.3430 -18.1850 Cl 1 UNL1 -0.1270 + 24 C -32.0110 -10.1400 -20.7080 C.2 1 UNL1 -0.0360 + 25 C -34.4600 -10.6130 -21.1380 C.3 1 UNL1 0.0860 +@BOND + 1 4 5 ar + 2 4 3 ar + 3 13 11 ar + 4 6 5 2 + 5 6 8 1 + 6 25 22 1 + 7 5 7 ar + 8 24 22 1 + 9 24 17 2 + 10 8 9 2 + 11 3 11 1 + 12 3 2 ar + 13 11 12 ar + 14 15 16 1 + 15 15 14 1 + 16 16 17 1 + 17 22 21 2 + 18 7 2 ar + 19 7 10 2 + 20 17 18 1 + 21 9 10 1 + 22 2 1 1 + 23 14 1 1 + 24 21 23 1 + 25 21 19 1 + 26 18 19 2 + 27 19 20 1 +########## Name: lig_61 +########## Vina_BE: -8.661 +########## MW: 391.183 +########## clogP: 3.892 +########## nonHatoms: 26 +########## Vina_LE: -0.333 +########## Vina_LipE: -12.553 +########## Close_contacts: 0 +########## Hydrophob_contacts: 20 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_61.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.3570 -6.4030 -20.4750 C.ar 1 UNL1 -0.1210 + 2 C -26.0290 -5.9950 -20.6750 C.ar 1 UNL1 -0.3280 + 3 S -25.7820 -4.2470 -20.5270 S.2 1 UNL1 0.2480 + 4 C -27.5150 -4.0470 -20.2700 C.ar 1 UNL1 -0.0670 + 5 C -28.1370 -2.8020 -20.0950 C.2 1 UNL1 0.0330 + 6 C -29.5300 -2.7530 -19.9340 C.2 1 UNL1 -0.0310 + 7 C -30.2750 -3.9440 -19.9680 C.2 1 UNL1 -0.0180 + 8 C -29.6400 -5.1890 -20.1460 C.2 1 UNL1 0.0490 + 9 CL -30.7000 -6.5840 -20.2250 Cl 1 UNL1 -0.1180 + 10 C -28.2290 -5.2380 -20.2820 C.ar 1 UNL1 -0.0270 + 11 C -24.8270 -6.8130 -20.9810 C.2 1 UNL1 0.9220 + 12 O -24.0930 -7.0670 -20.0410 O.co2 1 UNL1 -0.8090 + 13 O -24.5750 -7.1780 -22.1160 O.co2 1 UNL1 -0.8090 + 14 C -27.7290 -7.8700 -20.4390 C.3 1 UNL1 0.1020 + 15 C -27.6310 -8.4660 -19.0130 C.3 1 UNL1 -0.0120 + 16 C -28.3880 -9.8010 -18.8800 C.3 1 UNL1 0.2760 + 17 O -29.4450 -9.8410 -19.8620 O.2 1 UNL1 -0.3520 + 18 C -30.7300 -10.1510 -19.4880 C.2 1 UNL1 0.1360 + 19 C -31.7800 -10.1420 -20.4200 C.2 1 UNL1 -0.0060 + 20 C -33.0860 -10.4770 -20.0200 C.2 1 UNL1 -0.0400 + 21 C -34.2080 -10.4510 -21.0490 C.3 1 UNL1 0.0910 + 22 C -33.3320 -10.8350 -18.6760 C.2 1 UNL1 -0.0280 + 23 C -32.2720 -10.8630 -17.7430 C.2 1 UNL1 -0.0400 + 24 CL -34.9600 -11.2570 -18.1640 Cl 1 UNL1 -0.1390 + 25 C -30.9730 -10.5230 -18.1610 C.2 1 UNL1 -0.0060 + 26 C -32.5140 -11.2570 -16.2910 C.3 1 UNL1 0.0910 +@BOND + 1 13 11 ar + 2 21 20 1 + 3 11 2 1 + 4 11 12 ar + 5 2 3 ar + 6 2 1 ar + 7 3 4 ar + 8 1 14 1 + 9 1 10 ar + 10 14 15 1 + 11 19 20 1 + 12 19 18 2 + 13 10 4 ar + 14 10 8 1 + 15 4 5 1 + 16 9 8 1 + 17 8 7 2 + 18 5 6 2 + 19 20 22 2 + 20 7 6 1 + 21 17 18 1 + 22 17 16 1 + 23 18 25 1 + 24 15 16 1 + 25 22 24 1 + 26 22 23 1 + 27 25 23 2 + 28 23 26 1 +########## Name: lig_63 +########## Vina_BE: -8.81 +########## MW: 391.183 +########## clogP: 2.239 +########## nonHatoms: 26 +########## Vina_LE: -0.339 +########## Vina_LipE: -11.049 +########## Close_contacts: 1 +########## Hydrophob_contacts: 19 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_63.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.4490 -7.6020 -19.6860 C.ar 1 UNL1 -0.1210 + 2 C -26.1710 -7.4770 -20.2440 C.ar 1 UNL1 -0.3280 + 3 S -25.9250 -5.9660 -21.1460 S.2 1 UNL1 0.2480 + 4 C -27.5970 -5.5120 -20.8010 C.ar 1 UNL1 -0.0670 + 5 C -28.2320 -4.3380 -21.2370 C.2 1 UNL1 0.0330 + 6 C -29.5790 -4.1270 -20.8910 C.2 1 UNL1 -0.1500 + 7 CL -30.4010 -2.6750 -21.4220 Cl 1 UNL1 -0.1180 + 8 C -30.2700 -5.0840 -20.1230 C.2 1 UNL1 -0.0270 + 9 C -29.6150 -6.2540 -19.6940 C.2 1 UNL1 0.1770 + 10 C -28.2670 -6.4530 -20.0400 C.ar 1 UNL1 -0.0270 + 11 C -25.0380 -8.4330 -20.1800 C.2 1 UNL1 0.9220 + 12 O -24.3440 -8.3860 -19.1790 O.co2 1 UNL1 -0.8090 + 13 O -24.8130 -9.2000 -21.0990 O.co2 1 UNL1 -0.8090 + 14 C -27.8740 -8.7860 -18.8500 C.3 1 UNL1 0.1020 + 15 C -27.4970 -10.1240 -19.5250 C.3 1 UNL1 -0.0120 + 16 C -28.6510 -10.6940 -20.3700 C.3 1 UNL1 0.2760 + 17 O -29.7270 -9.7370 -20.3870 O.2 1 UNL1 -0.3520 + 18 C -30.9560 -10.0940 -19.8950 C.2 1 UNL1 0.1360 + 19 C -31.0820 -10.4020 -18.5370 C.2 1 UNL1 -0.0060 + 20 C -32.3310 -10.7690 -18.0030 C.2 1 UNL1 -0.0400 + 21 C -32.4440 -11.1130 -16.5240 C.3 1 UNL1 0.0910 + 22 C -33.4600 -10.8140 -18.8510 C.2 1 UNL1 -0.0280 + 23 C -33.3360 -10.4970 -20.2210 C.2 1 UNL1 -0.0400 + 24 CL -35.0280 -11.2680 -18.1960 Cl 1 UNL1 -0.1390 + 25 C -32.0760 -10.1360 -20.7360 C.2 1 UNL1 -0.0060 + 26 C -34.5410 -10.5390 -21.1500 C.3 1 UNL1 0.0910 +@BOND + 1 7 6 1 + 2 5 6 1 + 3 5 4 2 + 4 26 23 1 + 5 3 4 ar + 6 3 2 ar + 7 13 11 ar + 8 6 8 2 + 9 4 10 ar + 10 25 23 1 + 11 25 18 2 + 12 17 16 1 + 13 17 18 1 + 14 16 15 1 + 15 2 11 1 + 16 2 1 ar + 17 23 22 2 + 18 11 12 ar + 19 8 9 1 + 20 10 9 2 + 21 10 1 ar + 22 18 19 1 + 23 1 14 1 + 24 15 14 1 + 25 22 24 1 + 26 22 20 1 + 27 19 20 2 + 28 20 21 1 +########## Name: lig_65 +########## Vina_BE: -8.785 +########## MW: 391.183 +########## clogP: 2.165 +########## nonHatoms: 26 +########## Vina_LE: -0.338 +########## Vina_LipE: -10.95 +########## Close_contacts: 1 +########## Hydrophob_contacts: 23 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_65.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.2360 -7.2650 -19.9270 C.ar 1 UNL1 -0.1210 + 2 C -26.0820 -6.8010 -20.5700 C.ar 1 UNL1 -0.3280 + 3 S -26.2360 -5.1500 -21.2140 S.2 1 UNL1 0.2480 + 4 C -27.9120 -5.1030 -20.6470 C.ar 1 UNL1 -0.0670 + 5 C -28.8140 -4.0380 -20.8140 C.2 1 UNL1 -0.0920 + 6 CL -28.3350 -2.5620 -21.6290 Cl 1 UNL1 -0.1180 + 7 C -30.1230 -4.1680 -20.3180 C.2 1 UNL1 -0.0250 + 8 C -30.5160 -5.3540 -19.6690 C.2 1 UNL1 -0.0270 + 9 C -29.6000 -6.4120 -19.5120 C.2 1 UNL1 0.1770 + 10 C -28.2910 -6.2680 -20.0040 C.ar 1 UNL1 -0.0270 + 11 C -24.7920 -7.5060 -20.7750 C.2 1 UNL1 0.9220 + 12 O -24.5530 -7.8870 -21.9070 O.co2 1 UNL1 -0.8090 + 13 O -24.0330 -7.7050 -19.8420 O.co2 1 UNL1 -0.8090 + 14 C -27.3290 -8.6230 -19.2750 C.3 1 UNL1 0.1020 + 15 C -27.2780 -9.7610 -20.3190 C.3 1 UNL1 -0.0120 + 16 C -28.5530 -10.6240 -20.3030 C.3 1 UNL1 0.2760 + 17 O -29.6930 -9.7660 -20.5050 O.2 1 UNL1 -0.3520 + 18 C -30.9100 -10.0900 -19.9600 C.2 1 UNL1 0.1360 + 19 C -32.0210 -10.1860 -20.8050 C.2 1 UNL1 -0.0060 + 20 C -33.2840 -10.5260 -20.2870 C.2 1 UNL1 -0.0400 + 21 C -34.4820 -10.6100 -21.2230 C.3 1 UNL1 0.0910 + 22 C -33.4210 -10.7780 -18.9040 C.2 1 UNL1 -0.0280 + 23 C -32.2990 -10.6910 -18.0500 C.2 1 UNL1 -0.0400 + 24 CL -34.9930 -11.2070 -18.2430 Cl 1 UNL1 -0.1390 + 25 C -31.0450 -10.3460 -18.5880 C.2 1 UNL1 -0.0060 + 26 C -32.4250 -10.9630 -16.5570 C.3 1 UNL1 0.0910 +@BOND + 1 12 11 ar + 2 6 5 1 + 3 21 20 1 + 4 3 4 ar + 5 3 2 ar + 6 5 4 2 + 7 5 7 1 + 8 19 20 1 + 9 19 18 2 + 10 11 2 1 + 11 11 13 ar + 12 4 10 ar + 13 2 1 ar + 14 17 16 1 + 15 17 18 1 + 16 15 16 1 + 17 15 14 1 + 18 7 8 2 + 19 20 22 2 + 20 10 1 ar + 21 10 9 2 + 22 18 25 1 + 23 1 14 1 + 24 8 9 1 + 25 22 24 1 + 26 22 23 1 + 27 25 23 2 + 28 23 26 1 +########## Name: lig_67 +########## Vina_BE: -8.757 +########## MW: 339.665 +########## clogP: 1.007 +########## nonHatoms: 25 +########## Vina_LE: -0.35 +########## Vina_LipE: -9.764 +########## Close_contacts: 0 +########## Hydrophob_contacts: 25 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_67.pdbqt + 25 27 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.7550 -8.8910 -19.0150 C.3 1 UNL1 0.0980 + 2 C -27.6230 -7.5460 -19.6830 C.ar 1 UNL1 -0.2120 + 3 C -26.4120 -7.0380 -20.3090 C.ar 1 UNL1 0.0090 + 4 O -26.6150 -5.7840 -20.8520 O.2 1 UNL1 0.0590 + 5 C -27.9280 -5.4700 -20.6030 C.ar 1 UNL1 -0.1550 + 6 C -28.6040 -4.2980 -20.9700 C.2 1 UNL1 0.0130 + 7 C -28.5670 -6.4810 -19.9150 C.ar 1 UNL1 -0.0580 + 8 C -29.9640 -4.1760 -20.6180 C.2 1 UNL1 -0.0330 + 9 C -30.6180 -5.2130 -19.9150 C.2 1 UNL1 -0.0480 + 10 C -29.9180 -6.3830 -19.5560 C.2 1 UNL1 0.0180 + 11 C -25.0710 -7.6720 -20.4340 C.2 1 UNL1 0.9360 + 12 O -24.3520 -7.7940 -19.4530 O.co2 1 UNL1 -0.7970 + 13 O -24.7300 -8.0730 -21.5360 O.co2 1 UNL1 -0.7970 + 14 C -27.3870 -10.0540 -19.9710 C.3 1 UNL1 -0.0200 + 15 C -28.6240 -10.8240 -20.4700 C.3 1 UNL1 0.2790 + 16 O -29.7140 -9.8950 -20.6400 O.2 1 UNL1 -0.3530 + 17 C -30.9430 -10.1620 -20.0910 C.2 1 UNL1 0.1350 + 18 C -32.0960 -10.2170 -20.8910 C.2 1 UNL1 -0.0070 + 19 C -33.3460 -10.5070 -20.3170 C.2 1 UNL1 -0.0400 + 20 C -34.5800 -10.5540 -21.2070 C.3 1 UNL1 0.0930 + 21 C -33.4330 -10.7550 -18.9290 C.2 1 UNL1 -0.0270 + 22 C -32.2710 -10.7180 -18.1260 C.2 1 UNL1 -0.0400 + 23 CL -34.9890 -11.1210 -18.1980 Cl 1 UNL1 -0.1370 + 24 C -31.0300 -10.4230 -18.7190 C.2 1 UNL1 -0.0070 + 25 C -32.3420 -10.9930 -16.6300 C.3 1 UNL1 0.0930 +@BOND + 1 13 11 ar + 2 20 19 1 + 3 6 8 1 + 4 6 5 2 + 5 18 19 1 + 6 18 17 2 + 7 4 5 ar + 8 4 3 ar + 9 16 15 1 + 10 16 17 1 + 11 8 9 2 + 12 5 7 ar + 13 15 14 1 + 14 11 3 1 + 15 11 12 ar + 16 19 21 2 + 17 3 2 ar + 18 17 24 1 + 19 14 1 1 + 20 9 10 1 + 21 7 2 ar + 22 7 10 2 + 23 2 1 1 + 24 21 23 1 + 25 21 22 1 + 26 24 22 2 + 27 22 25 1 +########## Name: ligand +########## Vina_BE: -12.117 +########## MW: 373.704 +########## clogP: 1.841 +########## nonHatoms: 28 +########## Vina_LE: -0.433 +########## Vina_LipE: -13.958 +########## Close_contacts: 0 +########## Hydrophob_contacts: 27 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +ligand.pdbqt + 28 32 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -32.2140 -11.1630 -16.8070 C.2 1 UNL1 0.0110 + 2 C -33.5460 -11.1630 -17.2700 C.2 1 UNL1 0.0120 + 3 C -33.8490 -10.7220 -18.5720 C.2 1 UNL1 0.0160 + 4 C -26.5850 -7.3010 -20.3250 C.2 1 UNL1 0.0190 + 5 C -25.2610 -7.5910 -19.9330 C.2 1 UNL1 -0.1150 + 6 C -25.0070 -8.7970 -19.2540 C.2 1 UNL1 0.0410 + 7 C -26.0510 -9.6960 -18.9910 C.2 1 UNL1 -0.0250 + 8 C -29.2860 -10.6850 -20.1720 C.3 1 UNL1 0.2580 + 9 C -30.1120 -8.3230 -19.6160 C.3 1 UNL1 0.3010 + 10 C -27.6590 -8.1800 -20.0590 C.2 1 UNL1 0.0750 + 11 C -27.3640 -9.4050 -19.3950 C.2 1 UNL1 0.0310 + 12 C -30.5230 -9.7690 -19.9950 C.3 1 UNL1 -0.0410 + 13 C -32.8940 -9.7760 -20.8090 C.3 1 UNL1 0.0590 + 14 N -28.9760 -7.8240 -20.4170 N.pl3 1 UNL1 -0.6510 + 15 O -28.3000 -10.3960 -19.1660 O.2 1 UNL1 -0.3510 + 16 C -32.7990 -10.2890 -19.3940 C.2 1 UNL1 -0.0810 + 17 C -31.4850 -10.2940 -18.9440 C.2 1 UNL1 -0.0680 + 18 C -31.1710 -10.7230 -17.6450 C.2 1 UNL1 0.0660 + 19 CL -34.8330 -11.7100 -16.2180 Cl 1 UNL1 -0.1220 + 20 C -31.4160 -9.7960 -21.2770 C.3 1 UNL1 0.0350 + 21 C -24.1350 -6.6220 -20.2310 C.2 1 UNL1 0.9090 + 22 O -23.4610 -6.2230 -19.2950 O.co2 1 UNL1 -0.8300 + 23 O -23.9530 -6.2930 -21.3920 O.co2 1 UNL1 -0.8300 + 24 C -29.2910 -6.7130 -21.3410 C.3 1 UNL1 0.3130 + 25 C -30.1660 -5.6170 -20.6990 C.3 1 UNL1 -0.0270 + 26 C -29.7080 -5.0370 -19.3190 C.3 1 UNL1 0.0090 + 27 C -30.4350 -3.7260 -19.7600 C.3 1 UNL1 -0.0210 + 28 C -30.0390 -4.1420 -21.2120 C.3 1 UNL1 0.0090 +@BOND + 1 23 21 ar + 2 24 25 1 + 3 24 14 1 + 4 20 13 1 + 5 20 12 1 + 6 28 25 1 + 7 28 27 1 + 8 13 16 1 + 9 25 26 1 + 10 14 10 1 + 11 14 9 1 + 12 4 10 2 + 13 4 5 1 + 14 21 5 1 + 15 21 22 ar + 16 8 12 1 + 17 8 15 1 + 18 10 11 1 + 19 12 9 1 + 20 12 17 1 + 21 5 6 2 + 22 27 26 1 + 23 11 15 1 + 24 11 7 2 + 25 16 17 2 + 26 16 3 1 + 27 6 7 1 + 28 17 18 1 + 29 3 2 2 + 30 18 1 2 + 31 2 1 1 + 32 2 19 1 diff --git a/docking_mcl1/MTH_Results_all/VinaResults_AFv6_MCL1_171-321_wt_H.mol2 b/docking_mcl1/MTH_Results_all/VinaResults_AFv6_MCL1_171-321_wt_H.mol2 new file mode 100644 index 0000000..ed772d0 --- /dev/null +++ b/docking_mcl1/MTH_Results_all/VinaResults_AFv6_MCL1_171-321_wt_H.mol2 @@ -0,0 +1,2000 @@ +########## Name: lig_27 +########## Vina_BE: -6.315 +########## MW: 279.205 +########## clogP: -0.331 +########## nonHatoms: 23 +########## Vina_LE: -0.275 +########## Vina_LipE: -5.984 +########## Close_contacts: 0 +########## Hydrophob_contacts: 20 +########## HBonds: 0 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_27.pdbqt + 23 25 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 CA -24.8320 -7.8920 -22.7570 C.ar 1 UNL1 0.0410 + 2 N -24.8650 -8.5670 -23.9750 N.ar 1 UNL1 -0.2150 + 3 C -26.2100 -8.7120 -24.2480 C.ar 1 UNL1 -0.0400 + 4 C -26.8050 -9.3360 -25.3510 C.2 1 UNL1 -0.0330 + 5 C -28.2140 -9.3650 -25.4050 C.2 1 UNL1 -0.0360 + 6 C -28.9830 -8.7840 -24.3700 C.2 1 UNL1 -0.0710 + 7 C -28.3550 -8.1630 -23.2700 C.2 1 UNL1 0.0250 + 8 C -26.9540 -8.1370 -23.2330 C.ar 1 UNL1 -0.0710 + 9 C -26.0960 -7.6110 -22.2840 C.ar 1 UNL1 -0.1800 + 10 H -24.0540 -8.8750 -24.4900 H 1 UNL1 0.3100 + 11 C -23.5310 -7.5570 -22.0970 C.2 1 UNL1 0.8430 + 12 O -22.9800 -8.4690 -21.4950 O.co2 1 UNL1 -0.8210 + 13 OXT -23.0620 -6.4280 -22.1510 O.co2 1 UNL1 -0.8210 + 14 C -26.4700 -6.8910 -21.0030 C.3 1 UNL1 0.1040 + 15 C -26.4930 -7.8630 -19.7980 C.3 1 UNL1 -0.0260 + 16 C -27.6640 -7.6090 -18.8220 C.3 1 UNL1 0.2820 + 17 O -28.6720 -8.6380 -18.9520 O.2 1 UNL1 -0.3520 + 18 C -29.7470 -8.5480 -19.8080 C.2 1 UNL1 0.1340 + 19 C -30.4640 -9.6810 -20.2330 C.2 1 UNL1 -0.0120 + 20 C -31.5440 -9.5370 -21.1210 C.2 1 UNL1 0.0100 + 21 C -31.8970 -8.2630 -21.5970 C.2 1 UNL1 -0.0710 + 22 C -31.1720 -7.1330 -21.1870 C.2 1 UNL1 0.0100 + 23 C -30.0950 -7.2800 -20.2960 C.2 1 UNL1 -0.0120 +@BOND + 1 5 4 1 + 2 5 6 2 + 3 4 3 2 + 4 10 2 1 + 5 6 7 1 + 6 3 2 ar + 7 3 8 ar + 8 2 1 ar + 9 7 8 2 + 10 8 9 ar + 11 1 9 ar + 12 1 11 1 + 13 9 14 1 + 14 13 11 ar + 15 11 12 ar + 16 21 22 2 + 17 21 20 1 + 18 22 23 1 + 19 20 19 2 + 20 14 15 1 + 21 23 18 2 + 22 19 18 1 + 23 18 17 1 + 24 15 16 1 + 25 17 16 1 +########## Name: lig_28 +########## Vina_BE: -6.309 +########## MW: 291.216 +########## clogP: -0.176 +########## nonHatoms: 24 +########## Vina_LE: -0.263 +########## Vina_LipE: -6.133 +########## Close_contacts: 0 +########## Hydrophob_contacts: 16 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_28.pdbqt + 24 26 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -25.0650 -7.9270 -23.6990 C.ar 1 UNL1 -0.1860 + 2 CA -24.4410 -8.6210 -24.8120 C.ar 1 UNL1 0.0480 + 3 N -25.4050 -9.3180 -25.5490 N.ar 1 UNL1 -0.2140 + 4 C -26.6230 -9.0970 -24.9320 C.ar 1 UNL1 -0.0430 + 5 C -27.8750 -9.5950 -25.3080 C.2 1 UNL1 -0.0330 + 6 C -28.9880 -9.2440 -24.5170 C.2 1 UNL1 -0.0390 + 7 C -28.8260 -8.4210 -23.3790 C.2 1 UNL1 -0.0730 + 8 C -27.5520 -7.9370 -23.0220 C.2 1 UNL1 0.0200 + 9 C -26.4600 -8.2860 -23.8270 C.ar 1 UNL1 -0.0730 + 10 H -25.1950 -9.8730 -26.3640 H 1 UNL1 0.3100 + 11 C -23.0040 -8.6540 -25.2120 C.2 1 UNL1 0.8380 + 12 OXT -22.1370 -8.9700 -24.4130 O.co2 1 UNL1 -0.8150 + 13 O -22.7580 -8.3470 -26.3710 O.co2 1 UNL1 -0.8150 + 14 C -24.3450 -7.0210 -22.7320 C.3 1 UNL1 0.0980 + 15 C -23.7260 -7.7900 -21.5390 C.3 1 UNL1 0.0250 + 16 C -24.2210 -7.3250 -20.1500 C.3 1 UNL1 0.2440 + 17 O -25.3300 -6.4120 -20.2860 O.2 1 UNL1 -0.3680 + 18 C -26.6030 -6.7810 -19.9210 C.2 1 UNL1 0.1200 + 19 C -26.7970 -8.0520 -19.3600 C.2 1 UNL1 0.0070 + 20 C -28.0810 -8.4650 -18.9680 C.2 1 UNL1 -0.0080 + 21 C -29.1710 -7.5940 -19.1240 C.2 1 UNL1 -0.0310 + 22 C -28.9750 -6.3120 -19.6640 C.2 1 UNL1 -0.0040 + 23 C -27.6910 -5.8920 -20.0610 C.2 1 UNL1 -0.0960 + 24 C -27.5040 -4.4980 -20.6460 C.3 1 UNL1 0.0900 +@BOND + 1 13 11 ar + 2 10 3 1 + 3 3 4 ar + 4 3 2 ar + 5 5 4 2 + 6 5 6 1 + 7 11 2 1 + 8 11 12 ar + 9 4 9 ar + 10 2 1 ar + 11 6 7 2 + 12 9 1 ar + 13 9 8 2 + 14 1 14 1 + 15 7 8 1 + 16 14 15 1 + 17 15 16 1 + 18 24 23 1 + 19 17 16 1 + 20 17 18 1 + 21 23 18 2 + 22 23 22 1 + 23 18 19 1 + 24 22 21 2 + 25 19 20 2 + 26 21 20 1 +########## Name: lig_30 +########## Vina_BE: -7.041 +########## MW: 291.216 +########## clogP: -0.176 +########## nonHatoms: 24 +########## Vina_LE: -0.293 +########## Vina_LipE: -6.865 +########## Close_contacts: 0 +########## Hydrophob_contacts: 25 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_30.pdbqt + 24 26 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -25.8550 -7.5780 -21.8270 C.ar 1 UNL1 -0.1930 + 2 CA -24.5230 -7.8980 -22.1280 C.ar 1 UNL1 -0.0370 + 3 N -24.5060 -8.5080 -23.3950 N.ar 1 UNL1 -0.2140 + 4 C -25.7950 -8.5670 -23.8760 C.ar 1 UNL1 -0.0420 + 5 C -26.2470 -9.0840 -25.0960 C.2 1 UNL1 -0.0300 + 6 C -27.6310 -9.0220 -25.3600 C.2 1 UNL1 -0.0380 + 7 C -28.5150 -8.4570 -24.4110 C.2 1 UNL1 -0.0670 + 8 C -28.0250 -7.9460 -23.1910 C.2 1 UNL1 0.0130 + 9 C -26.6450 -8.0170 -22.9550 C.ar 1 UNL1 -0.0730 + 10 H -23.6610 -8.8320 -23.8410 H 1 UNL1 0.3100 + 11 C -23.2860 -7.6690 -21.3250 C.2 1 UNL1 0.9270 + 12 OXT -23.2780 -7.8380 -20.1160 O.co2 1 UNL1 -0.8140 + 13 O -22.3000 -7.3050 -21.9520 O.co2 1 UNL1 -0.8140 + 14 C -26.3180 -6.8790 -20.5720 C.3 1 UNL1 0.0990 + 15 C -26.6580 -7.8630 -19.4300 C.3 1 UNL1 0.0220 + 16 C -27.9640 -7.4860 -18.6890 C.3 1 UNL1 0.2540 + 17 O -28.9270 -6.9590 -19.6260 O.2 1 UNL1 -0.3400 + 18 C -29.9400 -7.7040 -20.1940 C.2 1 UNL1 0.1530 + 19 C -30.0040 -9.0660 -19.8710 C.2 1 UNL1 -0.0370 + 20 C -31.0180 -9.8780 -20.4050 C.2 1 UNL1 0.0140 + 21 C -31.9770 -9.3210 -21.2660 C.2 1 UNL1 -0.0660 + 22 C -31.9260 -7.9560 -21.5970 C.2 1 UNL1 -0.0450 + 23 C -32.9620 -7.3480 -22.5260 C.3 1 UNL1 0.0690 + 24 C -30.9090 -7.1500 -21.0560 C.2 1 UNL1 -0.0500 +@BOND + 1 6 5 1 + 2 6 7 2 + 3 5 4 2 + 4 7 8 1 + 5 4 3 ar + 6 4 9 ar + 7 10 3 1 + 8 3 2 ar + 9 8 9 2 + 10 9 1 ar + 11 23 22 1 + 12 2 1 ar + 13 2 11 1 + 14 13 11 ar + 15 1 14 1 + 16 22 21 2 + 17 22 24 1 + 18 11 12 ar + 19 21 20 1 + 20 24 18 2 + 21 14 15 1 + 22 20 19 2 + 23 18 19 1 + 24 18 17 1 + 25 17 16 1 + 26 15 16 1 +########## Name: lig_31 +########## Vina_BE: -7.302 +########## MW: 348.211 +########## clogP: 2.342 +########## nonHatoms: 27 +########## Vina_LE: -0.27 +########## Vina_LipE: -9.644 +########## Close_contacts: 1 +########## Hydrophob_contacts: 17 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_31.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -25.6260 -6.9140 -21.3560 C.3 1 UNL1 0.1040 + 2 C -25.5990 -7.7610 -22.6080 C.ar 1 UNL1 -0.1820 + 3 C -26.7330 -8.1790 -23.4020 C.ar 1 UNL1 -0.0710 + 4 C -28.1050 -7.9590 -23.2210 C.2 1 UNL1 0.0250 + 5 C -26.2650 -8.8890 -24.4740 C.ar 1 UNL1 -0.0390 + 6 C -28.9930 -8.4910 -24.1790 C.2 1 UNL1 -0.0680 + 7 C -28.5020 -9.2220 -25.2860 C.2 1 UNL1 -0.0330 + 8 C -27.1170 -9.4290 -25.4450 C.2 1 UNL1 -0.0310 + 9 N -24.8920 -8.9480 -24.4080 N.ar 1 UNL1 -0.2140 + 10 CA -24.4590 -8.2500 -23.2650 C.ar 1 UNL1 -0.0480 + 11 H -24.2570 -9.3920 -25.0560 H 1 UNL1 0.3110 + 12 C -23.0140 -8.1220 -22.9160 C.2 1 UNL1 0.9330 + 13 OXT -22.2510 -7.9230 -23.8480 O.co2 1 UNL1 -0.8230 + 14 O -22.6280 -8.2500 -21.7660 O.co2 1 UNL1 -0.8230 + 15 C -26.7050 -7.3840 -20.3540 C.3 1 UNL1 -0.0240 + 16 C -27.6880 -6.2630 -19.9390 C.3 1 UNL1 0.2880 + 17 O -28.8040 -6.8380 -19.2220 O.2 1 UNL1 -0.3460 + 18 C -29.6910 -7.6980 -19.8320 C.2 1 UNL1 0.1330 + 19 C -29.7120 -9.0680 -19.5270 C.2 1 UNL1 0.0660 + 20 C -30.6480 -9.9100 -20.1480 C.2 1 UNL1 0.0390 + 21 C -31.5610 -9.3830 -21.0770 C.2 1 UNL1 -0.0020 + 22 C -31.5470 -8.0080 -21.3970 C.2 1 UNL1 -0.1540 + 23 C -30.5930 -7.1770 -20.7710 C.2 1 UNL1 0.0190 + 24 C -32.5420 -7.4390 -22.4150 C.3 1 UNL1 0.6870 + 25 F -33.1440 -6.3240 -21.9490 F 1 UNL1 -0.2490 + 26 F -31.9480 -7.0970 -23.5810 F 1 UNL1 -0.2490 + 27 F -33.5270 -8.3080 -22.7320 F 1 UNL1 -0.2490 +@BOND + 1 8 7 2 + 2 8 5 1 + 3 7 6 1 + 4 11 9 1 + 5 5 9 ar + 6 5 3 ar + 7 9 10 ar + 8 6 4 2 + 9 13 12 ar + 10 26 24 1 + 11 3 4 1 + 12 3 2 ar + 13 10 12 1 + 14 10 2 ar + 15 12 14 ar + 16 27 24 1 + 17 2 1 1 + 18 24 25 1 + 19 24 22 1 + 20 22 21 2 + 21 22 23 1 + 22 1 15 1 + 23 21 20 1 + 24 23 18 2 + 25 15 16 1 + 26 20 19 2 + 27 16 17 1 + 28 18 19 1 + 29 18 17 1 +########## Name: lig_32 +########## Vina_BE: -6.615 +########## MW: 291.216 +########## clogP: -0.176 +########## nonHatoms: 24 +########## Vina_LE: -0.276 +########## Vina_LipE: -6.439 +########## Close_contacts: 0 +########## Hydrophob_contacts: 22 +########## HBonds: 0 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_32.pdbqt + 24 26 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -26.1100 -7.7200 -22.3080 C.ar 1 UNL1 -0.1930 + 2 CA -24.8300 -7.9500 -22.8310 C.ar 1 UNL1 -0.0370 + 3 N -24.9840 -8.5920 -24.0740 N.ar 1 UNL1 -0.2140 + 4 C -26.3290 -8.7380 -24.3350 C.ar 1 UNL1 -0.0430 + 5 C -26.9460 -9.2850 -25.4670 C.2 1 UNL1 -0.0300 + 6 C -28.3550 -9.2960 -25.5010 C.2 1 UNL1 -0.0380 + 7 C -29.1010 -8.7680 -24.4230 C.2 1 UNL1 -0.0670 + 8 C -28.4470 -8.2250 -23.2980 C.2 1 UNL1 0.0140 + 9 C -27.0470 -8.2270 -23.2870 C.ar 1 UNL1 -0.0720 + 10 H -24.2070 -8.8620 -24.6570 H 1 UNL1 0.3100 + 11 C -23.4940 -7.6000 -22.2650 C.2 1 UNL1 0.9270 + 12 OXT -22.8540 -8.4090 -21.6110 O.co2 1 UNL1 -0.8150 + 13 O -23.1050 -6.4600 -22.4770 O.co2 1 UNL1 -0.8150 + 14 C -26.4050 -7.0140 -21.0070 C.3 1 UNL1 0.0980 + 15 C -26.4420 -7.9870 -19.8060 C.3 1 UNL1 0.0230 + 16 C -27.5860 -7.6860 -18.8160 C.3 1 UNL1 0.2520 + 17 O -28.6170 -8.6770 -18.9840 O.2 1 UNL1 -0.3390 + 18 C -29.6710 -8.4670 -19.8400 C.2 1 UNL1 0.1480 + 19 C -30.4500 -9.5300 -20.3290 C.2 1 UNL1 -0.0390 + 20 C -31.5290 -9.2740 -21.1900 C.2 1 UNL1 0.0230 + 21 C -31.8380 -7.9540 -21.5680 C.2 1 UNL1 -0.1370 + 22 C -33.0050 -7.6810 -22.5020 C.3 1 UNL1 0.0600 + 23 C -31.0610 -6.8920 -21.0700 C.2 1 UNL1 0.0230 + 24 C -29.9850 -7.1500 -20.2050 C.2 1 UNL1 -0.0390 +@BOND + 1 6 5 1 + 2 6 7 2 + 3 5 4 2 + 4 10 3 1 + 5 7 8 1 + 6 4 3 ar + 7 4 9 ar + 8 3 2 ar + 9 8 9 2 + 10 9 1 ar + 11 2 1 ar + 12 2 11 1 + 13 22 21 1 + 14 13 11 ar + 15 1 14 1 + 16 11 12 ar + 17 21 20 2 + 18 21 23 1 + 19 20 19 1 + 20 23 24 2 + 21 14 15 1 + 22 19 18 2 + 23 24 18 1 + 24 18 17 1 + 25 15 16 1 + 26 17 16 1 +########## Name: lig_33 +########## Vina_BE: -6.448 +########## MW: 314.658 +########## clogP: 0.432 +########## nonHatoms: 24 +########## Vina_LE: -0.269 +########## Vina_LipE: -6.88 +########## Close_contacts: 0 +########## Hydrophob_contacts: 17 +########## HBonds: 0 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_33.pdbqt + 24 26 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 CA -24.8400 -7.8890 -22.8570 C.ar 1 UNL1 -0.0480 + 2 N -24.9930 -8.5490 -24.0890 N.ar 1 UNL1 -0.2140 + 3 C -26.3380 -8.7280 -24.3340 C.ar 1 UNL1 -0.0400 + 4 C -26.9510 -9.3450 -25.4310 C.2 1 UNL1 -0.0310 + 5 C -28.3590 -9.4070 -25.4420 C.2 1 UNL1 -0.0350 + 6 C -29.1090 -8.8600 -24.3750 C.2 1 UNL1 -0.0700 + 7 C -28.4580 -8.2450 -23.2830 C.2 1 UNL1 0.0250 + 8 C -27.0570 -8.1960 -23.2970 C.ar 1 UNL1 -0.0710 + 9 C -26.1220 -7.6470 -22.3430 C.ar 1 UNL1 -0.1810 + 10 H -24.2150 -8.8390 -24.6630 H 1 UNL1 0.3100 + 11 C -23.5080 -7.5520 -22.2710 C.2 1 UNL1 0.9320 + 12 O -22.9000 -8.4780 -21.7530 O.co2 1 UNL1 -0.8210 + 13 OXT -23.0700 -6.4110 -22.3020 O.co2 1 UNL1 -0.8210 + 14 C -26.3890 -6.9570 -21.0310 C.3 1 UNL1 0.1060 + 15 C -26.3960 -7.9560 -19.8500 C.3 1 UNL1 -0.0250 + 16 C -27.5100 -7.6940 -18.8110 C.3 1 UNL1 0.2840 + 17 O -28.5860 -8.6500 -18.9590 O.2 1 UNL1 -0.3480 + 18 C -29.6690 -8.4680 -19.7900 C.2 1 UNL1 0.1390 + 19 C -29.9660 -7.1600 -20.2000 C.2 1 UNL1 0.0010 + 20 C -31.0410 -6.9140 -21.0700 C.2 1 UNL1 0.0380 + 21 C -31.8180 -7.9850 -21.5390 C.2 1 UNL1 -0.0310 + 22 CL -33.1570 -7.6820 -22.6260 Cl 1 UNL1 -0.1370 + 23 C -31.5220 -9.2980 -21.1400 C.2 1 UNL1 0.0380 + 24 C -30.4420 -9.5420 -20.2720 C.2 1 UNL1 0.0010 +@BOND + 1 5 4 1 + 2 5 6 2 + 3 4 3 2 + 4 10 2 1 + 5 6 7 1 + 6 3 2 ar + 7 3 8 ar + 8 2 1 ar + 9 8 7 2 + 10 8 9 ar + 11 1 9 ar + 12 1 11 1 + 13 22 21 1 + 14 9 14 1 + 15 13 11 ar + 16 11 12 ar + 17 21 23 2 + 18 21 20 1 + 19 23 24 1 + 20 20 19 2 + 21 14 15 1 + 22 24 18 2 + 23 19 18 1 + 24 15 16 1 + 25 18 17 1 + 26 17 16 1 +########## Name: lig_34 +########## Vina_BE: -6.86 +########## MW: 348.211 +########## clogP: 2.342 +########## nonHatoms: 27 +########## Vina_LE: -0.254 +########## Vina_LipE: -9.202 +########## Close_contacts: 0 +########## Hydrophob_contacts: 19 +########## HBonds: 0 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_34.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -26.1940 -7.0890 -21.1750 C.3 1 UNL1 0.1040 + 2 C -26.0030 -7.8120 -22.4880 C.ar 1 UNL1 -0.1820 + 3 C -27.0310 -8.2420 -23.4080 C.ar 1 UNL1 -0.0710 + 4 C -28.4270 -8.1420 -23.3280 C.2 1 UNL1 0.0250 + 5 C -26.4230 -8.8080 -24.4940 C.ar 1 UNL1 -0.0390 + 6 C -29.1900 -8.6440 -24.4020 C.2 1 UNL1 -0.0680 + 7 C -28.5550 -9.2250 -25.5240 C.2 1 UNL1 -0.0330 + 8 C -27.1490 -9.3130 -25.5800 C.2 1 UNL1 -0.0310 + 9 N -25.0580 -8.7670 -24.3180 N.ar 1 UNL1 -0.2140 + 10 CA -24.7770 -8.1460 -23.0860 C.ar 1 UNL1 -0.0480 + 11 H -24.3410 -9.0950 -24.9470 H 1 UNL1 0.3110 + 12 C -23.3800 -7.9350 -22.6040 C.2 1 UNL1 0.9330 + 13 OXT -22.6590 -7.2610 -23.3230 O.co2 1 UNL1 -0.8230 + 14 O -22.9850 -8.4470 -21.5690 O.co2 1 UNL1 -0.8230 + 15 C -26.0920 -8.0370 -19.9580 C.3 1 UNL1 -0.0240 + 16 C -27.1020 -7.7030 -18.8310 C.3 1 UNL1 0.2880 + 17 O -28.2370 -8.5950 -18.9170 O.2 1 UNL1 -0.3460 + 18 C -29.3340 -8.3130 -19.7030 C.2 1 UNL1 0.1330 + 19 C -29.7010 -6.9960 -20.0280 C.2 1 UNL1 0.0660 + 20 C -30.8070 -6.7560 -20.8620 C.2 1 UNL1 0.0390 + 21 C -31.5670 -7.8290 -21.3760 C.2 1 UNL1 -0.1370 + 22 C -31.1970 -9.1460 -21.0310 C.2 1 UNL1 -0.0190 + 23 C -30.0920 -9.3830 -20.1970 C.2 1 UNL1 0.0190 + 24 C -32.7650 -7.5900 -22.3040 C.3 1 UNL1 0.6870 + 25 F -33.6710 -8.5900 -22.2230 F 1 UNL1 -0.2490 + 26 F -33.4370 -6.4470 -22.0390 F 1 UNL1 -0.2490 + 27 F -32.3830 -7.5240 -23.5980 F 1 UNL1 -0.2490 +@BOND + 1 8 7 2 + 2 8 5 1 + 3 7 6 1 + 4 11 9 1 + 5 5 9 ar + 6 5 3 ar + 7 6 4 2 + 8 9 10 ar + 9 27 24 1 + 10 3 4 1 + 11 3 2 ar + 12 13 12 ar + 13 10 12 1 + 14 10 2 ar + 15 12 14 ar + 16 2 1 1 + 17 24 25 1 + 18 24 26 1 + 19 24 21 1 + 20 21 22 2 + 21 21 20 1 + 22 1 15 1 + 23 22 23 1 + 24 20 19 2 + 25 23 18 2 + 26 19 18 1 + 27 15 16 1 + 28 18 17 1 + 29 17 16 1 +########## Name: lig_35 +########## Vina_BE: -6.269 +########## MW: 326.669 +########## clogP: 0.587 +########## nonHatoms: 25 +########## Vina_LE: -0.251 +########## Vina_LipE: -6.856 +########## Close_contacts: 0 +########## Hydrophob_contacts: 18 +########## HBonds: 0 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_35.pdbqt + 25 27 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -25.8340 -7.7980 -22.5470 C.ar 1 UNL1 -0.1950 + 2 CA -24.6450 -8.1620 -23.1960 C.ar 1 UNL1 -0.0370 + 3 N -24.9940 -8.8130 -24.3930 N.ar 1 UNL1 -0.2140 + 4 C -26.3670 -8.8240 -24.5090 C.ar 1 UNL1 -0.0420 + 5 C -27.1500 -9.3210 -25.5580 C.2 1 UNL1 -0.0290 + 6 C -28.5490 -9.1810 -25.4510 C.2 1 UNL1 -0.0370 + 7 C -29.1200 -8.5520 -24.3210 C.2 1 UNL1 -0.0660 + 8 C -28.3000 -8.0630 -23.2830 C.2 1 UNL1 0.0110 + 9 C -26.9140 -8.2200 -23.4090 C.ar 1 UNL1 -0.0740 + 10 H -24.3130 -9.1680 -25.0480 H 1 UNL1 0.3110 + 11 C -23.2280 -7.9270 -22.7870 C.2 1 UNL1 0.9270 + 12 OXT -22.7820 -8.4010 -21.7550 O.co2 1 UNL1 -0.8140 + 13 O -22.5700 -7.2090 -23.5270 O.co2 1 UNL1 -0.8140 + 14 C -25.9170 -7.0500 -21.2380 C.3 1 UNL1 0.0980 + 15 C -25.9860 -8.0060 -20.0250 C.3 1 UNL1 0.0260 + 16 C -26.8020 -7.4290 -18.8510 C.3 1 UNL1 0.2600 + 17 O -28.0040 -8.2070 -18.7010 O.2 1 UNL1 -0.3380 + 18 C -29.1060 -8.0560 -19.5140 C.2 1 UNL1 0.1580 + 19 C -29.7980 -9.2170 -19.8860 C.2 1 UNL1 -0.0400 + 20 C -30.9280 -9.1470 -20.7230 C.2 1 UNL1 -0.0300 + 21 C -31.6550 -10.4230 -21.1230 C.3 1 UNL1 0.0910 + 22 C -31.3630 -7.8880 -21.1860 C.2 1 UNL1 -0.0360 + 23 C -30.6710 -6.7220 -20.8180 C.2 1 UNL1 0.0390 + 24 CL -32.7650 -7.7370 -22.2300 Cl 1 UNL1 -0.1280 + 25 C -29.5440 -6.8030 -19.9840 C.2 1 UNL1 -0.0260 +@BOND + 1 5 6 1 + 2 5 4 2 + 3 6 7 2 + 4 10 3 1 + 5 4 3 ar + 6 4 9 ar + 7 3 2 ar + 8 7 8 1 + 9 13 11 ar + 10 9 8 2 + 11 9 1 ar + 12 2 11 1 + 13 2 1 ar + 14 11 12 ar + 15 1 14 1 + 16 24 22 1 + 17 14 15 1 + 18 22 23 2 + 19 22 20 1 + 20 21 20 1 + 21 23 25 1 + 22 20 19 2 + 23 15 16 1 + 24 25 18 2 + 25 19 18 1 + 26 18 17 1 + 27 16 17 1 +########## Name: lig_36 +########## Vina_BE: -6.602 +########## MW: 338.68 +########## clogP: 0.668 +########## nonHatoms: 26 +########## Vina_LE: -0.254 +########## Vina_LipE: -7.27 +########## Close_contacts: 1 +########## Hydrophob_contacts: 12 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_36.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -25.2220 -8.2680 -23.4680 C.ar 1 UNL1 -0.1820 + 2 CA -24.0520 -8.4310 -24.3180 C.ar 1 UNL1 0.0400 + 3 N -24.4350 -8.8790 -25.5860 N.ar 1 UNL1 -0.2140 + 4 C -25.8100 -9.0060 -25.5740 C.ar 1 UNL1 -0.0400 + 5 C -26.6390 -9.4230 -26.6220 C.2 1 UNL1 -0.0310 + 6 C -28.0270 -9.4780 -26.3810 C.2 1 UNL1 -0.0350 + 7 C -28.5490 -9.1210 -25.1170 C.2 1 UNL1 -0.0700 + 8 C -27.6900 -8.7040 -24.0780 C.2 1 UNL1 0.0250 + 9 C -26.3130 -8.6550 -24.3380 C.ar 1 UNL1 -0.0700 + 10 H -23.7840 -9.0600 -26.3360 H 1 UNL1 0.3100 + 11 C -22.6120 -8.1960 -24.0070 C.2 1 UNL1 0.8430 + 12 O -22.1960 -8.2620 -22.8630 O.co2 1 UNL1 -0.8210 + 13 OXT -21.8810 -7.9750 -24.9620 O.co2 1 UNL1 -0.8210 + 14 C -25.2290 -7.7960 -22.0330 C.3 1 UNL1 0.1050 + 15 C -25.6680 -6.3180 -21.9100 C.3 1 UNL1 -0.0250 + 16 C -25.8880 -5.8770 -20.4490 C.3 1 UNL1 0.2860 + 17 O -27.2930 -5.6110 -20.2720 O.2 1 UNL1 -0.3480 + 18 C -28.1930 -6.6470 -20.2470 C.2 1 UNL1 0.1410 + 19 C -29.1130 -6.7760 -21.2980 C.2 1 UNL1 -0.0340 + 20 C -30.0620 -7.8160 -21.2990 C.2 1 UNL1 -0.0570 + 21 C -30.0840 -8.7250 -20.2170 C.2 1 UNL1 -0.0260 + 22 C -29.1710 -8.5830 -19.1570 C.2 1 UNL1 0.0580 + 23 CL -31.2470 -10.0370 -20.1350 Cl 1 UNL1 -0.1370 + 24 C -28.2270 -7.5430 -19.1700 C.2 1 UNL1 0.0360 + 25 C -31.0480 -7.9190 -22.4580 C.3 1 UNL1 0.0570 + 26 C -32.4120 -7.2890 -22.1140 C.3 1 UNL1 0.0110 +@BOND + 1 5 6 1 + 2 5 4 2 + 3 6 7 2 + 4 10 3 1 + 5 3 4 ar + 6 3 2 ar + 7 4 9 ar + 8 7 8 1 + 9 13 11 ar + 10 9 8 2 + 11 9 1 ar + 12 2 11 1 + 13 2 1 ar + 14 11 12 ar + 15 1 14 1 + 16 25 26 1 + 17 25 20 1 + 18 14 15 1 + 19 15 16 1 + 20 20 19 1 + 21 20 21 2 + 22 19 18 2 + 23 16 17 1 + 24 17 18 1 + 25 18 24 1 + 26 21 23 1 + 27 21 22 1 + 28 24 22 2 +########## Name: lig_37 +########## Vina_BE: -6.531 +########## MW: 338.68 +########## clogP: 0.742 +########## nonHatoms: 26 +########## Vina_LE: -0.251 +########## Vina_LipE: -7.273 +########## Close_contacts: 1 +########## Hydrophob_contacts: 14 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_37.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -24.2020 -8.5370 -24.4700 C.ar 1 UNL1 -0.2010 + 2 CA -24.1620 -9.3820 -25.6530 C.ar 1 UNL1 0.0730 + 3 N -25.4610 -9.7230 -26.0430 N.ar 1 UNL1 -0.2220 + 4 C -26.3240 -9.1300 -25.1400 C.ar 1 UNL1 -0.0430 + 5 C -27.7220 -9.2010 -25.1220 C.2 1 UNL1 -0.0310 + 6 C -28.4030 -8.5170 -24.0950 C.2 1 UNL1 -0.0380 + 7 C -27.6830 -7.7870 -23.1200 C.2 1 UNL1 -0.0640 + 8 C -26.2730 -7.7350 -23.1620 C.2 1 UNL1 0.0190 + 9 C -25.6160 -8.4200 -24.1920 C.ar 1 UNL1 -0.0560 + 10 H -25.6740 -10.3070 -26.8370 H 1 UNL1 0.2980 + 11 C -22.9730 -9.8800 -26.4120 C.2 1 UNL1 0.8300 + 12 O -22.7130 -11.0710 -26.4700 O.co2 1 UNL1 -0.8100 + 13 OXT -22.2940 -9.0310 -26.9730 O.co2 1 UNL1 -0.8100 + 14 C -22.9860 -7.9960 -23.7640 C.3 1 UNL1 0.0940 + 15 C -23.0210 -8.2810 -22.2420 C.3 1 UNL1 -0.0200 + 16 C -22.6500 -7.0440 -21.3990 C.3 1 UNL1 0.2770 + 17 O -23.3090 -7.1360 -20.1200 O.2 1 UNL1 -0.3530 + 18 C -24.6500 -6.8620 -20.0090 C.2 1 UNL1 0.1400 + 19 C -25.1740 -5.6200 -20.4040 C.2 1 UNL1 -0.0100 + 20 C -26.5520 -5.3640 -20.2970 C.2 1 UNL1 -0.0400 + 21 C -27.0900 -4.0050 -20.7250 C.3 1 UNL1 0.0910 + 22 C -27.4110 -6.3700 -19.8010 C.2 1 UNL1 -0.0290 + 23 C -26.8890 -7.6270 -19.4210 C.2 1 UNL1 -0.0400 + 24 CL -29.1360 -6.0630 -19.6660 Cl 1 UNL1 -0.1380 + 25 C -25.5060 -7.8630 -19.5340 C.2 1 UNL1 -0.0100 + 26 C -27.7980 -8.7290 -18.8960 C.3 1 UNL1 0.0910 +@BOND + 1 13 11 ar + 2 10 3 1 + 3 12 11 ar + 4 11 2 1 + 5 3 2 ar + 6 3 4 ar + 7 2 1 ar + 8 4 5 2 + 9 4 9 ar + 10 5 6 1 + 11 1 9 ar + 12 1 14 1 + 13 9 8 2 + 14 6 7 2 + 15 14 15 1 + 16 8 7 1 + 17 15 16 1 + 18 16 17 1 + 19 21 20 1 + 20 19 20 1 + 21 19 18 2 + 22 20 22 2 + 23 17 18 1 + 24 18 25 1 + 25 22 24 1 + 26 22 23 1 + 27 25 23 2 + 28 23 26 1 +########## Name: lig_43 +########## Vina_BE: -7.274 +########## MW: 327.248 +########## clogP: 1.685 +########## nonHatoms: 27 +########## Vina_LE: -0.269 +########## Vina_LipE: -8.959 +########## Close_contacts: 0 +########## Hydrophob_contacts: 26 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_43.pdbqt + 27 30 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -25.1170 -7.4380 -21.9230 C.3 1 UNL1 0.1050 + 2 C -25.3120 -8.0570 -23.2880 C.ar 1 UNL1 -0.1800 + 3 C -26.5550 -8.5020 -23.8750 C.ar 1 UNL1 -0.0710 + 4 C -27.8550 -8.5170 -23.3550 C.2 1 UNL1 0.0250 + 5 C -26.2930 -8.9430 -25.1430 C.ar 1 UNL1 -0.0400 + 6 C -28.8930 -9.0030 -24.1790 C.2 1 UNL1 -0.0700 + 7 C -28.6160 -9.4570 -25.4900 C.2 1 UNL1 -0.0350 + 8 C -27.2980 -9.4300 -25.9890 C.2 1 UNL1 -0.0330 + 9 N -24.9470 -8.8080 -25.3980 N.ar 1 UNL1 -0.2140 + 10 CA -24.3230 -8.2490 -24.2680 C.ar 1 UNL1 -0.0480 + 11 H -24.4510 -9.0320 -26.2490 H 1 UNL1 0.3100 + 12 C -22.8610 -7.9510 -24.2390 C.2 1 UNL1 0.9320 + 13 O -22.1160 -8.9050 -24.4030 O.co2 1 UNL1 -0.8220 + 14 OXT -22.4490 -6.8210 -24.0370 O.co2 1 UNL1 -0.8220 + 15 C -25.7100 -6.0130 -21.8300 C.3 1 UNL1 -0.0240 + 16 C -25.7950 -5.4750 -20.3790 C.3 1 UNL1 0.2800 + 17 O -27.1830 -5.3310 -19.9950 O.2 1 UNL1 -0.3510 + 18 C -28.0490 -6.4050 -19.9670 C.2 1 UNL1 0.1230 + 19 C -27.7140 -7.5220 -19.1870 C.2 1 UNL1 -0.0090 + 20 C -28.5490 -8.6540 -19.1710 C.2 1 UNL1 -0.0040 + 21 C -29.7270 -8.6690 -19.9410 C.2 1 UNL1 -0.0700 + 22 C -30.5630 -9.8010 -19.9520 C.2 1 UNL1 -0.0070 + 23 C -30.0700 -7.5400 -20.7140 C.2 1 UNL1 -0.0050 + 24 C -31.7320 -9.8060 -20.7330 C.2 1 UNL1 -0.0330 + 25 C -32.0680 -8.6820 -21.5050 C.2 1 UNL1 -0.0250 + 26 C -31.2380 -7.5490 -21.4960 C.2 1 UNL1 0.0610 + 27 C -29.2390 -6.4100 -20.7150 C.2 1 UNL1 0.0260 +@BOND + 1 11 9 1 + 2 8 7 2 + 3 8 5 1 + 4 7 6 1 + 5 9 5 ar + 6 9 10 ar + 7 5 3 ar + 8 13 12 ar + 9 10 12 1 + 10 10 2 ar + 11 12 14 ar + 12 6 4 2 + 13 3 4 1 + 14 3 2 ar + 15 2 1 1 + 16 1 15 1 + 17 15 16 1 + 18 25 26 2 + 19 25 24 1 + 20 26 23 1 + 21 24 22 2 + 22 27 23 1 + 23 27 18 2 + 24 23 21 2 + 25 16 17 1 + 26 17 18 1 + 27 18 19 1 + 28 22 21 1 + 29 21 20 1 + 30 19 20 2 +########## Name: lig_46 +########## Vina_BE: -7.313 +########## MW: 315.238 +########## clogP: 0.06 +########## nonHatoms: 26 +########## Vina_LE: -0.281 +########## Vina_LipE: -7.373 +########## Close_contacts: 0 +########## Hydrophob_contacts: 21 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_46.pdbqt + 26 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 CA -24.3420 -8.2190 -23.4330 C.ar 1 UNL1 0.0410 + 2 N -24.5890 -8.8420 -24.6560 N.ar 1 UNL1 -0.2150 + 3 C -25.9640 -8.8870 -24.7470 C.ar 1 UNL1 -0.0400 + 4 C -26.7450 -9.4140 -25.7820 C.2 1 UNL1 -0.0330 + 5 C -28.1460 -9.3450 -25.6450 C.2 1 UNL1 -0.0360 + 6 C -28.7250 -8.7580 -24.4960 C.2 1 UNL1 -0.0710 + 7 C -27.9110 -8.2350 -23.4680 C.2 1 UNL1 0.0250 + 8 C -26.5200 -8.3110 -23.6200 C.ar 1 UNL1 -0.0710 + 9 C -25.5090 -7.8810 -22.7780 C.ar 1 UNL1 -0.1800 + 10 H -23.8780 -9.1690 -25.2940 H 1 UNL1 0.3100 + 11 C -22.9380 -7.9960 -22.9720 C.2 1 UNL1 0.8430 + 12 OXT -22.1600 -7.5510 -23.8040 O.co2 1 UNL1 -0.8210 + 13 O -22.5880 -8.2880 -21.8380 O.co2 1 UNL1 -0.8210 + 14 C -25.7010 -7.1820 -21.4430 C.3 1 UNL1 0.1040 + 15 C -26.3480 -5.7850 -21.5830 C.3 1 UNL1 -0.0250 + 16 C -26.5440 -5.0590 -20.2290 C.3 1 UNL1 0.2810 + 17 O -27.9270 -5.1580 -19.8230 O.2 1 UNL1 -0.3520 + 18 C -28.6260 -6.3480 -19.8440 C.2 1 UNL1 0.1360 + 19 C -28.2960 -7.3180 -18.8760 C.2 1 UNL1 -0.0540 + 20 C -28.9590 -8.5600 -18.8450 C.2 1 UNL1 0.0120 + 21 C -29.9580 -8.8080 -19.7970 C.2 1 UNL1 -0.1440 + 22 C -30.2930 -7.8520 -20.7450 C.2 1 UNL1 -0.0520 + 23 C -30.7900 -10.0590 -19.9530 C.3 1 UNL1 0.0490 + 24 C -29.6420 -6.6120 -20.7870 C.2 1 UNL1 0.0400 + 25 C -31.3940 -8.3310 -21.6570 C.3 1 UNL1 0.0880 + 26 C -31.8740 -9.6480 -20.9880 C.3 1 UNL1 -0.0140 +@BOND + 1 4 5 1 + 2 4 3 2 + 3 5 6 2 + 4 10 2 1 + 5 3 2 ar + 6 3 8 ar + 7 2 1 ar + 8 6 7 1 + 9 12 11 ar + 10 8 7 2 + 11 8 9 ar + 12 1 11 1 + 13 1 9 ar + 14 11 13 ar + 15 9 14 1 + 16 25 26 1 + 17 25 22 1 + 18 15 14 1 + 19 15 16 1 + 20 26 23 1 + 21 24 22 1 + 22 24 18 2 + 23 22 21 2 + 24 16 17 1 + 25 23 21 1 + 26 18 17 1 + 27 18 19 1 + 28 21 20 1 + 29 19 20 2 +########## Name: lig_47 +########## Vina_BE: -6.934 +########## MW: 329.244 +########## clogP: 0.864 +########## nonHatoms: 27 +########## Vina_LE: -0.257 +########## Vina_LipE: -7.798 +########## Close_contacts: 0 +########## Hydrophob_contacts: 16 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 1 +########## Halogen_Bonds: 0 +@MOLECULE +lig_47.pdbqt + 27 30 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -25.2570 -7.4990 -21.8330 C.3 1 UNL1 0.0930 + 2 C -25.3680 -8.1030 -23.2150 C.ar 1 UNL1 -0.1990 + 3 C -26.5730 -8.5340 -23.8860 C.ar 1 UNL1 -0.0570 + 4 C -27.9120 -8.5090 -23.4690 C.2 1 UNL1 0.0210 + 5 C -26.2290 -9.0010 -25.1250 C.ar 1 UNL1 -0.0420 + 6 C -28.8950 -8.9900 -24.3600 C.2 1 UNL1 -0.0640 + 7 C -28.5300 -9.4760 -25.6360 C.2 1 UNL1 -0.0370 + 8 C -27.1770 -9.4830 -26.0350 C.2 1 UNL1 -0.0300 + 9 N -24.8680 -8.8880 -25.2850 N.ar 1 UNL1 -0.2230 + 10 CA -24.3160 -8.3130 -24.1250 C.ar 1 UNL1 -0.0140 + 11 H -24.3200 -9.1270 -26.0990 H 1 UNL1 0.2970 + 12 C -22.8530 -8.0220 -24.0090 C.2 1 UNL1 0.9180 + 13 OXT -22.0990 -8.8650 -24.4700 O.co2 1 UNL1 -0.8120 + 14 O -22.4410 -7.0090 -23.4680 O.co2 1 UNL1 -0.8120 + 15 C -25.7010 -6.0180 -21.7950 C.3 1 UNL1 -0.0190 + 16 C -25.8400 -5.4470 -20.3610 C.3 1 UNL1 0.2750 + 17 O -27.2400 -5.3070 -20.0220 O.2 1 UNL1 -0.3530 + 18 C -28.0980 -6.3860 -19.9870 C.2 1 UNL1 0.1180 + 19 C -27.7710 -7.4910 -19.1870 C.2 1 UNL1 -0.0080 + 20 C -28.6090 -8.6230 -19.1660 C.2 1 UNL1 -0.0380 + 21 C -29.7770 -8.6730 -19.9470 C.2 1 UNL1 0.3580 + 22 N -30.5510 -9.7780 -19.9270 N.2 1 UNL1 -0.6790 + 23 C -30.1020 -7.5500 -20.7410 C.2 1 UNL1 -0.1170 + 24 C -31.6550 -9.8030 -20.6970 C.2 1 UNL1 0.3890 + 25 C -32.0410 -8.7340 -21.5200 C.2 1 UNL1 -0.1390 + 26 C -31.2490 -7.5760 -21.5480 C.2 1 UNL1 0.1450 + 27 C -29.2790 -6.4120 -20.7430 C.2 1 UNL1 0.0340 +@BOND + 1 11 9 1 + 2 8 7 2 + 3 8 5 1 + 4 7 6 1 + 5 9 5 ar + 6 9 10 ar + 7 5 3 ar + 8 13 12 ar + 9 6 4 2 + 10 10 12 1 + 11 10 2 ar + 12 12 14 ar + 13 3 4 1 + 14 3 2 ar + 15 2 1 1 + 16 1 15 1 + 17 15 16 1 + 18 26 25 2 + 19 26 23 1 + 20 25 24 1 + 21 27 23 1 + 22 27 18 2 + 23 23 21 2 + 24 24 22 2 + 25 16 17 1 + 26 17 18 1 + 27 18 19 1 + 28 21 22 1 + 29 21 20 1 + 30 19 20 2 +########## Name: lig_48 +########## Vina_BE: -6.488 +########## MW: 318.241 +########## clogP: 1.356 +########## nonHatoms: 27 +########## Vina_LE: -0.24 +########## Vina_LipE: -7.844 +########## Close_contacts: 1 +########## Hydrophob_contacts: 12 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 1 +########## Halogen_Bonds: 0 +@MOLECULE +lig_48.pdbqt + 27 30 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -23.6780 -7.4150 -23.2460 C.3 1 UNL1 0.1070 + 2 C -24.6710 -8.1780 -24.0860 C.ar 1 UNL1 -0.1800 + 3 C -26.1080 -8.3120 -24.0060 C.ar 1 UNL1 -0.0710 + 4 C -27.0140 -7.7450 -23.1010 C.2 1 UNL1 0.0260 + 5 C -26.5390 -9.1480 -25.0170 C.ar 1 UNL1 -0.0400 + 6 C -28.3820 -8.0500 -23.2490 C.2 1 UNL1 -0.0710 + 7 C -28.8200 -8.9070 -24.2850 C.2 1 UNL1 -0.0360 + 8 C -27.8920 -9.4680 -25.1870 C.2 1 UNL1 -0.0330 + 9 N -25.4680 -9.5850 -25.7720 N.ar 1 UNL1 -0.2150 + 10 CA -24.3180 -9.0120 -25.2220 C.ar 1 UNL1 0.0420 + 11 H -25.4590 -10.2060 -26.5670 H 1 UNL1 0.3100 + 12 C -22.9680 -9.2970 -25.7980 C.2 1 UNL1 0.8440 + 13 O -22.6920 -10.4770 -25.9660 O.co2 1 UNL1 -0.8220 + 14 OXT -22.1870 -8.3970 -26.0650 O.co2 1 UNL1 -0.8220 + 15 C -23.2270 -8.2200 -22.0020 C.3 1 UNL1 -0.0260 + 16 C -23.3280 -7.4390 -20.6720 C.3 1 UNL1 0.2890 + 17 O -24.5610 -7.7260 -19.9780 O.2 1 UNL1 -0.3500 + 18 C -25.6700 -6.9060 -19.9730 C.2 1 UNL1 0.1940 + 19 C -25.5080 -5.5940 -20.4620 C.2 1 UNL1 -0.0790 + 20 C -26.5990 -4.6980 -20.5310 C.2 1 UNL1 0.0210 + 21 C -27.8810 -5.1090 -20.1220 C.2 1 UNL1 -0.0830 + 22 C -28.0290 -6.4190 -19.6550 C.2 1 UNL1 -0.0070 + 23 N -29.1930 -7.0180 -19.2070 N.pl3 1 UNL1 -0.2530 + 24 C -26.9630 -7.3070 -19.5790 C.2 1 UNL1 -0.1320 + 25 C -28.7750 -8.2920 -18.8440 C.2 1 UNL1 0.0400 + 26 C -27.4480 -8.4970 -19.0670 C.2 1 UNL1 0.0740 + 27 H -30.1010 -6.6020 -19.0890 H 1 UNL1 0.2770 +@BOND + 1 11 9 1 + 2 14 12 ar + 3 13 12 ar + 4 12 10 1 + 5 9 10 ar + 6 9 5 ar + 7 10 2 ar + 8 8 5 1 + 9 8 7 2 + 10 5 3 ar + 11 7 6 1 + 12 2 3 ar + 13 2 1 1 + 14 3 4 1 + 15 6 4 2 + 16 1 15 1 + 17 15 16 1 + 18 16 17 1 + 19 20 19 1 + 20 20 21 2 + 21 19 18 2 + 22 21 22 1 + 23 17 18 1 + 24 18 24 1 + 25 22 24 2 + 26 22 23 1 + 27 24 26 1 + 28 23 27 1 + 29 23 25 1 + 30 26 25 2 +########## Name: lig_49 +########## Vina_BE: -6.515 +########## MW: 362.122 +########## clogP: 1.276 +########## nonHatoms: 26 +########## Vina_LE: -0.251 +########## Vina_LipE: -7.791 +########## Close_contacts: 0 +########## Hydrophob_contacts: 11 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_49.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -25.3100 -8.2510 -23.4180 C.ar 1 UNL1 -0.1740 + 2 CA -23.9070 -8.2090 -23.7910 C.ar 1 UNL1 0.0510 + 3 N -23.7440 -8.6390 -25.1070 N.ar 1 UNL1 -0.2090 + 4 C -25.0020 -8.9190 -25.6000 C.ar 1 UNL1 -0.0400 + 5 C -25.3130 -9.3470 -26.8960 C.2 1 UNL1 -0.0230 + 6 C -26.6670 -9.5530 -27.2170 C.2 1 UNL1 -0.0280 + 7 C -27.6670 -9.3220 -26.2480 C.2 1 UNL1 -0.0470 + 8 C -27.3330 -8.8890 -24.9480 C.2 1 UNL1 0.0560 + 9 CL -28.6340 -8.5950 -23.8090 Cl 1 UNL1 -0.1430 + 10 C -25.9710 -8.6960 -24.6360 C.ar 1 UNL1 -0.0600 + 11 H -22.8500 -8.6800 -25.5730 H 1 UNL1 0.3140 + 12 C -22.7300 -7.7780 -22.9840 C.2 1 UNL1 0.8390 + 13 O -21.9530 -7.0120 -23.5370 O.co2 1 UNL1 -0.8100 + 14 OXT -22.5840 -8.1530 -21.8330 O.co2 1 UNL1 -0.8100 + 15 C -25.8140 -7.8710 -22.0460 C.3 1 UNL1 0.1160 + 16 C -25.9980 -6.3410 -21.8980 C.3 1 UNL1 0.0410 + 17 C -26.0190 -5.8700 -20.4310 C.3 1 UNL1 0.2120 + 18 O -27.3790 -5.5990 -20.0480 O.2 1 UNL1 -0.3330 + 19 C -28.2970 -6.6160 -20.0060 C.2 1 UNL1 0.1530 + 20 C -29.4220 -6.6010 -20.8460 C.2 1 UNL1 -0.0300 + 21 C -30.3530 -7.6570 -20.8080 C.2 1 UNL1 -0.0340 + 22 C -31.5640 -7.6290 -21.7290 C.3 1 UNL1 0.0910 + 23 C -30.1390 -8.7330 -19.9200 C.2 1 UNL1 -0.0280 + 24 C -29.0040 -8.7510 -19.0900 C.2 1 UNL1 0.0370 + 25 CL -31.2630 -10.0760 -19.8290 Cl 1 UNL1 -0.1260 + 26 C -28.0810 -7.6930 -19.1380 C.2 1 UNL1 -0.0160 +@BOND + 1 6 5 1 + 2 6 7 2 + 3 5 4 2 + 4 7 8 1 + 5 4 3 ar + 6 4 10 ar + 7 11 3 1 + 8 3 2 ar + 9 8 10 2 + 10 8 9 1 + 11 10 1 ar + 12 2 1 ar + 13 2 12 1 + 14 13 12 ar + 15 1 15 1 + 16 12 14 ar + 17 15 16 1 + 18 16 17 1 + 19 22 21 1 + 20 20 21 1 + 21 20 19 2 + 22 21 23 2 + 23 17 18 1 + 24 18 19 1 + 25 19 26 1 + 26 23 25 1 + 27 23 24 1 + 28 26 24 2 +########## Name: lig_50 +########## Vina_BE: -4.862 +########## MW: 374.133 +########## clogP: 3.158 +########## nonHatoms: 27 +########## Vina_LE: -0.18 +########## Vina_LipE: -8.02 +########## Close_contacts: 0 +########## Hydrophob_contacts: 11 +########## HBonds: 0 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_50.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -27.4560 -7.7070 -21.7580 C.ar 1 UNL1 -0.1640 + 2 CA -27.9770 -7.4870 -20.4730 C.ar 1 UNL1 -0.0500 + 3 N -26.8950 -7.2830 -19.6020 N.ar 1 UNL1 -0.2090 + 4 C -25.7230 -7.4030 -20.3120 C.ar 1 UNL1 -0.0360 + 5 C -24.4160 -7.3000 -19.8220 C.2 1 UNL1 -0.0240 + 6 C -23.3590 -7.4850 -20.7330 C.2 1 UNL1 -0.0220 + 7 C -23.6340 -7.7740 -22.0890 C.2 1 UNL1 -0.0480 + 8 C -24.9620 -7.8750 -22.5530 C.2 1 UNL1 0.0590 + 9 CL -25.2250 -8.2680 -24.2400 Cl 1 UNL1 -0.1270 + 10 C -26.0080 -7.6710 -21.6290 C.ar 1 UNL1 -0.0630 + 11 H -27.0100 -7.1070 -18.6150 H 1 UNL1 0.3140 + 12 C -29.3900 -7.4560 -19.9940 C.2 1 UNL1 0.9330 + 13 OXT -29.7980 -6.3680 -19.6130 O.co2 1 UNL1 -0.8180 + 14 O -30.0770 -8.4640 -19.9580 O.co2 1 UNL1 -0.8180 + 15 C -28.3070 -7.9280 -22.9880 C.3 1 UNL1 0.1110 + 16 C -28.9310 -6.6100 -23.5150 C.3 1 UNL1 -0.0170 + 17 C -28.0110 -5.8780 -24.5110 C.3 1 UNL1 0.2780 + 18 O -27.7800 -4.5400 -24.0280 O.2 1 UNL1 -0.3480 + 19 C -26.8860 -4.3150 -23.0110 C.2 1 UNL1 0.1430 + 20 C -25.5030 -4.3600 -23.2420 C.2 1 UNL1 -0.0060 + 21 C -24.5990 -4.1110 -22.1930 C.2 1 UNL1 -0.0430 + 22 C -23.1030 -4.1710 -22.4720 C.3 1 UNL1 0.0850 + 23 C -25.0950 -3.8050 -20.9060 C.2 1 UNL1 -0.0300 + 24 C -26.4870 -3.7430 -20.6760 C.2 1 UNL1 -0.0430 + 25 CL -23.9760 -3.4910 -19.5880 Cl 1 UNL1 -0.1380 + 26 C -27.3750 -3.9950 -21.7390 C.2 1 UNL1 -0.0060 + 27 C -27.0430 -3.4010 -19.3000 C.3 1 UNL1 0.0850 +@BOND + 1 17 18 1 + 2 17 16 1 + 3 9 8 1 + 4 18 19 1 + 5 16 15 1 + 6 20 19 2 + 7 20 21 1 + 8 19 26 1 + 9 15 1 1 + 10 8 7 2 + 11 8 10 1 + 12 22 21 1 + 13 21 23 2 + 14 7 6 1 + 15 1 10 ar + 16 1 2 ar + 17 26 24 2 + 18 10 4 ar + 19 23 24 1 + 20 23 25 1 + 21 6 5 2 + 22 24 27 1 + 23 2 12 1 + 24 2 3 ar + 25 4 5 1 + 26 4 3 ar + 27 12 14 ar + 28 12 13 ar + 29 3 11 1 +########## Name: lig_52 +########## Vina_BE: -6.737 +########## MW: 362.122 +########## clogP: 1.35 +########## nonHatoms: 26 +########## Vina_LE: -0.259 +########## Vina_LipE: -8.087 +########## Close_contacts: 0 +########## Hydrophob_contacts: 13 +########## HBonds: 2 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_52.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -25.5380 -7.3540 -22.6210 C.ar 1 UNL1 -0.1740 + 2 CA -24.4210 -8.0600 -23.2220 C.ar 1 UNL1 0.0510 + 3 N -24.8760 -8.9370 -24.2110 N.ar 1 UNL1 -0.2090 + 4 C -26.2470 -8.7740 -24.2920 C.ar 1 UNL1 -0.0400 + 5 C -27.1310 -9.3950 -25.1830 C.2 1 UNL1 -0.0230 + 6 C -28.4950 -9.0460 -25.1080 C.2 1 UNL1 -0.1420 + 7 CL -29.6420 -9.7870 -26.2020 Cl 1 UNL1 -0.1430 + 8 C -28.9400 -8.0940 -24.1660 C.2 1 UNL1 -0.0570 + 9 C -28.0290 -7.4830 -23.2810 C.2 1 UNL1 0.1800 + 10 C -26.6780 -7.8460 -23.3660 C.ar 1 UNL1 -0.0600 + 11 H -24.2710 -9.5170 -24.7730 H 1 UNL1 0.3140 + 12 C -22.9650 -7.9240 -22.9260 C.2 1 UNL1 0.8390 + 13 OXT -22.1870 -7.5530 -23.7900 O.co2 1 UNL1 -0.8100 + 14 O -22.6130 -8.2240 -21.7950 O.co2 1 UNL1 -0.8100 + 15 C -25.4110 -6.2740 -21.5750 C.3 1 UNL1 0.1160 + 16 C -26.2980 -6.5490 -20.3380 C.3 1 UNL1 0.0410 + 17 C -27.2950 -5.4100 -20.0430 C.3 1 UNL1 0.2120 + 18 O -28.3730 -5.9420 -19.2480 O.2 1 UNL1 -0.3330 + 19 C -29.1530 -7.0050 -19.6450 C.2 1 UNL1 0.1530 + 20 C -30.1440 -6.7580 -20.6060 C.2 1 UNL1 -0.0300 + 21 C -30.9970 -7.7880 -21.0440 C.2 1 UNL1 -0.0340 + 22 C -32.0680 -7.4930 -22.0830 C.3 1 UNL1 0.0910 + 23 C -30.8480 -9.0810 -20.5020 C.2 1 UNL1 -0.0280 + 24 C -29.8640 -9.3320 -19.5320 C.2 1 UNL1 0.0370 + 25 CL -31.8800 -10.4050 -21.0090 Cl 1 UNL1 -0.1260 + 26 C -29.0170 -8.2970 -19.1000 C.2 1 UNL1 -0.0160 +@BOND + 1 7 6 1 + 2 5 6 1 + 3 5 4 2 + 4 6 8 2 + 5 11 3 1 + 6 4 3 ar + 7 4 10 ar + 8 3 2 ar + 9 8 9 1 + 10 13 12 ar + 11 10 9 2 + 12 10 1 ar + 13 2 12 1 + 14 2 1 ar + 15 12 14 ar + 16 1 15 1 + 17 22 21 1 + 18 15 16 1 + 19 21 20 1 + 20 21 23 2 + 21 25 23 1 + 22 20 19 2 + 23 23 24 1 + 24 16 17 1 + 25 17 18 1 + 26 19 18 1 + 27 19 26 1 + 28 24 26 2 +########## Name: lig_53 +########## Vina_BE: -6.631 +########## MW: 374.133 +########## clogP: 1.505 +########## nonHatoms: 27 +########## Vina_LE: -0.246 +########## Vina_LipE: -8.136 +########## Close_contacts: 2 +########## Hydrophob_contacts: 11 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_53.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -24.1290 -8.5720 -24.5670 C.ar 1 UNL1 -0.1640 + 2 CA -24.0950 -9.4550 -25.6560 C.ar 1 UNL1 -0.0500 + 3 N -25.4240 -9.7270 -26.0270 N.ar 1 UNL1 -0.2090 + 4 C -26.2710 -9.0410 -25.1830 C.ar 1 UNL1 -0.0360 + 5 C -27.6710 -9.0250 -25.1730 C.2 1 UNL1 -0.0240 + 6 C -28.3080 -8.2410 -24.1910 C.2 1 UNL1 -0.1370 + 7 CL -30.0560 -8.1790 -24.1250 Cl 1 UNL1 -0.1270 + 8 C -27.5450 -7.5040 -23.2570 C.2 1 UNL1 -0.0580 + 9 C -26.1350 -7.5450 -23.2950 C.2 1 UNL1 0.1840 + 10 C -25.5240 -8.3300 -24.2820 C.ar 1 UNL1 -0.0630 + 11 H -25.6740 -10.3420 -26.7880 H 1 UNL1 0.3140 + 12 C -22.9200 -10.0560 -26.3530 C.2 1 UNL1 0.9330 + 13 O -22.6850 -11.2520 -26.2800 O.co2 1 UNL1 -0.8180 + 14 OXT -22.2320 -9.2840 -27.0040 O.co2 1 UNL1 -0.8180 + 15 C -22.9140 -8.0370 -23.8520 C.3 1 UNL1 0.1110 + 16 C -22.9760 -8.2920 -22.3250 C.3 1 UNL1 -0.0170 + 17 C -22.7100 -7.0160 -21.5010 C.3 1 UNL1 0.2780 + 18 O -23.3470 -7.1550 -20.2150 O.2 1 UNL1 -0.3480 + 19 C -24.6840 -6.8740 -20.0710 C.2 1 UNL1 0.1430 + 20 C -25.2050 -5.6200 -20.4280 C.2 1 UNL1 -0.0060 + 21 C -26.5790 -5.3570 -20.2880 C.2 1 UNL1 -0.0430 + 22 C -27.1160 -3.9850 -20.6750 C.3 1 UNL1 0.0850 + 23 C -27.4350 -6.3690 -19.7980 C.2 1 UNL1 -0.0300 + 24 C -26.9150 -7.6360 -19.4570 C.2 1 UNL1 -0.0430 + 25 CL -29.1550 -6.0520 -19.6220 Cl 1 UNL1 -0.1380 + 26 C -25.5370 -7.8800 -19.6030 C.2 1 UNL1 -0.0060 + 27 C -27.8230 -8.7430 -18.9370 C.3 1 UNL1 0.0850 +@BOND + 1 14 12 ar + 2 11 3 1 + 3 12 13 ar + 4 12 2 1 + 5 3 2 ar + 6 3 4 ar + 7 2 1 ar + 8 4 5 2 + 9 4 10 ar + 10 5 6 1 + 11 1 10 ar + 12 1 15 1 + 13 10 9 2 + 14 6 7 1 + 15 6 8 2 + 16 15 16 1 + 17 9 8 1 + 18 16 17 1 + 19 17 18 1 + 20 22 21 1 + 21 20 21 1 + 22 20 19 2 + 23 21 23 2 + 24 18 19 1 + 25 19 26 1 + 26 23 25 1 + 27 23 24 1 + 28 26 24 2 + 29 24 27 1 +########## Name: lig_56 +########## Vina_BE: -6.255 +########## MW: 349.683 +########## clogP: 0.609 +########## nonHatoms: 26 +########## Vina_LE: -0.241 +########## Vina_LipE: -6.864 +########## Close_contacts: 0 +########## Hydrophob_contacts: 17 +########## HBonds: 0 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +lig_56.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -25.2570 -6.6960 -19.9850 C.ar 1 UNL1 -0.1970 + 2 C -25.4240 -5.3110 -20.4070 C.ar 1 UNL1 0.0660 + 3 N -26.7980 -4.9780 -20.4060 N.ar 1 UNL1 -0.0970 + 4 C -27.4130 -3.7030 -20.8050 C.3 1 UNL1 0.1750 + 5 C -27.4810 -6.1030 -19.9560 C.ar 1 UNL1 -0.0460 + 6 C -28.8610 -6.2550 -19.7360 C.2 1 UNL1 -0.0230 + 7 C -29.3260 -7.4920 -19.2470 C.2 1 UNL1 -0.0410 + 8 C -28.4220 -8.5440 -18.9820 C.2 1 UNL1 -0.0640 + 9 C -27.0430 -8.3690 -19.2080 C.2 1 UNL1 0.0090 + 10 C -26.6010 -7.1340 -19.7000 C.ar 1 UNL1 -0.0690 + 11 C -24.3260 -4.3540 -20.7790 C.2 1 UNL1 0.8400 + 12 O -24.0820 -4.1240 -21.9530 O.co2 1 UNL1 -0.8120 + 13 O -23.6650 -3.8360 -19.8890 O.co2 1 UNL1 -0.8120 + 14 C -23.9390 -7.4200 -19.8530 C.3 1 UNL1 0.0980 + 15 C -23.1090 -7.3720 -21.1560 C.3 1 UNL1 0.0270 + 16 C -23.6520 -8.2960 -22.2640 C.3 1 UNL1 0.2560 + 17 O -24.4680 -7.5130 -23.1570 O.2 1 UNL1 -0.3370 + 18 C -25.5920 -8.0230 -23.7650 C.2 1 UNL1 0.1610 + 19 C -26.8120 -7.9050 -23.0880 C.2 1 UNL1 -0.0360 + 20 C -27.9980 -8.4030 -23.6550 C.2 1 UNL1 -0.0350 + 21 C -29.3060 -8.2780 -22.8870 C.3 1 UNL1 0.0850 + 22 C -27.9540 -9.0160 -24.9260 C.2 1 UNL1 -0.0350 + 23 C -26.7290 -9.1310 -25.6180 C.2 1 UNL1 -0.0350 + 24 CL -29.4320 -9.6350 -25.6510 Cl 1 UNL1 -0.1280 + 25 C -25.5510 -8.6340 -25.0300 C.2 1 UNL1 -0.0360 + 26 C -26.6620 -9.7870 -26.9910 C.3 1 UNL1 0.0850 +@BOND + 1 26 23 1 + 2 24 22 1 + 3 23 25 1 + 4 23 22 2 + 5 25 18 2 + 6 22 20 1 + 7 18 17 1 + 8 18 19 1 + 9 20 19 2 + 10 20 21 1 + 11 17 16 1 + 12 16 15 1 + 13 12 11 ar + 14 15 14 1 + 15 4 3 1 + 16 11 2 1 + 17 11 13 ar + 18 2 3 ar + 19 2 1 ar + 20 3 5 ar + 21 1 14 1 + 22 1 10 ar + 23 5 6 2 + 24 5 10 ar + 25 6 7 1 + 26 10 9 2 + 27 7 8 2 + 28 9 8 1 +########## Name: lig_58 +########## Vina_BE: -5.485 +########## MW: 385.136 +########## clogP: 1.372 +########## nonHatoms: 27 +########## Vina_LE: -0.203 +########## Vina_LipE: -6.857 +########## Close_contacts: 0 +########## Hydrophob_contacts: 11 +########## HBonds: 0 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_58.pdbqt + 27 29 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -29.9220 -8.0590 -23.0000 C.ar 1 UNL1 -0.1800 + 2 C -30.7460 -7.0590 -23.6690 C.ar 1 UNL1 0.0600 + 3 N -29.9170 -6.1440 -24.3550 N.ar 1 UNL1 -0.0930 + 4 C -30.3320 -4.9910 -25.1690 C.3 1 UNL1 0.1810 + 5 C -28.6040 -6.5390 -24.1150 C.ar 1 UNL1 -0.0420 + 6 C -27.4170 -5.9350 -24.5650 C.2 1 UNL1 0.0010 + 7 C -26.1910 -6.5140 -24.1830 C.2 1 UNL1 0.0120 + 8 CL -24.6880 -5.7940 -24.7210 Cl 1 UNL1 -0.1500 + 9 C -26.1610 -7.6650 -23.3680 C.2 1 UNL1 -0.0410 + 10 C -27.3630 -8.2530 -22.9260 C.2 1 UNL1 0.0370 + 11 C -28.5730 -7.6640 -23.3190 C.ar 1 UNL1 -0.0650 + 12 C -32.2480 -6.9800 -23.6450 C.2 1 UNL1 0.8390 + 13 O -32.8650 -7.1320 -24.6880 O.co2 1 UNL1 -0.8140 + 14 O -32.8390 -6.7580 -22.5990 O.co2 1 UNL1 -0.8140 + 15 C -30.4490 -9.1900 -22.1530 C.3 1 UNL1 0.1100 + 16 C -30.8350 -8.7200 -20.7280 C.3 1 UNL1 -0.0230 + 17 C -29.7880 -9.1130 -19.6680 C.3 1 UNL1 0.2740 + 18 O -29.3210 -7.9200 -19.0070 O.2 1 UNL1 -0.3490 + 19 C -28.1970 -7.2720 -19.4570 C.2 1 UNL1 0.1360 + 20 C -28.2810 -6.0240 -20.0950 C.2 1 UNL1 -0.0030 + 21 C -27.1170 -5.3710 -20.5360 C.2 1 UNL1 -0.0420 + 22 C -27.2410 -4.0230 -21.2330 C.3 1 UNL1 0.0890 + 23 C -25.8580 -5.9730 -20.3220 C.2 1 UNL1 -0.0280 + 24 C -25.7680 -7.2200 -19.6640 C.2 1 UNL1 -0.0420 + 25 CL -24.3950 -5.1650 -20.8670 Cl 1 UNL1 -0.1370 + 26 C -26.9450 -7.8580 -19.2310 C.2 1 UNL1 -0.0030 + 27 C -24.4200 -7.8810 -19.4130 C.3 1 UNL1 0.0890 +@BOND + 1 4 3 1 + 2 8 7 1 + 3 13 12 ar + 4 6 7 1 + 5 6 5 2 + 6 3 5 ar + 7 3 2 ar + 8 7 9 2 + 9 5 11 ar + 10 2 12 1 + 11 2 1 ar + 12 12 14 ar + 13 9 10 1 + 14 11 1 ar + 15 11 10 2 + 16 1 15 1 + 17 15 16 1 + 18 22 21 1 + 19 25 23 1 + 20 16 17 1 + 21 21 23 2 + 22 21 20 1 + 23 23 24 1 + 24 20 19 2 + 25 17 18 1 + 26 24 27 1 + 27 24 26 2 + 28 19 26 1 + 29 19 18 1 +########## Name: lig_60 +########## Vina_BE: -5.386 +########## MW: 355.73 +########## clogP: 1.475 +########## nonHatoms: 25 +########## Vina_LE: -0.215 +########## Vina_LipE: -6.861 +########## Close_contacts: 0 +########## Hydrophob_contacts: 13 +########## HBonds: 0 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_60.pdbqt + 25 27 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -30.4450 -8.9760 -22.1980 C.3 1 UNL1 0.0980 + 2 C -29.9400 -7.8450 -23.0690 C.ar 1 UNL1 -0.1170 + 3 C -30.7800 -6.9440 -23.7380 C.ar 1 UNL1 -0.0730 + 4 S -29.8890 -5.7030 -24.6640 S.2 1 UNL1 0.0590 + 5 C -28.3670 -6.4520 -24.1790 C.ar 1 UNL1 -0.1180 + 6 C -27.0890 -6.0260 -24.5720 C.2 1 UNL1 0.0270 + 7 C -28.5420 -7.5460 -23.3510 C.ar 1 UNL1 -0.0690 + 8 C -25.9650 -6.7390 -24.1170 C.2 1 UNL1 -0.0420 + 9 C -26.1350 -7.8570 -23.2760 C.2 1 UNL1 -0.0390 + 10 C -27.4250 -8.2630 -22.8880 C.2 1 UNL1 0.0130 + 11 C -32.2700 -6.9230 -23.7560 C.2 1 UNL1 0.9090 + 12 O -32.9100 -6.7320 -22.7340 O.co2 1 UNL1 -0.8140 + 13 O -32.8220 -7.1380 -24.8240 O.co2 1 UNL1 -0.8140 + 14 C -30.8150 -8.5100 -20.7690 C.3 1 UNL1 0.0340 + 15 C -29.8690 -9.0610 -19.6830 C.3 1 UNL1 0.2510 + 16 O -29.2900 -7.9470 -18.9780 O.2 1 UNL1 -0.3350 + 17 C -28.1450 -7.3150 -19.4040 C.2 1 UNL1 0.1600 + 18 C -28.2800 -6.0680 -20.0230 C.2 1 UNL1 -0.0360 + 19 C -27.1510 -5.3720 -20.4900 C.2 1 UNL1 -0.0340 + 20 C -27.3330 -4.0270 -21.1810 C.3 1 UNL1 0.0860 + 21 C -25.8690 -5.9350 -20.3140 C.2 1 UNL1 -0.0340 + 22 C -25.7250 -7.1880 -19.6800 C.2 1 UNL1 -0.0340 + 23 CL -24.4480 -5.0710 -20.8860 Cl 1 UNL1 -0.1270 + 24 C -26.8660 -7.8740 -19.2290 C.2 1 UNL1 -0.0360 + 25 C -24.3490 -7.8110 -19.4790 C.3 1 UNL1 0.0860 +@BOND + 1 13 11 ar + 2 4 5 ar + 3 4 3 ar + 4 6 5 2 + 5 6 8 1 + 6 5 7 ar + 7 8 9 2 + 8 11 3 1 + 9 11 12 ar + 10 3 2 ar + 11 7 2 ar + 12 7 10 2 + 13 9 10 1 + 14 2 1 1 + 15 1 14 1 + 16 20 19 1 + 17 23 21 1 + 18 14 15 1 + 19 19 21 2 + 20 19 18 1 + 21 21 22 1 + 22 18 17 2 + 23 15 16 1 + 24 22 25 1 + 25 22 24 2 + 26 17 24 1 + 27 17 16 1 +########## Name: lig_61 +########## Vina_BE: -5.888 +########## MW: 391.183 +########## clogP: 2.165 +########## nonHatoms: 26 +########## Vina_LE: -0.226 +########## Vina_LipE: -8.053 +########## Close_contacts: 1 +########## Hydrophob_contacts: 10 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_61.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -24.1060 -3.2900 -19.4420 C.ar 1 UNL1 -0.1210 + 2 C -24.4750 -2.5590 -18.3020 C.ar 1 UNL1 -0.3280 + 3 S -26.1140 -1.8910 -18.3730 S.2 1 UNL1 0.2480 + 4 C -26.2830 -2.5380 -20.0050 C.ar 1 UNL1 -0.0670 + 5 C -27.4240 -2.3560 -20.8000 C.2 1 UNL1 0.0330 + 6 C -27.4390 -2.8820 -22.1010 C.2 1 UNL1 -0.0310 + 7 C -26.3100 -3.5640 -22.5870 C.2 1 UNL1 -0.0180 + 8 C -25.1690 -3.7400 -21.7800 C.2 1 UNL1 0.0490 + 9 CL -23.8150 -4.5600 -22.5370 Cl 1 UNL1 -0.1180 + 10 C -25.1660 -3.2290 -20.4570 C.ar 1 UNL1 -0.0270 + 11 C -23.6970 -2.2820 -17.0670 C.2 1 UNL1 0.9220 + 12 O -24.1350 -2.7590 -16.0340 O.co2 1 UNL1 -0.8090 + 13 O -22.6970 -1.5860 -17.0860 O.co2 1 UNL1 -0.8090 + 14 C -22.7910 -4.0370 -19.5030 C.3 1 UNL1 0.1020 + 15 C -22.8670 -5.4170 -18.8040 C.3 1 UNL1 -0.0120 + 16 C -23.1400 -6.5640 -19.7960 C.3 1 UNL1 0.2760 + 17 O -24.1140 -7.4590 -19.2220 O.2 1 UNL1 -0.3520 + 18 C -25.3670 -7.5690 -19.7740 C.2 1 UNL1 0.1360 + 19 C -26.4840 -7.8850 -18.9840 C.2 1 UNL1 -0.0060 + 20 C -27.7610 -7.9780 -19.5670 C.2 1 UNL1 -0.0400 + 21 C -28.9540 -8.3310 -18.6880 C.3 1 UNL1 0.0910 + 22 C -27.9140 -7.7390 -20.9510 C.2 1 UNL1 -0.0280 + 23 C -26.7930 -7.4020 -21.7410 C.2 1 UNL1 -0.0400 + 24 CL -29.5060 -7.8500 -21.6890 Cl 1 UNL1 -0.1390 + 25 C -25.5250 -7.3160 -21.1410 C.2 1 UNL1 -0.0060 + 26 C -26.9380 -7.1290 -23.2330 C.3 1 UNL1 0.0910 +@BOND + 1 26 23 1 + 2 7 6 2 + 3 7 8 1 + 4 9 8 1 + 5 6 5 1 + 6 8 10 2 + 7 23 25 1 + 8 23 22 2 + 9 24 22 1 + 10 25 18 2 + 11 22 20 1 + 12 5 4 2 + 13 10 4 ar + 14 10 1 ar + 15 4 3 ar + 16 16 17 1 + 17 16 15 1 + 18 18 17 1 + 19 18 19 1 + 20 20 19 2 + 21 20 21 1 + 22 14 1 1 + 23 14 15 1 + 24 1 2 ar + 25 3 2 ar + 26 2 11 1 + 27 13 11 ar + 28 11 12 ar +########## Name: lig_63 +########## Vina_BE: -5.484 +########## MW: 391.183 +########## clogP: 2.239 +########## nonHatoms: 26 +########## Vina_LE: -0.211 +########## Vina_LipE: -7.723 +########## Close_contacts: 0 +########## Hydrophob_contacts: 11 +########## HBonds: 0 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_63.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -30.0430 -7.9170 -23.0270 C.ar 1 UNL1 -0.1210 + 2 C -30.9310 -7.0300 -23.6490 C.ar 1 UNL1 -0.3280 + 3 S -30.1360 -5.8270 -24.6870 S.2 1 UNL1 0.2480 + 4 C -28.5680 -6.5060 -24.2380 C.ar 1 UNL1 -0.0670 + 5 C -27.3190 -6.0380 -24.6760 C.2 1 UNL1 0.0330 + 6 C -26.1550 -6.6790 -24.2140 C.2 1 UNL1 -0.1500 + 7 CL -24.5820 -6.1170 -24.7390 Cl 1 UNL1 -0.1180 + 8 C -26.2520 -7.7670 -23.3270 C.2 1 UNL1 -0.0270 + 9 C -27.5140 -8.2220 -22.9000 C.2 1 UNL1 0.1770 + 10 C -28.6720 -7.5790 -23.3710 C.ar 1 UNL1 -0.0270 + 11 C -32.4090 -6.9740 -23.5380 C.2 1 UNL1 0.9220 + 12 O -33.0380 -7.1470 -24.5670 O.co2 1 UNL1 -0.8090 + 13 O -32.9490 -6.7420 -22.4710 O.co2 1 UNL1 -0.8090 + 14 C -30.4940 -9.0420 -22.1260 C.3 1 UNL1 0.1020 + 15 C -30.7870 -8.5420 -20.6930 C.3 1 UNL1 -0.0120 + 16 C -29.7880 -9.1050 -19.6660 C.3 1 UNL1 0.2760 + 17 O -29.2460 -8.0120 -18.9020 O.2 1 UNL1 -0.3520 + 18 C -28.1560 -7.3310 -19.3770 C.2 1 UNL1 0.1360 + 19 C -26.8840 -7.8950 -19.2300 C.2 1 UNL1 -0.0060 + 20 C -25.7460 -7.2210 -19.7100 C.2 1 UNL1 -0.0400 + 21 C -24.3700 -7.8470 -19.5280 C.3 1 UNL1 0.0910 + 22 C -25.9010 -5.9720 -20.3510 C.2 1 UNL1 -0.0280 + 23 C -27.1840 -5.4040 -20.5060 C.2 1 UNL1 -0.0400 + 24 CL -24.4870 -5.1200 -20.9580 Cl 1 UNL1 -0.1390 + 25 C -28.3090 -6.0930 -20.0150 C.2 1 UNL1 -0.0060 + 26 C -27.3710 -4.0590 -21.1950 C.3 1 UNL1 0.0910 +@BOND + 1 7 6 1 + 2 3 4 ar + 3 3 2 ar + 4 5 4 2 + 5 5 6 1 + 6 12 11 ar + 7 4 10 ar + 8 6 8 2 + 9 2 11 1 + 10 2 1 ar + 11 11 13 ar + 12 10 1 ar + 13 10 9 2 + 14 8 9 1 + 15 1 14 1 + 16 14 15 1 + 17 26 23 1 + 18 24 22 1 + 19 15 16 1 + 20 23 22 2 + 21 23 25 1 + 22 22 20 1 + 23 25 18 2 + 24 20 21 1 + 25 20 19 2 + 26 16 17 1 + 27 18 19 1 + 28 18 17 1 +########## Name: lig_65 +########## Vina_BE: -6.435 +########## MW: 391.183 +########## clogP: 2.165 +########## nonHatoms: 26 +########## Vina_LE: -0.247 +########## Vina_LipE: -8.6 +########## Close_contacts: 0 +########## Hydrophob_contacts: 19 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_65.pdbqt + 26 28 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -30.4660 -8.0790 -23.1870 C.ar 1 UNL1 -0.1210 + 2 C -29.4020 -7.9970 -24.0930 C.ar 1 UNL1 -0.3280 + 3 S -29.7040 -6.8890 -25.4520 S.2 1 UNL1 0.2480 + 4 C -31.3210 -6.5670 -24.8080 C.ar 1 UNL1 -0.0670 + 5 C -32.2910 -5.7280 -25.3850 C.2 1 UNL1 -0.0920 + 6 CL -31.9690 -4.8570 -26.8720 Cl 1 UNL1 -0.1180 + 7 C -33.5400 -5.5940 -24.7540 C.2 1 UNL1 -0.0250 + 8 C -33.8070 -6.2980 -23.5640 C.2 1 UNL1 -0.0270 + 9 C -32.8240 -7.1350 -23.0000 C.2 1 UNL1 0.1770 + 10 C -31.5760 -7.2550 -23.6360 C.ar 1 UNL1 -0.0270 + 11 C -28.1010 -8.7090 -24.0580 C.2 1 UNL1 0.9220 + 12 O -27.2080 -8.1830 -23.4180 O.co2 1 UNL1 -0.8090 + 13 O -27.9450 -9.7550 -24.6650 O.co2 1 UNL1 -0.8090 + 14 C -30.4250 -8.9300 -21.9400 C.3 1 UNL1 0.1020 + 15 C -30.4020 -8.0630 -20.6600 C.3 1 UNL1 -0.0120 + 16 C -29.6430 -8.7470 -19.5080 C.3 1 UNL1 0.2760 + 17 O -28.9680 -7.7340 -18.7360 O.2 1 UNL1 -0.3520 + 18 C -28.0200 -6.9320 -19.3200 C.2 1 UNL1 0.1360 + 19 C -26.8610 -7.5250 -19.8320 C.2 1 UNL1 -0.0060 + 20 C -25.8690 -6.7390 -20.4460 C.2 1 UNL1 -0.0400 + 21 C -24.6090 -7.4040 -20.9830 C.3 1 UNL1 0.0910 + 22 C -26.0580 -5.3430 -20.5520 C.2 1 UNL1 -0.0280 + 23 C -27.2320 -4.7430 -20.0440 C.2 1 UNL1 -0.0400 + 24 CL -24.8290 -4.3480 -21.3200 Cl 1 UNL1 -0.1390 + 25 C -28.2090 -5.5470 -19.4290 C.2 1 UNL1 -0.0060 + 26 C -27.4560 -3.2410 -20.1510 C.3 1 UNL1 0.0910 +@BOND + 1 6 5 1 + 2 3 4 ar + 3 3 2 ar + 4 5 4 2 + 5 5 7 1 + 6 4 10 ar + 7 7 8 2 + 8 13 11 ar + 9 2 11 1 + 10 2 1 ar + 11 11 12 ar + 12 10 1 ar + 13 10 9 2 + 14 8 9 1 + 15 1 14 1 + 16 14 15 1 + 17 24 22 1 + 18 21 20 1 + 19 15 16 1 + 20 22 20 2 + 21 22 23 1 + 22 20 19 1 + 23 26 23 1 + 24 23 25 2 + 25 19 18 2 + 26 16 17 1 + 27 25 18 1 + 28 18 17 1 +########## Name: lig_67 +########## Vina_BE: -6.445 +########## MW: 339.665 +########## clogP: 2.551 +########## nonHatoms: 25 +########## Vina_LE: -0.258 +########## Vina_LipE: -8.996 +########## Close_contacts: 1 +########## Hydrophob_contacts: 13 +########## HBonds: 1 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 0 +@MOLECULE +lig_67.pdbqt + 25 27 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -22.4040 -4.2440 -19.0920 C.3 1 UNL1 0.0980 + 2 C -23.5700 -3.3900 -18.6680 C.ar 1 UNL1 -0.2120 + 3 C -23.5980 -2.5380 -17.4900 C.ar 1 UNL1 0.0090 + 4 O -24.8010 -1.8660 -17.3840 O.2 1 UNL1 0.0590 + 5 C -25.5490 -2.2510 -18.4690 C.ar 1 UNL1 -0.1550 + 6 C -26.8430 -1.8280 -18.8000 C.2 1 UNL1 0.0130 + 7 C -24.8640 -3.1520 -19.2600 C.ar 1 UNL1 -0.0580 + 8 C -27.4340 -2.3470 -19.9700 C.2 1 UNL1 -0.0330 + 9 C -26.7310 -3.2680 -20.7800 C.2 1 UNL1 -0.0480 + 10 C -25.4290 -3.6790 -20.4270 C.2 1 UNL1 0.0180 + 11 C -22.5510 -2.3140 -16.4560 C.2 1 UNL1 0.9360 + 12 O -22.1380 -1.1860 -16.2300 O.co2 1 UNL1 -0.7970 + 13 O -22.1370 -3.2860 -15.8430 O.co2 1 UNL1 -0.7970 + 14 C -22.5810 -5.7250 -18.6710 C.3 1 UNL1 -0.0200 + 15 C -23.1150 -6.6070 -19.8150 C.3 1 UNL1 0.2790 + 16 O -24.1040 -7.5110 -19.2830 O.2 1 UNL1 -0.3530 + 17 C -25.3740 -7.5320 -19.8030 C.2 1 UNL1 0.1350 + 18 C -26.4770 -7.8840 -19.0080 C.2 1 UNL1 -0.0070 + 19 C -27.7730 -7.8850 -19.5520 C.2 1 UNL1 -0.0400 + 20 C -28.9490 -8.2770 -18.6680 C.3 1 UNL1 0.0930 + 21 C -27.9610 -7.5180 -20.9030 C.2 1 UNL1 -0.0270 + 22 C -26.8540 -7.1460 -21.6990 C.2 1 UNL1 -0.0400 + 23 CL -29.5770 -7.5140 -21.5950 Cl 1 UNL1 -0.1370 + 24 C -25.5650 -7.1540 -21.1370 C.2 1 UNL1 -0.0070 + 25 C -27.0370 -6.7370 -23.1550 C.3 1 UNL1 0.0930 +@BOND + 1 25 22 1 + 2 22 24 1 + 3 22 21 2 + 4 23 21 1 + 5 24 17 2 + 6 21 19 1 + 7 9 10 2 + 8 9 8 1 + 9 10 7 1 + 10 8 6 2 + 11 15 16 1 + 12 15 14 1 + 13 17 16 1 + 14 17 18 1 + 15 19 18 2 + 16 19 20 1 + 17 7 2 ar + 18 7 5 ar + 19 1 14 1 + 20 1 2 1 + 21 6 5 1 + 22 2 3 ar + 23 5 4 ar + 24 3 4 ar + 25 3 11 1 + 26 11 12 ar + 27 11 13 ar +########## Name: ligand +########## Vina_BE: -6.847 +########## MW: 373.704 +########## clogP: 1.841 +########## nonHatoms: 28 +########## Vina_LE: -0.245 +########## Vina_LipE: -8.688 +########## Close_contacts: 0 +########## Hydrophob_contacts: 14 +########## HBonds: 0 +########## Salt_Bridges: 0 +########## Pi-Pi_Parallel: 0 +########## Pi-Pi_Perpendicular: 0 +########## Pi-Cation: 0 +########## Halogen_Bonds: 1 +@MOLECULE +ligand.pdbqt + 28 32 0 0 0 +SMALL +GASTEIGER + +@ATOM + 1 C -33.5170 -6.4800 -23.7370 C.2 1 UNL1 0.0110 + 2 C -33.9180 -6.5510 -25.0870 C.2 1 UNL1 0.0120 + 3 C -33.0480 -7.0700 -26.0630 C.2 1 UNL1 0.0160 + 4 C -26.1940 -7.1710 -21.5300 C.2 1 UNL1 0.0190 + 5 C -25.9500 -7.3520 -20.1520 C.2 1 UNL1 -0.1150 + 6 C -27.0050 -7.7900 -19.3320 C.2 1 UNL1 0.0410 + 7 C -28.2670 -8.0570 -19.8830 C.2 1 UNL1 -0.0250 + 8 C -29.8680 -8.9690 -22.9550 C.3 1 UNL1 0.2580 + 9 C -29.0170 -6.7660 -23.9490 C.3 1 UNL1 0.3010 + 10 C -27.4600 -7.4160 -22.1100 C.2 1 UNL1 0.0750 + 11 C -28.4980 -7.8860 -21.2560 C.2 1 UNL1 0.0310 + 12 C -29.9710 -7.9740 -24.1370 C.3 1 UNL1 -0.0410 + 13 C -30.6960 -8.0980 -26.5340 C.3 1 UNL1 0.0590 + 14 N -27.6750 -7.1660 -23.4810 N.pl3 1 UNL1 -0.6510 + 15 O -29.7500 -8.2600 -21.7100 O.2 1 UNL1 -0.3510 + 16 C -31.7810 -7.5150 -25.6620 C.2 1 UNL1 -0.0810 + 17 C -31.3840 -7.4530 -24.3330 C.2 1 UNL1 -0.0680 + 18 C -32.2390 -6.9300 -23.3510 C.2 1 UNL1 0.0660 + 19 CL -35.5080 -5.9860 -25.5530 Cl 1 UNL1 -0.1220 + 20 C -29.7150 -8.7020 -25.4960 C.3 1 UNL1 0.0350 + 21 C -24.5810 -7.0750 -19.5660 C.2 1 UNL1 0.9090 + 22 O -24.0790 -7.9320 -18.8540 O.co2 1 UNL1 -0.8300 + 23 O -24.0430 -6.0130 -19.8370 O.co2 1 UNL1 -0.8300 + 24 C -26.5760 -6.9510 -24.4470 C.3 1 UNL1 0.3130 + 25 C -25.9390 -8.2640 -24.9470 C.3 1 UNL1 -0.0270 + 26 C -25.3400 -8.2760 -26.3930 C.3 1 UNL1 0.0090 + 27 C -24.3650 -9.3720 -25.8540 C.3 1 UNL1 -0.0210 + 28 C -24.4880 -8.6320 -24.4840 C.3 1 UNL1 0.0090 +@BOND + 1 13 16 1 + 2 13 20 1 + 3 26 27 1 + 4 26 25 1 + 5 3 16 2 + 6 3 2 1 + 7 27 28 1 + 8 16 17 1 + 9 19 2 1 + 10 20 12 1 + 11 2 1 2 + 12 25 28 1 + 13 25 24 1 + 14 24 14 1 + 15 17 12 1 + 16 17 18 2 + 17 12 9 1 + 18 12 8 1 + 19 9 14 1 + 20 1 18 1 + 21 14 10 1 + 22 8 15 1 + 23 10 4 2 + 24 10 11 1 + 25 15 11 1 + 26 4 5 1 + 27 11 7 2 + 28 5 21 1 + 29 5 6 2 + 30 7 6 1 + 31 23 21 ar + 32 21 22 ar diff --git a/receptor/6o6f_wt_H.pdb b/receptor/6o6f_wt_H.pdb new file mode 100644 index 0000000..a755018 --- /dev/null +++ b/receptor/6o6f_wt_H.pdb @@ -0,0 +1,2429 @@ +HELIX 1 1 GLU 173 THR 191 1 19 +HELIX 2 2 GLY 203 ASN 223 1 21 +HELIX 3 3 GLU 225 LEU 235 1 11 +HELIX 4 4 GLU 240 SER 255 1 16 +HELIX 5 5 TRP 261 THR 280 1 20 +HELIX 6 6 GLU 284 THR 301 1 18 +HELIX 7 7 ARG 303 LYS 308 1 6 +HELIX 8 8 GLY 311 PHE 319 1 9 +ATOM 1 N SER 171 -23.840 -34.508 -6.167 1.00 0.00 N +ATOM 2 H1 SER 171 -24.073 -34.914 -5.272 1.00 0.00 H +ATOM 3 H2 SER 171 -23.979 -34.837 -5.236 1.00 0.00 H +ATOM 4 H3 SER 171 -23.978 -35.254 -6.813 1.00 0.00 H +ATOM 5 CA SER 171 -24.823 -33.425 -6.454 1.00 0.00 C +ATOM 6 HA SER 171 -25.412 -33.750 -7.212 1.00 0.00 H +ATOM 7 CB SER 171 -25.708 -33.194 -5.243 1.00 0.00 C +ATOM 8 HB2 SER 171 -26.374 -32.476 -5.458 1.00 0.00 H +ATOM 9 HB3 SER 171 -26.200 -34.043 -5.033 1.00 0.00 H +ATOM 10 OG SER 171 -24.971 -32.802 -4.100 1.00 0.00 O +ATOM 11 HG SER 171 -24.797 -31.818 -4.136 1.00 0.00 H +ATOM 12 C SER 171 -24.177 -32.110 -6.883 1.00 0.00 C +ATOM 13 O SER 171 -22.964 -31.912 -6.751 1.00 0.00 O +ATOM 14 N ASP 172 -25.017 -31.207 -7.377 1.00 0.00 N +ATOM 15 H ASP 172 -26.019 -31.507 -7.379 1.00 0.00 H +ATOM 16 CA ASP 172 -24.576 -29.909 -7.873 1.00 0.00 C +ATOM 17 HA ASP 172 -23.602 -30.008 -8.149 1.00 0.00 H +ATOM 18 CB ASP 172 -25.432 -29.532 -9.076 1.00 0.00 C +ATOM 19 HB2 ASP 172 -25.664 -30.370 -9.561 1.00 0.00 H +ATOM 20 HB3 ASP 172 -26.258 -29.091 -8.739 1.00 0.00 H +ATOM 21 CG ASP 172 -24.727 -28.599 -10.018 1.00 0.00 C +ATOM 22 OD1 ASP 172 -23.703 -27.997 -9.623 1.00 0.00 O +ATOM 23 OD2 ASP 172 -25.214 -28.470 -11.157 1.00 0.00 O +ATOM 24 C ASP 172 -24.625 -28.796 -6.824 1.00 0.00 C +ATOM 25 O ASP 172 -25.612 -28.057 -6.729 1.00 0.00 O +ATOM 26 N GLU 173 -23.548 -28.683 -6.049 1.00 0.00 N +ATOM 27 H GLU 173 -22.790 -29.365 -6.257 1.00 0.00 H +ATOM 28 CA GLU 173 -23.453 -27.676 -4.995 1.00 0.00 C +ATOM 29 HA GLU 173 -24.232 -27.772 -4.359 1.00 0.00 H +ATOM 30 CB GLU 173 -22.200 -27.947 -4.155 1.00 0.00 C +ATOM 31 HB2 GLU 173 -22.347 -28.794 -3.669 1.00 0.00 H +ATOM 32 HB3 GLU 173 -21.435 -28.012 -4.775 1.00 0.00 H +ATOM 33 CG GLU 173 -21.879 -26.877 -3.134 1.00 0.00 C +ATOM 34 HG2 GLU 173 -21.026 -27.114 -2.693 1.00 0.00 H +ATOM 35 HG3 GLU 173 -21.810 -26.008 -3.602 1.00 0.00 H +ATOM 36 CD GLU 173 -22.924 -26.721 -2.045 1.00 0.00 C +ATOM 37 OE1 GLU 173 -23.943 -27.446 -2.041 1.00 0.00 O +ATOM 38 OE2 GLU 173 -22.734 -25.830 -1.194 1.00 0.00 O +ATOM 39 C GLU 173 -23.443 -26.240 -5.559 1.00 0.00 C +ATOM 40 O GLU 173 -24.129 -25.350 -5.049 1.00 0.00 O +ATOM 41 N LEU 174 -22.675 -26.019 -6.620 1.00 0.00 N +ATOM 42 H LEU 174 -22.143 -26.835 -6.959 1.00 0.00 H +ATOM 43 CA LEU 174 -22.619 -24.699 -7.230 1.00 0.00 C +ATOM 44 HA LEU 174 -22.328 -24.032 -6.531 1.00 0.00 H +ATOM 45 CB LEU 174 -21.586 -24.661 -8.357 1.00 0.00 C +ATOM 46 HB2 LEU 174 -20.686 -24.796 -7.952 1.00 0.00 H +ATOM 47 HB3 LEU 174 -21.794 -25.401 -8.988 1.00 0.00 H +ATOM 48 CG LEU 174 -21.530 -23.367 -9.171 1.00 0.00 C +ATOM 49 HG LEU 174 -22.441 -23.160 -9.522 1.00 0.00 H +ATOM 50 CD1 LEU 174 -21.054 -22.201 -8.293 1.00 0.00 C +ATOM 51 HD11 LEU 174 -20.143 -22.406 -7.942 1.00 0.00 H +ATOM 52 HD12 LEU 174 -21.025 -21.368 -8.842 1.00 0.00 H +ATOM 53 HD13 LEU 174 -21.690 -22.082 -7.533 1.00 0.00 H +ATOM 54 CD2 LEU 174 -20.605 -23.568 -10.350 1.00 0.00 C +ATOM 55 HD21 LEU 174 -20.947 -24.313 -10.927 1.00 0.00 H +ATOM 56 HD22 LEU 174 -20.559 -22.727 -10.893 1.00 0.00 H +ATOM 57 HD23 LEU 174 -19.686 -23.800 -10.025 1.00 0.00 H +ATOM 58 C LEU 174 -23.982 -24.270 -7.762 1.00 0.00 C +ATOM 59 O LEU 174 -24.374 -23.103 -7.633 1.00 0.00 O +ATOM 60 N TYR 175 -24.715 -25.192 -8.372 1.00 0.00 N +ATOM 61 H TYR 175 -24.296 -26.118 -8.460 1.00 0.00 H +ATOM 62 CA TYR 175 -26.039 -24.830 -8.864 1.00 0.00 C +ATOM 63 HA TYR 175 -25.951 -24.004 -9.436 1.00 0.00 H +ATOM 64 CB TYR 175 -26.649 -25.942 -9.716 1.00 0.00 C +ATOM 65 HB2 TYR 175 -26.023 -26.152 -10.448 1.00 0.00 H +ATOM 66 HB3 TYR 175 -26.811 -26.724 -9.137 1.00 0.00 H +ATOM 67 CG TYR 175 -27.958 -25.506 -10.312 1.00 0.00 C +ATOM 68 CD1 TYR 175 -27.995 -24.770 -11.495 1.00 0.00 C +ATOM 69 HD1 TYR 175 -27.147 -24.606 -12.002 1.00 0.00 H +ATOM 70 CE1 TYR 175 -29.191 -24.255 -11.988 1.00 0.00 C +ATOM 71 HE1 TYR 175 -29.198 -23.731 -12.840 1.00 0.00 H +ATOM 72 CZ TYR 175 -30.369 -24.474 -11.292 1.00 0.00 C +ATOM 73 OH TYR 175 -31.551 -23.926 -11.754 1.00 0.00 O +ATOM 74 HH TYR 175 -31.551 -23.947 -12.751 1.00 0.00 H +ATOM 75 CE2 TYR 175 -30.358 -25.213 -10.119 1.00 0.00 C +ATOM 76 HE2 TYR 175 -31.208 -25.379 -9.621 1.00 0.00 H +ATOM 77 CD2 TYR 175 -29.155 -25.724 -9.637 1.00 0.00 C +ATOM 78 HD2 TYR 175 -29.154 -26.257 -8.793 1.00 0.00 H +ATOM 79 C TYR 175 -26.995 -24.507 -7.714 1.00 0.00 C +ATOM 80 O TYR 175 -27.704 -23.510 -7.775 1.00 0.00 O +ATOM 81 N ARG 176 -27.007 -25.346 -6.679 1.00 0.00 N +ATOM 82 H ARG 176 -26.357 -26.148 -6.760 1.00 0.00 H +ATOM 83 CA ARG 176 -27.880 -25.122 -5.538 1.00 0.00 C +ATOM 84 HA ARG 176 -28.838 -25.126 -5.855 1.00 0.00 H +ATOM 85 CB ARG 176 -27.703 -26.232 -4.499 1.00 0.00 C +ATOM 86 HB2 ARG 176 -27.919 -27.104 -4.934 1.00 0.00 H +ATOM 87 HB3 ARG 176 -26.751 -26.231 -4.201 1.00 0.00 H +ATOM 88 CG ARG 176 -28.582 -26.093 -3.263 1.00 0.00 C +ATOM 89 HG2 ARG 176 -28.651 -25.127 -3.013 1.00 0.00 H +ATOM 90 HG3 ARG 176 -29.494 -26.450 -3.465 1.00 0.00 H +ATOM 91 CD ARG 176 -28.029 -26.853 -2.073 1.00 0.00 C +ATOM 92 HD2 ARG 176 -28.698 -26.811 -1.338 1.00 0.00 H +ATOM 93 HD3 ARG 176 -27.879 -27.797 -2.350 1.00 0.00 H +ATOM 94 NE ARG 176 -26.768 -26.279 -1.611 1.00 0.00 N +ATOM 95 HE ARG 176 -25.931 -26.828 -1.727 1.00 0.00 H +ATOM 96 CZ ARG 176 -26.649 -25.079 -1.047 1.00 0.00 C +ATOM 97 NH1 ARG 176 -25.462 -24.636 -0.662 1.00 0.00 N +ATOM 98 HH11 ARG 176 -24.638 -25.179 -0.804 1.00 0.00 H +ATOM 99 HH12 ARG 176 -25.387 -23.734 -0.219 1.00 0.00 H +ATOM 100 NH2 ARG 176 -27.717 -24.321 -0.856 1.00 0.00 N +ATOM 101 HH21 ARG 176 -28.617 -24.651 -1.158 1.00 0.00 H +ATOM 102 HH22 ARG 176 -27.634 -23.430 -0.418 1.00 0.00 H +ATOM 103 C ARG 176 -27.593 -23.783 -4.878 1.00 0.00 C +ATOM 104 O ARG 176 -28.505 -23.016 -4.554 1.00 0.00 O +ATOM 105 N GLN 177 -26.313 -23.517 -4.660 1.00 0.00 N +ATOM 106 H GLN 177 -25.654 -24.258 -4.972 1.00 0.00 H +ATOM 107 CA GLN 177 -25.894 -22.281 -4.034 1.00 0.00 C +ATOM 108 HA GLN 177 -26.375 -22.196 -3.149 1.00 0.00 H +ATOM 109 CB GLN 177 -24.390 -22.315 -3.808 1.00 0.00 C +ATOM 110 HB2 GLN 177 -24.174 -23.066 -3.180 1.00 0.00 H +ATOM 111 HB3 GLN 177 -23.935 -22.483 -4.686 1.00 0.00 H +ATOM 112 CG GLN 177 -23.831 -21.036 -3.224 1.00 0.00 C +ATOM 113 HG2 GLN 177 -23.923 -20.309 -3.898 1.00 0.00 H +ATOM 114 HG3 GLN 177 -24.344 -20.808 -2.401 1.00 0.00 H +ATOM 115 CD GLN 177 -22.379 -21.189 -2.867 1.00 0.00 C +ATOM 116 OE1 GLN 177 -21.604 -21.751 -3.639 1.00 0.00 O +ATOM 117 NE2 GLN 177 -21.996 -20.691 -1.694 1.00 0.00 N +ATOM 118 HE21 GLN 177 -21.032 -20.769 -1.378 1.00 0.00 H +ATOM 119 HE22 GLN 177 -22.690 -20.224 -1.110 1.00 0.00 H +ATOM 120 C GLN 177 -26.268 -21.070 -4.879 1.00 0.00 C +ATOM 121 O GLN 177 -26.763 -20.074 -4.355 1.00 0.00 O +ATOM 122 N SER 178 -26.034 -21.158 -6.184 1.00 0.00 N +ATOM 123 H SER 178 -25.612 -22.049 -6.496 1.00 0.00 H +ATOM 124 CA SER 178 -26.362 -20.057 -7.081 1.00 0.00 C +ATOM 125 HA SER 178 -25.897 -19.228 -6.744 1.00 0.00 H +ATOM 126 CB SER 178 -25.888 -20.374 -8.504 1.00 0.00 C +ATOM 127 HB2 SER 178 -26.337 -21.208 -8.813 1.00 0.00 H +ATOM 128 HB3 SER 178 -26.132 -19.613 -9.099 1.00 0.00 H +ATOM 129 OG SER 178 -24.482 -20.562 -8.549 1.00 0.00 O +ATOM 130 HG SER 178 -24.258 -21.476 -8.214 1.00 0.00 H +ATOM 131 C SER 178 -27.863 -19.774 -7.098 1.00 0.00 C +ATOM 132 O SER 178 -28.285 -18.616 -7.152 1.00 0.00 O +ATOM 133 N LEU 179 -28.669 -20.829 -7.054 1.00 0.00 N +ATOM 134 H LEU 179 -28.201 -21.744 -7.001 1.00 0.00 H +ATOM 135 CA LEU 179 -30.117 -20.652 -7.082 1.00 0.00 C +ATOM 136 HA LEU 179 -30.355 -20.079 -7.882 1.00 0.00 H +ATOM 137 CB LEU 179 -30.823 -21.998 -7.275 1.00 0.00 C +ATOM 138 HB2 LEU 179 -30.510 -22.388 -8.129 1.00 0.00 H +ATOM 139 HB3 LEU 179 -30.592 -22.578 -6.509 1.00 0.00 H +ATOM 140 CG LEU 179 -32.355 -21.915 -7.344 1.00 0.00 C +ATOM 141 HG LEU 179 -32.701 -21.589 -6.466 1.00 0.00 H +ATOM 142 CD1 LEU 179 -32.793 -20.955 -8.449 1.00 0.00 C +ATOM 143 HD11 LEU 179 -32.446 -21.281 -9.328 1.00 0.00 H +ATOM 144 HD12 LEU 179 -33.791 -20.915 -8.477 1.00 0.00 H +ATOM 145 HD13 LEU 179 -32.427 -20.044 -8.261 1.00 0.00 H +ATOM 146 CD2 LEU 179 -32.923 -23.296 -7.579 1.00 0.00 C +ATOM 147 HD21 LEU 179 -32.657 -23.905 -6.828 1.00 0.00 H +ATOM 148 HD22 LEU 179 -33.923 -23.249 -7.625 1.00 0.00 H +ATOM 149 HD23 LEU 179 -32.572 -23.666 -8.442 1.00 0.00 H +ATOM 150 C LEU 179 -30.643 -19.964 -5.827 1.00 0.00 C +ATOM 151 O LEU 179 -31.515 -19.100 -5.916 1.00 0.00 O +ATOM 152 N GLU 180 -30.114 -20.332 -4.664 1.00 0.00 N +ATOM 153 H GLU 180 -29.384 -21.055 -4.720 1.00 0.00 H +ATOM 154 CA GLU 180 -30.573 -19.723 -3.431 1.00 0.00 C +ATOM 155 HA GLU 180 -31.571 -19.818 -3.350 1.00 0.00 H +ATOM 156 CB GLU 180 -29.980 -20.469 -2.231 1.00 0.00 C +ATOM 157 HB2 GLU 180 -30.326 -21.392 -2.254 1.00 0.00 H +ATOM 158 HB3 GLU 180 -28.999 -20.442 -2.318 1.00 0.00 H +ATOM 159 CG GLU 180 -30.342 -19.873 -0.882 1.00 0.00 C +ATOM 160 HG2 GLU 180 -29.648 -19.218 -0.637 1.00 0.00 H +ATOM 161 HG3 GLU 180 -31.231 -19.455 -0.955 1.00 0.00 H +ATOM 162 CD GLU 180 -30.412 -20.902 0.231 1.00 0.00 C +ATOM 163 OE1 GLU 180 -29.479 -21.732 0.342 1.00 0.00 O +ATOM 164 OE2 GLU 180 -31.405 -20.868 1.003 1.00 0.00 O +ATOM 165 C GLU 180 -30.206 -18.237 -3.394 1.00 0.00 C +ATOM 166 O GLU 180 -31.022 -17.410 -3.014 1.00 0.00 O +ATOM 167 N ILE 181 -28.991 -17.898 -3.817 1.00 0.00 N +ATOM 168 H ILE 181 -28.400 -18.686 -4.133 1.00 0.00 H +ATOM 169 CA ILE 181 -28.557 -16.506 -3.821 1.00 0.00 C +ATOM 170 HA ILE 181 -28.724 -16.153 -2.890 1.00 0.00 H +ATOM 171 CB ILE 181 -27.079 -16.406 -4.239 1.00 0.00 C +ATOM 172 HB ILE 181 -26.977 -16.860 -5.115 1.00 0.00 H +ATOM 173 CG2 ILE 181 -26.670 -14.946 -4.374 1.00 0.00 C +ATOM 174 HG21 ILE 181 -25.720 -14.892 -4.676 1.00 0.00 H +ATOM 175 HG22 ILE 181 -27.257 -14.496 -5.045 1.00 0.00 H +ATOM 176 HG23 ILE 181 -26.764 -14.490 -3.491 1.00 0.00 H +ATOM 177 CG1 ILE 181 -26.205 -17.135 -3.221 1.00 0.00 C +ATOM 178 HG12 ILE 181 -26.169 -16.593 -2.387 1.00 0.00 H +ATOM 179 HG13 ILE 181 -26.625 -18.016 -3.019 1.00 0.00 H +ATOM 180 CD1 ILE 181 -24.790 -17.375 -3.713 1.00 0.00 C +ATOM 181 HD11 ILE 181 -24.357 -16.498 -3.912 1.00 0.00 H +ATOM 182 HD12 ILE 181 -24.272 -17.853 -3.006 1.00 0.00 H +ATOM 183 HD13 ILE 181 -24.819 -17.931 -4.542 1.00 0.00 H +ATOM 184 C ILE 181 -29.390 -15.639 -4.768 1.00 0.00 C +ATOM 185 O ILE 181 -29.881 -14.570 -4.388 1.00 0.00 O +ATOM 186 N ILE 182 -29.538 -16.098 -6.006 1.00 0.00 N +ATOM 187 H ILE 182 -29.087 -17.009 -6.196 1.00 0.00 H +ATOM 188 CA ILE 182 -30.293 -15.344 -7.008 1.00 0.00 C +ATOM 189 HA ILE 182 -29.944 -14.397 -6.971 1.00 0.00 H +ATOM 190 CB ILE 182 -30.077 -15.948 -8.418 1.00 0.00 C +ATOM 191 HB ILE 182 -30.270 -16.917 -8.367 1.00 0.00 H +ATOM 192 CG2 ILE 182 -31.002 -15.272 -9.432 1.00 0.00 C +ATOM 193 HG21 ILE 182 -30.867 -15.687 -10.329 1.00 0.00 H +ATOM 194 HG22 ILE 182 -31.950 -15.393 -9.146 1.00 0.00 H +ATOM 195 HG23 ILE 182 -30.787 -14.299 -9.477 1.00 0.00 H +ATOM 196 CG1 ILE 182 -28.607 -15.776 -8.836 1.00 0.00 C +ATOM 197 HG12 ILE 182 -28.430 -14.805 -8.974 1.00 0.00 H +ATOM 198 HG13 ILE 182 -28.030 -16.107 -8.092 1.00 0.00 H +ATOM 199 CD1 ILE 182 -28.233 -16.529 -10.110 1.00 0.00 C +ATOM 200 HD11 ILE 182 -28.798 -16.197 -10.861 1.00 0.00 H +ATOM 201 HD12 ILE 182 -27.270 -16.367 -10.312 1.00 0.00 H +ATOM 202 HD13 ILE 182 -28.392 -17.503 -9.970 1.00 0.00 H +ATOM 203 C ILE 182 -31.792 -15.266 -6.690 1.00 0.00 C +ATOM 204 O ILE 182 -32.411 -14.222 -6.884 1.00 0.00 O +ATOM 205 N SER 183 -32.364 -16.364 -6.197 1.00 0.00 N +ATOM 206 H SER 183 -31.726 -17.177 -6.091 1.00 0.00 H +ATOM 207 CA SER 183 -33.785 -16.407 -5.836 1.00 0.00 C +ATOM 208 HA SER 183 -34.316 -16.106 -6.633 1.00 0.00 H +ATOM 209 CB SER 183 -34.195 -17.822 -5.410 1.00 0.00 C +ATOM 210 HB2 SER 183 -33.678 -18.068 -4.594 1.00 0.00 H +ATOM 211 HB3 SER 183 -35.171 -17.819 -5.206 1.00 0.00 H +ATOM 212 OG SER 183 -33.934 -18.750 -6.427 1.00 0.00 O +ATOM 213 HG SER 183 -32.968 -19.016 -6.406 1.00 0.00 H +ATOM 214 C SER 183 -34.077 -15.447 -4.686 1.00 0.00 C +ATOM 215 O SER 183 -35.054 -14.693 -4.717 1.00 0.00 O +ATOM 216 N ARG 184 -33.228 -15.485 -3.665 1.00 0.00 N +ATOM 217 H ARG 184 -32.460 -16.164 -3.751 1.00 0.00 H +ATOM 218 CA ARG 184 -33.417 -14.602 -2.522 1.00 0.00 C +ATOM 219 HA ARG 184 -34.340 -14.751 -2.143 1.00 0.00 H +ATOM 220 CB ARG 184 -32.406 -14.909 -1.415 1.00 0.00 C +ATOM 221 HB2 ARG 184 -31.495 -14.916 -1.821 1.00 0.00 H +ATOM 222 HB3 ARG 184 -32.467 -14.186 -0.731 1.00 0.00 H +ATOM 223 CG ARG 184 -32.626 -16.236 -0.722 1.00 0.00 C +ATOM 224 HG2 ARG 184 -33.580 -16.493 -0.787 1.00 0.00 H +ATOM 225 HG3 ARG 184 -32.043 -16.926 -1.128 1.00 0.00 H +ATOM 226 CD ARG 184 -32.264 -16.113 0.746 1.00 0.00 C +ATOM 227 HD2 ARG 184 -31.310 -15.829 0.808 1.00 0.00 H +ATOM 228 HD3 ARG 184 -32.853 -15.418 1.153 1.00 0.00 H +ATOM 229 NE ARG 184 -32.439 -17.372 1.459 1.00 0.00 N +ATOM 230 HE ARG 184 -32.645 -18.196 0.918 1.00 0.00 H +ATOM 231 CZ ARG 184 -32.344 -17.503 2.777 1.00 0.00 C +ATOM 232 NH1 ARG 184 -32.079 -16.447 3.533 1.00 0.00 N +ATOM 233 HH11 ARG 184 -31.967 -15.541 3.135 1.00 0.00 H +ATOM 234 HH12 ARG 184 -31.990 -16.561 4.531 1.00 0.00 H +ATOM 235 NH2 ARG 184 -32.508 -18.695 3.339 1.00 0.00 N +ATOM 236 HH21 ARG 184 -32.723 -19.488 2.764 1.00 0.00 H +ATOM 237 HH22 ARG 184 -32.420 -18.802 4.326 1.00 0.00 H +ATOM 238 C ARG 184 -33.290 -13.134 -2.923 1.00 0.00 C +ATOM 239 O ARG 184 -34.059 -12.283 -2.466 1.00 0.00 O +ATOM 240 N TYR 185 -32.320 -12.830 -3.777 1.00 0.00 N +ATOM 241 H TYR 185 -31.741 -13.617 -4.093 1.00 0.00 H +ATOM 242 CA TYR 185 -32.137 -11.452 -4.202 1.00 0.00 C +ATOM 243 HA TYR 185 -32.029 -10.877 -3.383 1.00 0.00 H +ATOM 244 CB TYR 185 -30.880 -11.310 -5.074 1.00 0.00 C +ATOM 245 HB2 TYR 185 -30.112 -11.686 -4.573 1.00 0.00 H +ATOM 246 HB3 TYR 185 -31.031 -11.809 -5.917 1.00 0.00 H +ATOM 247 CG TYR 185 -30.570 -9.871 -5.419 1.00 0.00 C +ATOM 248 CD1 TYR 185 -30.431 -8.910 -4.413 1.00 0.00 C +ATOM 249 HD1 TYR 185 -30.515 -9.183 -3.455 1.00 0.00 H +ATOM 250 CE1 TYR 185 -30.178 -7.574 -4.723 1.00 0.00 C +ATOM 251 HE1 TYR 185 -30.077 -6.899 -3.995 1.00 0.00 H +ATOM 252 CZ TYR 185 -30.066 -7.189 -6.058 1.00 0.00 C +ATOM 253 OH TYR 185 -29.845 -5.870 -6.376 1.00 0.00 O +ATOM 254 HH TYR 185 -29.842 -5.326 -5.538 1.00 0.00 H +ATOM 255 CE2 TYR 185 -30.197 -8.120 -7.069 1.00 0.00 C +ATOM 256 HE2 TYR 185 -30.117 -7.847 -8.025 1.00 0.00 H +ATOM 257 CD2 TYR 185 -30.445 -9.460 -6.746 1.00 0.00 C +ATOM 258 HD2 TYR 185 -30.532 -10.128 -7.480 1.00 0.00 H +ATOM 259 C TYR 185 -33.360 -10.955 -4.969 1.00 0.00 C +ATOM 260 O TYR 185 -33.872 -9.872 -4.690 1.00 0.00 O +ATOM 261 N LEU 186 -33.840 -11.739 -5.933 1.00 0.00 N +ATOM 262 H LEU 186 -33.347 -12.629 -6.071 1.00 0.00 H +ATOM 263 CA LEU 186 -35.002 -11.314 -6.721 1.00 0.00 C +ATOM 264 HA LEU 186 -34.796 -10.410 -7.129 1.00 0.00 H +ATOM 265 CB LEU 186 -35.257 -12.282 -7.881 1.00 0.00 C +ATOM 266 HB2 LEU 186 -34.873 -13.166 -7.630 1.00 0.00 H +ATOM 267 HB3 LEU 186 -36.241 -12.357 -8.005 1.00 0.00 H +ATOM 268 CG LEU 186 -34.654 -11.889 -9.231 1.00 0.00 C +ATOM 269 HG LEU 186 -35.038 -11.015 -9.515 1.00 0.00 H +ATOM 270 CD1 LEU 186 -33.146 -11.763 -9.099 1.00 0.00 C +ATOM 271 HD11 LEU 186 -32.760 -12.639 -8.806 1.00 0.00 H +ATOM 272 HD12 LEU 186 -32.752 -11.506 -9.982 1.00 0.00 H +ATOM 273 HD13 LEU 186 -32.926 -11.061 -8.421 1.00 0.00 H +ATOM 274 CD2 LEU 186 -35.024 -12.920 -10.294 1.00 0.00 C +ATOM 275 HD21 LEU 186 -36.019 -12.966 -10.380 1.00 0.00 H +ATOM 276 HD22 LEU 186 -34.624 -12.652 -11.170 1.00 0.00 H +ATOM 277 HD23 LEU 186 -34.670 -13.816 -10.025 1.00 0.00 H +ATOM 278 C LEU 186 -36.268 -11.184 -5.879 1.00 0.00 C +ATOM 279 O LEU 186 -37.076 -10.276 -6.093 1.00 0.00 O +ATOM 280 N ARG 187 -36.440 -12.076 -4.913 1.00 0.00 N +ATOM 281 H ARG 187 -35.706 -12.783 -4.821 1.00 0.00 H +ATOM 282 CA ARG 187 -37.615 -11.988 -4.085 1.00 0.00 C +ATOM 283 HA ARG 187 -38.439 -11.913 -4.678 1.00 0.00 H +ATOM 284 CB ARG 187 -37.800 -13.281 -3.308 1.00 0.00 C +ATOM 285 HB2 ARG 187 -37.759 -14.036 -3.941 1.00 0.00 H +ATOM 286 HB3 ARG 187 -37.094 -13.340 -2.623 1.00 0.00 H +ATOM 287 CG ARG 187 -39.143 -13.318 -2.610 1.00 0.00 C +ATOM 288 HG2 ARG 187 -39.139 -12.689 -1.827 1.00 0.00 H +ATOM 289 HG3 ARG 187 -39.867 -13.037 -3.247 1.00 0.00 H +ATOM 290 CD ARG 187 -39.527 -14.716 -2.071 1.00 0.00 C +ATOM 291 HD2 ARG 187 -39.428 -15.360 -2.826 1.00 0.00 H +ATOM 292 HD3 ARG 187 -38.879 -14.939 -1.346 1.00 0.00 H +ATOM 293 NE ARG 187 -40.880 -14.758 -1.558 1.00 0.00 N +ATOM 294 HE ARG 187 -41.022 -15.060 -0.606 1.00 0.00 H +ATOM 295 CZ ARG 187 -41.962 -14.422 -2.263 1.00 0.00 C +ATOM 296 NH1 ARG 187 -41.866 -14.026 -3.524 1.00 0.00 N +ATOM 297 HH11 ARG 187 -40.975 -13.992 -3.976 1.00 0.00 H +ATOM 298 HH12 ARG 187 -42.689 -13.760 -4.030 1.00 0.00 H +ATOM 299 NH2 ARG 187 -43.169 -14.421 -1.700 1.00 0.00 N +ATOM 300 HH21 ARG 187 -43.253 -14.698 -0.737 1.00 0.00 H +ATOM 301 HH22 ARG 187 -43.969 -14.154 -2.221 1.00 0.00 H +ATOM 302 C ARG 187 -37.607 -10.776 -3.138 1.00 0.00 C +ATOM 303 O ARG 187 -38.623 -10.082 -2.999 1.00 0.00 O +ATOM 304 N GLU 188 -36.486 -10.498 -2.479 1.00 0.00 N +ATOM 305 H GLU 188 -35.700 -11.122 -2.635 1.00 0.00 H +ATOM 306 CA GLU 188 -36.463 -9.332 -1.590 1.00 0.00 C +ATOM 307 HA GLU 188 -37.257 -9.366 -0.968 1.00 0.00 H +ATOM 308 CB GLU 188 -35.257 -9.375 -0.649 1.00 0.00 C +ATOM 309 HB2 GLU 188 -35.354 -8.607 -0.018 1.00 0.00 H +ATOM 310 HB3 GLU 188 -35.314 -10.234 -0.143 1.00 0.00 H +ATOM 311 CG GLU 188 -33.914 -9.293 -1.280 1.00 0.00 C +ATOM 312 HG2 GLU 188 -33.715 -10.144 -1.726 1.00 0.00 H +ATOM 313 HG3 GLU 188 -33.892 -8.530 -1.896 1.00 0.00 H +ATOM 314 CD GLU 188 -32.836 -9.065 -0.246 1.00 0.00 C +ATOM 315 OE1 GLU 188 -32.857 -9.773 0.778 1.00 0.00 O +ATOM 316 OE2 GLU 188 -31.959 -8.199 -0.446 1.00 0.00 O +ATOM 317 C GLU 188 -36.491 -8.010 -2.371 1.00 0.00 C +ATOM 318 O GLU 188 -36.955 -6.991 -1.860 1.00 0.00 O +ATOM 319 N GLN 189 -35.996 -8.024 -3.606 1.00 0.00 N +ATOM 320 H GLN 189 -35.603 -8.921 -3.916 1.00 0.00 H +ATOM 321 CA GLN 189 -36.035 -6.818 -4.421 1.00 0.00 C +ATOM 322 HA GLN 189 -35.710 -6.055 -3.868 1.00 0.00 H +ATOM 323 CB GLN 189 -35.194 -7.003 -5.691 1.00 0.00 C +ATOM 324 HB2 GLN 189 -35.385 -7.912 -6.070 1.00 0.00 H +ATOM 325 HB3 GLN 189 -35.471 -6.308 -6.361 1.00 0.00 H +ATOM 326 CG GLN 189 -33.694 -6.884 -5.479 1.00 0.00 C +ATOM 327 HG2 GLN 189 -33.455 -7.324 -4.617 1.00 0.00 H +ATOM 328 HG3 GLN 189 -33.226 -7.337 -6.234 1.00 0.00 H +ATOM 329 CD GLN 189 -33.241 -5.437 -5.425 1.00 0.00 C +ATOM 330 OE1 GLN 189 -33.468 -4.676 -6.366 1.00 0.00 O +ATOM 331 NE2 GLN 189 -32.601 -5.047 -4.324 1.00 0.00 N +ATOM 332 HE21 GLN 189 -32.259 -4.100 -4.226 1.00 0.00 H +ATOM 333 HE22 GLN 189 -32.462 -5.726 -3.575 1.00 0.00 H +ATOM 334 C GLN 189 -37.491 -6.535 -4.794 1.00 0.00 C +ATOM 335 O GLN 189 -37.945 -5.398 -4.771 1.00 0.00 O +ATOM 336 N ALA 190 -38.227 -7.591 -5.125 1.00 0.00 N +ATOM 337 H ALA 190 -37.734 -8.501 -5.082 1.00 0.00 H +ATOM 338 CA ALA 190 -39.628 -7.450 -5.517 1.00 0.00 C +ATOM 339 HA ALA 190 -39.696 -6.704 -6.210 1.00 0.00 H +ATOM 340 CB ALA 190 -40.105 -8.721 -6.222 1.00 0.00 C +ATOM 341 HB1 ALA 190 -39.426 -9.442 -6.098 1.00 0.00 H +ATOM 342 HB2 ALA 190 -40.976 -9.010 -5.829 1.00 0.00 H +ATOM 343 HB3 ALA 190 -40.222 -8.534 -7.196 1.00 0.00 H +ATOM 344 C ALA 190 -40.575 -7.118 -4.363 1.00 0.00 C +ATOM 345 O ALA 190 -41.540 -6.361 -4.534 1.00 0.00 O +ATOM 346 N THR 191 -40.291 -7.670 -3.188 1.00 0.00 N +ATOM 347 H THR 191 -39.428 -8.249 -3.176 1.00 0.00 H +ATOM 348 CA THR 191 -41.137 -7.467 -2.017 1.00 0.00 C +ATOM 349 HA THR 191 -42.084 -7.255 -2.340 1.00 0.00 H +ATOM 350 CB THR 191 -41.212 -8.756 -1.190 1.00 0.00 C +ATOM 351 HB THR 191 -41.899 -8.633 -0.445 1.00 0.00 H +ATOM 352 CG2 THR 191 -41.579 -9.934 -2.094 1.00 0.00 C +ATOM 353 HG21 THR 191 -40.796 -10.553 -2.174 1.00 0.00 H +ATOM 354 HG22 THR 191 -42.355 -10.430 -1.701 1.00 0.00 H +ATOM 355 HG23 THR 191 -41.828 -9.595 -3.003 1.00 0.00 H +ATOM 356 OG1 THR 191 -39.938 -9.010 -0.582 1.00 0.00 O +ATOM 357 HG1 THR 191 -39.291 -9.367 -1.264 1.00 0.00 H +ATOM 358 C THR 191 -40.690 -6.337 -1.095 1.00 0.00 C +ATOM 359 O THR 191 -41.528 -5.627 -0.535 1.00 0.00 O +ATOM 360 N GLY 192 -39.380 -6.175 -0.932 1.00 0.00 N +ATOM 361 H GLY 192 -38.786 -6.840 -1.450 1.00 0.00 H +ATOM 362 CA GLY 192 -38.866 -5.120 -0.073 1.00 0.00 C +ATOM 363 HA2 GLY 192 -38.083 -4.662 -0.540 1.00 0.00 H +ATOM 364 HA3 GLY 192 -39.585 -4.405 0.045 1.00 0.00 H +ATOM 365 C GLY 192 -38.419 -5.605 1.289 1.00 0.00 C +ATOM 366 O GLY 192 -38.015 -4.815 2.149 1.00 0.00 O +ATOM 367 N ALA 193 -38.481 -6.913 1.503 1.00 0.00 N +ATOM 368 H ALA 193 -38.812 -7.479 0.708 1.00 0.00 H +ATOM 369 CA ALA 193 -38.095 -7.481 2.800 1.00 0.00 C +ATOM 370 HA ALA 193 -37.816 -6.717 3.416 1.00 0.00 H +ATOM 371 CB ALA 193 -39.311 -8.131 3.428 1.00 0.00 C +ATOM 372 HB1 ALA 193 -39.671 -8.836 2.816 1.00 0.00 H +ATOM 373 HB2 ALA 193 -39.057 -8.551 4.300 1.00 0.00 H +ATOM 374 HB3 ALA 193 -40.018 -7.441 3.588 1.00 0.00 H +ATOM 375 C ALA 193 -36.941 -8.491 2.737 1.00 0.00 C +ATOM 376 O ALA 193 -36.797 -9.218 1.764 1.00 0.00 O +ATOM 377 N LYS 194 -36.137 -8.521 3.792 1.00 0.00 N +ATOM 378 H LYS 194 -36.399 -7.834 4.546 1.00 0.00 H +ATOM 379 CA LYS 194 -35.000 -9.414 3.905 1.00 0.00 C +ATOM 380 HA LYS 194 -34.637 -9.608 2.994 1.00 0.00 H +ATOM 381 CB LYS 194 -33.962 -8.782 4.828 1.00 0.00 C +ATOM 382 HB2 LYS 194 -34.314 -7.891 5.142 1.00 0.00 H +ATOM 383 HB3 LYS 194 -33.850 -9.376 5.637 1.00 0.00 H +ATOM 384 CG LYS 194 -32.552 -8.537 4.238 1.00 0.00 C +ATOM 385 HG2 LYS 194 -32.228 -9.382 3.836 1.00 0.00 H +ATOM 386 HG3 LYS 194 -32.614 -7.819 3.560 1.00 0.00 H +ATOM 387 CD LYS 194 -31.598 -8.106 5.345 1.00 0.00 C +ATOM 388 HD2 LYS 194 -30.683 -8.034 4.977 1.00 0.00 H +ATOM 389 HD3 LYS 194 -31.904 -7.246 5.723 1.00 0.00 H +ATOM 390 CE LYS 194 -31.578 -9.150 6.480 1.00 0.00 C +ATOM 391 HE2 LYS 194 -31.475 -8.660 7.367 1.00 0.00 H +ATOM 392 HE3 LYS 194 -32.485 -9.612 6.509 1.00 0.00 H +ATOM 393 NZ LYS 194 -30.502 -10.219 6.399 1.00 0.00 N +ATOM 394 HZ1 LYS 194 -29.673 -9.866 6.821 1.00 0.00 H +ATOM 395 HZ2 LYS 194 -30.821 -11.027 6.884 1.00 0.00 H +ATOM 396 HZ3 LYS 194 -30.339 -10.432 5.441 1.00 0.00 H +ATOM 397 C LYS 194 -35.461 -10.736 4.534 1.00 0.00 C +ATOM 398 O LYS 194 -36.205 -10.719 5.517 1.00 0.00 O +ATOM 399 N ASP 195 -35.042 -11.872 3.975 1.00 0.00 N +ATOM 400 H ASP 195 -34.456 -11.759 3.133 1.00 0.00 H +ATOM 401 CA ASP 195 -35.407 -13.175 4.543 1.00 0.00 C +ATOM 402 HA ASP 195 -36.292 -13.075 4.961 1.00 0.00 H +ATOM 403 CB ASP 195 -35.264 -14.296 3.512 1.00 0.00 C +ATOM 404 HB2 ASP 195 -35.753 -14.024 2.693 1.00 0.00 H +ATOM 405 HB3 ASP 195 -34.299 -14.418 3.323 1.00 0.00 H +ATOM 406 CG ASP 195 -35.836 -15.608 4.010 1.00 0.00 C +ATOM 407 OD1 ASP 195 -35.806 -15.841 5.242 1.00 0.00 O +ATOM 408 OD2 ASP 195 -36.306 -16.414 3.179 1.00 0.00 O +ATOM 409 C ASP 195 -34.400 -13.409 5.671 1.00 0.00 C +ATOM 410 O ASP 195 -33.192 -13.293 5.460 1.00 0.00 O +ATOM 411 N THR 196 -34.881 -13.764 6.859 1.00 0.00 N +ATOM 412 H THR 196 -35.908 -13.876 6.902 1.00 0.00 H +ATOM 413 CA THR 196 -33.995 -13.974 8.004 1.00 0.00 C +ATOM 414 HA THR 196 -33.160 -13.396 7.871 1.00 0.00 H +ATOM 415 CB THR 196 -34.663 -13.462 9.298 1.00 0.00 C +ATOM 416 HB THR 196 -34.741 -12.447 9.246 1.00 0.00 H +ATOM 417 CG2 THR 196 -36.039 -14.081 9.476 1.00 0.00 C +ATOM 418 HG21 THR 196 -36.744 -13.372 9.400 1.00 0.00 H +ATOM 419 HG22 THR 196 -36.195 -14.775 8.769 1.00 0.00 H +ATOM 420 HG23 THR 196 -36.105 -14.513 10.379 1.00 0.00 H +ATOM 421 OG1 THR 196 -33.838 -13.793 10.419 1.00 0.00 O +ATOM 422 HG1 THR 196 -33.244 -14.575 10.199 1.00 0.00 H +ATOM 423 C THR 196 -33.533 -15.420 8.225 1.00 0.00 C +ATOM 424 O THR 196 -32.717 -15.686 9.106 1.00 0.00 O +ATOM 425 N LYS 197 -34.047 -16.354 7.436 1.00 0.00 N +ATOM 426 H LYS 197 -34.728 -16.019 6.736 1.00 0.00 H +ATOM 427 CA LYS 197 -33.653 -17.761 7.574 1.00 0.00 C +ATOM 428 HA LYS 197 -33.695 -18.013 8.550 1.00 0.00 H +ATOM 429 CB LYS 197 -34.582 -18.672 6.768 1.00 0.00 C +ATOM 430 HB2 LYS 197 -34.700 -18.260 5.855 1.00 0.00 H +ATOM 431 HB3 LYS 197 -34.116 -19.560 6.652 1.00 0.00 H +ATOM 432 CG LYS 197 -35.945 -18.920 7.360 1.00 0.00 C +ATOM 433 HG2 LYS 197 -35.859 -19.468 8.180 1.00 0.00 H +ATOM 434 HG3 LYS 197 -36.390 -18.057 7.552 1.00 0.00 H +ATOM 435 CD LYS 197 -36.792 -19.691 6.345 1.00 0.00 C +ATOM 436 HD2 LYS 197 -36.349 -20.560 6.155 1.00 0.00 H +ATOM 437 HD3 LYS 197 -37.697 -19.837 6.728 1.00 0.00 H +ATOM 438 CE LYS 197 -36.937 -18.921 5.034 1.00 0.00 C +ATOM 439 HE2 LYS 197 -37.346 -18.024 5.233 1.00 0.00 H +ATOM 440 HE3 LYS 197 -36.021 -18.775 4.645 1.00 0.00 H +ATOM 441 NZ LYS 197 -37.781 -19.638 4.047 1.00 0.00 N +ATOM 442 HZ1 LYS 197 -37.836 -19.103 3.203 1.00 0.00 H +ATOM 443 HZ2 LYS 197 -37.377 -20.532 3.849 1.00 0.00 H +ATOM 444 HZ3 LYS 197 -38.700 -19.763 4.422 1.00 0.00 H +ATOM 445 C LYS 197 -32.235 -17.999 7.066 1.00 0.00 C +ATOM 446 O LYS 197 -31.797 -17.352 6.116 1.00 0.00 O +ATOM 447 N PRO 198 -31.498 -18.937 7.693 1.00 0.00 N +ATOM 448 CD PRO 198 -31.793 -19.679 8.933 1.00 0.00 C +ATOM 449 HD2 PRO 198 -32.731 -20.015 8.924 1.00 0.00 H +ATOM 450 HD3 PRO 198 -31.646 -19.099 9.731 1.00 0.00 H +ATOM 451 CG PRO 198 -30.801 -20.803 8.874 1.00 0.00 C +ATOM 452 HG2 PRO 198 -31.115 -21.527 8.265 1.00 0.00 H +ATOM 453 HG3 PRO 198 -30.624 -21.173 9.782 1.00 0.00 H +ATOM 454 CB PRO 198 -29.581 -20.144 8.326 1.00 0.00 C +ATOM 455 HB2 PRO 198 -28.955 -20.816 7.932 1.00 0.00 H +ATOM 456 HB3 PRO 198 -29.107 -19.620 9.032 1.00 0.00 H +ATOM 457 CA PRO 198 -30.132 -19.217 7.241 1.00 0.00 C +ATOM 458 HA PRO 198 -29.578 -18.369 7.242 1.00 0.00 H +ATOM 459 C PRO 198 -30.105 -19.878 5.874 1.00 0.00 C +ATOM 460 O PRO 198 -31.050 -20.558 5.479 1.00 0.00 O +ATOM 461 N MET 199 -29.018 -19.659 5.146 1.00 0.00 N +ATOM 462 H MET 199 -28.313 -19.040 5.584 1.00 0.00 H +ATOM 463 CA MET 199 -28.864 -20.261 3.834 1.00 0.00 C +ATOM 464 HA MET 199 -29.708 -20.131 3.324 1.00 0.00 H +ATOM 465 CB MET 199 -27.650 -19.656 3.126 1.00 0.00 C +ATOM 466 HB2 MET 199 -26.845 -19.720 3.736 1.00 0.00 H +ATOM 467 HB3 MET 199 -27.449 -20.196 2.295 1.00 0.00 H +ATOM 468 CG MET 199 -27.807 -18.184 2.705 1.00 0.00 C +ATOM 469 HG2 MET 199 -28.163 -17.663 3.515 1.00 0.00 H +ATOM 470 HG3 MET 199 -26.869 -17.806 2.530 1.00 0.00 H +ATOM 471 SD MET 199 -28.869 -17.976 1.279 1.00 0.00 S +ATOM 472 CE MET 199 -29.039 -16.192 1.184 1.00 0.00 C +ATOM 473 HE1 MET 199 -28.557 -15.769 1.952 1.00 0.00 H +ATOM 474 HE2 MET 199 -28.647 -15.864 0.324 1.00 0.00 H +ATOM 475 HE3 MET 199 -30.008 -15.946 1.223 1.00 0.00 H +ATOM 476 C MET 199 -28.659 -21.757 4.034 1.00 0.00 C +ATOM 477 O MET 199 -28.502 -22.222 5.167 1.00 0.00 O +ATOM 478 N GLY 200 -28.675 -22.519 2.944 1.00 0.00 N +ATOM 479 H GLY 200 -28.837 -22.025 2.059 1.00 0.00 H +ATOM 480 CA GLY 200 -28.471 -23.950 3.064 1.00 0.00 C +ATOM 481 HA2 GLY 200 -29.090 -24.324 3.751 1.00 0.00 H +ATOM 482 HA3 GLY 200 -28.639 -24.391 2.185 1.00 0.00 H +ATOM 483 C GLY 200 -27.036 -24.195 3.488 1.00 0.00 C +ATOM 484 O GLY 200 -26.294 -23.225 3.695 1.00 0.00 O +TER 485 GLY 200 +ATOM 486 N SER 202 -22.146 -24.130 3.748 1.00 0.00 N +ATOM 487 H SER 202 -22.234 -23.719 4.664 1.00 0.00 H +ATOM 488 CA SER 202 -22.622 -23.510 2.517 1.00 0.00 C +ATOM 489 HA SER 202 -21.830 -23.349 1.919 1.00 0.00 H +ATOM 490 CB SER 202 -23.636 -24.435 1.814 1.00 0.00 C +ATOM 491 HB2 SER 202 -24.414 -24.578 2.423 1.00 0.00 H +ATOM 492 HB3 SER 202 -23.943 -23.992 0.974 1.00 0.00 H +ATOM 493 OG SER 202 -23.074 -25.710 1.481 1.00 0.00 O +ATOM 494 HG SER 202 -22.978 -25.775 0.491 1.00 0.00 H +ATOM 495 C SER 202 -23.272 -22.153 2.804 1.00 0.00 C +ATOM 496 O SER 202 -23.310 -21.276 1.936 1.00 0.00 O +ATOM 497 N GLY 203 -23.777 -21.984 4.021 1.00 0.00 N +ATOM 498 H GLY 203 -23.655 -22.788 4.661 1.00 0.00 H +ATOM 499 CA GLY 203 -24.441 -20.751 4.383 1.00 0.00 C +ATOM 500 HA2 GLY 203 -25.256 -20.613 3.746 1.00 0.00 H +ATOM 501 HA3 GLY 203 -24.892 -20.877 5.315 1.00 0.00 H +ATOM 502 C GLY 203 -23.633 -19.469 4.412 1.00 0.00 C +ATOM 503 O GLY 203 -24.079 -18.443 3.888 1.00 0.00 O +ATOM 504 N ALA 204 -22.455 -19.505 5.029 1.00 0.00 N +ATOM 505 H ALA 204 -22.188 -20.427 5.414 1.00 0.00 H +ATOM 506 CA ALA 204 -21.620 -18.309 5.138 1.00 0.00 C +ATOM 507 HA ALA 204 -22.069 -17.664 5.793 1.00 0.00 H +ATOM 508 CB ALA 204 -20.295 -18.660 5.774 1.00 0.00 C +ATOM 509 HB1 ALA 204 -19.693 -19.083 5.094 1.00 0.00 H +ATOM 510 HB2 ALA 204 -19.858 -17.831 6.128 1.00 0.00 H +ATOM 511 HB3 ALA 204 -20.440 -19.302 6.529 1.00 0.00 H +ATOM 512 C ALA 204 -21.387 -17.579 3.827 1.00 0.00 C +ATOM 513 O ALA 204 -21.739 -16.404 3.713 1.00 0.00 O +ATOM 514 N THR 205 -20.775 -18.251 2.859 1.00 0.00 N +ATOM 515 H THR 205 -20.498 -19.217 3.100 1.00 0.00 H +ATOM 516 CA THR 205 -20.532 -17.633 1.568 1.00 0.00 C +ATOM 517 HA THR 205 -19.930 -16.829 1.705 1.00 0.00 H +ATOM 518 CB THR 205 -19.838 -18.600 0.603 1.00 0.00 C +ATOM 519 HB THR 205 -20.388 -19.459 0.541 1.00 0.00 H +ATOM 520 CG2 THR 205 -19.688 -17.969 -0.767 1.00 0.00 C +ATOM 521 HG21 THR 205 -18.922 -18.393 -1.258 1.00 0.00 H +ATOM 522 HG22 THR 205 -20.529 -18.100 -1.299 1.00 0.00 H +ATOM 523 HG23 THR 205 -19.511 -16.986 -0.674 1.00 0.00 H +ATOM 524 OG1 THR 205 -18.539 -18.940 1.106 1.00 0.00 O +ATOM 525 HG1 THR 205 -17.858 -18.903 0.367 1.00 0.00 H +ATOM 526 C THR 205 -21.813 -17.161 0.908 1.00 0.00 C +ATOM 527 O THR 205 -21.870 -16.049 0.377 1.00 0.00 O +ATOM 528 N SER 206 -22.849 -17.987 0.930 1.00 0.00 N +ATOM 529 H SER 206 -22.712 -18.880 1.388 1.00 0.00 H +ATOM 530 CA SER 206 -24.082 -17.545 0.301 1.00 0.00 C +ATOM 531 HA SER 206 -23.894 -17.344 -0.664 1.00 0.00 H +ATOM 532 CB SER 206 -25.163 -18.627 0.400 1.00 0.00 C +ATOM 533 HB2 SER 206 -25.271 -18.884 1.360 1.00 0.00 H +ATOM 534 HB3 SER 206 -26.023 -18.250 0.057 1.00 0.00 H +ATOM 535 OG SER 206 -24.833 -19.780 -0.352 1.00 0.00 O +ATOM 536 HG SER 206 -24.317 -20.416 0.221 1.00 0.00 H +ATOM 537 C SER 206 -24.580 -16.241 0.955 1.00 0.00 C +ATOM 538 O SER 206 -25.060 -15.346 0.260 1.00 0.00 O +ATOM 539 N ARG 207 -24.463 -16.128 2.280 1.00 0.00 N +ATOM 540 H ARG 207 -24.026 -16.932 2.753 1.00 0.00 H +ATOM 541 CA ARG 207 -24.935 -14.931 2.966 1.00 0.00 C +ATOM 542 HA ARG 207 -25.912 -14.791 2.736 1.00 0.00 H +ATOM 543 CB ARG 207 -24.870 -15.099 4.487 1.00 0.00 C +ATOM 544 HB2 ARG 207 -25.449 -15.865 4.741 1.00 0.00 H +ATOM 545 HB3 ARG 207 -23.926 -15.277 4.741 1.00 0.00 H +ATOM 546 CG ARG 207 -25.343 -13.873 5.257 1.00 0.00 C +ATOM 547 HG2 ARG 207 -24.726 -13.107 5.076 1.00 0.00 H +ATOM 548 HG3 ARG 207 -26.268 -13.633 4.965 1.00 0.00 H +ATOM 549 CD ARG 207 -25.374 -14.106 6.768 1.00 0.00 C +ATOM 550 HD2 ARG 207 -25.475 -13.222 7.213 1.00 0.00 H +ATOM 551 HD3 ARG 207 -26.156 -14.687 6.972 1.00 0.00 H +ATOM 552 NE ARG 207 -24.150 -14.753 7.248 1.00 0.00 N +ATOM 553 HE ARG 207 -23.369 -14.165 7.482 1.00 0.00 H +ATOM 554 CZ ARG 207 -24.008 -16.068 7.394 1.00 0.00 C +ATOM 555 NH1 ARG 207 -25.010 -16.887 7.093 1.00 0.00 N +ATOM 556 HH11 ARG 207 -25.871 -16.536 6.737 1.00 0.00 H +ATOM 557 HH12 ARG 207 -24.897 -17.879 7.226 1.00 0.00 H +ATOM 558 NH2 ARG 207 -22.882 -16.570 7.876 1.00 0.00 N +ATOM 559 HH21 ARG 207 -22.127 -15.951 8.113 1.00 0.00 H +ATOM 560 HH22 ARG 207 -22.779 -17.553 8.003 1.00 0.00 H +ATOM 561 C ARG 207 -24.159 -13.691 2.565 1.00 0.00 C +ATOM 562 O ARG 207 -24.739 -12.622 2.380 1.00 0.00 O +ATOM 563 N LYS 208 -22.847 -13.824 2.452 1.00 0.00 N +ATOM 564 H LYS 208 -22.477 -14.764 2.651 1.00 0.00 H +ATOM 565 CA LYS 208 -22.031 -12.689 2.070 1.00 0.00 C +ATOM 566 HA LYS 208 -22.285 -11.895 2.630 1.00 0.00 H +ATOM 567 CB LYS 208 -20.548 -12.995 2.327 1.00 0.00 C +ATOM 568 HB2 LYS 208 -20.249 -13.677 1.671 1.00 0.00 H +ATOM 569 HB3 LYS 208 -20.030 -12.155 2.219 1.00 0.00 H +ATOM 570 CG LYS 208 -20.272 -13.545 3.743 1.00 0.00 C +ATOM 571 HG2 LYS 208 -20.522 -12.847 4.412 1.00 0.00 H +ATOM 572 HG3 LYS 208 -20.829 -14.361 3.884 1.00 0.00 H +ATOM 573 CD LYS 208 -18.793 -13.913 3.941 1.00 0.00 C +ATOM 574 HD2 LYS 208 -18.726 -14.565 4.691 1.00 0.00 H +ATOM 575 HD3 LYS 208 -18.451 -14.319 3.099 1.00 0.00 H +ATOM 576 CE LYS 208 -17.930 -12.693 4.278 1.00 0.00 C +ATOM 577 HE2 LYS 208 -16.968 -12.964 4.247 1.00 0.00 H +ATOM 578 HE3 LYS 208 -18.098 -11.984 3.594 1.00 0.00 H +ATOM 579 NZ LYS 208 -18.254 -12.166 5.628 1.00 0.00 N +ATOM 580 HZ1 LYS 208 -18.502 -12.924 6.231 1.00 0.00 H +ATOM 581 HZ2 LYS 208 -17.457 -11.691 6.000 1.00 0.00 H +ATOM 582 HZ3 LYS 208 -19.022 -11.528 5.561 1.00 0.00 H +ATOM 583 C LYS 208 -22.269 -12.344 0.603 1.00 0.00 C +ATOM 584 O LYS 208 -22.216 -11.180 0.220 1.00 0.00 O +ATOM 585 N ALA 209 -22.535 -13.358 -0.219 1.00 0.00 N +ATOM 586 H ALA 209 -22.551 -14.292 0.224 1.00 0.00 H +ATOM 587 CA ALA 209 -22.784 -13.136 -1.649 1.00 0.00 C +ATOM 588 HA ALA 209 -22.020 -12.620 -2.033 1.00 0.00 H +ATOM 589 CB ALA 209 -22.907 -14.491 -2.387 1.00 0.00 C +ATOM 590 HB1 ALA 209 -23.859 -14.782 -2.368 1.00 0.00 H +ATOM 591 HB2 ALA 209 -22.604 -14.373 -3.328 1.00 0.00 H +ATOM 592 HB3 ALA 209 -22.335 -15.162 -1.925 1.00 0.00 H +ATOM 593 C ALA 209 -24.065 -12.313 -1.817 1.00 0.00 C +ATOM 594 O ALA 209 -24.118 -11.411 -2.654 1.00 0.00 O +ATOM 595 N LEU 210 -25.086 -12.614 -1.014 1.00 0.00 N +ATOM 596 H LEU 210 -24.914 -13.393 -0.359 1.00 0.00 H +ATOM 597 CA LEU 210 -26.340 -11.872 -1.086 1.00 0.00 C +ATOM 598 HA LEU 210 -26.663 -11.880 -2.037 1.00 0.00 H +ATOM 599 CB LEU 210 -27.393 -12.512 -0.177 1.00 0.00 C +ATOM 600 HB2 LEU 210 -27.535 -13.450 -0.489 1.00 0.00 H +ATOM 601 HB3 LEU 210 -27.031 -12.517 0.753 1.00 0.00 H +ATOM 602 CG LEU 210 -28.766 -11.836 -0.129 1.00 0.00 C +ATOM 603 HG LEU 210 -28.666 -10.918 0.234 1.00 0.00 H +ATOM 604 CD1 LEU 210 -29.339 -11.757 -1.551 1.00 0.00 C +ATOM 605 HD11 LEU 210 -29.430 -12.680 -1.919 1.00 0.00 H +ATOM 606 HD12 LEU 210 -30.234 -11.316 -1.520 1.00 0.00 H +ATOM 607 HD13 LEU 210 -28.720 -11.224 -2.125 1.00 0.00 H +ATOM 608 CD2 LEU 210 -29.717 -12.614 0.785 1.00 0.00 C +ATOM 609 HD21 LEU 210 -29.336 -12.644 1.708 1.00 0.00 H +ATOM 610 HD22 LEU 210 -30.605 -12.157 0.802 1.00 0.00 H +ATOM 611 HD23 LEU 210 -29.824 -13.544 0.435 1.00 0.00 H +ATOM 612 C LEU 210 -26.126 -10.426 -0.661 1.00 0.00 C +ATOM 613 O LEU 210 -26.672 -9.500 -1.267 1.00 0.00 O +ATOM 614 N GLU 211 -25.336 -10.239 0.392 1.00 0.00 N +ATOM 615 H GLU 211 -24.941 -11.106 0.802 1.00 0.00 H +ATOM 616 CA GLU 211 -25.060 -8.902 0.914 1.00 0.00 C +ATOM 617 HA GLU 211 -25.921 -8.451 1.161 1.00 0.00 H +ATOM 618 CB GLU 211 -24.248 -9.010 2.216 1.00 0.00 C +ATOM 619 HB2 GLU 211 -23.607 -9.734 2.109 1.00 0.00 H +ATOM 620 HB3 GLU 211 -23.845 -8.143 2.390 1.00 0.00 H +ATOM 621 CG GLU 211 -25.141 -9.355 3.414 1.00 0.00 C +ATOM 622 HG2 GLU 211 -25.576 -8.524 3.721 1.00 0.00 H +ATOM 623 HG3 GLU 211 -25.805 -10.024 3.121 1.00 0.00 H +ATOM 624 CD GLU 211 -24.396 -9.950 4.615 1.00 0.00 C +ATOM 625 OE1 GLU 211 -23.160 -10.134 4.545 1.00 0.00 O +ATOM 626 OE2 GLU 211 -25.066 -10.236 5.638 1.00 0.00 O +ATOM 627 C GLU 211 -24.331 -8.066 -0.137 1.00 0.00 C +ATOM 628 O GLU 211 -24.606 -6.878 -0.308 1.00 0.00 O +ATOM 629 N THR 212 -23.403 -8.695 -0.850 1.00 0.00 N +ATOM 630 H THR 212 -23.261 -9.693 -0.597 1.00 0.00 H +ATOM 631 CA THR 212 -22.652 -8.019 -1.903 1.00 0.00 C +ATOM 632 HA THR 212 -22.234 -7.197 -1.521 1.00 0.00 H +ATOM 633 CB THR 212 -21.593 -8.951 -2.489 1.00 0.00 C +ATOM 634 HB THR 212 -22.050 -9.782 -2.864 1.00 0.00 H +ATOM 635 CG2 THR 212 -20.804 -8.250 -3.592 1.00 0.00 C +ATOM 636 HG21 THR 212 -20.406 -8.932 -4.208 1.00 0.00 H +ATOM 637 HG22 THR 212 -21.413 -7.649 -4.113 1.00 0.00 H +ATOM 638 HG23 THR 212 -20.069 -7.704 -3.186 1.00 0.00 H +ATOM 639 OG1 THR 212 -20.707 -9.364 -1.445 1.00 0.00 O +ATOM 640 HG1 THR 212 -21.163 -10.025 -0.839 1.00 0.00 H +ATOM 641 C THR 212 -23.621 -7.598 -3.006 1.00 0.00 C +ATOM 642 O THR 212 -23.522 -6.497 -3.545 1.00 0.00 O +ATOM 643 N LEU 213 -24.557 -8.483 -3.353 1.00 0.00 N +ATOM 644 H LEU 213 -24.524 -9.381 -2.857 1.00 0.00 H +ATOM 645 CA LEU 213 -25.546 -8.147 -4.381 1.00 0.00 C +ATOM 646 HA LEU 213 -25.055 -7.882 -5.224 1.00 0.00 H +ATOM 647 CB LEU 213 -26.428 -9.358 -4.726 1.00 0.00 C +ATOM 648 HB2 LEU 213 -26.596 -9.861 -3.876 1.00 0.00 H +ATOM 649 HB3 LEU 213 -27.295 -9.008 -5.081 1.00 0.00 H +ATOM 650 CG LEU 213 -25.884 -10.357 -5.747 1.00 0.00 C +ATOM 651 HG LEU 213 -24.983 -10.658 -5.458 1.00 0.00 H +ATOM 652 CD1 LEU 213 -26.821 -11.552 -5.819 1.00 0.00 C +ATOM 653 HD11 LEU 213 -27.732 -11.247 -6.099 1.00 0.00 H +ATOM 654 HD12 LEU 213 -26.472 -12.212 -6.486 1.00 0.00 H +ATOM 655 HD13 LEU 213 -26.878 -11.987 -4.920 1.00 0.00 H +ATOM 656 CD2 LEU 213 -25.750 -9.692 -7.117 1.00 0.00 C +ATOM 657 HD21 LEU 213 -25.122 -8.917 -7.049 1.00 0.00 H +ATOM 658 HD22 LEU 213 -25.394 -10.356 -7.774 1.00 0.00 H +ATOM 659 HD23 LEU 213 -26.647 -9.371 -7.418 1.00 0.00 H +ATOM 660 C LEU 213 -26.448 -6.975 -3.966 1.00 0.00 C +ATOM 661 O LEU 213 -26.835 -6.171 -4.802 1.00 0.00 O +ATOM 662 N ARG 214 -26.796 -6.887 -2.684 1.00 0.00 N +ATOM 663 H ARG 214 -26.430 -7.627 -2.072 1.00 0.00 H +ATOM 664 CA ARG 214 -27.649 -5.788 -2.220 1.00 0.00 C +ATOM 665 HA ARG 214 -28.475 -5.762 -2.789 1.00 0.00 H +ATOM 666 CB ARG 214 -28.025 -5.958 -0.756 1.00 0.00 C +ATOM 667 HB2 ARG 214 -27.182 -6.127 -0.238 1.00 0.00 H +ATOM 668 HB3 ARG 214 -28.433 -5.097 -0.439 1.00 0.00 H +ATOM 669 CG ARG 214 -28.986 -7.069 -0.472 1.00 0.00 C +ATOM 670 HG2 ARG 214 -29.854 -6.889 -0.908 1.00 0.00 H +ATOM 671 HG3 ARG 214 -28.606 -7.932 -0.769 1.00 0.00 H +ATOM 672 CD ARG 214 -29.212 -7.141 1.020 1.00 0.00 C +ATOM 673 HD2 ARG 214 -28.324 -7.169 1.469 1.00 0.00 H +ATOM 674 HD3 ARG 214 -29.714 -6.327 1.299 1.00 0.00 H +ATOM 675 NE ARG 214 -29.974 -8.325 1.382 1.00 0.00 N +ATOM 676 HE ARG 214 -30.629 -8.690 0.709 1.00 0.00 H +ATOM 677 CZ ARG 214 -29.859 -8.952 2.541 1.00 0.00 C +ATOM 678 NH1 ARG 214 -29.010 -8.502 3.450 1.00 0.00 N +ATOM 679 HH11 ARG 214 -28.462 -7.685 3.296 1.00 0.00 H +ATOM 680 HH12 ARG 214 -28.912 -8.997 4.327 1.00 0.00 H +ATOM 681 NH2 ARG 214 -30.589 -10.032 2.782 1.00 0.00 N +ATOM 682 HH21 ARG 214 -31.240 -10.358 2.092 1.00 0.00 H +ATOM 683 HH22 ARG 214 -30.494 -10.521 3.648 1.00 0.00 H +ATOM 684 C ARG 214 -26.916 -4.468 -2.353 1.00 0.00 C +ATOM 685 O ARG 214 -27.527 -3.411 -2.529 1.00 0.00 O +ATOM 686 N ARG 215 -25.598 -4.531 -2.240 1.00 0.00 N +ATOM 687 H ARG 215 -25.218 -5.484 -2.074 1.00 0.00 H +ATOM 688 CA ARG 215 -24.772 -3.343 -2.344 1.00 0.00 C +ATOM 689 HA ARG 215 -25.251 -2.571 -1.903 1.00 0.00 H +ATOM 690 CB ARG 215 -23.456 -3.579 -1.595 1.00 0.00 C +ATOM 691 HB2 ARG 215 -23.668 -3.684 -0.620 1.00 0.00 H +ATOM 692 HB3 ARG 215 -23.054 -4.433 -1.934 1.00 0.00 H +ATOM 693 CG ARG 215 -22.404 -2.483 -1.729 1.00 0.00 C +ATOM 694 HG2 ARG 215 -21.960 -2.554 -2.610 1.00 0.00 H +ATOM 695 HG3 ARG 215 -22.830 -1.598 -1.612 1.00 0.00 H +ATOM 696 CD ARG 215 -21.336 -2.642 -0.644 1.00 0.00 C +ATOM 697 HD2 ARG 215 -20.586 -2.020 -0.858 1.00 0.00 H +ATOM 698 HD3 ARG 215 -21.748 -2.390 0.229 1.00 0.00 H +ATOM 699 NE ARG 215 -20.817 -4.012 -0.557 1.00 0.00 N +ATOM 700 HE ARG 215 -21.280 -4.645 0.082 1.00 0.00 H +ATOM 701 CZ ARG 215 -19.786 -4.485 -1.253 1.00 0.00 C +ATOM 702 NH1 ARG 215 -19.136 -3.710 -2.101 1.00 0.00 N +ATOM 703 HH11 ARG 215 -19.389 -2.752 -2.223 1.00 0.00 H +ATOM 704 HH12 ARG 215 -18.369 -4.086 -2.636 1.00 0.00 H +ATOM 705 NH2 ARG 215 -19.408 -5.743 -1.095 1.00 0.00 N +ATOM 706 HH21 ARG 215 -19.886 -6.331 -0.437 1.00 0.00 H +ATOM 707 HH22 ARG 215 -18.646 -6.112 -1.627 1.00 0.00 H +ATOM 708 C ARG 215 -24.504 -2.978 -3.798 1.00 0.00 C +ATOM 709 O ARG 215 -24.844 -1.875 -4.230 1.00 0.00 O +ATOM 710 N VAL 216 -23.937 -3.911 -4.560 1.00 0.00 N +ATOM 711 H VAL 216 -23.767 -4.818 -4.080 1.00 0.00 H +ATOM 712 CA VAL 216 -23.588 -3.665 -5.956 1.00 0.00 C +ATOM 713 HA VAL 216 -23.173 -2.734 -6.016 1.00 0.00 H +ATOM 714 CB VAL 216 -22.501 -4.669 -6.424 1.00 0.00 C +ATOM 715 HB VAL 216 -22.904 -5.579 -6.390 1.00 0.00 H +ATOM 716 CG1 VAL 216 -22.107 -4.403 -7.864 1.00 0.00 C +ATOM 717 HG11 VAL 216 -21.477 -5.115 -8.178 1.00 0.00 H +ATOM 718 HG12 VAL 216 -22.924 -4.406 -8.443 1.00 0.00 H +ATOM 719 HG13 VAL 216 -21.658 -3.511 -7.931 1.00 0.00 H +ATOM 720 CG2 VAL 216 -21.285 -4.550 -5.521 1.00 0.00 C +ATOM 721 HG21 VAL 216 -21.276 -5.314 -4.875 1.00 0.00 H +ATOM 722 HG22 VAL 216 -20.455 -4.572 -6.079 1.00 0.00 H +ATOM 723 HG23 VAL 216 -21.329 -3.686 -5.018 1.00 0.00 H +ATOM 724 C VAL 216 -24.770 -3.707 -6.922 1.00 0.00 C +ATOM 725 O VAL 216 -24.858 -2.883 -7.834 1.00 0.00 O +ATOM 726 N GLY 217 -25.667 -4.672 -6.741 1.00 0.00 N +ATOM 727 H GLY 217 -25.482 -5.307 -5.955 1.00 0.00 H +ATOM 728 CA GLY 217 -26.813 -4.773 -7.627 1.00 0.00 C +ATOM 729 HA2 GLY 217 -26.491 -4.980 -8.572 1.00 0.00 H +ATOM 730 HA3 GLY 217 -27.391 -5.563 -7.341 1.00 0.00 H +ATOM 731 C GLY 217 -27.671 -3.518 -7.660 1.00 0.00 C +ATOM 732 O GLY 217 -28.157 -3.111 -8.712 1.00 0.00 O +ATOM 733 N ASP 218 -27.863 -2.905 -6.500 1.00 0.00 N +ATOM 734 H ASP 218 -27.396 -3.356 -5.686 1.00 0.00 H +ATOM 735 CA ASP 218 -28.667 -1.695 -6.391 1.00 0.00 C +ATOM 736 HA ASP 218 -29.551 -1.881 -6.844 1.00 0.00 H +ATOM 737 CB ASP 218 -28.881 -1.366 -4.912 1.00 0.00 C +ATOM 738 HB2 ASP 218 -27.995 -1.323 -4.472 1.00 0.00 H +ATOM 739 HB3 ASP 218 -29.351 -0.498 -4.852 1.00 0.00 H +ATOM 740 CG ASP 218 -29.725 -2.426 -4.199 1.00 0.00 C +ATOM 741 OD1 ASP 218 -29.671 -3.617 -4.593 1.00 0.00 O +ATOM 742 OD2 ASP 218 -30.443 -2.080 -3.231 1.00 0.00 O +ATOM 743 C ASP 218 -28.031 -0.518 -7.125 1.00 0.00 C +ATOM 744 O ASP 218 -28.728 0.302 -7.718 1.00 0.00 O +ATOM 745 N GLY 219 -26.705 -0.442 -7.097 1.00 0.00 N +ATOM 746 H GLY 219 -26.229 -1.187 -6.572 1.00 0.00 H +ATOM 747 CA GLY 219 -26.027 0.643 -7.780 1.00 0.00 C +ATOM 748 HA2 GLY 219 -26.419 1.527 -7.483 1.00 0.00 H +ATOM 749 HA3 GLY 219 -25.048 0.643 -7.527 1.00 0.00 H +ATOM 750 C GLY 219 -26.152 0.524 -9.291 1.00 0.00 C +ATOM 751 O GLY 219 -26.279 1.531 -9.995 1.00 0.00 O +ATOM 752 N VAL 220 -26.126 -0.709 -9.786 1.00 0.00 N +ATOM 753 H VAL 220 -26.028 -1.462 -9.075 1.00 0.00 H +ATOM 754 CA VAL 220 -26.228 -0.966 -11.217 1.00 0.00 C +ATOM 755 HA VAL 220 -25.505 -0.431 -11.685 1.00 0.00 H +ATOM 756 CB VAL 220 -26.008 -2.470 -11.526 1.00 0.00 C +ATOM 757 HB VAL 220 -26.700 -2.979 -11.027 1.00 0.00 H +ATOM 758 CG1 VAL 220 -26.224 -2.738 -13.001 1.00 0.00 C +ATOM 759 HG11 VAL 220 -25.631 -3.488 -13.298 1.00 0.00 H +ATOM 760 HG12 VAL 220 -27.180 -2.990 -13.162 1.00 0.00 H +ATOM 761 HG13 VAL 220 -26.006 -1.916 -13.529 1.00 0.00 H +ATOM 762 CG2 VAL 220 -24.601 -2.884 -11.109 1.00 0.00 C +ATOM 763 HG21 VAL 220 -24.131 -2.097 -10.711 1.00 0.00 H +ATOM 764 HG22 VAL 220 -24.661 -3.618 -10.434 1.00 0.00 H +ATOM 765 HG23 VAL 220 -24.101 -3.205 -11.913 1.00 0.00 H +ATOM 766 C VAL 220 -27.572 -0.539 -11.796 1.00 0.00 C +ATOM 767 O VAL 220 -27.629 0.062 -12.865 1.00 0.00 O +ATOM 768 N GLN 221 -28.653 -0.860 -11.092 1.00 0.00 N +ATOM 769 H GLN 221 -28.465 -1.365 -10.207 1.00 0.00 H +ATOM 770 CA GLN 221 -29.991 -0.514 -11.556 1.00 0.00 C +ATOM 771 HA GLN 221 -30.109 -0.894 -12.482 1.00 0.00 H +ATOM 772 CB GLN 221 -31.044 -1.094 -10.606 1.00 0.00 C +ATOM 773 HB2 GLN 221 -30.895 -0.710 -9.689 1.00 0.00 H +ATOM 774 HB3 GLN 221 -31.955 -0.815 -10.928 1.00 0.00 H +ATOM 775 CG GLN 221 -31.032 -2.613 -10.488 1.00 0.00 C +ATOM 776 HG2 GLN 221 -31.214 -3.006 -11.385 1.00 0.00 H +ATOM 777 HG3 GLN 221 -30.136 -2.903 -10.163 1.00 0.00 H +ATOM 778 CD GLN 221 -32.088 -3.121 -9.514 1.00 0.00 C +ATOM 779 OE1 GLN 221 -31.765 -3.778 -8.530 1.00 0.00 O +ATOM 780 NE2 GLN 221 -33.352 -2.822 -9.790 1.00 0.00 N +ATOM 781 HE21 GLN 221 -34.106 -3.139 -9.194 1.00 0.00 H +ATOM 782 HE22 GLN 221 -33.552 -2.262 -10.620 1.00 0.00 H +ATOM 783 C GLN 221 -30.175 1.002 -11.652 1.00 0.00 C +ATOM 784 O GLN 221 -30.936 1.487 -12.489 1.00 0.00 O +ATOM 785 N ARG 222 -29.482 1.740 -10.785 1.00 0.00 N +ATOM 786 H ARG 222 -28.895 1.194 -10.123 1.00 0.00 H +ATOM 787 CA ARG 222 -29.554 3.198 -10.780 1.00 0.00 C +ATOM 788 HA ARG 222 -30.497 3.478 -10.985 1.00 0.00 H +ATOM 789 CB ARG 222 -29.146 3.743 -9.411 1.00 0.00 C +ATOM 790 HB2 ARG 222 -28.240 3.386 -9.190 1.00 0.00 H +ATOM 791 HB3 ARG 222 -29.110 4.739 -9.469 1.00 0.00 H +ATOM 792 CG ARG 222 -30.087 3.373 -8.273 1.00 0.00 C +ATOM 793 HG2 ARG 222 -30.510 2.489 -8.463 1.00 0.00 H +ATOM 794 HG3 ARG 222 -29.574 3.324 -7.418 1.00 0.00 H +ATOM 795 CD ARG 222 -31.205 4.401 -8.091 1.00 0.00 C +ATOM 796 HD2 ARG 222 -31.701 4.164 -7.261 1.00 0.00 H +ATOM 797 HD3 ARG 222 -30.779 5.296 -7.994 1.00 0.00 H +ATOM 798 NE ARG 222 -32.111 4.409 -9.220 1.00 0.00 N +ATOM 799 HE ARG 222 -32.021 3.673 -9.908 1.00 0.00 H +ATOM 800 CZ ARG 222 -33.062 5.320 -9.423 1.00 0.00 C +ATOM 801 NH1 ARG 222 -33.254 6.320 -8.557 1.00 0.00 N +ATOM 802 HH11 ARG 222 -32.669 6.405 -7.754 1.00 0.00 H +ATOM 803 HH12 ARG 222 -33.986 6.982 -8.719 1.00 0.00 H +ATOM 804 NH2 ARG 222 -33.795 5.265 -10.528 1.00 0.00 N +ATOM 805 HH21 ARG 222 -33.618 4.554 -11.211 1.00 0.00 H +ATOM 806 HH22 ARG 222 -34.523 5.933 -10.681 1.00 0.00 H +ATOM 807 C ARG 222 -28.630 3.781 -11.846 1.00 0.00 C +ATOM 808 O ARG 222 -29.035 4.643 -12.633 1.00 0.00 O +ATOM 809 N ASN 223 -27.386 3.304 -11.867 1.00 0.00 N +ATOM 810 H ASN 223 -27.178 2.587 -11.153 1.00 0.00 H +ATOM 811 CA ASN 223 -26.412 3.784 -12.845 1.00 0.00 C +ATOM 812 HA ASN 223 -26.346 4.788 -12.729 1.00 0.00 H +ATOM 813 CB ASN 223 -25.052 3.121 -12.625 1.00 0.00 C +ATOM 814 HB2 ASN 223 -25.205 2.158 -12.418 1.00 0.00 H +ATOM 815 HB3 ASN 223 -24.523 3.209 -13.466 1.00 0.00 H +ATOM 816 CG ASN 223 -24.284 3.747 -11.496 1.00 0.00 C +ATOM 817 OD1 ASN 223 -24.321 4.960 -11.310 1.00 0.00 O +ATOM 818 ND2 ASN 223 -23.569 2.929 -10.741 1.00 0.00 N +ATOM 819 HD21 ASN 223 -23.040 3.287 -9.970 1.00 0.00 H +ATOM 820 HD22 ASN 223 -23.554 1.946 -10.939 1.00 0.00 H +ATOM 821 C ASN 223 -26.845 3.528 -14.280 1.00 0.00 C +ATOM 822 O ASN 223 -26.482 4.267 -15.189 1.00 0.00 O +ATOM 823 N HIE 224 -27.626 2.479 -14.479 1.00 0.00 N +ATOM 824 H HIE 224 -27.882 1.952 -13.625 1.00 0.00 H +ATOM 825 CA HIE 224 -28.068 2.127 -15.810 1.00 0.00 C +ATOM 826 HA HIE 224 -27.697 2.802 -16.464 1.00 0.00 H +ATOM 827 CB HIE 224 -27.465 0.762 -16.162 1.00 0.00 C +ATOM 828 HB2 HIE 224 -27.749 0.092 -15.474 1.00 0.00 H +ATOM 829 HB3 HIE 224 -27.804 0.478 -17.060 1.00 0.00 H +ATOM 830 CG HIE 224 -25.966 0.787 -16.208 1.00 0.00 C +ATOM 831 ND1 HIE 224 -25.278 1.419 -17.219 1.00 0.00 N +ATOM 832 CE1 HIE 224 -23.982 1.395 -16.948 1.00 0.00 C +ATOM 833 HE1 HIE 224 -23.263 1.785 -17.515 1.00 0.00 H +ATOM 834 NE2 HIE 224 -23.808 0.766 -15.803 1.00 0.00 N +ATOM 835 HE2 HIE 224 -22.922 0.599 -15.348 1.00 0.00 H +ATOM 836 CD2 HIE 224 -25.033 0.367 -15.317 1.00 0.00 C +ATOM 837 HD2 HIE 224 -25.199 -0.133 -14.475 1.00 0.00 H +ATOM 838 C HIE 224 -29.589 2.151 -15.920 1.00 0.00 C +ATOM 839 O HIE 224 -30.184 1.417 -16.696 1.00 0.00 O +ATOM 840 N GLU 225 -30.198 3.056 -15.157 1.00 0.00 N +ATOM 841 H GLU 225 -29.545 3.640 -14.582 1.00 0.00 H +ATOM 842 CA GLU 225 -31.647 3.223 -15.122 1.00 0.00 C +ATOM 843 HA GLU 225 -32.064 2.437 -14.627 1.00 0.00 H +ATOM 844 CB GLU 225 -32.009 4.470 -14.313 1.00 0.00 C +ATOM 845 HB2 GLU 225 -31.779 4.294 -13.373 1.00 0.00 H +ATOM 846 HB3 GLU 225 -31.502 5.226 -14.684 1.00 0.00 H +ATOM 847 CG GLU 225 -33.485 4.834 -14.366 1.00 0.00 C +ATOM 848 HG2 GLU 225 -33.750 4.902 -15.307 1.00 0.00 H +ATOM 849 HG3 GLU 225 -33.989 4.148 -13.879 1.00 0.00 H +ATOM 850 CD GLU 225 -33.767 6.167 -13.709 1.00 0.00 C +ATOM 851 OE1 GLU 225 -34.384 6.172 -12.627 1.00 0.00 O +ATOM 852 OE2 GLU 225 -33.367 7.211 -14.275 1.00 0.00 O +ATOM 853 C GLU 225 -32.279 3.340 -16.501 1.00 0.00 C +ATOM 854 O GLU 225 -33.199 2.598 -16.844 1.00 0.00 O +ATOM 855 N THR 226 -31.799 4.295 -17.283 1.00 0.00 N +ATOM 856 H THR 226 -31.027 4.852 -16.875 1.00 0.00 H +ATOM 857 CA THR 226 -32.340 4.519 -18.614 1.00 0.00 C +ATOM 858 HA THR 226 -33.312 4.798 -18.524 1.00 0.00 H +ATOM 859 CB THR 226 -31.601 5.678 -19.321 1.00 0.00 C +ATOM 860 HB THR 226 -30.630 5.406 -19.466 1.00 0.00 H +ATOM 861 CG2 THR 226 -32.278 6.016 -20.645 1.00 0.00 C +ATOM 862 HG21 THR 226 -33.265 5.859 -20.570 1.00 0.00 H +ATOM 863 HG22 THR 226 -32.114 6.978 -20.873 1.00 0.00 H +ATOM 864 HG23 THR 226 -31.906 5.437 -21.373 1.00 0.00 H +ATOM 865 OG1 THR 226 -31.622 6.837 -18.478 1.00 0.00 O +ATOM 866 HG1 THR 226 -32.024 6.612 -17.584 1.00 0.00 H +ATOM 867 C THR 226 -32.285 3.274 -19.493 1.00 0.00 C +ATOM 868 O THR 226 -33.275 2.921 -20.132 1.00 0.00 O +ATOM 869 N ALA 227 -31.140 2.604 -19.535 1.00 0.00 N +ATOM 870 H ALA 227 -30.377 2.985 -18.965 1.00 0.00 H +ATOM 871 CA ALA 227 -31.030 1.404 -20.360 1.00 0.00 C +ATOM 872 HA ALA 227 -31.313 1.626 -21.299 1.00 0.00 H +ATOM 873 CB ALA 227 -29.587 0.923 -20.403 1.00 0.00 C +ATOM 874 HB1 ALA 227 -29.545 0.033 -20.856 1.00 0.00 H +ATOM 875 HB2 ALA 227 -29.030 1.580 -20.910 1.00 0.00 H +ATOM 876 HB3 ALA 227 -29.235 0.839 -19.471 1.00 0.00 H +ATOM 877 C ALA 227 -31.946 0.291 -19.831 1.00 0.00 C +ATOM 878 O ALA 227 -32.558 -0.445 -20.607 1.00 0.00 O +ATOM 879 N PHE 228 -32.040 0.180 -18.508 1.00 0.00 N +ATOM 880 H PHE 228 -31.483 0.867 -17.970 1.00 0.00 H +ATOM 881 CA PHE 228 -32.875 -0.845 -17.894 1.00 0.00 C +ATOM 882 HA PHE 228 -32.609 -1.726 -18.303 1.00 0.00 H +ATOM 883 CB PHE 228 -32.657 -0.863 -16.376 1.00 0.00 C +ATOM 884 HB2 PHE 228 -32.453 0.057 -16.087 1.00 0.00 H +ATOM 885 HB3 PHE 228 -33.480 -1.206 -15.955 1.00 0.00 H +ATOM 886 CG PHE 228 -31.509 -1.751 -15.940 1.00 0.00 C +ATOM 887 CD1 PHE 228 -30.329 -1.796 -16.678 1.00 0.00 C +ATOM 888 HD1 PHE 228 -30.236 -1.239 -17.499 1.00 0.00 H +ATOM 889 CE1 PHE 228 -29.267 -2.610 -16.286 1.00 0.00 C +ATOM 890 HE1 PHE 228 -28.428 -2.631 -16.841 1.00 0.00 H +ATOM 891 CZ PHE 228 -29.369 -3.390 -15.134 1.00 0.00 C +ATOM 892 HZ PHE 228 -28.607 -3.965 -14.854 1.00 0.00 H +ATOM 893 CE2 PHE 228 -30.542 -3.356 -14.382 1.00 0.00 C +ATOM 894 HE2 PHE 228 -30.638 -3.918 -13.551 1.00 0.00 H +ATOM 895 CD2 PHE 228 -31.606 -2.531 -14.785 1.00 0.00 C +ATOM 896 HD2 PHE 228 -32.438 -2.504 -14.237 1.00 0.00 H +ATOM 897 C PHE 228 -34.346 -0.630 -18.234 1.00 0.00 C +ATOM 898 O PHE 228 -35.036 -1.576 -18.613 1.00 0.00 O +ATOM 899 N GLN 229 -34.822 0.609 -18.104 1.00 0.00 N +ATOM 900 H GLN 229 -34.143 1.306 -17.757 1.00 0.00 H +ATOM 901 CA GLN 229 -36.212 0.925 -18.437 1.00 0.00 C +ATOM 902 HA GLN 229 -36.802 0.315 -17.914 1.00 0.00 H +ATOM 903 CB GLN 229 -36.517 2.409 -18.220 1.00 0.00 C +ATOM 904 HB2 GLN 229 -35.962 2.948 -18.880 1.00 0.00 H +ATOM 905 HB3 GLN 229 -37.494 2.572 -18.458 1.00 0.00 H +ATOM 906 CG GLN 229 -36.275 2.978 -16.835 1.00 0.00 C +ATOM 907 HG2 GLN 229 -36.906 2.557 -16.194 1.00 0.00 H +ATOM 908 HG3 GLN 229 -35.335 2.800 -16.569 1.00 0.00 H +ATOM 909 CD GLN 229 -36.503 4.493 -16.807 1.00 0.00 C +ATOM 910 OE1 GLN 229 -37.320 4.990 -16.022 1.00 0.00 O +ATOM 911 NE2 GLN 229 -35.779 5.232 -17.659 1.00 0.00 N +ATOM 912 HE21 GLN 229 -35.892 6.229 -17.699 1.00 0.00 H +ATOM 913 HE22 GLN 229 -35.111 4.755 -18.263 1.00 0.00 H +ATOM 914 C GLN 229 -36.435 0.633 -19.922 1.00 0.00 C +ATOM 915 O GLN 229 -37.483 0.135 -20.321 1.00 0.00 O +ATOM 916 N GLY 230 -35.441 0.976 -20.732 1.00 0.00 N +ATOM 917 H GLY 230 -34.618 1.394 -20.266 1.00 0.00 H +ATOM 918 CA GLY 230 -35.540 0.763 -22.165 1.00 0.00 C +ATOM 919 HA2 GLY 230 -36.349 1.273 -22.524 1.00 0.00 H +ATOM 920 HA3 GLY 230 -34.723 1.173 -22.621 1.00 0.00 H +ATOM 921 C GLY 230 -35.654 -0.692 -22.564 1.00 0.00 C +ATOM 922 O GLY 230 -36.481 -1.049 -23.410 1.00 0.00 O +ATOM 923 N MET 231 -34.824 -1.535 -21.957 1.00 0.00 N +ATOM 924 H MET 231 -34.183 -1.102 -21.270 1.00 0.00 H +ATOM 925 CA MET 231 -34.844 -2.958 -22.262 1.00 0.00 C +ATOM 926 HA MET 231 -34.808 -3.069 -23.257 1.00 0.00 H +ATOM 927 CB MET 231 -33.647 -3.666 -21.615 1.00 0.00 C +ATOM 928 HB2 MET 231 -32.797 -3.241 -21.947 1.00 0.00 H +ATOM 929 HB3 MET 231 -33.695 -3.543 -20.617 1.00 0.00 H +ATOM 930 CG MET 231 -33.583 -5.163 -21.911 1.00 0.00 C +ATOM 931 HG2 MET 231 -32.788 -5.561 -21.399 1.00 0.00 H +ATOM 932 HG3 MET 231 -34.416 -5.610 -21.511 1.00 0.00 H +ATOM 933 SD MET 231 -33.450 -5.539 -23.685 1.00 0.00 S +ATOM 934 CE MET 231 -32.706 -7.161 -23.630 1.00 0.00 C +ATOM 935 HE1 MET 231 -32.654 -7.541 -24.556 1.00 0.00 H +ATOM 936 HE2 MET 231 -31.782 -7.097 -23.248 1.00 0.00 H +ATOM 937 HE3 MET 231 -33.259 -7.768 -23.055 1.00 0.00 H +ATOM 938 C MET 231 -36.150 -3.574 -21.767 1.00 0.00 C +ATOM 939 O MET 231 -36.762 -4.372 -22.472 1.00 0.00 O +ATOM 940 N LEU 232 -36.589 -3.202 -20.565 1.00 0.00 N +ATOM 941 H LEU 232 -36.000 -2.524 -20.067 1.00 0.00 H +ATOM 942 CA LEU 232 -37.835 -3.753 -20.035 1.00 0.00 C +ATOM 943 HA LEU 232 -37.737 -4.753 -19.955 1.00 0.00 H +ATOM 944 CB LEU 232 -38.108 -3.214 -18.619 1.00 0.00 C +ATOM 945 HB2 LEU 232 -37.344 -3.478 -18.041 1.00 0.00 H +ATOM 946 HB3 LEU 232 -38.178 -2.226 -18.678 1.00 0.00 H +ATOM 947 CG LEU 232 -39.392 -3.726 -17.941 1.00 0.00 C +ATOM 948 HG LEU 232 -40.171 -3.491 -18.518 1.00 0.00 H +ATOM 949 CD1 LEU 232 -39.318 -5.224 -17.761 1.00 0.00 C +ATOM 950 HD11 LEU 232 -38.530 -5.459 -17.188 1.00 0.00 H +ATOM 951 HD12 LEU 232 -40.155 -5.555 -17.320 1.00 0.00 H +ATOM 952 HD13 LEU 232 -39.220 -5.669 -18.653 1.00 0.00 H +ATOM 953 CD2 LEU 232 -39.595 -3.050 -16.608 1.00 0.00 C +ATOM 954 HD21 LEU 232 -39.673 -2.058 -16.737 1.00 0.00 H +ATOM 955 HD22 LEU 232 -40.434 -3.391 -16.176 1.00 0.00 H +ATOM 956 HD23 LEU 232 -38.816 -3.241 -16.006 1.00 0.00 H +ATOM 957 C LEU 232 -39.024 -3.463 -20.965 1.00 0.00 C +ATOM 958 O LEU 232 -39.825 -4.358 -21.258 1.00 0.00 O +ATOM 959 N ARG 233 -39.128 -2.222 -21.441 1.00 0.00 N +ATOM 960 H ARG 233 -38.392 -1.567 -21.116 1.00 0.00 H +ATOM 961 CA ARG 233 -40.209 -1.829 -22.355 1.00 0.00 C +ATOM 962 HA ARG 233 -41.088 -1.993 -21.902 1.00 0.00 H +ATOM 963 CB ARG 233 -40.090 -0.339 -22.721 1.00 0.00 C +ATOM 964 HB2 ARG 233 -40.217 0.195 -21.889 1.00 0.00 H +ATOM 965 HB3 ARG 233 -39.178 -0.183 -23.090 1.00 0.00 H +ATOM 966 CG ARG 233 -41.106 0.149 -23.754 1.00 0.00 C +ATOM 967 HG2 ARG 233 -40.816 -0.134 -24.658 1.00 0.00 H +ATOM 968 HG3 ARG 233 -41.999 -0.219 -23.534 1.00 0.00 H +ATOM 969 CD ARG 233 -41.191 1.664 -23.727 1.00 0.00 C +ATOM 970 HD2 ARG 233 -40.826 1.981 -22.864 1.00 0.00 H +ATOM 971 HD3 ARG 233 -40.667 2.018 -24.489 1.00 0.00 H +ATOM 972 NE ARG 233 -42.583 2.097 -23.853 1.00 0.00 N +ATOM 973 HE ARG 233 -43.096 2.270 -22.997 1.00 0.00 H +ATOM 974 CZ ARG 233 -43.223 2.280 -25.000 1.00 0.00 C +ATOM 975 NH1 ARG 233 -42.604 2.085 -26.154 1.00 0.00 N +ATOM 976 HH11 ARG 233 -41.655 1.779 -26.184 1.00 0.00 H +ATOM 977 HH12 ARG 233 -43.096 2.246 -27.018 1.00 0.00 H +ATOM 978 NH2 ARG 233 -44.495 2.646 -24.990 1.00 0.00 N +ATOM 979 HH21 ARG 233 -44.976 2.765 -24.118 1.00 0.00 H +ATOM 980 HH22 ARG 233 -44.981 2.804 -25.850 1.00 0.00 H +ATOM 981 C ARG 233 -40.147 -2.669 -23.628 1.00 0.00 C +ATOM 982 O ARG 233 -41.156 -3.186 -24.111 1.00 0.00 O +ATOM 983 N LYS 234 -38.945 -2.788 -24.172 1.00 0.00 N +ATOM 984 H LYS 234 -38.187 -2.283 -23.661 1.00 0.00 H +ATOM 985 CA LYS 234 -38.717 -3.558 -25.377 1.00 0.00 C +ATOM 986 HA LYS 234 -39.224 -3.132 -26.142 1.00 0.00 H +ATOM 987 CB LYS 234 -37.226 -3.516 -25.701 1.00 0.00 C +ATOM 988 HB2 LYS 234 -36.952 -2.545 -25.764 1.00 0.00 H +ATOM 989 HB3 LYS 234 -36.730 -3.924 -24.920 1.00 0.00 H +ATOM 990 CG LYS 234 -36.794 -4.215 -26.958 1.00 0.00 C +ATOM 991 HG2 LYS 234 -36.765 -5.192 -26.806 1.00 0.00 H +ATOM 992 HG3 LYS 234 -37.406 -3.984 -27.699 1.00 0.00 H +ATOM 993 CD LYS 234 -35.391 -3.735 -27.315 1.00 0.00 C +ATOM 994 HD2 LYS 234 -35.458 -3.070 -28.053 1.00 0.00 H +ATOM 995 HD3 LYS 234 -34.980 -3.316 -26.511 1.00 0.00 H +ATOM 996 CE LYS 234 -34.497 -4.881 -27.774 1.00 0.00 C +ATOM 997 HE2 LYS 234 -34.432 -5.562 -27.035 1.00 0.00 H +ATOM 998 HE3 LYS 234 -34.916 -5.324 -28.576 1.00 0.00 H +ATOM 999 NZ LYS 234 -33.104 -4.438 -28.144 1.00 0.00 N +ATOM 1000 HZ1 LYS 234 -32.517 -4.519 -27.343 1.00 0.00 H +ATOM 1001 HZ2 LYS 234 -32.765 -5.022 -28.877 1.00 0.00 H +ATOM 1002 HZ3 LYS 234 -33.138 -3.490 -28.449 1.00 0.00 H +ATOM 1003 C LYS 234 -39.192 -4.997 -25.225 1.00 0.00 C +ATOM 1004 O LYS 234 -39.803 -5.550 -26.143 1.00 0.00 O +ATOM 1005 N LEU 235 -38.898 -5.594 -24.072 1.00 0.00 N +ATOM 1006 H LEU 235 -38.370 -4.992 -23.399 1.00 0.00 H +ATOM 1007 CA LEU 235 -39.280 -6.971 -23.774 1.00 0.00 C +ATOM 1008 HA LEU 235 -38.951 -7.565 -24.526 1.00 0.00 H +ATOM 1009 CB LEU 235 -38.581 -7.431 -22.494 1.00 0.00 C +ATOM 1010 HB2 LEU 235 -38.735 -6.749 -21.799 1.00 0.00 H +ATOM 1011 HB3 LEU 235 -38.953 -8.307 -22.239 1.00 0.00 H +ATOM 1012 CG LEU 235 -37.066 -7.599 -22.646 1.00 0.00 C +ATOM 1013 HG LEU 235 -36.686 -6.758 -23.029 1.00 0.00 H +ATOM 1014 CD1 LEU 235 -36.429 -7.880 -21.301 1.00 0.00 C +ATOM 1015 HD11 LEU 235 -36.811 -8.721 -20.915 1.00 0.00 H +ATOM 1016 HD12 LEU 235 -35.439 -7.988 -21.412 1.00 0.00 H +ATOM 1017 HD13 LEU 235 -36.610 -7.119 -20.676 1.00 0.00 H +ATOM 1018 CD2 LEU 235 -36.785 -8.737 -23.619 1.00 0.00 C +ATOM 1019 HD21 LEU 235 -37.190 -8.524 -24.508 1.00 0.00 H +ATOM 1020 HD22 LEU 235 -35.796 -8.851 -23.722 1.00 0.00 H +ATOM 1021 HD23 LEU 235 -37.183 -9.584 -23.266 1.00 0.00 H +ATOM 1022 C LEU 235 -40.790 -7.151 -23.649 1.00 0.00 C +ATOM 1023 O LEU 235 -41.312 -8.244 -23.864 1.00 0.00 O +ATOM 1024 N ASP 236 -41.479 -6.078 -23.281 1.00 0.00 N +ATOM 1025 H ASP 236 -40.897 -5.237 -23.078 1.00 0.00 H +ATOM 1026 CA ASP 236 -42.930 -6.089 -23.174 1.00 0.00 C +ATOM 1027 HA ASP 236 -43.198 -5.284 -22.612 1.00 0.00 H +ATOM 1028 CB ASP 236 -43.512 -5.955 -24.582 1.00 0.00 C +ATOM 1029 HB2 ASP 236 -43.130 -5.134 -24.994 1.00 0.00 H +ATOM 1030 HB3 ASP 236 -43.244 -6.759 -25.102 1.00 0.00 H +ATOM 1031 CG ASP 236 -45.020 -5.848 -24.587 1.00 0.00 C +ATOM 1032 OD1 ASP 236 -45.614 -5.551 -23.527 1.00 0.00 O +ATOM 1033 OD2 ASP 236 -45.595 -6.052 -25.673 1.00 0.00 O +ATOM 1034 C ASP 236 -43.492 -7.326 -22.464 1.00 0.00 C +ATOM 1035 O ASP 236 -44.227 -8.124 -23.049 1.00 0.00 O +ATOM 1036 N ILE 237 -43.153 -7.458 -21.184 1.00 0.00 N +ATOM 1037 H ILE 237 -42.562 -6.680 -20.813 1.00 0.00 H +ATOM 1038 CA ILE 237 -43.573 -8.593 -20.373 1.00 0.00 C +ATOM 1039 HA ILE 237 -43.630 -9.385 -21.002 1.00 0.00 H +ATOM 1040 CB ILE 237 -42.572 -8.834 -19.239 1.00 0.00 C +ATOM 1041 HB ILE 237 -42.634 -8.076 -18.604 1.00 0.00 H +ATOM 1042 CG2 ILE 237 -42.882 -10.158 -18.555 1.00 0.00 C +ATOM 1043 HG21 ILE 237 -42.233 -10.309 -17.812 1.00 0.00 H +ATOM 1044 HG22 ILE 237 -43.810 -10.134 -18.186 1.00 0.00 H +ATOM 1045 HG23 ILE 237 -42.808 -10.901 -19.218 1.00 0.00 H +ATOM 1046 CG1 ILE 237 -41.151 -8.856 -19.811 1.00 0.00 C +ATOM 1047 HG12 ILE 237 -41.034 -9.703 -20.330 1.00 0.00 H +ATOM 1048 HG13 ILE 237 -41.058 -8.085 -20.443 1.00 0.00 H +ATOM 1049 CD1 ILE 237 -40.061 -8.763 -18.768 1.00 0.00 C +ATOM 1050 HD11 ILE 237 -40.136 -9.536 -18.139 1.00 0.00 H +ATOM 1051 HD12 ILE 237 -39.169 -8.784 -19.217 1.00 0.00 H +ATOM 1052 HD13 ILE 237 -40.160 -7.908 -18.260 1.00 0.00 H +ATOM 1053 C ILE 237 -44.960 -8.419 -19.768 1.00 0.00 C +ATOM 1054 O ILE 237 -45.183 -7.546 -18.917 1.00 0.00 O +ATOM 1055 N LYS 238 -45.884 -9.273 -20.199 1.00 0.00 N +ATOM 1056 H LYS 238 -45.540 -9.973 -20.889 1.00 0.00 H +ATOM 1057 CA LYS 238 -47.262 -9.218 -19.732 1.00 0.00 C +ATOM 1058 HA LYS 238 -47.355 -8.439 -19.081 1.00 0.00 H +ATOM 1059 CB LYS 238 -48.179 -8.957 -20.924 1.00 0.00 C +ATOM 1060 HB2 LYS 238 -48.145 -9.754 -21.526 1.00 0.00 H +ATOM 1061 HB3 LYS 238 -49.111 -8.837 -20.582 1.00 0.00 H +ATOM 1062 CG LYS 238 -47.810 -7.728 -21.741 1.00 0.00 C +ATOM 1063 HG2 LYS 238 -48.003 -6.906 -21.206 1.00 0.00 H +ATOM 1064 HG3 LYS 238 -46.837 -7.760 -21.966 1.00 0.00 H +ATOM 1065 CD LYS 238 -48.610 -7.654 -23.052 1.00 0.00 C +ATOM 1066 HD2 LYS 238 -49.480 -8.117 -22.922 1.00 0.00 H +ATOM 1067 HD3 LYS 238 -48.756 -6.699 -23.285 1.00 0.00 H +ATOM 1068 CE LYS 238 -47.874 -8.330 -24.227 1.00 0.00 C +ATOM 1069 HE2 LYS 238 -48.518 -8.438 -24.988 1.00 0.00 H +ATOM 1070 HE3 LYS 238 -47.121 -7.735 -24.517 1.00 0.00 H +ATOM 1071 NZ LYS 238 -47.318 -9.681 -23.860 1.00 0.00 N +ATOM 1072 HZ1 LYS 238 -47.680 -10.361 -24.492 1.00 0.00 H +ATOM 1073 HZ2 LYS 238 -46.324 -9.649 -23.925 1.00 0.00 H +ATOM 1074 HZ3 LYS 238 -47.593 -9.900 -22.927 1.00 0.00 H +ATOM 1075 C LYS 238 -47.726 -10.489 -19.030 1.00 0.00 C +ATOM 1076 O LYS 238 -48.572 -10.441 -18.132 1.00 0.00 O +ATOM 1077 N ASN 239 -47.178 -11.625 -19.441 1.00 0.00 N +ATOM 1078 H ASN 239 -46.461 -11.534 -20.173 1.00 0.00 H +ATOM 1079 CA ASN 239 -47.600 -12.889 -18.861 1.00 0.00 C +ATOM 1080 HA ASN 239 -47.917 -12.691 -17.910 1.00 0.00 H +ATOM 1081 CB ASN 239 -48.744 -13.446 -19.706 1.00 0.00 C +ATOM 1082 HB2 ASN 239 -48.927 -14.379 -19.418 1.00 0.00 H +ATOM 1083 HB3 ASN 239 -49.546 -12.875 -19.570 1.00 0.00 H +ATOM 1084 CG ASN 239 -48.407 -13.458 -21.193 1.00 0.00 C +ATOM 1085 OD1 ASN 239 -47.492 -14.166 -21.637 1.00 0.00 O +ATOM 1086 ND2 ASN 239 -49.138 -12.669 -21.970 1.00 0.00 N +ATOM 1087 HD21 ASN 239 -48.969 -12.636 -22.955 1.00 0.00 H +ATOM 1088 HD22 ASN 239 -49.861 -12.103 -21.569 1.00 0.00 H +ATOM 1089 C ASN 239 -46.506 -13.939 -18.750 1.00 0.00 C +ATOM 1090 O ASN 239 -45.313 -13.666 -18.947 1.00 0.00 O +ATOM 1091 N GLU 240 -46.952 -15.156 -18.459 1.00 0.00 N +ATOM 1092 H GLU 240 -48.000 -15.208 -18.353 1.00 0.00 H +ATOM 1093 CA GLU 240 -46.091 -16.315 -18.299 1.00 0.00 C +ATOM 1094 HA GLU 240 -45.426 -16.146 -17.552 1.00 0.00 H +ATOM 1095 CB GLU 240 -46.957 -17.490 -17.848 1.00 0.00 C +ATOM 1096 HB2 GLU 240 -47.330 -17.258 -16.955 1.00 0.00 H +ATOM 1097 HB3 GLU 240 -47.690 -17.591 -18.512 1.00 0.00 H +ATOM 1098 CG GLU 240 -46.262 -18.822 -17.724 1.00 0.00 C +ATOM 1099 HG2 GLU 240 -46.068 -19.159 -18.621 1.00 0.00 H +ATOM 1100 HG3 GLU 240 -45.463 -18.710 -17.173 1.00 0.00 H +ATOM 1101 CD GLU 240 -47.151 -19.838 -17.037 1.00 0.00 C +ATOM 1102 OE1 GLU 240 -48.271 -20.067 -17.540 1.00 0.00 O +ATOM 1103 OE2 GLU 240 -46.731 -20.397 -15.997 1.00 0.00 O +ATOM 1104 C GLU 240 -45.330 -16.660 -19.577 1.00 0.00 C +ATOM 1105 O GLU 240 -44.142 -16.980 -19.526 1.00 0.00 O +ATOM 1106 N ASP 241 -46.003 -16.593 -20.721 1.00 0.00 N +ATOM 1107 H ASP 241 -46.986 -16.316 -20.645 1.00 0.00 H +ATOM 1108 CA ASP 241 -45.327 -16.906 -21.970 1.00 0.00 C +ATOM 1109 HA ASP 241 -44.904 -17.812 -21.866 1.00 0.00 H +ATOM 1110 CB ASP 241 -46.316 -16.953 -23.145 1.00 0.00 C +ATOM 1111 HB2 ASP 241 -46.894 -16.152 -23.094 1.00 0.00 H +ATOM 1112 HB3 ASP 241 -45.796 -16.967 -23.985 1.00 0.00 H +ATOM 1113 CG ASP 241 -47.208 -18.199 -23.103 1.00 0.00 C +ATOM 1114 OD1 ASP 241 -46.773 -19.234 -22.538 1.00 0.00 O +ATOM 1115 OD2 ASP 241 -48.335 -18.158 -23.643 1.00 0.00 O +ATOM 1116 C ASP 241 -44.188 -15.913 -22.229 1.00 0.00 C +ATOM 1117 O ASP 241 -43.108 -16.313 -22.680 1.00 0.00 O +ATOM 1118 N ASP 242 -44.404 -14.628 -21.944 1.00 0.00 N +ATOM 1119 H ASP 242 -45.338 -14.393 -21.607 1.00 0.00 H +ATOM 1120 CA ASP 242 -43.319 -13.655 -22.126 1.00 0.00 C +ATOM 1121 HA ASP 242 -42.953 -13.790 -23.048 1.00 0.00 H +ATOM 1122 CB ASP 242 -43.792 -12.217 -21.884 1.00 0.00 C +ATOM 1123 HB2 ASP 242 -44.008 -12.126 -20.917 1.00 0.00 H +ATOM 1124 HB3 ASP 242 -43.047 -11.606 -22.130 1.00 0.00 H +ATOM 1125 CG ASP 242 -45.015 -11.852 -22.695 1.00 0.00 C +ATOM 1126 OD1 ASP 242 -45.044 -12.127 -23.907 1.00 0.00 O +ATOM 1127 OD2 ASP 242 -45.950 -11.279 -22.106 1.00 0.00 O +ATOM 1128 C ASP 242 -42.181 -13.949 -21.144 1.00 0.00 C +ATOM 1129 O ASP 242 -41.015 -13.758 -21.470 1.00 0.00 O +ATOM 1130 N VAL 243 -42.505 -14.396 -19.934 1.00 0.00 N +ATOM 1131 H VAL 243 -43.506 -14.513 -19.754 1.00 0.00 H +ATOM 1132 CA VAL 243 -41.453 -14.684 -18.965 1.00 0.00 C +ATOM 1133 HA VAL 243 -40.864 -13.877 -18.892 1.00 0.00 H +ATOM 1134 CB VAL 243 -42.030 -15.023 -17.558 1.00 0.00 C +ATOM 1135 HB VAL 243 -42.661 -15.780 -17.672 1.00 0.00 H +ATOM 1136 CG1 VAL 243 -40.915 -15.500 -16.632 1.00 0.00 C +ATOM 1137 HG11 VAL 243 -40.495 -16.322 -17.014 1.00 0.00 H +ATOM 1138 HG12 VAL 243 -40.225 -14.782 -16.546 1.00 0.00 H +ATOM 1139 HG13 VAL 243 -41.297 -15.707 -15.732 1.00 0.00 H +ATOM 1140 CG2 VAL 243 -42.699 -13.795 -16.959 1.00 0.00 C +ATOM 1141 HG21 VAL 243 -43.686 -13.851 -17.107 1.00 0.00 H +ATOM 1142 HG22 VAL 243 -42.507 -13.760 -15.978 1.00 0.00 H +ATOM 1143 HG23 VAL 243 -42.339 -12.974 -17.402 1.00 0.00 H +ATOM 1144 C VAL 243 -40.604 -15.844 -19.465 1.00 0.00 C +ATOM 1145 O VAL 243 -39.394 -15.845 -19.300 1.00 0.00 O +ATOM 1146 N LYS 244 -41.241 -16.828 -20.091 1.00 0.00 N +ATOM 1147 H LYS 244 -42.262 -16.706 -20.180 1.00 0.00 H +ATOM 1148 CA LYS 244 -40.512 -17.979 -20.600 1.00 0.00 C +ATOM 1149 HA LYS 244 -39.925 -18.344 -19.871 1.00 0.00 H +ATOM 1150 CB LYS 244 -41.491 -19.072 -21.035 1.00 0.00 C +ATOM 1151 HB2 LYS 244 -42.115 -18.680 -21.705 1.00 0.00 H +ATOM 1152 HB3 LYS 244 -40.966 -19.811 -21.449 1.00 0.00 H +ATOM 1153 CG LYS 244 -42.307 -19.641 -19.892 1.00 0.00 C +ATOM 1154 HG2 LYS 244 -41.711 -19.784 -19.101 1.00 0.00 H +ATOM 1155 HG3 LYS 244 -43.032 -18.997 -19.652 1.00 0.00 H +ATOM 1156 CD LYS 244 -42.940 -20.971 -20.274 1.00 0.00 C +ATOM 1157 HD2 LYS 244 -43.713 -20.800 -20.869 1.00 0.00 H +ATOM 1158 HD3 LYS 244 -42.261 -21.534 -20.723 1.00 0.00 H +ATOM 1159 CE LYS 244 -43.432 -21.698 -19.032 1.00 0.00 C +ATOM 1160 HE2 LYS 244 -42.715 -21.672 -18.334 1.00 0.00 H +ATOM 1161 HE3 LYS 244 -44.248 -21.234 -18.684 1.00 0.00 H +ATOM 1162 NZ LYS 244 -43.770 -23.120 -19.332 1.00 0.00 N +ATOM 1163 HZ1 LYS 244 -44.005 -23.589 -18.482 1.00 0.00 H +ATOM 1164 HZ2 LYS 244 -44.548 -23.149 -19.958 1.00 0.00 H +ATOM 1165 HZ3 LYS 244 -42.981 -23.564 -19.755 1.00 0.00 H +ATOM 1166 C LYS 244 -39.634 -17.566 -21.772 1.00 0.00 C +ATOM 1167 O LYS 244 -38.559 -18.126 -21.990 1.00 0.00 O +ATOM 1168 N SER 245 -40.084 -16.571 -22.522 1.00 0.00 N +ATOM 1169 H SER 245 -40.986 -16.165 -22.226 1.00 0.00 H +ATOM 1170 CA SER 245 -39.327 -16.110 -23.679 1.00 0.00 C +ATOM 1171 HA SER 245 -39.098 -16.917 -24.247 1.00 0.00 H +ATOM 1172 CB SER 245 -40.176 -15.146 -24.509 1.00 0.00 C +ATOM 1173 HB2 SER 245 -39.747 -15.025 -25.399 1.00 0.00 H +ATOM 1174 HB3 SER 245 -41.087 -15.533 -24.617 1.00 0.00 H +ATOM 1175 OG SER 245 -40.283 -13.886 -23.872 1.00 0.00 O +ATOM 1176 HG SER 245 -40.573 -14.015 -22.924 1.00 0.00 H +ATOM 1177 C SER 245 -38.014 -15.430 -23.290 1.00 0.00 C +ATOM 1178 O SER 245 -37.148 -15.217 -24.137 1.00 0.00 O +ATOM 1179 N LEU 246 -37.859 -15.104 -22.010 1.00 0.00 N +ATOM 1180 H LEU 246 -38.642 -15.366 -21.390 1.00 0.00 H +ATOM 1181 CA LEU 246 -36.651 -14.423 -21.551 1.00 0.00 C +ATOM 1182 HA LEU 246 -36.510 -13.595 -22.137 1.00 0.00 H +ATOM 1183 CB LEU 246 -36.860 -13.871 -20.137 1.00 0.00 C +ATOM 1184 HB2 LEU 246 -37.135 -14.618 -19.557 1.00 0.00 H +ATOM 1185 HB3 LEU 246 -36.015 -13.464 -19.841 1.00 0.00 H +ATOM 1186 CG LEU 246 -37.946 -12.798 -20.057 1.00 0.00 C +ATOM 1187 HG LEU 246 -38.782 -13.150 -20.467 1.00 0.00 H +ATOM 1188 CD1 LEU 246 -38.209 -12.441 -18.599 1.00 0.00 C +ATOM 1189 HD11 LEU 246 -37.368 -12.093 -18.184 1.00 0.00 H +ATOM 1190 HD12 LEU 246 -38.920 -11.739 -18.551 1.00 0.00 H +ATOM 1191 HD13 LEU 246 -38.512 -13.256 -18.106 1.00 0.00 H +ATOM 1192 CD2 LEU 246 -37.526 -11.581 -20.857 1.00 0.00 C +ATOM 1193 HD21 LEU 246 -37.387 -11.838 -21.815 1.00 0.00 H +ATOM 1194 HD22 LEU 246 -38.239 -10.879 -20.803 1.00 0.00 H +ATOM 1195 HD23 LEU 246 -36.671 -11.212 -20.487 1.00 0.00 H +ATOM 1196 C LEU 246 -35.376 -15.259 -21.598 1.00 0.00 C +ATOM 1197 O LEU 246 -34.285 -14.711 -21.756 1.00 0.00 O +ATOM 1198 N SER 247 -35.501 -16.575 -21.463 1.00 0.00 N +ATOM 1199 H SER 247 -36.463 -16.918 -21.330 1.00 0.00 H +ATOM 1200 CA SER 247 -34.326 -17.438 -21.507 1.00 0.00 C +ATOM 1201 HA SER 247 -33.723 -17.189 -20.738 1.00 0.00 H +ATOM 1202 CB SER 247 -34.731 -18.912 -21.372 1.00 0.00 C +ATOM 1203 HB2 SER 247 -35.345 -19.144 -22.121 1.00 0.00 H +ATOM 1204 HB3 SER 247 -33.909 -19.473 -21.418 1.00 0.00 H +ATOM 1205 OG SER 247 -35.389 -19.155 -20.141 1.00 0.00 O +ATOM 1206 HG SER 247 -35.365 -18.328 -19.581 1.00 0.00 H +ATOM 1207 C SER 247 -33.530 -17.243 -22.802 1.00 0.00 C +ATOM 1208 O SER 247 -32.311 -17.108 -22.768 1.00 0.00 O +ATOM 1209 N ARG 248 -34.227 -17.231 -23.938 1.00 0.00 N +ATOM 1210 H ARG 248 -35.254 -17.356 -23.817 1.00 0.00 H +ATOM 1211 CA ARG 248 -33.593 -17.055 -25.249 1.00 0.00 C +ATOM 1212 HA ARG 248 -32.956 -17.818 -25.404 1.00 0.00 H +ATOM 1213 CB ARG 248 -34.660 -17.078 -26.367 1.00 0.00 C +ATOM 1214 HB2 ARG 248 -35.156 -17.940 -26.306 1.00 0.00 H +ATOM 1215 HB3 ARG 248 -35.284 -16.315 -26.218 1.00 0.00 H +ATOM 1216 CG ARG 248 -34.111 -16.956 -27.809 1.00 0.00 C +ATOM 1217 HG2 ARG 248 -33.851 -16.014 -27.980 1.00 0.00 H +ATOM 1218 HG3 ARG 248 -33.332 -17.561 -27.913 1.00 0.00 H +ATOM 1219 CD ARG 248 -35.170 -17.358 -28.856 1.00 0.00 C +ATOM 1220 HD2 ARG 248 -35.648 -18.160 -28.508 1.00 0.00 H +ATOM 1221 HD3 ARG 248 -35.805 -16.595 -28.949 1.00 0.00 H +ATOM 1222 NE ARG 248 -34.584 -17.668 -30.165 1.00 0.00 N +ATOM 1223 HE ARG 248 -34.342 -18.638 -30.345 1.00 0.00 H +ATOM 1224 CZ ARG 248 -34.344 -16.789 -31.132 1.00 0.00 C +ATOM 1225 NH1 ARG 248 -34.645 -15.504 -30.966 1.00 0.00 N +ATOM 1226 HH11 ARG 248 -35.035 -15.178 -30.109 1.00 0.00 H +ATOM 1227 HH12 ARG 248 -34.475 -14.854 -31.714 1.00 0.00 H +ATOM 1228 NH2 ARG 248 -33.783 -17.199 -32.267 1.00 0.00 N +ATOM 1229 HH21 ARG 248 -33.528 -18.161 -32.377 1.00 0.00 H +ATOM 1230 HH22 ARG 248 -33.616 -16.549 -33.006 1.00 0.00 H +ATOM 1231 C ARG 248 -32.810 -15.746 -25.304 1.00 0.00 C +ATOM 1232 O ARG 248 -31.688 -15.699 -25.813 1.00 0.00 O +ATOM 1233 N VAL 249 -33.405 -14.683 -24.773 1.00 0.00 N +ATOM 1234 H VAL 249 -34.342 -14.858 -24.373 1.00 0.00 H +ATOM 1235 CA VAL 249 -32.753 -13.381 -24.773 1.00 0.00 C +ATOM 1236 HA VAL 249 -32.458 -13.175 -25.719 1.00 0.00 H +ATOM 1237 CB VAL 249 -33.716 -12.262 -24.314 1.00 0.00 C +ATOM 1238 HB VAL 249 -33.921 -12.417 -23.357 1.00 0.00 H +ATOM 1239 CG1 VAL 249 -33.018 -10.911 -24.410 1.00 0.00 C +ATOM 1240 HG11 VAL 249 -32.036 -11.033 -24.272 1.00 0.00 H +ATOM 1241 HG12 VAL 249 -33.181 -10.515 -25.313 1.00 0.00 H +ATOM 1242 HG13 VAL 249 -33.380 -10.298 -23.708 1.00 0.00 H +ATOM 1243 CG2 VAL 249 -34.972 -12.268 -25.166 1.00 0.00 C +ATOM 1244 HG21 VAL 249 -34.718 -12.223 -26.133 1.00 0.00 H +ATOM 1245 HG22 VAL 249 -35.486 -13.109 -24.994 1.00 0.00 H +ATOM 1246 HG23 VAL 249 -35.537 -11.476 -24.931 1.00 0.00 H +ATOM 1247 C VAL 249 -31.510 -13.350 -23.882 1.00 0.00 C +ATOM 1248 O VAL 249 -30.495 -12.756 -24.245 1.00 0.00 O +ATOM 1249 N MET 250 -31.575 -13.993 -22.717 1.00 0.00 N +ATOM 1250 H MET 250 -32.471 -14.450 -22.509 1.00 0.00 H +ATOM 1251 CA MET 250 -30.413 -14.021 -21.817 1.00 0.00 C +ATOM 1252 HA MET 250 -30.108 -13.073 -21.675 1.00 0.00 H +ATOM 1253 CB MET 250 -30.767 -14.652 -20.462 1.00 0.00 C +ATOM 1254 HB2 MET 250 -31.159 -15.570 -20.623 1.00 0.00 H +ATOM 1255 HB3 MET 250 -29.917 -14.770 -19.927 1.00 0.00 H +ATOM 1256 CG MET 250 -31.756 -13.851 -19.619 1.00 0.00 C +ATOM 1257 HG2 MET 250 -31.425 -12.878 -19.564 1.00 0.00 H +ATOM 1258 HG3 MET 250 -32.651 -13.799 -20.124 1.00 0.00 H +ATOM 1259 SD MET 250 -32.022 -14.522 -17.935 1.00 0.00 S +ATOM 1260 CE MET 250 -33.303 -15.728 -18.230 1.00 0.00 C +ATOM 1261 HE1 MET 250 -33.057 -16.597 -17.796 1.00 0.00 H +ATOM 1262 HE2 MET 250 -34.170 -15.403 -17.847 1.00 0.00 H +ATOM 1263 HE3 MET 250 -33.413 -15.872 -19.216 1.00 0.00 H +ATOM 1264 C MET 250 -29.254 -14.805 -22.431 1.00 0.00 C +ATOM 1265 O MET 250 -28.099 -14.462 -22.220 1.00 0.00 O +ATOM 1266 N ILE 251 -29.562 -15.866 -23.169 1.00 0.00 N +ATOM 1267 H ILE 251 -30.571 -16.073 -23.244 1.00 0.00 H +ATOM 1268 CA ILE 251 -28.520 -16.659 -23.813 1.00 0.00 C +ATOM 1269 HA ILE 251 -27.814 -16.802 -23.131 1.00 0.00 H +ATOM 1270 CB ILE 251 -29.122 -17.962 -24.439 1.00 0.00 C +ATOM 1271 HB ILE 251 -29.942 -17.701 -24.933 1.00 0.00 H +ATOM 1272 CG2 ILE 251 -28.130 -18.591 -25.407 1.00 0.00 C +ATOM 1273 HG21 ILE 251 -28.544 -19.393 -25.834 1.00 0.00 H +ATOM 1274 HG22 ILE 251 -27.886 -17.928 -26.113 1.00 0.00 H +ATOM 1275 HG23 ILE 251 -27.308 -18.865 -24.911 1.00 0.00 H +ATOM 1276 CG1 ILE 251 -29.514 -18.960 -23.343 1.00 0.00 C +ATOM 1277 HG12 ILE 251 -30.052 -18.475 -22.652 1.00 0.00 H +ATOM 1278 HG13 ILE 251 -30.096 -19.664 -23.755 1.00 0.00 H +ATOM 1279 CD1 ILE 251 -28.341 -19.644 -22.658 1.00 0.00 C +ATOM 1280 HD11 ILE 251 -27.763 -18.952 -22.230 1.00 0.00 H +ATOM 1281 HD12 ILE 251 -28.688 -20.272 -21.964 1.00 0.00 H +ATOM 1282 HD13 ILE 251 -27.814 -20.150 -23.338 1.00 0.00 H +ATOM 1283 C ILE 251 -27.899 -15.796 -24.909 1.00 0.00 C +ATOM 1284 O ILE 251 -26.686 -15.713 -25.061 1.00 0.00 O +ATOM 1285 N HIE 252 -28.766 -15.125 -25.655 1.00 0.00 N +ATOM 1286 H HIE 252 -29.766 -15.260 -25.388 1.00 0.00 H +ATOM 1287 CA HIE 252 -28.349 -14.265 -26.763 1.00 0.00 C +ATOM 1288 HA HIE 252 -27.828 -14.831 -27.425 1.00 0.00 H +ATOM 1289 CB HIE 252 -29.595 -13.708 -27.470 1.00 0.00 C +ATOM 1290 HB2 HIE 252 -30.203 -14.475 -27.706 1.00 0.00 H +ATOM 1291 HB3 HIE 252 -30.083 -13.101 -26.832 1.00 0.00 H +ATOM 1292 CG HIE 252 -29.293 -12.942 -28.716 1.00 0.00 C +ATOM 1293 ND1 HIE 252 -28.674 -11.718 -28.707 1.00 0.00 N +ATOM 1294 CE1 HIE 252 -28.569 -11.272 -29.952 1.00 0.00 C +ATOM 1295 HE1 HIE 252 -28.162 -10.408 -30.226 1.00 0.00 H +ATOM 1296 NE2 HIE 252 -29.099 -12.171 -30.756 1.00 0.00 N +ATOM 1297 HE2 HIE 252 -29.160 -12.100 -31.762 1.00 0.00 H +ATOM 1298 CD2 HIE 252 -29.559 -13.231 -30.011 1.00 0.00 C +ATOM 1299 HD2 HIE 252 -30.002 -14.049 -30.359 1.00 0.00 H +ATOM 1300 C HIE 252 -27.455 -13.107 -26.323 1.00 0.00 C +ATOM 1301 O HIE 252 -26.403 -12.851 -26.914 1.00 0.00 O +ATOM 1302 N VAL 253 -27.868 -12.431 -25.260 1.00 0.00 N +ATOM 1303 H VAL 253 -28.738 -12.802 -24.820 1.00 0.00 H +ATOM 1304 CA VAL 253 -27.155 -11.263 -24.755 1.00 0.00 C +ATOM 1305 HA VAL 253 -26.718 -10.791 -25.553 1.00 0.00 H +ATOM 1306 CB VAL 253 -28.172 -10.255 -24.143 1.00 0.00 C +ATOM 1307 HB VAL 253 -28.626 -10.716 -23.390 1.00 0.00 H +ATOM 1308 CG1 VAL 253 -27.444 -9.054 -23.567 1.00 0.00 C +ATOM 1309 HG11 VAL 253 -26.951 -8.579 -24.296 1.00 0.00 H +ATOM 1310 HG12 VAL 253 -28.105 -8.428 -23.152 1.00 0.00 H +ATOM 1311 HG13 VAL 253 -26.793 -9.358 -22.870 1.00 0.00 H +ATOM 1312 CG2 VAL 253 -29.170 -9.822 -25.214 1.00 0.00 C +ATOM 1313 HG21 VAL 253 -29.979 -10.407 -25.164 1.00 0.00 H +ATOM 1314 HG22 VAL 253 -29.430 -8.871 -25.054 1.00 0.00 H +ATOM 1315 HG23 VAL 253 -28.744 -9.910 -26.113 1.00 0.00 H +ATOM 1316 C VAL 253 -26.048 -11.549 -23.730 1.00 0.00 C +ATOM 1317 O VAL 253 -24.956 -10.985 -23.811 1.00 0.00 O +ATOM 1318 N PHE 254 -26.328 -12.408 -22.759 1.00 0.00 N +ATOM 1319 H PHE 254 -27.266 -12.822 -22.785 1.00 0.00 H +ATOM 1320 CA PHE 254 -25.325 -12.707 -21.744 1.00 0.00 C +ATOM 1321 HA PHE 254 -24.774 -11.854 -21.612 1.00 0.00 H +ATOM 1322 CB PHE 254 -25.989 -13.057 -20.407 1.00 0.00 C +ATOM 1323 HB2 PHE 254 -26.372 -12.229 -20.033 1.00 0.00 H +ATOM 1324 HB3 PHE 254 -26.683 -13.735 -20.582 1.00 0.00 H +ATOM 1325 CG PHE 254 -25.029 -13.626 -19.389 1.00 0.00 C +ATOM 1326 CD1 PHE 254 -24.147 -12.797 -18.690 1.00 0.00 C +ATOM 1327 HD1 PHE 254 -24.181 -11.814 -18.825 1.00 0.00 H +ATOM 1328 CE1 PHE 254 -23.221 -13.337 -17.803 1.00 0.00 C +ATOM 1329 HE1 PHE 254 -22.601 -12.726 -17.299 1.00 0.00 H +ATOM 1330 CZ PHE 254 -23.155 -14.716 -17.618 1.00 0.00 C +ATOM 1331 HZ PHE 254 -22.481 -15.100 -16.991 1.00 0.00 H +ATOM 1332 CE2 PHE 254 -24.029 -15.548 -18.308 1.00 0.00 C +ATOM 1333 HE2 PHE 254 -23.994 -16.551 -18.171 1.00 0.00 H +ATOM 1334 CD2 PHE 254 -24.952 -15.006 -19.189 1.00 0.00 C +ATOM 1335 HD2 PHE 254 -25.574 -15.609 -19.690 1.00 0.00 H +ATOM 1336 C PHE 254 -24.328 -13.814 -22.100 1.00 0.00 C +ATOM 1337 O PHE 254 -23.119 -13.620 -22.006 1.00 0.00 O +ATOM 1338 N SER 255 -24.824 -14.984 -22.489 1.00 0.00 N +ATOM 1339 H SER 255 -25.846 -15.043 -22.539 1.00 0.00 H +ATOM 1340 CA SER 255 -23.919 -16.088 -22.814 1.00 0.00 C +ATOM 1341 HA SER 255 -23.308 -16.236 -22.009 1.00 0.00 H +ATOM 1342 CB SER 255 -24.706 -17.379 -23.015 1.00 0.00 C +ATOM 1343 HB2 SER 255 -25.312 -17.270 -23.792 1.00 0.00 H +ATOM 1344 HB3 SER 255 -24.070 -18.125 -23.165 1.00 0.00 H +ATOM 1345 OG SER 255 -25.481 -17.658 -21.860 1.00 0.00 O +ATOM 1346 HG SER 255 -26.173 -16.947 -21.744 1.00 0.00 H +ATOM 1347 C SER 255 -23.028 -15.853 -24.033 1.00 0.00 C +ATOM 1348 O SER 255 -21.872 -16.284 -24.046 1.00 0.00 O +ATOM 1349 N ASP 256 -23.562 -15.187 -25.054 1.00 0.00 N +ATOM 1350 H ASP 256 -24.538 -14.876 -24.914 1.00 0.00 H +ATOM 1351 CA ASP 256 -22.796 -14.929 -26.274 1.00 0.00 C +ATOM 1352 HA ASP 256 -22.166 -15.700 -26.396 1.00 0.00 H +ATOM 1353 CB ASP 256 -23.747 -14.753 -27.466 1.00 0.00 C +ATOM 1354 HB2 ASP 256 -24.491 -15.403 -27.360 1.00 0.00 H +ATOM 1355 HB3 ASP 256 -24.092 -13.822 -27.446 1.00 0.00 H +ATOM 1356 CG ASP 256 -23.067 -14.997 -28.796 1.00 0.00 C +ATOM 1357 OD1 ASP 256 -21.899 -15.441 -28.789 1.00 0.00 O +ATOM 1358 OD2 ASP 256 -23.705 -14.759 -29.840 1.00 0.00 O +ATOM 1359 C ASP 256 -21.950 -13.679 -26.100 1.00 0.00 C +ATOM 1360 O ASP 256 -22.237 -12.639 -26.691 1.00 0.00 O +ATOM 1361 N GLY 257 -20.903 -13.787 -25.291 1.00 0.00 N +ATOM 1362 H GLY 257 -20.767 -14.718 -24.867 1.00 0.00 H +ATOM 1363 CA GLY 257 -20.035 -12.647 -25.048 1.00 0.00 C +ATOM 1364 HA2 GLY 257 -19.568 -12.390 -25.896 1.00 0.00 H +ATOM 1365 HA3 GLY 257 -20.579 -11.870 -24.726 1.00 0.00 H +ATOM 1366 C GLY 257 -18.999 -13.009 -23.992 1.00 0.00 C +ATOM 1367 O GLY 257 -19.096 -14.059 -23.348 1.00 0.00 O +ATOM 1368 N VAL 258 -18.008 -12.147 -23.794 1.00 0.00 N +ATOM 1369 H VAL 258 -18.029 -11.305 -24.384 1.00 0.00 H +ATOM 1370 CA VAL 258 -16.993 -12.427 -22.800 1.00 0.00 C +ATOM 1371 HA VAL 258 -16.642 -13.351 -22.958 1.00 0.00 H +ATOM 1372 CB VAL 258 -15.803 -11.420 -22.883 1.00 0.00 C +ATOM 1373 HB VAL 258 -16.082 -10.596 -22.417 1.00 0.00 H +ATOM 1374 CG1 VAL 258 -14.611 -11.992 -22.117 1.00 0.00 C +ATOM 1375 HG11 VAL 258 -14.588 -12.984 -22.234 1.00 0.00 H +ATOM 1376 HG12 VAL 258 -13.767 -11.593 -22.472 1.00 0.00 H +ATOM 1377 HG13 VAL 258 -14.704 -11.771 -21.147 1.00 0.00 H +ATOM 1378 CG2 VAL 258 -15.418 -11.159 -24.334 1.00 0.00 C +ATOM 1379 HG21 VAL 258 -14.941 -11.959 -24.697 1.00 0.00 H +ATOM 1380 HG22 VAL 258 -16.245 -10.989 -24.869 1.00 0.00 H +ATOM 1381 HG23 VAL 258 -14.819 -10.360 -24.377 1.00 0.00 H +ATOM 1382 C VAL 258 -17.632 -12.393 -21.429 1.00 0.00 C +ATOM 1383 O VAL 258 -18.617 -11.691 -21.193 1.00 0.00 O +ATOM 1384 N THR 259 -17.055 -13.166 -20.524 1.00 0.00 N +ATOM 1385 H THR 259 -16.219 -13.685 -20.861 1.00 0.00 H +ATOM 1386 CA THR 259 -17.570 -13.262 -19.175 1.00 0.00 C +ATOM 1387 HA THR 259 -18.481 -12.817 -19.143 1.00 0.00 H +ATOM 1388 CB THR 259 -17.698 -14.742 -18.757 1.00 0.00 C +ATOM 1389 HB THR 259 -16.764 -15.138 -18.663 1.00 0.00 H +ATOM 1390 CG2 THR 259 -18.450 -14.851 -17.455 1.00 0.00 C +ATOM 1391 HG21 THR 259 -19.421 -14.635 -17.596 1.00 0.00 H +ATOM 1392 HG22 THR 259 -18.377 -15.784 -17.089 1.00 0.00 H +ATOM 1393 HG23 THR 259 -18.072 -14.209 -16.781 1.00 0.00 H +ATOM 1394 OG1 THR 259 -18.391 -15.469 -19.785 1.00 0.00 O +ATOM 1395 HG1 THR 259 -18.425 -14.928 -20.631 1.00 0.00 H +ATOM 1396 C THR 259 -16.670 -12.569 -18.162 1.00 0.00 C +ATOM 1397 O THR 259 -15.458 -12.745 -18.180 1.00 0.00 O +ATOM 1398 N ASN 260 -17.278 -11.789 -17.279 1.00 0.00 N +ATOM 1399 H ASN 260 -18.307 -11.683 -17.432 1.00 0.00 H +ATOM 1400 CA ASN 260 -16.568 -11.135 -16.186 1.00 0.00 C +ATOM 1401 HA ASN 260 -15.902 -11.776 -15.842 1.00 0.00 H +ATOM 1402 CB ASN 260 -15.905 -9.805 -16.602 1.00 0.00 C +ATOM 1403 HB2 ASN 260 -15.574 -9.352 -15.775 1.00 0.00 H +ATOM 1404 HB3 ASN 260 -15.133 -10.018 -17.200 1.00 0.00 H +ATOM 1405 CG ASN 260 -16.841 -8.858 -17.334 1.00 0.00 C +ATOM 1406 OD1 ASN 260 -17.905 -8.490 -16.837 1.00 0.00 O +ATOM 1407 ND2 ASN 260 -16.428 -8.445 -18.529 1.00 0.00 N +ATOM 1408 HD21 ASN 260 -16.996 -7.815 -19.063 1.00 0.00 H +ATOM 1409 HD22 ASN 260 -15.555 -8.760 -18.898 1.00 0.00 H +ATOM 1410 C ASN 260 -17.607 -10.938 -15.098 1.00 0.00 C +ATOM 1411 O ASN 260 -18.800 -11.075 -15.362 1.00 0.00 O +ATOM 1412 N TRP 261 -17.170 -10.647 -13.877 1.00 0.00 N +ATOM 1413 H TRP 261 -16.152 -10.550 -13.781 1.00 0.00 H +ATOM 1414 CA TRP 261 -18.117 -10.488 -12.788 1.00 0.00 C +ATOM 1415 HA TRP 261 -18.642 -11.351 -12.705 1.00 0.00 H +ATOM 1416 CB TRP 261 -17.375 -10.282 -11.458 1.00 0.00 C +ATOM 1417 HB2 TRP 261 -16.612 -9.673 -11.604 1.00 0.00 H +ATOM 1418 HB3 TRP 261 -18.005 -9.923 -10.788 1.00 0.00 H +ATOM 1419 CG TRP 261 -16.810 -11.573 -10.890 1.00 0.00 C +ATOM 1420 CD1 TRP 261 -15.501 -11.850 -10.618 1.00 0.00 C +ATOM 1421 HD1 TRP 261 -14.739 -11.221 -10.750 1.00 0.00 H +ATOM 1422 NE1 TRP 261 -15.379 -13.137 -10.129 1.00 0.00 N +ATOM 1423 HE1 TRP 261 -14.522 -13.574 -9.861 1.00 0.00 H +ATOM 1424 CE2 TRP 261 -16.620 -13.712 -10.073 1.00 0.00 C +ATOM 1425 CZ2 TRP 261 -17.006 -14.995 -9.651 1.00 0.00 C +ATOM 1426 HZ2 TRP 261 -16.315 -15.646 -9.327 1.00 0.00 H +ATOM 1427 CH2 TRP 261 -18.340 -15.306 -9.703 1.00 0.00 C +ATOM 1428 HH2 TRP 261 -18.655 -16.207 -9.405 1.00 0.00 H +ATOM 1429 CZ3 TRP 261 -19.289 -14.382 -10.169 1.00 0.00 C +ATOM 1430 HZ3 TRP 261 -20.249 -14.631 -10.204 1.00 0.00 H +ATOM 1431 CE3 TRP 261 -18.906 -13.105 -10.590 1.00 0.00 C +ATOM 1432 HE3 TRP 261 -19.592 -12.461 -10.911 1.00 0.00 H +ATOM 1433 CD2 TRP 261 -17.549 -12.761 -10.547 1.00 0.00 C +ATOM 1434 C TRP 261 -19.123 -9.367 -13.037 1.00 0.00 C +ATOM 1435 O TRP 261 -20.273 -9.459 -12.611 1.00 0.00 O +ATOM 1436 N GLY 262 -18.696 -8.325 -13.748 1.00 0.00 N +ATOM 1437 H GLY 262 -17.715 -8.379 -14.061 1.00 0.00 H +ATOM 1438 CA GLY 262 -19.586 -7.214 -14.037 1.00 0.00 C +ATOM 1439 HA2 GLY 262 -19.918 -6.812 -13.169 1.00 0.00 H +ATOM 1440 HA3 GLY 262 -19.075 -6.492 -14.529 1.00 0.00 H +ATOM 1441 C GLY 262 -20.780 -7.641 -14.877 1.00 0.00 C +ATOM 1442 O GLY 262 -21.913 -7.225 -14.620 1.00 0.00 O +ATOM 1443 N ARG 263 -20.539 -8.488 -15.875 1.00 0.00 N +ATOM 1444 H ARG 263 -19.560 -8.777 -15.986 1.00 0.00 H +ATOM 1445 CA ARG 263 -21.633 -8.947 -16.729 1.00 0.00 C +ATOM 1446 HA ARG 263 -22.156 -8.144 -17.044 1.00 0.00 H +ATOM 1447 CB ARG 263 -21.092 -9.657 -17.976 1.00 0.00 C +ATOM 1448 HB2 ARG 263 -20.407 -10.313 -17.688 1.00 0.00 H +ATOM 1449 HB3 ARG 263 -21.848 -10.112 -18.428 1.00 0.00 H +ATOM 1450 CG ARG 263 -20.444 -8.706 -18.979 1.00 0.00 C +ATOM 1451 HG2 ARG 263 -21.127 -8.065 -19.323 1.00 0.00 H +ATOM 1452 HG3 ARG 263 -19.704 -8.205 -18.535 1.00 0.00 H +ATOM 1453 CD ARG 263 -19.846 -9.447 -20.189 1.00 0.00 C +ATOM 1454 HD2 ARG 263 -19.412 -8.769 -20.774 1.00 0.00 H +ATOM 1455 HD3 ARG 263 -19.170 -10.090 -19.844 1.00 0.00 H +ATOM 1456 NE ARG 263 -20.865 -10.172 -20.953 1.00 0.00 N +ATOM 1457 HE ARG 263 -20.922 -11.166 -20.833 1.00 0.00 H +ATOM 1458 CZ ARG 263 -21.712 -9.588 -21.790 1.00 0.00 C +ATOM 1459 NH1 ARG 263 -21.642 -8.290 -21.971 1.00 0.00 N +ATOM 1460 HH11 ARG 263 -20.961 -7.721 -21.518 1.00 0.00 H +ATOM 1461 HH12 ARG 263 -22.304 -7.837 -22.598 1.00 0.00 H +ATOM 1462 NH2 ARG 263 -22.642 -10.290 -22.413 1.00 0.00 N +ATOM 1463 HH21 ARG 263 -22.690 -11.284 -22.261 1.00 0.00 H +ATOM 1464 HH22 ARG 263 -23.288 -9.848 -23.027 1.00 0.00 H +ATOM 1465 C ARG 263 -22.575 -9.876 -15.974 1.00 0.00 C +ATOM 1466 O ARG 263 -23.756 -9.949 -16.291 1.00 0.00 O +ATOM 1467 N ILE 264 -22.050 -10.595 -14.985 1.00 0.00 N +ATOM 1468 H ILE 264 -21.039 -10.459 -14.830 1.00 0.00 H +ATOM 1469 CA ILE 264 -22.880 -11.500 -14.199 1.00 0.00 C +ATOM 1470 HA ILE 264 -23.483 -11.964 -14.843 1.00 0.00 H +ATOM 1471 CB ILE 264 -21.985 -12.465 -13.384 1.00 0.00 C +ATOM 1472 HB ILE 264 -21.293 -11.928 -12.933 1.00 0.00 H +ATOM 1473 CG2 ILE 264 -22.805 -13.230 -12.339 1.00 0.00 C +ATOM 1474 HG21 ILE 264 -22.199 -13.828 -11.821 1.00 0.00 H +ATOM 1475 HG22 ILE 264 -23.242 -12.579 -11.724 1.00 0.00 H +ATOM 1476 HG23 ILE 264 -23.500 -13.774 -12.802 1.00 0.00 H +ATOM 1477 CG1 ILE 264 -21.291 -13.423 -14.357 1.00 0.00 C +ATOM 1478 HG12 ILE 264 -21.995 -13.994 -14.788 1.00 0.00 H +ATOM 1479 HG13 ILE 264 -20.858 -12.872 -15.076 1.00 0.00 H +ATOM 1480 CD1 ILE 264 -20.253 -14.307 -13.729 1.00 0.00 C +ATOM 1481 HD11 ILE 264 -20.676 -14.873 -13.020 1.00 0.00 H +ATOM 1482 HD12 ILE 264 -19.848 -14.900 -14.427 1.00 0.00 H +ATOM 1483 HD13 ILE 264 -19.535 -13.744 -13.317 1.00 0.00 H +ATOM 1484 C ILE 264 -23.782 -10.670 -13.282 1.00 0.00 C +ATOM 1485 O ILE 264 -24.956 -10.986 -13.084 1.00 0.00 O +ATOM 1486 N VAL 265 -23.231 -9.590 -12.741 1.00 0.00 N +ATOM 1487 H VAL 265 -22.236 -9.436 -12.982 1.00 0.00 H +ATOM 1488 CA VAL 265 -23.999 -8.703 -11.874 1.00 0.00 C +ATOM 1489 HA VAL 265 -24.442 -9.254 -11.169 1.00 0.00 H +ATOM 1490 CB VAL 265 -23.098 -7.632 -11.234 1.00 0.00 C +ATOM 1491 HB VAL 265 -22.575 -7.203 -11.962 1.00 0.00 H +ATOM 1492 CG1 VAL 265 -23.949 -6.547 -10.596 1.00 0.00 C +ATOM 1493 HG11 VAL 265 -23.364 -5.926 -10.073 1.00 0.00 H +ATOM 1494 HG12 VAL 265 -24.425 -6.032 -11.309 1.00 0.00 H +ATOM 1495 HG13 VAL 265 -24.621 -6.965 -9.984 1.00 0.00 H +ATOM 1496 CG2 VAL 265 -22.187 -8.274 -10.192 1.00 0.00 C +ATOM 1497 HG21 VAL 265 -22.288 -9.267 -10.235 1.00 0.00 H +ATOM 1498 HG22 VAL 265 -21.239 -8.022 -10.385 1.00 0.00 H +ATOM 1499 HG23 VAL 265 -22.446 -7.947 -9.284 1.00 0.00 H +ATOM 1500 C VAL 265 -25.106 -8.024 -12.699 1.00 0.00 C +ATOM 1501 O VAL 265 -26.230 -7.866 -12.228 1.00 0.00 O +ATOM 1502 N THR 266 -24.797 -7.645 -13.937 1.00 0.00 N +ATOM 1503 H THR 266 -23.827 -7.828 -14.227 1.00 0.00 H +ATOM 1504 CA THR 266 -25.802 -7.015 -14.791 1.00 0.00 C +ATOM 1505 HA THR 266 -26.195 -6.237 -14.302 1.00 0.00 H +ATOM 1506 CB THR 266 -25.192 -6.544 -16.125 1.00 0.00 C +ATOM 1507 HB THR 266 -24.752 -7.338 -16.584 1.00 0.00 H +ATOM 1508 CG2 THR 266 -26.275 -5.935 -17.034 1.00 0.00 C +ATOM 1509 HG21 THR 266 -27.172 -6.277 -16.755 1.00 0.00 H +ATOM 1510 HG22 THR 266 -26.255 -4.939 -16.951 1.00 0.00 H +ATOM 1511 HG23 THR 266 -26.097 -6.196 -17.982 1.00 0.00 H +ATOM 1512 OG1 THR 266 -24.177 -5.563 -15.857 1.00 0.00 O +ATOM 1513 HG1 THR 266 -23.376 -5.998 -15.434 1.00 0.00 H +ATOM 1514 C THR 266 -26.919 -8.016 -15.079 1.00 0.00 C +ATOM 1515 O THR 266 -28.102 -7.673 -15.065 1.00 0.00 O +ATOM 1516 N LEU 267 -26.537 -9.259 -15.345 1.00 0.00 N +ATOM 1517 H LEU 267 -25.512 -9.412 -15.348 1.00 0.00 H +ATOM 1518 CA LEU 267 -27.511 -10.311 -15.610 1.00 0.00 C +ATOM 1519 HA LEU 267 -28.040 -10.063 -16.429 1.00 0.00 H +ATOM 1520 CB LEU 267 -26.791 -11.643 -15.839 1.00 0.00 C +ATOM 1521 HB2 LEU 267 -26.350 -11.603 -16.734 1.00 0.00 H +ATOM 1522 HB3 LEU 267 -26.101 -11.745 -15.126 1.00 0.00 H +ATOM 1523 CG LEU 267 -27.658 -12.908 -15.817 1.00 0.00 C +ATOM 1524 HG LEU 267 -28.287 -12.856 -15.047 1.00 0.00 H +ATOM 1525 CD1 LEU 267 -28.450 -13.011 -17.114 1.00 0.00 C +ATOM 1526 HD11 LEU 267 -27.818 -13.056 -17.888 1.00 0.00 H +ATOM 1527 HD12 LEU 267 -29.014 -13.837 -17.096 1.00 0.00 H +ATOM 1528 HD13 LEU 267 -29.038 -12.208 -17.210 1.00 0.00 H +ATOM 1529 CD2 LEU 267 -26.769 -14.138 -15.637 1.00 0.00 C +ATOM 1530 HD21 LEU 267 -26.269 -14.062 -14.775 1.00 0.00 H +ATOM 1531 HD22 LEU 267 -27.339 -14.959 -15.623 1.00 0.00 H +ATOM 1532 HD23 LEU 267 -26.121 -14.192 -16.396 1.00 0.00 H +ATOM 1533 C LEU 267 -28.486 -10.466 -14.440 1.00 0.00 C +ATOM 1534 O LEU 267 -29.704 -10.525 -14.630 1.00 0.00 O +ATOM 1535 N ILE 268 -27.937 -10.531 -13.232 1.00 0.00 N +ATOM 1536 H ILE 268 -26.899 -10.447 -13.221 1.00 0.00 H +ATOM 1537 CA ILE 268 -28.737 -10.707 -12.023 1.00 0.00 C +ATOM 1538 HA ILE 268 -29.429 -11.406 -12.241 1.00 0.00 H +ATOM 1539 CB ILE 268 -27.836 -11.130 -10.830 1.00 0.00 C +ATOM 1540 HB ILE 268 -27.096 -10.477 -10.765 1.00 0.00 H +ATOM 1541 CG2 ILE 268 -28.635 -11.125 -9.524 1.00 0.00 C +ATOM 1542 HG21 ILE 268 -28.031 -11.365 -8.768 1.00 0.00 H +ATOM 1543 HG22 ILE 268 -29.015 -10.215 -9.374 1.00 0.00 H +ATOM 1544 HG23 ILE 268 -29.374 -11.791 -9.588 1.00 0.00 H +ATOM 1545 CG1 ILE 268 -27.232 -12.514 -11.101 1.00 0.00 C +ATOM 1546 HG12 ILE 268 -27.963 -13.193 -11.050 1.00 0.00 H +ATOM 1547 HG13 ILE 268 -26.860 -12.516 -12.029 1.00 0.00 H +ATOM 1548 CD1 ILE 268 -26.127 -12.908 -10.135 1.00 0.00 C +ATOM 1549 HD11 ILE 268 -26.492 -12.921 -9.206 1.00 0.00 H +ATOM 1550 HD12 ILE 268 -25.788 -13.815 -10.377 1.00 0.00 H +ATOM 1551 HD13 ILE 268 -25.385 -12.243 -10.197 1.00 0.00 H +ATOM 1552 C ILE 268 -29.503 -9.437 -11.658 1.00 0.00 C +ATOM 1553 O ILE 268 -30.666 -9.494 -11.258 1.00 0.00 O +ATOM 1554 N SER 269 -28.850 -8.293 -11.829 1.00 0.00 N +ATOM 1555 H SER 269 -27.887 -8.395 -12.209 1.00 0.00 H +ATOM 1556 CA SER 269 -29.452 -7.007 -11.504 1.00 0.00 C +ATOM 1557 HA SER 269 -29.763 -7.043 -10.539 1.00 0.00 H +ATOM 1558 CB SER 269 -28.413 -5.898 -11.641 1.00 0.00 C +ATOM 1559 HB2 SER 269 -28.046 -5.913 -12.562 1.00 0.00 H +ATOM 1560 HB3 SER 269 -28.846 -5.026 -11.449 1.00 0.00 H +ATOM 1561 OG SER 269 -27.359 -6.104 -10.719 1.00 0.00 O +ATOM 1562 HG SER 269 -26.715 -6.772 -11.091 1.00 0.00 H +ATOM 1563 C SER 269 -30.657 -6.687 -12.371 1.00 0.00 C +ATOM 1564 O SER 269 -31.663 -6.161 -11.887 1.00 0.00 O +ATOM 1565 N PHE 270 -30.554 -6.970 -13.660 1.00 0.00 N +ATOM 1566 H PHE 270 -29.662 -7.363 -13.966 1.00 0.00 H +ATOM 1567 CA PHE 270 -31.685 -6.709 -14.524 1.00 0.00 C +ATOM 1568 HA PHE 270 -32.057 -5.822 -14.269 1.00 0.00 H +ATOM 1569 CB PHE 270 -31.292 -6.802 -16.000 1.00 0.00 C +ATOM 1570 HB2 PHE 270 -30.548 -6.174 -16.155 1.00 0.00 H +ATOM 1571 HB3 PHE 270 -31.029 -7.734 -16.185 1.00 0.00 H +ATOM 1572 CG PHE 270 -32.412 -6.439 -16.935 1.00 0.00 C +ATOM 1573 CD1 PHE 270 -32.845 -5.119 -17.043 1.00 0.00 C +ATOM 1574 HD1 PHE 270 -32.389 -4.402 -16.529 1.00 0.00 H +ATOM 1575 CE1 PHE 270 -33.919 -4.787 -17.873 1.00 0.00 C +ATOM 1576 HE1 PHE 270 -34.218 -3.831 -17.935 1.00 0.00 H +ATOM 1577 CZ PHE 270 -34.560 -5.781 -18.600 1.00 0.00 C +ATOM 1578 HZ PHE 270 -35.328 -5.548 -19.194 1.00 0.00 H +ATOM 1579 CE2 PHE 270 -34.130 -7.102 -18.499 1.00 0.00 C +ATOM 1580 HE2 PHE 270 -34.593 -7.831 -19.025 1.00 0.00 H +ATOM 1581 CD2 PHE 270 -33.062 -7.419 -17.670 1.00 0.00 C +ATOM 1582 HD2 PHE 270 -32.756 -8.372 -17.603 1.00 0.00 H +ATOM 1583 C PHE 270 -32.759 -7.742 -14.201 1.00 0.00 C +ATOM 1584 O PHE 270 -33.948 -7.482 -14.363 1.00 0.00 O +ATOM 1585 N GLY 271 -32.330 -8.919 -13.752 1.00 0.00 N +ATOM 1586 H GLY 271 -31.308 -9.025 -13.696 1.00 0.00 H +ATOM 1587 CA GLY 271 -33.283 -9.951 -13.379 1.00 0.00 C +ATOM 1588 HA2 GLY 271 -33.873 -10.163 -14.156 1.00 0.00 H +ATOM 1589 HA3 GLY 271 -32.796 -10.774 -13.093 1.00 0.00 H +ATOM 1590 C GLY 271 -34.130 -9.437 -12.226 1.00 0.00 C +ATOM 1591 O GLY 271 -35.335 -9.677 -12.173 1.00 0.00 O +ATOM 1592 N ALA 272 -33.489 -8.730 -11.298 1.00 0.00 N +ATOM 1593 H ALA 272 -32.467 -8.624 -11.461 1.00 0.00 H +ATOM 1594 CA ALA 272 -34.182 -8.156 -10.149 1.00 0.00 C +ATOM 1595 HA ALA 272 -34.733 -8.872 -9.712 1.00 0.00 H +ATOM 1596 CB ALA 272 -33.182 -7.617 -9.146 1.00 0.00 C +ATOM 1597 HB1 ALA 272 -32.392 -8.229 -9.095 1.00 0.00 H +ATOM 1598 HB2 ALA 272 -32.876 -6.707 -9.430 1.00 0.00 H +ATOM 1599 HB3 ALA 272 -33.610 -7.555 -8.243 1.00 0.00 H +ATOM 1600 C ALA 272 -35.109 -7.037 -10.606 1.00 0.00 C +ATOM 1601 O ALA 272 -36.184 -6.845 -10.039 1.00 0.00 O +ATOM 1602 N PHE 273 -34.682 -6.304 -11.634 1.00 0.00 N +ATOM 1603 H PHE 273 -33.748 -6.581 -12.004 1.00 0.00 H +ATOM 1604 CA PHE 273 -35.467 -5.203 -12.191 1.00 0.00 C +ATOM 1605 HA PHE 273 -35.743 -4.625 -11.428 1.00 0.00 H +ATOM 1606 CB PHE 273 -34.648 -4.478 -13.270 1.00 0.00 C +ATOM 1607 HB2 PHE 273 -33.740 -4.323 -12.905 1.00 0.00 H +ATOM 1608 HB3 PHE 273 -34.614 -5.066 -14.067 1.00 0.00 H +ATOM 1609 CG PHE 273 -35.212 -3.149 -13.695 1.00 0.00 C +ATOM 1610 CD1 PHE 273 -35.122 -2.036 -12.863 1.00 0.00 C +ATOM 1611 HD1 PHE 273 -34.711 -2.117 -11.963 1.00 0.00 H +ATOM 1612 CE1 PHE 273 -35.607 -0.788 -13.281 1.00 0.00 C +ATOM 1613 HE1 PHE 273 -35.534 -0.000 -12.666 1.00 0.00 H +ATOM 1614 CZ PHE 273 -36.184 -0.659 -14.540 1.00 0.00 C +ATOM 1615 HZ PHE 273 -36.527 0.227 -14.843 1.00 0.00 H +ATOM 1616 CE2 PHE 273 -36.279 -1.772 -15.373 1.00 0.00 C +ATOM 1617 HE2 PHE 273 -36.701 -1.687 -16.289 1.00 0.00 H +ATOM 1618 CD2 PHE 273 -35.796 -3.002 -14.947 1.00 0.00 C +ATOM 1619 HD2 PHE 273 -35.869 -3.797 -15.553 1.00 0.00 H +ATOM 1620 C PHE 273 -36.748 -5.778 -12.794 1.00 0.00 C +ATOM 1621 O PHE 273 -37.816 -5.187 -12.683 1.00 0.00 O +ATOM 1622 N VAL 274 -36.633 -6.931 -13.447 1.00 0.00 N +ATOM 1623 H VAL 274 -35.676 -7.316 -13.494 1.00 0.00 H +ATOM 1624 CA VAL 274 -37.798 -7.571 -14.039 1.00 0.00 C +ATOM 1625 HA VAL 274 -38.326 -6.879 -14.527 1.00 0.00 H +ATOM 1626 CB VAL 274 -37.387 -8.720 -14.996 1.00 0.00 C +ATOM 1627 HB VAL 274 -36.832 -9.358 -14.475 1.00 0.00 H +ATOM 1628 CG1 VAL 274 -38.619 -9.480 -15.471 1.00 0.00 C +ATOM 1629 HG11 VAL 274 -38.340 -10.211 -16.093 1.00 0.00 H +ATOM 1630 HG12 VAL 274 -39.091 -9.875 -14.683 1.00 0.00 H +ATOM 1631 HG13 VAL 274 -39.234 -8.853 -15.948 1.00 0.00 H +ATOM 1632 CG2 VAL 274 -36.637 -8.154 -16.194 1.00 0.00 C +ATOM 1633 HG21 VAL 274 -36.840 -7.179 -16.279 1.00 0.00 H +ATOM 1634 HG22 VAL 274 -35.655 -8.283 -16.059 1.00 0.00 H +ATOM 1635 HG23 VAL 274 -36.929 -8.632 -17.022 1.00 0.00 H +ATOM 1636 C VAL 274 -38.679 -8.128 -12.918 1.00 0.00 C +ATOM 1637 O VAL 274 -39.900 -8.053 -12.989 1.00 0.00 O +ATOM 1638 N ALA 275 -38.051 -8.685 -11.885 1.00 0.00 N +ATOM 1639 H ALA 275 -37.017 -8.693 -11.956 1.00 0.00 H +ATOM 1640 CA ALA 275 -38.788 -9.234 -10.754 1.00 0.00 C +ATOM 1641 HA ALA 275 -39.379 -9.977 -11.078 1.00 0.00 H +ATOM 1642 CB ALA 275 -37.819 -9.798 -9.703 1.00 0.00 C +ATOM 1643 HB1 ALA 275 -38.106 -9.494 -8.798 1.00 0.00 H +ATOM 1644 HB2 ALA 275 -37.834 -10.794 -9.746 1.00 0.00 H +ATOM 1645 HB3 ALA 275 -36.899 -9.465 -9.895 1.00 0.00 H +ATOM 1646 C ALA 275 -39.671 -8.149 -10.132 1.00 0.00 C +ATOM 1647 O ALA 275 -40.813 -8.413 -9.743 1.00 0.00 O +ATOM 1648 N LYS 276 -39.140 -6.933 -10.027 1.00 0.00 N +ATOM 1649 H LYS 276 -38.168 -6.846 -10.365 1.00 0.00 H +ATOM 1650 CA LYS 276 -39.909 -5.821 -9.467 1.00 0.00 C +ATOM 1651 HA LYS 276 -40.239 -6.082 -8.559 1.00 0.00 H +ATOM 1652 CB LYS 276 -39.056 -4.558 -9.365 1.00 0.00 C +ATOM 1653 HB2 LYS 276 -38.563 -4.446 -10.230 1.00 0.00 H +ATOM 1654 HB3 LYS 276 -39.672 -3.778 -9.236 1.00 0.00 H +ATOM 1655 CG LYS 276 -38.051 -4.567 -8.238 1.00 0.00 C +ATOM 1656 HG2 LYS 276 -38.533 -4.481 -7.367 1.00 0.00 H +ATOM 1657 HG3 LYS 276 -37.542 -5.425 -8.258 1.00 0.00 H +ATOM 1658 CD LYS 276 -37.085 -3.417 -8.382 1.00 0.00 C +ATOM 1659 HD2 LYS 276 -36.546 -3.546 -9.210 1.00 0.00 H +ATOM 1660 HD3 LYS 276 -37.597 -2.565 -8.435 1.00 0.00 H +ATOM 1661 CE LYS 276 -36.143 -3.341 -7.200 1.00 0.00 C +ATOM 1662 HE2 LYS 276 -36.662 -3.100 -6.384 1.00 0.00 H +ATOM 1663 HE3 LYS 276 -35.705 -4.228 -7.074 1.00 0.00 H +ATOM 1664 NZ LYS 276 -35.107 -2.311 -7.446 1.00 0.00 N +ATOM 1665 HZ1 LYS 276 -35.246 -1.905 -8.350 1.00 0.00 H +ATOM 1666 HZ2 LYS 276 -35.172 -1.597 -6.748 1.00 0.00 H +ATOM 1667 HZ3 LYS 276 -34.200 -2.732 -7.407 1.00 0.00 H +ATOM 1668 C LYS 276 -41.100 -5.536 -10.363 1.00 0.00 C +ATOM 1669 O LYS 276 -42.215 -5.319 -9.885 1.00 0.00 O +ATOM 1670 N HIE 277 -40.853 -5.525 -11.670 1.00 0.00 N +ATOM 1671 H HIE 277 -39.863 -5.706 -11.927 1.00 0.00 H +ATOM 1672 CA HIE 277 -41.905 -5.277 -12.645 1.00 0.00 C +ATOM 1673 HA HIE 277 -42.322 -4.384 -12.449 1.00 0.00 H +ATOM 1674 CB HIE 277 -41.314 -5.289 -14.054 1.00 0.00 C +ATOM 1675 HB2 HIE 277 -40.784 -4.446 -14.194 1.00 0.00 H +ATOM 1676 HB3 HIE 277 -40.693 -6.075 -14.141 1.00 0.00 H +ATOM 1677 CG HIE 277 -42.344 -5.382 -15.135 1.00 0.00 C +ATOM 1678 ND1 HIE 277 -43.132 -4.316 -15.507 1.00 0.00 N +ATOM 1679 CE1 HIE 277 -43.967 -4.701 -16.457 1.00 0.00 C +ATOM 1680 HE1 HIE 277 -44.647 -4.126 -16.903 1.00 0.00 H +ATOM 1681 NE2 HIE 277 -43.748 -5.977 -16.712 1.00 0.00 N +ATOM 1682 HE2 HIE 277 -44.239 -6.529 -17.389 1.00 0.00 H +ATOM 1683 CD2 HIE 277 -42.735 -6.427 -15.899 1.00 0.00 C +ATOM 1684 HD2 HIE 277 -42.362 -7.350 -15.878 1.00 0.00 H +ATOM 1685 C HIE 277 -43.002 -6.344 -12.545 1.00 0.00 C +ATOM 1686 O HIE 277 -44.191 -6.039 -12.682 1.00 0.00 O +ATOM 1687 N LEU 278 -42.592 -7.592 -12.312 1.00 0.00 N +ATOM 1688 H LEU 278 -41.560 -7.698 -12.221 1.00 0.00 H +ATOM 1689 CA LEU 278 -43.526 -8.711 -12.196 1.00 0.00 C +ATOM 1690 HA LEU 278 -44.096 -8.740 -13.030 1.00 0.00 H +ATOM 1691 CB LEU 278 -42.762 -10.033 -12.087 1.00 0.00 C +ATOM 1692 HB2 LEU 278 -42.036 -9.911 -11.434 1.00 0.00 H +ATOM 1693 HB3 LEU 278 -43.398 -10.730 -11.812 1.00 0.00 H +ATOM 1694 CG LEU 278 -42.133 -10.470 -13.405 1.00 0.00 C +ATOM 1695 HG LEU 278 -41.482 -9.772 -13.703 1.00 0.00 H +ATOM 1696 CD1 LEU 278 -41.411 -11.794 -13.236 1.00 0.00 C +ATOM 1697 HD11 LEU 278 -42.060 -12.496 -12.939 1.00 0.00 H +ATOM 1698 HD12 LEU 278 -41.003 -12.069 -14.108 1.00 0.00 H +ATOM 1699 HD13 LEU 278 -40.689 -11.698 -12.549 1.00 0.00 H +ATOM 1700 CD2 LEU 278 -43.222 -10.602 -14.452 1.00 0.00 C +ATOM 1701 HD21 LEU 278 -43.681 -9.720 -14.575 1.00 0.00 H +ATOM 1702 HD22 LEU 278 -42.819 -10.889 -15.323 1.00 0.00 H +ATOM 1703 HD23 LEU 278 -43.893 -11.285 -14.157 1.00 0.00 H +ATOM 1704 C LEU 278 -44.450 -8.569 -10.989 1.00 0.00 C +ATOM 1705 O LEU 278 -45.623 -8.954 -11.051 1.00 0.00 O +ATOM 1706 N LYS 279 -43.920 -8.030 -9.896 1.00 0.00 N +ATOM 1707 H LYS 279 -42.923 -7.764 -9.975 1.00 0.00 H +ATOM 1708 CA LYS 279 -44.715 -7.840 -8.686 1.00 0.00 C +ATOM 1709 HA LYS 279 -45.225 -8.680 -8.498 1.00 0.00 H +ATOM 1710 CB LYS 279 -43.805 -7.482 -7.512 1.00 0.00 C +ATOM 1711 HB2 LYS 279 -43.176 -8.246 -7.362 1.00 0.00 H +ATOM 1712 HB3 LYS 279 -43.279 -6.667 -7.764 1.00 0.00 H +ATOM 1713 CG LYS 279 -44.532 -7.200 -6.214 1.00 0.00 C +ATOM 1714 HG2 LYS 279 -43.874 -6.876 -5.534 1.00 0.00 H +ATOM 1715 HG3 LYS 279 -45.224 -6.497 -6.372 1.00 0.00 H +ATOM 1716 CD LYS 279 -45.207 -8.448 -5.691 1.00 0.00 C +ATOM 1717 HD2 LYS 279 -45.969 -8.688 -6.296 1.00 0.00 H +ATOM 1718 HD3 LYS 279 -44.546 -9.201 -5.681 1.00 0.00 H +ATOM 1719 CE LYS 279 -45.763 -8.288 -4.271 1.00 0.00 C +ATOM 1720 HE2 LYS 279 -46.090 -9.184 -3.949 1.00 0.00 H +ATOM 1721 HE3 LYS 279 -45.018 -7.987 -3.664 1.00 0.00 H +ATOM 1722 NZ LYS 279 -46.892 -7.298 -4.182 1.00 0.00 N +ATOM 1723 HZ1 LYS 279 -47.093 -6.953 -5.096 1.00 0.00 H +ATOM 1724 HZ2 LYS 279 -47.694 -7.755 -3.806 1.00 0.00 H +ATOM 1725 HZ3 LYS 279 -46.618 -6.547 -3.586 1.00 0.00 H +ATOM 1726 C LYS 279 -45.696 -6.706 -8.913 1.00 0.00 C +ATOM 1727 O LYS 279 -46.876 -6.795 -8.559 1.00 0.00 O +ATOM 1728 N THR 280 -45.177 -5.634 -9.503 1.00 0.00 N +ATOM 1729 H THR 280 -44.158 -5.730 -9.741 1.00 0.00 H +ATOM 1730 CA THR 280 -45.943 -4.432 -9.797 1.00 0.00 C +ATOM 1731 HA THR 280 -46.245 -4.020 -8.924 1.00 0.00 H +ATOM 1732 CB THR 280 -45.039 -3.414 -10.528 1.00 0.00 C +ATOM 1733 HB THR 280 -44.638 -3.862 -11.348 1.00 0.00 H +ATOM 1734 CG2 THR 280 -45.819 -2.186 -10.931 1.00 0.00 C +ATOM 1735 HG21 THR 280 -46.797 -2.404 -10.999 1.00 0.00 H +ATOM 1736 HG22 THR 280 -45.696 -1.459 -10.249 1.00 0.00 H +ATOM 1737 HG23 THR 280 -45.500 -1.850 -11.822 1.00 0.00 H +ATOM 1738 OG1 THR 280 -43.962 -3.031 -9.655 1.00 0.00 O +ATOM 1739 HG1 THR 280 -43.250 -3.740 -9.651 1.00 0.00 H +ATOM 1740 C THR 280 -47.187 -4.732 -10.634 1.00 0.00 C +ATOM 1741 O THR 280 -48.260 -4.173 -10.379 1.00 0.00 O +ATOM 1742 N ILE 281 -47.040 -5.618 -11.619 1.00 0.00 N +ATOM 1743 H ILE 281 -46.090 -6.016 -11.711 1.00 0.00 H +ATOM 1744 CA ILE 281 -48.158 -5.979 -12.487 1.00 0.00 C +ATOM 1745 HA ILE 281 -48.818 -5.212 -12.429 1.00 0.00 H +ATOM 1746 CB ILE 281 -47.723 -6.197 -13.963 1.00 0.00 C +ATOM 1747 HB ILE 281 -48.546 -6.348 -14.500 1.00 0.00 H +ATOM 1748 CG2 ILE 281 -46.986 -4.959 -14.477 1.00 0.00 C +ATOM 1749 HG21 ILE 281 -46.747 -5.092 -15.436 1.00 0.00 H +ATOM 1750 HG22 ILE 281 -47.578 -4.162 -14.387 1.00 0.00 H +ATOM 1751 HG23 ILE 281 -46.156 -4.823 -13.941 1.00 0.00 H +ATOM 1752 CG1 ILE 281 -46.832 -7.434 -14.092 1.00 0.00 C +ATOM 1753 HG12 ILE 281 -45.954 -7.234 -13.667 1.00 0.00 H +ATOM 1754 HG13 ILE 281 -47.268 -8.183 -13.599 1.00 0.00 H +ATOM 1755 CD1 ILE 281 -46.609 -7.851 -15.520 1.00 0.00 C +ATOM 1756 HD11 ILE 281 -46.168 -7.106 -16.022 1.00 0.00 H +ATOM 1757 HD12 ILE 281 -46.022 -8.661 -15.545 1.00 0.00 H +ATOM 1758 HD13 ILE 281 -47.488 -8.065 -15.948 1.00 0.00 H +ATOM 1759 C ILE 281 -48.899 -7.226 -12.028 1.00 0.00 C +ATOM 1760 O ILE 281 -49.607 -7.858 -12.817 1.00 0.00 O +ATOM 1761 N ASN 282 -48.731 -7.578 -10.754 1.00 0.00 N +ATOM 1762 H ASN 282 -48.101 -6.948 -10.211 1.00 0.00 H +ATOM 1763 CA ASN 282 -49.380 -8.755 -10.167 1.00 0.00 C +ATOM 1764 HA ASN 282 -49.008 -8.849 -9.211 1.00 0.00 H +ATOM 1765 CB ASN 282 -50.877 -8.523 -9.987 1.00 0.00 C +ATOM 1766 HB2 ASN 282 -51.158 -7.797 -10.605 1.00 0.00 H +ATOM 1767 HB3 ASN 282 -51.352 -9.369 -10.204 1.00 0.00 H +ATOM 1768 CG ASN 282 -51.208 -8.122 -8.579 1.00 0.00 C +ATOM 1769 OD1 ASN 282 -51.177 -6.936 -8.252 1.00 0.00 O +ATOM 1770 ND2 ASN 282 -51.493 -9.099 -7.724 1.00 0.00 N +ATOM 1771 HD21 ASN 282 -51.725 -8.889 -6.778 1.00 0.00 H +ATOM 1772 HD22 ASN 282 -51.472 -10.051 -8.039 1.00 0.00 H +ATOM 1773 C ASN 282 -49.157 -10.096 -10.859 1.00 0.00 C +ATOM 1774 O ASN 282 -50.109 -10.831 -11.162 1.00 0.00 O +ATOM 1775 N GLN 283 -47.888 -10.398 -11.128 1.00 0.00 N +ATOM 1776 H GLN 283 -47.203 -9.656 -10.878 1.00 0.00 H +ATOM 1777 CA GLN 283 -47.501 -11.677 -11.728 1.00 0.00 C +ATOM 1778 HA GLN 283 -48.270 -12.287 -11.668 1.00 0.00 H +ATOM 1779 CB GLN 283 -46.992 -11.472 -13.156 1.00 0.00 C +ATOM 1780 HB2 GLN 283 -46.424 -10.653 -13.183 1.00 0.00 H +ATOM 1781 HB3 GLN 283 -46.453 -12.268 -13.425 1.00 0.00 H +ATOM 1782 CG GLN 283 -48.118 -11.299 -14.177 1.00 0.00 C +ATOM 1783 HG2 GLN 283 -48.852 -10.767 -13.754 1.00 0.00 H +ATOM 1784 HG3 GLN 283 -47.758 -10.800 -14.966 1.00 0.00 H +ATOM 1785 CD GLN 283 -48.696 -12.621 -14.661 1.00 0.00 C +ATOM 1786 OE1 GLN 283 -48.563 -13.663 -14.011 1.00 0.00 O +ATOM 1787 NE2 GLN 283 -49.364 -12.576 -15.803 1.00 0.00 N +ATOM 1788 HE21 GLN 283 -49.771 -13.424 -16.202 1.00 0.00 H +ATOM 1789 HE22 GLN 283 -49.470 -11.685 -16.282 1.00 0.00 H +ATOM 1790 C GLN 283 -46.402 -12.207 -10.825 1.00 0.00 C +ATOM 1791 O GLN 283 -45.402 -12.743 -11.289 1.00 0.00 O +ATOM 1792 N GLU 284 -46.614 -12.047 -9.522 1.00 0.00 N +ATOM 1793 H GLU 284 -47.524 -11.591 -9.286 1.00 0.00 H +ATOM 1794 CA GLU 284 -45.653 -12.474 -8.508 1.00 0.00 C +ATOM 1795 HA GLU 284 -44.825 -11.868 -8.554 1.00 0.00 H +ATOM 1796 CB GLU 284 -46.227 -12.220 -7.116 1.00 0.00 C +ATOM 1797 HB2 GLU 284 -46.836 -11.454 -7.181 1.00 0.00 H +ATOM 1798 HB3 GLU 284 -46.681 -13.040 -6.827 1.00 0.00 H +ATOM 1799 CG GLU 284 -45.167 -11.889 -6.099 1.00 0.00 C +ATOM 1800 HG2 GLU 284 -44.517 -12.628 -6.074 1.00 0.00 H +ATOM 1801 HG3 GLU 284 -44.746 -11.036 -6.351 1.00 0.00 H +ATOM 1802 CD GLU 284 -45.729 -11.727 -4.711 1.00 0.00 C +ATOM 1803 OE1 GLU 284 -46.883 -11.254 -4.595 1.00 0.00 O +ATOM 1804 OE2 GLU 284 -45.005 -12.055 -3.750 1.00 0.00 O +ATOM 1805 C GLU 284 -45.204 -13.933 -8.594 1.00 0.00 C +ATOM 1806 O GLU 284 -44.051 -14.254 -8.288 1.00 0.00 O +ATOM 1807 N SER 285 -46.099 -14.826 -9.001 1.00 0.00 N +ATOM 1808 H SER 285 -47.022 -14.453 -9.249 1.00 0.00 H +ATOM 1809 CA SER 285 -45.736 -16.237 -9.071 1.00 0.00 C +ATOM 1810 HA SER 285 -45.328 -16.499 -8.178 1.00 0.00 H +ATOM 1811 CB SER 285 -46.978 -17.107 -9.289 1.00 0.00 C +ATOM 1812 HB2 SER 285 -46.721 -18.065 -9.180 1.00 0.00 H +ATOM 1813 HB3 SER 285 -47.664 -16.861 -8.607 1.00 0.00 H +ATOM 1814 OG SER 285 -47.529 -16.922 -10.583 1.00 0.00 O +ATOM 1815 HG SER 285 -48.009 -16.047 -10.618 1.00 0.00 H +ATOM 1816 C SER 285 -44.711 -16.547 -10.158 1.00 0.00 C +ATOM 1817 O SER 285 -44.196 -17.662 -10.224 1.00 0.00 O +ATOM 1818 N CYS 286 -44.415 -15.567 -11.006 1.00 0.00 N +ATOM 1819 H CYS 286 -44.905 -14.674 -10.836 1.00 0.00 H +ATOM 1820 CA CYS 286 -43.460 -15.778 -12.088 1.00 0.00 C +ATOM 1821 HA CYS 286 -43.531 -16.747 -12.387 1.00 0.00 H +ATOM 1822 CB CYS 286 -43.816 -14.888 -13.282 1.00 0.00 C +ATOM 1823 HB2 CYS 286 -43.878 -13.941 -12.951 1.00 0.00 H +ATOM 1824 HB3 CYS 286 -43.062 -14.947 -13.944 1.00 0.00 H +ATOM 1825 SG CYS 286 -45.353 -15.297 -14.132 1.00 0.00 S +ATOM 1826 HG CYS 286 -45.691 -14.491 -14.619 1.00 0.00 H +ATOM 1827 C CYS 286 -42.018 -15.518 -11.677 1.00 0.00 C +ATOM 1828 O CYS 286 -41.087 -15.868 -12.400 1.00 0.00 O +ATOM 1829 N ILE 287 -41.841 -14.909 -10.510 1.00 0.00 N +ATOM 1830 H ILE 287 -42.715 -14.693 -9.994 1.00 0.00 H +ATOM 1831 CA ILE 287 -40.513 -14.583 -10.019 1.00 0.00 C +ATOM 1832 HA ILE 287 -40.056 -14.056 -10.766 1.00 0.00 H +ATOM 1833 CB ILE 287 -40.600 -13.656 -8.774 1.00 0.00 C +ATOM 1834 HB ILE 287 -41.148 -14.114 -8.094 1.00 0.00 H +ATOM 1835 CG2 ILE 287 -39.195 -13.338 -8.249 1.00 0.00 C +ATOM 1836 HG21 ILE 287 -39.270 -12.748 -7.449 1.00 0.00 H +ATOM 1837 HG22 ILE 287 -38.738 -14.188 -7.999 1.00 0.00 H +ATOM 1838 HG23 ILE 287 -38.676 -12.874 -8.962 1.00 0.00 H +ATOM 1839 CG1 ILE 287 -41.317 -12.348 -9.164 1.00 0.00 C +ATOM 1840 HG12 ILE 287 -40.728 -11.846 -9.800 1.00 0.00 H +ATOM 1841 HG13 ILE 287 -42.162 -12.590 -9.647 1.00 0.00 H +ATOM 1842 CD1 ILE 287 -41.672 -11.434 -7.997 1.00 0.00 C +ATOM 1843 HD11 ILE 287 -40.835 -11.174 -7.521 1.00 0.00 H +ATOM 1844 HD12 ILE 287 -42.129 -10.620 -8.348 1.00 0.00 H +ATOM 1845 HD13 ILE 287 -42.279 -11.922 -7.374 1.00 0.00 H +ATOM 1846 C ILE 287 -39.618 -15.775 -9.723 1.00 0.00 C +ATOM 1847 O ILE 287 -38.500 -15.831 -10.211 1.00 0.00 O +ATOM 1848 N GLU 288 -40.099 -16.733 -8.941 1.00 0.00 N +ATOM 1849 H GLU 288 -41.052 -16.591 -8.590 1.00 0.00 H +ATOM 1850 CA GLU 288 -39.275 -17.902 -8.630 1.00 0.00 C +ATOM 1851 HA GLU 288 -38.451 -17.615 -8.134 1.00 0.00 H +ATOM 1852 CB GLU 288 -40.025 -18.823 -7.677 1.00 0.00 C +ATOM 1853 HB2 GLU 288 -40.347 -18.280 -6.921 1.00 0.00 H +ATOM 1854 HB3 GLU 288 -40.765 -19.239 -8.175 1.00 0.00 H +ATOM 1855 CG GLU 288 -39.173 -19.947 -7.101 1.00 0.00 C +ATOM 1856 HG2 GLU 288 -39.013 -20.608 -7.809 1.00 0.00 H +ATOM 1857 HG3 GLU 288 -38.341 -19.560 -6.753 1.00 0.00 H +ATOM 1858 CD GLU 288 -39.856 -20.673 -5.944 1.00 0.00 C +ATOM 1859 OE1 GLU 288 -39.451 -20.469 -4.775 1.00 0.00 O +ATOM 1860 OE2 GLU 288 -40.804 -21.433 -6.218 1.00 0.00 O +ATOM 1861 C GLU 288 -38.859 -18.634 -9.919 1.00 0.00 C +ATOM 1862 O GLU 288 -37.709 -19.041 -10.060 1.00 0.00 O +ATOM 1863 N PRO 289 -39.785 -18.801 -10.879 1.00 0.00 N +ATOM 1864 CD PRO 289 -41.247 -18.648 -10.751 1.00 0.00 C +ATOM 1865 HD2 PRO 289 -41.522 -17.719 -10.984 1.00 0.00 H +ATOM 1866 HD3 PRO 289 -41.541 -18.866 -9.823 1.00 0.00 H +ATOM 1867 CG PRO 289 -41.764 -19.645 -11.745 1.00 0.00 C +ATOM 1868 HG2 PRO 289 -42.678 -19.407 -12.055 1.00 0.00 H +ATOM 1869 HG3 PRO 289 -41.753 -20.566 -11.372 1.00 0.00 H +ATOM 1870 CB PRO 289 -40.780 -19.528 -12.878 1.00 0.00 C +ATOM 1871 HB2 PRO 289 -40.935 -18.694 -13.394 1.00 0.00 H +ATOM 1872 HB3 PRO 289 -40.829 -20.321 -13.472 1.00 0.00 H +ATOM 1873 CA PRO 289 -39.443 -19.476 -12.140 1.00 0.00 C +ATOM 1874 HA PRO 289 -39.121 -20.408 -11.970 1.00 0.00 H +ATOM 1875 C PRO 289 -38.387 -18.666 -12.901 1.00 0.00 C +ATOM 1876 O PRO 289 -37.498 -19.231 -13.534 1.00 0.00 O +ATOM 1877 N LEU 290 -38.485 -17.340 -12.828 1.00 0.00 N +ATOM 1878 H LEU 290 -39.281 -16.987 -12.273 1.00 0.00 H +ATOM 1879 CA LEU 290 -37.515 -16.476 -13.500 1.00 0.00 C +ATOM 1880 HA LEU 290 -37.463 -16.744 -14.466 1.00 0.00 H +ATOM 1881 CB LEU 290 -37.923 -15.009 -13.387 1.00 0.00 C +ATOM 1882 HB2 LEU 290 -38.773 -14.889 -13.868 1.00 0.00 H +ATOM 1883 HB3 LEU 290 -37.998 -14.783 -12.434 1.00 0.00 H +ATOM 1884 CG LEU 290 -36.903 -14.052 -14.009 1.00 0.00 C +ATOM 1885 HG LEU 290 -36.003 -14.241 -13.620 1.00 0.00 H +ATOM 1886 CD1 LEU 290 -36.856 -14.244 -15.514 1.00 0.00 C +ATOM 1887 HD11 LEU 290 -37.759 -14.059 -15.905 1.00 0.00 H +ATOM 1888 HD12 LEU 290 -36.187 -13.615 -15.913 1.00 0.00 H +ATOM 1889 HD13 LEU 290 -36.591 -15.186 -15.725 1.00 0.00 H +ATOM 1890 CD2 LEU 290 -37.269 -12.634 -13.665 1.00 0.00 C +ATOM 1891 HD21 LEU 290 -37.271 -12.512 -12.669 1.00 0.00 H +ATOM 1892 HD22 LEU 290 -36.604 -12.000 -14.070 1.00 0.00 H +ATOM 1893 HD23 LEU 290 -38.182 -12.419 -14.021 1.00 0.00 H +ATOM 1894 C LEU 290 -36.131 -16.644 -12.878 1.00 0.00 C +ATOM 1895 O LEU 290 -35.124 -16.698 -13.586 1.00 0.00 O +ATOM 1896 N ALA 291 -36.087 -16.709 -11.550 1.00 0.00 N +ATOM 1897 H ALA 291 -37.001 -16.638 -11.075 1.00 0.00 H +ATOM 1898 CA ALA 291 -34.817 -16.870 -10.849 1.00 0.00 C +ATOM 1899 HA ALA 291 -34.208 -16.116 -11.104 1.00 0.00 H +ATOM 1900 CB ALA 291 -35.032 -16.836 -9.329 1.00 0.00 C +ATOM 1901 HB1 ALA 291 -35.841 -16.289 -9.125 1.00 0.00 H +ATOM 1902 HB2 ALA 291 -35.161 -17.767 -8.996 1.00 0.00 H +ATOM 1903 HB3 ALA 291 -34.231 -16.430 -8.894 1.00 0.00 H +ATOM 1904 C ALA 291 -34.166 -18.185 -11.261 1.00 0.00 C +ATOM 1905 O ALA 291 -32.949 -18.275 -11.381 1.00 0.00 O +ATOM 1906 N GLU 292 -34.989 -19.204 -11.477 1.00 0.00 N +ATOM 1907 H GLU 292 -35.994 -18.993 -11.330 1.00 0.00 H +ATOM 1908 CA GLU 292 -34.487 -20.500 -11.887 1.00 0.00 C +ATOM 1909 HA GLU 292 -33.766 -20.804 -11.261 1.00 0.00 H +ATOM 1910 CB GLU 292 -35.612 -21.538 -11.847 1.00 0.00 C +ATOM 1911 HB2 GLU 292 -36.072 -21.445 -10.981 1.00 0.00 H +ATOM 1912 HB3 GLU 292 -36.212 -21.357 -12.606 1.00 0.00 H +ATOM 1913 CG GLU 292 -35.134 -22.972 -11.966 1.00 0.00 C +ATOM 1914 HG2 GLU 292 -34.917 -23.149 -12.905 1.00 0.00 H +ATOM 1915 HG3 GLU 292 -34.367 -23.095 -11.369 1.00 0.00 H +ATOM 1916 CD GLU 292 -36.204 -23.960 -11.547 1.00 0.00 C +ATOM 1917 OE1 GLU 292 -36.975 -23.633 -10.618 1.00 0.00 O +ATOM 1918 OE2 GLU 292 -36.262 -25.059 -12.129 1.00 0.00 O +ATOM 1919 C GLU 292 -33.919 -20.405 -13.302 1.00 0.00 C +ATOM 1920 O GLU 292 -32.898 -21.015 -13.600 1.00 0.00 O +ATOM 1921 N SER 293 -34.587 -19.641 -14.168 1.00 0.00 N +ATOM 1922 H SER 293 -35.438 -19.189 -13.786 1.00 0.00 H +ATOM 1923 CA SER 293 -34.133 -19.468 -15.552 1.00 0.00 C +ATOM 1924 HA SER 293 -34.007 -20.383 -15.953 1.00 0.00 H +ATOM 1925 CB SER 293 -35.161 -18.677 -16.365 1.00 0.00 C +ATOM 1926 HB2 SER 293 -35.388 -17.844 -15.872 1.00 0.00 H +ATOM 1927 HB3 SER 293 -34.768 -18.458 -17.252 1.00 0.00 H +ATOM 1928 OG SER 293 -36.342 -19.437 -16.558 1.00 0.00 O +ATOM 1929 HG SER 293 -36.848 -19.490 -15.698 1.00 0.00 H +ATOM 1930 C SER 293 -32.793 -18.743 -15.604 1.00 0.00 C +ATOM 1931 O SER 293 -31.915 -19.092 -16.394 1.00 0.00 O +ATOM 1932 N ILE 294 -32.644 -17.729 -14.760 1.00 0.00 N +ATOM 1933 H ILE 294 -33.460 -17.532 -14.158 1.00 0.00 H +ATOM 1934 CA ILE 294 -31.398 -16.965 -14.712 1.00 0.00 C +ATOM 1935 HA ILE 294 -31.183 -16.718 -15.657 1.00 0.00 H +ATOM 1936 CB ILE 294 -31.517 -15.748 -13.765 1.00 0.00 C +ATOM 1937 HB ILE 294 -31.826 -16.078 -12.882 1.00 0.00 H +ATOM 1938 CG2 ILE 294 -30.166 -15.058 -13.630 1.00 0.00 C +ATOM 1939 HG21 ILE 294 -30.246 -14.291 -12.996 1.00 0.00 H +ATOM 1940 HG22 ILE 294 -29.493 -15.709 -13.283 1.00 0.00 H +ATOM 1941 HG23 ILE 294 -29.873 -14.722 -14.523 1.00 0.00 H +ATOM 1942 CG1 ILE 294 -32.565 -14.763 -14.298 1.00 0.00 C +ATOM 1943 HG12 ILE 294 -32.268 -14.440 -15.194 1.00 0.00 H +ATOM 1944 HG13 ILE 294 -33.429 -15.253 -14.404 1.00 0.00 H +ATOM 1945 CD1 ILE 294 -32.797 -13.561 -13.395 1.00 0.00 C +ATOM 1946 HD11 ILE 294 -31.941 -13.059 -13.292 1.00 0.00 H +ATOM 1947 HD12 ILE 294 -33.488 -12.971 -13.807 1.00 0.00 H +ATOM 1948 HD13 ILE 294 -33.112 -13.878 -12.503 1.00 0.00 H +ATOM 1949 C ILE 294 -30.263 -17.863 -14.226 1.00 0.00 C +ATOM 1950 O ILE 294 -29.157 -17.838 -14.768 1.00 0.00 O +ATOM 1951 N THR 295 -30.545 -18.657 -13.198 1.00 0.00 N +ATOM 1952 H THR 295 -31.511 -18.575 -12.833 1.00 0.00 H +ATOM 1953 CA THR 295 -29.547 -19.564 -12.648 1.00 0.00 C +ATOM 1954 HA THR 295 -28.737 -19.030 -12.387 1.00 0.00 H +ATOM 1955 CB THR 295 -30.079 -20.312 -11.406 1.00 0.00 C +ATOM 1956 HB THR 295 -30.869 -20.891 -11.687 1.00 0.00 H +ATOM 1957 CG2 THR 295 -28.976 -21.162 -10.787 1.00 0.00 C +ATOM 1958 HG21 THR 295 -28.350 -20.578 -10.266 1.00 0.00 H +ATOM 1959 HG22 THR 295 -29.378 -21.844 -10.172 1.00 0.00 H +ATOM 1960 HG23 THR 295 -28.464 -21.631 -11.509 1.00 0.00 H +ATOM 1961 OG1 THR 295 -30.539 -19.361 -10.441 1.00 0.00 O +ATOM 1962 HG1 THR 295 -31.401 -18.941 -10.746 1.00 0.00 H +ATOM 1963 C THR 295 -29.129 -20.588 -13.697 1.00 0.00 C +ATOM 1964 O THR 295 -27.951 -20.909 -13.808 1.00 0.00 O +ATOM 1965 N ASP 296 -30.092 -21.093 -14.469 1.00 0.00 N +ATOM 1966 H ASP 296 -31.041 -20.749 -14.276 1.00 0.00 H +ATOM 1967 CA ASP 296 -29.769 -22.070 -15.510 1.00 0.00 C +ATOM 1968 HA ASP 296 -29.272 -22.822 -15.064 1.00 0.00 H +ATOM 1969 CB ASP 296 -31.028 -22.577 -16.218 1.00 0.00 C +ATOM 1970 HB2 ASP 296 -31.595 -21.788 -16.432 1.00 0.00 H +ATOM 1971 HB3 ASP 296 -30.744 -23.035 -17.054 1.00 0.00 H +ATOM 1972 CG ASP 296 -31.823 -23.540 -15.375 1.00 0.00 C +ATOM 1973 OD1 ASP 296 -31.238 -24.168 -14.466 1.00 0.00 O +ATOM 1974 OD2 ASP 296 -33.035 -23.683 -15.635 1.00 0.00 O +ATOM 1975 C ASP 296 -28.836 -21.464 -16.544 1.00 0.00 C +ATOM 1976 O ASP 296 -27.879 -22.103 -16.968 1.00 0.00 O +ATOM 1977 N VAL 297 -29.112 -20.227 -16.948 1.00 0.00 N +ATOM 1978 H VAL 297 -29.944 -19.797 -16.515 1.00 0.00 H +ATOM 1979 CA VAL 297 -28.271 -19.561 -17.936 1.00 0.00 C +ATOM 1980 HA VAL 297 -28.191 -20.165 -18.739 1.00 0.00 H +ATOM 1981 CB VAL 297 -28.898 -18.220 -18.388 1.00 0.00 C +ATOM 1982 HB VAL 297 -29.063 -17.675 -17.576 1.00 0.00 H +ATOM 1983 CG1 VAL 297 -27.904 -17.436 -19.256 1.00 0.00 C +ATOM 1984 HG11 VAL 297 -28.385 -16.690 -19.711 1.00 0.00 H +ATOM 1985 HG12 VAL 297 -27.181 -17.068 -18.675 1.00 0.00 H +ATOM 1986 HG13 VAL 297 -27.510 -18.049 -19.937 1.00 0.00 H +ATOM 1987 CG2 VAL 297 -30.184 -18.490 -19.161 1.00 0.00 C +ATOM 1988 HG21 VAL 297 -30.804 -19.028 -18.590 1.00 0.00 H +ATOM 1989 HG22 VAL 297 -30.614 -17.620 -19.399 1.00 0.00 H +ATOM 1990 HG23 VAL 297 -29.966 -18.998 -19.994 1.00 0.00 H +ATOM 1991 C VAL 297 -26.868 -19.315 -17.393 1.00 0.00 C +ATOM 1992 O VAL 297 -25.877 -19.574 -18.071 1.00 0.00 O +ATOM 1993 N LEU 298 -26.787 -18.828 -16.159 1.00 0.00 N +ATOM 1994 H LEU 298 -27.691 -18.665 -15.687 1.00 0.00 H +ATOM 1995 CA LEU 298 -25.487 -18.551 -15.537 1.00 0.00 C +ATOM 1996 HA LEU 298 -24.962 -17.940 -16.154 1.00 0.00 H +ATOM 1997 CB LEU 298 -25.674 -17.814 -14.206 1.00 0.00 C +ATOM 1998 HB2 LEU 298 -26.062 -16.920 -14.406 1.00 0.00 H +ATOM 1999 HB3 LEU 298 -26.299 -18.348 -13.649 1.00 0.00 H +ATOM 2000 CG LEU 298 -24.404 -17.591 -13.390 1.00 0.00 C +ATOM 2001 HG LEU 298 -23.978 -18.472 -13.199 1.00 0.00 H +ATOM 2002 CD1 LEU 298 -23.426 -16.719 -14.175 1.00 0.00 C +ATOM 2003 HD11 LEU 298 -23.852 -15.836 -14.370 1.00 0.00 H +ATOM 2004 HD12 LEU 298 -22.598 -16.579 -13.633 1.00 0.00 H +ATOM 2005 HD13 LEU 298 -23.191 -17.174 -15.033 1.00 0.00 H +ATOM 2006 CD2 LEU 298 -24.747 -16.911 -12.069 1.00 0.00 C +ATOM 2007 HD21 LEU 298 -25.375 -17.490 -11.549 1.00 0.00 H +ATOM 2008 HD22 LEU 298 -23.910 -16.769 -11.540 1.00 0.00 H +ATOM 2009 HD23 LEU 298 -25.181 -16.028 -12.251 1.00 0.00 H +ATOM 2010 C LEU 298 -24.646 -19.810 -15.285 1.00 0.00 C +ATOM 2011 O LEU 298 -23.514 -19.923 -15.764 1.00 0.00 O +ATOM 2012 N VAL 299 -25.210 -20.758 -14.545 1.00 0.00 N +ATOM 2013 H VAL 299 -26.179 -20.563 -14.244 1.00 0.00 H +ATOM 2014 CA VAL 299 -24.480 -21.965 -14.208 1.00 0.00 C +ATOM 2015 HA VAL 299 -23.540 -21.688 -13.894 1.00 0.00 H +ATOM 2016 CB VAL 299 -25.121 -22.663 -12.966 1.00 0.00 C +ATOM 2017 HB VAL 299 -26.039 -22.940 -13.228 1.00 0.00 H +ATOM 2018 CG1 VAL 299 -24.354 -23.921 -12.597 1.00 0.00 C +ATOM 2019 HG11 VAL 299 -24.502 -24.133 -11.630 1.00 0.00 H +ATOM 2020 HG12 VAL 299 -24.675 -24.686 -13.157 1.00 0.00 H +ATOM 2021 HG13 VAL 299 -23.377 -23.778 -12.759 1.00 0.00 H +ATOM 2022 CG2 VAL 299 -25.133 -21.702 -11.781 1.00 0.00 C +ATOM 2023 HG21 VAL 299 -25.080 -20.763 -12.119 1.00 0.00 H +ATOM 2024 HG22 VAL 299 -25.979 -21.828 -11.265 1.00 0.00 H +ATOM 2025 HG23 VAL 299 -24.348 -21.895 -11.194 1.00 0.00 H +ATOM 2026 C VAL 299 -24.305 -22.980 -15.332 1.00 0.00 C +ATOM 2027 O VAL 299 -23.236 -23.584 -15.445 1.00 0.00 O +ATOM 2028 N ARG 300 -25.322 -23.160 -16.172 1.00 0.00 N +ATOM 2029 H ARG 300 -26.144 -22.561 -16.006 1.00 0.00 H +ATOM 2030 CA ARG 300 -25.236 -24.151 -17.242 1.00 0.00 C +ATOM 2031 HA ARG 300 -24.816 -25.000 -16.861 1.00 0.00 H +ATOM 2032 CB ARG 300 -26.636 -24.560 -17.707 1.00 0.00 C +ATOM 2033 HB2 ARG 300 -27.022 -23.808 -18.242 1.00 0.00 H +ATOM 2034 HB3 ARG 300 -26.551 -25.370 -18.287 1.00 0.00 H +ATOM 2035 CG ARG 300 -27.633 -24.894 -16.588 1.00 0.00 C +ATOM 2036 HG2 ARG 300 -27.621 -24.150 -15.906 1.00 0.00 H +ATOM 2037 HG3 ARG 300 -28.562 -24.940 -16.981 1.00 0.00 H +ATOM 2038 CD ARG 300 -27.369 -26.208 -15.855 1.00 0.00 C +ATOM 2039 HD2 ARG 300 -27.318 -26.931 -16.523 1.00 0.00 H +ATOM 2040 HD3 ARG 300 -26.528 -26.116 -15.348 1.00 0.00 H +ATOM 2041 NE ARG 300 -28.473 -26.492 -14.916 1.00 0.00 N +ATOM 2042 HE ARG 300 -29.244 -25.837 -14.901 1.00 0.00 H +ATOM 2043 CZ ARG 300 -28.533 -27.537 -14.093 1.00 0.00 C +ATOM 2044 NH1 ARG 300 -27.546 -28.413 -14.078 1.00 0.00 N +ATOM 2045 HH11 ARG 300 -26.740 -28.308 -14.653 1.00 0.00 H +ATOM 2046 HH12 ARG 300 -27.604 -29.218 -13.465 1.00 0.00 H +ATOM 2047 NH2 ARG 300 -29.593 -27.723 -13.305 1.00 0.00 N +ATOM 2048 HH21 ARG 300 -30.337 -27.049 -13.330 1.00 0.00 H +ATOM 2049 HH22 ARG 300 -29.643 -28.511 -12.706 1.00 0.00 H +ATOM 2050 C ARG 300 -24.416 -23.705 -18.443 1.00 0.00 C +ATOM 2051 O ARG 300 -23.952 -24.554 -19.191 1.00 0.00 O +ATOM 2052 N THR 301 -24.238 -22.398 -18.647 1.00 0.00 N +ATOM 2053 H THR 301 -24.694 -21.774 -17.981 1.00 0.00 H +ATOM 2054 CA THR 301 -23.423 -21.951 -19.781 1.00 0.00 C +ATOM 2055 HA THR 301 -23.268 -22.748 -20.395 1.00 0.00 H +ATOM 2056 CB THR 301 -24.154 -20.889 -20.679 1.00 0.00 C +ATOM 2057 HB THR 301 -23.608 -20.770 -21.533 1.00 0.00 H +ATOM 2058 CG2 THR 301 -25.556 -21.360 -21.005 1.00 0.00 C +ATOM 2059 HG21 THR 301 -25.521 -22.100 -21.682 1.00 0.00 H +ATOM 2060 HG22 THR 301 -26.006 -21.699 -20.175 1.00 0.00 H +ATOM 2061 HG23 THR 301 -26.095 -20.601 -21.380 1.00 0.00 H +ATOM 2062 OG1 THR 301 -24.228 -19.629 -20.004 1.00 0.00 O +ATOM 2063 HG1 THR 301 -24.915 -19.664 -19.270 1.00 0.00 H +ATOM 2064 C THR 301 -22.053 -21.387 -19.382 1.00 0.00 C +ATOM 2065 O THR 301 -21.204 -21.174 -20.242 1.00 0.00 O +ATOM 2066 N LYS 302 -21.823 -21.154 -18.093 1.00 0.00 N +ATOM 2067 H LYS 302 -22.586 -21.387 -17.452 1.00 0.00 H +ATOM 2068 CA LYS 302 -20.535 -20.595 -17.674 1.00 0.00 C +ATOM 2069 HA LYS 302 -19.895 -20.627 -18.471 1.00 0.00 H +ATOM 2070 CB LYS 302 -20.686 -19.101 -17.320 1.00 0.00 C +ATOM 2071 HB2 LYS 302 -21.279 -19.036 -16.517 1.00 0.00 H +ATOM 2072 HB3 LYS 302 -19.778 -18.749 -17.091 1.00 0.00 H +ATOM 2073 CG LYS 302 -21.274 -18.240 -18.425 1.00 0.00 C +ATOM 2074 HG2 LYS 302 -22.184 -18.595 -18.668 1.00 0.00 H +ATOM 2075 HG3 LYS 302 -21.379 -17.298 -18.087 1.00 0.00 H +ATOM 2076 CD LYS 302 -20.412 -18.213 -19.681 1.00 0.00 C +ATOM 2077 HD2 LYS 302 -19.526 -17.824 -19.459 1.00 0.00 H +ATOM 2078 HD3 LYS 302 -20.313 -19.137 -20.028 1.00 0.00 H +ATOM 2079 CE LYS 302 -21.052 -17.352 -20.782 1.00 0.00 C +ATOM 2080 HE2 LYS 302 -21.978 -17.698 -20.960 1.00 0.00 H +ATOM 2081 HE3 LYS 302 -21.119 -16.406 -20.450 1.00 0.00 H +ATOM 2082 NZ LYS 302 -20.267 -17.370 -22.056 1.00 0.00 N +ATOM 2083 HZ1 LYS 302 -19.328 -17.089 -21.866 1.00 0.00 H +ATOM 2084 HZ2 LYS 302 -20.274 -18.295 -22.432 1.00 0.00 H +ATOM 2085 HZ3 LYS 302 -20.684 -16.738 -22.707 1.00 0.00 H +ATOM 2086 C LYS 302 -19.875 -21.312 -16.498 1.00 0.00 C +ATOM 2087 O LYS 302 -19.105 -20.698 -15.763 1.00 0.00 O +ATOM 2088 N ARG 303 -20.147 -22.604 -16.328 1.00 0.00 N +ATOM 2089 H ARG 303 -20.771 -23.023 -17.027 1.00 0.00 H +ATOM 2090 CA ARG 303 -19.568 -23.337 -15.200 1.00 0.00 C +ATOM 2091 HA ARG 303 -19.917 -22.926 -14.337 1.00 0.00 H +ATOM 2092 CB ARG 303 -20.039 -24.794 -15.180 1.00 0.00 C +ATOM 2093 HB2 ARG 303 -21.023 -24.809 -15.259 1.00 0.00 H +ATOM 2094 HB3 ARG 303 -19.609 -25.276 -15.927 1.00 0.00 H +ATOM 2095 CG ARG 303 -19.662 -25.522 -13.875 1.00 0.00 C +ATOM 2096 HG2 ARG 303 -18.674 -25.478 -13.754 1.00 0.00 H +ATOM 2097 HG3 ARG 303 -20.121 -25.075 -13.112 1.00 0.00 H +ATOM 2098 CD ARG 303 -20.081 -26.981 -13.901 1.00 0.00 C +ATOM 2099 HD2 ARG 303 -19.638 -27.418 -14.690 1.00 0.00 H +ATOM 2100 HD3 ARG 303 -19.741 -27.417 -13.060 1.00 0.00 H +ATOM 2101 NE ARG 303 -21.528 -27.189 -13.993 1.00 0.00 N +ATOM 2102 HE ARG 303 -21.924 -27.307 -14.916 1.00 0.00 H +ATOM 2103 CZ ARG 303 -22.358 -27.234 -12.956 1.00 0.00 C +ATOM 2104 NH1 ARG 303 -21.903 -27.077 -11.718 1.00 0.00 N +ATOM 2105 HH11 ARG 303 -20.936 -26.903 -11.548 1.00 0.00 H +ATOM 2106 HH12 ARG 303 -22.540 -27.133 -10.943 1.00 0.00 H +ATOM 2107 NH2 ARG 303 -23.646 -27.480 -13.158 1.00 0.00 N +ATOM 2108 HH21 ARG 303 -23.990 -27.611 -14.090 1.00 0.00 H +ATOM 2109 HH22 ARG 303 -24.275 -27.534 -12.383 1.00 0.00 H +ATOM 2110 C ARG 303 -18.046 -23.309 -15.169 1.00 0.00 C +ATOM 2111 O ARG 303 -17.450 -23.016 -14.134 1.00 0.00 O +ATOM 2112 N ASP 304 -17.408 -23.618 -16.294 1.00 0.00 N +ATOM 2113 H ASP 304 -18.010 -23.844 -17.098 1.00 0.00 H +ATOM 2114 CA ASP 304 -15.945 -23.624 -16.343 1.00 0.00 C +ATOM 2115 HA ASP 304 -15.632 -24.350 -15.719 1.00 0.00 H +ATOM 2116 CB ASP 304 -15.438 -23.869 -17.767 1.00 0.00 C +ATOM 2117 HB2 ASP 304 -15.813 -23.158 -18.351 1.00 0.00 H +ATOM 2118 HB3 ASP 304 -14.446 -23.818 -17.752 1.00 0.00 H +ATOM 2119 CG ASP 304 -15.852 -25.219 -18.310 1.00 0.00 C +ATOM 2120 OD1 ASP 304 -15.508 -26.250 -17.690 1.00 0.00 O +ATOM 2121 OD2 ASP 304 -16.522 -25.239 -19.364 1.00 0.00 O +ATOM 2122 C ASP 304 -15.375 -22.313 -15.830 1.00 0.00 C +ATOM 2123 O ASP 304 -14.464 -22.313 -15.010 1.00 0.00 O +ATOM 2124 N TRP 305 -15.908 -21.198 -16.320 1.00 0.00 N +ATOM 2125 H TRP 305 -16.665 -21.343 -17.015 1.00 0.00 H +ATOM 2126 CA TRP 305 -15.447 -19.875 -15.898 1.00 0.00 C +ATOM 2127 HA TRP 305 -14.455 -19.833 -16.050 1.00 0.00 H +ATOM 2128 CB TRP 305 -16.178 -18.769 -16.674 1.00 0.00 C +ATOM 2129 HB2 TRP 305 -16.129 -18.965 -17.644 1.00 0.00 H +ATOM 2130 HB3 TRP 305 -17.119 -18.723 -16.367 1.00 0.00 H +ATOM 2131 CG TRP 305 -15.583 -17.381 -16.476 1.00 0.00 C +ATOM 2132 CD1 TRP 305 -14.605 -16.794 -17.230 1.00 0.00 C +ATOM 2133 HD1 TRP 305 -14.170 -17.210 -18.028 1.00 0.00 H +ATOM 2134 NE1 TRP 305 -14.305 -15.549 -16.734 1.00 0.00 N +ATOM 2135 HE1 TRP 305 -13.624 -14.921 -17.112 1.00 0.00 H +ATOM 2136 CE2 TRP 305 -15.087 -15.304 -15.639 1.00 0.00 C +ATOM 2137 CZ2 TRP 305 -15.143 -14.180 -14.801 1.00 0.00 C +ATOM 2138 HZ2 TRP 305 -14.543 -13.394 -14.973 1.00 0.00 H +ATOM 2139 CH2 TRP 305 -16.036 -14.206 -13.758 1.00 0.00 C +ATOM 2140 HH2 TRP 305 -16.103 -13.426 -13.138 1.00 0.00 H +ATOM 2141 CZ3 TRP 305 -16.871 -15.317 -13.538 1.00 0.00 C +ATOM 2142 HZ3 TRP 305 -17.511 -15.313 -12.780 1.00 0.00 H +ATOM 2143 CE3 TRP 305 -16.817 -16.438 -14.373 1.00 0.00 C +ATOM 2144 HE3 TRP 305 -17.412 -17.214 -14.203 1.00 0.00 H +ATOM 2145 CD2 TRP 305 -15.912 -16.433 -15.442 1.00 0.00 C +ATOM 2146 C TRP 305 -15.692 -19.669 -14.402 1.00 0.00 C +ATOM 2147 O TRP 305 -14.809 -19.222 -13.675 1.00 0.00 O +ATOM 2148 N LEU 306 -16.897 -19.995 -13.943 1.00 0.00 N +ATOM 2149 H LEU 306 -17.551 -20.370 -14.647 1.00 0.00 H +ATOM 2150 CA LEU 306 -17.230 -19.819 -12.533 1.00 0.00 C +ATOM 2151 HA LEU 306 -17.155 -18.836 -12.307 1.00 0.00 H +ATOM 2152 CB LEU 306 -18.679 -20.241 -12.273 1.00 0.00 C +ATOM 2153 HB2 LEU 306 -18.811 -21.132 -12.666 1.00 0.00 H +ATOM 2154 HB3 LEU 306 -18.829 -20.232 -11.303 1.00 0.00 H +ATOM 2155 CG LEU 306 -19.695 -19.297 -12.911 1.00 0.00 C +ATOM 2156 HG LEU 306 -19.384 -19.058 -13.830 1.00 0.00 H +ATOM 2157 CD1 LEU 306 -21.053 -19.967 -12.993 1.00 0.00 C +ATOM 2158 HD11 LEU 306 -21.366 -20.209 -12.073 1.00 0.00 H +ATOM 2159 HD12 LEU 306 -21.713 -19.341 -13.412 1.00 0.00 H +ATOM 2160 HD13 LEU 306 -20.986 -20.797 -13.548 1.00 0.00 H +ATOM 2161 CD2 LEU 306 -19.769 -18.011 -12.098 1.00 0.00 C +ATOM 2162 HD21 LEU 306 -18.869 -17.573 -12.083 1.00 0.00 H +ATOM 2163 HD22 LEU 306 -20.434 -17.391 -12.514 1.00 0.00 H +ATOM 2164 HD23 LEU 306 -20.052 -18.223 -11.162 1.00 0.00 H +ATOM 2165 C LEU 306 -16.291 -20.594 -11.618 1.00 0.00 C +ATOM 2166 O LEU 306 -15.801 -20.061 -10.624 1.00 0.00 O +ATOM 2167 N VAL 307 -16.037 -21.850 -11.955 1.00 0.00 N +ATOM 2168 H VAL 307 -16.500 -22.182 -12.814 1.00 0.00 H +ATOM 2169 CA VAL 307 -15.155 -22.673 -11.136 1.00 0.00 C +ATOM 2170 HA VAL 307 -15.501 -22.661 -10.192 1.00 0.00 H +ATOM 2171 CB VAL 307 -15.143 -24.141 -11.644 1.00 0.00 C +ATOM 2172 HB VAL 307 -14.859 -24.122 -12.597 1.00 0.00 H +ATOM 2173 CG1 VAL 307 -14.119 -24.965 -10.883 1.00 0.00 C +ATOM 2174 HG11 VAL 307 -14.459 -25.899 -10.766 1.00 0.00 H +ATOM 2175 HG12 VAL 307 -13.259 -24.987 -11.394 1.00 0.00 H +ATOM 2176 HG13 VAL 307 -13.960 -24.556 -9.984 1.00 0.00 H +ATOM 2177 CG2 VAL 307 -16.537 -24.742 -11.481 1.00 0.00 C +ATOM 2178 HG21 VAL 307 -16.594 -25.201 -10.595 1.00 0.00 H +ATOM 2179 HG22 VAL 307 -17.216 -24.011 -11.528 1.00 0.00 H +ATOM 2180 HG23 VAL 307 -16.697 -25.401 -12.215 1.00 0.00 H +ATOM 2181 C VAL 307 -13.741 -22.099 -11.125 1.00 0.00 C +ATOM 2182 O VAL 307 -13.110 -21.996 -10.069 1.00 0.00 O +ATOM 2183 N LYS 308 -13.249 -21.704 -12.293 1.00 0.00 N +ATOM 2184 H LYS 308 -13.872 -21.830 -13.103 1.00 0.00 H +ATOM 2185 CA LYS 308 -11.906 -21.133 -12.378 1.00 0.00 C +ATOM 2186 HA LYS 308 -11.246 -21.792 -12.001 1.00 0.00 H +ATOM 2187 CB LYS 308 -11.521 -20.884 -13.844 1.00 0.00 C +ATOM 2188 HB2 LYS 308 -11.676 -21.725 -14.353 1.00 0.00 H +ATOM 2189 HB3 LYS 308 -12.102 -20.157 -14.198 1.00 0.00 H +ATOM 2190 CG LYS 308 -10.063 -20.470 -14.035 1.00 0.00 C +ATOM 2191 HG2 LYS 308 -9.967 -19.500 -13.791 1.00 0.00 H +ATOM 2192 HG3 LYS 308 -9.487 -21.017 -13.421 1.00 0.00 H +ATOM 2193 CD LYS 308 -9.578 -20.665 -15.467 1.00 0.00 C +ATOM 2194 HD2 LYS 308 -9.666 -21.617 -15.710 1.00 0.00 H +ATOM 2195 HD3 LYS 308 -10.102 -20.084 -16.067 1.00 0.00 H +ATOM 2196 CE LYS 308 -8.105 -20.270 -15.570 1.00 0.00 C +ATOM 2197 HE2 LYS 308 -7.729 -20.632 -16.413 1.00 0.00 H +ATOM 2198 HE3 LYS 308 -8.031 -19.281 -15.549 1.00 0.00 H +ATOM 2199 NZ LYS 308 -7.345 -20.845 -14.406 1.00 0.00 N +ATOM 2200 HZ1 LYS 308 -6.403 -21.012 -14.685 1.00 0.00 H +ATOM 2201 HZ2 LYS 308 -7.367 -20.193 -13.652 1.00 0.00 H +ATOM 2202 HZ3 LYS 308 -7.775 -21.701 -14.130 1.00 0.00 H +ATOM 2203 C LYS 308 -11.812 -19.834 -11.569 1.00 0.00 C +ATOM 2204 O LYS 308 -10.761 -19.522 -11.011 1.00 0.00 O +ATOM 2205 N GLN 309 -12.916 -19.093 -11.480 1.00 0.00 N +ATOM 2206 H GLN 309 -13.738 -19.468 -11.979 1.00 0.00 H +ATOM 2207 CA GLN 309 -12.922 -17.846 -10.722 1.00 0.00 C +ATOM 2208 HA GLN 309 -11.984 -17.463 -10.743 1.00 0.00 H +ATOM 2209 CB GLN 309 -13.872 -16.832 -11.364 1.00 0.00 C +ATOM 2210 HB2 GLN 309 -14.777 -17.254 -11.456 1.00 0.00 H +ATOM 2211 HB3 GLN 309 -13.944 -16.033 -10.761 1.00 0.00 H +ATOM 2212 CG GLN 309 -13.433 -16.350 -12.736 1.00 0.00 C +ATOM 2213 HG2 GLN 309 -13.461 -17.122 -13.371 1.00 0.00 H +ATOM 2214 HG3 GLN 309 -14.067 -15.641 -13.045 1.00 0.00 H +ATOM 2215 CD GLN 309 -12.032 -15.779 -12.731 1.00 0.00 C +ATOM 2216 OE1 GLN 309 -11.704 -14.917 -11.908 1.00 0.00 O +ATOM 2217 NE2 GLN 309 -11.196 -16.252 -13.647 1.00 0.00 N +ATOM 2218 HE21 GLN 309 -10.241 -15.906 -13.714 1.00 0.00 H +ATOM 2219 HE22 GLN 309 -11.525 -16.973 -14.288 1.00 0.00 H +ATOM 2220 C GLN 309 -13.304 -18.048 -9.253 1.00 0.00 C +ATOM 2221 O GLN 309 -13.660 -17.099 -8.564 1.00 0.00 O +ATOM 2222 N ARG 310 -13.260 -19.298 -8.798 1.00 0.00 N +ATOM 2223 H ARG 310 -12.992 -20.009 -9.518 1.00 0.00 H +ATOM 2224 CA ARG 310 -13.561 -19.655 -7.407 1.00 0.00 C +ATOM 2225 HA ARG 310 -13.294 -20.640 -7.265 1.00 0.00 H +ATOM 2226 CB ARG 310 -12.605 -18.913 -6.455 1.00 0.00 C +ATOM 2227 HB2 ARG 310 -12.560 -17.965 -6.736 1.00 0.00 H +ATOM 2228 HB3 ARG 310 -12.956 -18.996 -5.534 1.00 0.00 H +ATOM 2229 CG ARG 310 -11.176 -19.478 -6.468 1.00 0.00 C +ATOM 2230 HG2 ARG 310 -11.160 -20.344 -5.969 1.00 0.00 H +ATOM 2231 HG3 ARG 310 -10.892 -19.632 -7.414 1.00 0.00 H +ATOM 2232 CD ARG 310 -10.153 -18.538 -5.816 1.00 0.00 C +ATOM 2233 HD2 ARG 310 -9.293 -19.041 -5.725 1.00 0.00 H +ATOM 2234 HD3 ARG 310 -10.021 -17.760 -6.432 1.00 0.00 H +ATOM 2235 NE ARG 310 -10.570 -18.050 -4.501 1.00 0.00 N +ATOM 2236 HE ARG 310 -10.736 -17.054 -4.406 1.00 0.00 H +ATOM 2237 CZ ARG 310 -10.749 -18.806 -3.424 1.00 0.00 C +ATOM 2238 NH1 ARG 310 -10.551 -20.116 -3.478 1.00 0.00 N +ATOM 2239 HH11 ARG 310 -10.245 -20.553 -4.321 1.00 0.00 H +ATOM 2240 HH12 ARG 310 -10.709 -20.678 -2.659 1.00 0.00 H +ATOM 2241 NH2 ARG 310 -11.135 -18.238 -2.288 1.00 0.00 N +ATOM 2242 HH21 ARG 310 -11.270 -17.247 -2.242 1.00 0.00 H +ATOM 2243 HH22 ARG 310 -11.291 -18.800 -1.475 1.00 0.00 H +ATOM 2244 C ARG 310 -15.009 -19.484 -6.950 1.00 0.00 C +ATOM 2245 O ARG 310 -15.268 -19.281 -5.769 1.00 0.00 O +ATOM 2246 N GLY 311 -15.940 -19.577 -7.895 1.00 0.00 N +ATOM 2247 H GLY 311 -15.578 -19.721 -8.854 1.00 0.00 H +ATOM 2248 CA GLY 311 -17.353 -19.479 -7.568 1.00 0.00 C +ATOM 2249 HA2 GLY 311 -17.898 -19.492 -8.441 1.00 0.00 H +ATOM 2250 HA3 GLY 311 -17.638 -20.331 -7.066 1.00 0.00 H +ATOM 2251 C GLY 311 -17.759 -18.269 -6.753 1.00 0.00 C +ATOM 2252 O GLY 311 -17.192 -17.194 -6.911 1.00 0.00 O +ATOM 2253 N TRP 312 -18.734 -18.445 -5.866 1.00 0.00 N +ATOM 2254 H TRP 312 -19.110 -19.405 -5.810 1.00 0.00 H +ATOM 2255 CA TRP 312 -19.204 -17.337 -5.056 1.00 0.00 C +ATOM 2256 HA TRP 312 -19.419 -16.563 -5.681 1.00 0.00 H +ATOM 2257 CB TRP 312 -20.528 -17.714 -4.385 1.00 0.00 C +ATOM 2258 HB2 TRP 312 -20.415 -18.561 -3.904 1.00 0.00 H +ATOM 2259 HB3 TRP 312 -20.812 -16.981 -3.798 1.00 0.00 H +ATOM 2260 CG TRP 312 -21.611 -17.918 -5.408 1.00 0.00 C +ATOM 2261 CD1 TRP 312 -22.114 -19.110 -5.855 1.00 0.00 C +ATOM 2262 HD1 TRP 312 -21.844 -20.009 -5.517 1.00 0.00 H +ATOM 2263 NE1 TRP 312 -23.050 -18.891 -6.843 1.00 0.00 N +ATOM 2264 HE1 TRP 312 -23.559 -19.598 -7.327 1.00 0.00 H +ATOM 2265 CE2 TRP 312 -23.165 -17.541 -7.050 1.00 0.00 C +ATOM 2266 CZ2 TRP 312 -23.979 -16.829 -7.943 1.00 0.00 C +ATOM 2267 HZ2 TRP 312 -24.602 -17.321 -8.557 1.00 0.00 H +ATOM 2268 CH2 TRP 312 -23.884 -15.462 -7.937 1.00 0.00 C +ATOM 2269 HH2 TRP 312 -24.446 -14.917 -8.558 1.00 0.00 H +ATOM 2270 CZ3 TRP 312 -23.001 -14.790 -7.064 1.00 0.00 C +ATOM 2271 HZ3 TRP 312 -22.953 -13.799 -7.082 1.00 0.00 H +ATOM 2272 CE3 TRP 312 -22.194 -15.496 -6.178 1.00 0.00 C +ATOM 2273 HE3 TRP 312 -21.575 -15.010 -5.568 1.00 0.00 H +ATOM 2274 CD2 TRP 312 -22.273 -16.895 -6.162 1.00 0.00 C +ATOM 2275 C TRP 312 -18.173 -16.830 -4.049 1.00 0.00 C +ATOM 2276 O TRP 312 -18.248 -15.684 -3.600 1.00 0.00 O +ATOM 2277 N ASP 313 -17.200 -17.662 -3.693 1.00 0.00 N +ATOM 2278 H ASP 313 -17.237 -18.598 -4.090 1.00 0.00 H +ATOM 2279 CA ASP 313 -16.167 -17.185 -2.776 1.00 0.00 C +ATOM 2280 HA ASP 313 -16.623 -16.709 -2.041 1.00 0.00 H +ATOM 2281 CB ASP 313 -15.235 -18.307 -2.338 1.00 0.00 C +ATOM 2282 HB2 ASP 313 -14.914 -18.779 -3.151 1.00 0.00 H +ATOM 2283 HB3 ASP 313 -14.473 -17.903 -1.846 1.00 0.00 H +ATOM 2284 CG ASP 313 -15.921 -19.311 -1.433 1.00 0.00 C +ATOM 2285 OD1 ASP 313 -16.655 -18.880 -0.517 1.00 0.00 O +ATOM 2286 OD2 ASP 313 -15.721 -20.525 -1.634 1.00 0.00 O +ATOM 2287 C ASP 313 -15.376 -16.151 -3.561 1.00 0.00 C +ATOM 2288 O ASP 313 -14.967 -15.123 -3.014 1.00 0.00 O +ATOM 2289 N GLY 314 -15.181 -16.427 -4.850 1.00 0.00 N +ATOM 2290 H GLY 314 -15.578 -17.322 -5.173 1.00 0.00 H +ATOM 2291 CA GLY 314 -14.453 -15.501 -5.703 1.00 0.00 C +ATOM 2292 HA2 GLY 314 -13.563 -15.285 -5.285 1.00 0.00 H +ATOM 2293 HA3 GLY 314 -14.285 -15.929 -6.599 1.00 0.00 H +ATOM 2294 C GLY 314 -15.239 -14.212 -5.902 1.00 0.00 C +ATOM 2295 O GLY 314 -14.670 -13.125 -5.933 1.00 0.00 O +ATOM 2296 N PHE 315 -16.550 -14.349 -6.055 1.00 0.00 N +ATOM 2297 H PHE 315 -16.884 -15.342 -6.033 1.00 0.00 H +ATOM 2298 CA PHE 315 -17.450 -13.216 -6.238 1.00 0.00 C +ATOM 2299 HA PHE 315 -17.134 -12.716 -7.046 1.00 0.00 H +ATOM 2300 CB PHE 315 -18.892 -13.727 -6.340 1.00 0.00 C +ATOM 2301 HB2 PHE 315 -18.956 -14.288 -7.155 1.00 0.00 H +ATOM 2302 HB3 PHE 315 -19.080 -14.264 -5.527 1.00 0.00 H +ATOM 2303 CG PHE 315 -19.936 -12.648 -6.435 1.00 0.00 C +ATOM 2304 CD1 PHE 315 -20.142 -11.951 -7.624 1.00 0.00 C +ATOM 2305 HD1 PHE 315 -19.563 -12.131 -8.412 1.00 0.00 H +ATOM 2306 CE1 PHE 315 -21.157 -10.998 -7.728 1.00 0.00 C +ATOM 2307 HE1 PHE 315 -21.297 -10.515 -8.595 1.00 0.00 H +ATOM 2308 CZ PHE 315 -21.963 -10.728 -6.626 1.00 0.00 C +ATOM 2309 HZ PHE 315 -22.686 -10.044 -6.694 1.00 0.00 H +ATOM 2310 CE2 PHE 315 -21.756 -11.415 -5.433 1.00 0.00 C +ATOM 2311 HE2 PHE 315 -22.341 -11.225 -4.628 1.00 0.00 H +ATOM 2312 CD2 PHE 315 -20.746 -12.361 -5.342 1.00 0.00 C +ATOM 2313 HD2 PHE 315 -20.598 -12.845 -4.478 1.00 0.00 H +ATOM 2314 C PHE 315 -17.323 -12.260 -5.052 1.00 0.00 C +ATOM 2315 O PHE 315 -17.168 -11.053 -5.223 1.00 0.00 O +ATOM 2316 N VAL 316 -17.398 -12.819 -3.850 1.00 0.00 N +ATOM 2317 H VAL 316 -17.527 -13.853 -3.859 1.00 0.00 H +ATOM 2318 CA VAL 316 -17.305 -12.036 -2.627 1.00 0.00 C +ATOM 2319 HA VAL 316 -18.019 -11.319 -2.655 1.00 0.00 H +ATOM 2320 CB VAL 316 -17.572 -12.943 -1.391 1.00 0.00 C +ATOM 2321 HB VAL 316 -16.970 -13.732 -1.470 1.00 0.00 H +ATOM 2322 CG1 VAL 316 -17.214 -12.225 -0.108 1.00 0.00 C +ATOM 2323 HG11 VAL 316 -16.431 -12.675 0.324 1.00 0.00 H +ATOM 2324 HG12 VAL 316 -16.978 -11.273 -0.308 1.00 0.00 H +ATOM 2325 HG13 VAL 316 -17.993 -12.246 0.520 1.00 0.00 H +ATOM 2326 CG2 VAL 316 -19.034 -13.352 -1.366 1.00 0.00 C +ATOM 2327 HG21 VAL 316 -19.224 -13.853 -0.521 1.00 0.00 H +ATOM 2328 HG22 VAL 316 -19.608 -12.534 -1.407 1.00 0.00 H +ATOM 2329 HG23 VAL 316 -19.228 -13.938 -2.153 1.00 0.00 H +ATOM 2330 C VAL 316 -15.951 -11.338 -2.486 1.00 0.00 C +ATOM 2331 O VAL 316 -15.879 -10.180 -2.059 1.00 0.00 O +ATOM 2332 N GLU 317 -14.883 -12.042 -2.854 1.00 0.00 N +ATOM 2333 H GLU 317 -15.092 -13.000 -3.199 1.00 0.00 H +ATOM 2334 CA GLU 317 -13.536 -11.493 -2.772 1.00 0.00 C +ATOM 2335 HA GLU 317 -13.370 -11.138 -1.844 1.00 0.00 H +ATOM 2336 CB GLU 317 -12.481 -12.571 -3.051 1.00 0.00 C +ATOM 2337 HB2 GLU 317 -12.613 -12.880 -3.983 1.00 0.00 H +ATOM 2338 HB3 GLU 317 -11.592 -12.152 -2.938 1.00 0.00 H +ATOM 2339 CG GLU 317 -12.538 -13.785 -2.149 1.00 0.00 C +ATOM 2340 HG2 GLU 317 -12.380 -13.497 -1.226 1.00 0.00 H +ATOM 2341 HG3 GLU 317 -13.405 -14.225 -2.268 1.00 0.00 H +ATOM 2342 CD GLU 317 -11.460 -14.806 -2.497 1.00 0.00 C +ATOM 2343 OE1 GLU 317 -11.286 -15.099 -3.704 1.00 0.00 O +ATOM 2344 OE2 GLU 317 -10.791 -15.314 -1.570 1.00 0.00 O +ATOM 2345 C GLU 317 -13.347 -10.373 -3.785 1.00 0.00 C +ATOM 2346 O GLU 317 -12.708 -9.370 -3.488 1.00 0.00 O +ATOM 2347 N PHE 318 -13.903 -10.554 -4.982 1.00 0.00 N +ATOM 2348 H PHE 318 -14.429 -11.445 -5.085 1.00 0.00 H +ATOM 2349 CA PHE 318 -13.772 -9.570 -6.046 1.00 0.00 C +ATOM 2350 HA PHE 318 -12.782 -9.417 -6.185 1.00 0.00 H +ATOM 2351 CB PHE 318 -14.452 -10.090 -7.317 1.00 0.00 C +ATOM 2352 HB2 PHE 318 -14.103 -10.997 -7.496 1.00 0.00 H +ATOM 2353 HB3 PHE 318 -15.427 -10.104 -7.153 1.00 0.00 H +ATOM 2354 CG PHE 318 -14.196 -9.244 -8.532 1.00 0.00 C +ATOM 2355 CD1 PHE 318 -12.948 -9.247 -9.151 1.00 0.00 C +ATOM 2356 HD1 PHE 318 -12.214 -9.809 -8.785 1.00 0.00 H +ATOM 2357 CE1 PHE 318 -12.711 -8.470 -10.285 1.00 0.00 C +ATOM 2358 HE1 PHE 318 -11.806 -8.485 -10.717 1.00 0.00 H +ATOM 2359 CZ PHE 318 -13.733 -7.679 -10.806 1.00 0.00 C +ATOM 2360 HZ PHE 318 -13.569 -7.123 -11.616 1.00 0.00 H +ATOM 2361 CE2 PHE 318 -14.986 -7.671 -10.188 1.00 0.00 C +ATOM 2362 HE2 PHE 318 -15.731 -7.098 -10.559 1.00 0.00 H +ATOM 2363 CD2 PHE 318 -15.206 -8.450 -9.061 1.00 0.00 C +ATOM 2364 HD2 PHE 318 -16.107 -8.441 -8.622 1.00 0.00 H +ATOM 2365 C PHE 318 -14.374 -8.229 -5.662 1.00 0.00 C +ATOM 2366 O PHE 318 -13.821 -7.177 -5.980 1.00 0.00 O +ATOM 2367 N PHE 319 -15.495 -8.275 -4.950 1.00 0.00 N +ATOM 2368 H PHE 319 -15.820 -9.231 -4.708 1.00 0.00 H +ATOM 2369 CA PHE 319 -16.196 -7.061 -4.551 1.00 0.00 C +ATOM 2370 HA PHE 319 -15.856 -6.310 -5.159 1.00 0.00 H +ATOM 2371 CB PHE 319 -17.685 -7.247 -4.792 1.00 0.00 C +ATOM 2372 HB2 PHE 319 -17.942 -8.144 -4.459 1.00 0.00 H +ATOM 2373 HB3 PHE 319 -18.168 -6.534 -4.303 1.00 0.00 H +ATOM 2374 CG PHE 319 -18.090 -7.163 -6.243 1.00 0.00 C +ATOM 2375 CD1 PHE 319 -18.040 -5.950 -6.913 1.00 0.00 C +ATOM 2376 HD1 PHE 319 -17.728 -5.131 -6.441 1.00 0.00 H +ATOM 2377 CE1 PHE 319 -18.422 -5.856 -8.254 1.00 0.00 C +ATOM 2378 HE1 PHE 319 -18.436 -4.956 -8.701 1.00 0.00 H +ATOM 2379 CZ PHE 319 -18.780 -7.001 -8.956 1.00 0.00 C +ATOM 2380 HZ PHE 319 -19.001 -6.942 -9.925 1.00 0.00 H +ATOM 2381 CE2 PHE 319 -18.824 -8.218 -8.294 1.00 0.00 C +ATOM 2382 HE2 PHE 319 -19.135 -9.053 -8.780 1.00 0.00 H +ATOM 2383 CD2 PHE 319 -18.445 -8.302 -6.964 1.00 0.00 C +ATOM 2384 HD2 PHE 319 -18.424 -9.195 -6.510 1.00 0.00 H +ATOM 2385 C PHE 319 -15.959 -6.591 -3.113 1.00 0.00 C +ATOM 2386 O PHE 319 -16.508 -5.563 -2.702 1.00 0.00 O +ATOM 2387 N HIE 320 -15.142 -7.327 -2.360 1.00 0.00 N +ATOM 2388 H HIE 320 -14.746 -8.163 -2.844 1.00 0.00 H +ATOM 2389 CA HIE 320 -14.827 -6.989 -0.970 1.00 0.00 C +ATOM 2390 HA HIE 320 -15.658 -7.155 -0.409 1.00 0.00 H +ATOM 2391 CB HIE 320 -13.721 -7.908 -0.459 1.00 0.00 C +ATOM 2392 HB2 HIE 320 -14.045 -8.860 -0.483 1.00 0.00 H +ATOM 2393 HB3 HIE 320 -12.921 -7.827 -1.063 1.00 0.00 H +ATOM 2394 CG HIE 320 -13.281 -7.599 0.943 1.00 0.00 C +ATOM 2395 ND1 HIE 320 -12.082 -7.001 1.233 1.00 0.00 N +ATOM 2396 CE1 HIE 320 -11.992 -6.810 2.544 1.00 0.00 C +ATOM 2397 HE1 HIE 320 -11.224 -6.395 3.018 1.00 0.00 H +ATOM 2398 NE2 HIE 320 -13.094 -7.268 3.099 1.00 0.00 N +ATOM 2399 HE2 HIE 320 -13.305 -7.253 4.087 1.00 0.00 H +ATOM 2400 CD2 HIE 320 -13.922 -7.773 2.122 1.00 0.00 C +ATOM 2401 HD2 HIE 320 -14.814 -8.185 2.260 1.00 0.00 H +ATOM 2402 C HIE 320 -14.408 -5.537 -0.782 1.00 0.00 C +ATOM 2403 O HIE 320 -13.615 -5.004 -1.559 1.00 0.00 O +ATOM 2404 N VAL 321 -14.952 -4.910 0.258 1.00 0.00 N +ATOM 2405 H VAL 321 -15.604 -5.489 0.824 1.00 0.00 H +ATOM 2406 CA VAL 321 -14.645 -3.513 0.566 1.00 0.00 C +ATOM 2407 HA VAL 321 -14.327 -3.069 -0.278 1.00 0.00 H +ATOM 2408 CB VAL 321 -15.896 -2.762 1.098 1.00 0.00 C +ATOM 2409 HB VAL 321 -15.663 -1.800 1.156 1.00 0.00 H +ATOM 2410 CG1 VAL 321 -17.041 -2.889 0.101 1.00 0.00 C +ATOM 2411 HG11 VAL 321 -16.676 -2.876 -0.829 1.00 0.00 H +ATOM 2412 HG12 VAL 321 -17.525 -3.750 0.257 1.00 0.00 H +ATOM 2413 HG13 VAL 321 -17.674 -2.125 0.221 1.00 0.00 H +ATOM 2414 CG2 VAL 321 -16.310 -3.320 2.445 1.00 0.00 C +ATOM 2415 HG21 VAL 321 -16.918 -4.103 2.309 1.00 0.00 H +ATOM 2416 HG22 VAL 321 -15.496 -3.613 2.949 1.00 0.00 H +ATOM 2417 HG23 VAL 321 -16.789 -2.612 2.966 1.00 0.00 H +ATOM 2418 C VAL 321 -13.520 -3.423 1.597 1.00 0.00 C +ATOM 2419 O VAL 321 -12.468 -2.832 1.254 1.00 0.00 O +ATOM 2420 OXT VAL 321 -13.431 -3.824 2.731 1.00 0.00 O +END diff --git a/receptor/conf.txt b/receptor/conf.txt index d949848..7817cb3 100644 --- a/receptor/conf.txt +++ b/receptor/conf.txt @@ -1,10 +1,10 @@ -center_x = 7.3 -center_y = 17.7 -center_z = 1.5 +center_x = -29.32 +center_y = -7.88 +center_z = -19.98 size_x = 15 -size_y = 17 -size_z = 17 +size_y = 15 +size_z = 15 energy_range = 4 exhaustiveness = 20 diff --git a/receptor/eg5_adp_mg_00000.pdb b/receptor/eg5_adp_mg_00000.pdb deleted file mode 100644 index 20e1822..0000000 --- a/receptor/eg5_adp_mg_00000.pdb +++ /dev/null @@ -1,5595 +0,0 @@ -HELIX 1 1 LEU 15 LYS 19 1 5 -HELIX 2 2 GLN 63 VAL 70 1 8 -HELIX 3 3 CYS 72 ILE 79 1 8 -HELIX 4 4 LYS 96 MET 100 1 5 -HELIX 5 5 ILE 121 ASN 135 1 15 -HELIX 6 6 LYS 192 LEU 212 1 21 -HELIX 7 7 ASN 214 SER 217 1 4 -HELIX 8 8 ASN 256 ARG 259 1 4 -HELIX 9 9 ASP 264 VAL 288 1 25 -HELIX 10 10 LYS 300 ILE 304 1 5 -HELIX 11 11 LEU 328 ASN 343 1 16 -SHEET 1 1 1 GLN 5 CYS 10 0 -SHEET 2 2 1 VAL 26 ASP 29 0 -SHEET 3 3 1 GLU 34 VAL 37 0 -SHEET 4 4 1 LYS 49 THR 52 0 -SHEET 5 5 1 MET 55 PHE 57 0 -SHEET 6 6 1 ASN 83 GLY 90 0 -SHEET 7 7 1 PHE 139 TYR 149 0 -SHEET 8 8 1 GLU 152 PHE 154 0 -SHEET 9 9 1 MET 169 ASP 171 0 -SHEET 10 10 1 VAL 179 ILE 181 0 -SHEET 11 11 1 ILE 187 VAL 189 0 -SHEET 12 12 1 HIE 221 GLU 232 0 -SHEET 13 13 1 LEU 240 ASP 250 0 -SHEET 14 14 1 ARG 314 ILE 321 0 -CRYST1 88.626 88.626 88.626 109.47 109.47 109.47 1 -ATOM 1 N GLY 1 0.977 -21.125 -3.548 1.00 0.00 N -ATOM 2 H1 GLY 1 0.646 -21.861 -4.156 1.00 0.00 H -ATOM 3 H2 GLY 1 1.491 -21.579 -2.806 1.00 0.00 H -ATOM 4 H3 GLY 1 1.696 -20.600 -4.024 1.00 0.00 H -ATOM 5 CA GLY 1 -0.145 -20.276 -3.147 1.00 0.00 C -ATOM 6 HA2 GLY 1 -0.907 -20.799 -2.569 1.00 0.00 H -ATOM 7 HA3 GLY 1 0.275 -19.465 -2.552 1.00 0.00 H -ATOM 8 C GLY 1 -0.782 -19.713 -4.402 1.00 0.00 C -ATOM 9 O GLY 1 -0.602 -20.197 -5.520 1.00 0.00 O -ATOM 10 N LYS 2 -1.394 -18.537 -4.281 1.00 0.00 N -ATOM 11 H LYS 2 -1.430 -18.067 -3.388 1.00 0.00 H -ATOM 12 CA LYS 2 -2.020 -17.741 -5.359 1.00 0.00 C -ATOM 13 HA LYS 2 -2.282 -18.418 -6.171 1.00 0.00 H -ATOM 14 CB LYS 2 -3.341 -17.119 -4.853 1.00 0.00 C -ATOM 15 HB2 LYS 2 -3.928 -17.988 -4.557 1.00 0.00 H -ATOM 16 HB3 LYS 2 -3.105 -16.583 -3.933 1.00 0.00 H -ATOM 17 CG LYS 2 -4.321 -16.267 -5.825 1.00 0.00 C -ATOM 18 HG2 LYS 2 -4.181 -15.186 -5.841 1.00 0.00 H -ATOM 19 HG3 LYS 2 -4.031 -16.533 -6.842 1.00 0.00 H -ATOM 20 CD LYS 2 -5.827 -16.512 -5.624 1.00 0.00 C -ATOM 21 HD2 LYS 2 -6.074 -17.574 -5.647 1.00 0.00 H -ATOM 22 HD3 LYS 2 -5.962 -16.245 -4.575 1.00 0.00 H -ATOM 23 CE LYS 2 -6.860 -15.762 -6.511 1.00 0.00 C -ATOM 24 HE2 LYS 2 -7.839 -16.153 -6.233 1.00 0.00 H -ATOM 25 HE3 LYS 2 -6.797 -14.701 -6.268 1.00 0.00 H -ATOM 26 NZ LYS 2 -6.436 -15.901 -7.909 1.00 0.00 N -ATOM 27 HZ1 LYS 2 -6.389 -16.860 -8.223 1.00 0.00 H -ATOM 28 HZ2 LYS 2 -6.994 -15.378 -8.569 1.00 0.00 H -ATOM 29 HZ3 LYS 2 -5.491 -15.561 -8.026 1.00 0.00 H -ATOM 30 C LYS 2 -1.108 -16.698 -6.086 1.00 0.00 C -ATOM 31 O LYS 2 -0.138 -16.155 -5.446 1.00 0.00 O -ATOM 32 N ASN 3 -1.257 -16.593 -7.409 1.00 0.00 N -ATOM 33 H ASN 3 -1.780 -17.332 -7.856 1.00 0.00 H -ATOM 34 CA ASN 3 -0.566 -15.537 -8.159 1.00 0.00 C -ATOM 35 HA ASN 3 0.509 -15.703 -8.091 1.00 0.00 H -ATOM 36 CB ASN 3 -1.048 -15.627 -9.659 1.00 0.00 C -ATOM 37 HB2 ASN 3 -1.281 -16.665 -9.898 1.00 0.00 H -ATOM 38 HB3 ASN 3 -2.022 -15.143 -9.729 1.00 0.00 H -ATOM 39 CG ASN 3 -0.107 -15.019 -10.614 1.00 0.00 C -ATOM 40 OD1 ASN 3 0.694 -15.792 -11.200 1.00 0.00 O -ATOM 41 ND2 ASN 3 0.078 -13.724 -10.682 1.00 0.00 N -ATOM 42 HD21 ASN 3 0.912 -13.399 -11.150 1.00 0.00 H -ATOM 43 HD22 ASN 3 -0.507 -13.009 -10.273 1.00 0.00 H -ATOM 44 C ASN 3 -0.815 -14.151 -7.518 1.00 0.00 C -ATOM 45 O ASN 3 -1.969 -13.962 -7.135 1.00 0.00 O -ATOM 46 N ILE 4 0.174 -13.294 -7.545 1.00 0.00 N -ATOM 47 H ILE 4 1.045 -13.583 -7.966 1.00 0.00 H -ATOM 48 CA ILE 4 -0.037 -11.964 -7.008 1.00 0.00 C -ATOM 49 HA ILE 4 -0.495 -12.099 -6.028 1.00 0.00 H -ATOM 50 CB ILE 4 1.304 -11.259 -6.737 1.00 0.00 C -ATOM 51 HB ILE 4 1.964 -11.428 -7.588 1.00 0.00 H -ATOM 52 CG2 ILE 4 1.137 -9.708 -6.578 1.00 0.00 C -ATOM 53 HG21 ILE 4 2.015 -9.147 -6.259 1.00 0.00 H -ATOM 54 HG22 ILE 4 0.810 -9.277 -7.525 1.00 0.00 H -ATOM 55 HG23 ILE 4 0.329 -9.520 -5.871 1.00 0.00 H -ATOM 56 CG1 ILE 4 1.946 -11.806 -5.465 1.00 0.00 C -ATOM 57 HG12 ILE 4 1.295 -11.538 -4.633 1.00 0.00 H -ATOM 58 HG13 ILE 4 1.876 -12.894 -5.458 1.00 0.00 H -ATOM 59 CD1 ILE 4 3.328 -11.312 -5.018 1.00 0.00 C -ATOM 60 HD11 ILE 4 4.029 -11.534 -5.823 1.00 0.00 H -ATOM 61 HD12 ILE 4 3.223 -10.248 -4.811 1.00 0.00 H -ATOM 62 HD13 ILE 4 3.653 -11.920 -4.173 1.00 0.00 H -ATOM 63 C ILE 4 -0.922 -11.254 -8.003 1.00 0.00 C -ATOM 64 O ILE 4 -0.736 -11.157 -9.219 1.00 0.00 O -ATOM 65 N GLN 5 -1.963 -10.668 -7.444 1.00 0.00 N -ATOM 66 H GLN 5 -2.087 -10.743 -6.444 1.00 0.00 H -ATOM 67 CA GLN 5 -2.843 -9.772 -8.232 1.00 0.00 C -ATOM 68 HA GLN 5 -3.174 -10.286 -9.134 1.00 0.00 H -ATOM 69 CB GLN 5 -4.200 -9.592 -7.476 1.00 0.00 C -ATOM 70 HB2 GLN 5 -4.640 -10.589 -7.465 1.00 0.00 H -ATOM 71 HB3 GLN 5 -4.026 -9.262 -6.451 1.00 0.00 H -ATOM 72 CG GLN 5 -5.281 -8.670 -8.151 1.00 0.00 C -ATOM 73 HG2 GLN 5 -4.795 -7.695 -8.117 1.00 0.00 H -ATOM 74 HG3 GLN 5 -5.309 -8.944 -9.205 1.00 0.00 H -ATOM 75 CD GLN 5 -6.664 -8.827 -7.523 1.00 0.00 C -ATOM 76 OE1 GLN 5 -6.741 -9.131 -6.333 1.00 0.00 O -ATOM 77 NE2 GLN 5 -7.790 -8.598 -8.133 1.00 0.00 N -ATOM 78 HE21 GLN 5 -8.620 -8.580 -7.559 1.00 0.00 H -ATOM 79 HE22 GLN 5 -7.840 -8.333 -9.106 1.00 0.00 H -ATOM 80 C GLN 5 -2.148 -8.477 -8.670 1.00 0.00 C -ATOM 81 O GLN 5 -1.703 -7.714 -7.818 1.00 0.00 O -ATOM 82 N VAL 6 -2.205 -8.026 -9.941 1.00 0.00 N -ATOM 83 H VAL 6 -2.699 -8.559 -10.643 1.00 0.00 H -ATOM 84 CA VAL 6 -1.643 -6.673 -10.326 1.00 0.00 C -ATOM 85 HA VAL 6 -1.377 -6.125 -9.422 1.00 0.00 H -ATOM 86 CB VAL 6 -0.295 -6.728 -11.121 1.00 0.00 C -ATOM 87 HB VAL 6 -0.378 -7.152 -12.121 1.00 0.00 H -ATOM 88 CG1 VAL 6 0.299 -5.268 -11.208 1.00 0.00 C -ATOM 89 HG11 VAL 6 0.650 -4.867 -10.257 1.00 0.00 H -ATOM 90 HG12 VAL 6 1.187 -5.182 -11.833 1.00 0.00 H -ATOM 91 HG13 VAL 6 -0.479 -4.574 -11.527 1.00 0.00 H -ATOM 92 CG2 VAL 6 0.690 -7.557 -10.337 1.00 0.00 C -ATOM 93 HG21 VAL 6 1.690 -7.423 -10.750 1.00 0.00 H -ATOM 94 HG22 VAL 6 0.652 -7.169 -9.318 1.00 0.00 H -ATOM 95 HG23 VAL 6 0.402 -8.603 -10.436 1.00 0.00 H -ATOM 96 C VAL 6 -2.753 -5.839 -11.002 1.00 0.00 C -ATOM 97 O VAL 6 -3.316 -6.232 -12.047 1.00 0.00 O -ATOM 98 N VAL 7 -3.131 -4.617 -10.532 1.00 0.00 N -ATOM 99 H VAL 7 -2.825 -4.262 -9.637 1.00 0.00 H -ATOM 100 CA VAL 7 -4.305 -3.815 -10.993 1.00 0.00 C -ATOM 101 HA VAL 7 -4.627 -4.234 -11.947 1.00 0.00 H -ATOM 102 CB VAL 7 -5.466 -4.013 -10.000 1.00 0.00 C -ATOM 103 HB VAL 7 -6.380 -3.696 -10.502 1.00 0.00 H -ATOM 104 CG1 VAL 7 -5.706 -5.493 -9.652 1.00 0.00 C -ATOM 105 HG11 VAL 7 -4.788 -5.799 -9.150 1.00 0.00 H -ATOM 106 HG12 VAL 7 -6.475 -5.585 -8.885 1.00 0.00 H -ATOM 107 HG13 VAL 7 -5.968 -6.091 -10.525 1.00 0.00 H -ATOM 108 CG2 VAL 7 -5.423 -3.218 -8.692 1.00 0.00 C -ATOM 109 HG21 VAL 7 -6.265 -3.467 -8.045 1.00 0.00 H -ATOM 110 HG22 VAL 7 -4.490 -3.463 -8.185 1.00 0.00 H -ATOM 111 HG23 VAL 7 -5.455 -2.145 -8.880 1.00 0.00 H -ATOM 112 C VAL 7 -3.955 -2.349 -11.141 1.00 0.00 C -ATOM 113 O VAL 7 -3.045 -1.775 -10.577 1.00 0.00 O -ATOM 114 N VAL 8 -4.722 -1.672 -12.065 1.00 0.00 N -ATOM 115 H VAL 8 -5.656 -1.959 -12.319 1.00 0.00 H -ATOM 116 CA VAL 8 -4.386 -0.331 -12.475 1.00 0.00 C -ATOM 117 HA VAL 8 -3.411 -0.173 -12.013 1.00 0.00 H -ATOM 118 CB VAL 8 -4.065 -0.291 -13.970 1.00 0.00 C -ATOM 119 HB VAL 8 -4.920 -0.413 -14.634 1.00 0.00 H -ATOM 120 CG1 VAL 8 -3.408 1.076 -14.252 1.00 0.00 C -ATOM 121 HG11 VAL 8 -3.146 1.116 -15.310 1.00 0.00 H -ATOM 122 HG12 VAL 8 -4.145 1.878 -14.292 1.00 0.00 H -ATOM 123 HG13 VAL 8 -2.535 1.242 -13.621 1.00 0.00 H -ATOM 124 CG2 VAL 8 -2.948 -1.286 -14.354 1.00 0.00 C -ATOM 125 HG21 VAL 8 -2.063 -1.240 -13.719 1.00 0.00 H -ATOM 126 HG22 VAL 8 -3.403 -2.272 -14.259 1.00 0.00 H -ATOM 127 HG23 VAL 8 -2.613 -1.109 -15.376 1.00 0.00 H -ATOM 128 C VAL 8 -5.412 0.644 -11.973 1.00 0.00 C -ATOM 129 O VAL 8 -6.587 0.263 -12.071 1.00 0.00 O -ATOM 130 N ARG 9 -5.010 1.844 -11.645 1.00 0.00 N -ATOM 131 H ARG 9 -4.008 1.889 -11.532 1.00 0.00 H -ATOM 132 CA ARG 9 -5.947 2.993 -11.458 1.00 0.00 C -ATOM 133 HA ARG 9 -6.872 2.829 -12.011 1.00 0.00 H -ATOM 134 CB ARG 9 -6.322 3.196 -10.012 1.00 0.00 C -ATOM 135 HB2 ARG 9 -6.703 2.239 -9.657 1.00 0.00 H -ATOM 136 HB3 ARG 9 -5.393 3.358 -9.465 1.00 0.00 H -ATOM 137 CG ARG 9 -7.267 4.330 -9.701 1.00 0.00 C -ATOM 138 HG2 ARG 9 -6.871 5.288 -10.040 1.00 0.00 H -ATOM 139 HG3 ARG 9 -8.196 4.151 -10.243 1.00 0.00 H -ATOM 140 CD ARG 9 -7.631 4.556 -8.196 1.00 0.00 C -ATOM 141 HD2 ARG 9 -7.961 3.599 -7.793 1.00 0.00 H -ATOM 142 HD3 ARG 9 -6.675 4.841 -7.756 1.00 0.00 H -ATOM 143 NE ARG 9 -8.760 5.488 -7.968 1.00 0.00 N -ATOM 144 HE ARG 9 -8.936 6.188 -8.675 1.00 0.00 H -ATOM 145 CZ ARG 9 -9.362 5.657 -6.826 1.00 0.00 C -ATOM 146 NH1 ARG 9 -8.965 5.067 -5.738 1.00 0.00 N -ATOM 147 HH11 ARG 9 -8.143 4.481 -5.704 1.00 0.00 H -ATOM 148 HH12 ARG 9 -9.414 5.234 -4.849 1.00 0.00 H -ATOM 149 NH2 ARG 9 -10.360 6.422 -6.716 1.00 0.00 N -ATOM 150 HH21 ARG 9 -10.813 6.849 -7.512 1.00 0.00 H -ATOM 151 HH22 ARG 9 -10.762 6.592 -5.806 1.00 0.00 H -ATOM 152 C ARG 9 -5.241 4.212 -12.050 1.00 0.00 C -ATOM 153 O ARG 9 -4.103 4.631 -11.679 1.00 0.00 O -ATOM 154 N CYS 10 -6.016 4.846 -12.921 1.00 0.00 N -ATOM 155 H CYS 10 -6.773 4.273 -13.266 1.00 0.00 H -ATOM 156 CA CYS 10 -5.892 6.217 -13.563 1.00 0.00 C -ATOM 157 HA CYS 10 -4.882 6.628 -13.552 1.00 0.00 H -ATOM 158 CB CYS 10 -6.218 6.027 -15.068 1.00 0.00 C -ATOM 159 HB2 CYS 10 -5.546 5.350 -15.594 1.00 0.00 H -ATOM 160 HB3 CYS 10 -7.221 5.616 -15.185 1.00 0.00 H -ATOM 161 SG CYS 10 -6.164 7.507 -16.018 1.00 0.00 S -ATOM 162 HG CYS 10 -6.150 6.819 -17.164 1.00 0.00 H -ATOM 163 C CYS 10 -6.827 7.163 -12.799 1.00 0.00 C -ATOM 164 O CYS 10 -7.820 6.756 -12.241 1.00 0.00 O -ATOM 165 N ARG 11 -6.356 8.445 -12.676 1.00 0.00 N -ATOM 166 H ARG 11 -5.470 8.668 -13.108 1.00 0.00 H -ATOM 167 CA ARG 11 -6.969 9.613 -11.898 1.00 0.00 C -ATOM 168 HA ARG 11 -7.796 9.104 -11.402 1.00 0.00 H -ATOM 169 CB ARG 11 -6.092 9.984 -10.753 1.00 0.00 C -ATOM 170 HB2 ARG 11 -6.611 10.647 -10.061 1.00 0.00 H -ATOM 171 HB3 ARG 11 -5.783 9.043 -10.297 1.00 0.00 H -ATOM 172 CG ARG 11 -4.766 10.614 -11.201 1.00 0.00 C -ATOM 173 HG2 ARG 11 -3.937 9.924 -11.046 1.00 0.00 H -ATOM 174 HG3 ARG 11 -4.885 10.745 -12.276 1.00 0.00 H -ATOM 175 CD ARG 11 -4.452 12.001 -10.520 1.00 0.00 C -ATOM 176 HD2 ARG 11 -5.237 12.689 -10.834 1.00 0.00 H -ATOM 177 HD3 ARG 11 -4.529 11.877 -9.440 1.00 0.00 H -ATOM 178 NE ARG 11 -3.146 12.519 -10.892 1.00 0.00 N -ATOM 179 HE ARG 11 -2.468 12.457 -10.147 1.00 0.00 H -ATOM 180 CZ ARG 11 -2.719 13.204 -11.916 1.00 0.00 C -ATOM 181 NH1 ARG 11 -3.488 13.608 -12.857 1.00 0.00 N -ATOM 182 HH11 ARG 11 -4.457 13.442 -12.626 1.00 0.00 H -ATOM 183 HH12 ARG 11 -3.202 14.320 -13.514 1.00 0.00 H -ATOM 184 NH2 ARG 11 -1.458 13.549 -11.947 1.00 0.00 N -ATOM 185 HH21 ARG 11 -0.851 13.349 -11.164 1.00 0.00 H -ATOM 186 HH22 ARG 11 -1.111 14.030 -12.764 1.00 0.00 H -ATOM 187 C ARG 11 -7.528 10.742 -12.796 1.00 0.00 C -ATOM 188 O ARG 11 -7.063 10.828 -13.905 1.00 0.00 O -ATOM 189 N PRO 12 -8.519 11.580 -12.387 1.00 0.00 N -ATOM 190 CD PRO 12 -9.317 11.611 -11.149 1.00 0.00 C -ATOM 191 HD2 PRO 12 -8.842 12.094 -10.295 1.00 0.00 H -ATOM 192 HD3 PRO 12 -9.617 10.629 -10.784 1.00 0.00 H -ATOM 193 CG PRO 12 -10.478 12.435 -11.455 1.00 0.00 C -ATOM 194 HG2 PRO 12 -10.826 13.030 -10.610 1.00 0.00 H -ATOM 195 HG3 PRO 12 -11.287 11.883 -11.935 1.00 0.00 H -ATOM 196 CB PRO 12 -9.906 13.496 -12.403 1.00 0.00 C -ATOM 197 HB2 PRO 12 -9.446 14.306 -11.838 1.00 0.00 H -ATOM 198 HB3 PRO 12 -10.662 13.841 -13.108 1.00 0.00 H -ATOM 199 CA PRO 12 -8.822 12.868 -13.190 1.00 0.00 C -ATOM 200 HA PRO 12 -9.174 12.605 -14.188 1.00 0.00 H -ATOM 201 C PRO 12 -7.536 13.765 -13.348 1.00 0.00 C -ATOM 202 O PRO 12 -6.577 13.541 -12.596 1.00 0.00 O -ATOM 203 N PHE 13 -7.548 14.748 -14.289 1.00 0.00 N -ATOM 204 H PHE 13 -8.397 14.993 -14.779 1.00 0.00 H -ATOM 205 CA PHE 13 -6.407 15.594 -14.517 1.00 0.00 C -ATOM 206 HA PHE 13 -5.578 14.900 -14.650 1.00 0.00 H -ATOM 207 CB PHE 13 -6.561 16.445 -15.813 1.00 0.00 C -ATOM 208 HB2 PHE 13 -7.549 16.904 -15.783 1.00 0.00 H -ATOM 209 HB3 PHE 13 -5.962 17.347 -15.688 1.00 0.00 H -ATOM 210 CG PHE 13 -6.285 15.848 -17.176 1.00 0.00 C -ATOM 211 CD1 PHE 13 -5.184 16.292 -17.989 1.00 0.00 C -ATOM 212 HD1 PHE 13 -4.540 17.022 -17.523 1.00 0.00 H -ATOM 213 CE1 PHE 13 -5.096 15.916 -19.348 1.00 0.00 C -ATOM 214 HE1 PHE 13 -4.456 16.439 -20.043 1.00 0.00 H -ATOM 215 CZ PHE 13 -5.997 14.999 -19.845 1.00 0.00 C -ATOM 216 HZ PHE 13 -5.895 14.647 -20.861 1.00 0.00 H -ATOM 217 CE2 PHE 13 -6.993 14.453 -19.016 1.00 0.00 C -ATOM 218 HE2 PHE 13 -7.597 13.646 -19.403 1.00 0.00 H -ATOM 219 CD2 PHE 13 -7.201 14.868 -17.699 1.00 0.00 C -ATOM 220 HD2 PHE 13 -8.060 14.499 -17.158 1.00 0.00 H -ATOM 221 C PHE 13 -6.153 16.447 -13.238 1.00 0.00 C -ATOM 222 O PHE 13 -7.098 16.958 -12.642 1.00 0.00 O -ATOM 223 N ASN 14 -4.890 16.661 -12.813 1.00 0.00 N -ATOM 224 H ASN 14 -4.180 16.324 -13.447 1.00 0.00 H -ATOM 225 CA ASN 14 -4.520 17.678 -11.762 1.00 0.00 C -ATOM 226 HA ASN 14 -5.416 17.751 -11.146 1.00 0.00 H -ATOM 227 CB ASN 14 -3.304 17.217 -10.970 1.00 0.00 C -ATOM 228 HB2 ASN 14 -3.213 17.796 -10.051 1.00 0.00 H -ATOM 229 HB3 ASN 14 -3.353 16.157 -10.720 1.00 0.00 H -ATOM 230 CG ASN 14 -1.973 17.314 -11.711 1.00 0.00 C -ATOM 231 OD1 ASN 14 -1.827 18.117 -12.633 1.00 0.00 O -ATOM 232 ND2 ASN 14 -0.967 16.650 -11.108 1.00 0.00 N -ATOM 233 HD21 ASN 14 -0.097 16.486 -11.596 1.00 0.00 H -ATOM 234 HD22 ASN 14 -1.163 16.175 -10.239 1.00 0.00 H -ATOM 235 C ASN 14 -4.508 19.140 -12.297 1.00 0.00 C -ATOM 236 O ASN 14 -4.748 19.419 -13.514 1.00 0.00 O -ATOM 237 N LEU 15 -4.164 20.099 -11.444 1.00 0.00 N -ATOM 238 H LEU 15 -3.954 19.967 -10.466 1.00 0.00 H -ATOM 239 CA LEU 15 -4.096 21.536 -11.922 1.00 0.00 C -ATOM 240 HA LEU 15 -4.963 21.919 -12.461 1.00 0.00 H -ATOM 241 CB LEU 15 -4.007 22.571 -10.794 1.00 0.00 C -ATOM 242 HB2 LEU 15 -4.943 22.547 -10.236 1.00 0.00 H -ATOM 243 HB3 LEU 15 -3.255 22.292 -10.055 1.00 0.00 H -ATOM 244 CG LEU 15 -3.674 24.005 -11.119 1.00 0.00 C -ATOM 245 HG LEU 15 -2.649 23.930 -11.482 1.00 0.00 H -ATOM 246 CD1 LEU 15 -4.776 24.637 -11.993 1.00 0.00 C -ATOM 247 HD11 LEU 15 -4.281 25.526 -12.385 1.00 0.00 H -ATOM 248 HD12 LEU 15 -5.017 23.976 -12.825 1.00 0.00 H -ATOM 249 HD13 LEU 15 -5.742 24.833 -11.527 1.00 0.00 H -ATOM 250 CD2 LEU 15 -3.512 24.888 -9.895 1.00 0.00 C -ATOM 251 HD21 LEU 15 -4.443 24.812 -9.333 1.00 0.00 H -ATOM 252 HD22 LEU 15 -2.698 24.555 -9.251 1.00 0.00 H -ATOM 253 HD23 LEU 15 -3.209 25.877 -10.239 1.00 0.00 H -ATOM 254 C LEU 15 -2.937 21.792 -12.906 1.00 0.00 C -ATOM 255 O LEU 15 -3.133 22.588 -13.862 1.00 0.00 O -ATOM 256 N ALA 16 -1.769 21.240 -12.735 1.00 0.00 N -ATOM 257 H ALA 16 -1.732 20.677 -11.897 1.00 0.00 H -ATOM 258 CA ALA 16 -0.449 21.456 -13.429 1.00 0.00 C -ATOM 259 HA ALA 16 -0.240 22.523 -13.513 1.00 0.00 H -ATOM 260 CB ALA 16 0.641 20.708 -12.566 1.00 0.00 C -ATOM 261 HB1 ALA 16 1.626 20.906 -12.988 1.00 0.00 H -ATOM 262 HB2 ALA 16 0.540 21.087 -11.549 1.00 0.00 H -ATOM 263 HB3 ALA 16 0.370 19.658 -12.463 1.00 0.00 H -ATOM 264 C ALA 16 -0.560 20.908 -14.857 1.00 0.00 C -ATOM 265 O ALA 16 -0.077 21.514 -15.750 1.00 0.00 O -ATOM 266 N GLU 17 -1.198 19.742 -15.056 1.00 0.00 N -ATOM 267 H GLU 17 -1.555 19.295 -14.224 1.00 0.00 H -ATOM 268 CA GLU 17 -1.502 19.085 -16.347 1.00 0.00 C -ATOM 269 HA GLU 17 -0.538 19.131 -16.853 1.00 0.00 H -ATOM 270 CB GLU 17 -2.087 17.694 -16.110 1.00 0.00 C -ATOM 271 HB2 GLU 17 -3.035 17.840 -15.593 1.00 0.00 H -ATOM 272 HB3 GLU 17 -2.284 17.237 -17.080 1.00 0.00 H -ATOM 273 CG GLU 17 -1.075 16.766 -15.462 1.00 0.00 C -ATOM 274 HG2 GLU 17 -0.325 16.507 -16.209 1.00 0.00 H -ATOM 275 HG3 GLU 17 -0.573 17.322 -14.670 1.00 0.00 H -ATOM 276 CD GLU 17 -1.736 15.557 -14.843 1.00 0.00 C -ATOM 277 OE1 GLU 17 -2.982 15.437 -14.751 1.00 0.00 O -ATOM 278 OE2 GLU 17 -0.968 14.630 -14.406 1.00 0.00 O -ATOM 279 C GLU 17 -2.450 19.939 -17.328 1.00 0.00 C -ATOM 280 O GLU 17 -2.149 20.090 -18.530 1.00 0.00 O -ATOM 281 N ARG 18 -3.532 20.624 -16.862 1.00 0.00 N -ATOM 282 H ARG 18 -3.795 20.404 -15.912 1.00 0.00 H -ATOM 283 CA ARG 18 -4.189 21.737 -17.674 1.00 0.00 C -ATOM 284 HA ARG 18 -4.633 21.268 -18.551 1.00 0.00 H -ATOM 285 CB ARG 18 -5.398 22.215 -16.945 1.00 0.00 C -ATOM 286 HB2 ARG 18 -5.987 21.398 -16.529 1.00 0.00 H -ATOM 287 HB3 ARG 18 -4.969 22.792 -16.126 1.00 0.00 H -ATOM 288 CG ARG 18 -6.300 23.110 -17.761 1.00 0.00 C -ATOM 289 HG2 ARG 18 -5.890 24.075 -18.061 1.00 0.00 H -ATOM 290 HG3 ARG 18 -6.606 22.672 -18.711 1.00 0.00 H -ATOM 291 CD ARG 18 -7.565 23.436 -16.965 1.00 0.00 C -ATOM 292 HD2 ARG 18 -7.785 22.610 -16.288 1.00 0.00 H -ATOM 293 HD3 ARG 18 -7.391 24.325 -16.359 1.00 0.00 H -ATOM 294 NE ARG 18 -8.730 23.755 -17.787 1.00 0.00 N -ATOM 295 HE ARG 18 -8.506 23.600 -18.759 1.00 0.00 H -ATOM 296 CZ ARG 18 -9.933 24.204 -17.510 1.00 0.00 C -ATOM 297 NH1 ARG 18 -10.315 24.491 -16.235 1.00 0.00 N -ATOM 298 HH11 ARG 18 -9.667 24.167 -15.532 1.00 0.00 H -ATOM 299 HH12 ARG 18 -11.049 25.153 -16.028 1.00 0.00 H -ATOM 300 NH2 ARG 18 -10.860 24.425 -18.362 1.00 0.00 N -ATOM 301 HH21 ARG 18 -10.652 24.450 -19.350 1.00 0.00 H -ATOM 302 HH22 ARG 18 -11.753 24.732 -18.004 1.00 0.00 H -ATOM 303 C ARG 18 -3.259 22.842 -18.116 1.00 0.00 C -ATOM 304 O ARG 18 -3.167 23.159 -19.329 1.00 0.00 O -ATOM 305 N LYS 19 -2.545 23.432 -17.136 1.00 0.00 N -ATOM 306 H LYS 19 -2.727 23.134 -16.188 1.00 0.00 H -ATOM 307 CA LYS 19 -1.402 24.372 -17.251 1.00 0.00 C -ATOM 308 HA LYS 19 -1.765 25.231 -17.815 1.00 0.00 H -ATOM 309 CB LYS 19 -0.803 24.812 -15.874 1.00 0.00 C -ATOM 310 HB2 LYS 19 -0.114 24.132 -15.371 1.00 0.00 H -ATOM 311 HB3 LYS 19 -0.069 25.593 -16.072 1.00 0.00 H -ATOM 312 CG LYS 19 -1.854 25.413 -14.918 1.00 0.00 C -ATOM 313 HG2 LYS 19 -2.181 26.314 -15.438 1.00 0.00 H -ATOM 314 HG3 LYS 19 -2.646 24.669 -14.833 1.00 0.00 H -ATOM 315 CD LYS 19 -1.404 25.872 -13.600 1.00 0.00 C -ATOM 316 HD2 LYS 19 -2.287 26.285 -13.112 1.00 0.00 H -ATOM 317 HD3 LYS 19 -1.156 24.982 -13.022 1.00 0.00 H -ATOM 318 CE LYS 19 -0.172 26.843 -13.689 1.00 0.00 C -ATOM 319 HE2 LYS 19 0.653 26.308 -14.160 1.00 0.00 H -ATOM 320 HE3 LYS 19 -0.555 27.661 -14.298 1.00 0.00 H -ATOM 321 NZ LYS 19 0.185 27.300 -12.323 1.00 0.00 N -ATOM 322 HZ1 LYS 19 -0.556 27.367 -11.640 1.00 0.00 H -ATOM 323 HZ2 LYS 19 0.793 26.597 -11.927 1.00 0.00 H -ATOM 324 HZ3 LYS 19 0.729 28.150 -12.350 1.00 0.00 H -ATOM 325 C LYS 19 -0.258 23.918 -18.120 1.00 0.00 C -ATOM 326 O LYS 19 0.599 24.804 -18.394 1.00 0.00 O -ATOM 327 N ALA 20 -0.080 22.652 -18.603 1.00 0.00 N -ATOM 328 H ALA 20 -0.651 21.958 -18.142 1.00 0.00 H -ATOM 329 CA ALA 20 0.936 22.190 -19.524 1.00 0.00 C -ATOM 330 HA ALA 20 1.662 22.964 -19.774 1.00 0.00 H -ATOM 331 CB ALA 20 1.788 21.173 -18.860 1.00 0.00 C -ATOM 332 HB1 ALA 20 2.758 21.033 -19.336 1.00 0.00 H -ATOM 333 HB2 ALA 20 1.851 21.407 -17.797 1.00 0.00 H -ATOM 334 HB3 ALA 20 1.314 20.192 -18.824 1.00 0.00 H -ATOM 335 C ALA 20 0.332 21.822 -20.916 1.00 0.00 C -ATOM 336 O ALA 20 0.926 21.208 -21.709 1.00 0.00 O -ATOM 337 N SER 21 -0.910 22.236 -21.157 1.00 0.00 N -ATOM 338 H SER 21 -1.425 22.585 -20.362 1.00 0.00 H -ATOM 339 CA SER 21 -1.660 21.869 -22.377 1.00 0.00 C -ATOM 340 HA SER 21 -2.716 22.089 -22.218 1.00 0.00 H -ATOM 341 CB SER 21 -1.232 22.694 -23.614 1.00 0.00 C -ATOM 342 HB2 SER 21 -0.170 22.609 -23.845 1.00 0.00 H -ATOM 343 HB3 SER 21 -1.814 22.333 -24.462 1.00 0.00 H -ATOM 344 OG SER 21 -1.512 24.056 -23.418 1.00 0.00 O -ATOM 345 HG SER 21 -0.957 24.267 -22.664 1.00 0.00 H -ATOM 346 C SER 21 -1.619 20.347 -22.713 1.00 0.00 C -ATOM 347 O SER 21 -1.560 19.968 -23.906 1.00 0.00 O -ATOM 348 N ALA 22 -1.514 19.494 -21.658 1.00 0.00 N -ATOM 349 H ALA 22 -1.669 19.850 -20.726 1.00 0.00 H -ATOM 350 CA ALA 22 -1.342 18.084 -21.706 1.00 0.00 C -ATOM 351 HA ALA 22 -0.376 18.018 -22.207 1.00 0.00 H -ATOM 352 CB ALA 22 -1.048 17.427 -20.292 1.00 0.00 C -ATOM 353 HB1 ALA 22 -0.884 16.358 -20.423 1.00 0.00 H -ATOM 354 HB2 ALA 22 -0.200 17.953 -19.854 1.00 0.00 H -ATOM 355 HB3 ALA 22 -1.964 17.615 -19.732 1.00 0.00 H -ATOM 356 C ALA 22 -2.594 17.498 -22.424 1.00 0.00 C -ATOM 357 O ALA 22 -3.691 17.968 -22.199 1.00 0.00 O -ATOM 358 N HIE 23 -2.460 16.453 -23.268 1.00 0.00 N -ATOM 359 H HIE 23 -1.536 16.160 -23.552 1.00 0.00 H -ATOM 360 CA HIE 23 -3.492 15.576 -23.811 1.00 0.00 C -ATOM 361 HA HIE 23 -4.472 16.046 -23.885 1.00 0.00 H -ATOM 362 CB HIE 23 -3.054 15.169 -25.189 1.00 0.00 C -ATOM 363 HB2 HIE 23 -2.025 14.811 -25.237 1.00 0.00 H -ATOM 364 HB3 HIE 23 -3.620 14.291 -25.498 1.00 0.00 H -ATOM 365 CG HIE 23 -3.186 16.121 -26.273 1.00 0.00 C -ATOM 366 ND1 HIE 23 -2.859 15.916 -27.586 1.00 0.00 N -ATOM 367 CE1 HIE 23 -3.449 16.910 -28.309 1.00 0.00 C -ATOM 368 HE1 HIE 23 -3.406 16.894 -29.388 1.00 0.00 H -ATOM 369 NE2 HIE 23 -4.151 17.682 -27.507 1.00 0.00 N -ATOM 370 HE2 HIE 23 -4.599 18.501 -27.893 1.00 0.00 H -ATOM 371 CD2 HIE 23 -3.920 17.281 -26.238 1.00 0.00 C -ATOM 372 HD2 HIE 23 -4.413 17.636 -25.345 1.00 0.00 H -ATOM 373 C HIE 23 -3.616 14.323 -22.908 1.00 0.00 C -ATOM 374 O HIE 23 -2.567 13.901 -22.319 1.00 0.00 O -ATOM 375 N SER 24 -4.871 13.769 -22.866 1.00 0.00 N -ATOM 376 H SER 24 -5.662 14.294 -23.210 1.00 0.00 H -ATOM 377 CA SER 24 -5.021 12.472 -22.258 1.00 0.00 C -ATOM 378 HA SER 24 -4.552 12.381 -21.278 1.00 0.00 H -ATOM 379 CB SER 24 -6.528 12.199 -22.080 1.00 0.00 C -ATOM 380 HB2 SER 24 -6.885 13.114 -21.608 1.00 0.00 H -ATOM 381 HB3 SER 24 -7.037 12.019 -23.027 1.00 0.00 H -ATOM 382 OG SER 24 -6.587 11.075 -21.280 1.00 0.00 O -ATOM 383 HG SER 24 -6.628 10.238 -21.747 1.00 0.00 H -ATOM 384 C SER 24 -4.400 11.338 -23.072 1.00 0.00 C -ATOM 385 O SER 24 -4.850 11.126 -24.174 1.00 0.00 O -ATOM 386 N ILE 25 -3.396 10.611 -22.623 1.00 0.00 N -ATOM 387 H ILE 25 -2.899 10.882 -21.786 1.00 0.00 H -ATOM 388 CA ILE 25 -2.580 9.689 -23.417 1.00 0.00 C -ATOM 389 HA ILE 25 -3.138 9.494 -24.333 1.00 0.00 H -ATOM 390 CB ILE 25 -1.269 10.248 -23.919 1.00 0.00 C -ATOM 391 HB ILE 25 -0.654 9.561 -24.501 1.00 0.00 H -ATOM 392 CG2 ILE 25 -1.680 11.460 -24.913 1.00 0.00 C -ATOM 393 HG21 ILE 25 -0.782 11.774 -25.445 1.00 0.00 H -ATOM 394 HG22 ILE 25 -2.432 11.115 -25.623 1.00 0.00 H -ATOM 395 HG23 ILE 25 -2.167 12.315 -24.445 1.00 0.00 H -ATOM 396 CG1 ILE 25 -0.325 10.837 -22.882 1.00 0.00 C -ATOM 397 HG12 ILE 25 0.447 11.378 -23.429 1.00 0.00 H -ATOM 398 HG13 ILE 25 -0.919 11.631 -22.429 1.00 0.00 H -ATOM 399 CD1 ILE 25 0.221 9.810 -21.872 1.00 0.00 C -ATOM 400 HD11 ILE 25 -0.564 9.521 -21.173 1.00 0.00 H -ATOM 401 HD12 ILE 25 0.528 8.921 -22.422 1.00 0.00 H -ATOM 402 HD13 ILE 25 1.082 10.181 -21.315 1.00 0.00 H -ATOM 403 C ILE 25 -2.566 8.251 -22.864 1.00 0.00 C -ATOM 404 O ILE 25 -1.771 7.478 -23.405 1.00 0.00 O -ATOM 405 N VAL 26 -3.426 7.866 -21.918 1.00 0.00 N -ATOM 406 H VAL 26 -3.908 8.574 -21.381 1.00 0.00 H -ATOM 407 CA VAL 26 -3.654 6.496 -21.449 1.00 0.00 C -ATOM 408 HA VAL 26 -2.955 5.913 -22.047 1.00 0.00 H -ATOM 409 CB VAL 26 -3.218 6.357 -19.934 1.00 0.00 C -ATOM 410 HB VAL 26 -3.839 7.059 -19.377 1.00 0.00 H -ATOM 411 CG1 VAL 26 -3.560 4.990 -19.361 1.00 0.00 C -ATOM 412 HG11 VAL 26 -3.104 4.252 -20.021 1.00 0.00 H -ATOM 413 HG12 VAL 26 -3.187 4.935 -18.338 1.00 0.00 H -ATOM 414 HG13 VAL 26 -4.632 4.794 -19.360 1.00 0.00 H -ATOM 415 CG2 VAL 26 -1.710 6.680 -19.724 1.00 0.00 C -ATOM 416 HG21 VAL 26 -1.545 7.754 -19.807 1.00 0.00 H -ATOM 417 HG22 VAL 26 -1.464 6.358 -18.712 1.00 0.00 H -ATOM 418 HG23 VAL 26 -1.115 6.195 -20.498 1.00 0.00 H -ATOM 419 C VAL 26 -5.081 6.061 -21.646 1.00 0.00 C -ATOM 420 O VAL 26 -6.001 6.697 -21.123 1.00 0.00 O -ATOM 421 N GLU 27 -5.279 4.934 -22.347 1.00 0.00 N -ATOM 422 H GLU 27 -4.403 4.493 -22.590 1.00 0.00 H -ATOM 423 CA GLU 27 -6.453 4.221 -22.797 1.00 0.00 C -ATOM 424 HA GLU 27 -7.359 4.790 -22.588 1.00 0.00 H -ATOM 425 CB GLU 27 -6.320 3.753 -24.245 1.00 0.00 C -ATOM 426 HB2 GLU 27 -5.542 2.993 -24.320 1.00 0.00 H -ATOM 427 HB3 GLU 27 -7.293 3.346 -24.519 1.00 0.00 H -ATOM 428 CG GLU 27 -5.892 4.921 -25.265 1.00 0.00 C -ATOM 429 HG2 GLU 27 -4.846 5.149 -25.063 1.00 0.00 H -ATOM 430 HG3 GLU 27 -6.165 4.634 -26.281 1.00 0.00 H -ATOM 431 CD GLU 27 -6.610 6.228 -24.943 1.00 0.00 C -ATOM 432 OE1 GLU 27 -7.887 6.245 -24.779 1.00 0.00 O -ATOM 433 OE2 GLU 27 -5.957 7.307 -24.858 1.00 0.00 O -ATOM 434 C GLU 27 -6.681 3.011 -21.863 1.00 0.00 C -ATOM 435 O GLU 27 -6.398 1.886 -22.175 1.00 0.00 O -ATOM 436 N CYS 28 -7.232 3.246 -20.644 1.00 0.00 N -ATOM 437 H CYS 28 -7.162 4.154 -20.207 1.00 0.00 H -ATOM 438 CA CYS 28 -7.693 2.176 -19.859 1.00 0.00 C -ATOM 439 HA CYS 28 -6.993 1.356 -19.701 1.00 0.00 H -ATOM 440 CB CYS 28 -8.144 2.687 -18.478 1.00 0.00 C -ATOM 441 HB2 CYS 28 -8.619 3.646 -18.681 1.00 0.00 H -ATOM 442 HB3 CYS 28 -8.840 2.012 -17.979 1.00 0.00 H -ATOM 443 SG CYS 28 -6.729 2.979 -17.411 1.00 0.00 S -ATOM 444 HG CYS 28 -5.960 3.779 -18.154 1.00 0.00 H -ATOM 445 C CYS 28 -8.948 1.620 -20.551 1.00 0.00 C -ATOM 446 O CYS 28 -9.863 2.432 -20.904 1.00 0.00 O -ATOM 447 N ASP 29 -9.012 0.328 -20.747 1.00 0.00 N -ATOM 448 H ASP 29 -8.240 -0.238 -20.425 1.00 0.00 H -ATOM 449 CA ASP 29 -10.162 -0.346 -21.369 1.00 0.00 C -ATOM 450 HA ASP 29 -11.047 0.290 -21.353 1.00 0.00 H -ATOM 451 CB ASP 29 -9.875 -0.659 -22.866 1.00 0.00 C -ATOM 452 HB2 ASP 29 -9.805 0.350 -23.274 1.00 0.00 H -ATOM 453 HB3 ASP 29 -8.946 -1.225 -22.927 1.00 0.00 H -ATOM 454 CG ASP 29 -11.081 -1.286 -23.514 1.00 0.00 C -ATOM 455 OD1 ASP 29 -11.285 -1.325 -24.768 1.00 0.00 O -ATOM 456 OD2 ASP 29 -11.924 -1.799 -22.735 1.00 0.00 O -ATOM 457 C ASP 29 -10.453 -1.587 -20.441 1.00 0.00 C -ATOM 458 O ASP 29 -9.816 -2.631 -20.415 1.00 0.00 O -ATOM 459 N PRO 30 -11.405 -1.342 -19.398 1.00 0.00 N -ATOM 460 CD PRO 30 -11.802 -0.024 -18.937 1.00 0.00 C -ATOM 461 HD2 PRO 30 -12.713 0.240 -19.473 1.00 0.00 H -ATOM 462 HD3 PRO 30 -11.005 0.715 -19.021 1.00 0.00 H -ATOM 463 CG PRO 30 -12.204 -0.082 -17.462 1.00 0.00 C -ATOM 464 HG2 PRO 30 -12.844 0.720 -17.093 1.00 0.00 H -ATOM 465 HG3 PRO 30 -11.284 -0.035 -16.879 1.00 0.00 H -ATOM 466 CB PRO 30 -12.691 -1.534 -17.440 1.00 0.00 C -ATOM 467 HB2 PRO 30 -13.671 -1.551 -17.917 1.00 0.00 H -ATOM 468 HB3 PRO 30 -12.854 -2.008 -16.472 1.00 0.00 H -ATOM 469 CA PRO 30 -11.744 -2.317 -18.355 1.00 0.00 C -ATOM 470 HA PRO 30 -10.910 -2.730 -17.787 1.00 0.00 H -ATOM 471 C PRO 30 -12.418 -3.612 -18.936 1.00 0.00 C -ATOM 472 O PRO 30 -12.135 -4.745 -18.392 1.00 0.00 O -ATOM 473 N VAL 31 -13.200 -3.450 -20.045 1.00 0.00 N -ATOM 474 H VAL 31 -13.293 -2.517 -20.420 1.00 0.00 H -ATOM 475 CA VAL 31 -13.785 -4.577 -20.781 1.00 0.00 C -ATOM 476 HA VAL 31 -14.412 -5.187 -20.132 1.00 0.00 H -ATOM 477 CB VAL 31 -14.784 -4.021 -21.818 1.00 0.00 C -ATOM 478 HB VAL 31 -14.401 -3.116 -22.289 1.00 0.00 H -ATOM 479 CG1 VAL 31 -15.346 -5.010 -22.891 1.00 0.00 C -ATOM 480 HG11 VAL 31 -16.187 -4.561 -23.421 1.00 0.00 H -ATOM 481 HG12 VAL 31 -14.615 -4.982 -23.699 1.00 0.00 H -ATOM 482 HG13 VAL 31 -15.554 -6.044 -22.615 1.00 0.00 H -ATOM 483 CG2 VAL 31 -15.992 -3.694 -20.970 1.00 0.00 C -ATOM 484 HG21 VAL 31 -16.418 -4.661 -20.704 1.00 0.00 H -ATOM 485 HG22 VAL 31 -15.754 -3.150 -20.056 1.00 0.00 H -ATOM 486 HG23 VAL 31 -16.627 -2.982 -21.498 1.00 0.00 H -ATOM 487 C VAL 31 -12.767 -5.485 -21.431 1.00 0.00 C -ATOM 488 O VAL 31 -12.937 -6.695 -21.442 1.00 0.00 O -ATOM 489 N ARG 32 -11.630 -4.880 -21.817 1.00 0.00 N -ATOM 490 H ARG 32 -11.763 -3.894 -21.992 1.00 0.00 H -ATOM 491 CA ARG 32 -10.517 -5.505 -22.387 1.00 0.00 C -ATOM 492 HA ARG 32 -10.810 -6.363 -22.992 1.00 0.00 H -ATOM 493 CB ARG 32 -9.858 -4.543 -23.357 1.00 0.00 C -ATOM 494 HB2 ARG 32 -10.631 -4.060 -23.954 1.00 0.00 H -ATOM 495 HB3 ARG 32 -9.355 -3.781 -22.762 1.00 0.00 H -ATOM 496 CG ARG 32 -8.853 -5.146 -24.370 1.00 0.00 C -ATOM 497 HG2 ARG 32 -8.593 -4.329 -25.043 1.00 0.00 H -ATOM 498 HG3 ARG 32 -7.937 -5.342 -23.814 1.00 0.00 H -ATOM 499 CD ARG 32 -9.235 -6.453 -25.143 1.00 0.00 C -ATOM 500 HD2 ARG 32 -8.281 -6.781 -25.556 1.00 0.00 H -ATOM 501 HD3 ARG 32 -9.497 -7.141 -24.339 1.00 0.00 H -ATOM 502 NE ARG 32 -10.349 -6.269 -26.083 1.00 0.00 N -ATOM 503 HE ARG 32 -10.622 -5.308 -26.227 1.00 0.00 H -ATOM 504 CZ ARG 32 -10.630 -7.040 -27.086 1.00 0.00 C -ATOM 505 NH1 ARG 32 -9.977 -8.171 -27.315 1.00 0.00 N -ATOM 506 HH11 ARG 32 -9.194 -8.411 -26.723 1.00 0.00 H -ATOM 507 HH12 ARG 32 -10.230 -8.874 -27.995 1.00 0.00 H -ATOM 508 NH2 ARG 32 -11.626 -6.740 -27.824 1.00 0.00 N -ATOM 509 HH21 ARG 32 -12.282 -6.044 -27.499 1.00 0.00 H -ATOM 510 HH22 ARG 32 -11.735 -7.229 -28.701 1.00 0.00 H -ATOM 511 C ARG 32 -9.496 -5.985 -21.362 1.00 0.00 C -ATOM 512 O ARG 32 -8.590 -6.674 -21.781 1.00 0.00 O -ATOM 513 N LYS 33 -9.562 -5.572 -20.116 1.00 0.00 N -ATOM 514 H LYS 33 -10.421 -5.127 -19.826 1.00 0.00 H -ATOM 515 CA LYS 33 -8.477 -5.700 -19.164 1.00 0.00 C -ATOM 516 HA LYS 33 -8.672 -4.982 -18.367 1.00 0.00 H -ATOM 517 CB LYS 33 -8.442 -7.142 -18.584 1.00 0.00 C -ATOM 518 HB2 LYS 33 -8.177 -7.954 -19.262 1.00 0.00 H -ATOM 519 HB3 LYS 33 -7.683 -7.101 -17.803 1.00 0.00 H -ATOM 520 CG LYS 33 -9.692 -7.596 -17.754 1.00 0.00 C -ATOM 521 HG2 LYS 33 -9.931 -6.706 -17.172 1.00 0.00 H -ATOM 522 HG3 LYS 33 -10.526 -7.797 -18.427 1.00 0.00 H -ATOM 523 CD LYS 33 -9.307 -8.814 -16.871 1.00 0.00 C -ATOM 524 HD2 LYS 33 -8.865 -9.636 -17.433 1.00 0.00 H -ATOM 525 HD3 LYS 33 -8.496 -8.454 -16.237 1.00 0.00 H -ATOM 526 CE LYS 33 -10.539 -9.235 -16.014 1.00 0.00 C -ATOM 527 HE2 LYS 33 -11.343 -9.343 -16.743 1.00 0.00 H -ATOM 528 HE3 LYS 33 -10.282 -10.137 -15.459 1.00 0.00 H -ATOM 529 NZ LYS 33 -10.985 -8.322 -15.011 1.00 0.00 N -ATOM 530 HZ1 LYS 33 -11.607 -7.623 -15.393 1.00 0.00 H -ATOM 531 HZ2 LYS 33 -11.626 -8.750 -14.358 1.00 0.00 H -ATOM 532 HZ3 LYS 33 -10.244 -7.967 -14.424 1.00 0.00 H -ATOM 533 C LYS 33 -7.077 -5.242 -19.740 1.00 0.00 C -ATOM 534 O LYS 33 -6.047 -5.820 -19.514 1.00 0.00 O -ATOM 535 N GLU 34 -7.113 -4.155 -20.583 1.00 0.00 N -ATOM 536 H GLU 34 -8.002 -3.678 -20.626 1.00 0.00 H -ATOM 537 CA GLU 34 -5.846 -3.565 -21.082 1.00 0.00 C -ATOM 538 HA GLU 34 -4.994 -4.008 -20.565 1.00 0.00 H -ATOM 539 CB GLU 34 -5.735 -3.751 -22.643 1.00 0.00 C -ATOM 540 HB2 GLU 34 -6.673 -3.446 -23.107 1.00 0.00 H -ATOM 541 HB3 GLU 34 -5.035 -2.987 -22.981 1.00 0.00 H -ATOM 542 CG GLU 34 -4.990 -5.032 -23.142 1.00 0.00 C -ATOM 543 HG2 GLU 34 -4.042 -5.277 -22.663 1.00 0.00 H -ATOM 544 HG3 GLU 34 -5.492 -5.943 -22.816 1.00 0.00 H -ATOM 545 CD GLU 34 -4.987 -5.185 -24.638 1.00 0.00 C -ATOM 546 OE1 GLU 34 -5.719 -4.407 -25.340 1.00 0.00 O -ATOM 547 OE2 GLU 34 -4.298 -6.053 -25.193 1.00 0.00 O -ATOM 548 C GLU 34 -5.862 -2.099 -20.739 1.00 0.00 C -ATOM 549 O GLU 34 -6.853 -1.393 -20.498 1.00 0.00 O -ATOM 550 N VAL 35 -4.676 -1.565 -20.852 1.00 0.00 N -ATOM 551 H VAL 35 -3.983 -2.233 -21.156 1.00 0.00 H -ATOM 552 CA VAL 35 -4.267 -0.171 -20.610 1.00 0.00 C -ATOM 553 HA VAL 35 -4.956 0.629 -20.881 1.00 0.00 H -ATOM 554 CB VAL 35 -3.638 0.002 -19.188 1.00 0.00 C -ATOM 555 HB VAL 35 -2.713 -0.573 -19.171 1.00 0.00 H -ATOM 556 CG1 VAL 35 -3.172 1.399 -18.936 1.00 0.00 C -ATOM 557 HG11 VAL 35 -2.418 1.525 -18.158 1.00 0.00 H -ATOM 558 HG12 VAL 35 -2.911 1.877 -19.880 1.00 0.00 H -ATOM 559 HG13 VAL 35 -4.051 1.949 -18.600 1.00 0.00 H -ATOM 560 CG2 VAL 35 -4.638 -0.458 -18.106 1.00 0.00 C -ATOM 561 HG21 VAL 35 -4.872 -1.506 -18.296 1.00 0.00 H -ATOM 562 HG22 VAL 35 -4.048 -0.406 -17.192 1.00 0.00 H -ATOM 563 HG23 VAL 35 -5.436 0.276 -18.218 1.00 0.00 H -ATOM 564 C VAL 35 -3.144 0.034 -21.690 1.00 0.00 C -ATOM 565 O VAL 35 -2.305 -0.796 -21.847 1.00 0.00 O -ATOM 566 N SER 36 -3.297 1.152 -22.508 1.00 0.00 N -ATOM 567 H SER 36 -3.997 1.865 -22.362 1.00 0.00 H -ATOM 568 CA SER 36 -2.328 1.400 -23.574 1.00 0.00 C -ATOM 569 HA SER 36 -1.471 0.731 -23.493 1.00 0.00 H -ATOM 570 CB SER 36 -3.077 1.090 -24.896 1.00 0.00 C -ATOM 571 HB2 SER 36 -3.471 0.074 -24.878 1.00 0.00 H -ATOM 572 HB3 SER 36 -3.780 1.899 -25.089 1.00 0.00 H -ATOM 573 OG SER 36 -2.069 1.061 -25.912 1.00 0.00 O -ATOM 574 HG SER 36 -1.799 0.151 -26.053 1.00 0.00 H -ATOM 575 C SER 36 -1.820 2.860 -23.517 1.00 0.00 C -ATOM 576 O SER 36 -2.699 3.693 -23.237 1.00 0.00 O -ATOM 577 N VAL 37 -0.555 3.188 -23.728 1.00 0.00 N -ATOM 578 H VAL 37 0.138 2.472 -23.891 1.00 0.00 H -ATOM 579 CA VAL 37 -0.013 4.515 -23.506 1.00 0.00 C -ATOM 580 HA VAL 37 -0.845 5.178 -23.271 1.00 0.00 H -ATOM 581 CB VAL 37 0.902 4.506 -22.310 1.00 0.00 C -ATOM 582 HB VAL 37 0.312 4.444 -21.395 1.00 0.00 H -ATOM 583 CG1 VAL 37 2.111 3.545 -22.343 1.00 0.00 C -ATOM 584 HG11 VAL 37 1.904 2.481 -22.459 1.00 0.00 H -ATOM 585 HG12 VAL 37 2.678 3.904 -23.202 1.00 0.00 H -ATOM 586 HG13 VAL 37 2.668 3.609 -21.408 1.00 0.00 H -ATOM 587 CG2 VAL 37 1.449 5.865 -22.060 1.00 0.00 C -ATOM 588 HG21 VAL 37 0.579 6.478 -21.821 1.00 0.00 H -ATOM 589 HG22 VAL 37 2.132 5.822 -21.212 1.00 0.00 H -ATOM 590 HG23 VAL 37 1.953 6.245 -22.949 1.00 0.00 H -ATOM 591 C VAL 37 0.601 5.053 -24.835 1.00 0.00 C -ATOM 592 O VAL 37 1.441 4.364 -25.432 1.00 0.00 O -ATOM 593 N ARG 38 0.166 6.139 -25.403 1.00 0.00 N -ATOM 594 H ARG 38 -0.482 6.659 -24.828 1.00 0.00 H -ATOM 595 CA ARG 38 0.365 6.674 -26.757 1.00 0.00 C -ATOM 596 HA ARG 38 0.197 5.856 -27.457 1.00 0.00 H -ATOM 597 CB ARG 38 -0.670 7.788 -27.071 1.00 0.00 C -ATOM 598 HB2 ARG 38 -0.561 8.565 -26.314 1.00 0.00 H -ATOM 599 HB3 ARG 38 -0.557 8.140 -28.096 1.00 0.00 H -ATOM 600 CG ARG 38 -2.149 7.294 -26.989 1.00 0.00 C -ATOM 601 HG2 ARG 38 -2.106 6.370 -27.565 1.00 0.00 H -ATOM 602 HG3 ARG 38 -2.377 6.892 -26.002 1.00 0.00 H -ATOM 603 CD ARG 38 -3.091 8.340 -27.605 1.00 0.00 C -ATOM 604 HD2 ARG 38 -2.600 9.307 -27.503 1.00 0.00 H -ATOM 605 HD3 ARG 38 -3.149 8.240 -28.689 1.00 0.00 H -ATOM 606 NE ARG 38 -4.467 8.368 -27.078 1.00 0.00 N -ATOM 607 HE ARG 38 -4.712 7.845 -26.249 1.00 0.00 H -ATOM 608 CZ ARG 38 -5.382 9.249 -27.364 1.00 0.00 C -ATOM 609 NH1 ARG 38 -5.233 10.126 -28.333 1.00 0.00 N -ATOM 610 HH11 ARG 38 -4.407 10.067 -28.912 1.00 0.00 H -ATOM 611 HH12 ARG 38 -5.907 10.857 -28.507 1.00 0.00 H -ATOM 612 NH2 ARG 38 -6.390 9.416 -26.636 1.00 0.00 N -ATOM 613 HH21 ARG 38 -6.409 8.936 -25.748 1.00 0.00 H -ATOM 614 HH22 ARG 38 -6.873 10.290 -26.791 1.00 0.00 H -ATOM 615 C ARG 38 1.755 7.216 -27.169 1.00 0.00 C -ATOM 616 O ARG 38 1.929 8.190 -27.896 1.00 0.00 O -ATOM 617 N THR 39 2.803 6.424 -26.930 1.00 0.00 N -ATOM 618 H THR 39 2.631 5.570 -26.419 1.00 0.00 H -ATOM 619 CA THR 39 4.205 6.496 -27.363 1.00 0.00 C -ATOM 620 HA THR 39 4.694 7.431 -27.088 1.00 0.00 H -ATOM 621 CB THR 39 4.958 5.283 -26.899 1.00 0.00 C -ATOM 622 HB THR 39 5.927 5.334 -27.397 1.00 0.00 H -ATOM 623 CG2 THR 39 5.340 5.271 -25.440 1.00 0.00 C -ATOM 624 HG21 THR 39 5.571 4.263 -25.095 1.00 0.00 H -ATOM 625 HG22 THR 39 6.201 5.919 -25.274 1.00 0.00 H -ATOM 626 HG23 THR 39 4.519 5.642 -24.826 1.00 0.00 H -ATOM 627 OG1 THR 39 4.344 4.101 -27.156 1.00 0.00 O -ATOM 628 HG1 THR 39 4.240 4.101 -28.111 1.00 0.00 H -ATOM 629 C THR 39 4.250 6.488 -28.874 1.00 0.00 C -ATOM 630 O THR 39 3.412 5.784 -29.484 1.00 0.00 O -ATOM 631 N GLY 40 5.271 7.129 -29.481 1.00 0.00 N -ATOM 632 H GLY 40 5.915 7.562 -28.834 1.00 0.00 H -ATOM 633 CA GLY 40 5.623 7.195 -30.867 1.00 0.00 C -ATOM 634 HA2 GLY 40 6.465 7.887 -30.862 1.00 0.00 H -ATOM 635 HA3 GLY 40 6.096 6.248 -31.129 1.00 0.00 H -ATOM 636 C GLY 40 4.577 7.603 -31.915 1.00 0.00 C -ATOM 637 O GLY 40 4.771 7.496 -33.102 1.00 0.00 O -ATOM 638 N GLY 41 3.478 8.146 -31.393 1.00 0.00 N -ATOM 639 H GLY 41 3.557 8.331 -30.403 1.00 0.00 H -ATOM 640 CA GLY 41 2.396 8.729 -32.196 1.00 0.00 C -ATOM 641 HA2 GLY 41 2.711 9.740 -32.455 1.00 0.00 H -ATOM 642 HA3 GLY 41 2.384 8.148 -33.118 1.00 0.00 H -ATOM 643 C GLY 41 1.025 8.791 -31.471 1.00 0.00 C -ATOM 644 O GLY 41 0.590 7.803 -30.890 1.00 0.00 O -ATOM 645 N LEU 42 0.361 9.953 -31.497 1.00 0.00 N -ATOM 646 H LEU 42 0.683 10.721 -32.069 1.00 0.00 H -ATOM 647 CA LEU 42 -0.705 10.244 -30.571 1.00 0.00 C -ATOM 648 HA LEU 42 -0.583 9.756 -29.604 1.00 0.00 H -ATOM 649 CB LEU 42 -0.679 11.752 -30.239 1.00 0.00 C -ATOM 650 HB2 LEU 42 -0.934 12.390 -31.085 1.00 0.00 H -ATOM 651 HB3 LEU 42 -1.487 11.984 -29.544 1.00 0.00 H -ATOM 652 CG LEU 42 0.688 12.209 -29.670 1.00 0.00 C -ATOM 653 HG LEU 42 1.480 12.027 -30.397 1.00 0.00 H -ATOM 654 CD1 LEU 42 0.654 13.761 -29.428 1.00 0.00 C -ATOM 655 HD11 LEU 42 0.459 14.268 -30.372 1.00 0.00 H -ATOM 656 HD12 LEU 42 -0.121 14.042 -28.715 1.00 0.00 H -ATOM 657 HD13 LEU 42 1.534 14.270 -29.034 1.00 0.00 H -ATOM 658 CD2 LEU 42 0.928 11.622 -28.277 1.00 0.00 C -ATOM 659 HD21 LEU 42 0.197 12.056 -27.595 1.00 0.00 H -ATOM 660 HD22 LEU 42 0.910 10.533 -28.244 1.00 0.00 H -ATOM 661 HD23 LEU 42 1.915 12.001 -28.013 1.00 0.00 H -ATOM 662 C LEU 42 -2.089 9.710 -31.104 1.00 0.00 C -ATOM 663 O LEU 42 -3.124 9.735 -30.469 1.00 0.00 O -ATOM 664 N ALA 43 -2.049 9.039 -32.266 1.00 0.00 N -ATOM 665 H ALA 43 -1.216 9.198 -32.814 1.00 0.00 H -ATOM 666 CA ALA 43 -3.225 8.495 -32.919 1.00 0.00 C -ATOM 667 HA ALA 43 -4.037 8.319 -32.214 1.00 0.00 H -ATOM 668 CB ALA 43 -3.831 9.621 -33.858 1.00 0.00 C -ATOM 669 HB1 ALA 43 -4.788 9.242 -34.215 1.00 0.00 H -ATOM 670 HB2 ALA 43 -4.057 10.482 -33.229 1.00 0.00 H -ATOM 671 HB3 ALA 43 -3.117 9.947 -34.615 1.00 0.00 H -ATOM 672 C ALA 43 -2.808 7.122 -33.681 1.00 0.00 C -ATOM 673 O ALA 43 -3.701 6.386 -34.122 1.00 0.00 O -ATOM 674 N ASP 44 -1.545 6.727 -33.726 1.00 0.00 N -ATOM 675 H ASP 44 -0.839 7.248 -33.225 1.00 0.00 H -ATOM 676 CA ASP 44 -1.052 5.517 -34.393 1.00 0.00 C -ATOM 677 HA ASP 44 -1.694 5.359 -35.259 1.00 0.00 H -ATOM 678 CB ASP 44 0.368 5.780 -34.883 1.00 0.00 C -ATOM 679 HB2 ASP 44 0.292 6.688 -35.482 1.00 0.00 H -ATOM 680 HB3 ASP 44 1.083 5.923 -34.072 1.00 0.00 H -ATOM 681 CG ASP 44 0.847 4.599 -35.684 1.00 0.00 C -ATOM 682 OD1 ASP 44 1.987 4.691 -36.187 1.00 0.00 O -ATOM 683 OD2 ASP 44 0.218 3.507 -35.907 1.00 0.00 O -ATOM 684 C ASP 44 -1.123 4.353 -33.518 1.00 0.00 C -ATOM 685 O ASP 44 -0.420 4.329 -32.484 1.00 0.00 O -ATOM 686 N LYS 45 -1.998 3.348 -33.804 1.00 0.00 N -ATOM 687 H LYS 45 -2.570 3.354 -34.636 1.00 0.00 H -ATOM 688 CA LYS 45 -2.207 2.211 -32.904 1.00 0.00 C -ATOM 689 HA LYS 45 -2.315 2.593 -31.889 1.00 0.00 H -ATOM 690 CB LYS 45 -3.487 1.390 -33.194 1.00 0.00 C -ATOM 691 HB2 LYS 45 -3.572 0.998 -34.207 1.00 0.00 H -ATOM 692 HB3 LYS 45 -3.483 0.573 -32.473 1.00 0.00 H -ATOM 693 CG LYS 45 -4.687 2.305 -32.890 1.00 0.00 C -ATOM 694 HG2 LYS 45 -4.614 2.566 -31.834 1.00 0.00 H -ATOM 695 HG3 LYS 45 -4.779 3.247 -33.429 1.00 0.00 H -ATOM 696 CD LYS 45 -5.954 1.546 -33.062 1.00 0.00 C -ATOM 697 HD2 LYS 45 -5.939 1.177 -34.087 1.00 0.00 H -ATOM 698 HD3 LYS 45 -5.974 0.644 -32.451 1.00 0.00 H -ATOM 699 CE LYS 45 -7.186 2.347 -32.809 1.00 0.00 C -ATOM 700 HE2 LYS 45 -7.074 2.767 -31.810 1.00 0.00 H -ATOM 701 HE3 LYS 45 -7.289 3.177 -33.507 1.00 0.00 H -ATOM 702 NZ LYS 45 -8.396 1.435 -32.923 1.00 0.00 N -ATOM 703 HZ1 LYS 45 -9.204 2.032 -32.821 1.00 0.00 H -ATOM 704 HZ2 LYS 45 -8.460 1.060 -33.859 1.00 0.00 H -ATOM 705 HZ3 LYS 45 -8.469 0.653 -32.288 1.00 0.00 H -ATOM 706 C LYS 45 -1.054 1.239 -32.906 1.00 0.00 C -ATOM 707 O LYS 45 -0.959 0.422 -31.985 1.00 0.00 O -ATOM 708 N SER 46 -0.198 1.343 -33.824 1.00 0.00 N -ATOM 709 H SER 46 -0.371 1.963 -34.603 1.00 0.00 H -ATOM 710 CA SER 46 1.068 0.503 -33.907 1.00 0.00 C -ATOM 711 HA SER 46 0.742 -0.500 -33.633 1.00 0.00 H -ATOM 712 CB SER 46 1.662 0.510 -35.359 1.00 0.00 C -ATOM 713 HB2 SER 46 2.439 -0.254 -35.392 1.00 0.00 H -ATOM 714 HB3 SER 46 0.956 0.232 -36.143 1.00 0.00 H -ATOM 715 OG SER 46 2.184 1.784 -35.741 1.00 0.00 O -ATOM 716 HG SER 46 1.422 2.365 -35.687 1.00 0.00 H -ATOM 717 C SER 46 2.190 0.951 -32.997 1.00 0.00 C -ATOM 718 O SER 46 3.013 0.148 -32.559 1.00 0.00 O -ATOM 719 N SER 47 2.285 2.195 -32.607 1.00 0.00 N -ATOM 720 H SER 47 1.531 2.782 -32.935 1.00 0.00 H -ATOM 721 CA SER 47 3.353 2.766 -31.808 1.00 0.00 C -ATOM 722 HA SER 47 4.290 2.211 -31.851 1.00 0.00 H -ATOM 723 CB SER 47 3.638 4.218 -32.317 1.00 0.00 C -ATOM 724 HB2 SER 47 4.527 4.562 -31.789 1.00 0.00 H -ATOM 725 HB3 SER 47 3.816 4.326 -33.387 1.00 0.00 H -ATOM 726 OG SER 47 2.634 5.158 -32.118 1.00 0.00 O -ATOM 727 HG SER 47 2.792 5.368 -31.194 1.00 0.00 H -ATOM 728 C SER 47 3.021 2.890 -30.340 1.00 0.00 C -ATOM 729 O SER 47 3.915 2.822 -29.507 1.00 0.00 O -ATOM 730 N ARG 48 1.728 2.933 -29.947 1.00 0.00 N -ATOM 731 H ARG 48 1.058 2.947 -30.703 1.00 0.00 H -ATOM 732 CA ARG 48 1.241 2.939 -28.583 1.00 0.00 C -ATOM 733 HA ARG 48 1.866 3.662 -28.059 1.00 0.00 H -ATOM 734 CB ARG 48 -0.250 3.410 -28.495 1.00 0.00 C -ATOM 735 HB2 ARG 48 -0.574 3.588 -27.470 1.00 0.00 H -ATOM 736 HB3 ARG 48 -0.321 4.311 -29.104 1.00 0.00 H -ATOM 737 CG ARG 48 -1.222 2.361 -29.058 1.00 0.00 C -ATOM 738 HG2 ARG 48 -0.995 2.133 -30.100 1.00 0.00 H -ATOM 739 HG3 ARG 48 -1.284 1.432 -28.492 1.00 0.00 H -ATOM 740 CD ARG 48 -2.682 2.825 -28.846 1.00 0.00 C -ATOM 741 HD2 ARG 48 -3.410 2.030 -29.011 1.00 0.00 H -ATOM 742 HD3 ARG 48 -2.903 2.912 -27.782 1.00 0.00 H -ATOM 743 NE ARG 48 -3.125 3.989 -29.687 1.00 0.00 N -ATOM 744 HE ARG 48 -2.404 4.616 -30.011 1.00 0.00 H -ATOM 745 CZ ARG 48 -4.303 4.598 -29.562 1.00 0.00 C -ATOM 746 NH1 ARG 48 -5.353 4.073 -28.994 1.00 0.00 N -ATOM 747 HH11 ARG 48 -5.383 3.090 -28.767 1.00 0.00 H -ATOM 748 HH12 ARG 48 -6.133 4.691 -28.822 1.00 0.00 H -ATOM 749 NH2 ARG 48 -4.416 5.840 -30.012 1.00 0.00 N -ATOM 750 HH21 ARG 48 -3.652 6.368 -30.409 1.00 0.00 H -ATOM 751 HH22 ARG 48 -5.313 6.294 -29.908 1.00 0.00 H -ATOM 752 C ARG 48 1.404 1.531 -27.945 1.00 0.00 C -ATOM 753 O ARG 48 1.171 0.482 -28.527 1.00 0.00 O -ATOM 754 N LYS 49 1.883 1.513 -26.699 1.00 0.00 N -ATOM 755 H LYS 49 2.118 2.429 -26.343 1.00 0.00 H -ATOM 756 CA LYS 49 2.424 0.311 -25.923 1.00 0.00 C -ATOM 757 HA LYS 49 2.763 -0.408 -26.668 1.00 0.00 H -ATOM 758 CB LYS 49 3.646 0.720 -25.064 1.00 0.00 C -ATOM 759 HB2 LYS 49 3.568 1.746 -24.705 1.00 0.00 H -ATOM 760 HB3 LYS 49 3.733 0.043 -24.214 1.00 0.00 H -ATOM 761 CG LYS 49 4.887 0.610 -25.919 1.00 0.00 C -ATOM 762 HG2 LYS 49 4.887 -0.416 -26.288 1.00 0.00 H -ATOM 763 HG3 LYS 49 4.891 1.279 -26.779 1.00 0.00 H -ATOM 764 CD LYS 49 6.132 0.873 -25.050 1.00 0.00 C -ATOM 765 HD2 LYS 49 6.113 1.955 -24.920 1.00 0.00 H -ATOM 766 HD3 LYS 49 6.033 0.340 -24.104 1.00 0.00 H -ATOM 767 CE LYS 49 7.377 0.355 -25.729 1.00 0.00 C -ATOM 768 HE2 LYS 49 7.283 -0.725 -25.835 1.00 0.00 H -ATOM 769 HE3 LYS 49 7.369 0.772 -26.736 1.00 0.00 H -ATOM 770 NZ LYS 49 8.573 0.652 -24.947 1.00 0.00 N -ATOM 771 HZ1 LYS 49 9.384 0.358 -25.472 1.00 0.00 H -ATOM 772 HZ2 LYS 49 8.668 1.652 -24.839 1.00 0.00 H -ATOM 773 HZ3 LYS 49 8.556 0.162 -24.064 1.00 0.00 H -ATOM 774 C LYS 49 1.280 -0.242 -25.030 1.00 0.00 C -ATOM 775 O LYS 49 0.794 0.381 -24.105 1.00 0.00 O -ATOM 776 N THR 50 0.807 -1.366 -25.491 1.00 0.00 N -ATOM 777 H THR 50 1.243 -1.819 -26.281 1.00 0.00 H -ATOM 778 CA THR 50 -0.254 -2.040 -24.715 1.00 0.00 C -ATOM 779 HA THR 50 -0.836 -1.313 -24.149 1.00 0.00 H -ATOM 780 CB THR 50 -1.183 -2.690 -25.801 1.00 0.00 C -ATOM 781 HB THR 50 -0.577 -3.490 -26.227 1.00 0.00 H -ATOM 782 CG2 THR 50 -2.461 -3.258 -25.336 1.00 0.00 C -ATOM 783 HG21 THR 50 -2.912 -2.397 -24.844 1.00 0.00 H -ATOM 784 HG22 THR 50 -3.117 -3.569 -26.150 1.00 0.00 H -ATOM 785 HG23 THR 50 -2.171 -4.033 -24.626 1.00 0.00 H -ATOM 786 OG1 THR 50 -1.480 -1.810 -26.818 1.00 0.00 O -ATOM 787 HG1 THR 50 -0.964 -1.970 -27.612 1.00 0.00 H -ATOM 788 C THR 50 0.218 -2.976 -23.645 1.00 0.00 C -ATOM 789 O THR 50 1.117 -3.831 -23.797 1.00 0.00 O -ATOM 790 N TYR 51 -0.343 -2.832 -22.470 1.00 0.00 N -ATOM 791 H TYR 51 -1.097 -2.204 -22.232 1.00 0.00 H -ATOM 792 CA TYR 51 -0.184 -3.693 -21.304 1.00 0.00 C -ATOM 793 HA TYR 51 0.496 -4.506 -21.560 1.00 0.00 H -ATOM 794 CB TYR 51 0.478 -2.854 -20.210 1.00 0.00 C -ATOM 795 HB2 TYR 51 -0.293 -2.154 -19.888 1.00 0.00 H -ATOM 796 HB3 TYR 51 0.662 -3.548 -19.390 1.00 0.00 H -ATOM 797 CG TYR 51 1.853 -2.304 -20.542 1.00 0.00 C -ATOM 798 CD1 TYR 51 2.992 -2.963 -20.201 1.00 0.00 C -ATOM 799 HD1 TYR 51 2.840 -3.903 -19.692 1.00 0.00 H -ATOM 800 CE1 TYR 51 4.226 -2.437 -20.457 1.00 0.00 C -ATOM 801 HE1 TYR 51 5.085 -3.027 -20.172 1.00 0.00 H -ATOM 802 CZ TYR 51 4.388 -1.205 -21.112 1.00 0.00 C -ATOM 803 OH TYR 51 5.605 -0.713 -21.525 1.00 0.00 O -ATOM 804 HH TYR 51 6.198 -1.457 -21.397 1.00 0.00 H -ATOM 805 CE2 TYR 51 3.222 -0.471 -21.421 1.00 0.00 C -ATOM 806 HE2 TYR 51 3.307 0.522 -21.836 1.00 0.00 H -ATOM 807 CD2 TYR 51 1.943 -0.977 -21.074 1.00 0.00 C -ATOM 808 HD2 TYR 51 1.123 -0.326 -21.338 1.00 0.00 H -ATOM 809 C TYR 51 -1.550 -4.357 -20.926 1.00 0.00 C -ATOM 810 O TYR 51 -2.621 -3.784 -21.182 1.00 0.00 O -ATOM 811 N THR 52 -1.635 -5.573 -20.353 1.00 0.00 N -ATOM 812 H THR 52 -0.779 -5.980 -20.005 1.00 0.00 H -ATOM 813 CA THR 52 -2.811 -6.175 -19.729 1.00 0.00 C -ATOM 814 HA THR 52 -3.577 -5.413 -19.877 1.00 0.00 H -ATOM 815 CB THR 52 -3.351 -7.358 -20.602 1.00 0.00 C -ATOM 816 HB THR 52 -3.354 -7.150 -21.672 1.00 0.00 H -ATOM 817 CG2 THR 52 -2.377 -8.462 -20.485 1.00 0.00 C -ATOM 818 HG21 THR 52 -2.197 -8.709 -19.439 1.00 0.00 H -ATOM 819 HG22 THR 52 -2.868 -9.325 -20.936 1.00 0.00 H -ATOM 820 HG23 THR 52 -1.470 -8.251 -21.051 1.00 0.00 H -ATOM 821 OG1 THR 52 -4.605 -7.843 -20.347 1.00 0.00 O -ATOM 822 HG1 THR 52 -5.239 -7.179 -20.066 1.00 0.00 H -ATOM 823 C THR 52 -2.681 -6.521 -18.278 1.00 0.00 C -ATOM 824 O THR 52 -1.581 -6.896 -17.826 1.00 0.00 O -ATOM 825 N PHE 53 -3.777 -6.421 -17.519 1.00 0.00 N -ATOM 826 H PHE 53 -4.621 -6.082 -17.958 1.00 0.00 H -ATOM 827 CA PHE 53 -3.805 -6.668 -16.067 1.00 0.00 C -ATOM 828 HA PHE 53 -2.839 -7.061 -15.750 1.00 0.00 H -ATOM 829 CB PHE 53 -3.775 -5.267 -15.355 1.00 0.00 C -ATOM 830 HB2 PHE 53 -4.563 -4.657 -15.798 1.00 0.00 H -ATOM 831 HB3 PHE 53 -4.077 -5.193 -14.310 1.00 0.00 H -ATOM 832 CG PHE 53 -2.429 -4.608 -15.517 1.00 0.00 C -ATOM 833 CD1 PHE 53 -1.285 -5.125 -14.848 1.00 0.00 C -ATOM 834 HD1 PHE 53 -1.460 -5.750 -13.985 1.00 0.00 H -ATOM 835 CE1 PHE 53 0.001 -4.650 -15.072 1.00 0.00 C -ATOM 836 HE1 PHE 53 0.712 -4.829 -14.278 1.00 0.00 H -ATOM 837 CZ PHE 53 0.260 -3.725 -16.082 1.00 0.00 C -ATOM 838 HZ PHE 53 1.247 -3.331 -16.273 1.00 0.00 H -ATOM 839 CE2 PHE 53 -0.890 -3.212 -16.780 1.00 0.00 C -ATOM 840 HE2 PHE 53 -0.774 -2.460 -17.546 1.00 0.00 H -ATOM 841 CD2 PHE 53 -2.190 -3.594 -16.445 1.00 0.00 C -ATOM 842 HD2 PHE 53 -3.017 -3.165 -16.992 1.00 0.00 H -ATOM 843 C PHE 53 -5.009 -7.478 -15.520 1.00 0.00 C -ATOM 844 O PHE 53 -5.791 -8.096 -16.278 1.00 0.00 O -ATOM 845 N ASP 54 -5.133 -7.513 -14.201 1.00 0.00 N -ATOM 846 H ASP 54 -4.452 -7.080 -13.593 1.00 0.00 H -ATOM 847 CA ASP 54 -6.242 -8.246 -13.475 1.00 0.00 C -ATOM 848 HA ASP 54 -6.586 -9.112 -14.040 1.00 0.00 H -ATOM 849 CB ASP 54 -5.720 -8.803 -12.090 1.00 0.00 C -ATOM 850 HB2 ASP 54 -5.273 -7.961 -11.562 1.00 0.00 H -ATOM 851 HB3 ASP 54 -6.536 -9.272 -11.540 1.00 0.00 H -ATOM 852 CG ASP 54 -4.644 -9.892 -12.297 1.00 0.00 C -ATOM 853 OD1 ASP 54 -3.668 -10.008 -11.538 1.00 0.00 O -ATOM 854 OD2 ASP 54 -4.695 -10.606 -13.344 1.00 0.00 O -ATOM 855 C ASP 54 -7.446 -7.435 -13.194 1.00 0.00 C -ATOM 856 O ASP 54 -8.571 -7.920 -13.362 1.00 0.00 O -ATOM 857 N MET 55 -7.311 -6.179 -12.853 1.00 0.00 N -ATOM 858 H MET 55 -6.362 -5.833 -12.842 1.00 0.00 H -ATOM 859 CA MET 55 -8.431 -5.184 -12.766 1.00 0.00 C -ATOM 860 HA MET 55 -9.241 -5.534 -13.406 1.00 0.00 H -ATOM 861 CB MET 55 -8.941 -5.082 -11.299 1.00 0.00 C -ATOM 862 HB2 MET 55 -8.366 -4.417 -10.654 1.00 0.00 H -ATOM 863 HB3 MET 55 -9.867 -4.515 -11.391 1.00 0.00 H -ATOM 864 CG MET 55 -9.141 -6.448 -10.627 1.00 0.00 C -ATOM 865 HG2 MET 55 -9.782 -6.916 -11.374 1.00 0.00 H -ATOM 866 HG3 MET 55 -8.163 -6.929 -10.603 1.00 0.00 H -ATOM 867 SD MET 55 -9.926 -6.505 -9.054 1.00 0.00 S -ATOM 868 CE MET 55 -11.698 -6.850 -9.543 1.00 0.00 C -ATOM 869 HE1 MET 55 -12.329 -6.851 -8.654 1.00 0.00 H -ATOM 870 HE2 MET 55 -12.143 -6.091 -10.185 1.00 0.00 H -ATOM 871 HE3 MET 55 -11.858 -7.771 -10.104 1.00 0.00 H -ATOM 872 C MET 55 -7.919 -3.837 -13.295 1.00 0.00 C -ATOM 873 O MET 55 -6.711 -3.559 -13.313 1.00 0.00 O -ATOM 874 N VAL 56 -8.844 -3.066 -13.874 1.00 0.00 N -ATOM 875 H VAL 56 -9.821 -3.318 -13.834 1.00 0.00 H -ATOM 876 CA VAL 56 -8.492 -1.735 -14.406 1.00 0.00 C -ATOM 877 HA VAL 56 -7.524 -1.452 -13.993 1.00 0.00 H -ATOM 878 CB VAL 56 -8.327 -1.779 -15.919 1.00 0.00 C -ATOM 879 HB VAL 56 -9.262 -2.061 -16.403 1.00 0.00 H -ATOM 880 CG1 VAL 56 -7.971 -0.392 -16.500 1.00 0.00 C -ATOM 881 HG11 VAL 56 -7.602 -0.597 -17.505 1.00 0.00 H -ATOM 882 HG12 VAL 56 -8.805 0.309 -16.528 1.00 0.00 H -ATOM 883 HG13 VAL 56 -7.085 -0.026 -15.982 1.00 0.00 H -ATOM 884 CG2 VAL 56 -7.196 -2.813 -16.327 1.00 0.00 C -ATOM 885 HG21 VAL 56 -6.900 -2.659 -17.365 1.00 0.00 H -ATOM 886 HG22 VAL 56 -6.311 -2.544 -15.750 1.00 0.00 H -ATOM 887 HG23 VAL 56 -7.430 -3.863 -16.156 1.00 0.00 H -ATOM 888 C VAL 56 -9.534 -0.697 -14.019 1.00 0.00 C -ATOM 889 O VAL 56 -10.693 -0.837 -14.397 1.00 0.00 O -ATOM 890 N PHE 57 -9.119 0.276 -13.191 1.00 0.00 N -ATOM 891 H PHE 57 -8.134 0.330 -12.977 1.00 0.00 H -ATOM 892 CA PHE 57 -9.977 1.396 -12.791 1.00 0.00 C -ATOM 893 HA PHE 57 -11.010 1.119 -13.004 1.00 0.00 H -ATOM 894 CB PHE 57 -9.841 1.600 -11.253 1.00 0.00 C -ATOM 895 HB2 PHE 57 -8.818 1.935 -11.081 1.00 0.00 H -ATOM 896 HB3 PHE 57 -10.496 2.439 -11.021 1.00 0.00 H -ATOM 897 CG PHE 57 -10.000 0.331 -10.458 1.00 0.00 C -ATOM 898 CD1 PHE 57 -11.240 -0.298 -10.311 1.00 0.00 C -ATOM 899 HD1 PHE 57 -12.159 0.137 -10.676 1.00 0.00 H -ATOM 900 CE1 PHE 57 -11.349 -1.529 -9.682 1.00 0.00 C -ATOM 901 HE1 PHE 57 -12.271 -2.091 -9.692 1.00 0.00 H -ATOM 902 CZ PHE 57 -10.213 -2.244 -9.220 1.00 0.00 C -ATOM 903 HZ PHE 57 -10.302 -3.241 -8.813 1.00 0.00 H -ATOM 904 CE2 PHE 57 -8.998 -1.620 -9.252 1.00 0.00 C -ATOM 905 HE2 PHE 57 -8.120 -2.143 -8.902 1.00 0.00 H -ATOM 906 CD2 PHE 57 -8.882 -0.307 -9.833 1.00 0.00 C -ATOM 907 HD2 PHE 57 -7.946 0.225 -9.911 1.00 0.00 H -ATOM 908 C PHE 57 -9.615 2.676 -13.589 1.00 0.00 C -ATOM 909 O PHE 57 -8.609 3.406 -13.508 1.00 0.00 O -ATOM 910 N GLY 58 -10.582 3.005 -14.451 1.00 0.00 N -ATOM 911 H GLY 58 -11.385 2.394 -14.495 1.00 0.00 H -ATOM 912 CA GLY 58 -10.653 4.288 -15.064 1.00 0.00 C -ATOM 913 HA2 GLY 58 -9.782 4.273 -15.721 1.00 0.00 H -ATOM 914 HA3 GLY 58 -11.595 4.262 -15.612 1.00 0.00 H -ATOM 915 C GLY 58 -10.751 5.482 -14.081 1.00 0.00 C -ATOM 916 O GLY 58 -11.231 5.327 -12.925 1.00 0.00 O -ATOM 917 N ALA 59 -10.376 6.665 -14.570 1.00 0.00 N -ATOM 918 H ALA 59 -9.977 6.558 -15.492 1.00 0.00 H -ATOM 919 CA ALA 59 -10.343 7.892 -13.812 1.00 0.00 C -ATOM 920 HA ALA 59 -9.617 7.835 -13.001 1.00 0.00 H -ATOM 921 CB ALA 59 -9.862 9.062 -14.692 1.00 0.00 C -ATOM 922 HB1 ALA 59 -10.322 9.038 -15.681 1.00 0.00 H -ATOM 923 HB2 ALA 59 -10.059 10.000 -14.173 1.00 0.00 H -ATOM 924 HB3 ALA 59 -8.820 8.857 -14.936 1.00 0.00 H -ATOM 925 C ALA 59 -11.765 8.254 -13.205 1.00 0.00 C -ATOM 926 O ALA 59 -11.895 8.742 -12.072 1.00 0.00 O -ATOM 927 N SER 60 -12.845 8.006 -13.956 1.00 0.00 N -ATOM 928 H SER 60 -12.775 7.444 -14.792 1.00 0.00 H -ATOM 929 CA SER 60 -14.245 8.242 -13.339 1.00 0.00 C -ATOM 930 HA SER 60 -14.384 9.231 -12.902 1.00 0.00 H -ATOM 931 CB SER 60 -15.287 8.284 -14.427 1.00 0.00 C -ATOM 932 HB2 SER 60 -16.283 8.444 -14.014 1.00 0.00 H -ATOM 933 HB3 SER 60 -15.111 9.170 -15.037 1.00 0.00 H -ATOM 934 OG SER 60 -15.314 7.021 -15.123 1.00 0.00 O -ATOM 935 HG SER 60 -15.728 7.212 -15.967 1.00 0.00 H -ATOM 936 C SER 60 -14.656 7.307 -12.158 1.00 0.00 C -ATOM 937 O SER 60 -15.595 7.648 -11.421 1.00 0.00 O -ATOM 938 N THR 61 -13.980 6.158 -11.989 1.00 0.00 N -ATOM 939 H THR 61 -13.239 5.922 -12.634 1.00 0.00 H -ATOM 940 CA THR 61 -14.546 5.178 -11.051 1.00 0.00 C -ATOM 941 HA THR 61 -15.604 5.031 -11.269 1.00 0.00 H -ATOM 942 CB THR 61 -13.713 3.884 -11.017 1.00 0.00 C -ATOM 943 HB THR 61 -12.706 4.186 -10.729 1.00 0.00 H -ATOM 944 CG2 THR 61 -14.162 2.700 -10.128 1.00 0.00 C -ATOM 945 HG21 THR 61 -13.340 2.019 -9.902 1.00 0.00 H -ATOM 946 HG22 THR 61 -14.503 3.079 -9.164 1.00 0.00 H -ATOM 947 HG23 THR 61 -15.042 2.219 -10.556 1.00 0.00 H -ATOM 948 OG1 THR 61 -13.585 3.296 -12.280 1.00 0.00 O -ATOM 949 HG1 THR 61 -13.578 3.924 -13.006 1.00 0.00 H -ATOM 950 C THR 61 -14.558 5.711 -9.633 1.00 0.00 C -ATOM 951 O THR 61 -13.525 6.192 -9.146 1.00 0.00 O -ATOM 952 N LYS 62 -15.659 5.432 -8.932 1.00 0.00 N -ATOM 953 H LYS 62 -16.351 4.782 -9.275 1.00 0.00 H -ATOM 954 CA LYS 62 -15.835 5.942 -7.550 1.00 0.00 C -ATOM 955 HA LYS 62 -15.397 6.939 -7.586 1.00 0.00 H -ATOM 956 CB LYS 62 -17.372 6.001 -7.245 1.00 0.00 C -ATOM 957 HB2 LYS 62 -17.774 5.056 -7.612 1.00 0.00 H -ATOM 958 HB3 LYS 62 -17.485 6.243 -6.189 1.00 0.00 H -ATOM 959 CG LYS 62 -17.944 7.149 -8.098 1.00 0.00 C -ATOM 960 HG2 LYS 62 -17.480 8.092 -7.808 1.00 0.00 H -ATOM 961 HG3 LYS 62 -17.610 7.060 -9.132 1.00 0.00 H -ATOM 962 CD LYS 62 -19.508 7.294 -8.022 1.00 0.00 C -ATOM 963 HD2 LYS 62 -19.697 7.630 -7.003 1.00 0.00 H -ATOM 964 HD3 LYS 62 -19.783 8.017 -8.790 1.00 0.00 H -ATOM 965 CE LYS 62 -20.389 6.075 -8.401 1.00 0.00 C -ATOM 966 HE2 LYS 62 -20.177 5.830 -9.441 1.00 0.00 H -ATOM 967 HE3 LYS 62 -20.010 5.252 -7.795 1.00 0.00 H -ATOM 968 NZ LYS 62 -21.875 6.280 -8.233 1.00 0.00 N -ATOM 969 HZ1 LYS 62 -22.401 5.418 -8.206 1.00 0.00 H -ATOM 970 HZ2 LYS 62 -22.014 6.587 -7.281 1.00 0.00 H -ATOM 971 HZ3 LYS 62 -22.326 6.942 -8.849 1.00 0.00 H -ATOM 972 C LYS 62 -14.991 5.133 -6.503 1.00 0.00 C -ATOM 973 O LYS 62 -14.794 3.896 -6.699 1.00 0.00 O -ATOM 974 N GLN 63 -14.579 5.698 -5.366 1.00 0.00 N -ATOM 975 H GLN 63 -14.786 6.665 -5.162 1.00 0.00 H -ATOM 976 CA GLN 63 -13.819 5.076 -4.301 1.00 0.00 C -ATOM 977 HA GLN 63 -12.813 4.777 -4.595 1.00 0.00 H -ATOM 978 CB GLN 63 -13.587 6.068 -3.179 1.00 0.00 C -ATOM 979 HB2 GLN 63 -14.574 6.489 -2.987 1.00 0.00 H -ATOM 980 HB3 GLN 63 -13.202 5.582 -2.283 1.00 0.00 H -ATOM 981 CG GLN 63 -12.612 7.213 -3.439 1.00 0.00 C -ATOM 982 HG2 GLN 63 -12.519 7.503 -4.486 1.00 0.00 H -ATOM 983 HG3 GLN 63 -12.902 8.130 -2.926 1.00 0.00 H -ATOM 984 CD GLN 63 -11.130 6.842 -3.092 1.00 0.00 C -ATOM 985 OE1 GLN 63 -10.530 6.020 -3.787 1.00 0.00 O -ATOM 986 NE2 GLN 63 -10.569 7.426 -2.126 1.00 0.00 N -ATOM 987 HE21 GLN 63 -9.642 7.136 -1.851 1.00 0.00 H -ATOM 988 HE22 GLN 63 -10.920 8.283 -1.724 1.00 0.00 H -ATOM 989 C GLN 63 -14.480 3.804 -3.618 1.00 0.00 C -ATOM 990 O GLN 63 -13.701 2.880 -3.293 1.00 0.00 O -ATOM 991 N ILE 64 -15.833 3.692 -3.539 1.00 0.00 N -ATOM 992 H ILE 64 -16.341 4.564 -3.495 1.00 0.00 H -ATOM 993 CA ILE 64 -16.528 2.436 -3.041 1.00 0.00 C -ATOM 994 HA ILE 64 -15.977 2.084 -2.169 1.00 0.00 H -ATOM 995 CB ILE 64 -17.961 2.771 -2.481 1.00 0.00 C -ATOM 996 HB ILE 64 -17.892 3.492 -1.667 1.00 0.00 H -ATOM 997 CG2 ILE 64 -18.849 3.501 -3.533 1.00 0.00 C -ATOM 998 HG21 ILE 64 -19.771 3.854 -3.071 1.00 0.00 H -ATOM 999 HG22 ILE 64 -18.410 4.446 -3.851 1.00 0.00 H -ATOM 1000 HG23 ILE 64 -19.053 2.806 -4.348 1.00 0.00 H -ATOM 1001 CG1 ILE 64 -18.632 1.552 -1.848 1.00 0.00 C -ATOM 1002 HG12 ILE 64 -19.708 1.682 -1.741 1.00 0.00 H -ATOM 1003 HG13 ILE 64 -18.686 0.745 -2.579 1.00 0.00 H -ATOM 1004 CD1 ILE 64 -17.967 1.119 -0.516 1.00 0.00 C -ATOM 1005 HD11 ILE 64 -18.462 0.254 -0.075 1.00 0.00 H -ATOM 1006 HD12 ILE 64 -16.935 0.861 -0.755 1.00 0.00 H -ATOM 1007 HD13 ILE 64 -18.009 1.902 0.241 1.00 0.00 H -ATOM 1008 C ILE 64 -16.479 1.304 -4.002 1.00 0.00 C -ATOM 1009 O ILE 64 -16.409 0.176 -3.704 1.00 0.00 O -ATOM 1010 N ASP 65 -16.675 1.595 -5.277 1.00 0.00 N -ATOM 1011 H ASP 65 -16.815 2.576 -5.472 1.00 0.00 H -ATOM 1012 CA ASP 65 -16.673 0.616 -6.397 1.00 0.00 C -ATOM 1013 HA ASP 65 -17.452 -0.130 -6.240 1.00 0.00 H -ATOM 1014 CB ASP 65 -17.003 1.216 -7.731 1.00 0.00 C -ATOM 1015 HB2 ASP 65 -16.299 2.020 -7.943 1.00 0.00 H -ATOM 1016 HB3 ASP 65 -17.002 0.403 -8.457 1.00 0.00 H -ATOM 1017 CG ASP 65 -18.432 1.812 -7.765 1.00 0.00 C -ATOM 1018 OD1 ASP 65 -19.233 1.768 -6.794 1.00 0.00 O -ATOM 1019 OD2 ASP 65 -18.754 2.288 -8.870 1.00 0.00 O -ATOM 1020 C ASP 65 -15.245 0.035 -6.550 1.00 0.00 C -ATOM 1021 O ASP 65 -15.123 -1.206 -6.784 1.00 0.00 O -ATOM 1022 N VAL 66 -14.173 0.861 -6.225 1.00 0.00 N -ATOM 1023 H VAL 66 -14.352 1.817 -5.952 1.00 0.00 H -ATOM 1024 CA VAL 66 -12.791 0.388 -6.151 1.00 0.00 C -ATOM 1025 HA VAL 66 -12.581 -0.186 -7.054 1.00 0.00 H -ATOM 1026 CB VAL 66 -11.726 1.475 -5.983 1.00 0.00 C -ATOM 1027 HB VAL 66 -12.114 2.283 -5.362 1.00 0.00 H -ATOM 1028 CG1 VAL 66 -10.335 0.957 -5.753 1.00 0.00 C -ATOM 1029 HG11 VAL 66 -10.273 0.591 -4.729 1.00 0.00 H -ATOM 1030 HG12 VAL 66 -10.161 0.226 -6.543 1.00 0.00 H -ATOM 1031 HG13 VAL 66 -9.617 1.776 -5.733 1.00 0.00 H -ATOM 1032 CG2 VAL 66 -11.640 2.131 -7.315 1.00 0.00 C -ATOM 1033 HG21 VAL 66 -10.945 2.970 -7.262 1.00 0.00 H -ATOM 1034 HG22 VAL 66 -11.377 1.543 -8.194 1.00 0.00 H -ATOM 1035 HG23 VAL 66 -12.593 2.619 -7.522 1.00 0.00 H -ATOM 1036 C VAL 66 -12.692 -0.546 -4.932 1.00 0.00 C -ATOM 1037 O VAL 66 -12.183 -1.696 -5.030 1.00 0.00 O -ATOM 1038 N TYR 67 -13.266 -0.213 -3.740 1.00 0.00 N -ATOM 1039 H TYR 67 -13.774 0.658 -3.798 1.00 0.00 H -ATOM 1040 CA TYR 67 -13.226 -1.009 -2.484 1.00 0.00 C -ATOM 1041 HA TYR 67 -12.217 -1.143 -2.097 1.00 0.00 H -ATOM 1042 CB TYR 67 -14.003 -0.192 -1.412 1.00 0.00 C -ATOM 1043 HB2 TYR 67 -13.735 0.864 -1.441 1.00 0.00 H -ATOM 1044 HB3 TYR 67 -15.049 -0.098 -1.706 1.00 0.00 H -ATOM 1045 CG TYR 67 -13.996 -0.875 -0.103 1.00 0.00 C -ATOM 1046 CD1 TYR 67 -15.072 -1.658 0.282 1.00 0.00 C -ATOM 1047 HD1 TYR 67 -15.944 -1.813 -0.336 1.00 0.00 H -ATOM 1048 CE1 TYR 67 -14.921 -2.298 1.466 1.00 0.00 C -ATOM 1049 HE1 TYR 67 -15.660 -3.008 1.804 1.00 0.00 H -ATOM 1050 CZ TYR 67 -13.854 -2.159 2.331 1.00 0.00 C -ATOM 1051 OH TYR 67 -13.800 -2.930 3.513 1.00 0.00 O -ATOM 1052 HH TYR 67 -14.670 -3.321 3.625 1.00 0.00 H -ATOM 1053 CE2 TYR 67 -12.792 -1.324 1.968 1.00 0.00 C -ATOM 1054 HE2 TYR 67 -11.912 -1.181 2.579 1.00 0.00 H -ATOM 1055 CD2 TYR 67 -12.835 -0.740 0.764 1.00 0.00 C -ATOM 1056 HD2 TYR 67 -12.056 -0.053 0.468 1.00 0.00 H -ATOM 1057 C TYR 67 -13.855 -2.363 -2.704 1.00 0.00 C -ATOM 1058 O TYR 67 -13.245 -3.418 -2.570 1.00 0.00 O -ATOM 1059 N ARG 68 -15.066 -2.370 -3.217 1.00 0.00 N -ATOM 1060 H ARG 68 -15.423 -1.456 -3.454 1.00 0.00 H -ATOM 1061 CA ARG 68 -15.883 -3.551 -3.477 1.00 0.00 C -ATOM 1062 HA ARG 68 -15.950 -4.011 -2.491 1.00 0.00 H -ATOM 1063 CB ARG 68 -17.208 -3.074 -4.043 1.00 0.00 C -ATOM 1064 HB2 ARG 68 -17.602 -2.121 -3.690 1.00 0.00 H -ATOM 1065 HB3 ARG 68 -17.114 -3.037 -5.128 1.00 0.00 H -ATOM 1066 CG ARG 68 -18.333 -4.045 -3.776 1.00 0.00 C -ATOM 1067 HG2 ARG 68 -18.215 -5.105 -4.004 1.00 0.00 H -ATOM 1068 HG3 ARG 68 -18.666 -4.067 -2.739 1.00 0.00 H -ATOM 1069 CD ARG 68 -19.584 -3.539 -4.533 1.00 0.00 C -ATOM 1070 HD2 ARG 68 -19.339 -3.358 -5.580 1.00 0.00 H -ATOM 1071 HD3 ARG 68 -20.265 -4.391 -4.531 1.00 0.00 H -ATOM 1072 NE ARG 68 -20.171 -2.337 -3.879 1.00 0.00 N -ATOM 1073 HE ARG 68 -20.373 -2.372 -2.890 1.00 0.00 H -ATOM 1074 CZ ARG 68 -20.362 -1.158 -4.481 1.00 0.00 C -ATOM 1075 NH1 ARG 68 -19.816 -0.815 -5.610 1.00 0.00 N -ATOM 1076 HH11 ARG 68 -19.506 -1.542 -6.240 1.00 0.00 H -ATOM 1077 HH12 ARG 68 -19.710 0.144 -5.907 1.00 0.00 H -ATOM 1078 NH2 ARG 68 -20.978 -0.150 -3.921 1.00 0.00 N -ATOM 1079 HH21 ARG 68 -21.412 -0.173 -3.009 1.00 0.00 H -ATOM 1080 HH22 ARG 68 -21.156 0.641 -4.524 1.00 0.00 H -ATOM 1081 C ARG 68 -15.183 -4.593 -4.420 1.00 0.00 C -ATOM 1082 O ARG 68 -15.441 -5.824 -4.245 1.00 0.00 O -ATOM 1083 N SER 69 -14.321 -4.117 -5.314 1.00 0.00 N -ATOM 1084 H SER 69 -14.306 -3.107 -5.315 1.00 0.00 H -ATOM 1085 CA SER 69 -13.670 -4.944 -6.311 1.00 0.00 C -ATOM 1086 HA SER 69 -14.295 -5.832 -6.410 1.00 0.00 H -ATOM 1087 CB SER 69 -13.721 -4.174 -7.669 1.00 0.00 C -ATOM 1088 HB2 SER 69 -13.101 -3.277 -7.666 1.00 0.00 H -ATOM 1089 HB3 SER 69 -13.388 -4.887 -8.423 1.00 0.00 H -ATOM 1090 OG SER 69 -15.071 -3.746 -7.889 1.00 0.00 O -ATOM 1091 HG SER 69 -15.082 -2.848 -7.549 1.00 0.00 H -ATOM 1092 C SER 69 -12.237 -5.251 -5.921 1.00 0.00 C -ATOM 1093 O SER 69 -11.806 -6.348 -6.240 1.00 0.00 O -ATOM 1094 N VAL 70 -11.525 -4.344 -5.245 1.00 0.00 N -ATOM 1095 H VAL 70 -11.921 -3.445 -5.009 1.00 0.00 H -ATOM 1096 CA VAL 70 -10.120 -4.611 -4.849 1.00 0.00 C -ATOM 1097 HA VAL 70 -9.715 -5.231 -5.649 1.00 0.00 H -ATOM 1098 CB VAL 70 -9.311 -3.243 -4.781 1.00 0.00 C -ATOM 1099 HB VAL 70 -9.772 -2.616 -4.018 1.00 0.00 H -ATOM 1100 CG1 VAL 70 -7.975 -3.512 -4.093 1.00 0.00 C -ATOM 1101 HG11 VAL 70 -7.982 -3.916 -3.081 1.00 0.00 H -ATOM 1102 HG12 VAL 70 -7.338 -4.151 -4.704 1.00 0.00 H -ATOM 1103 HG13 VAL 70 -7.437 -2.566 -4.030 1.00 0.00 H -ATOM 1104 CG2 VAL 70 -8.954 -2.614 -6.095 1.00 0.00 C -ATOM 1105 HG21 VAL 70 -8.197 -1.835 -6.003 1.00 0.00 H -ATOM 1106 HG22 VAL 70 -8.493 -3.391 -6.705 1.00 0.00 H -ATOM 1107 HG23 VAL 70 -9.802 -2.117 -6.566 1.00 0.00 H -ATOM 1108 C VAL 70 -10.121 -5.356 -3.501 1.00 0.00 C -ATOM 1109 O VAL 70 -9.226 -6.207 -3.290 1.00 0.00 O -ATOM 1110 N VAL 71 -11.059 -5.042 -2.594 1.00 0.00 N -ATOM 1111 H VAL 71 -11.769 -4.345 -2.764 1.00 0.00 H -ATOM 1112 CA VAL 71 -10.762 -5.296 -1.056 1.00 0.00 C -ATOM 1113 HA VAL 71 -9.702 -5.529 -0.961 1.00 0.00 H -ATOM 1114 CB VAL 71 -11.127 -4.186 -0.101 1.00 0.00 C -ATOM 1115 HB VAL 71 -12.192 -3.967 -0.182 1.00 0.00 H -ATOM 1116 CG1 VAL 71 -10.764 -4.466 1.401 1.00 0.00 C -ATOM 1117 HG11 VAL 71 -9.757 -4.882 1.433 1.00 0.00 H -ATOM 1118 HG12 VAL 71 -10.931 -3.588 2.025 1.00 0.00 H -ATOM 1119 HG13 VAL 71 -11.458 -5.172 1.859 1.00 0.00 H -ATOM 1120 CG2 VAL 71 -10.295 -2.916 -0.480 1.00 0.00 C -ATOM 1121 HG21 VAL 71 -10.630 -2.216 0.285 1.00 0.00 H -ATOM 1122 HG22 VAL 71 -9.240 -3.145 -0.328 1.00 0.00 H -ATOM 1123 HG23 VAL 71 -10.595 -2.574 -1.471 1.00 0.00 H -ATOM 1124 C VAL 71 -11.585 -6.449 -0.638 1.00 0.00 C -ATOM 1125 O VAL 71 -11.114 -7.372 0.017 1.00 0.00 O -ATOM 1126 N CYS 72 -12.822 -6.556 -1.091 1.00 0.00 N -ATOM 1127 H CYS 72 -13.194 -6.012 -1.856 1.00 0.00 H -ATOM 1128 CA CYS 72 -13.774 -7.429 -0.404 1.00 0.00 C -ATOM 1129 HA CYS 72 -13.641 -7.261 0.665 1.00 0.00 H -ATOM 1130 CB CYS 72 -15.209 -7.079 -0.795 1.00 0.00 C -ATOM 1131 HB2 CYS 72 -15.297 -6.917 -1.870 1.00 0.00 H -ATOM 1132 HB3 CYS 72 -15.933 -7.824 -0.466 1.00 0.00 H -ATOM 1133 SG CYS 72 -15.559 -5.456 -0.146 1.00 0.00 S -ATOM 1134 HG CYS 72 -16.847 -5.694 0.120 1.00 0.00 H -ATOM 1135 C CYS 72 -13.483 -9.026 -0.601 1.00 0.00 C -ATOM 1136 O CYS 72 -13.758 -9.730 0.385 1.00 0.00 O -ATOM 1137 N PRO 73 -12.964 -9.588 -1.728 1.00 0.00 N -ATOM 1138 CD PRO 73 -12.770 -8.906 -2.992 1.00 0.00 C -ATOM 1139 HD2 PRO 73 -11.888 -8.272 -2.905 1.00 0.00 H -ATOM 1140 HD3 PRO 73 -13.654 -8.422 -3.407 1.00 0.00 H -ATOM 1141 CG PRO 73 -12.538 -10.094 -3.967 1.00 0.00 C -ATOM 1142 HG2 PRO 73 -11.708 -9.964 -4.661 1.00 0.00 H -ATOM 1143 HG3 PRO 73 -13.457 -10.258 -4.530 1.00 0.00 H -ATOM 1144 CB PRO 73 -12.151 -11.305 -3.132 1.00 0.00 C -ATOM 1145 HB2 PRO 73 -11.072 -11.447 -3.189 1.00 0.00 H -ATOM 1146 HB3 PRO 73 -12.562 -12.273 -3.419 1.00 0.00 H -ATOM 1147 CA PRO 73 -12.577 -11.019 -1.684 1.00 0.00 C -ATOM 1148 HA PRO 73 -13.369 -11.681 -1.333 1.00 0.00 H -ATOM 1149 C PRO 73 -11.387 -11.235 -0.732 1.00 0.00 C -ATOM 1150 O PRO 73 -11.151 -12.319 -0.191 1.00 0.00 O -ATOM 1151 N ILE 74 -10.597 -10.224 -0.428 1.00 0.00 N -ATOM 1152 H ILE 74 -10.648 -9.345 -0.923 1.00 0.00 H -ATOM 1153 CA ILE 74 -9.415 -10.312 0.425 1.00 0.00 C -ATOM 1154 HA ILE 74 -8.973 -11.296 0.274 1.00 0.00 H -ATOM 1155 CB ILE 74 -8.362 -9.272 0.109 1.00 0.00 C -ATOM 1156 HB ILE 74 -8.791 -8.304 -0.150 1.00 0.00 H -ATOM 1157 CG2 ILE 74 -7.457 -8.989 1.286 1.00 0.00 C -ATOM 1158 HG21 ILE 74 -6.554 -8.532 0.882 1.00 0.00 H -ATOM 1159 HG22 ILE 74 -7.935 -8.157 1.804 1.00 0.00 H -ATOM 1160 HG23 ILE 74 -7.166 -9.930 1.751 1.00 0.00 H -ATOM 1161 CG1 ILE 74 -7.743 -9.841 -1.225 1.00 0.00 C -ATOM 1162 HG12 ILE 74 -7.455 -10.884 -1.093 1.00 0.00 H -ATOM 1163 HG13 ILE 74 -8.459 -9.807 -2.046 1.00 0.00 H -ATOM 1164 CD1 ILE 74 -6.524 -9.170 -1.698 1.00 0.00 C -ATOM 1165 HD11 ILE 74 -6.120 -9.708 -2.556 1.00 0.00 H -ATOM 1166 HD12 ILE 74 -6.697 -8.112 -1.896 1.00 0.00 H -ATOM 1167 HD13 ILE 74 -5.760 -9.224 -0.922 1.00 0.00 H -ATOM 1168 C ILE 74 -9.926 -10.206 1.835 1.00 0.00 C -ATOM 1169 O ILE 74 -9.546 -11.033 2.697 1.00 0.00 O -ATOM 1170 N LEU 75 -10.788 -9.284 2.185 1.00 0.00 N -ATOM 1171 H LEU 75 -11.148 -8.719 1.429 1.00 0.00 H -ATOM 1172 CA LEU 75 -11.416 -9.189 3.496 1.00 0.00 C -ATOM 1173 HA LEU 75 -10.580 -9.145 4.194 1.00 0.00 H -ATOM 1174 CB LEU 75 -12.071 -7.811 3.786 1.00 0.00 C -ATOM 1175 HB2 LEU 75 -11.403 -7.040 3.403 1.00 0.00 H -ATOM 1176 HB3 LEU 75 -12.968 -7.760 3.168 1.00 0.00 H -ATOM 1177 CG LEU 75 -12.624 -7.557 5.187 1.00 0.00 C -ATOM 1178 HG LEU 75 -13.436 -8.183 5.557 1.00 0.00 H -ATOM 1179 CD1 LEU 75 -11.733 -7.531 6.416 1.00 0.00 C -ATOM 1180 HD11 LEU 75 -11.104 -8.421 6.442 1.00 0.00 H -ATOM 1181 HD12 LEU 75 -11.134 -6.626 6.309 1.00 0.00 H -ATOM 1182 HD13 LEU 75 -12.377 -7.607 7.292 1.00 0.00 H -ATOM 1183 CD2 LEU 75 -13.253 -6.173 5.159 1.00 0.00 C -ATOM 1184 HD21 LEU 75 -12.555 -5.383 4.884 1.00 0.00 H -ATOM 1185 HD22 LEU 75 -14.008 -6.155 4.373 1.00 0.00 H -ATOM 1186 HD23 LEU 75 -13.738 -5.883 6.092 1.00 0.00 H -ATOM 1187 C LEU 75 -12.343 -10.389 3.814 1.00 0.00 C -ATOM 1188 O LEU 75 -12.260 -10.794 4.910 1.00 0.00 O -ATOM 1189 N ASP 76 -13.099 -10.980 2.828 1.00 0.00 N -ATOM 1190 H ASP 76 -13.032 -10.602 1.893 1.00 0.00 H -ATOM 1191 CA ASP 76 -13.454 -12.427 2.911 1.00 0.00 C -ATOM 1192 HA ASP 76 -14.207 -12.457 3.698 1.00 0.00 H -ATOM 1193 CB ASP 76 -14.058 -12.953 1.602 1.00 0.00 C -ATOM 1194 HB2 ASP 76 -13.392 -12.948 0.739 1.00 0.00 H -ATOM 1195 HB3 ASP 76 -14.169 -14.037 1.582 1.00 0.00 H -ATOM 1196 CG ASP 76 -15.416 -12.333 1.257 1.00 0.00 C -ATOM 1197 OD1 ASP 76 -16.020 -12.840 0.255 1.00 0.00 O -ATOM 1198 OD2 ASP 76 -16.016 -11.523 2.011 1.00 0.00 O -ATOM 1199 C ASP 76 -12.337 -13.519 3.267 1.00 0.00 C -ATOM 1200 O ASP 76 -12.555 -14.344 4.101 1.00 0.00 O -ATOM 1201 N GLU 77 -11.108 -13.483 2.736 1.00 0.00 N -ATOM 1202 H GLU 77 -10.904 -12.802 2.019 1.00 0.00 H -ATOM 1203 CA GLU 77 -9.975 -14.403 3.049 1.00 0.00 C -ATOM 1204 HA GLU 77 -10.441 -15.380 2.927 1.00 0.00 H -ATOM 1205 CB GLU 77 -8.845 -14.243 2.035 1.00 0.00 C -ATOM 1206 HB2 GLU 77 -9.282 -14.223 1.037 1.00 0.00 H -ATOM 1207 HB3 GLU 77 -8.428 -13.241 2.140 1.00 0.00 H -ATOM 1208 CG GLU 77 -7.649 -15.193 2.101 1.00 0.00 C -ATOM 1209 HG2 GLU 77 -6.752 -14.802 1.622 1.00 0.00 H -ATOM 1210 HG3 GLU 77 -7.465 -15.296 3.170 1.00 0.00 H -ATOM 1211 CD GLU 77 -7.872 -16.504 1.377 1.00 0.00 C -ATOM 1212 OE1 GLU 77 -8.690 -17.324 1.821 1.00 0.00 O -ATOM 1213 OE2 GLU 77 -7.246 -16.727 0.264 1.00 0.00 O -ATOM 1214 C GLU 77 -9.513 -14.084 4.450 1.00 0.00 C -ATOM 1215 O GLU 77 -9.298 -15.044 5.139 1.00 0.00 O -ATOM 1216 N VAL 78 -9.369 -12.809 4.816 1.00 0.00 N -ATOM 1217 H VAL 78 -9.508 -12.049 4.165 1.00 0.00 H -ATOM 1218 CA VAL 78 -8.820 -12.414 6.130 1.00 0.00 C -ATOM 1219 HA VAL 78 -7.880 -12.905 6.379 1.00 0.00 H -ATOM 1220 CB VAL 78 -8.518 -10.871 6.105 1.00 0.00 C -ATOM 1221 HB VAL 78 -9.414 -10.288 5.892 1.00 0.00 H -ATOM 1222 CG1 VAL 78 -8.082 -10.258 7.439 1.00 0.00 C -ATOM 1223 HG11 VAL 78 -7.132 -9.752 7.264 1.00 0.00 H -ATOM 1224 HG12 VAL 78 -8.799 -9.630 7.966 1.00 0.00 H -ATOM 1225 HG13 VAL 78 -7.831 -11.004 8.194 1.00 0.00 H -ATOM 1226 CG2 VAL 78 -7.345 -10.774 5.046 1.00 0.00 C -ATOM 1227 HG21 VAL 78 -7.607 -11.261 4.107 1.00 0.00 H -ATOM 1228 HG22 VAL 78 -7.260 -9.721 4.779 1.00 0.00 H -ATOM 1229 HG23 VAL 78 -6.491 -11.306 5.466 1.00 0.00 H -ATOM 1230 C VAL 78 -9.756 -12.681 7.277 1.00 0.00 C -ATOM 1231 O VAL 78 -9.360 -13.212 8.278 1.00 0.00 O -ATOM 1232 N ILE 79 -11.074 -12.407 7.089 1.00 0.00 N -ATOM 1233 H ILE 79 -11.407 -11.923 6.267 1.00 0.00 H -ATOM 1234 CA ILE 79 -12.081 -12.857 8.079 1.00 0.00 C -ATOM 1235 HA ILE 79 -11.639 -12.746 9.069 1.00 0.00 H -ATOM 1236 CB ILE 79 -13.299 -11.871 8.048 1.00 0.00 C -ATOM 1237 HB ILE 79 -13.604 -11.792 7.004 1.00 0.00 H -ATOM 1238 CG2 ILE 79 -14.563 -12.303 8.787 1.00 0.00 C -ATOM 1239 HG21 ILE 79 -14.849 -13.320 8.519 1.00 0.00 H -ATOM 1240 HG22 ILE 79 -14.483 -12.319 9.874 1.00 0.00 H -ATOM 1241 HG23 ILE 79 -15.405 -11.712 8.427 1.00 0.00 H -ATOM 1242 CG1 ILE 79 -13.050 -10.386 8.451 1.00 0.00 C -ATOM 1243 HG12 ILE 79 -12.362 -9.939 7.733 1.00 0.00 H -ATOM 1244 HG13 ILE 79 -13.989 -9.832 8.475 1.00 0.00 H -ATOM 1245 CD1 ILE 79 -12.457 -10.182 9.872 1.00 0.00 C -ATOM 1246 HD11 ILE 79 -13.198 -10.337 10.657 1.00 0.00 H -ATOM 1247 HD12 ILE 79 -11.562 -10.772 10.069 1.00 0.00 H -ATOM 1248 HD13 ILE 79 -12.232 -9.121 9.976 1.00 0.00 H -ATOM 1249 C ILE 79 -12.362 -14.389 8.095 1.00 0.00 C -ATOM 1250 O ILE 79 -12.675 -14.896 9.207 1.00 0.00 O -ATOM 1251 N MET 80 -12.077 -15.156 7.096 1.00 0.00 N -ATOM 1252 H MET 80 -11.856 -14.761 6.193 1.00 0.00 H -ATOM 1253 CA MET 80 -11.810 -16.636 7.257 1.00 0.00 C -ATOM 1254 HA MET 80 -12.579 -16.959 7.960 1.00 0.00 H -ATOM 1255 CB MET 80 -12.090 -17.326 5.880 1.00 0.00 C -ATOM 1256 HB2 MET 80 -13.002 -16.879 5.484 1.00 0.00 H -ATOM 1257 HB3 MET 80 -11.247 -17.069 5.238 1.00 0.00 H -ATOM 1258 CG MET 80 -12.284 -18.810 5.937 1.00 0.00 C -ATOM 1259 HG2 MET 80 -12.595 -19.145 4.948 1.00 0.00 H -ATOM 1260 HG3 MET 80 -11.332 -19.311 6.111 1.00 0.00 H -ATOM 1261 SD MET 80 -13.512 -19.412 7.078 1.00 0.00 S -ATOM 1262 CE MET 80 -13.421 -21.215 6.702 1.00 0.00 C -ATOM 1263 HE1 MET 80 -13.695 -21.293 5.650 1.00 0.00 H -ATOM 1264 HE2 MET 80 -12.412 -21.619 6.781 1.00 0.00 H -ATOM 1265 HE3 MET 80 -14.103 -21.855 7.262 1.00 0.00 H -ATOM 1266 C MET 80 -10.514 -17.184 7.956 1.00 0.00 C -ATOM 1267 O MET 80 -10.226 -18.393 7.997 1.00 0.00 O -ATOM 1268 N GLY 81 -9.692 -16.250 8.520 1.00 0.00 N -ATOM 1269 H GLY 81 -9.945 -15.272 8.532 1.00 0.00 H -ATOM 1270 CA GLY 81 -8.616 -16.466 9.408 1.00 0.00 C -ATOM 1271 HA2 GLY 81 -8.507 -15.583 10.037 1.00 0.00 H -ATOM 1272 HA3 GLY 81 -8.690 -17.377 10.002 1.00 0.00 H -ATOM 1273 C GLY 81 -7.250 -16.650 8.789 1.00 0.00 C -ATOM 1274 O GLY 81 -6.697 -17.777 8.883 1.00 0.00 O -ATOM 1275 N TYR 82 -6.833 -15.629 8.092 1.00 0.00 N -ATOM 1276 H TYR 82 -7.182 -14.730 8.391 1.00 0.00 H -ATOM 1277 CA TYR 82 -5.630 -15.635 7.228 1.00 0.00 C -ATOM 1278 HA TYR 82 -4.847 -16.177 7.759 1.00 0.00 H -ATOM 1279 CB TYR 82 -6.000 -16.319 5.884 1.00 0.00 C -ATOM 1280 HB2 TYR 82 -6.554 -17.238 6.073 1.00 0.00 H -ATOM 1281 HB3 TYR 82 -6.599 -15.577 5.357 1.00 0.00 H -ATOM 1282 CG TYR 82 -4.826 -16.732 4.958 1.00 0.00 C -ATOM 1283 CD1 TYR 82 -4.291 -15.854 3.973 1.00 0.00 C -ATOM 1284 HD1 TYR 82 -4.798 -14.924 3.763 1.00 0.00 H -ATOM 1285 CE1 TYR 82 -3.158 -16.218 3.216 1.00 0.00 C -ATOM 1286 HE1 TYR 82 -2.775 -15.521 2.486 1.00 0.00 H -ATOM 1287 CZ TYR 82 -2.510 -17.385 3.532 1.00 0.00 C -ATOM 1288 OH TYR 82 -1.352 -17.697 2.883 1.00 0.00 O -ATOM 1289 HH TYR 82 -0.919 -16.894 2.584 1.00 0.00 H -ATOM 1290 CE2 TYR 82 -2.897 -18.238 4.622 1.00 0.00 C -ATOM 1291 HE2 TYR 82 -2.404 -19.145 4.941 1.00 0.00 H -ATOM 1292 CD2 TYR 82 -4.109 -17.894 5.251 1.00 0.00 C -ATOM 1293 HD2 TYR 82 -4.314 -18.425 6.169 1.00 0.00 H -ATOM 1294 C TYR 82 -5.019 -14.202 6.998 1.00 0.00 C -ATOM 1295 O TYR 82 -5.626 -13.238 7.411 1.00 0.00 O -ATOM 1296 N ASN 83 -3.858 -14.084 6.407 1.00 0.00 N -ATOM 1297 H ASN 83 -3.435 -14.875 5.942 1.00 0.00 H -ATOM 1298 CA ASN 83 -3.165 -12.776 6.204 1.00 0.00 C -ATOM 1299 HA ASN 83 -3.605 -11.976 6.798 1.00 0.00 H -ATOM 1300 CB ASN 83 -1.773 -12.981 6.828 1.00 0.00 C -ATOM 1301 HB2 ASN 83 -1.115 -13.720 6.371 1.00 0.00 H -ATOM 1302 HB3 ASN 83 -1.146 -12.093 6.750 1.00 0.00 H -ATOM 1303 CG ASN 83 -1.789 -13.341 8.358 1.00 0.00 C -ATOM 1304 OD1 ASN 83 -2.824 -13.652 8.926 1.00 0.00 O -ATOM 1305 ND2 ASN 83 -0.708 -13.350 9.099 1.00 0.00 N -ATOM 1306 HD21 ASN 83 -0.701 -13.796 10.005 1.00 0.00 H -ATOM 1307 HD22 ASN 83 0.133 -12.978 8.682 1.00 0.00 H -ATOM 1308 C ASN 83 -3.095 -12.273 4.772 1.00 0.00 C -ATOM 1309 O ASN 83 -2.727 -13.035 3.851 1.00 0.00 O -ATOM 1310 N CYS 84 -3.375 -10.973 4.542 1.00 0.00 N -ATOM 1311 H CYS 84 -3.619 -10.366 5.312 1.00 0.00 H -ATOM 1312 CA CYS 84 -3.201 -10.427 3.164 1.00 0.00 C -ATOM 1313 HA CYS 84 -2.545 -11.068 2.574 1.00 0.00 H -ATOM 1314 CB CYS 84 -4.558 -10.384 2.469 1.00 0.00 C -ATOM 1315 HB2 CYS 84 -5.177 -9.662 3.001 1.00 0.00 H -ATOM 1316 HB3 CYS 84 -4.466 -10.072 1.428 1.00 0.00 H -ATOM 1317 SG CYS 84 -5.269 -11.967 2.303 1.00 0.00 S -ATOM 1318 HG CYS 84 -5.705 -12.041 3.564 1.00 0.00 H -ATOM 1319 C CYS 84 -2.591 -9.023 3.172 1.00 0.00 C -ATOM 1320 O CYS 84 -2.229 -8.585 4.223 1.00 0.00 O -ATOM 1321 N THR 85 -2.323 -8.385 2.032 1.00 0.00 N -ATOM 1322 H THR 85 -2.627 -8.871 1.201 1.00 0.00 H -ATOM 1323 CA THR 85 -1.624 -7.102 1.836 1.00 0.00 C -ATOM 1324 HA THR 85 -1.838 -6.403 2.644 1.00 0.00 H -ATOM 1325 CB THR 85 -0.094 -7.193 1.828 1.00 0.00 C -ATOM 1326 HB THR 85 0.199 -7.915 1.066 1.00 0.00 H -ATOM 1327 CG2 THR 85 0.568 -5.879 1.592 1.00 0.00 C -ATOM 1328 HG21 THR 85 0.084 -5.119 2.205 1.00 0.00 H -ATOM 1329 HG22 THR 85 1.647 -5.958 1.730 1.00 0.00 H -ATOM 1330 HG23 THR 85 0.375 -5.573 0.563 1.00 0.00 H -ATOM 1331 OG1 THR 85 0.311 -7.630 3.147 1.00 0.00 O -ATOM 1332 HG1 THR 85 1.176 -8.037 3.059 1.00 0.00 H -ATOM 1333 C THR 85 -2.131 -6.382 0.554 1.00 0.00 C -ATOM 1334 O THR 85 -2.160 -7.004 -0.511 1.00 0.00 O -ATOM 1335 N ILE 86 -2.367 -5.071 0.648 1.00 0.00 N -ATOM 1336 H ILE 86 -2.426 -4.685 1.579 1.00 0.00 H -ATOM 1337 CA ILE 86 -2.430 -4.181 -0.587 1.00 0.00 C -ATOM 1338 HA ILE 86 -2.408 -4.754 -1.515 1.00 0.00 H -ATOM 1339 CB ILE 86 -3.865 -3.612 -0.549 1.00 0.00 C -ATOM 1340 HB ILE 86 -3.886 -3.000 0.353 1.00 0.00 H -ATOM 1341 CG2 ILE 86 -4.054 -2.631 -1.778 1.00 0.00 C -ATOM 1342 HG21 ILE 86 -3.284 -1.860 -1.806 1.00 0.00 H -ATOM 1343 HG22 ILE 86 -4.039 -3.139 -2.742 1.00 0.00 H -ATOM 1344 HG23 ILE 86 -4.991 -2.094 -1.628 1.00 0.00 H -ATOM 1345 CG1 ILE 86 -5.034 -4.632 -0.545 1.00 0.00 C -ATOM 1346 HG12 ILE 86 -4.916 -5.160 -1.491 1.00 0.00 H -ATOM 1347 HG13 ILE 86 -4.867 -5.292 0.307 1.00 0.00 H -ATOM 1348 CD1 ILE 86 -6.511 -4.229 -0.515 1.00 0.00 C -ATOM 1349 HD11 ILE 86 -6.710 -3.679 -1.435 1.00 0.00 H -ATOM 1350 HD12 ILE 86 -7.107 -5.140 -0.447 1.00 0.00 H -ATOM 1351 HD13 ILE 86 -6.533 -3.577 0.358 1.00 0.00 H -ATOM 1352 C ILE 86 -1.252 -3.205 -0.578 1.00 0.00 C -ATOM 1353 O ILE 86 -1.037 -2.539 0.397 1.00 0.00 O -ATOM 1354 N PHE 87 -0.533 -3.114 -1.622 1.00 0.00 N -ATOM 1355 H PHE 87 -0.782 -3.804 -2.315 1.00 0.00 H -ATOM 1356 CA PHE 87 0.358 -2.028 -2.003 1.00 0.00 C -ATOM 1357 HA PHE 87 0.673 -1.526 -1.088 1.00 0.00 H -ATOM 1358 CB PHE 87 1.711 -2.516 -2.668 1.00 0.00 C -ATOM 1359 HB2 PHE 87 1.393 -2.966 -3.609 1.00 0.00 H -ATOM 1360 HB3 PHE 87 2.232 -1.586 -2.895 1.00 0.00 H -ATOM 1361 CG PHE 87 2.671 -3.339 -1.863 1.00 0.00 C -ATOM 1362 CD1 PHE 87 3.852 -2.782 -1.308 1.00 0.00 C -ATOM 1363 HD1 PHE 87 4.150 -1.752 -1.433 1.00 0.00 H -ATOM 1364 CE1 PHE 87 4.808 -3.622 -0.746 1.00 0.00 C -ATOM 1365 HE1 PHE 87 5.721 -3.166 -0.394 1.00 0.00 H -ATOM 1366 CZ PHE 87 4.611 -5.021 -0.665 1.00 0.00 C -ATOM 1367 HZ PHE 87 5.269 -5.720 -0.171 1.00 0.00 H -ATOM 1368 CE2 PHE 87 3.457 -5.552 -1.271 1.00 0.00 C -ATOM 1369 HE2 PHE 87 3.387 -6.621 -1.412 1.00 0.00 H -ATOM 1370 CD2 PHE 87 2.503 -4.732 -1.936 1.00 0.00 C -ATOM 1371 HD2 PHE 87 1.652 -5.134 -2.465 1.00 0.00 H -ATOM 1372 C PHE 87 -0.378 -1.077 -2.951 1.00 0.00 C -ATOM 1373 O PHE 87 -1.273 -1.527 -3.672 1.00 0.00 O -ATOM 1374 N ALA 88 0.050 0.182 -2.907 1.00 0.00 N -ATOM 1375 H ALA 88 0.749 0.384 -2.206 1.00 0.00 H -ATOM 1376 CA ALA 88 -0.141 1.208 -3.935 1.00 0.00 C -ATOM 1377 HA ALA 88 -0.479 0.713 -4.845 1.00 0.00 H -ATOM 1378 CB ALA 88 -1.213 2.220 -3.556 1.00 0.00 C -ATOM 1379 HB1 ALA 88 -1.404 2.860 -4.417 1.00 0.00 H -ATOM 1380 HB2 ALA 88 -2.143 1.731 -3.266 1.00 0.00 H -ATOM 1381 HB3 ALA 88 -0.931 2.794 -2.674 1.00 0.00 H -ATOM 1382 C ALA 88 1.243 1.909 -4.295 1.00 0.00 C -ATOM 1383 O ALA 88 1.936 2.396 -3.426 1.00 0.00 O -ATOM 1384 N TYR 89 1.482 1.978 -5.617 1.00 0.00 N -ATOM 1385 H TYR 89 0.781 1.671 -6.277 1.00 0.00 H -ATOM 1386 CA TYR 89 2.766 2.422 -6.260 1.00 0.00 C -ATOM 1387 HA TYR 89 3.233 3.110 -5.555 1.00 0.00 H -ATOM 1388 CB TYR 89 3.616 1.157 -6.506 1.00 0.00 C -ATOM 1389 HB2 TYR 89 3.726 0.534 -5.618 1.00 0.00 H -ATOM 1390 HB3 TYR 89 3.060 0.550 -7.221 1.00 0.00 H -ATOM 1391 CG TYR 89 4.948 1.593 -7.126 1.00 0.00 C -ATOM 1392 CD1 TYR 89 5.303 1.281 -8.462 1.00 0.00 C -ATOM 1393 HD1 TYR 89 4.626 0.906 -9.216 1.00 0.00 H -ATOM 1394 CE1 TYR 89 6.603 1.603 -8.915 1.00 0.00 C -ATOM 1395 HE1 TYR 89 6.778 1.486 -9.974 1.00 0.00 H -ATOM 1396 CZ TYR 89 7.571 2.234 -8.117 1.00 0.00 C -ATOM 1397 OH TYR 89 8.764 2.473 -8.603 1.00 0.00 O -ATOM 1398 HH TYR 89 8.999 1.885 -9.325 1.00 0.00 H -ATOM 1399 CE2 TYR 89 7.131 2.715 -6.833 1.00 0.00 C -ATOM 1400 HE2 TYR 89 7.738 3.276 -6.138 1.00 0.00 H -ATOM 1401 CD2 TYR 89 5.878 2.270 -6.348 1.00 0.00 C -ATOM 1402 HD2 TYR 89 5.638 2.509 -5.323 1.00 0.00 H -ATOM 1403 C TYR 89 2.604 3.292 -7.496 1.00 0.00 C -ATOM 1404 O TYR 89 1.632 3.150 -8.215 1.00 0.00 O -ATOM 1405 N GLY 90 3.450 4.278 -7.708 1.00 0.00 N -ATOM 1406 H GLY 90 4.237 4.437 -7.096 1.00 0.00 H -ATOM 1407 CA GLY 90 3.179 5.309 -8.750 1.00 0.00 C -ATOM 1408 HA2 GLY 90 3.650 4.972 -9.673 1.00 0.00 H -ATOM 1409 HA3 GLY 90 2.100 5.316 -8.907 1.00 0.00 H -ATOM 1410 C GLY 90 3.719 6.749 -8.493 1.00 0.00 C -ATOM 1411 O GLY 90 4.106 7.117 -7.414 1.00 0.00 O -ATOM 1412 N GLN 91 3.778 7.597 -9.536 1.00 0.00 N -ATOM 1413 H GLN 91 3.317 7.423 -10.417 1.00 0.00 H -ATOM 1414 CA GLN 91 4.518 8.898 -9.489 1.00 0.00 C -ATOM 1415 HA GLN 91 5.546 8.688 -9.194 1.00 0.00 H -ATOM 1416 CB GLN 91 4.546 9.645 -10.801 1.00 0.00 C -ATOM 1417 HB2 GLN 91 5.327 9.211 -11.426 1.00 0.00 H -ATOM 1418 HB3 GLN 91 3.538 9.540 -11.201 1.00 0.00 H -ATOM 1419 CG GLN 91 4.851 11.167 -10.751 1.00 0.00 C -ATOM 1420 HG2 GLN 91 4.032 11.769 -10.358 1.00 0.00 H -ATOM 1421 HG3 GLN 91 5.760 11.288 -10.162 1.00 0.00 H -ATOM 1422 CD GLN 91 5.004 11.943 -12.057 1.00 0.00 C -ATOM 1423 OE1 GLN 91 5.358 11.486 -13.150 1.00 0.00 O -ATOM 1424 NE2 GLN 91 4.987 13.270 -11.853 1.00 0.00 N -ATOM 1425 HE21 GLN 91 4.955 13.823 -12.698 1.00 0.00 H -ATOM 1426 HE22 GLN 91 4.586 13.487 -10.952 1.00 0.00 H -ATOM 1427 C GLN 91 3.870 9.769 -8.381 1.00 0.00 C -ATOM 1428 O GLN 91 2.678 9.792 -8.072 1.00 0.00 O -ATOM 1429 N THR 92 4.781 10.519 -7.805 1.00 0.00 N -ATOM 1430 H THR 92 5.740 10.380 -8.088 1.00 0.00 H -ATOM 1431 CA THR 92 4.482 11.515 -6.751 1.00 0.00 C -ATOM 1432 HA THR 92 3.941 11.119 -5.891 1.00 0.00 H -ATOM 1433 CB THR 92 5.751 12.224 -6.236 1.00 0.00 C -ATOM 1434 HB THR 92 6.167 12.792 -7.068 1.00 0.00 H -ATOM 1435 CG2 THR 92 5.427 13.150 -5.036 1.00 0.00 C -ATOM 1436 HG21 THR 92 6.308 13.754 -4.818 1.00 0.00 H -ATOM 1437 HG22 THR 92 4.601 13.800 -5.323 1.00 0.00 H -ATOM 1438 HG23 THR 92 5.284 12.583 -4.117 1.00 0.00 H -ATOM 1439 OG1 THR 92 6.635 11.240 -5.841 1.00 0.00 O -ATOM 1440 HG1 THR 92 7.282 11.112 -6.539 1.00 0.00 H -ATOM 1441 C THR 92 3.588 12.589 -7.391 1.00 0.00 C -ATOM 1442 O THR 92 4.086 13.427 -8.212 1.00 0.00 O -ATOM 1443 N GLY 93 2.239 12.526 -7.089 1.00 0.00 N -ATOM 1444 H GLY 93 1.934 11.813 -6.442 1.00 0.00 H -ATOM 1445 CA GLY 93 1.166 13.131 -7.852 1.00 0.00 C -ATOM 1446 HA2 GLY 93 0.574 13.769 -7.197 1.00 0.00 H -ATOM 1447 HA3 GLY 93 1.609 13.844 -8.547 1.00 0.00 H -ATOM 1448 C GLY 93 0.116 12.225 -8.586 1.00 0.00 C -ATOM 1449 O GLY 93 -0.688 12.761 -9.412 1.00 0.00 O -ATOM 1450 N THR 94 0.039 10.916 -8.263 1.00 0.00 N -ATOM 1451 H THR 94 0.838 10.678 -7.693 1.00 0.00 H -ATOM 1452 CA THR 94 -0.890 9.949 -8.794 1.00 0.00 C -ATOM 1453 HA THR 94 -1.386 10.517 -9.581 1.00 0.00 H -ATOM 1454 CB THR 94 -0.121 8.849 -9.636 1.00 0.00 C -ATOM 1455 HB THR 94 -0.815 8.117 -10.051 1.00 0.00 H -ATOM 1456 CG2 THR 94 0.729 9.592 -10.743 1.00 0.00 C -ATOM 1457 HG21 THR 94 0.047 10.215 -11.322 1.00 0.00 H -ATOM 1458 HG22 THR 94 1.500 10.174 -10.239 1.00 0.00 H -ATOM 1459 HG23 THR 94 1.188 8.863 -11.410 1.00 0.00 H -ATOM 1460 OG1 THR 94 0.747 8.182 -8.739 1.00 0.00 O -ATOM 1461 HG1 THR 94 1.317 8.854 -8.358 1.00 0.00 H -ATOM 1462 C THR 94 -2.054 9.421 -7.973 1.00 0.00 C -ATOM 1463 O THR 94 -2.811 8.659 -8.495 1.00 0.00 O -ATOM 1464 N GLY 95 -2.062 9.638 -6.664 1.00 0.00 N -ATOM 1465 H GLY 95 -1.363 10.220 -6.225 1.00 0.00 H -ATOM 1466 CA GLY 95 -3.180 9.144 -5.790 1.00 0.00 C -ATOM 1467 HA2 GLY 95 -3.271 9.866 -4.979 1.00 0.00 H -ATOM 1468 HA3 GLY 95 -4.106 9.009 -6.350 1.00 0.00 H -ATOM 1469 C GLY 95 -3.034 7.821 -5.087 1.00 0.00 C -ATOM 1470 O GLY 95 -4.039 7.156 -4.881 1.00 0.00 O -ATOM 1471 N LYS 96 -1.800 7.531 -4.594 1.00 0.00 N -ATOM 1472 H LYS 96 -1.111 8.264 -4.509 1.00 0.00 H -ATOM 1473 CA LYS 96 -1.591 6.307 -3.775 1.00 0.00 C -ATOM 1474 HA LYS 96 -2.027 5.435 -4.263 1.00 0.00 H -ATOM 1475 CB LYS 96 -0.129 6.034 -3.611 1.00 0.00 C -ATOM 1476 HB2 LYS 96 0.385 6.666 -2.887 1.00 0.00 H -ATOM 1477 HB3 LYS 96 -0.019 5.068 -3.119 1.00 0.00 H -ATOM 1478 CG LYS 96 0.703 5.999 -4.936 1.00 0.00 C -ATOM 1479 HG2 LYS 96 0.331 5.102 -5.431 1.00 0.00 H -ATOM 1480 HG3 LYS 96 0.445 6.867 -5.542 1.00 0.00 H -ATOM 1481 CD LYS 96 2.197 6.009 -4.780 1.00 0.00 C -ATOM 1482 HD2 LYS 96 2.576 5.226 -4.123 1.00 0.00 H -ATOM 1483 HD3 LYS 96 2.583 5.914 -5.795 1.00 0.00 H -ATOM 1484 CE LYS 96 2.710 7.365 -4.221 1.00 0.00 C -ATOM 1485 HE2 LYS 96 2.144 7.593 -3.318 1.00 0.00 H -ATOM 1486 HE3 LYS 96 3.757 7.147 -4.008 1.00 0.00 H -ATOM 1487 NZ LYS 96 2.600 8.435 -5.201 1.00 0.00 N -ATOM 1488 HZ1 LYS 96 3.035 8.158 -6.070 1.00 0.00 H -ATOM 1489 HZ2 LYS 96 1.670 8.824 -5.254 1.00 0.00 H -ATOM 1490 HZ3 LYS 96 3.217 9.180 -4.909 1.00 0.00 H -ATOM 1491 C LYS 96 -2.216 6.430 -2.467 1.00 0.00 C -ATOM 1492 O LYS 96 -3.055 5.648 -2.106 1.00 0.00 O -ATOM 1493 N THR 97 -1.897 7.439 -1.714 1.00 0.00 N -ATOM 1494 H THR 97 -1.250 8.111 -2.102 1.00 0.00 H -ATOM 1495 CA THR 97 -2.590 7.746 -0.395 1.00 0.00 C -ATOM 1496 HA THR 97 -2.633 6.865 0.245 1.00 0.00 H -ATOM 1497 CB THR 97 -1.939 8.928 0.405 1.00 0.00 C -ATOM 1498 HB THR 97 -2.027 9.826 -0.208 1.00 0.00 H -ATOM 1499 CG2 THR 97 -2.488 9.129 1.785 1.00 0.00 C -ATOM 1500 HG21 THR 97 -2.443 8.204 2.360 1.00 0.00 H -ATOM 1501 HG22 THR 97 -1.809 9.782 2.332 1.00 0.00 H -ATOM 1502 HG23 THR 97 -3.539 9.417 1.785 1.00 0.00 H -ATOM 1503 OG1 THR 97 -0.494 8.743 0.598 1.00 0.00 O -ATOM 1504 HG1 THR 97 -0.290 7.949 1.097 1.00 0.00 H -ATOM 1505 C THR 97 -4.055 8.049 -0.592 1.00 0.00 C -ATOM 1506 O THR 97 -4.789 7.683 0.317 1.00 0.00 O -ATOM 1507 N PHE 98 -4.436 8.650 -1.702 1.00 0.00 N -ATOM 1508 H PHE 98 -3.694 9.054 -2.255 1.00 0.00 H -ATOM 1509 CA PHE 98 -5.830 8.866 -1.927 1.00 0.00 C -ATOM 1510 HA PHE 98 -6.331 9.437 -1.146 1.00 0.00 H -ATOM 1511 CB PHE 98 -5.858 9.698 -3.229 1.00 0.00 C -ATOM 1512 HB2 PHE 98 -5.309 10.621 -3.046 1.00 0.00 H -ATOM 1513 HB3 PHE 98 -5.393 9.181 -4.069 1.00 0.00 H -ATOM 1514 CG PHE 98 -7.338 10.018 -3.680 1.00 0.00 C -ATOM 1515 CD1 PHE 98 -8.028 9.120 -4.556 1.00 0.00 C -ATOM 1516 HD1 PHE 98 -7.500 8.271 -4.963 1.00 0.00 H -ATOM 1517 CE1 PHE 98 -9.374 9.321 -4.893 1.00 0.00 C -ATOM 1518 HE1 PHE 98 -9.953 8.655 -5.515 1.00 0.00 H -ATOM 1519 CZ PHE 98 -10.061 10.489 -4.370 1.00 0.00 C -ATOM 1520 HZ PHE 98 -11.053 10.675 -4.756 1.00 0.00 H -ATOM 1521 CE2 PHE 98 -9.431 11.329 -3.463 1.00 0.00 C -ATOM 1522 HE2 PHE 98 -10.004 12.146 -3.048 1.00 0.00 H -ATOM 1523 CD2 PHE 98 -8.100 11.094 -3.152 1.00 0.00 C -ATOM 1524 HD2 PHE 98 -7.600 11.677 -2.393 1.00 0.00 H -ATOM 1525 C PHE 98 -6.670 7.582 -2.126 1.00 0.00 C -ATOM 1526 O PHE 98 -7.679 7.407 -1.404 1.00 0.00 O -ATOM 1527 N THR 99 -6.181 6.575 -2.817 1.00 0.00 N -ATOM 1528 H THR 99 -5.340 6.712 -3.360 1.00 0.00 H -ATOM 1529 CA THR 99 -6.781 5.277 -2.824 1.00 0.00 C -ATOM 1530 HA THR 99 -7.821 5.301 -3.147 1.00 0.00 H -ATOM 1531 CB THR 99 -6.034 4.419 -3.766 1.00 0.00 C -ATOM 1532 HB THR 99 -4.989 4.295 -3.481 1.00 0.00 H -ATOM 1533 CG2 THR 99 -6.589 3.021 -3.990 1.00 0.00 C -ATOM 1534 HG21 THR 99 -5.920 2.468 -4.651 1.00 0.00 H -ATOM 1535 HG22 THR 99 -6.674 2.459 -3.060 1.00 0.00 H -ATOM 1536 HG23 THR 99 -7.493 3.143 -4.587 1.00 0.00 H -ATOM 1537 OG1 THR 99 -6.064 4.926 -5.118 1.00 0.00 O -ATOM 1538 HG1 THR 99 -5.655 5.793 -5.175 1.00 0.00 H -ATOM 1539 C THR 99 -6.683 4.572 -1.418 1.00 0.00 C -ATOM 1540 O THR 99 -7.761 4.025 -1.005 1.00 0.00 O -ATOM 1541 N MET 100 -5.536 4.614 -0.668 1.00 0.00 N -ATOM 1542 H MET 100 -4.937 5.371 -0.964 1.00 0.00 H -ATOM 1543 CA MET 100 -5.363 4.062 0.667 1.00 0.00 C -ATOM 1544 HA MET 100 -5.814 3.071 0.614 1.00 0.00 H -ATOM 1545 CB MET 100 -3.942 4.030 1.047 1.00 0.00 C -ATOM 1546 HB2 MET 100 -3.583 5.054 0.952 1.00 0.00 H -ATOM 1547 HB3 MET 100 -3.850 3.692 2.080 1.00 0.00 H -ATOM 1548 CG MET 100 -3.107 3.101 0.233 1.00 0.00 C -ATOM 1549 HG2 MET 100 -3.048 3.470 -0.791 1.00 0.00 H -ATOM 1550 HG3 MET 100 -2.091 3.238 0.605 1.00 0.00 H -ATOM 1551 SD MET 100 -3.582 1.371 0.326 1.00 0.00 S -ATOM 1552 CE MET 100 -1.986 0.538 -0.230 1.00 0.00 C -ATOM 1553 HE1 MET 100 -1.870 0.492 -1.313 1.00 0.00 H -ATOM 1554 HE2 MET 100 -1.105 1.095 0.087 1.00 0.00 H -ATOM 1555 HE3 MET 100 -2.069 -0.534 -0.050 1.00 0.00 H -ATOM 1556 C MET 100 -6.360 4.716 1.703 1.00 0.00 C -ATOM 1557 O MET 100 -7.003 3.874 2.341 1.00 0.00 O -ATOM 1558 N GLU 101 -6.336 5.992 1.951 1.00 0.00 N -ATOM 1559 H GLU 101 -5.715 6.563 1.396 1.00 0.00 H -ATOM 1560 CA GLU 101 -7.015 6.670 3.020 1.00 0.00 C -ATOM 1561 HA GLU 101 -7.511 5.869 3.569 1.00 0.00 H -ATOM 1562 CB GLU 101 -5.957 7.259 3.975 1.00 0.00 C -ATOM 1563 HB2 GLU 101 -5.300 6.558 4.491 1.00 0.00 H -ATOM 1564 HB3 GLU 101 -5.291 7.769 3.280 1.00 0.00 H -ATOM 1565 CG GLU 101 -6.498 8.247 5.034 1.00 0.00 C -ATOM 1566 HG2 GLU 101 -7.315 8.828 4.606 1.00 0.00 H -ATOM 1567 HG3 GLU 101 -6.795 7.668 5.908 1.00 0.00 H -ATOM 1568 CD GLU 101 -5.400 9.232 5.477 1.00 0.00 C -ATOM 1569 OE1 GLU 101 -5.791 10.377 5.851 1.00 0.00 O -ATOM 1570 OE2 GLU 101 -4.199 8.909 5.504 1.00 0.00 O -ATOM 1571 C GLU 101 -8.058 7.735 2.496 1.00 0.00 C -ATOM 1572 O GLU 101 -9.191 7.891 3.072 1.00 0.00 O -ATOM 1573 N GLY 102 -7.684 8.459 1.433 1.00 0.00 N -ATOM 1574 H GLY 102 -6.775 8.362 1.005 1.00 0.00 H -ATOM 1575 CA GLY 102 -8.685 9.273 0.772 1.00 0.00 C -ATOM 1576 HA2 GLY 102 -8.239 9.476 -0.201 1.00 0.00 H -ATOM 1577 HA3 GLY 102 -9.611 8.711 0.652 1.00 0.00 H -ATOM 1578 C GLY 102 -8.961 10.628 1.468 1.00 0.00 C -ATOM 1579 O GLY 102 -8.554 10.987 2.592 1.00 0.00 O -ATOM 1580 N GLU 103 -9.861 11.402 0.821 1.00 0.00 N -ATOM 1581 H GLU 103 -10.235 11.066 -0.055 1.00 0.00 H -ATOM 1582 CA GLU 103 -10.407 12.620 1.419 1.00 0.00 C -ATOM 1583 HA GLU 103 -9.666 13.023 2.109 1.00 0.00 H -ATOM 1584 CB GLU 103 -10.592 13.811 0.448 1.00 0.00 C -ATOM 1585 HB2 GLU 103 -11.507 13.693 -0.132 1.00 0.00 H -ATOM 1586 HB3 GLU 103 -10.677 14.704 1.067 1.00 0.00 H -ATOM 1587 CG GLU 103 -9.371 13.982 -0.481 1.00 0.00 C -ATOM 1588 HG2 GLU 103 -9.253 13.176 -1.206 1.00 0.00 H -ATOM 1589 HG3 GLU 103 -9.670 14.870 -1.037 1.00 0.00 H -ATOM 1590 CD GLU 103 -8.065 14.258 0.222 1.00 0.00 C -ATOM 1591 OE1 GLU 103 -8.068 15.040 1.167 1.00 0.00 O -ATOM 1592 OE2 GLU 103 -6.972 13.924 -0.291 1.00 0.00 O -ATOM 1593 C GLU 103 -11.658 12.310 2.288 1.00 0.00 C -ATOM 1594 O GLU 103 -12.755 12.752 1.972 1.00 0.00 O -ATOM 1595 N ARG 104 -11.416 11.458 3.248 1.00 0.00 N -ATOM 1596 H ARG 104 -10.459 11.146 3.336 1.00 0.00 H -ATOM 1597 CA ARG 104 -12.349 10.951 4.238 1.00 0.00 C -ATOM 1598 HA ARG 104 -13.068 10.380 3.650 1.00 0.00 H -ATOM 1599 CB ARG 104 -11.554 10.145 5.262 1.00 0.00 C -ATOM 1600 HB2 ARG 104 -12.161 9.648 6.018 1.00 0.00 H -ATOM 1601 HB3 ARG 104 -11.037 9.424 4.629 1.00 0.00 H -ATOM 1602 CG ARG 104 -10.460 11.001 5.983 1.00 0.00 C -ATOM 1603 HG2 ARG 104 -9.903 11.623 5.282 1.00 0.00 H -ATOM 1604 HG3 ARG 104 -10.841 11.636 6.783 1.00 0.00 H -ATOM 1605 CD ARG 104 -9.469 10.098 6.762 1.00 0.00 C -ATOM 1606 HD2 ARG 104 -9.987 9.840 7.686 1.00 0.00 H -ATOM 1607 HD3 ARG 104 -9.306 9.231 6.122 1.00 0.00 H -ATOM 1608 NE ARG 104 -8.166 10.768 7.033 1.00 0.00 N -ATOM 1609 HE ARG 104 -7.394 10.449 6.466 1.00 0.00 H -ATOM 1610 CZ ARG 104 -7.766 11.757 7.886 1.00 0.00 C -ATOM 1611 NH1 ARG 104 -8.642 12.262 8.765 1.00 0.00 N -ATOM 1612 HH11 ARG 104 -9.613 11.990 8.708 1.00 0.00 H -ATOM 1613 HH12 ARG 104 -8.366 13.100 9.256 1.00 0.00 H -ATOM 1614 NH2 ARG 104 -6.517 12.186 7.827 1.00 0.00 N -ATOM 1615 HH21 ARG 104 -5.923 11.656 7.205 1.00 0.00 H -ATOM 1616 HH22 ARG 104 -6.177 12.805 8.550 1.00 0.00 H -ATOM 1617 C ARG 104 -13.149 12.031 5.024 1.00 0.00 C -ATOM 1618 O ARG 104 -12.579 13.056 5.505 1.00 0.00 O -ATOM 1619 N SER 105 -14.421 11.867 5.116 1.00 0.00 N -ATOM 1620 H SER 105 -14.793 11.077 4.609 1.00 0.00 H -ATOM 1621 CA SER 105 -15.289 12.586 6.062 1.00 0.00 C -ATOM 1622 HA SER 105 -15.109 13.660 6.011 1.00 0.00 H -ATOM 1623 CB SER 105 -16.780 12.430 5.606 1.00 0.00 C -ATOM 1624 HB2 SER 105 -17.263 11.613 6.142 1.00 0.00 H -ATOM 1625 HB3 SER 105 -17.338 13.324 5.887 1.00 0.00 H -ATOM 1626 OG SER 105 -16.933 12.264 4.243 1.00 0.00 O -ATOM 1627 HG SER 105 -16.622 11.359 4.157 1.00 0.00 H -ATOM 1628 C SER 105 -15.071 12.017 7.448 1.00 0.00 C -ATOM 1629 O SER 105 -14.756 10.832 7.583 1.00 0.00 O -ATOM 1630 N PRO 106 -15.318 12.734 8.534 1.00 0.00 N -ATOM 1631 CD PRO 106 -15.682 14.139 8.555 1.00 0.00 C -ATOM 1632 HD2 PRO 106 -16.385 14.516 7.812 1.00 0.00 H -ATOM 1633 HD3 PRO 106 -14.776 14.733 8.438 1.00 0.00 H -ATOM 1634 CG PRO 106 -16.320 14.411 9.934 1.00 0.00 C -ATOM 1635 HG2 PRO 106 -17.368 14.113 9.905 1.00 0.00 H -ATOM 1636 HG3 PRO 106 -16.233 15.433 10.303 1.00 0.00 H -ATOM 1637 CB PRO 106 -15.480 13.464 10.855 1.00 0.00 C -ATOM 1638 HB2 PRO 106 -16.084 13.150 11.706 1.00 0.00 H -ATOM 1639 HB3 PRO 106 -14.470 13.834 11.037 1.00 0.00 H -ATOM 1640 CA PRO 106 -15.279 12.256 9.916 1.00 0.00 C -ATOM 1641 HA PRO 106 -14.274 11.861 10.064 1.00 0.00 H -ATOM 1642 C PRO 106 -16.213 11.090 10.232 1.00 0.00 C -ATOM 1643 O PRO 106 -17.168 10.862 9.472 1.00 0.00 O -ATOM 1644 N ASN 107 -15.840 10.366 11.292 1.00 0.00 N -ATOM 1645 H ASN 107 -15.121 10.729 11.901 1.00 0.00 H -ATOM 1646 CA ASN 107 -16.471 9.202 11.754 1.00 0.00 C -ATOM 1647 HA ASN 107 -16.519 8.500 10.921 1.00 0.00 H -ATOM 1648 CB ASN 107 -15.575 8.597 12.831 1.00 0.00 C -ATOM 1649 HB2 ASN 107 -14.523 8.516 12.558 1.00 0.00 H -ATOM 1650 HB3 ASN 107 -15.448 9.283 13.669 1.00 0.00 H -ATOM 1651 CG ASN 107 -16.067 7.226 13.235 1.00 0.00 C -ATOM 1652 OD1 ASN 107 -16.244 6.390 12.374 1.00 0.00 O -ATOM 1653 ND2 ASN 107 -16.295 6.941 14.495 1.00 0.00 N -ATOM 1654 HD21 ASN 107 -16.621 5.992 14.609 1.00 0.00 H -ATOM 1655 HD22 ASN 107 -16.244 7.608 15.252 1.00 0.00 H -ATOM 1656 C ASN 107 -17.924 9.515 12.183 1.00 0.00 C -ATOM 1657 O ASN 107 -18.276 10.646 12.352 1.00 0.00 O -ATOM 1658 N GLU 108 -18.842 8.548 12.261 1.00 0.00 N -ATOM 1659 H GLU 108 -18.569 7.611 12.001 1.00 0.00 H -ATOM 1660 CA GLU 108 -20.292 8.677 12.438 1.00 0.00 C -ATOM 1661 HA GLU 108 -20.661 7.653 12.484 1.00 0.00 H -ATOM 1662 CB GLU 108 -20.587 9.309 13.808 1.00 0.00 C -ATOM 1663 HB2 GLU 108 -20.529 10.397 13.766 1.00 0.00 H -ATOM 1664 HB3 GLU 108 -21.607 9.111 14.139 1.00 0.00 H -ATOM 1665 CG GLU 108 -19.681 8.909 14.950 1.00 0.00 C -ATOM 1666 HG2 GLU 108 -18.692 9.249 14.643 1.00 0.00 H -ATOM 1667 HG3 GLU 108 -19.928 9.548 15.798 1.00 0.00 H -ATOM 1668 CD GLU 108 -19.659 7.462 15.320 1.00 0.00 C -ATOM 1669 OE1 GLU 108 -20.250 6.533 14.748 1.00 0.00 O -ATOM 1670 OE2 GLU 108 -18.897 7.218 16.324 1.00 0.00 O -ATOM 1671 C GLU 108 -21.052 9.415 11.352 1.00 0.00 C -ATOM 1672 O GLU 108 -22.285 9.299 11.395 1.00 0.00 O -ATOM 1673 N GLU 109 -20.441 10.128 10.421 1.00 0.00 N -ATOM 1674 H GLU 109 -19.431 10.128 10.395 1.00 0.00 H -ATOM 1675 CA GLU 109 -21.205 10.934 9.445 1.00 0.00 C -ATOM 1676 HA GLU 109 -21.975 11.484 9.985 1.00 0.00 H -ATOM 1677 CB GLU 109 -20.230 11.921 8.784 1.00 0.00 C -ATOM 1678 HB2 GLU 109 -19.821 12.496 9.615 1.00 0.00 H -ATOM 1679 HB3 GLU 109 -19.396 11.309 8.439 1.00 0.00 H -ATOM 1680 CG GLU 109 -20.656 12.913 7.648 1.00 0.00 C -ATOM 1681 HG2 GLU 109 -19.777 13.113 7.035 1.00 0.00 H -ATOM 1682 HG3 GLU 109 -21.456 12.500 7.032 1.00 0.00 H -ATOM 1683 CD GLU 109 -21.138 14.235 8.272 1.00 0.00 C -ATOM 1684 OE1 GLU 109 -22.214 14.207 8.911 1.00 0.00 O -ATOM 1685 OE2 GLU 109 -20.498 15.262 8.165 1.00 0.00 O -ATOM 1686 C GLU 109 -21.769 10.091 8.338 1.00 0.00 C -ATOM 1687 O GLU 109 -22.862 10.428 7.785 1.00 0.00 O -ATOM 1688 N TYR 110 -21.090 9.059 7.967 1.00 0.00 N -ATOM 1689 H TYR 110 -20.155 9.023 8.346 1.00 0.00 H -ATOM 1690 CA TYR 110 -21.502 8.024 6.988 1.00 0.00 C -ATOM 1691 HA TYR 110 -22.591 8.030 6.943 1.00 0.00 H -ATOM 1692 CB TYR 110 -20.915 8.401 5.680 1.00 0.00 C -ATOM 1693 HB2 TYR 110 -19.849 8.176 5.713 1.00 0.00 H -ATOM 1694 HB3 TYR 110 -21.233 7.748 4.867 1.00 0.00 H -ATOM 1695 CG TYR 110 -21.240 9.820 5.182 1.00 0.00 C -ATOM 1696 CD1 TYR 110 -22.519 10.171 4.758 1.00 0.00 C -ATOM 1697 HD1 TYR 110 -23.350 9.513 4.966 1.00 0.00 H -ATOM 1698 CE1 TYR 110 -22.781 11.445 4.144 1.00 0.00 C -ATOM 1699 HE1 TYR 110 -23.769 11.693 3.783 1.00 0.00 H -ATOM 1700 CZ TYR 110 -21.707 12.339 3.966 1.00 0.00 C -ATOM 1701 OH TYR 110 -21.918 13.543 3.345 1.00 0.00 O -ATOM 1702 HH TYR 110 -22.714 13.639 2.818 1.00 0.00 H -ATOM 1703 CE2 TYR 110 -20.406 11.923 4.265 1.00 0.00 C -ATOM 1704 HE2 TYR 110 -19.586 12.601 4.080 1.00 0.00 H -ATOM 1705 CD2 TYR 110 -20.185 10.663 4.827 1.00 0.00 C -ATOM 1706 HD2 TYR 110 -19.192 10.326 5.084 1.00 0.00 H -ATOM 1707 C TYR 110 -21.150 6.578 7.379 1.00 0.00 C -ATOM 1708 O TYR 110 -20.158 6.382 8.006 1.00 0.00 O -ATOM 1709 N THR 111 -21.942 5.615 6.899 1.00 0.00 N -ATOM 1710 H THR 111 -22.846 5.924 6.571 1.00 0.00 H -ATOM 1711 CA THR 111 -21.560 4.180 6.926 1.00 0.00 C -ATOM 1712 HA THR 111 -21.062 4.035 7.885 1.00 0.00 H -ATOM 1713 CB THR 111 -22.862 3.275 6.935 1.00 0.00 C -ATOM 1714 HB THR 111 -23.528 3.504 7.766 1.00 0.00 H -ATOM 1715 CG2 THR 111 -23.687 3.410 5.698 1.00 0.00 C -ATOM 1716 HG21 THR 111 -24.358 4.262 5.808 1.00 0.00 H -ATOM 1717 HG22 THR 111 -23.108 3.701 4.821 1.00 0.00 H -ATOM 1718 HG23 THR 111 -24.230 2.533 5.347 1.00 0.00 H -ATOM 1719 OG1 THR 111 -22.377 1.931 7.086 1.00 0.00 O -ATOM 1720 HG1 THR 111 -23.127 1.361 7.267 1.00 0.00 H -ATOM 1721 C THR 111 -20.611 3.850 5.829 1.00 0.00 C -ATOM 1722 O THR 111 -20.444 4.666 4.869 1.00 0.00 O -ATOM 1723 N TRP 112 -19.764 2.816 5.961 1.00 0.00 N -ATOM 1724 H TRP 112 -19.703 2.425 6.890 1.00 0.00 H -ATOM 1725 CA TRP 112 -18.700 2.543 5.066 1.00 0.00 C -ATOM 1726 HA TRP 112 -17.979 3.342 5.239 1.00 0.00 H -ATOM 1727 CB TRP 112 -18.004 1.252 5.433 1.00 0.00 C -ATOM 1728 HB2 TRP 112 -17.076 1.023 4.909 1.00 0.00 H -ATOM 1729 HB3 TRP 112 -17.599 1.408 6.433 1.00 0.00 H -ATOM 1730 CG TRP 112 -18.786 -0.049 5.286 1.00 0.00 C -ATOM 1731 CD1 TRP 112 -19.643 -0.549 6.225 1.00 0.00 C -ATOM 1732 HD1 TRP 112 -19.881 -0.078 7.168 1.00 0.00 H -ATOM 1733 NE1 TRP 112 -20.142 -1.718 5.726 1.00 0.00 N -ATOM 1734 HE1 TRP 112 -20.832 -2.357 6.094 1.00 0.00 H -ATOM 1735 CE2 TRP 112 -19.681 -1.999 4.448 1.00 0.00 C -ATOM 1736 CZ2 TRP 112 -19.965 -3.024 3.501 1.00 0.00 C -ATOM 1737 HZ2 TRP 112 -20.570 -3.885 3.744 1.00 0.00 H -ATOM 1738 CH2 TRP 112 -19.373 -2.921 2.288 1.00 0.00 C -ATOM 1739 HH2 TRP 112 -19.608 -3.685 1.562 1.00 0.00 H -ATOM 1740 CZ3 TRP 112 -18.444 -1.937 1.980 1.00 0.00 C -ATOM 1741 HZ3 TRP 112 -17.942 -1.957 1.024 1.00 0.00 H -ATOM 1742 CE3 TRP 112 -18.084 -1.026 2.945 1.00 0.00 C -ATOM 1743 HE3 TRP 112 -17.362 -0.255 2.723 1.00 0.00 H -ATOM 1744 CD2 TRP 112 -18.753 -0.945 4.138 1.00 0.00 C -ATOM 1745 C TRP 112 -18.996 2.546 3.568 1.00 0.00 C -ATOM 1746 O TRP 112 -18.104 2.877 2.771 1.00 0.00 O -ATOM 1747 N GLU 113 -20.248 2.300 3.105 1.00 0.00 N -ATOM 1748 H GLU 113 -20.955 2.010 3.767 1.00 0.00 H -ATOM 1749 CA GLU 113 -20.583 2.303 1.704 1.00 0.00 C -ATOM 1750 HA GLU 113 -19.761 2.021 1.046 1.00 0.00 H -ATOM 1751 CB GLU 113 -21.678 1.247 1.421 1.00 0.00 C -ATOM 1752 HB2 GLU 113 -21.816 1.196 0.341 1.00 0.00 H -ATOM 1753 HB3 GLU 113 -21.370 0.265 1.779 1.00 0.00 H -ATOM 1754 CG GLU 113 -22.919 1.650 2.273 1.00 0.00 C -ATOM 1755 HG2 GLU 113 -22.692 1.516 3.330 1.00 0.00 H -ATOM 1756 HG3 GLU 113 -23.062 2.723 2.148 1.00 0.00 H -ATOM 1757 CD GLU 113 -24.149 0.809 1.815 1.00 0.00 C -ATOM 1758 OE1 GLU 113 -25.316 1.119 2.151 1.00 0.00 O -ATOM 1759 OE2 GLU 113 -24.005 0.047 0.850 1.00 0.00 O -ATOM 1760 C GLU 113 -21.054 3.688 1.085 1.00 0.00 C -ATOM 1761 O GLU 113 -21.217 3.800 -0.123 1.00 0.00 O -ATOM 1762 N GLU 114 -21.196 4.766 1.974 1.00 0.00 N -ATOM 1763 H GLU 114 -20.852 4.737 2.923 1.00 0.00 H -ATOM 1764 CA GLU 114 -21.789 6.051 1.668 1.00 0.00 C -ATOM 1765 HA GLU 114 -22.248 5.979 0.682 1.00 0.00 H -ATOM 1766 CB GLU 114 -23.022 6.274 2.614 1.00 0.00 C -ATOM 1767 HB2 GLU 114 -23.624 5.394 2.389 1.00 0.00 H -ATOM 1768 HB3 GLU 114 -22.721 6.260 3.662 1.00 0.00 H -ATOM 1769 CG GLU 114 -23.816 7.589 2.418 1.00 0.00 C -ATOM 1770 HG2 GLU 114 -24.664 7.743 3.085 1.00 0.00 H -ATOM 1771 HG3 GLU 114 -23.204 8.419 2.774 1.00 0.00 H -ATOM 1772 CD GLU 114 -24.352 7.836 1.027 1.00 0.00 C -ATOM 1773 OE1 GLU 114 -24.591 6.821 0.349 1.00 0.00 O -ATOM 1774 OE2 GLU 114 -24.507 8.989 0.672 1.00 0.00 O -ATOM 1775 C GLU 114 -20.815 7.284 1.426 1.00 0.00 C -ATOM 1776 O GLU 114 -21.177 8.166 0.648 1.00 0.00 O -ATOM 1777 N ASP 115 -19.623 7.225 2.060 1.00 0.00 N -ATOM 1778 H ASP 115 -19.493 6.517 2.769 1.00 0.00 H -ATOM 1779 CA ASP 115 -18.638 8.274 1.862 1.00 0.00 C -ATOM 1780 HA ASP 115 -19.220 9.192 1.943 1.00 0.00 H -ATOM 1781 CB ASP 115 -17.582 8.309 2.980 1.00 0.00 C -ATOM 1782 HB2 ASP 115 -18.071 8.325 3.955 1.00 0.00 H -ATOM 1783 HB3 ASP 115 -17.026 7.382 2.838 1.00 0.00 H -ATOM 1784 CG ASP 115 -16.532 9.422 2.906 1.00 0.00 C -ATOM 1785 OD1 ASP 115 -16.056 9.792 1.862 1.00 0.00 O -ATOM 1786 OD2 ASP 115 -16.057 9.822 3.966 1.00 0.00 O -ATOM 1787 C ASP 115 -18.093 8.284 0.421 1.00 0.00 C -ATOM 1788 O ASP 115 -17.643 7.269 -0.063 1.00 0.00 O -ATOM 1789 N PRO 116 -17.936 9.446 -0.277 1.00 0.00 N -ATOM 1790 CD PRO 116 -18.620 10.677 0.147 1.00 0.00 C -ATOM 1791 HD2 PRO 116 -18.175 11.030 1.077 1.00 0.00 H -ATOM 1792 HD3 PRO 116 -19.681 10.474 0.287 1.00 0.00 H -ATOM 1793 CG PRO 116 -18.441 11.725 -0.893 1.00 0.00 C -ATOM 1794 HG2 PRO 116 -17.719 12.448 -0.514 1.00 0.00 H -ATOM 1795 HG3 PRO 116 -19.392 12.209 -1.112 1.00 0.00 H -ATOM 1796 CB PRO 116 -17.987 10.931 -2.173 1.00 0.00 C -ATOM 1797 HB2 PRO 116 -17.205 11.383 -2.783 1.00 0.00 H -ATOM 1798 HB3 PRO 116 -18.872 10.690 -2.763 1.00 0.00 H -ATOM 1799 CA PRO 116 -17.440 9.518 -1.619 1.00 0.00 C -ATOM 1800 HA PRO 116 -17.913 8.725 -2.199 1.00 0.00 H -ATOM 1801 C PRO 116 -15.948 9.417 -1.690 1.00 0.00 C -ATOM 1802 O PRO 116 -15.363 8.786 -2.540 1.00 0.00 O -ATOM 1803 N LEU 117 -15.305 10.212 -0.858 1.00 0.00 N -ATOM 1804 H LEU 117 -15.760 10.719 -0.112 1.00 0.00 H -ATOM 1805 CA LEU 117 -13.881 10.520 -1.112 1.00 0.00 C -ATOM 1806 HA LEU 117 -13.552 10.142 -2.080 1.00 0.00 H -ATOM 1807 CB LEU 117 -13.634 12.058 -1.110 1.00 0.00 C -ATOM 1808 HB2 LEU 117 -13.738 12.347 -0.064 1.00 0.00 H -ATOM 1809 HB3 LEU 117 -12.586 12.146 -1.397 1.00 0.00 H -ATOM 1810 CG LEU 117 -14.507 12.942 -2.028 1.00 0.00 C -ATOM 1811 HG LEU 117 -15.492 13.130 -1.599 1.00 0.00 H -ATOM 1812 CD1 LEU 117 -13.883 14.357 -2.126 1.00 0.00 C -ATOM 1813 HD11 LEU 117 -13.687 14.627 -1.089 1.00 0.00 H -ATOM 1814 HD12 LEU 117 -12.947 14.401 -2.683 1.00 0.00 H -ATOM 1815 HD13 LEU 117 -14.562 15.124 -2.500 1.00 0.00 H -ATOM 1816 CD2 LEU 117 -14.714 12.484 -3.514 1.00 0.00 C -ATOM 1817 HD21 LEU 117 -13.874 12.637 -4.192 1.00 0.00 H -ATOM 1818 HD22 LEU 117 -15.096 11.464 -3.479 1.00 0.00 H -ATOM 1819 HD23 LEU 117 -15.486 13.099 -3.976 1.00 0.00 H -ATOM 1820 C LEU 117 -13.004 9.697 -0.142 1.00 0.00 C -ATOM 1821 O LEU 117 -11.745 9.581 -0.371 1.00 0.00 O -ATOM 1822 N ALA 118 -13.581 9.177 1.012 1.00 0.00 N -ATOM 1823 H ALA 118 -14.442 9.513 1.421 1.00 0.00 H -ATOM 1824 CA ALA 118 -12.730 8.241 1.805 1.00 0.00 C -ATOM 1825 HA ALA 118 -11.949 8.807 2.312 1.00 0.00 H -ATOM 1826 CB ALA 118 -13.538 7.721 2.984 1.00 0.00 C -ATOM 1827 HB1 ALA 118 -13.764 8.458 3.755 1.00 0.00 H -ATOM 1828 HB2 ALA 118 -14.482 7.304 2.633 1.00 0.00 H -ATOM 1829 HB3 ALA 118 -13.015 6.889 3.455 1.00 0.00 H -ATOM 1830 C ALA 118 -12.110 7.137 0.900 1.00 0.00 C -ATOM 1831 O ALA 118 -12.756 6.468 0.063 1.00 0.00 O -ATOM 1832 N GLY 119 -10.907 6.790 1.201 1.00 0.00 N -ATOM 1833 H GLY 119 -10.401 7.265 1.935 1.00 0.00 H -ATOM 1834 CA GLY 119 -10.272 5.567 0.619 1.00 0.00 C -ATOM 1835 HA2 GLY 119 -10.588 5.505 -0.422 1.00 0.00 H -ATOM 1836 HA3 GLY 119 -9.190 5.669 0.710 1.00 0.00 H -ATOM 1837 C GLY 119 -10.629 4.194 1.152 1.00 0.00 C -ATOM 1838 O GLY 119 -11.716 3.985 1.680 1.00 0.00 O -ATOM 1839 N ILE 120 -9.627 3.357 1.190 1.00 0.00 N -ATOM 1840 H ILE 120 -8.765 3.580 0.714 1.00 0.00 H -ATOM 1841 CA ILE 120 -9.839 1.947 1.473 1.00 0.00 C -ATOM 1842 HA ILE 120 -10.836 1.587 1.219 1.00 0.00 H -ATOM 1843 CB ILE 120 -8.746 1.042 0.741 1.00 0.00 C -ATOM 1844 HB ILE 120 -7.812 1.592 0.857 1.00 0.00 H -ATOM 1845 CG2 ILE 120 -8.613 -0.357 1.440 1.00 0.00 C -ATOM 1846 HG21 ILE 120 -7.803 -0.791 0.853 1.00 0.00 H -ATOM 1847 HG22 ILE 120 -8.389 -0.159 2.488 1.00 0.00 H -ATOM 1848 HG23 ILE 120 -9.596 -0.827 1.401 1.00 0.00 H -ATOM 1849 CG1 ILE 120 -9.144 1.045 -0.724 1.00 0.00 C -ATOM 1850 HG12 ILE 120 -10.130 0.625 -0.924 1.00 0.00 H -ATOM 1851 HG13 ILE 120 -9.320 2.010 -1.198 1.00 0.00 H -ATOM 1852 CD1 ILE 120 -8.073 0.421 -1.561 1.00 0.00 C -ATOM 1853 HD11 ILE 120 -8.240 -0.653 -1.484 1.00 0.00 H -ATOM 1854 HD12 ILE 120 -8.094 0.711 -2.611 1.00 0.00 H -ATOM 1855 HD13 ILE 120 -7.107 0.627 -1.101 1.00 0.00 H -ATOM 1856 C ILE 120 -9.788 1.774 2.994 1.00 0.00 C -ATOM 1857 O ILE 120 -10.679 1.316 3.645 1.00 0.00 O -ATOM 1858 N ILE 121 -8.713 2.229 3.673 1.00 0.00 N -ATOM 1859 H ILE 121 -7.986 2.755 3.210 1.00 0.00 H -ATOM 1860 CA ILE 121 -8.446 2.072 5.126 1.00 0.00 C -ATOM 1861 HA ILE 121 -8.178 1.048 5.384 1.00 0.00 H -ATOM 1862 CB ILE 121 -7.089 2.835 5.485 1.00 0.00 C -ATOM 1863 HB ILE 121 -7.105 3.887 5.202 1.00 0.00 H -ATOM 1864 CG2 ILE 121 -6.937 2.701 6.995 1.00 0.00 C -ATOM 1865 HG21 ILE 121 -7.652 3.385 7.452 1.00 0.00 H -ATOM 1866 HG22 ILE 121 -7.228 1.700 7.313 1.00 0.00 H -ATOM 1867 HG23 ILE 121 -5.923 2.951 7.305 1.00 0.00 H -ATOM 1868 CG1 ILE 121 -5.869 2.200 4.798 1.00 0.00 C -ATOM 1869 HG12 ILE 121 -5.608 1.250 5.265 1.00 0.00 H -ATOM 1870 HG13 ILE 121 -5.989 2.047 3.725 1.00 0.00 H -ATOM 1871 CD1 ILE 121 -4.594 3.143 4.963 1.00 0.00 C -ATOM 1872 HD11 ILE 121 -4.412 3.500 5.976 1.00 0.00 H -ATOM 1873 HD12 ILE 121 -3.664 2.589 4.832 1.00 0.00 H -ATOM 1874 HD13 ILE 121 -4.624 4.037 4.340 1.00 0.00 H -ATOM 1875 C ILE 121 -9.620 2.375 6.037 1.00 0.00 C -ATOM 1876 O ILE 121 -10.052 1.433 6.716 1.00 0.00 O -ATOM 1877 N PRO 122 -10.218 3.595 6.033 1.00 0.00 N -ATOM 1878 CD PRO 122 -9.909 4.768 5.245 1.00 0.00 C -ATOM 1879 HD2 PRO 122 -10.189 4.731 4.193 1.00 0.00 H -ATOM 1880 HD3 PRO 122 -8.839 4.975 5.277 1.00 0.00 H -ATOM 1881 CG PRO 122 -10.619 6.038 5.881 1.00 0.00 C -ATOM 1882 HG2 PRO 122 -11.053 6.635 5.079 1.00 0.00 H -ATOM 1883 HG3 PRO 122 -9.981 6.571 6.586 1.00 0.00 H -ATOM 1884 CB PRO 122 -11.702 5.351 6.665 1.00 0.00 C -ATOM 1885 HB2 PRO 122 -12.569 5.427 6.010 1.00 0.00 H -ATOM 1886 HB3 PRO 122 -11.985 5.772 7.629 1.00 0.00 H -ATOM 1887 CA PRO 122 -11.241 3.922 6.998 1.00 0.00 C -ATOM 1888 HA PRO 122 -10.816 3.892 8.002 1.00 0.00 H -ATOM 1889 C PRO 122 -12.462 2.990 6.904 1.00 0.00 C -ATOM 1890 O PRO 122 -13.066 2.579 7.932 1.00 0.00 O -ATOM 1891 N ARG 123 -12.763 2.519 5.691 1.00 0.00 N -ATOM 1892 H ARG 123 -12.200 2.807 4.903 1.00 0.00 H -ATOM 1893 CA ARG 123 -13.853 1.582 5.414 1.00 0.00 C -ATOM 1894 HA ARG 123 -14.823 1.888 5.806 1.00 0.00 H -ATOM 1895 CB ARG 123 -14.105 1.508 3.902 1.00 0.00 C -ATOM 1896 HB2 ARG 123 -13.172 1.246 3.403 1.00 0.00 H -ATOM 1897 HB3 ARG 123 -14.851 0.721 3.790 1.00 0.00 H -ATOM 1898 CG ARG 123 -14.708 2.804 3.272 1.00 0.00 C -ATOM 1899 HG2 ARG 123 -15.669 2.928 3.770 1.00 0.00 H -ATOM 1900 HG3 ARG 123 -14.137 3.701 3.508 1.00 0.00 H -ATOM 1901 CD ARG 123 -14.812 2.575 1.787 1.00 0.00 C -ATOM 1902 HD2 ARG 123 -13.928 2.022 1.471 1.00 0.00 H -ATOM 1903 HD3 ARG 123 -15.725 2.062 1.486 1.00 0.00 H -ATOM 1904 NE ARG 123 -14.762 3.798 0.976 1.00 0.00 N -ATOM 1905 HE ARG 123 -13.843 4.157 0.758 1.00 0.00 H -ATOM 1906 CZ ARG 123 -15.721 4.534 0.491 1.00 0.00 C -ATOM 1907 NH1 ARG 123 -17.002 4.417 0.763 1.00 0.00 N -ATOM 1908 HH11 ARG 123 -17.282 3.831 1.537 1.00 0.00 H -ATOM 1909 HH12 ARG 123 -17.646 4.998 0.246 1.00 0.00 H -ATOM 1910 NH2 ARG 123 -15.348 5.538 -0.273 1.00 0.00 N -ATOM 1911 HH21 ARG 123 -14.378 5.807 -0.184 1.00 0.00 H -ATOM 1912 HH22 ARG 123 -16.069 6.179 -0.572 1.00 0.00 H -ATOM 1913 C ARG 123 -13.497 0.218 5.986 1.00 0.00 C -ATOM 1914 O ARG 123 -14.378 -0.327 6.617 1.00 0.00 O -ATOM 1915 N THR 124 -12.318 -0.265 5.749 1.00 0.00 N -ATOM 1916 H THR 124 -11.667 0.325 5.250 1.00 0.00 H -ATOM 1917 CA THR 124 -11.843 -1.561 6.314 1.00 0.00 C -ATOM 1918 HA THR 124 -12.535 -2.282 5.877 1.00 0.00 H -ATOM 1919 CB THR 124 -10.384 -1.950 5.997 1.00 0.00 C -ATOM 1920 HB THR 124 -9.634 -1.365 6.531 1.00 0.00 H -ATOM 1921 CG2 THR 124 -10.014 -3.421 6.138 1.00 0.00 C -ATOM 1922 HG21 THR 124 -10.259 -3.969 7.048 1.00 0.00 H -ATOM 1923 HG22 THR 124 -10.544 -3.998 5.380 1.00 0.00 H -ATOM 1924 HG23 THR 124 -8.958 -3.524 5.890 1.00 0.00 H -ATOM 1925 OG1 THR 124 -10.286 -1.726 4.634 1.00 0.00 O -ATOM 1926 HG1 THR 124 -10.248 -0.768 4.595 1.00 0.00 H -ATOM 1927 C THR 124 -11.958 -1.550 7.837 1.00 0.00 C -ATOM 1928 O THR 124 -12.642 -2.440 8.374 1.00 0.00 O -ATOM 1929 N LEU 125 -11.367 -0.595 8.514 1.00 0.00 N -ATOM 1930 H LEU 125 -10.764 0.059 8.035 1.00 0.00 H -ATOM 1931 CA LEU 125 -11.474 -0.457 9.955 1.00 0.00 C -ATOM 1932 HA LEU 125 -10.947 -1.265 10.461 1.00 0.00 H -ATOM 1933 CB LEU 125 -10.719 0.909 10.280 1.00 0.00 C -ATOM 1934 HB2 LEU 125 -9.813 0.927 9.673 1.00 0.00 H -ATOM 1935 HB3 LEU 125 -11.356 1.694 9.874 1.00 0.00 H -ATOM 1936 CG LEU 125 -10.588 1.396 11.723 1.00 0.00 C -ATOM 1937 HG LEU 125 -11.600 1.610 12.065 1.00 0.00 H -ATOM 1938 CD1 LEU 125 -9.876 0.338 12.563 1.00 0.00 C -ATOM 1939 HD11 LEU 125 -10.531 -0.524 12.433 1.00 0.00 H -ATOM 1940 HD12 LEU 125 -8.892 0.013 12.226 1.00 0.00 H -ATOM 1941 HD13 LEU 125 -9.907 0.636 13.611 1.00 0.00 H -ATOM 1942 CD2 LEU 125 -9.693 2.596 11.750 1.00 0.00 C -ATOM 1943 HD21 LEU 125 -10.016 3.414 11.107 1.00 0.00 H -ATOM 1944 HD22 LEU 125 -9.767 3.055 12.736 1.00 0.00 H -ATOM 1945 HD23 LEU 125 -8.680 2.342 11.439 1.00 0.00 H -ATOM 1946 C LEU 125 -12.877 -0.415 10.420 1.00 0.00 C -ATOM 1947 O LEU 125 -13.125 -0.781 11.561 1.00 0.00 O -ATOM 1948 N HIE 126 -13.852 0.071 9.618 1.00 0.00 N -ATOM 1949 H HIE 126 -13.633 0.501 8.731 1.00 0.00 H -ATOM 1950 CA HIE 126 -15.222 0.089 10.029 1.00 0.00 C -ATOM 1951 HA HIE 126 -15.420 0.356 11.067 1.00 0.00 H -ATOM 1952 CB HIE 126 -15.922 1.229 9.322 1.00 0.00 C -ATOM 1953 HB2 HIE 126 -15.287 2.114 9.363 1.00 0.00 H -ATOM 1954 HB3 HIE 126 -15.866 0.960 8.267 1.00 0.00 H -ATOM 1955 CG HIE 126 -17.470 1.495 9.575 1.00 0.00 C -ATOM 1956 ND1 HIE 126 -18.343 2.228 8.768 1.00 0.00 N -ATOM 1957 CE1 HIE 126 -19.553 2.138 9.314 1.00 0.00 C -ATOM 1958 HE1 HIE 126 -20.518 2.446 8.939 1.00 0.00 H -ATOM 1959 NE2 HIE 126 -19.474 1.356 10.369 1.00 0.00 N -ATOM 1960 HE2 HIE 126 -20.241 0.828 10.760 1.00 0.00 H -ATOM 1961 CD2 HIE 126 -18.163 0.964 10.580 1.00 0.00 C -ATOM 1962 HD2 HIE 126 -17.903 0.268 11.364 1.00 0.00 H -ATOM 1963 C HIE 126 -15.844 -1.294 9.730 1.00 0.00 C -ATOM 1964 O HIE 126 -16.442 -1.921 10.553 1.00 0.00 O -ATOM 1965 N GLN 127 -15.746 -1.771 8.486 1.00 0.00 N -ATOM 1966 H GLN 127 -15.299 -1.269 7.732 1.00 0.00 H -ATOM 1967 CA GLN 127 -16.410 -2.994 8.090 1.00 0.00 C -ATOM 1968 HA GLN 127 -17.465 -2.909 8.350 1.00 0.00 H -ATOM 1969 CB GLN 127 -16.304 -3.162 6.500 1.00 0.00 C -ATOM 1970 HB2 GLN 127 -16.783 -2.259 6.121 1.00 0.00 H -ATOM 1971 HB3 GLN 127 -15.265 -3.199 6.172 1.00 0.00 H -ATOM 1972 CG GLN 127 -17.088 -4.412 5.989 1.00 0.00 C -ATOM 1973 HG2 GLN 127 -16.667 -5.340 6.375 1.00 0.00 H -ATOM 1974 HG3 GLN 127 -18.129 -4.247 6.268 1.00 0.00 H -ATOM 1975 CD GLN 127 -16.997 -4.631 4.468 1.00 0.00 C -ATOM 1976 OE1 GLN 127 -16.061 -4.240 3.784 1.00 0.00 O -ATOM 1977 NE2 GLN 127 -17.809 -5.543 3.963 1.00 0.00 N -ATOM 1978 HE21 GLN 127 -17.684 -5.837 3.005 1.00 0.00 H -ATOM 1979 HE22 GLN 127 -18.613 -5.901 4.459 1.00 0.00 H -ATOM 1980 C GLN 127 -15.951 -4.241 8.830 1.00 0.00 C -ATOM 1981 O GLN 127 -16.723 -5.202 8.812 1.00 0.00 O -ATOM 1982 N ILE 128 -14.787 -4.230 9.505 1.00 0.00 N -ATOM 1983 H ILE 128 -14.192 -3.448 9.270 1.00 0.00 H -ATOM 1984 CA ILE 128 -14.355 -5.364 10.279 1.00 0.00 C -ATOM 1985 HA ILE 128 -14.308 -6.205 9.588 1.00 0.00 H -ATOM 1986 CB ILE 128 -13.007 -5.056 10.880 1.00 0.00 C -ATOM 1987 HB ILE 128 -12.947 -4.005 11.162 1.00 0.00 H -ATOM 1988 CG2 ILE 128 -12.625 -5.875 12.089 1.00 0.00 C -ATOM 1989 HG21 ILE 128 -12.831 -6.936 11.953 1.00 0.00 H -ATOM 1990 HG22 ILE 128 -11.558 -5.882 12.313 1.00 0.00 H -ATOM 1991 HG23 ILE 128 -13.159 -5.442 12.934 1.00 0.00 H -ATOM 1992 CG1 ILE 128 -11.941 -5.393 9.790 1.00 0.00 C -ATOM 1993 HG12 ILE 128 -11.761 -6.459 9.653 1.00 0.00 H -ATOM 1994 HG13 ILE 128 -12.373 -5.023 8.859 1.00 0.00 H -ATOM 1995 CD1 ILE 128 -10.606 -4.738 10.011 1.00 0.00 C -ATOM 1996 HD11 ILE 128 -10.648 -3.763 10.497 1.00 0.00 H -ATOM 1997 HD12 ILE 128 -9.931 -5.324 10.635 1.00 0.00 H -ATOM 1998 HD13 ILE 128 -10.099 -4.694 9.047 1.00 0.00 H -ATOM 1999 C ILE 128 -15.403 -5.653 11.388 1.00 0.00 C -ATOM 2000 O ILE 128 -15.987 -6.740 11.442 1.00 0.00 O -ATOM 2001 N PHE 129 -15.663 -4.601 12.183 1.00 0.00 N -ATOM 2002 H PHE 129 -15.132 -3.750 12.069 1.00 0.00 H -ATOM 2003 CA PHE 129 -16.733 -4.652 13.154 1.00 0.00 C -ATOM 2004 HA PHE 129 -16.555 -5.399 13.928 1.00 0.00 H -ATOM 2005 CB PHE 129 -16.744 -3.293 13.821 1.00 0.00 C -ATOM 2006 HB2 PHE 129 -16.763 -2.485 13.089 1.00 0.00 H -ATOM 2007 HB3 PHE 129 -17.609 -3.164 14.471 1.00 0.00 H -ATOM 2008 CG PHE 129 -15.516 -2.973 14.650 1.00 0.00 C -ATOM 2009 CD1 PHE 129 -14.468 -2.181 14.124 1.00 0.00 C -ATOM 2010 HD1 PHE 129 -14.608 -1.783 13.129 1.00 0.00 H -ATOM 2011 CE1 PHE 129 -13.301 -1.938 14.918 1.00 0.00 C -ATOM 2012 HE1 PHE 129 -12.478 -1.347 14.544 1.00 0.00 H -ATOM 2013 CZ PHE 129 -13.305 -2.481 16.218 1.00 0.00 C -ATOM 2014 HZ PHE 129 -12.451 -2.229 16.829 1.00 0.00 H -ATOM 2015 CE2 PHE 129 -14.354 -3.254 16.701 1.00 0.00 C -ATOM 2016 HE2 PHE 129 -14.251 -3.612 17.714 1.00 0.00 H -ATOM 2017 CD2 PHE 129 -15.441 -3.537 15.897 1.00 0.00 C -ATOM 2018 HD2 PHE 129 -16.286 -4.100 16.266 1.00 0.00 H -ATOM 2019 C PHE 129 -18.157 -4.914 12.706 1.00 0.00 C -ATOM 2020 O PHE 129 -18.908 -5.601 13.382 1.00 0.00 O -ATOM 2021 N GLU 130 -18.408 -4.519 11.451 1.00 0.00 N -ATOM 2022 H GLU 130 -17.701 -3.930 11.033 1.00 0.00 H -ATOM 2023 CA GLU 130 -19.657 -4.840 10.782 1.00 0.00 C -ATOM 2024 HA GLU 130 -20.400 -4.510 11.509 1.00 0.00 H -ATOM 2025 CB GLU 130 -19.879 -3.942 9.558 1.00 0.00 C -ATOM 2026 HB2 GLU 130 -19.123 -4.035 8.778 1.00 0.00 H -ATOM 2027 HB3 GLU 130 -20.758 -4.277 9.007 1.00 0.00 H -ATOM 2028 CG GLU 130 -19.968 -2.405 9.923 1.00 0.00 C -ATOM 2029 HG2 GLU 130 -19.056 -2.166 10.469 1.00 0.00 H -ATOM 2030 HG3 GLU 130 -20.069 -1.794 9.027 1.00 0.00 H -ATOM 2031 CD GLU 130 -21.296 -2.064 10.718 1.00 0.00 C -ATOM 2032 OE1 GLU 130 -21.576 -0.853 10.843 1.00 0.00 O -ATOM 2033 OE2 GLU 130 -22.097 -2.961 11.123 1.00 0.00 O -ATOM 2034 C GLU 130 -19.842 -6.356 10.305 1.00 0.00 C -ATOM 2035 O GLU 130 -20.865 -6.965 10.487 1.00 0.00 O -ATOM 2036 N LYS 131 -18.721 -6.940 9.766 1.00 0.00 N -ATOM 2037 H LYS 131 -17.902 -6.352 9.706 1.00 0.00 H -ATOM 2038 CA LYS 131 -18.610 -8.257 9.239 1.00 0.00 C -ATOM 2039 HA LYS 131 -19.415 -8.489 8.543 1.00 0.00 H -ATOM 2040 CB LYS 131 -17.381 -8.272 8.407 1.00 0.00 C -ATOM 2041 HB2 LYS 131 -17.318 -7.381 7.782 1.00 0.00 H -ATOM 2042 HB3 LYS 131 -16.567 -8.234 9.130 1.00 0.00 H -ATOM 2043 CG LYS 131 -17.281 -9.440 7.386 1.00 0.00 C -ATOM 2044 HG2 LYS 131 -17.091 -10.402 7.862 1.00 0.00 H -ATOM 2045 HG3 LYS 131 -18.182 -9.648 6.808 1.00 0.00 H -ATOM 2046 CD LYS 131 -16.324 -9.111 6.261 1.00 0.00 C -ATOM 2047 HD2 LYS 131 -16.840 -8.502 5.518 1.00 0.00 H -ATOM 2048 HD3 LYS 131 -15.417 -8.575 6.537 1.00 0.00 H -ATOM 2049 CE LYS 131 -15.755 -10.317 5.447 1.00 0.00 C -ATOM 2050 HE2 LYS 131 -14.988 -9.969 4.755 1.00 0.00 H -ATOM 2051 HE3 LYS 131 -15.206 -11.010 6.085 1.00 0.00 H -ATOM 2052 NZ LYS 131 -16.768 -11.021 4.581 1.00 0.00 N -ATOM 2053 HZ1 LYS 131 -17.298 -11.708 5.097 1.00 0.00 H -ATOM 2054 HZ2 LYS 131 -17.434 -10.421 4.114 1.00 0.00 H -ATOM 2055 HZ3 LYS 131 -16.272 -11.437 3.806 1.00 0.00 H -ATOM 2056 C LYS 131 -18.582 -9.316 10.402 1.00 0.00 C -ATOM 2057 O LYS 131 -18.984 -10.484 10.239 1.00 0.00 O -ATOM 2058 N LEU 132 -18.112 -8.919 11.601 1.00 0.00 N -ATOM 2059 H LEU 132 -17.733 -7.983 11.632 1.00 0.00 H -ATOM 2060 CA LEU 132 -18.035 -9.687 12.878 1.00 0.00 C -ATOM 2061 HA LEU 132 -17.971 -10.765 12.733 1.00 0.00 H -ATOM 2062 CB LEU 132 -16.929 -9.136 13.808 1.00 0.00 C -ATOM 2063 HB2 LEU 132 -17.048 -8.067 13.986 1.00 0.00 H -ATOM 2064 HB3 LEU 132 -17.074 -9.643 14.761 1.00 0.00 H -ATOM 2065 CG LEU 132 -15.571 -9.495 13.173 1.00 0.00 C -ATOM 2066 HG LEU 132 -15.519 -9.104 12.157 1.00 0.00 H -ATOM 2067 CD1 LEU 132 -14.549 -8.669 13.896 1.00 0.00 C -ATOM 2068 HD11 LEU 132 -14.571 -9.007 14.932 1.00 0.00 H -ATOM 2069 HD12 LEU 132 -13.609 -8.836 13.370 1.00 0.00 H -ATOM 2070 HD13 LEU 132 -14.764 -7.605 13.799 1.00 0.00 H -ATOM 2071 CD2 LEU 132 -15.297 -10.995 13.253 1.00 0.00 C -ATOM 2072 HD21 LEU 132 -15.638 -11.470 14.173 1.00 0.00 H -ATOM 2073 HD22 LEU 132 -15.750 -11.524 12.414 1.00 0.00 H -ATOM 2074 HD23 LEU 132 -14.242 -11.268 13.254 1.00 0.00 H -ATOM 2075 C LEU 132 -19.353 -9.624 13.672 1.00 0.00 C -ATOM 2076 O LEU 132 -19.813 -10.689 14.186 1.00 0.00 O -ATOM 2077 N THR 133 -19.983 -8.422 13.752 1.00 0.00 N -ATOM 2078 H THR 133 -19.561 -7.681 13.209 1.00 0.00 H -ATOM 2079 CA THR 133 -21.208 -8.204 14.543 1.00 0.00 C -ATOM 2080 HA THR 133 -21.001 -8.644 15.519 1.00 0.00 H -ATOM 2081 CB THR 133 -21.552 -6.667 14.714 1.00 0.00 C -ATOM 2082 HB THR 133 -21.632 -6.210 13.727 1.00 0.00 H -ATOM 2083 CG2 THR 133 -22.886 -6.426 15.410 1.00 0.00 C -ATOM 2084 HG21 THR 133 -22.987 -5.341 15.392 1.00 0.00 H -ATOM 2085 HG22 THR 133 -23.701 -6.978 14.942 1.00 0.00 H -ATOM 2086 HG23 THR 133 -22.635 -6.765 16.415 1.00 0.00 H -ATOM 2087 OG1 THR 133 -20.423 -6.159 15.443 1.00 0.00 O -ATOM 2088 HG1 THR 133 -19.823 -5.762 14.807 1.00 0.00 H -ATOM 2089 C THR 133 -22.353 -8.918 13.792 1.00 0.00 C -ATOM 2090 O THR 133 -23.266 -9.375 14.489 1.00 0.00 O -ATOM 2091 N ASP 134 -22.284 -9.106 12.512 1.00 0.00 N -ATOM 2092 H ASP 134 -21.658 -8.548 11.949 1.00 0.00 H -ATOM 2093 CA ASP 134 -23.217 -10.009 11.796 1.00 0.00 C -ATOM 2094 HA ASP 134 -24.250 -9.854 12.108 1.00 0.00 H -ATOM 2095 CB ASP 134 -22.983 -9.728 10.288 1.00 0.00 C -ATOM 2096 HB2 ASP 134 -23.289 -8.689 10.168 1.00 0.00 H -ATOM 2097 HB3 ASP 134 -21.981 -9.926 9.906 1.00 0.00 H -ATOM 2098 CG ASP 134 -23.976 -10.504 9.454 1.00 0.00 C -ATOM 2099 OD1 ASP 134 -23.501 -11.064 8.442 1.00 0.00 O -ATOM 2100 OD2 ASP 134 -25.178 -10.267 9.640 1.00 0.00 O -ATOM 2101 C ASP 134 -22.952 -11.509 12.070 1.00 0.00 C -ATOM 2102 O ASP 134 -23.999 -12.202 12.225 1.00 0.00 O -ATOM 2103 N ASN 135 -21.739 -12.058 12.419 1.00 0.00 N -ATOM 2104 H ASN 135 -20.909 -11.504 12.265 1.00 0.00 H -ATOM 2105 CA ASN 135 -21.473 -13.424 12.780 1.00 0.00 C -ATOM 2106 HA ASN 135 -22.189 -13.969 12.164 1.00 0.00 H -ATOM 2107 CB ASN 135 -20.107 -13.925 12.200 1.00 0.00 C -ATOM 2108 HB2 ASN 135 -20.105 -13.789 11.119 1.00 0.00 H -ATOM 2109 HB3 ASN 135 -19.339 -13.280 12.628 1.00 0.00 H -ATOM 2110 CG ASN 135 -19.698 -15.302 12.603 1.00 0.00 C -ATOM 2111 OD1 ASN 135 -19.308 -15.557 13.690 1.00 0.00 O -ATOM 2112 ND2 ASN 135 -19.859 -16.297 11.745 1.00 0.00 N -ATOM 2113 HD21 ASN 135 -19.508 -17.190 12.061 1.00 0.00 H -ATOM 2114 HD22 ASN 135 -20.264 -16.096 10.842 1.00 0.00 H -ATOM 2115 C ASN 135 -21.730 -13.816 14.272 1.00 0.00 C -ATOM 2116 O ASN 135 -22.127 -14.944 14.534 1.00 0.00 O -ATOM 2117 N GLY 136 -21.480 -12.906 15.204 1.00 0.00 N -ATOM 2118 H GLY 136 -21.190 -11.979 14.925 1.00 0.00 H -ATOM 2119 CA GLY 136 -21.770 -13.041 16.649 1.00 0.00 C -ATOM 2120 HA2 GLY 136 -21.830 -12.057 17.115 1.00 0.00 H -ATOM 2121 HA3 GLY 136 -22.724 -13.568 16.669 1.00 0.00 H -ATOM 2122 C GLY 136 -20.658 -13.849 17.270 1.00 0.00 C -ATOM 2123 O GLY 136 -20.809 -14.284 18.421 1.00 0.00 O -ATOM 2124 N THR 137 -19.473 -14.051 16.673 1.00 0.00 N -ATOM 2125 H THR 137 -19.363 -13.715 15.727 1.00 0.00 H -ATOM 2126 CA THR 137 -18.224 -14.559 17.301 1.00 0.00 C -ATOM 2127 HA THR 137 -18.398 -15.524 17.777 1.00 0.00 H -ATOM 2128 CB THR 137 -17.172 -14.883 16.276 1.00 0.00 C -ATOM 2129 HB THR 137 -17.469 -15.614 15.525 1.00 0.00 H -ATOM 2130 CG2 THR 137 -16.661 -13.670 15.505 1.00 0.00 C -ATOM 2131 HG21 THR 137 -17.403 -12.981 15.101 1.00 0.00 H -ATOM 2132 HG22 THR 137 -16.120 -13.029 16.200 1.00 0.00 H -ATOM 2133 HG23 THR 137 -15.936 -14.059 14.789 1.00 0.00 H -ATOM 2134 OG1 THR 137 -15.965 -15.417 16.835 1.00 0.00 O -ATOM 2135 HG1 THR 137 -16.111 -16.205 17.364 1.00 0.00 H -ATOM 2136 C THR 137 -17.826 -13.568 18.425 1.00 0.00 C -ATOM 2137 O THR 137 -18.160 -12.360 18.328 1.00 0.00 O -ATOM 2138 N GLU 138 -17.124 -13.977 19.474 1.00 0.00 N -ATOM 2139 H GLU 138 -16.935 -14.968 19.505 1.00 0.00 H -ATOM 2140 CA GLU 138 -16.274 -13.131 20.257 1.00 0.00 C -ATOM 2141 HA GLU 138 -16.802 -12.179 20.293 1.00 0.00 H -ATOM 2142 CB GLU 138 -16.174 -13.699 21.690 1.00 0.00 C -ATOM 2143 HB2 GLU 138 -17.163 -13.882 22.111 1.00 0.00 H -ATOM 2144 HB3 GLU 138 -15.764 -14.708 21.634 1.00 0.00 H -ATOM 2145 CG GLU 138 -15.316 -12.914 22.640 1.00 0.00 C -ATOM 2146 HG2 GLU 138 -15.532 -13.363 23.609 1.00 0.00 H -ATOM 2147 HG3 GLU 138 -14.261 -13.126 22.469 1.00 0.00 H -ATOM 2148 CD GLU 138 -15.477 -11.391 22.731 1.00 0.00 C -ATOM 2149 OE1 GLU 138 -15.970 -10.631 21.838 1.00 0.00 O -ATOM 2150 OE2 GLU 138 -15.126 -10.790 23.760 1.00 0.00 O -ATOM 2151 C GLU 138 -14.896 -12.860 19.604 1.00 0.00 C -ATOM 2152 O GLU 138 -14.196 -13.764 19.072 1.00 0.00 O -ATOM 2153 N PHE 139 -14.423 -11.638 19.704 1.00 0.00 N -ATOM 2154 H PHE 139 -15.014 -11.059 20.283 1.00 0.00 H -ATOM 2155 CA PHE 139 -13.271 -11.101 18.849 1.00 0.00 C -ATOM 2156 HA PHE 139 -12.586 -11.922 18.641 1.00 0.00 H -ATOM 2157 CB PHE 139 -13.867 -10.651 17.485 1.00 0.00 C -ATOM 2158 HB2 PHE 139 -13.044 -10.526 16.781 1.00 0.00 H -ATOM 2159 HB3 PHE 139 -14.366 -11.501 17.021 1.00 0.00 H -ATOM 2160 CG PHE 139 -14.728 -9.472 17.482 1.00 0.00 C -ATOM 2161 CD1 PHE 139 -16.146 -9.603 17.392 1.00 0.00 C -ATOM 2162 HD1 PHE 139 -16.611 -10.574 17.308 1.00 0.00 H -ATOM 2163 CE1 PHE 139 -16.942 -8.488 17.430 1.00 0.00 C -ATOM 2164 HE1 PHE 139 -17.990 -8.737 17.339 1.00 0.00 H -ATOM 2165 CZ PHE 139 -16.433 -7.206 17.371 1.00 0.00 C -ATOM 2166 HZ PHE 139 -17.095 -6.371 17.193 1.00 0.00 H -ATOM 2167 CE2 PHE 139 -15.070 -7.020 17.559 1.00 0.00 C -ATOM 2168 HE2 PHE 139 -14.719 -6.011 17.404 1.00 0.00 H -ATOM 2169 CD2 PHE 139 -14.219 -8.137 17.685 1.00 0.00 C -ATOM 2170 HD2 PHE 139 -13.141 -8.104 17.745 1.00 0.00 H -ATOM 2171 C PHE 139 -12.446 -10.020 19.547 1.00 0.00 C -ATOM 2172 O PHE 139 -12.894 -9.342 20.461 1.00 0.00 O -ATOM 2173 N SER 140 -11.288 -9.727 19.001 1.00 0.00 N -ATOM 2174 H SER 140 -10.923 -10.471 18.424 1.00 0.00 H -ATOM 2175 CA SER 140 -10.469 -8.596 19.517 1.00 0.00 C -ATOM 2176 HA SER 140 -11.173 -7.828 19.836 1.00 0.00 H -ATOM 2177 CB SER 140 -9.670 -8.934 20.727 1.00 0.00 C -ATOM 2178 HB2 SER 140 -10.229 -9.124 21.644 1.00 0.00 H -ATOM 2179 HB3 SER 140 -9.142 -9.863 20.513 1.00 0.00 H -ATOM 2180 OG SER 140 -8.715 -7.917 20.955 1.00 0.00 O -ATOM 2181 HG SER 140 -9.238 -7.199 21.319 1.00 0.00 H -ATOM 2182 C SER 140 -9.606 -7.994 18.432 1.00 0.00 C -ATOM 2183 O SER 140 -8.783 -8.672 17.780 1.00 0.00 O -ATOM 2184 N VAL 141 -9.783 -6.742 18.166 1.00 0.00 N -ATOM 2185 H VAL 141 -10.433 -6.199 18.717 1.00 0.00 H -ATOM 2186 CA VAL 141 -9.140 -6.019 17.030 1.00 0.00 C -ATOM 2187 HA VAL 141 -8.749 -6.771 16.345 1.00 0.00 H -ATOM 2188 CB VAL 141 -9.993 -5.105 16.168 1.00 0.00 C -ATOM 2189 HB VAL 141 -10.678 -4.424 16.673 1.00 0.00 H -ATOM 2190 CG1 VAL 141 -9.255 -4.327 15.065 1.00 0.00 C -ATOM 2191 HG11 VAL 141 -8.707 -3.454 15.418 1.00 0.00 H -ATOM 2192 HG12 VAL 141 -8.618 -4.962 14.449 1.00 0.00 H -ATOM 2193 HG13 VAL 141 -9.990 -3.920 14.370 1.00 0.00 H -ATOM 2194 CG2 VAL 141 -10.987 -5.984 15.421 1.00 0.00 C -ATOM 2195 HG21 VAL 141 -11.792 -5.346 15.056 1.00 0.00 H -ATOM 2196 HG22 VAL 141 -10.542 -6.604 14.643 1.00 0.00 H -ATOM 2197 HG23 VAL 141 -11.396 -6.710 16.124 1.00 0.00 H -ATOM 2198 C VAL 141 -7.940 -5.181 17.519 1.00 0.00 C -ATOM 2199 O VAL 141 -8.057 -4.404 18.453 1.00 0.00 O -ATOM 2200 N LYS 142 -6.743 -5.457 16.885 1.00 0.00 N -ATOM 2201 H LYS 142 -6.795 -6.081 16.092 1.00 0.00 H -ATOM 2202 CA LYS 142 -5.522 -4.633 17.201 1.00 0.00 C -ATOM 2203 HA LYS 142 -5.773 -3.861 17.928 1.00 0.00 H -ATOM 2204 CB LYS 142 -4.334 -5.486 17.739 1.00 0.00 C -ATOM 2205 HB2 LYS 142 -4.451 -6.448 17.241 1.00 0.00 H -ATOM 2206 HB3 LYS 142 -3.358 -5.090 17.460 1.00 0.00 H -ATOM 2207 CG LYS 142 -4.317 -5.621 19.259 1.00 0.00 C -ATOM 2208 HG2 LYS 142 -3.309 -5.965 19.490 1.00 0.00 H -ATOM 2209 HG3 LYS 142 -4.390 -4.681 19.806 1.00 0.00 H -ATOM 2210 CD LYS 142 -5.375 -6.542 19.915 1.00 0.00 C -ATOM 2211 HD2 LYS 142 -5.546 -6.359 20.975 1.00 0.00 H -ATOM 2212 HD3 LYS 142 -6.366 -6.393 19.485 1.00 0.00 H -ATOM 2213 CE LYS 142 -4.994 -8.031 19.754 1.00 0.00 C -ATOM 2214 HE2 LYS 142 -4.580 -8.280 18.777 1.00 0.00 H -ATOM 2215 HE3 LYS 142 -4.282 -8.241 20.551 1.00 0.00 H -ATOM 2216 NZ LYS 142 -6.201 -8.928 19.947 1.00 0.00 N -ATOM 2217 HZ1 LYS 142 -6.672 -8.623 20.786 1.00 0.00 H -ATOM 2218 HZ2 LYS 142 -6.793 -8.886 19.130 1.00 0.00 H -ATOM 2219 HZ3 LYS 142 -5.861 -9.866 20.108 1.00 0.00 H -ATOM 2220 C LYS 142 -5.050 -3.811 15.969 1.00 0.00 C -ATOM 2221 O LYS 142 -5.328 -4.241 14.826 1.00 0.00 O -ATOM 2222 N VAL 143 -4.353 -2.702 16.147 1.00 0.00 N -ATOM 2223 H VAL 143 -4.252 -2.333 17.081 1.00 0.00 H -ATOM 2224 CA VAL 143 -3.983 -1.792 15.054 1.00 0.00 C -ATOM 2225 HA VAL 143 -4.009 -2.399 14.149 1.00 0.00 H -ATOM 2226 CB VAL 143 -5.038 -0.731 14.841 1.00 0.00 C -ATOM 2227 HB VAL 143 -5.955 -1.301 14.695 1.00 0.00 H -ATOM 2228 CG1 VAL 143 -5.176 0.288 15.984 1.00 0.00 C -ATOM 2229 HG11 VAL 143 -5.894 1.051 15.684 1.00 0.00 H -ATOM 2230 HG12 VAL 143 -5.488 -0.189 16.914 1.00 0.00 H -ATOM 2231 HG13 VAL 143 -4.220 0.741 16.246 1.00 0.00 H -ATOM 2232 CG2 VAL 143 -4.978 0.070 13.596 1.00 0.00 C -ATOM 2233 HG21 VAL 143 -5.946 0.560 13.489 1.00 0.00 H -ATOM 2234 HG22 VAL 143 -4.184 0.815 13.642 1.00 0.00 H -ATOM 2235 HG23 VAL 143 -4.736 -0.654 12.818 1.00 0.00 H -ATOM 2236 C VAL 143 -2.586 -1.124 15.163 1.00 0.00 C -ATOM 2237 O VAL 143 -2.113 -0.739 16.301 1.00 0.00 O -ATOM 2238 N SER 144 -1.891 -0.989 14.025 1.00 0.00 N -ATOM 2239 H SER 144 -2.270 -1.413 13.190 1.00 0.00 H -ATOM 2240 CA SER 144 -0.502 -0.453 13.955 1.00 0.00 C -ATOM 2241 HA SER 144 -0.271 -0.064 14.947 1.00 0.00 H -ATOM 2242 CB SER 144 0.525 -1.573 13.628 1.00 0.00 C -ATOM 2243 HB2 SER 144 0.435 -2.453 14.265 1.00 0.00 H -ATOM 2244 HB3 SER 144 0.448 -1.845 12.575 1.00 0.00 H -ATOM 2245 OG SER 144 1.844 -1.190 13.642 1.00 0.00 O -ATOM 2246 HG SER 144 2.374 -1.877 14.054 1.00 0.00 H -ATOM 2247 C SER 144 -0.417 0.595 12.805 1.00 0.00 C -ATOM 2248 O SER 144 -1.185 0.526 11.867 1.00 0.00 O -ATOM 2249 N LEU 145 0.506 1.547 12.926 1.00 0.00 N -ATOM 2250 H LEU 145 1.048 1.493 13.777 1.00 0.00 H -ATOM 2251 CA LEU 145 0.594 2.669 12.035 1.00 0.00 C -ATOM 2252 HA LEU 145 0.373 2.286 11.038 1.00 0.00 H -ATOM 2253 CB LEU 145 -0.541 3.605 12.523 1.00 0.00 C -ATOM 2254 HB2 LEU 145 -1.519 3.142 12.389 1.00 0.00 H -ATOM 2255 HB3 LEU 145 -0.400 3.767 13.592 1.00 0.00 H -ATOM 2256 CG LEU 145 -0.602 4.990 11.778 1.00 0.00 C -ATOM 2257 HG LEU 145 0.332 5.527 11.945 1.00 0.00 H -ATOM 2258 CD1 LEU 145 -0.866 4.915 10.256 1.00 0.00 C -ATOM 2259 HD11 LEU 145 -0.040 4.556 9.642 1.00 0.00 H -ATOM 2260 HD12 LEU 145 -1.786 4.425 9.939 1.00 0.00 H -ATOM 2261 HD13 LEU 145 -0.966 5.979 10.037 1.00 0.00 H -ATOM 2262 CD2 LEU 145 -1.719 5.813 12.411 1.00 0.00 C -ATOM 2263 HD21 LEU 145 -2.655 5.253 12.436 1.00 0.00 H -ATOM 2264 HD22 LEU 145 -1.424 6.005 13.442 1.00 0.00 H -ATOM 2265 HD23 LEU 145 -2.025 6.747 11.940 1.00 0.00 H -ATOM 2266 C LEU 145 2.020 3.266 11.923 1.00 0.00 C -ATOM 2267 O LEU 145 2.497 3.584 13.005 1.00 0.00 O -ATOM 2268 N LEU 146 2.670 3.470 10.742 1.00 0.00 N -ATOM 2269 H LEU 146 2.149 3.251 9.905 1.00 0.00 H -ATOM 2270 CA LEU 146 4.128 3.615 10.554 1.00 0.00 C -ATOM 2271 HA LEU 146 4.563 4.112 11.421 1.00 0.00 H -ATOM 2272 CB LEU 146 4.626 2.169 10.402 1.00 0.00 C -ATOM 2273 HB2 LEU 146 4.414 1.599 11.306 1.00 0.00 H -ATOM 2274 HB3 LEU 146 3.985 1.760 9.621 1.00 0.00 H -ATOM 2275 CG LEU 146 6.107 1.838 10.075 1.00 0.00 C -ATOM 2276 HG LEU 146 6.393 2.136 9.066 1.00 0.00 H -ATOM 2277 CD1 LEU 146 7.063 2.371 11.095 1.00 0.00 C -ATOM 2278 HD11 LEU 146 8.114 2.184 10.879 1.00 0.00 H -ATOM 2279 HD12 LEU 146 7.005 3.460 11.082 1.00 0.00 H -ATOM 2280 HD13 LEU 146 6.954 2.021 12.122 1.00 0.00 H -ATOM 2281 CD2 LEU 146 6.313 0.342 10.247 1.00 0.00 C -ATOM 2282 HD21 LEU 146 7.375 0.097 10.283 1.00 0.00 H -ATOM 2283 HD22 LEU 146 5.822 0.053 11.175 1.00 0.00 H -ATOM 2284 HD23 LEU 146 5.860 -0.233 9.440 1.00 0.00 H -ATOM 2285 C LEU 146 4.511 4.500 9.255 1.00 0.00 C -ATOM 2286 O LEU 146 3.801 4.484 8.232 1.00 0.00 O -ATOM 2287 N GLU 147 5.565 5.304 9.399 1.00 0.00 N -ATOM 2288 H GLU 147 6.150 5.213 10.217 1.00 0.00 H -ATOM 2289 CA GLU 147 6.225 5.869 8.247 1.00 0.00 C -ATOM 2290 HA GLU 147 5.820 5.393 7.354 1.00 0.00 H -ATOM 2291 CB GLU 147 6.018 7.328 8.121 1.00 0.00 C -ATOM 2292 HB2 GLU 147 4.967 7.562 8.288 1.00 0.00 H -ATOM 2293 HB3 GLU 147 6.621 7.749 8.926 1.00 0.00 H -ATOM 2294 CG GLU 147 6.374 7.955 6.787 1.00 0.00 C -ATOM 2295 HG2 GLU 147 6.878 8.910 6.935 1.00 0.00 H -ATOM 2296 HG3 GLU 147 7.121 7.304 6.332 1.00 0.00 H -ATOM 2297 CD GLU 147 5.158 8.127 5.929 1.00 0.00 C -ATOM 2298 OE1 GLU 147 5.269 8.888 4.950 1.00 0.00 O -ATOM 2299 OE2 GLU 147 4.153 7.390 6.150 1.00 0.00 O -ATOM 2300 C GLU 147 7.697 5.383 8.180 1.00 0.00 C -ATOM 2301 O GLU 147 8.266 5.019 9.247 1.00 0.00 O -ATOM 2302 N ILE 148 8.277 5.212 7.016 1.00 0.00 N -ATOM 2303 H ILE 148 7.823 5.383 6.130 1.00 0.00 H -ATOM 2304 CA ILE 148 9.649 4.754 6.889 1.00 0.00 C -ATOM 2305 HA ILE 148 10.169 4.817 7.844 1.00 0.00 H -ATOM 2306 CB ILE 148 9.692 3.203 6.579 1.00 0.00 C -ATOM 2307 HB ILE 148 9.039 3.145 5.708 1.00 0.00 H -ATOM 2308 CG2 ILE 148 11.160 2.596 6.163 1.00 0.00 C -ATOM 2309 HG21 ILE 148 11.198 2.969 5.139 1.00 0.00 H -ATOM 2310 HG22 ILE 148 11.878 2.984 6.886 1.00 0.00 H -ATOM 2311 HG23 ILE 148 11.252 1.510 6.151 1.00 0.00 H -ATOM 2312 CG1 ILE 148 9.040 2.249 7.665 1.00 0.00 C -ATOM 2313 HG12 ILE 148 9.491 2.576 8.603 1.00 0.00 H -ATOM 2314 HG13 ILE 148 7.972 2.438 7.775 1.00 0.00 H -ATOM 2315 CD1 ILE 148 9.180 0.705 7.571 1.00 0.00 C -ATOM 2316 HD11 ILE 148 8.777 0.393 6.608 1.00 0.00 H -ATOM 2317 HD12 ILE 148 10.223 0.418 7.700 1.00 0.00 H -ATOM 2318 HD13 ILE 148 8.577 0.169 8.304 1.00 0.00 H -ATOM 2319 C ILE 148 10.417 5.537 5.886 1.00 0.00 C -ATOM 2320 O ILE 148 10.023 5.779 4.740 1.00 0.00 O -ATOM 2321 N TYR 149 11.656 6.062 6.309 1.00 0.00 N -ATOM 2322 H TYR 149 12.023 5.791 7.210 1.00 0.00 H -ATOM 2323 CA TYR 149 12.470 6.994 5.452 1.00 0.00 C -ATOM 2324 HA TYR 149 12.424 6.631 4.426 1.00 0.00 H -ATOM 2325 CB TYR 149 11.878 8.385 5.498 1.00 0.00 C -ATOM 2326 HB2 TYR 149 10.920 8.274 4.990 1.00 0.00 H -ATOM 2327 HB3 TYR 149 11.697 8.659 6.537 1.00 0.00 H -ATOM 2328 CG TYR 149 12.755 9.475 4.881 1.00 0.00 C -ATOM 2329 CD1 TYR 149 13.724 10.085 5.725 1.00 0.00 C -ATOM 2330 HD1 TYR 149 13.898 9.584 6.665 1.00 0.00 H -ATOM 2331 CE1 TYR 149 14.451 11.177 5.222 1.00 0.00 C -ATOM 2332 HE1 TYR 149 15.155 11.625 5.906 1.00 0.00 H -ATOM 2333 CZ TYR 149 14.263 11.625 3.861 1.00 0.00 C -ATOM 2334 OH TYR 149 14.973 12.663 3.437 1.00 0.00 O -ATOM 2335 HH TYR 149 15.738 12.754 4.010 1.00 0.00 H -ATOM 2336 CE2 TYR 149 13.396 10.906 3.040 1.00 0.00 C -ATOM 2337 HE2 TYR 149 13.338 11.213 2.006 1.00 0.00 H -ATOM 2338 CD2 TYR 149 12.610 9.824 3.544 1.00 0.00 C -ATOM 2339 HD2 TYR 149 11.906 9.353 2.874 1.00 0.00 H -ATOM 2340 C TYR 149 13.930 6.944 5.876 1.00 0.00 C -ATOM 2341 O TYR 149 14.226 6.978 7.074 1.00 0.00 O -ATOM 2342 N ASN 150 14.823 6.952 4.872 1.00 0.00 N -ATOM 2343 H ASN 150 14.541 6.799 3.915 1.00 0.00 H -ATOM 2344 CA ASN 150 16.230 6.895 5.122 1.00 0.00 C -ATOM 2345 HA ASN 150 16.643 6.737 4.126 1.00 0.00 H -ATOM 2346 CB ASN 150 16.746 8.268 5.497 1.00 0.00 C -ATOM 2347 HB2 ASN 150 16.308 9.007 4.826 1.00 0.00 H -ATOM 2348 HB3 ASN 150 16.460 8.476 6.528 1.00 0.00 H -ATOM 2349 CG ASN 150 18.224 8.530 5.410 1.00 0.00 C -ATOM 2350 OD1 ASN 150 18.748 8.419 4.325 1.00 0.00 O -ATOM 2351 ND2 ASN 150 18.876 8.993 6.457 1.00 0.00 N -ATOM 2352 HD21 ASN 150 19.865 9.182 6.387 1.00 0.00 H -ATOM 2353 HD22 ASN 150 18.423 9.041 7.359 1.00 0.00 H -ATOM 2354 C ASN 150 16.732 5.684 6.005 1.00 0.00 C -ATOM 2355 O ASN 150 17.587 5.838 6.881 1.00 0.00 O -ATOM 2356 N GLU 151 16.169 4.505 5.840 1.00 0.00 N -ATOM 2357 H GLU 151 15.482 4.325 5.121 1.00 0.00 H -ATOM 2358 CA GLU 151 16.463 3.290 6.658 1.00 0.00 C -ATOM 2359 HA GLU 151 15.712 2.574 6.324 1.00 0.00 H -ATOM 2360 CB GLU 151 17.780 2.598 6.271 1.00 0.00 C -ATOM 2361 HB2 GLU 151 18.536 3.363 6.446 1.00 0.00 H -ATOM 2362 HB3 GLU 151 17.856 1.812 7.022 1.00 0.00 H -ATOM 2363 CG GLU 151 17.935 1.934 4.860 1.00 0.00 C -ATOM 2364 HG2 GLU 151 17.790 2.743 4.145 1.00 0.00 H -ATOM 2365 HG3 GLU 151 18.973 1.600 4.830 1.00 0.00 H -ATOM 2366 CD GLU 151 16.883 0.845 4.559 1.00 0.00 C -ATOM 2367 OE1 GLU 151 16.174 1.032 3.576 1.00 0.00 O -ATOM 2368 OE2 GLU 151 16.725 -0.142 5.316 1.00 0.00 O -ATOM 2369 C GLU 151 16.294 3.567 8.206 1.00 0.00 C -ATOM 2370 O GLU 151 16.882 2.934 9.018 1.00 0.00 O -ATOM 2371 N GLU 152 15.327 4.396 8.529 1.00 0.00 N -ATOM 2372 H GLU 152 15.014 5.008 7.789 1.00 0.00 H -ATOM 2373 CA GLU 152 14.677 4.498 9.843 1.00 0.00 C -ATOM 2374 HA GLU 152 15.014 3.657 10.450 1.00 0.00 H -ATOM 2375 CB GLU 152 15.095 5.785 10.634 1.00 0.00 C -ATOM 2376 HB2 GLU 152 14.884 6.688 10.061 1.00 0.00 H -ATOM 2377 HB3 GLU 152 14.434 5.839 11.499 1.00 0.00 H -ATOM 2378 CG GLU 152 16.647 5.795 10.938 1.00 0.00 C -ATOM 2379 HG2 GLU 152 16.863 4.830 11.396 1.00 0.00 H -ATOM 2380 HG3 GLU 152 17.223 5.826 10.013 1.00 0.00 H -ATOM 2381 CD GLU 152 17.010 6.971 11.882 1.00 0.00 C -ATOM 2382 OE1 GLU 152 17.470 6.649 13.000 1.00 0.00 O -ATOM 2383 OE2 GLU 152 16.800 8.160 11.527 1.00 0.00 O -ATOM 2384 C GLU 152 13.175 4.377 9.815 1.00 0.00 C -ATOM 2385 O GLU 152 12.514 4.620 8.819 1.00 0.00 O -ATOM 2386 N LEU 153 12.566 4.014 10.925 1.00 0.00 N -ATOM 2387 H LEU 153 13.116 3.938 11.768 1.00 0.00 H -ATOM 2388 CA LEU 153 11.156 3.751 11.127 1.00 0.00 C -ATOM 2389 HA LEU 153 10.539 3.842 10.233 1.00 0.00 H -ATOM 2390 CB LEU 153 11.056 2.318 11.770 1.00 0.00 C -ATOM 2391 HB2 LEU 153 11.787 2.312 12.579 1.00 0.00 H -ATOM 2392 HB3 LEU 153 10.066 2.206 12.212 1.00 0.00 H -ATOM 2393 CG LEU 153 11.311 1.162 10.807 1.00 0.00 C -ATOM 2394 HG LEU 153 10.542 0.978 10.056 1.00 0.00 H -ATOM 2395 CD1 LEU 153 12.481 1.229 9.862 1.00 0.00 C -ATOM 2396 HD11 LEU 153 12.174 1.977 9.131 1.00 0.00 H -ATOM 2397 HD12 LEU 153 13.402 1.566 10.337 1.00 0.00 H -ATOM 2398 HD13 LEU 153 12.546 0.255 9.379 1.00 0.00 H -ATOM 2399 CD2 LEU 153 11.426 -0.031 11.717 1.00 0.00 C -ATOM 2400 HD21 LEU 153 12.299 0.041 12.366 1.00 0.00 H -ATOM 2401 HD22 LEU 153 10.506 0.000 12.302 1.00 0.00 H -ATOM 2402 HD23 LEU 153 11.518 -0.899 11.065 1.00 0.00 H -ATOM 2403 C LEU 153 10.603 4.766 12.150 1.00 0.00 C -ATOM 2404 O LEU 153 11.275 5.186 13.075 1.00 0.00 O -ATOM 2405 N PHE 154 9.350 5.234 11.877 1.00 0.00 N -ATOM 2406 H PHE 154 8.902 5.098 10.983 1.00 0.00 H -ATOM 2407 CA PHE 154 8.754 6.354 12.607 1.00 0.00 C -ATOM 2408 HA PHE 154 9.549 6.589 13.314 1.00 0.00 H -ATOM 2409 CB PHE 154 8.710 7.625 11.687 1.00 0.00 C -ATOM 2410 HB2 PHE 154 8.094 7.409 10.815 1.00 0.00 H -ATOM 2411 HB3 PHE 154 8.212 8.362 12.317 1.00 0.00 H -ATOM 2412 CG PHE 154 10.056 8.248 11.389 1.00 0.00 C -ATOM 2413 CD1 PHE 154 10.684 9.120 12.247 1.00 0.00 C -ATOM 2414 HD1 PHE 154 10.060 9.425 13.074 1.00 0.00 H -ATOM 2415 CE1 PHE 154 12.060 9.564 12.111 1.00 0.00 C -ATOM 2416 HE1 PHE 154 12.571 10.079 12.911 1.00 0.00 H -ATOM 2417 CZ PHE 154 12.797 9.152 10.966 1.00 0.00 C -ATOM 2418 HZ PHE 154 13.866 9.269 10.875 1.00 0.00 H -ATOM 2419 CE2 PHE 154 12.079 8.399 9.993 1.00 0.00 C -ATOM 2420 HE2 PHE 154 12.707 8.072 9.178 1.00 0.00 H -ATOM 2421 CD2 PHE 154 10.791 7.918 10.218 1.00 0.00 C -ATOM 2422 HD2 PHE 154 10.303 7.383 9.416 1.00 0.00 H -ATOM 2423 C PHE 154 7.508 6.023 13.297 1.00 0.00 C -ATOM 2424 O PHE 154 6.584 5.589 12.639 1.00 0.00 O -ATOM 2425 N ASP 155 7.421 6.378 14.635 1.00 0.00 N -ATOM 2426 H ASP 155 8.164 6.890 15.088 1.00 0.00 H -ATOM 2427 CA ASP 155 6.356 5.978 15.559 1.00 0.00 C -ATOM 2428 HA ASP 155 6.026 4.982 15.265 1.00 0.00 H -ATOM 2429 CB ASP 155 6.903 6.094 17.025 1.00 0.00 C -ATOM 2430 HB2 ASP 155 7.908 5.689 17.137 1.00 0.00 H -ATOM 2431 HB3 ASP 155 6.868 7.121 17.391 1.00 0.00 H -ATOM 2432 CG ASP 155 5.892 5.370 17.929 1.00 0.00 C -ATOM 2433 OD1 ASP 155 4.687 5.070 17.653 1.00 0.00 O -ATOM 2434 OD2 ASP 155 6.271 5.067 19.121 1.00 0.00 O -ATOM 2435 C ASP 155 5.047 6.765 15.389 1.00 0.00 C -ATOM 2436 O ASP 155 4.662 7.628 16.148 1.00 0.00 O -ATOM 2437 N LEU 156 4.486 6.578 14.140 1.00 0.00 N -ATOM 2438 H LEU 156 4.993 5.967 13.515 1.00 0.00 H -ATOM 2439 CA LEU 156 3.249 7.212 13.825 1.00 0.00 C -ATOM 2440 HA LEU 156 3.419 8.258 14.079 1.00 0.00 H -ATOM 2441 CB LEU 156 2.912 7.159 12.290 1.00 0.00 C -ATOM 2442 HB2 LEU 156 3.115 6.192 11.831 1.00 0.00 H -ATOM 2443 HB3 LEU 156 1.836 7.240 12.136 1.00 0.00 H -ATOM 2444 CG LEU 156 3.551 8.378 11.523 1.00 0.00 C -ATOM 2445 HG LEU 156 3.240 9.356 11.892 1.00 0.00 H -ATOM 2446 CD1 LEU 156 5.058 8.381 11.543 1.00 0.00 C -ATOM 2447 HD11 LEU 156 5.433 9.145 10.862 1.00 0.00 H -ATOM 2448 HD12 LEU 156 5.368 8.573 12.570 1.00 0.00 H -ATOM 2449 HD13 LEU 156 5.463 7.418 11.235 1.00 0.00 H -ATOM 2450 CD2 LEU 156 2.965 8.345 10.086 1.00 0.00 C -ATOM 2451 HD21 LEU 156 3.457 9.141 9.527 1.00 0.00 H -ATOM 2452 HD22 LEU 156 3.171 7.390 9.602 1.00 0.00 H -ATOM 2453 HD23 LEU 156 1.906 8.606 10.074 1.00 0.00 H -ATOM 2454 C LEU 156 2.121 6.744 14.741 1.00 0.00 C -ATOM 2455 O LEU 156 1.097 7.439 14.923 1.00 0.00 O -ATOM 2456 N LEU 157 2.207 5.526 15.296 1.00 0.00 N -ATOM 2457 H LEU 157 3.029 4.982 15.074 1.00 0.00 H -ATOM 2458 CA LEU 157 1.237 4.956 16.116 1.00 0.00 C -ATOM 2459 HA LEU 157 0.330 5.037 15.518 1.00 0.00 H -ATOM 2460 CB LEU 157 1.664 3.488 16.363 1.00 0.00 C -ATOM 2461 HB2 LEU 157 1.677 3.051 15.365 1.00 0.00 H -ATOM 2462 HB3 LEU 157 2.625 3.430 16.874 1.00 0.00 H -ATOM 2463 CG LEU 157 0.677 2.684 17.253 1.00 0.00 C -ATOM 2464 HG LEU 157 0.660 3.185 18.221 1.00 0.00 H -ATOM 2465 CD1 LEU 157 -0.715 2.772 16.702 1.00 0.00 C -ATOM 2466 HD11 LEU 157 -1.406 1.976 16.982 1.00 0.00 H -ATOM 2467 HD12 LEU 157 -1.299 3.611 17.080 1.00 0.00 H -ATOM 2468 HD13 LEU 157 -0.627 2.912 15.625 1.00 0.00 H -ATOM 2469 CD2 LEU 157 1.042 1.259 17.513 1.00 0.00 C -ATOM 2470 HD21 LEU 157 1.128 0.768 16.544 1.00 0.00 H -ATOM 2471 HD22 LEU 157 1.871 1.161 18.214 1.00 0.00 H -ATOM 2472 HD23 LEU 157 0.225 0.699 17.968 1.00 0.00 H -ATOM 2473 C LEU 157 0.942 5.657 17.431 1.00 0.00 C -ATOM 2474 O LEU 157 -0.264 5.828 17.719 1.00 0.00 O -ATOM 2475 N ASN 158 1.921 5.989 18.218 1.00 0.00 N -ATOM 2476 H ASN 158 2.890 5.802 18.004 1.00 0.00 H -ATOM 2477 CA ASN 158 1.715 6.424 19.556 1.00 0.00 C -ATOM 2478 HA ASN 158 0.894 5.810 19.927 1.00 0.00 H -ATOM 2479 CB ASN 158 2.915 5.839 20.392 1.00 0.00 C -ATOM 2480 HB2 ASN 158 3.874 6.054 19.920 1.00 0.00 H -ATOM 2481 HB3 ASN 158 2.988 6.232 21.406 1.00 0.00 H -ATOM 2482 CG ASN 158 2.838 4.330 20.550 1.00 0.00 C -ATOM 2483 OD1 ASN 158 2.112 3.800 21.359 1.00 0.00 O -ATOM 2484 ND2 ASN 158 3.717 3.617 19.807 1.00 0.00 N -ATOM 2485 HD21 ASN 158 3.772 2.617 19.671 1.00 0.00 H -ATOM 2486 HD22 ASN 158 4.177 4.213 19.135 1.00 0.00 H -ATOM 2487 C ASN 158 1.308 7.968 19.689 1.00 0.00 C -ATOM 2488 O ASN 158 1.668 8.734 18.850 1.00 0.00 O -ATOM 2489 N PRO 159 0.798 8.379 20.849 1.00 0.00 N -ATOM 2490 CD PRO 159 0.523 7.527 22.000 1.00 0.00 C -ATOM 2491 HD2 PRO 159 1.503 7.281 22.408 1.00 0.00 H -ATOM 2492 HD3 PRO 159 -0.059 6.640 21.748 1.00 0.00 H -ATOM 2493 CG PRO 159 -0.232 8.403 22.964 1.00 0.00 C -ATOM 2494 HG2 PRO 159 0.044 8.237 24.005 1.00 0.00 H -ATOM 2495 HG3 PRO 159 -1.277 8.103 22.887 1.00 0.00 H -ATOM 2496 CB PRO 159 0.044 9.904 22.578 1.00 0.00 C -ATOM 2497 HB2 PRO 159 0.812 10.294 23.247 1.00 0.00 H -ATOM 2498 HB3 PRO 159 -0.948 10.353 22.542 1.00 0.00 H -ATOM 2499 CA PRO 159 0.394 9.822 21.054 1.00 0.00 C -ATOM 2500 HA PRO 159 -0.444 9.955 20.370 1.00 0.00 H -ATOM 2501 C PRO 159 1.316 11.003 20.769 1.00 0.00 C -ATOM 2502 O PRO 159 0.773 12.011 20.278 1.00 0.00 O -ATOM 2503 N SER 160 2.658 10.960 20.977 1.00 0.00 N -ATOM 2504 H SER 160 3.081 10.090 21.267 1.00 0.00 H -ATOM 2505 CA SER 160 3.580 12.111 20.700 1.00 0.00 C -ATOM 2506 HA SER 160 3.253 12.924 21.350 1.00 0.00 H -ATOM 2507 CB SER 160 4.908 11.646 21.193 1.00 0.00 C -ATOM 2508 HB2 SER 160 4.824 11.408 22.253 1.00 0.00 H -ATOM 2509 HB3 SER 160 5.232 10.784 20.610 1.00 0.00 H -ATOM 2510 OG SER 160 5.757 12.725 21.041 1.00 0.00 O -ATOM 2511 HG SER 160 6.612 12.409 21.342 1.00 0.00 H -ATOM 2512 C SER 160 3.556 12.489 19.235 1.00 0.00 C -ATOM 2513 O SER 160 4.063 11.728 18.367 1.00 0.00 O -ATOM 2514 N SER 161 3.059 13.689 19.045 1.00 0.00 N -ATOM 2515 H SER 161 2.736 14.162 19.878 1.00 0.00 H -ATOM 2516 CA SER 161 2.801 14.376 17.760 1.00 0.00 C -ATOM 2517 HA SER 161 2.216 13.667 17.175 1.00 0.00 H -ATOM 2518 CB SER 161 1.928 15.558 18.010 1.00 0.00 C -ATOM 2519 HB2 SER 161 1.675 15.966 17.031 1.00 0.00 H -ATOM 2520 HB3 SER 161 0.979 15.309 18.485 1.00 0.00 H -ATOM 2521 OG SER 161 2.581 16.411 18.932 1.00 0.00 O -ATOM 2522 HG SER 161 2.303 16.243 19.836 1.00 0.00 H -ATOM 2523 C SER 161 4.095 14.881 16.955 1.00 0.00 C -ATOM 2524 O SER 161 3.893 15.171 15.767 1.00 0.00 O -ATOM 2525 N ASP 162 5.306 14.790 17.600 1.00 0.00 N -ATOM 2526 H ASP 162 5.277 14.326 18.497 1.00 0.00 H -ATOM 2527 CA ASP 162 6.528 15.179 16.895 1.00 0.00 C -ATOM 2528 HA ASP 162 6.322 16.047 16.269 1.00 0.00 H -ATOM 2529 CB ASP 162 7.601 15.564 17.872 1.00 0.00 C -ATOM 2530 HB2 ASP 162 7.308 16.483 18.379 1.00 0.00 H -ATOM 2531 HB3 ASP 162 7.765 14.730 18.554 1.00 0.00 H -ATOM 2532 CG ASP 162 8.973 15.861 17.231 1.00 0.00 C -ATOM 2533 OD1 ASP 162 9.855 16.331 17.957 1.00 0.00 O -ATOM 2534 OD2 ASP 162 9.173 15.893 15.975 1.00 0.00 O -ATOM 2535 C ASP 162 7.015 13.959 16.002 1.00 0.00 C -ATOM 2536 O ASP 162 7.100 12.739 16.398 1.00 0.00 O -ATOM 2537 N VAL 163 7.250 14.293 14.734 1.00 0.00 N -ATOM 2538 H VAL 163 7.075 15.256 14.483 1.00 0.00 H -ATOM 2539 CA VAL 163 7.664 13.343 13.705 1.00 0.00 C -ATOM 2540 HA VAL 163 7.002 12.483 13.800 1.00 0.00 H -ATOM 2541 CB VAL 163 7.216 13.960 12.299 1.00 0.00 C -ATOM 2542 HB VAL 163 6.182 14.270 12.447 1.00 0.00 H -ATOM 2543 CG1 VAL 163 8.014 15.239 11.793 1.00 0.00 C -ATOM 2544 HG11 VAL 163 7.420 15.815 11.084 1.00 0.00 H -ATOM 2545 HG12 VAL 163 8.366 15.787 12.667 1.00 0.00 H -ATOM 2546 HG13 VAL 163 8.934 14.860 11.348 1.00 0.00 H -ATOM 2547 CG2 VAL 163 7.185 12.852 11.241 1.00 0.00 C -ATOM 2548 HG21 VAL 163 8.256 12.651 11.199 1.00 0.00 H -ATOM 2549 HG22 VAL 163 6.701 11.910 11.497 1.00 0.00 H -ATOM 2550 HG23 VAL 163 6.725 13.251 10.338 1.00 0.00 H -ATOM 2551 C VAL 163 9.084 12.745 13.726 1.00 0.00 C -ATOM 2552 O VAL 163 9.351 11.742 13.065 1.00 0.00 O -ATOM 2553 N SER 164 9.869 13.269 14.631 1.00 0.00 N -ATOM 2554 H SER 164 9.586 14.145 15.048 1.00 0.00 H -ATOM 2555 CA SER 164 11.155 12.731 15.030 1.00 0.00 C -ATOM 2556 HA SER 164 11.628 12.357 14.122 1.00 0.00 H -ATOM 2557 CB SER 164 12.041 13.792 15.632 1.00 0.00 C -ATOM 2558 HB2 SER 164 12.977 13.249 15.763 1.00 0.00 H -ATOM 2559 HB3 SER 164 12.236 14.594 14.920 1.00 0.00 H -ATOM 2560 OG SER 164 11.475 14.312 16.820 1.00 0.00 O -ATOM 2561 HG SER 164 10.759 14.945 16.723 1.00 0.00 H -ATOM 2562 C SER 164 11.020 11.503 16.016 1.00 0.00 C -ATOM 2563 O SER 164 12.081 11.002 16.470 1.00 0.00 O -ATOM 2564 N GLU 165 9.788 11.064 16.425 1.00 0.00 N -ATOM 2565 H GLU 165 8.994 11.674 16.291 1.00 0.00 H -ATOM 2566 CA GLU 165 9.703 9.895 17.251 1.00 0.00 C -ATOM 2567 HA GLU 165 10.451 10.129 18.008 1.00 0.00 H -ATOM 2568 CB GLU 165 8.346 9.814 17.907 1.00 0.00 C -ATOM 2569 HB2 GLU 165 7.681 10.094 17.089 1.00 0.00 H -ATOM 2570 HB3 GLU 165 8.296 8.775 18.231 1.00 0.00 H -ATOM 2571 CG GLU 165 7.884 10.683 19.127 1.00 0.00 C -ATOM 2572 HG2 GLU 165 8.166 11.722 18.956 1.00 0.00 H -ATOM 2573 HG3 GLU 165 6.828 10.480 19.306 1.00 0.00 H -ATOM 2574 CD GLU 165 8.437 10.132 20.394 1.00 0.00 C -ATOM 2575 OE1 GLU 165 9.273 9.244 20.441 1.00 0.00 O -ATOM 2576 OE2 GLU 165 8.045 10.739 21.440 1.00 0.00 O -ATOM 2577 C GLU 165 10.077 8.700 16.500 1.00 0.00 C -ATOM 2578 O GLU 165 9.534 8.409 15.460 1.00 0.00 O -ATOM 2579 N ARG 166 11.074 7.967 17.028 1.00 0.00 N -ATOM 2580 H ARG 166 11.382 8.129 17.977 1.00 0.00 H -ATOM 2581 CA ARG 166 11.678 6.786 16.355 1.00 0.00 C -ATOM 2582 HA ARG 166 11.371 6.688 15.314 1.00 0.00 H -ATOM 2583 CB ARG 166 13.151 7.015 16.262 1.00 0.00 C -ATOM 2584 HB2 ARG 166 13.505 7.240 17.268 1.00 0.00 H -ATOM 2585 HB3 ARG 166 13.686 6.105 15.990 1.00 0.00 H -ATOM 2586 CG ARG 166 13.619 8.091 15.356 1.00 0.00 C -ATOM 2587 HG2 ARG 166 13.274 7.813 14.360 1.00 0.00 H -ATOM 2588 HG3 ARG 166 13.197 9.075 15.559 1.00 0.00 H -ATOM 2589 CD ARG 166 15.142 8.237 15.348 1.00 0.00 C -ATOM 2590 HD2 ARG 166 15.492 8.603 16.313 1.00 0.00 H -ATOM 2591 HD3 ARG 166 15.431 7.199 15.179 1.00 0.00 H -ATOM 2592 NE ARG 166 15.669 8.952 14.199 1.00 0.00 N -ATOM 2593 HE ARG 166 16.012 8.429 13.406 1.00 0.00 H -ATOM 2594 CZ ARG 166 15.729 10.252 14.070 1.00 0.00 C -ATOM 2595 NH1 ARG 166 15.240 11.114 14.875 1.00 0.00 N -ATOM 2596 HH11 ARG 166 14.626 10.836 15.628 1.00 0.00 H -ATOM 2597 HH12 ARG 166 15.559 12.057 14.703 1.00 0.00 H -ATOM 2598 NH2 ARG 166 16.443 10.657 13.016 1.00 0.00 N -ATOM 2599 HH21 ARG 166 16.857 9.935 12.444 1.00 0.00 H -ATOM 2600 HH22 ARG 166 16.412 11.612 12.687 1.00 0.00 H -ATOM 2601 C ARG 166 11.338 5.495 17.098 1.00 0.00 C -ATOM 2602 O ARG 166 11.082 5.445 18.278 1.00 0.00 O -ATOM 2603 N LEU 167 11.526 4.432 16.288 1.00 0.00 N -ATOM 2604 H LEU 167 11.872 4.655 15.366 1.00 0.00 H -ATOM 2605 CA LEU 167 11.368 3.052 16.671 1.00 0.00 C -ATOM 2606 HA LEU 167 10.977 2.875 17.673 1.00 0.00 H -ATOM 2607 CB LEU 167 10.306 2.500 15.725 1.00 0.00 C -ATOM 2608 HB2 LEU 167 10.687 2.773 14.741 1.00 0.00 H -ATOM 2609 HB3 LEU 167 10.215 1.437 15.950 1.00 0.00 H -ATOM 2610 CG LEU 167 8.923 3.173 15.854 1.00 0.00 C -ATOM 2611 HG LEU 167 9.134 4.242 15.829 1.00 0.00 H -ATOM 2612 CD1 LEU 167 8.017 2.775 14.670 1.00 0.00 C -ATOM 2613 HD11 LEU 167 7.987 1.688 14.605 1.00 0.00 H -ATOM 2614 HD12 LEU 167 7.022 3.195 14.820 1.00 0.00 H -ATOM 2615 HD13 LEU 167 8.406 3.284 13.788 1.00 0.00 H -ATOM 2616 CD2 LEU 167 8.216 2.663 17.019 1.00 0.00 C -ATOM 2617 HD21 LEU 167 8.730 2.911 17.948 1.00 0.00 H -ATOM 2618 HD22 LEU 167 7.215 3.092 17.042 1.00 0.00 H -ATOM 2619 HD23 LEU 167 8.338 1.579 17.014 1.00 0.00 H -ATOM 2620 C LEU 167 12.653 2.224 16.338 1.00 0.00 C -ATOM 2621 O LEU 167 13.351 2.474 15.346 1.00 0.00 O -ATOM 2622 N GLN 168 13.006 1.348 17.252 1.00 0.00 N -ATOM 2623 H GLN 168 12.471 1.219 18.099 1.00 0.00 H -ATOM 2624 CA GLN 168 14.157 0.472 17.029 1.00 0.00 C -ATOM 2625 HA GLN 168 14.647 0.784 16.106 1.00 0.00 H -ATOM 2626 CB GLN 168 15.118 0.495 18.209 1.00 0.00 C -ATOM 2627 HB2 GLN 168 14.559 0.274 19.118 1.00 0.00 H -ATOM 2628 HB3 GLN 168 15.885 -0.277 18.141 1.00 0.00 H -ATOM 2629 CG GLN 168 15.739 1.944 18.422 1.00 0.00 C -ATOM 2630 HG2 GLN 168 16.662 2.065 18.988 1.00 0.00 H -ATOM 2631 HG3 GLN 168 15.910 2.365 17.432 1.00 0.00 H -ATOM 2632 CD GLN 168 14.761 2.832 19.199 1.00 0.00 C -ATOM 2633 OE1 GLN 168 14.006 2.425 20.120 1.00 0.00 O -ATOM 2634 NE2 GLN 168 14.758 4.139 18.998 1.00 0.00 N -ATOM 2635 HE21 GLN 168 14.248 4.577 19.751 1.00 0.00 H -ATOM 2636 HE22 GLN 168 15.098 4.679 18.215 1.00 0.00 H -ATOM 2637 C GLN 168 13.624 -0.952 16.884 1.00 0.00 C -ATOM 2638 O GLN 168 12.558 -1.283 17.327 1.00 0.00 O -ATOM 2639 N MET 169 14.418 -1.844 16.315 1.00 0.00 N -ATOM 2640 H MET 169 15.266 -1.435 15.950 1.00 0.00 H -ATOM 2641 CA MET 169 14.010 -3.165 15.932 1.00 0.00 C -ATOM 2642 HA MET 169 13.280 -3.538 16.650 1.00 0.00 H -ATOM 2643 CB MET 169 13.365 -3.145 14.548 1.00 0.00 C -ATOM 2644 HB2 MET 169 13.329 -4.175 14.193 1.00 0.00 H -ATOM 2645 HB3 MET 169 12.361 -2.732 14.646 1.00 0.00 H -ATOM 2646 CG MET 169 14.137 -2.433 13.450 1.00 0.00 C -ATOM 2647 HG2 MET 169 14.012 -1.367 13.636 1.00 0.00 H -ATOM 2648 HG3 MET 169 15.213 -2.607 13.416 1.00 0.00 H -ATOM 2649 SD MET 169 13.473 -2.790 11.730 1.00 0.00 S -ATOM 2650 CE MET 169 14.276 -4.386 11.306 1.00 0.00 C -ATOM 2651 HE1 MET 169 13.918 -4.697 10.324 1.00 0.00 H -ATOM 2652 HE2 MET 169 15.364 -4.320 11.309 1.00 0.00 H -ATOM 2653 HE3 MET 169 13.984 -5.013 12.148 1.00 0.00 H -ATOM 2654 C MET 169 15.177 -4.187 16.019 1.00 0.00 C -ATOM 2655 O MET 169 16.304 -3.976 15.726 1.00 0.00 O -ATOM 2656 N PHE 170 14.789 -5.484 16.244 1.00 0.00 N -ATOM 2657 H PHE 170 13.795 -5.665 16.220 1.00 0.00 H -ATOM 2658 CA PHE 170 15.667 -6.604 16.488 1.00 0.00 C -ATOM 2659 HA PHE 170 16.578 -6.335 15.954 1.00 0.00 H -ATOM 2660 CB PHE 170 16.013 -6.767 18.001 1.00 0.00 C -ATOM 2661 HB2 PHE 170 16.757 -7.562 18.041 1.00 0.00 H -ATOM 2662 HB3 PHE 170 16.482 -5.820 18.270 1.00 0.00 H -ATOM 2663 CG PHE 170 14.915 -7.173 18.875 1.00 0.00 C -ATOM 2664 CD1 PHE 170 14.250 -6.146 19.563 1.00 0.00 C -ATOM 2665 HD1 PHE 170 14.416 -5.103 19.338 1.00 0.00 H -ATOM 2666 CE1 PHE 170 13.308 -6.456 20.498 1.00 0.00 C -ATOM 2667 HE1 PHE 170 12.800 -5.718 21.101 1.00 0.00 H -ATOM 2668 CZ PHE 170 12.932 -7.767 20.719 1.00 0.00 C -ATOM 2669 HZ PHE 170 12.120 -7.983 21.397 1.00 0.00 H -ATOM 2670 CE2 PHE 170 13.597 -8.833 20.059 1.00 0.00 C -ATOM 2671 HE2 PHE 170 13.256 -9.854 20.147 1.00 0.00 H -ATOM 2672 CD2 PHE 170 14.503 -8.551 19.032 1.00 0.00 C -ATOM 2673 HD2 PHE 170 14.930 -9.299 18.380 1.00 0.00 H -ATOM 2674 C PHE 170 15.194 -7.960 15.931 1.00 0.00 C -ATOM 2675 O PHE 170 13.983 -8.174 15.844 1.00 0.00 O -ATOM 2676 N ASP 171 16.111 -8.791 15.538 1.00 0.00 N -ATOM 2677 H ASP 171 17.081 -8.570 15.713 1.00 0.00 H -ATOM 2678 CA ASP 171 15.819 -10.090 14.899 1.00 0.00 C -ATOM 2679 HA ASP 171 15.287 -9.903 13.966 1.00 0.00 H -ATOM 2680 CB ASP 171 17.115 -10.678 14.442 1.00 0.00 C -ATOM 2681 HB2 ASP 171 17.665 -10.918 15.351 1.00 0.00 H -ATOM 2682 HB3 ASP 171 16.886 -11.651 14.007 1.00 0.00 H -ATOM 2683 CG ASP 171 17.949 -9.852 13.468 1.00 0.00 C -ATOM 2684 OD1 ASP 171 17.369 -9.391 12.382 1.00 0.00 O -ATOM 2685 OD2 ASP 171 19.104 -9.621 13.804 1.00 0.00 O -ATOM 2686 C ASP 171 15.069 -10.944 15.922 1.00 0.00 C -ATOM 2687 O ASP 171 15.488 -11.127 17.055 1.00 0.00 O -ATOM 2688 N ASP 172 13.959 -11.567 15.457 1.00 0.00 N -ATOM 2689 H ASP 172 13.735 -11.337 14.500 1.00 0.00 H -ATOM 2690 CA ASP 172 13.100 -12.412 16.302 1.00 0.00 C -ATOM 2691 HA ASP 172 12.641 -11.849 17.114 1.00 0.00 H -ATOM 2692 CB ASP 172 11.927 -12.823 15.411 1.00 0.00 C -ATOM 2693 HB2 ASP 172 11.402 -11.939 15.049 1.00 0.00 H -ATOM 2694 HB3 ASP 172 12.216 -13.265 14.457 1.00 0.00 H -ATOM 2695 CG ASP 172 10.772 -13.591 16.016 1.00 0.00 C -ATOM 2696 OD1 ASP 172 9.711 -13.738 15.319 1.00 0.00 O -ATOM 2697 OD2 ASP 172 10.927 -13.982 17.202 1.00 0.00 O -ATOM 2698 C ASP 172 13.887 -13.622 16.713 1.00 0.00 C -ATOM 2699 O ASP 172 14.284 -14.352 15.828 1.00 0.00 O -ATOM 2700 N PRO 173 14.064 -13.914 18.034 1.00 0.00 N -ATOM 2701 CD PRO 173 13.619 -13.168 19.178 1.00 0.00 C -ATOM 2702 HD2 PRO 173 12.539 -13.187 19.326 1.00 0.00 H -ATOM 2703 HD3 PRO 173 13.927 -12.124 19.114 1.00 0.00 H -ATOM 2704 CG PRO 173 14.386 -13.602 20.389 1.00 0.00 C -ATOM 2705 HG2 PRO 173 13.782 -13.584 21.296 1.00 0.00 H -ATOM 2706 HG3 PRO 173 15.286 -12.992 20.469 1.00 0.00 H -ATOM 2707 CB PRO 173 14.863 -15.032 20.013 1.00 0.00 C -ATOM 2708 HB2 PRO 173 14.242 -15.782 20.502 1.00 0.00 H -ATOM 2709 HB3 PRO 173 15.908 -15.131 20.309 1.00 0.00 H -ATOM 2710 CA PRO 173 14.743 -15.168 18.476 1.00 0.00 C -ATOM 2711 HA PRO 173 15.737 -15.164 18.029 1.00 0.00 H -ATOM 2712 C PRO 173 14.162 -16.562 18.044 1.00 0.00 C -ATOM 2713 O PRO 173 14.941 -17.554 18.166 1.00 0.00 O -ATOM 2714 N ARG 174 12.892 -16.546 17.563 1.00 0.00 N -ATOM 2715 H ARG 174 12.400 -15.667 17.497 1.00 0.00 H -ATOM 2716 CA ARG 174 12.229 -17.798 17.096 1.00 0.00 C -ATOM 2717 HA ARG 174 12.298 -18.536 17.895 1.00 0.00 H -ATOM 2718 CB ARG 174 10.741 -17.447 16.888 1.00 0.00 C -ATOM 2719 HB2 ARG 174 10.736 -16.593 16.211 1.00 0.00 H -ATOM 2720 HB3 ARG 174 10.258 -18.347 16.507 1.00 0.00 H -ATOM 2721 CG ARG 174 9.982 -17.114 18.238 1.00 0.00 C -ATOM 2722 HG2 ARG 174 10.109 -18.030 18.815 1.00 0.00 H -ATOM 2723 HG3 ARG 174 10.355 -16.179 18.656 1.00 0.00 H -ATOM 2724 CD ARG 174 8.520 -16.886 17.904 1.00 0.00 C -ATOM 2725 HD2 ARG 174 8.143 -17.694 17.275 1.00 0.00 H -ATOM 2726 HD3 ARG 174 7.926 -16.886 18.818 1.00 0.00 H -ATOM 2727 NE ARG 174 8.284 -15.679 17.183 1.00 0.00 N -ATOM 2728 HE ARG 174 9.130 -15.221 16.874 1.00 0.00 H -ATOM 2729 CZ ARG 174 7.246 -14.880 17.319 1.00 0.00 C -ATOM 2730 NH1 ARG 174 6.092 -15.153 17.948 1.00 0.00 N -ATOM 2731 HH11 ARG 174 5.864 -16.001 18.446 1.00 0.00 H -ATOM 2732 HH12 ARG 174 5.427 -14.397 18.023 1.00 0.00 H -ATOM 2733 NH2 ARG 174 7.376 -13.703 16.784 1.00 0.00 N -ATOM 2734 HH21 ARG 174 8.021 -13.709 16.007 1.00 0.00 H -ATOM 2735 HH22 ARG 174 6.631 -13.024 16.716 1.00 0.00 H -ATOM 2736 C ARG 174 12.944 -18.390 15.881 1.00 0.00 C -ATOM 2737 O ARG 174 13.039 -19.642 15.721 1.00 0.00 O -ATOM 2738 N ASN 175 13.530 -17.569 14.979 1.00 0.00 N -ATOM 2739 H ASN 175 13.421 -16.567 15.052 1.00 0.00 H -ATOM 2740 CA ASN 175 14.136 -18.015 13.695 1.00 0.00 C -ATOM 2741 HA ASN 175 14.696 -18.912 13.957 1.00 0.00 H -ATOM 2742 CB ASN 175 13.027 -18.371 12.714 1.00 0.00 C -ATOM 2743 HB2 ASN 175 13.416 -18.598 11.722 1.00 0.00 H -ATOM 2744 HB3 ASN 175 12.443 -19.228 13.051 1.00 0.00 H -ATOM 2745 CG ASN 175 12.037 -17.225 12.631 1.00 0.00 C -ATOM 2746 OD1 ASN 175 12.439 -16.102 12.367 1.00 0.00 O -ATOM 2747 ND2 ASN 175 10.732 -17.475 12.747 1.00 0.00 N -ATOM 2748 HD21 ASN 175 10.105 -16.731 12.476 1.00 0.00 H -ATOM 2749 HD22 ASN 175 10.370 -18.418 12.773 1.00 0.00 H -ATOM 2750 C ASN 175 15.124 -17.085 13.054 1.00 0.00 C -ATOM 2751 O ASN 175 15.720 -17.471 12.111 1.00 0.00 O -ATOM 2752 N LYS 176 15.359 -15.862 13.572 1.00 0.00 N -ATOM 2753 H LYS 176 14.706 -15.631 14.307 1.00 0.00 H -ATOM 2754 CA LYS 176 16.336 -14.805 13.185 1.00 0.00 C -ATOM 2755 HA LYS 176 16.150 -13.906 13.772 1.00 0.00 H -ATOM 2756 CB LYS 176 17.843 -15.204 13.365 1.00 0.00 C -ATOM 2757 HB2 LYS 176 18.087 -16.190 12.968 1.00 0.00 H -ATOM 2758 HB3 LYS 176 18.339 -14.444 12.762 1.00 0.00 H -ATOM 2759 CG LYS 176 18.363 -15.301 14.836 1.00 0.00 C -ATOM 2760 HG2 LYS 176 18.469 -14.321 15.300 1.00 0.00 H -ATOM 2761 HG3 LYS 176 17.600 -15.725 15.489 1.00 0.00 H -ATOM 2762 CD LYS 176 19.570 -16.266 14.915 1.00 0.00 C -ATOM 2763 HD2 LYS 176 19.406 -17.270 14.524 1.00 0.00 H -ATOM 2764 HD3 LYS 176 20.442 -15.887 14.384 1.00 0.00 H -ATOM 2765 CE LYS 176 20.032 -16.473 16.380 1.00 0.00 C -ATOM 2766 HE2 LYS 176 20.028 -15.495 16.863 1.00 0.00 H -ATOM 2767 HE3 LYS 176 19.278 -17.043 16.924 1.00 0.00 H -ATOM 2768 NZ LYS 176 21.362 -17.159 16.448 1.00 0.00 N -ATOM 2769 HZ1 LYS 176 21.671 -17.099 17.408 1.00 0.00 H -ATOM 2770 HZ2 LYS 176 21.342 -18.087 16.049 1.00 0.00 H -ATOM 2771 HZ3 LYS 176 22.136 -16.689 16.001 1.00 0.00 H -ATOM 2772 C LYS 176 16.002 -14.222 11.754 1.00 0.00 C -ATOM 2773 O LYS 176 16.352 -13.102 11.470 1.00 0.00 O -ATOM 2774 N ARG 177 15.300 -14.949 10.867 1.00 0.00 N -ATOM 2775 H ARG 177 14.986 -15.828 11.253 1.00 0.00 H -ATOM 2776 CA ARG 177 14.710 -14.432 9.656 1.00 0.00 C -ATOM 2777 HA ARG 177 15.527 -14.008 9.073 1.00 0.00 H -ATOM 2778 CB ARG 177 14.045 -15.601 8.805 1.00 0.00 C -ATOM 2779 HB2 ARG 177 14.775 -16.126 8.189 1.00 0.00 H -ATOM 2780 HB3 ARG 177 13.475 -16.234 9.484 1.00 0.00 H -ATOM 2781 CG ARG 177 13.085 -15.024 7.736 1.00 0.00 C -ATOM 2782 HG2 ARG 177 12.306 -14.460 8.248 1.00 0.00 H -ATOM 2783 HG3 ARG 177 13.694 -14.371 7.111 1.00 0.00 H -ATOM 2784 CD ARG 177 12.449 -16.231 6.995 1.00 0.00 C -ATOM 2785 HD2 ARG 177 13.185 -16.922 6.584 1.00 0.00 H -ATOM 2786 HD3 ARG 177 11.901 -16.868 7.690 1.00 0.00 H -ATOM 2787 NE ARG 177 11.603 -15.786 5.904 1.00 0.00 N -ATOM 2788 HE ARG 177 12.008 -15.702 4.982 1.00 0.00 H -ATOM 2789 CZ ARG 177 10.362 -15.304 5.924 1.00 0.00 C -ATOM 2790 NH1 ARG 177 9.654 -15.380 6.994 1.00 0.00 N -ATOM 2791 HH11 ARG 177 9.996 -15.842 7.825 1.00 0.00 H -ATOM 2792 HH12 ARG 177 8.692 -15.088 7.095 1.00 0.00 H -ATOM 2793 NH2 ARG 177 9.793 -14.750 4.895 1.00 0.00 N -ATOM 2794 HH21 ARG 177 10.271 -14.818 4.007 1.00 0.00 H -ATOM 2795 HH22 ARG 177 8.886 -14.319 4.998 1.00 0.00 H -ATOM 2796 C ARG 177 13.720 -13.273 10.041 1.00 0.00 C -ATOM 2797 O ARG 177 13.845 -12.244 9.376 1.00 0.00 O -ATOM 2798 N GLY 178 12.859 -13.387 11.093 1.00 0.00 N -ATOM 2799 H GLY 178 12.752 -14.228 11.642 1.00 0.00 H -ATOM 2800 CA GLY 178 11.921 -12.276 11.377 1.00 0.00 C -ATOM 2801 HA2 GLY 178 11.447 -11.903 10.469 1.00 0.00 H -ATOM 2802 HA3 GLY 178 11.138 -12.651 12.037 1.00 0.00 H -ATOM 2803 C GLY 178 12.516 -11.014 12.132 1.00 0.00 C -ATOM 2804 O GLY 178 13.489 -11.051 12.784 1.00 0.00 O -ATOM 2805 N VAL 179 11.675 -9.963 12.196 1.00 0.00 N -ATOM 2806 H VAL 179 10.949 -9.983 11.494 1.00 0.00 H -ATOM 2807 CA VAL 179 11.951 -8.728 13.026 1.00 0.00 C -ATOM 2808 HA VAL 179 12.600 -9.230 13.743 1.00 0.00 H -ATOM 2809 CB VAL 179 12.683 -7.547 12.322 1.00 0.00 C -ATOM 2810 HB VAL 179 12.838 -6.803 13.104 1.00 0.00 H -ATOM 2811 CG1 VAL 179 14.148 -7.807 11.897 1.00 0.00 C -ATOM 2812 HG11 VAL 179 14.567 -6.983 11.321 1.00 0.00 H -ATOM 2813 HG12 VAL 179 14.774 -7.940 12.779 1.00 0.00 H -ATOM 2814 HG13 VAL 179 14.044 -8.722 11.314 1.00 0.00 H -ATOM 2815 CG2 VAL 179 11.875 -6.789 11.243 1.00 0.00 C -ATOM 2816 HG21 VAL 179 12.264 -5.808 10.972 1.00 0.00 H -ATOM 2817 HG22 VAL 179 12.057 -7.336 10.318 1.00 0.00 H -ATOM 2818 HG23 VAL 179 10.802 -6.735 11.429 1.00 0.00 H -ATOM 2819 C VAL 179 10.841 -8.311 13.979 1.00 0.00 C -ATOM 2820 O VAL 179 9.736 -8.191 13.473 1.00 0.00 O -ATOM 2821 N ILE 180 11.162 -7.914 15.190 1.00 0.00 N -ATOM 2822 H ILE 180 12.116 -8.035 15.498 1.00 0.00 H -ATOM 2823 CA ILE 180 10.255 -7.281 16.190 1.00 0.00 C -ATOM 2824 HA ILE 180 9.247 -7.457 15.815 1.00 0.00 H -ATOM 2825 CB ILE 180 10.418 -8.042 17.560 1.00 0.00 C -ATOM 2826 HB ILE 180 11.446 -7.954 17.912 1.00 0.00 H -ATOM 2827 CG2 ILE 180 9.464 -7.582 18.649 1.00 0.00 C -ATOM 2828 HG21 ILE 180 8.436 -7.793 18.356 1.00 0.00 H -ATOM 2829 HG22 ILE 180 9.698 -8.255 19.474 1.00 0.00 H -ATOM 2830 HG23 ILE 180 9.687 -6.605 19.078 1.00 0.00 H -ATOM 2831 CG1 ILE 180 10.101 -9.519 17.251 1.00 0.00 C -ATOM 2832 HG12 ILE 180 9.135 -9.551 16.747 1.00 0.00 H -ATOM 2833 HG13 ILE 180 10.732 -9.941 16.469 1.00 0.00 H -ATOM 2834 CD1 ILE 180 10.120 -10.590 18.362 1.00 0.00 C -ATOM 2835 HD11 ILE 180 9.995 -11.622 18.035 1.00 0.00 H -ATOM 2836 HD12 ILE 180 11.112 -10.633 18.812 1.00 0.00 H -ATOM 2837 HD13 ILE 180 9.430 -10.298 19.154 1.00 0.00 H -ATOM 2838 C ILE 180 10.537 -5.772 16.225 1.00 0.00 C -ATOM 2839 O ILE 180 11.604 -5.372 16.610 1.00 0.00 O -ATOM 2840 N ILE 181 9.581 -4.890 15.935 1.00 0.00 N -ATOM 2841 H ILE 181 8.680 -5.284 15.705 1.00 0.00 H -ATOM 2842 CA ILE 181 9.788 -3.467 16.098 1.00 0.00 C -ATOM 2843 HA ILE 181 10.843 -3.217 15.982 1.00 0.00 H -ATOM 2844 CB ILE 181 9.081 -2.662 14.971 1.00 0.00 C -ATOM 2845 HB ILE 181 8.009 -2.844 15.045 1.00 0.00 H -ATOM 2846 CG2 ILE 181 9.317 -1.215 15.168 1.00 0.00 C -ATOM 2847 HG21 ILE 181 8.751 -1.040 16.083 1.00 0.00 H -ATOM 2848 HG22 ILE 181 10.378 -0.993 15.287 1.00 0.00 H -ATOM 2849 HG23 ILE 181 8.881 -0.672 14.330 1.00 0.00 H -ATOM 2850 CG1 ILE 181 9.459 -3.109 13.526 1.00 0.00 C -ATOM 2851 HG12 ILE 181 10.517 -2.991 13.289 1.00 0.00 H -ATOM 2852 HG13 ILE 181 9.283 -4.180 13.427 1.00 0.00 H -ATOM 2853 CD1 ILE 181 8.547 -2.519 12.502 1.00 0.00 C -ATOM 2854 HD11 ILE 181 7.528 -2.879 12.644 1.00 0.00 H -ATOM 2855 HD12 ILE 181 8.727 -1.450 12.389 1.00 0.00 H -ATOM 2856 HD13 ILE 181 8.832 -2.943 11.538 1.00 0.00 H -ATOM 2857 C ILE 181 9.386 -3.104 17.517 1.00 0.00 C -ATOM 2858 O ILE 181 8.219 -3.408 17.947 1.00 0.00 O -ATOM 2859 N LYS 182 10.308 -2.694 18.367 1.00 0.00 N -ATOM 2860 H LYS 182 11.181 -2.454 17.920 1.00 0.00 H -ATOM 2861 CA LYS 182 10.142 -2.061 19.725 1.00 0.00 C -ATOM 2862 HA LYS 182 9.576 -2.728 20.376 1.00 0.00 H -ATOM 2863 CB LYS 182 11.607 -1.820 20.300 1.00 0.00 C -ATOM 2864 HB2 LYS 182 12.240 -1.234 19.634 1.00 0.00 H -ATOM 2865 HB3 LYS 182 11.537 -1.124 21.136 1.00 0.00 H -ATOM 2866 CG LYS 182 12.274 -3.139 20.709 1.00 0.00 C -ATOM 2867 HG2 LYS 182 11.551 -3.733 21.268 1.00 0.00 H -ATOM 2868 HG3 LYS 182 12.526 -3.567 19.738 1.00 0.00 H -ATOM 2869 CD LYS 182 13.573 -2.855 21.439 1.00 0.00 C -ATOM 2870 HD2 LYS 182 14.248 -3.704 21.548 1.00 0.00 H -ATOM 2871 HD3 LYS 182 14.154 -2.140 20.856 1.00 0.00 H -ATOM 2872 CE LYS 182 13.424 -2.266 22.850 1.00 0.00 C -ATOM 2873 HE2 LYS 182 13.090 -1.239 22.699 1.00 0.00 H -ATOM 2874 HE3 LYS 182 12.772 -2.836 23.513 1.00 0.00 H -ATOM 2875 NZ LYS 182 14.726 -2.237 23.502 1.00 0.00 N -ATOM 2876 HZ1 LYS 182 14.743 -1.983 24.479 1.00 0.00 H -ATOM 2877 HZ2 LYS 182 15.149 -3.153 23.459 1.00 0.00 H -ATOM 2878 HZ3 LYS 182 15.320 -1.541 23.075 1.00 0.00 H -ATOM 2879 C LYS 182 9.408 -0.770 19.621 1.00 0.00 C -ATOM 2880 O LYS 182 9.278 -0.262 18.530 1.00 0.00 O -ATOM 2881 N GLY 183 8.760 -0.278 20.666 1.00 0.00 N -ATOM 2882 H GLY 183 8.891 -0.823 21.506 1.00 0.00 H -ATOM 2883 CA GLY 183 7.846 0.870 20.695 1.00 0.00 C -ATOM 2884 HA2 GLY 183 7.623 1.171 21.719 1.00 0.00 H -ATOM 2885 HA3 GLY 183 8.357 1.723 20.250 1.00 0.00 H -ATOM 2886 C GLY 183 6.498 0.760 19.987 1.00 0.00 C -ATOM 2887 O GLY 183 5.486 1.184 20.543 1.00 0.00 O -ATOM 2888 N LEU 184 6.452 0.092 18.785 1.00 0.00 N -ATOM 2889 H LEU 184 7.330 -0.365 18.586 1.00 0.00 H -ATOM 2890 CA LEU 184 5.306 -0.024 17.876 1.00 0.00 C -ATOM 2891 HA LEU 184 4.864 0.963 18.006 1.00 0.00 H -ATOM 2892 CB LEU 184 5.761 -0.331 16.393 1.00 0.00 C -ATOM 2893 HB2 LEU 184 6.560 0.402 16.274 1.00 0.00 H -ATOM 2894 HB3 LEU 184 6.270 -1.294 16.353 1.00 0.00 H -ATOM 2895 CG LEU 184 4.742 -0.258 15.153 1.00 0.00 C -ATOM 2896 HG LEU 184 3.960 -0.998 15.318 1.00 0.00 H -ATOM 2897 CD1 LEU 184 4.135 1.104 15.034 1.00 0.00 C -ATOM 2898 HD11 LEU 184 3.767 1.386 16.021 1.00 0.00 H -ATOM 2899 HD12 LEU 184 4.952 1.820 14.937 1.00 0.00 H -ATOM 2900 HD13 LEU 184 3.409 1.105 14.222 1.00 0.00 H -ATOM 2901 CD2 LEU 184 5.444 -0.590 13.802 1.00 0.00 C -ATOM 2902 HD21 LEU 184 6.056 -1.464 14.025 1.00 0.00 H -ATOM 2903 HD22 LEU 184 4.767 -0.810 12.977 1.00 0.00 H -ATOM 2904 HD23 LEU 184 6.173 0.154 13.481 1.00 0.00 H -ATOM 2905 C LEU 184 4.269 -1.071 18.321 1.00 0.00 C -ATOM 2906 O LEU 184 3.554 -1.620 17.482 1.00 0.00 O -ATOM 2907 N GLU 185 4.255 -1.474 19.602 1.00 0.00 N -ATOM 2908 H GLU 185 4.861 -0.883 20.153 1.00 0.00 H -ATOM 2909 CA GLU 185 3.379 -2.495 20.209 1.00 0.00 C -ATOM 2910 HA GLU 185 3.662 -3.477 19.832 1.00 0.00 H -ATOM 2911 CB GLU 185 3.695 -2.525 21.713 1.00 0.00 C -ATOM 2912 HB2 GLU 185 4.758 -2.510 21.952 1.00 0.00 H -ATOM 2913 HB3 GLU 185 3.345 -1.596 22.163 1.00 0.00 H -ATOM 2914 CG GLU 185 2.827 -3.570 22.465 1.00 0.00 C -ATOM 2915 HG2 GLU 185 2.869 -3.313 23.524 1.00 0.00 H -ATOM 2916 HG3 GLU 185 1.769 -3.559 22.202 1.00 0.00 H -ATOM 2917 CD GLU 185 3.340 -5.005 22.247 1.00 0.00 C -ATOM 2918 OE1 GLU 185 2.541 -5.893 21.873 1.00 0.00 O -ATOM 2919 OE2 GLU 185 4.591 -5.270 22.225 1.00 0.00 O -ATOM 2920 C GLU 185 1.902 -2.058 19.917 1.00 0.00 C -ATOM 2921 O GLU 185 1.617 -0.844 20.085 1.00 0.00 O -ATOM 2922 N GLU 186 1.052 -3.041 19.415 1.00 0.00 N -ATOM 2923 H GLU 186 1.235 -4.027 19.293 1.00 0.00 H -ATOM 2924 CA GLU 186 -0.223 -2.565 18.831 1.00 0.00 C -ATOM 2925 HA GLU 186 -0.013 -1.740 18.151 1.00 0.00 H -ATOM 2926 CB GLU 186 -1.033 -3.606 18.066 1.00 0.00 C -ATOM 2927 HB2 GLU 186 -1.303 -4.340 18.826 1.00 0.00 H -ATOM 2928 HB3 GLU 186 -1.923 -3.103 17.688 1.00 0.00 H -ATOM 2929 CG GLU 186 -0.334 -4.372 16.890 1.00 0.00 C -ATOM 2930 HG2 GLU 186 -0.976 -5.080 16.367 1.00 0.00 H -ATOM 2931 HG3 GLU 186 0.091 -3.680 16.163 1.00 0.00 H -ATOM 2932 CD GLU 186 0.780 -5.285 17.379 1.00 0.00 C -ATOM 2933 OE1 GLU 186 0.568 -6.155 18.240 1.00 0.00 O -ATOM 2934 OE2 GLU 186 1.918 -5.164 16.886 1.00 0.00 O -ATOM 2935 C GLU 186 -1.134 -1.890 19.904 1.00 0.00 C -ATOM 2936 O GLU 186 -1.164 -2.223 21.110 1.00 0.00 O -ATOM 2937 N ILE 187 -2.044 -1.066 19.356 1.00 0.00 N -ATOM 2938 H ILE 187 -1.915 -0.859 18.376 1.00 0.00 H -ATOM 2939 CA ILE 187 -3.173 -0.492 20.062 1.00 0.00 C -ATOM 2940 HA ILE 187 -2.920 -0.456 21.122 1.00 0.00 H -ATOM 2941 CB ILE 187 -3.416 0.996 19.689 1.00 0.00 C -ATOM 2942 HB ILE 187 -3.247 1.217 18.635 1.00 0.00 H -ATOM 2943 CG2 ILE 187 -4.934 1.431 19.935 1.00 0.00 C -ATOM 2944 HG21 ILE 187 -5.059 2.470 19.630 1.00 0.00 H -ATOM 2945 HG22 ILE 187 -5.505 0.972 19.127 1.00 0.00 H -ATOM 2946 HG23 ILE 187 -5.363 1.208 20.912 1.00 0.00 H -ATOM 2947 CG1 ILE 187 -2.360 1.878 20.366 1.00 0.00 C -ATOM 2948 HG12 ILE 187 -2.556 1.881 21.438 1.00 0.00 H -ATOM 2949 HG13 ILE 187 -1.336 1.528 20.236 1.00 0.00 H -ATOM 2950 CD1 ILE 187 -2.486 3.338 19.940 1.00 0.00 C -ATOM 2951 HD11 ILE 187 -3.498 3.719 20.076 1.00 0.00 H -ATOM 2952 HD12 ILE 187 -1.724 4.021 20.316 1.00 0.00 H -ATOM 2953 HD13 ILE 187 -2.407 3.447 18.858 1.00 0.00 H -ATOM 2954 C ILE 187 -4.418 -1.481 20.029 1.00 0.00 C -ATOM 2955 O ILE 187 -5.016 -1.687 18.961 1.00 0.00 O -ATOM 2956 N THR 188 -4.858 -2.018 21.128 1.00 0.00 N -ATOM 2957 H THR 188 -4.435 -1.757 22.007 1.00 0.00 H -ATOM 2958 CA THR 188 -6.216 -2.627 21.211 1.00 0.00 C -ATOM 2959 HA THR 188 -6.276 -3.427 20.473 1.00 0.00 H -ATOM 2960 CB THR 188 -6.495 -3.170 22.610 1.00 0.00 C -ATOM 2961 HB THR 188 -6.240 -2.320 23.242 1.00 0.00 H -ATOM 2962 CG2 THR 188 -7.958 -3.585 22.937 1.00 0.00 C -ATOM 2963 HG21 THR 188 -8.143 -4.554 22.473 1.00 0.00 H -ATOM 2964 HG22 THR 188 -7.961 -3.641 24.025 1.00 0.00 H -ATOM 2965 HG23 THR 188 -8.628 -2.796 22.596 1.00 0.00 H -ATOM 2966 OG1 THR 188 -5.728 -4.253 22.903 1.00 0.00 O -ATOM 2967 HG1 THR 188 -4.841 -3.906 23.022 1.00 0.00 H -ATOM 2968 C THR 188 -7.302 -1.622 20.759 1.00 0.00 C -ATOM 2969 O THR 188 -7.359 -0.471 21.241 1.00 0.00 O -ATOM 2970 N VAL 189 -8.253 -2.031 19.944 1.00 0.00 N -ATOM 2971 H VAL 189 -8.333 -2.947 19.525 1.00 0.00 H -ATOM 2972 CA VAL 189 -9.397 -1.257 19.501 1.00 0.00 C -ATOM 2973 HA VAL 189 -9.197 -0.214 19.749 1.00 0.00 H -ATOM 2974 CB VAL 189 -9.662 -1.334 18.008 1.00 0.00 C -ATOM 2975 HB VAL 189 -9.902 -2.382 17.831 1.00 0.00 H -ATOM 2976 CG1 VAL 189 -10.770 -0.339 17.460 1.00 0.00 C -ATOM 2977 HG11 VAL 189 -11.679 -0.463 18.049 1.00 0.00 H -ATOM 2978 HG12 VAL 189 -10.484 0.708 17.559 1.00 0.00 H -ATOM 2979 HG13 VAL 189 -11.025 -0.381 16.401 1.00 0.00 H -ATOM 2980 CG2 VAL 189 -8.395 -1.053 17.113 1.00 0.00 C -ATOM 2981 HG21 VAL 189 -7.863 -0.145 17.395 1.00 0.00 H -ATOM 2982 HG22 VAL 189 -7.737 -1.917 17.203 1.00 0.00 H -ATOM 2983 HG23 VAL 189 -8.639 -0.928 16.058 1.00 0.00 H -ATOM 2984 C VAL 189 -10.719 -1.710 20.182 1.00 0.00 C -ATOM 2985 O VAL 189 -10.934 -2.912 20.153 1.00 0.00 O -ATOM 2986 N HIE 190 -11.613 -0.784 20.627 1.00 0.00 N -ATOM 2987 H HIE 190 -11.310 0.175 20.719 1.00 0.00 H -ATOM 2988 CA HIE 190 -12.933 -1.018 21.222 1.00 0.00 C -ATOM 2989 HA HIE 190 -13.045 -2.098 21.130 1.00 0.00 H -ATOM 2990 CB HIE 190 -12.820 -0.633 22.696 1.00 0.00 C -ATOM 2991 HB2 HIE 190 -12.536 0.408 22.848 1.00 0.00 H -ATOM 2992 HB3 HIE 190 -13.761 -0.893 23.181 1.00 0.00 H -ATOM 2993 CG HIE 190 -11.842 -1.357 23.577 1.00 0.00 C -ATOM 2994 ND1 HIE 190 -11.897 -2.675 23.919 1.00 0.00 N -ATOM 2995 CE1 HIE 190 -10.821 -2.953 24.687 1.00 0.00 C -ATOM 2996 HE1 HIE 190 -10.567 -3.961 24.980 1.00 0.00 H -ATOM 2997 NE2 HIE 190 -10.064 -1.888 24.868 1.00 0.00 N -ATOM 2998 HE2 HIE 190 -9.191 -1.852 25.375 1.00 0.00 H -ATOM 2999 CD2 HIE 190 -10.734 -0.849 24.188 1.00 0.00 C -ATOM 3000 HD2 HIE 190 -10.412 0.174 24.059 1.00 0.00 H -ATOM 3001 C HIE 190 -14.106 -0.256 20.455 1.00 0.00 C -ATOM 3002 O HIE 190 -15.161 -0.841 20.280 1.00 0.00 O -ATOM 3003 N ASN 191 -13.862 0.880 19.937 1.00 0.00 N -ATOM 3004 H ASN 191 -13.017 1.364 20.204 1.00 0.00 H -ATOM 3005 CA ASN 191 -14.692 1.649 19.008 1.00 0.00 C -ATOM 3006 HA ASN 191 -15.382 0.963 18.516 1.00 0.00 H -ATOM 3007 CB ASN 191 -15.394 2.668 19.883 1.00 0.00 C -ATOM 3008 HB2 ASN 191 -15.908 2.194 20.719 1.00 0.00 H -ATOM 3009 HB3 ASN 191 -14.635 3.333 20.295 1.00 0.00 H -ATOM 3010 CG ASN 191 -16.452 3.476 19.082 1.00 0.00 C -ATOM 3011 OD1 ASN 191 -16.195 4.109 18.059 1.00 0.00 O -ATOM 3012 ND2 ASN 191 -17.721 3.406 19.468 1.00 0.00 N -ATOM 3013 HD21 ASN 191 -18.370 3.936 18.905 1.00 0.00 H -ATOM 3014 HD22 ASN 191 -17.901 2.768 20.230 1.00 0.00 H -ATOM 3015 C ASN 191 -13.730 2.366 18.001 1.00 0.00 C -ATOM 3016 O ASN 191 -12.743 3.006 18.454 1.00 0.00 O -ATOM 3017 N LYS 192 -13.886 2.235 16.650 1.00 0.00 N -ATOM 3018 H LYS 192 -14.706 1.775 16.282 1.00 0.00 H -ATOM 3019 CA LYS 192 -13.025 2.869 15.691 1.00 0.00 C -ATOM 3020 HA LYS 192 -12.008 2.480 15.726 1.00 0.00 H -ATOM 3021 CB LYS 192 -13.368 2.667 14.164 1.00 0.00 C -ATOM 3022 HB2 LYS 192 -12.573 3.103 13.558 1.00 0.00 H -ATOM 3023 HB3 LYS 192 -13.336 1.580 14.090 1.00 0.00 H -ATOM 3024 CG LYS 192 -14.685 3.178 13.539 1.00 0.00 C -ATOM 3025 HG2 LYS 192 -14.713 4.261 13.652 1.00 0.00 H -ATOM 3026 HG3 LYS 192 -14.537 3.033 12.469 1.00 0.00 H -ATOM 3027 CD LYS 192 -15.954 2.465 14.060 1.00 0.00 C -ATOM 3028 HD2 LYS 192 -16.041 1.431 13.726 1.00 0.00 H -ATOM 3029 HD3 LYS 192 -16.020 2.641 15.134 1.00 0.00 H -ATOM 3030 CE LYS 192 -17.146 3.240 13.364 1.00 0.00 C -ATOM 3031 HE2 LYS 192 -17.059 4.326 13.357 1.00 0.00 H -ATOM 3032 HE3 LYS 192 -17.127 2.893 12.331 1.00 0.00 H -ATOM 3033 NZ LYS 192 -18.412 2.791 13.923 1.00 0.00 N -ATOM 3034 HZ1 LYS 192 -18.416 1.782 13.952 1.00 0.00 H -ATOM 3035 HZ2 LYS 192 -18.579 3.155 14.850 1.00 0.00 H -ATOM 3036 HZ3 LYS 192 -19.194 3.091 13.359 1.00 0.00 H -ATOM 3037 C LYS 192 -12.873 4.393 15.824 1.00 0.00 C -ATOM 3038 O LYS 192 -11.869 4.989 15.313 1.00 0.00 O -ATOM 3039 N ASP 193 -13.835 5.083 16.457 1.00 0.00 N -ATOM 3040 H ASP 193 -14.645 4.505 16.627 1.00 0.00 H -ATOM 3041 CA ASP 193 -13.763 6.514 16.753 1.00 0.00 C -ATOM 3042 HA ASP 193 -13.932 7.070 15.831 1.00 0.00 H -ATOM 3043 CB ASP 193 -14.949 6.852 17.706 1.00 0.00 C -ATOM 3044 HB2 ASP 193 -15.936 6.551 17.356 1.00 0.00 H -ATOM 3045 HB3 ASP 193 -14.781 6.230 18.585 1.00 0.00 H -ATOM 3046 CG ASP 193 -14.960 8.347 17.935 1.00 0.00 C -ATOM 3047 OD1 ASP 193 -14.679 8.689 19.061 1.00 0.00 O -ATOM 3048 OD2 ASP 193 -15.283 9.088 16.976 1.00 0.00 O -ATOM 3049 C ASP 193 -12.396 7.028 17.350 1.00 0.00 C -ATOM 3050 O ASP 193 -11.745 7.938 16.747 1.00 0.00 O -ATOM 3051 N GLU 194 -11.869 6.322 18.363 1.00 0.00 N -ATOM 3052 H GLU 194 -12.407 5.541 18.709 1.00 0.00 H -ATOM 3053 CA GLU 194 -10.576 6.594 19.017 1.00 0.00 C -ATOM 3054 HA GLU 194 -10.579 7.655 19.267 1.00 0.00 H -ATOM 3055 CB GLU 194 -10.315 5.720 20.218 1.00 0.00 C -ATOM 3056 HB2 GLU 194 -10.381 4.695 19.856 1.00 0.00 H -ATOM 3057 HB3 GLU 194 -9.330 5.974 20.610 1.00 0.00 H -ATOM 3058 CG GLU 194 -11.369 5.864 21.322 1.00 0.00 C -ATOM 3059 HG2 GLU 194 -12.296 5.734 20.764 1.00 0.00 H -ATOM 3060 HG3 GLU 194 -11.224 5.043 22.024 1.00 0.00 H -ATOM 3061 CD GLU 194 -11.303 7.239 21.974 1.00 0.00 C -ATOM 3062 OE1 GLU 194 -12.233 7.464 22.755 1.00 0.00 O -ATOM 3063 OE2 GLU 194 -10.363 8.045 21.818 1.00 0.00 O -ATOM 3064 C GLU 194 -9.429 6.409 18.026 1.00 0.00 C -ATOM 3065 O GLU 194 -8.520 7.201 18.039 1.00 0.00 O -ATOM 3066 N VAL 195 -9.475 5.477 17.079 1.00 0.00 N -ATOM 3067 H VAL 195 -10.268 4.852 17.108 1.00 0.00 H -ATOM 3068 CA VAL 195 -8.403 5.100 16.133 1.00 0.00 C -ATOM 3069 HA VAL 195 -7.422 5.097 16.607 1.00 0.00 H -ATOM 3070 CB VAL 195 -8.624 3.665 15.695 1.00 0.00 C -ATOM 3071 HB VAL 195 -9.647 3.523 15.346 1.00 0.00 H -ATOM 3072 CG1 VAL 195 -7.568 3.138 14.710 1.00 0.00 C -ATOM 3073 HG11 VAL 195 -6.593 3.424 15.105 1.00 0.00 H -ATOM 3074 HG12 VAL 195 -7.610 2.052 14.630 1.00 0.00 H -ATOM 3075 HG13 VAL 195 -7.776 3.517 13.709 1.00 0.00 H -ATOM 3076 CG2 VAL 195 -8.542 2.779 16.929 1.00 0.00 C -ATOM 3077 HG21 VAL 195 -9.280 3.034 17.689 1.00 0.00 H -ATOM 3078 HG22 VAL 195 -8.661 1.785 16.496 1.00 0.00 H -ATOM 3079 HG23 VAL 195 -7.518 2.759 17.301 1.00 0.00 H -ATOM 3080 C VAL 195 -8.355 6.006 14.865 1.00 0.00 C -ATOM 3081 O VAL 195 -7.321 6.242 14.208 1.00 0.00 O -ATOM 3082 N TYR 196 -9.548 6.519 14.463 1.00 0.00 N -ATOM 3083 H TYR 196 -10.395 6.097 14.814 1.00 0.00 H -ATOM 3084 CA TYR 196 -9.634 7.568 13.412 1.00 0.00 C -ATOM 3085 HA TYR 196 -9.060 7.246 12.543 1.00 0.00 H -ATOM 3086 CB TYR 196 -11.165 7.828 13.032 1.00 0.00 C -ATOM 3087 HB2 TYR 196 -11.505 6.903 12.568 1.00 0.00 H -ATOM 3088 HB3 TYR 196 -11.672 7.895 13.994 1.00 0.00 H -ATOM 3089 CG TYR 196 -11.501 8.959 12.098 1.00 0.00 C -ATOM 3090 CD1 TYR 196 -11.486 10.272 12.565 1.00 0.00 C -ATOM 3091 HD1 TYR 196 -11.358 10.525 13.608 1.00 0.00 H -ATOM 3092 CE1 TYR 196 -11.565 11.415 11.740 1.00 0.00 C -ATOM 3093 HE1 TYR 196 -11.306 12.370 12.172 1.00 0.00 H -ATOM 3094 CZ TYR 196 -11.675 11.220 10.361 1.00 0.00 C -ATOM 3095 OH TYR 196 -11.603 12.217 9.474 1.00 0.00 O -ATOM 3096 HH TYR 196 -11.345 13.060 9.855 1.00 0.00 H -ATOM 3097 CE2 TYR 196 -11.812 9.888 9.926 1.00 0.00 C -ATOM 3098 HE2 TYR 196 -12.001 9.672 8.885 1.00 0.00 H -ATOM 3099 CD2 TYR 196 -11.698 8.778 10.746 1.00 0.00 C -ATOM 3100 HD2 TYR 196 -11.731 7.775 10.347 1.00 0.00 H -ATOM 3101 C TYR 196 -8.904 8.858 13.773 1.00 0.00 C -ATOM 3102 O TYR 196 -8.059 9.353 13.028 1.00 0.00 O -ATOM 3103 N GLN 197 -9.078 9.377 15.008 1.00 0.00 N -ATOM 3104 H GLN 197 -9.823 8.945 15.536 1.00 0.00 H -ATOM 3105 CA GLN 197 -8.190 10.414 15.624 1.00 0.00 C -ATOM 3106 HA GLN 197 -8.334 11.313 15.025 1.00 0.00 H -ATOM 3107 CB GLN 197 -8.711 10.786 17.047 1.00 0.00 C -ATOM 3108 HB2 GLN 197 -8.455 9.902 17.631 1.00 0.00 H -ATOM 3109 HB3 GLN 197 -8.077 11.553 17.493 1.00 0.00 H -ATOM 3110 CG GLN 197 -10.137 11.116 17.460 1.00 0.00 C -ATOM 3111 HG2 GLN 197 -10.770 10.228 17.439 1.00 0.00 H -ATOM 3112 HG3 GLN 197 -10.145 11.611 18.431 1.00 0.00 H -ATOM 3113 CD GLN 197 -10.669 12.228 16.579 1.00 0.00 C -ATOM 3114 OE1 GLN 197 -9.924 13.089 16.022 1.00 0.00 O -ATOM 3115 NE2 GLN 197 -11.996 12.291 16.406 1.00 0.00 N -ATOM 3116 HE21 GLN 197 -12.384 13.011 15.813 1.00 0.00 H -ATOM 3117 HE22 GLN 197 -12.532 11.490 16.707 1.00 0.00 H -ATOM 3118 C GLN 197 -6.685 10.065 15.546 1.00 0.00 C -ATOM 3119 O GLN 197 -5.876 10.853 15.083 1.00 0.00 O -ATOM 3120 N ILE 198 -6.293 8.855 16.010 1.00 0.00 N -ATOM 3121 H ILE 198 -6.922 8.205 16.460 1.00 0.00 H -ATOM 3122 CA ILE 198 -4.935 8.338 15.942 1.00 0.00 C -ATOM 3123 HA ILE 198 -4.280 8.933 16.579 1.00 0.00 H -ATOM 3124 CB ILE 198 -4.720 6.935 16.634 1.00 0.00 C -ATOM 3125 HB ILE 198 -5.379 6.202 16.167 1.00 0.00 H -ATOM 3126 CG2 ILE 198 -3.329 6.339 16.378 1.00 0.00 C -ATOM 3127 HG21 ILE 198 -3.330 6.111 15.313 1.00 0.00 H -ATOM 3128 HG22 ILE 198 -2.588 7.126 16.518 1.00 0.00 H -ATOM 3129 HG23 ILE 198 -3.202 5.386 16.892 1.00 0.00 H -ATOM 3130 CG1 ILE 198 -4.936 7.040 18.134 1.00 0.00 C -ATOM 3131 HG12 ILE 198 -4.107 7.577 18.595 1.00 0.00 H -ATOM 3132 HG13 ILE 198 -5.820 7.656 18.298 1.00 0.00 H -ATOM 3133 CD1 ILE 198 -5.161 5.683 18.773 1.00 0.00 C -ATOM 3134 HD11 ILE 198 -5.130 5.873 19.846 1.00 0.00 H -ATOM 3135 HD12 ILE 198 -6.158 5.291 18.573 1.00 0.00 H -ATOM 3136 HD13 ILE 198 -4.382 4.955 18.545 1.00 0.00 H -ATOM 3137 C ILE 198 -4.452 8.418 14.452 1.00 0.00 C -ATOM 3138 O ILE 198 -3.383 8.903 14.225 1.00 0.00 O -ATOM 3139 N LEU 199 -5.211 7.892 13.515 1.00 0.00 N -ATOM 3140 H LEU 199 -6.062 7.501 13.893 1.00 0.00 H -ATOM 3141 CA LEU 199 -5.005 7.883 12.004 1.00 0.00 C -ATOM 3142 HA LEU 199 -4.025 7.475 11.758 1.00 0.00 H -ATOM 3143 CB LEU 199 -6.182 7.087 11.390 1.00 0.00 C -ATOM 3144 HB2 LEU 199 -6.140 6.074 11.793 1.00 0.00 H -ATOM 3145 HB3 LEU 199 -7.091 7.516 11.811 1.00 0.00 H -ATOM 3146 CG LEU 199 -6.293 7.079 9.821 1.00 0.00 C -ATOM 3147 HG LEU 199 -5.303 7.139 9.368 1.00 0.00 H -ATOM 3148 CD1 LEU 199 -7.106 5.904 9.316 1.00 0.00 C -ATOM 3149 HD11 LEU 199 -7.529 6.063 8.325 1.00 0.00 H -ATOM 3150 HD12 LEU 199 -6.481 5.011 9.281 1.00 0.00 H -ATOM 3151 HD13 LEU 199 -7.994 5.794 9.939 1.00 0.00 H -ATOM 3152 CD2 LEU 199 -7.006 8.333 9.139 1.00 0.00 C -ATOM 3153 HD21 LEU 199 -8.084 8.321 9.304 1.00 0.00 H -ATOM 3154 HD22 LEU 199 -6.598 9.222 9.620 1.00 0.00 H -ATOM 3155 HD23 LEU 199 -6.754 8.418 8.082 1.00 0.00 H -ATOM 3156 C LEU 199 -4.889 9.335 11.536 1.00 0.00 C -ATOM 3157 O LEU 199 -4.054 9.536 10.665 1.00 0.00 O -ATOM 3158 N GLU 200 -5.591 10.353 12.134 1.00 0.00 N -ATOM 3159 H GLU 200 -6.268 10.110 12.843 1.00 0.00 H -ATOM 3160 CA GLU 200 -5.420 11.819 11.813 1.00 0.00 C -ATOM 3161 HA GLU 200 -5.554 11.836 10.731 1.00 0.00 H -ATOM 3162 CB GLU 200 -6.566 12.690 12.400 1.00 0.00 C -ATOM 3163 HB2 GLU 200 -7.550 12.280 12.172 1.00 0.00 H -ATOM 3164 HB3 GLU 200 -6.568 12.720 13.489 1.00 0.00 H -ATOM 3165 CG GLU 200 -6.518 14.203 12.051 1.00 0.00 C -ATOM 3166 HG2 GLU 200 -7.259 14.739 12.645 1.00 0.00 H -ATOM 3167 HG3 GLU 200 -5.502 14.546 12.243 1.00 0.00 H -ATOM 3168 CD GLU 200 -6.845 14.431 10.590 1.00 0.00 C -ATOM 3169 OE1 GLU 200 -8.009 14.646 10.229 1.00 0.00 O -ATOM 3170 OE2 GLU 200 -5.996 14.346 9.692 1.00 0.00 O -ATOM 3171 C GLU 200 -3.995 12.317 12.260 1.00 0.00 C -ATOM 3172 O GLU 200 -3.386 12.989 11.428 1.00 0.00 O -ATOM 3173 N LYS 201 -3.521 11.964 13.460 1.00 0.00 N -ATOM 3174 H LYS 201 -4.199 11.654 14.141 1.00 0.00 H -ATOM 3175 CA LYS 201 -2.108 12.190 13.860 1.00 0.00 C -ATOM 3176 HA LYS 201 -1.917 13.230 13.596 1.00 0.00 H -ATOM 3177 CB LYS 201 -2.031 12.050 15.378 1.00 0.00 C -ATOM 3178 HB2 LYS 201 -2.768 12.727 15.809 1.00 0.00 H -ATOM 3179 HB3 LYS 201 -2.498 11.117 15.696 1.00 0.00 H -ATOM 3180 CG LYS 201 -0.605 12.362 15.964 1.00 0.00 C -ATOM 3181 HG2 LYS 201 0.209 11.800 15.506 1.00 0.00 H -ATOM 3182 HG3 LYS 201 -0.414 13.431 15.873 1.00 0.00 H -ATOM 3183 CD LYS 201 -0.597 12.221 17.519 1.00 0.00 C -ATOM 3184 HD2 LYS 201 -0.620 11.188 17.865 1.00 0.00 H -ATOM 3185 HD3 LYS 201 0.342 12.613 17.908 1.00 0.00 H -ATOM 3186 CE LYS 201 -1.680 13.127 18.234 1.00 0.00 C -ATOM 3187 HE2 LYS 201 -1.461 14.174 18.021 1.00 0.00 H -ATOM 3188 HE3 LYS 201 -2.651 12.794 17.867 1.00 0.00 H -ATOM 3189 NZ LYS 201 -1.744 12.882 19.709 1.00 0.00 N -ATOM 3190 HZ1 LYS 201 -2.372 13.565 20.107 1.00 0.00 H -ATOM 3191 HZ2 LYS 201 -2.185 12.012 19.972 1.00 0.00 H -ATOM 3192 HZ3 LYS 201 -0.880 12.937 20.230 1.00 0.00 H -ATOM 3193 C LYS 201 -1.045 11.282 13.170 1.00 0.00 C -ATOM 3194 O LYS 201 0.069 11.709 12.960 1.00 0.00 O -ATOM 3195 N GLY 202 -1.513 10.194 12.588 1.00 0.00 N -ATOM 3196 H GLY 202 -2.372 9.822 12.970 1.00 0.00 H -ATOM 3197 CA GLY 202 -0.799 9.569 11.444 1.00 0.00 C -ATOM 3198 HA2 GLY 202 0.211 9.419 11.828 1.00 0.00 H -ATOM 3199 HA3 GLY 202 -1.152 8.617 11.049 1.00 0.00 H -ATOM 3200 C GLY 202 -0.604 10.605 10.251 1.00 0.00 C -ATOM 3201 O GLY 202 0.577 10.890 9.896 1.00 0.00 O -ATOM 3202 N ALA 203 -1.697 11.152 9.711 1.00 0.00 N -ATOM 3203 H ALA 203 -2.654 10.898 9.909 1.00 0.00 H -ATOM 3204 CA ALA 203 -1.590 12.183 8.682 1.00 0.00 C -ATOM 3205 HA ALA 203 -1.005 11.867 7.818 1.00 0.00 H -ATOM 3206 CB ALA 203 -2.935 12.492 8.093 1.00 0.00 C -ATOM 3207 HB1 ALA 203 -2.832 13.163 7.240 1.00 0.00 H -ATOM 3208 HB2 ALA 203 -3.466 11.614 7.725 1.00 0.00 H -ATOM 3209 HB3 ALA 203 -3.502 13.036 8.848 1.00 0.00 H -ATOM 3210 C ALA 203 -0.927 13.554 9.044 1.00 0.00 C -ATOM 3211 O ALA 203 -0.136 14.148 8.240 1.00 0.00 O -ATOM 3212 N ALA 204 -1.087 14.049 10.221 1.00 0.00 N -ATOM 3213 H ALA 204 -1.753 13.536 10.781 1.00 0.00 H -ATOM 3214 CA ALA 204 -0.429 15.307 10.718 1.00 0.00 C -ATOM 3215 HA ALA 204 -0.776 16.139 10.106 1.00 0.00 H -ATOM 3216 CB ALA 204 -0.892 15.548 12.136 1.00 0.00 C -ATOM 3217 HB1 ALA 204 -0.621 16.558 12.440 1.00 0.00 H -ATOM 3218 HB2 ALA 204 -1.979 15.463 12.147 1.00 0.00 H -ATOM 3219 HB3 ALA 204 -0.388 14.869 12.824 1.00 0.00 H -ATOM 3220 C ALA 204 1.090 15.218 10.614 1.00 0.00 C -ATOM 3221 O ALA 204 1.651 16.111 10.084 1.00 0.00 O -ATOM 3222 N LYS 205 1.690 14.108 11.139 1.00 0.00 N -ATOM 3223 H LYS 205 1.150 13.361 11.551 1.00 0.00 H -ATOM 3224 CA LYS 205 3.182 13.925 11.016 1.00 0.00 C -ATOM 3225 HA LYS 205 3.641 14.767 11.533 1.00 0.00 H -ATOM 3226 CB LYS 205 3.566 12.701 11.800 1.00 0.00 C -ATOM 3227 HB2 LYS 205 3.044 11.780 11.539 1.00 0.00 H -ATOM 3228 HB3 LYS 205 4.599 12.514 11.508 1.00 0.00 H -ATOM 3229 CG LYS 205 3.474 12.910 13.262 1.00 0.00 C -ATOM 3230 HG2 LYS 205 4.202 13.659 13.574 1.00 0.00 H -ATOM 3231 HG3 LYS 205 2.474 13.258 13.523 1.00 0.00 H -ATOM 3232 CD LYS 205 3.965 11.584 13.898 1.00 0.00 C -ATOM 3233 HD2 LYS 205 3.244 10.772 13.801 1.00 0.00 H -ATOM 3234 HD3 LYS 205 4.927 11.288 13.480 1.00 0.00 H -ATOM 3235 CE LYS 205 4.278 11.740 15.362 1.00 0.00 C -ATOM 3236 HE2 LYS 205 4.922 12.591 15.581 1.00 0.00 H -ATOM 3237 HE3 LYS 205 3.358 11.930 15.915 1.00 0.00 H -ATOM 3238 NZ LYS 205 4.927 10.593 16.048 1.00 0.00 N -ATOM 3239 HZ1 LYS 205 5.896 10.498 15.779 1.00 0.00 H -ATOM 3240 HZ2 LYS 205 4.797 10.754 17.036 1.00 0.00 H -ATOM 3241 HZ3 LYS 205 4.356 9.791 15.822 1.00 0.00 H -ATOM 3242 C LYS 205 3.713 13.860 9.596 1.00 0.00 C -ATOM 3243 O LYS 205 4.726 14.535 9.420 1.00 0.00 O -ATOM 3244 N ARG 206 3.035 13.151 8.640 1.00 0.00 N -ATOM 3245 H ARG 206 2.265 12.583 8.961 1.00 0.00 H -ATOM 3246 CA ARG 206 3.356 13.237 7.223 1.00 0.00 C -ATOM 3247 HA ARG 206 4.366 12.866 7.046 1.00 0.00 H -ATOM 3248 CB ARG 206 2.406 12.365 6.433 1.00 0.00 C -ATOM 3249 HB2 ARG 206 1.371 12.599 6.680 1.00 0.00 H -ATOM 3250 HB3 ARG 206 2.559 12.539 5.368 1.00 0.00 H -ATOM 3251 CG ARG 206 2.671 10.872 6.675 1.00 0.00 C -ATOM 3252 HG2 ARG 206 3.688 10.599 6.395 1.00 0.00 H -ATOM 3253 HG3 ARG 206 2.718 10.677 7.746 1.00 0.00 H -ATOM 3254 CD ARG 206 1.593 10.049 6.030 1.00 0.00 C -ATOM 3255 HD2 ARG 206 0.677 10.454 6.460 1.00 0.00 H -ATOM 3256 HD3 ARG 206 1.518 10.176 4.950 1.00 0.00 H -ATOM 3257 NE ARG 206 1.757 8.686 6.522 1.00 0.00 N -ATOM 3258 HE ARG 206 2.557 8.157 6.207 1.00 0.00 H -ATOM 3259 CZ ARG 206 0.952 8.040 7.289 1.00 0.00 C -ATOM 3260 NH1 ARG 206 -0.245 8.408 7.476 1.00 0.00 N -ATOM 3261 HH11 ARG 206 -0.680 9.074 6.854 1.00 0.00 H -ATOM 3262 HH12 ARG 206 -0.899 7.873 8.029 1.00 0.00 H -ATOM 3263 NH2 ARG 206 1.390 6.966 7.863 1.00 0.00 N -ATOM 3264 HH21 ARG 206 2.338 6.763 7.582 1.00 0.00 H -ATOM 3265 HH22 ARG 206 0.768 6.238 8.184 1.00 0.00 H -ATOM 3266 C ARG 206 3.347 14.636 6.605 1.00 0.00 C -ATOM 3267 O ARG 206 4.283 14.984 5.907 1.00 0.00 O -ATOM 3268 N THR 207 2.277 15.389 6.864 1.00 0.00 N -ATOM 3269 H THR 207 1.527 14.933 7.364 1.00 0.00 H -ATOM 3270 CA THR 207 2.152 16.770 6.452 1.00 0.00 C -ATOM 3271 HA THR 207 2.382 16.797 5.387 1.00 0.00 H -ATOM 3272 CB THR 207 0.698 17.271 6.735 1.00 0.00 C -ATOM 3273 HB THR 207 0.508 16.905 7.744 1.00 0.00 H -ATOM 3274 CG2 THR 207 0.381 18.748 6.701 1.00 0.00 C -ATOM 3275 HG21 THR 207 0.382 19.021 5.645 1.00 0.00 H -ATOM 3276 HG22 THR 207 -0.627 19.035 7.000 1.00 0.00 H -ATOM 3277 HG23 THR 207 1.136 19.366 7.186 1.00 0.00 H -ATOM 3278 OG1 THR 207 -0.164 16.666 5.863 1.00 0.00 O -ATOM 3279 HG1 THR 207 -1.017 16.594 6.298 1.00 0.00 H -ATOM 3280 C THR 207 3.185 17.722 7.082 1.00 0.00 C -ATOM 3281 O THR 207 3.820 18.456 6.371 1.00 0.00 O -ATOM 3282 N THR 208 3.435 17.495 8.382 1.00 0.00 N -ATOM 3283 H THR 208 3.000 16.654 8.733 1.00 0.00 H -ATOM 3284 CA THR 208 4.625 18.093 9.073 1.00 0.00 C -ATOM 3285 HA THR 208 4.514 19.172 9.180 1.00 0.00 H -ATOM 3286 CB THR 208 4.607 17.695 10.542 1.00 0.00 C -ATOM 3287 HB THR 208 4.585 16.611 10.654 1.00 0.00 H -ATOM 3288 CG2 THR 208 5.715 18.335 11.374 1.00 0.00 C -ATOM 3289 HG21 THR 208 6.688 17.883 11.181 1.00 0.00 H -ATOM 3290 HG22 THR 208 5.833 19.369 11.049 1.00 0.00 H -ATOM 3291 HG23 THR 208 5.439 18.444 12.423 1.00 0.00 H -ATOM 3292 OG1 THR 208 3.341 18.106 11.076 1.00 0.00 O -ATOM 3293 HG1 THR 208 2.662 17.621 10.601 1.00 0.00 H -ATOM 3294 C THR 208 6.019 17.719 8.444 1.00 0.00 C -ATOM 3295 O THR 208 6.822 18.593 8.276 1.00 0.00 O -ATOM 3296 N ALA 209 6.245 16.532 7.956 1.00 0.00 N -ATOM 3297 H ALA 209 5.603 15.800 8.226 1.00 0.00 H -ATOM 3298 CA ALA 209 7.599 16.123 7.545 1.00 0.00 C -ATOM 3299 HA ALA 209 8.331 16.400 8.305 1.00 0.00 H -ATOM 3300 CB ALA 209 7.597 14.625 7.527 1.00 0.00 C -ATOM 3301 HB1 ALA 209 7.045 14.231 8.380 1.00 0.00 H -ATOM 3302 HB2 ALA 209 6.993 14.226 6.712 1.00 0.00 H -ATOM 3303 HB3 ALA 209 8.626 14.266 7.503 1.00 0.00 H -ATOM 3304 C ALA 209 8.161 16.867 6.373 1.00 0.00 C -ATOM 3305 O ALA 209 9.350 17.220 6.342 1.00 0.00 O -ATOM 3306 N ALA 210 7.330 17.032 5.388 1.00 0.00 N -ATOM 3307 H ALA 210 6.380 16.788 5.628 1.00 0.00 H -ATOM 3308 CA ALA 210 7.530 17.897 4.149 1.00 0.00 C -ATOM 3309 HA ALA 210 8.329 17.484 3.532 1.00 0.00 H -ATOM 3310 CB ALA 210 6.225 17.871 3.317 1.00 0.00 C -ATOM 3311 HB1 ALA 210 6.422 18.219 2.303 1.00 0.00 H -ATOM 3312 HB2 ALA 210 5.820 16.859 3.301 1.00 0.00 H -ATOM 3313 HB3 ALA 210 5.453 18.502 3.757 1.00 0.00 H -ATOM 3314 C ALA 210 7.919 19.375 4.478 1.00 0.00 C -ATOM 3315 O ALA 210 8.575 19.989 3.604 1.00 0.00 O -ATOM 3316 N THR 211 7.436 19.891 5.578 1.00 0.00 N -ATOM 3317 H THR 211 6.855 19.352 6.204 1.00 0.00 H -ATOM 3318 CA THR 211 7.883 21.153 6.062 1.00 0.00 C -ATOM 3319 HA THR 211 7.927 21.830 5.209 1.00 0.00 H -ATOM 3320 CB THR 211 6.839 21.703 7.035 1.00 0.00 C -ATOM 3321 HB THR 211 6.626 21.042 7.875 1.00 0.00 H -ATOM 3322 CG2 THR 211 7.199 23.063 7.626 1.00 0.00 C -ATOM 3323 HG21 THR 211 7.333 23.614 6.695 1.00 0.00 H -ATOM 3324 HG22 THR 211 6.393 23.445 8.252 1.00 0.00 H -ATOM 3325 HG23 THR 211 8.166 22.950 8.117 1.00 0.00 H -ATOM 3326 OG1 THR 211 5.564 21.770 6.489 1.00 0.00 O -ATOM 3327 HG1 THR 211 5.327 20.999 5.967 1.00 0.00 H -ATOM 3328 C THR 211 9.375 21.100 6.599 1.00 0.00 C -ATOM 3329 O THR 211 10.137 21.976 6.290 1.00 0.00 O -ATOM 3330 N LEU 212 9.814 20.034 7.330 1.00 0.00 N -ATOM 3331 H LEU 212 9.153 19.334 7.638 1.00 0.00 H -ATOM 3332 CA LEU 212 11.171 19.885 7.883 1.00 0.00 C -ATOM 3333 HA LEU 212 11.547 20.808 8.324 1.00 0.00 H -ATOM 3334 CB LEU 212 11.201 18.828 8.995 1.00 0.00 C -ATOM 3335 HB2 LEU 212 11.000 17.857 8.543 1.00 0.00 H -ATOM 3336 HB3 LEU 212 12.256 18.690 9.234 1.00 0.00 H -ATOM 3337 CG LEU 212 10.280 19.009 10.218 1.00 0.00 C -ATOM 3338 HG LEU 212 9.286 19.296 9.875 1.00 0.00 H -ATOM 3339 CD1 LEU 212 10.157 17.776 11.081 1.00 0.00 C -ATOM 3340 HD11 LEU 212 9.658 16.999 10.501 1.00 0.00 H -ATOM 3341 HD12 LEU 212 11.152 17.502 11.431 1.00 0.00 H -ATOM 3342 HD13 LEU 212 9.482 18.141 11.855 1.00 0.00 H -ATOM 3343 CD2 LEU 212 10.744 20.194 11.108 1.00 0.00 C -ATOM 3344 HD21 LEU 212 10.729 21.114 10.523 1.00 0.00 H -ATOM 3345 HD22 LEU 212 10.116 20.253 11.997 1.00 0.00 H -ATOM 3346 HD23 LEU 212 11.779 19.971 11.370 1.00 0.00 H -ATOM 3347 C LEU 212 12.215 19.580 6.735 1.00 0.00 C -ATOM 3348 O LEU 212 13.191 20.326 6.562 1.00 0.00 O -ATOM 3349 N MET 213 11.947 18.543 5.880 1.00 0.00 N -ATOM 3350 H MET 213 11.089 18.032 6.033 1.00 0.00 H -ATOM 3351 CA MET 213 12.725 18.331 4.679 1.00 0.00 C -ATOM 3352 HA MET 213 13.292 19.168 4.270 1.00 0.00 H -ATOM 3353 CB MET 213 13.807 17.301 4.966 1.00 0.00 C -ATOM 3354 HB2 MET 213 13.327 16.359 5.231 1.00 0.00 H -ATOM 3355 HB3 MET 213 14.269 17.047 4.012 1.00 0.00 H -ATOM 3356 CG MET 213 14.864 17.682 5.989 1.00 0.00 C -ATOM 3357 HG2 MET 213 15.113 18.707 5.712 1.00 0.00 H -ATOM 3358 HG3 MET 213 14.423 17.794 6.979 1.00 0.00 H -ATOM 3359 SD MET 213 16.523 16.735 5.981 1.00 0.00 S -ATOM 3360 CE MET 213 17.047 16.954 4.288 1.00 0.00 C -ATOM 3361 HE1 MET 213 18.014 16.504 4.064 1.00 0.00 H -ATOM 3362 HE2 MET 213 16.341 16.358 3.709 1.00 0.00 H -ATOM 3363 HE3 MET 213 17.039 18.023 4.073 1.00 0.00 H -ATOM 3364 C MET 213 11.837 17.878 3.526 1.00 0.00 C -ATOM 3365 O MET 213 11.190 16.814 3.623 1.00 0.00 O -ATOM 3366 N ASN 214 11.816 18.619 2.436 1.00 0.00 N -ATOM 3367 H ASN 214 12.447 19.408 2.419 1.00 0.00 H -ATOM 3368 CA ASN 214 10.735 18.502 1.378 1.00 0.00 C -ATOM 3369 HA ASN 214 9.766 18.821 1.760 1.00 0.00 H -ATOM 3370 CB ASN 214 11.084 19.366 0.156 1.00 0.00 C -ATOM 3371 HB2 ASN 214 11.053 20.414 0.454 1.00 0.00 H -ATOM 3372 HB3 ASN 214 12.114 19.184 -0.151 1.00 0.00 H -ATOM 3373 CG ASN 214 10.266 19.147 -1.110 1.00 0.00 C -ATOM 3374 OD1 ASN 214 10.761 18.520 -2.000 1.00 0.00 O -ATOM 3375 ND2 ASN 214 9.115 19.680 -1.299 1.00 0.00 N -ATOM 3376 HD21 ASN 214 8.617 19.644 -2.177 1.00 0.00 H -ATOM 3377 HD22 ASN 214 8.666 20.296 -0.636 1.00 0.00 H -ATOM 3378 C ASN 214 10.531 17.096 0.902 1.00 0.00 C -ATOM 3379 O ASN 214 9.445 16.708 0.581 1.00 0.00 O -ATOM 3380 N ALA 215 11.611 16.286 0.858 1.00 0.00 N -ATOM 3381 H ALA 215 12.524 16.683 1.029 1.00 0.00 H -ATOM 3382 CA ALA 215 11.715 14.900 0.388 1.00 0.00 C -ATOM 3383 HA ALA 215 11.362 14.975 -0.640 1.00 0.00 H -ATOM 3384 CB ALA 215 13.123 14.397 0.478 1.00 0.00 C -ATOM 3385 HB1 ALA 215 13.410 14.334 1.528 1.00 0.00 H -ATOM 3386 HB2 ALA 215 13.159 13.391 0.060 1.00 0.00 H -ATOM 3387 HB3 ALA 215 13.688 15.135 -0.091 1.00 0.00 H -ATOM 3388 C ALA 215 10.826 13.954 1.201 1.00 0.00 C -ATOM 3389 O ALA 215 10.398 13.006 0.567 1.00 0.00 O -ATOM 3390 N TYR 216 10.415 14.225 2.413 1.00 0.00 N -ATOM 3391 H TYR 216 10.804 15.012 2.913 1.00 0.00 H -ATOM 3392 CA TYR 216 9.346 13.489 3.072 1.00 0.00 C -ATOM 3393 HA TYR 216 9.708 12.463 3.135 1.00 0.00 H -ATOM 3394 CB TYR 216 9.213 13.993 4.527 1.00 0.00 C -ATOM 3395 HB2 TYR 216 9.444 15.054 4.620 1.00 0.00 H -ATOM 3396 HB3 TYR 216 8.167 14.048 4.828 1.00 0.00 H -ATOM 3397 CG TYR 216 9.950 13.224 5.565 1.00 0.00 C -ATOM 3398 CD1 TYR 216 9.417 12.015 6.038 1.00 0.00 C -ATOM 3399 HD1 TYR 216 8.409 11.743 5.759 1.00 0.00 H -ATOM 3400 CE1 TYR 216 10.204 11.224 6.946 1.00 0.00 C -ATOM 3401 HE1 TYR 216 9.801 10.269 7.248 1.00 0.00 H -ATOM 3402 CZ TYR 216 11.426 11.724 7.479 1.00 0.00 C -ATOM 3403 OH TYR 216 12.213 10.896 8.217 1.00 0.00 O -ATOM 3404 HH TYR 216 13.120 11.209 8.202 1.00 0.00 H -ATOM 3405 CE2 TYR 216 11.932 12.961 7.000 1.00 0.00 C -ATOM 3406 HE2 TYR 216 12.910 13.305 7.303 1.00 0.00 H -ATOM 3407 CD2 TYR 216 11.246 13.699 5.962 1.00 0.00 C -ATOM 3408 HD2 TYR 216 11.746 14.536 5.497 1.00 0.00 H -ATOM 3409 C TYR 216 7.948 13.573 2.366 1.00 0.00 C -ATOM 3410 O TYR 216 7.095 12.722 2.589 1.00 0.00 O -ATOM 3411 N SER 217 7.689 14.594 1.527 1.00 0.00 N -ATOM 3412 H SER 217 8.392 15.310 1.410 1.00 0.00 H -ATOM 3413 CA SER 217 6.473 14.687 0.689 1.00 0.00 C -ATOM 3414 HA SER 217 5.612 14.604 1.352 1.00 0.00 H -ATOM 3415 CB SER 217 6.343 16.063 0.062 1.00 0.00 C -ATOM 3416 HB2 SER 217 5.350 16.135 -0.381 1.00 0.00 H -ATOM 3417 HB3 SER 217 6.358 16.792 0.871 1.00 0.00 H -ATOM 3418 OG SER 217 7.328 16.419 -0.949 1.00 0.00 O -ATOM 3419 HG SER 217 8.182 16.691 -0.605 1.00 0.00 H -ATOM 3420 C SER 217 6.376 13.599 -0.391 1.00 0.00 C -ATOM 3421 O SER 217 5.298 13.358 -1.006 1.00 0.00 O -ATOM 3422 N SER 218 7.522 12.887 -0.642 1.00 0.00 N -ATOM 3423 H SER 218 8.418 13.163 -0.267 1.00 0.00 H -ATOM 3424 CA SER 218 7.611 12.049 -1.883 1.00 0.00 C -ATOM 3425 HA SER 218 6.578 11.773 -2.093 1.00 0.00 H -ATOM 3426 CB SER 218 8.252 12.899 -3.034 1.00 0.00 C -ATOM 3427 HB2 SER 218 8.313 12.345 -3.971 1.00 0.00 H -ATOM 3428 HB3 SER 218 7.644 13.799 -3.127 1.00 0.00 H -ATOM 3429 OG SER 218 9.574 13.378 -2.701 1.00 0.00 O -ATOM 3430 HG SER 218 9.459 14.323 -2.820 1.00 0.00 H -ATOM 3431 C SER 218 8.446 10.764 -1.699 1.00 0.00 C -ATOM 3432 O SER 218 8.094 9.750 -2.333 1.00 0.00 O -ATOM 3433 N ARG 219 9.594 10.763 -0.969 1.00 0.00 N -ATOM 3434 H ARG 219 9.929 11.645 -0.610 1.00 0.00 H -ATOM 3435 CA ARG 219 10.518 9.567 -0.814 1.00 0.00 C -ATOM 3436 HA ARG 219 10.309 8.805 -1.565 1.00 0.00 H -ATOM 3437 CB ARG 219 12.012 10.054 -0.910 1.00 0.00 C -ATOM 3438 HB2 ARG 219 12.345 10.484 0.035 1.00 0.00 H -ATOM 3439 HB3 ARG 219 12.667 9.194 -1.051 1.00 0.00 H -ATOM 3440 CG ARG 219 12.326 11.223 -1.802 1.00 0.00 C -ATOM 3441 HG2 ARG 219 11.698 12.086 -1.579 1.00 0.00 H -ATOM 3442 HG3 ARG 219 13.389 11.436 -1.681 1.00 0.00 H -ATOM 3443 CD ARG 219 11.994 10.780 -3.247 1.00 0.00 C -ATOM 3444 HD2 ARG 219 12.727 10.038 -3.566 1.00 0.00 H -ATOM 3445 HD3 ARG 219 11.110 10.150 -3.146 1.00 0.00 H -ATOM 3446 NE ARG 219 11.895 11.897 -4.177 1.00 0.00 N -ATOM 3447 HE ARG 219 12.344 12.726 -3.814 1.00 0.00 H -ATOM 3448 CZ ARG 219 11.174 11.913 -5.257 1.00 0.00 C -ATOM 3449 NH1 ARG 219 10.426 10.913 -5.603 1.00 0.00 N -ATOM 3450 HH11 ARG 219 10.451 10.080 -5.031 1.00 0.00 H -ATOM 3451 HH12 ARG 219 9.862 11.028 -6.433 1.00 0.00 H -ATOM 3452 NH2 ARG 219 11.106 12.899 -6.103 1.00 0.00 N -ATOM 3453 HH21 ARG 219 11.617 13.769 -6.061 1.00 0.00 H -ATOM 3454 HH22 ARG 219 10.496 12.858 -6.907 1.00 0.00 H -ATOM 3455 C ARG 219 10.313 8.772 0.522 1.00 0.00 C -ATOM 3456 O ARG 219 11.123 7.822 0.701 1.00 0.00 O -ATOM 3457 N SER 220 9.350 9.019 1.349 1.00 0.00 N -ATOM 3458 H SER 220 8.773 9.821 1.143 1.00 0.00 H -ATOM 3459 CA SER 220 8.928 8.195 2.540 1.00 0.00 C -ATOM 3460 HA SER 220 9.728 7.572 2.939 1.00 0.00 H -ATOM 3461 CB SER 220 8.712 9.112 3.769 1.00 0.00 C -ATOM 3462 HB2 SER 220 8.542 8.554 4.690 1.00 0.00 H -ATOM 3463 HB3 SER 220 9.573 9.779 3.805 1.00 0.00 H -ATOM 3464 OG SER 220 7.553 9.865 3.522 1.00 0.00 O -ATOM 3465 HG SER 220 6.732 9.513 3.875 1.00 0.00 H -ATOM 3466 C SER 220 7.772 7.285 2.242 1.00 0.00 C -ATOM 3467 O SER 220 6.862 7.674 1.476 1.00 0.00 O -ATOM 3468 N HIE 221 7.806 6.086 2.780 1.00 0.00 N -ATOM 3469 H HIE 221 8.522 5.883 3.463 1.00 0.00 H -ATOM 3470 CA HIE 221 6.794 4.961 2.581 1.00 0.00 C -ATOM 3471 HA HIE 221 6.202 5.057 1.671 1.00 0.00 H -ATOM 3472 CB HIE 221 7.592 3.672 2.418 1.00 0.00 C -ATOM 3473 HB2 HIE 221 8.042 3.484 3.393 1.00 0.00 H -ATOM 3474 HB3 HIE 221 6.820 2.932 2.212 1.00 0.00 H -ATOM 3475 CG HIE 221 8.694 3.630 1.346 1.00 0.00 C -ATOM 3476 ND1 HIE 221 8.552 3.152 0.065 1.00 0.00 N -ATOM 3477 CE1 HIE 221 9.784 3.084 -0.469 1.00 0.00 C -ATOM 3478 HE1 HIE 221 10.040 2.767 -1.469 1.00 0.00 H -ATOM 3479 NE2 HIE 221 10.619 3.642 0.380 1.00 0.00 N -ATOM 3480 HE2 HIE 221 11.602 3.614 0.150 1.00 0.00 H -ATOM 3481 CD2 HIE 221 9.971 4.010 1.549 1.00 0.00 C -ATOM 3482 HD2 HIE 221 10.385 4.145 2.537 1.00 0.00 H -ATOM 3483 C HIE 221 5.879 4.876 3.811 1.00 0.00 C -ATOM 3484 O HIE 221 6.373 4.736 4.974 1.00 0.00 O -ATOM 3485 N SER 222 4.532 4.931 3.629 1.00 0.00 N -ATOM 3486 H SER 222 4.236 4.796 2.672 1.00 0.00 H -ATOM 3487 CA SER 222 3.538 4.612 4.747 1.00 0.00 C -ATOM 3488 HA SER 222 4.066 4.845 5.671 1.00 0.00 H -ATOM 3489 CB SER 222 2.263 5.443 4.503 1.00 0.00 C -ATOM 3490 HB2 SER 222 1.736 4.952 3.685 1.00 0.00 H -ATOM 3491 HB3 SER 222 1.658 5.219 5.381 1.00 0.00 H -ATOM 3492 OG SER 222 2.544 6.837 4.248 1.00 0.00 O -ATOM 3493 HG SER 222 3.210 7.141 4.869 1.00 0.00 H -ATOM 3494 C SER 222 3.031 3.157 4.795 1.00 0.00 C -ATOM 3495 O SER 222 2.785 2.586 3.756 1.00 0.00 O -ATOM 3496 N VAL 223 2.887 2.602 6.033 1.00 0.00 N -ATOM 3497 H VAL 223 3.301 3.105 6.805 1.00 0.00 H -ATOM 3498 CA VAL 223 2.318 1.278 6.331 1.00 0.00 C -ATOM 3499 HA VAL 223 1.804 0.876 5.458 1.00 0.00 H -ATOM 3500 CB VAL 223 3.376 0.276 6.840 1.00 0.00 C -ATOM 3501 HB VAL 223 3.771 0.672 7.775 1.00 0.00 H -ATOM 3502 CG1 VAL 223 2.712 -1.066 7.091 1.00 0.00 C -ATOM 3503 HG11 VAL 223 2.069 -1.386 6.270 1.00 0.00 H -ATOM 3504 HG12 VAL 223 3.501 -1.806 7.228 1.00 0.00 H -ATOM 3505 HG13 VAL 223 2.054 -1.115 7.959 1.00 0.00 H -ATOM 3506 CG2 VAL 223 4.602 0.078 6.002 1.00 0.00 C -ATOM 3507 HG21 VAL 223 4.348 -0.340 5.028 1.00 0.00 H -ATOM 3508 HG22 VAL 223 5.016 1.085 5.946 1.00 0.00 H -ATOM 3509 HG23 VAL 223 5.375 -0.533 6.469 1.00 0.00 H -ATOM 3510 C VAL 223 1.259 1.380 7.433 1.00 0.00 C -ATOM 3511 O VAL 223 1.598 1.873 8.473 1.00 0.00 O -ATOM 3512 N PHE 224 0.047 0.809 7.193 1.00 0.00 N -ATOM 3513 H PHE 224 -0.118 0.414 6.278 1.00 0.00 H -ATOM 3514 CA PHE 224 -0.955 0.519 8.156 1.00 0.00 C -ATOM 3515 HA PHE 224 -0.710 0.976 9.114 1.00 0.00 H -ATOM 3516 CB PHE 224 -2.265 1.164 7.708 1.00 0.00 C -ATOM 3517 HB2 PHE 224 -2.144 2.247 7.719 1.00 0.00 H -ATOM 3518 HB3 PHE 224 -2.446 0.896 6.667 1.00 0.00 H -ATOM 3519 CG PHE 224 -3.437 0.806 8.530 1.00 0.00 C -ATOM 3520 CD1 PHE 224 -4.298 -0.214 8.131 1.00 0.00 C -ATOM 3521 HD1 PHE 224 -4.047 -0.930 7.363 1.00 0.00 H -ATOM 3522 CE1 PHE 224 -5.491 -0.477 8.779 1.00 0.00 C -ATOM 3523 HE1 PHE 224 -6.154 -1.289 8.520 1.00 0.00 H -ATOM 3524 CZ PHE 224 -5.907 0.458 9.744 1.00 0.00 C -ATOM 3525 HZ PHE 224 -6.897 0.284 10.139 1.00 0.00 H -ATOM 3526 CE2 PHE 224 -5.087 1.496 10.147 1.00 0.00 C -ATOM 3527 HE2 PHE 224 -5.452 2.251 10.827 1.00 0.00 H -ATOM 3528 CD2 PHE 224 -3.828 1.688 9.566 1.00 0.00 C -ATOM 3529 HD2 PHE 224 -3.237 2.566 9.779 1.00 0.00 H -ATOM 3530 C PHE 224 -0.982 -1.014 8.344 1.00 0.00 C -ATOM 3531 O PHE 224 -0.728 -1.735 7.406 1.00 0.00 O -ATOM 3532 N SER 225 -1.374 -1.486 9.556 1.00 0.00 N -ATOM 3533 H SER 225 -1.410 -0.835 10.328 1.00 0.00 H -ATOM 3534 CA SER 225 -1.533 -2.885 9.801 1.00 0.00 C -ATOM 3535 HA SER 225 -1.953 -3.304 8.886 1.00 0.00 H -ATOM 3536 CB SER 225 -0.266 -3.573 10.266 1.00 0.00 C -ATOM 3537 HB2 SER 225 0.567 -3.456 9.573 1.00 0.00 H -ATOM 3538 HB3 SER 225 -0.026 -3.304 11.294 1.00 0.00 H -ATOM 3539 OG SER 225 -0.556 -4.943 10.263 1.00 0.00 O -ATOM 3540 HG SER 225 -0.386 -5.236 9.365 1.00 0.00 H -ATOM 3541 C SER 225 -2.667 -3.086 10.851 1.00 0.00 C -ATOM 3542 O SER 225 -2.676 -2.493 11.936 1.00 0.00 O -ATOM 3543 N VAL 226 -3.658 -3.934 10.465 1.00 0.00 N -ATOM 3544 H VAL 226 -3.672 -4.425 9.582 1.00 0.00 H -ATOM 3545 CA VAL 226 -4.795 -4.361 11.363 1.00 0.00 C -ATOM 3546 HA VAL 226 -4.742 -3.828 12.312 1.00 0.00 H -ATOM 3547 CB VAL 226 -6.106 -3.713 10.810 1.00 0.00 C -ATOM 3548 HB VAL 226 -5.906 -2.642 10.774 1.00 0.00 H -ATOM 3549 CG1 VAL 226 -6.599 -4.229 9.473 1.00 0.00 C -ATOM 3550 HG11 VAL 226 -6.810 -5.295 9.560 1.00 0.00 H -ATOM 3551 HG12 VAL 226 -7.454 -3.644 9.136 1.00 0.00 H -ATOM 3552 HG13 VAL 226 -5.795 -4.141 8.742 1.00 0.00 H -ATOM 3553 CG2 VAL 226 -7.259 -3.838 11.820 1.00 0.00 C -ATOM 3554 HG21 VAL 226 -6.893 -3.532 12.800 1.00 0.00 H -ATOM 3555 HG22 VAL 226 -8.062 -3.139 11.588 1.00 0.00 H -ATOM 3556 HG23 VAL 226 -7.566 -4.882 11.765 1.00 0.00 H -ATOM 3557 C VAL 226 -4.907 -5.869 11.480 1.00 0.00 C -ATOM 3558 O VAL 226 -4.863 -6.643 10.510 1.00 0.00 O -ATOM 3559 N THR 227 -4.880 -6.336 12.750 1.00 0.00 N -ATOM 3560 H THR 227 -4.936 -5.724 13.551 1.00 0.00 H -ATOM 3561 CA THR 227 -4.922 -7.729 13.103 1.00 0.00 C -ATOM 3562 HA THR 227 -4.927 -8.441 12.277 1.00 0.00 H -ATOM 3563 CB THR 227 -3.718 -8.009 14.101 1.00 0.00 C -ATOM 3564 HB THR 227 -3.727 -7.445 15.034 1.00 0.00 H -ATOM 3565 CG2 THR 227 -3.663 -9.464 14.301 1.00 0.00 C -ATOM 3566 HG21 THR 227 -2.828 -9.806 14.913 1.00 0.00 H -ATOM 3567 HG22 THR 227 -4.518 -9.701 14.933 1.00 0.00 H -ATOM 3568 HG23 THR 227 -3.855 -9.984 13.363 1.00 0.00 H -ATOM 3569 OG1 THR 227 -2.551 -7.643 13.353 1.00 0.00 O -ATOM 3570 HG1 THR 227 -2.621 -6.690 13.264 1.00 0.00 H -ATOM 3571 C THR 227 -6.260 -8.030 13.865 1.00 0.00 C -ATOM 3572 O THR 227 -6.577 -7.297 14.772 1.00 0.00 O -ATOM 3573 N ILE 228 -6.904 -9.162 13.514 1.00 0.00 N -ATOM 3574 H ILE 228 -6.533 -9.702 12.746 1.00 0.00 H -ATOM 3575 CA ILE 228 -8.327 -9.446 13.905 1.00 0.00 C -ATOM 3576 HA ILE 228 -8.580 -8.725 14.682 1.00 0.00 H -ATOM 3577 CB ILE 228 -9.290 -9.309 12.653 1.00 0.00 C -ATOM 3578 HB ILE 228 -9.021 -10.109 11.964 1.00 0.00 H -ATOM 3579 CG2 ILE 228 -10.810 -9.590 13.100 1.00 0.00 C -ATOM 3580 HG21 ILE 228 -11.183 -8.772 13.716 1.00 0.00 H -ATOM 3581 HG22 ILE 228 -11.474 -9.755 12.252 1.00 0.00 H -ATOM 3582 HG23 ILE 228 -10.774 -10.576 13.565 1.00 0.00 H -ATOM 3583 CG1 ILE 228 -9.100 -7.896 11.964 1.00 0.00 C -ATOM 3584 HG12 ILE 228 -10.091 -7.653 11.580 1.00 0.00 H -ATOM 3585 HG13 ILE 228 -8.817 -7.092 12.643 1.00 0.00 H -ATOM 3586 CD1 ILE 228 -8.125 -7.974 10.802 1.00 0.00 C -ATOM 3587 HD11 ILE 228 -8.492 -8.657 10.036 1.00 0.00 H -ATOM 3588 HD12 ILE 228 -8.168 -6.967 10.386 1.00 0.00 H -ATOM 3589 HD13 ILE 228 -7.177 -8.304 11.227 1.00 0.00 H -ATOM 3590 C ILE 228 -8.349 -10.793 14.640 1.00 0.00 C -ATOM 3591 O ILE 228 -8.513 -11.843 14.001 1.00 0.00 O -ATOM 3592 N HIE 229 -8.272 -10.826 15.929 1.00 0.00 N -ATOM 3593 H HIE 229 -8.265 -9.955 16.441 1.00 0.00 H -ATOM 3594 CA HIE 229 -8.545 -12.048 16.688 1.00 0.00 C -ATOM 3595 HA HIE 229 -7.887 -12.810 16.273 1.00 0.00 H -ATOM 3596 CB HIE 229 -7.853 -11.874 18.106 1.00 0.00 C -ATOM 3597 HB2 HIE 229 -8.201 -10.966 18.598 1.00 0.00 H -ATOM 3598 HB3 HIE 229 -7.934 -12.708 18.802 1.00 0.00 H -ATOM 3599 CG HIE 229 -6.351 -11.607 18.066 1.00 0.00 C -ATOM 3600 ND1 HIE 229 -5.699 -10.454 17.508 1.00 0.00 N -ATOM 3601 CE1 HIE 229 -4.423 -10.529 17.872 1.00 0.00 C -ATOM 3602 HE1 HIE 229 -3.702 -9.765 17.623 1.00 0.00 H -ATOM 3603 NE2 HIE 229 -4.226 -11.625 18.600 1.00 0.00 N -ATOM 3604 HE2 HIE 229 -3.402 -11.808 19.155 1.00 0.00 H -ATOM 3605 CD2 HIE 229 -5.375 -12.293 18.729 1.00 0.00 C -ATOM 3606 HD2 HIE 229 -5.553 -13.172 19.330 1.00 0.00 H -ATOM 3607 C HIE 229 -10.039 -12.490 16.717 1.00 0.00 C -ATOM 3608 O HIE 229 -10.935 -11.674 16.677 1.00 0.00 O -ATOM 3609 N MET 230 -10.259 -13.796 16.665 1.00 0.00 N -ATOM 3610 H MET 230 -9.481 -14.425 16.801 1.00 0.00 H -ATOM 3611 CA MET 230 -11.609 -14.408 16.461 1.00 0.00 C -ATOM 3612 HA MET 230 -12.375 -13.759 16.886 1.00 0.00 H -ATOM 3613 CB MET 230 -11.852 -14.726 14.936 1.00 0.00 C -ATOM 3614 HB2 MET 230 -11.013 -15.248 14.475 1.00 0.00 H -ATOM 3615 HB3 MET 230 -12.762 -15.312 14.807 1.00 0.00 H -ATOM 3616 CG MET 230 -12.084 -13.425 14.159 1.00 0.00 C -ATOM 3617 HG2 MET 230 -12.968 -12.936 14.567 1.00 0.00 H -ATOM 3618 HG3 MET 230 -11.225 -12.772 14.317 1.00 0.00 H -ATOM 3619 SD MET 230 -12.414 -13.712 12.433 1.00 0.00 S -ATOM 3620 CE MET 230 -10.685 -13.621 11.853 1.00 0.00 C -ATOM 3621 HE1 MET 230 -9.998 -14.233 12.437 1.00 0.00 H -ATOM 3622 HE2 MET 230 -10.656 -13.711 10.767 1.00 0.00 H -ATOM 3623 HE3 MET 230 -10.349 -12.595 12.001 1.00 0.00 H -ATOM 3624 C MET 230 -11.606 -15.699 17.304 1.00 0.00 C -ATOM 3625 O MET 230 -10.614 -16.418 17.262 1.00 0.00 O -ATOM 3626 N LYS 231 -12.732 -16.068 17.959 1.00 0.00 N -ATOM 3627 H LYS 231 -13.537 -15.555 17.630 1.00 0.00 H -ATOM 3628 CA LYS 231 -12.841 -17.251 18.746 1.00 0.00 C -ATOM 3629 HA LYS 231 -11.856 -17.425 19.179 1.00 0.00 H -ATOM 3630 CB LYS 231 -13.846 -17.028 19.885 1.00 0.00 C -ATOM 3631 HB2 LYS 231 -13.789 -16.006 20.260 1.00 0.00 H -ATOM 3632 HB3 LYS 231 -14.885 -17.158 19.583 1.00 0.00 H -ATOM 3633 CG LYS 231 -13.606 -17.979 21.056 1.00 0.00 C -ATOM 3634 HG2 LYS 231 -13.539 -19.006 20.699 1.00 0.00 H -ATOM 3635 HG3 LYS 231 -12.680 -17.595 21.483 1.00 0.00 H -ATOM 3636 CD LYS 231 -14.640 -17.921 22.204 1.00 0.00 C -ATOM 3637 HD2 LYS 231 -14.433 -16.940 22.631 1.00 0.00 H -ATOM 3638 HD3 LYS 231 -15.699 -18.045 21.977 1.00 0.00 H -ATOM 3639 CE LYS 231 -14.167 -18.977 23.192 1.00 0.00 C -ATOM 3640 HE2 LYS 231 -14.211 -19.973 22.752 1.00 0.00 H -ATOM 3641 HE3 LYS 231 -13.110 -18.792 23.384 1.00 0.00 H -ATOM 3642 NZ LYS 231 -14.962 -18.998 24.375 1.00 0.00 N -ATOM 3643 HZ1 LYS 231 -15.809 -19.534 24.250 1.00 0.00 H -ATOM 3644 HZ2 LYS 231 -14.352 -19.319 25.114 1.00 0.00 H -ATOM 3645 HZ3 LYS 231 -15.217 -18.055 24.634 1.00 0.00 H -ATOM 3646 C LYS 231 -13.188 -18.481 17.929 1.00 0.00 C -ATOM 3647 O LYS 231 -14.110 -18.412 17.183 1.00 0.00 O -ATOM 3648 N GLU 232 -12.376 -19.549 18.115 1.00 0.00 N -ATOM 3649 H GLU 232 -11.770 -19.605 18.921 1.00 0.00 H -ATOM 3650 CA GLU 232 -12.656 -20.837 17.443 1.00 0.00 C -ATOM 3651 HA GLU 232 -13.273 -20.539 16.595 1.00 0.00 H -ATOM 3652 CB GLU 232 -11.322 -21.383 16.840 1.00 0.00 C -ATOM 3653 HB2 GLU 232 -10.732 -20.578 16.403 1.00 0.00 H -ATOM 3654 HB3 GLU 232 -10.640 -21.726 17.618 1.00 0.00 H -ATOM 3655 CG GLU 232 -11.446 -22.595 15.906 1.00 0.00 C -ATOM 3656 HG2 GLU 232 -10.502 -22.827 15.414 1.00 0.00 H -ATOM 3657 HG3 GLU 232 -11.744 -23.452 16.510 1.00 0.00 H -ATOM 3658 CD GLU 232 -12.561 -22.380 14.857 1.00 0.00 C -ATOM 3659 OE1 GLU 232 -13.525 -23.186 14.838 1.00 0.00 O -ATOM 3660 OE2 GLU 232 -12.413 -21.432 14.067 1.00 0.00 O -ATOM 3661 C GLU 232 -13.469 -21.782 18.356 1.00 0.00 C -ATOM 3662 O GLU 232 -12.941 -22.309 19.317 1.00 0.00 O -ATOM 3663 N THR 233 -14.741 -21.926 18.144 1.00 0.00 N -ATOM 3664 H THR 233 -15.191 -21.660 17.280 1.00 0.00 H -ATOM 3665 CA THR 233 -15.697 -22.465 19.183 1.00 0.00 C -ATOM 3666 HA THR 233 -15.457 -22.085 20.176 1.00 0.00 H -ATOM 3667 CB THR 233 -17.153 -22.131 18.772 1.00 0.00 C -ATOM 3668 HB THR 233 -17.219 -22.259 17.692 1.00 0.00 H -ATOM 3669 CG2 THR 233 -18.361 -22.755 19.516 1.00 0.00 C -ATOM 3670 HG21 THR 233 -19.296 -22.251 19.270 1.00 0.00 H -ATOM 3671 HG22 THR 233 -18.400 -23.750 19.072 1.00 0.00 H -ATOM 3672 HG23 THR 233 -18.215 -22.978 20.573 1.00 0.00 H -ATOM 3673 OG1 THR 233 -17.430 -20.741 19.049 1.00 0.00 O -ATOM 3674 HG1 THR 233 -17.241 -20.183 18.291 1.00 0.00 H -ATOM 3675 C THR 233 -15.639 -23.990 19.279 1.00 0.00 C -ATOM 3676 O THR 233 -15.530 -24.670 18.216 1.00 0.00 O -ATOM 3677 N THR 234 -15.790 -24.596 20.488 1.00 0.00 N -ATOM 3678 H THR 234 -16.012 -23.996 21.270 1.00 0.00 H -ATOM 3679 CA THR 234 -16.143 -26.045 20.773 1.00 0.00 C -ATOM 3680 HA THR 234 -16.872 -26.390 20.040 1.00 0.00 H -ATOM 3681 CB THR 234 -14.883 -26.828 20.558 1.00 0.00 C -ATOM 3682 HB THR 234 -14.741 -26.857 19.478 1.00 0.00 H -ATOM 3683 CG2 THR 234 -13.581 -26.404 21.267 1.00 0.00 C -ATOM 3684 HG21 THR 234 -12.956 -27.273 21.474 1.00 0.00 H -ATOM 3685 HG22 THR 234 -12.974 -25.737 20.654 1.00 0.00 H -ATOM 3686 HG23 THR 234 -13.801 -25.907 22.211 1.00 0.00 H -ATOM 3687 OG1 THR 234 -15.150 -28.160 20.875 1.00 0.00 O -ATOM 3688 HG1 THR 234 -15.685 -28.502 20.155 1.00 0.00 H -ATOM 3689 C THR 234 -16.772 -26.232 22.188 1.00 0.00 C -ATOM 3690 O THR 234 -16.444 -25.531 23.142 1.00 0.00 O -ATOM 3691 N ILE 235 -17.684 -27.155 22.308 1.00 0.00 N -ATOM 3692 H ILE 235 -17.950 -27.560 21.423 1.00 0.00 H -ATOM 3693 CA ILE 235 -18.237 -27.674 23.591 1.00 0.00 C -ATOM 3694 HA ILE 235 -18.680 -26.789 24.048 1.00 0.00 H -ATOM 3695 CB ILE 235 -19.406 -28.586 23.196 1.00 0.00 C -ATOM 3696 HB ILE 235 -19.899 -28.025 22.401 1.00 0.00 H -ATOM 3697 CG2 ILE 235 -18.965 -29.840 22.468 1.00 0.00 C -ATOM 3698 HG21 ILE 235 -18.104 -29.733 21.808 1.00 0.00 H -ATOM 3699 HG22 ILE 235 -18.522 -30.564 23.151 1.00 0.00 H -ATOM 3700 HG23 ILE 235 -19.824 -30.214 21.910 1.00 0.00 H -ATOM 3701 CG1 ILE 235 -20.501 -28.896 24.258 1.00 0.00 C -ATOM 3702 HG12 ILE 235 -20.089 -29.586 24.994 1.00 0.00 H -ATOM 3703 HG13 ILE 235 -20.788 -27.999 24.806 1.00 0.00 H -ATOM 3704 CD1 ILE 235 -21.836 -29.299 23.743 1.00 0.00 C -ATOM 3705 HD11 ILE 235 -22.655 -28.955 24.375 1.00 0.00 H -ATOM 3706 HD12 ILE 235 -22.041 -28.788 22.803 1.00 0.00 H -ATOM 3707 HD13 ILE 235 -21.919 -30.382 23.837 1.00 0.00 H -ATOM 3708 C ILE 235 -17.223 -28.192 24.581 1.00 0.00 C -ATOM 3709 O ILE 235 -17.534 -28.584 25.666 1.00 0.00 O -ATOM 3710 N ASP 236 -16.018 -28.525 24.078 1.00 0.00 N -ATOM 3711 H ASP 236 -15.966 -28.495 23.070 1.00 0.00 H -ATOM 3712 CA ASP 236 -14.829 -28.929 24.883 1.00 0.00 C -ATOM 3713 HA ASP 236 -15.033 -29.656 25.670 1.00 0.00 H -ATOM 3714 CB ASP 236 -13.761 -29.517 23.953 1.00 0.00 C -ATOM 3715 HB2 ASP 236 -13.638 -28.882 23.076 1.00 0.00 H -ATOM 3716 HB3 ASP 236 -12.757 -29.575 24.374 1.00 0.00 H -ATOM 3717 CG ASP 236 -14.030 -30.889 23.433 1.00 0.00 C -ATOM 3718 OD1 ASP 236 -15.088 -31.477 23.748 1.00 0.00 O -ATOM 3719 OD2 ASP 236 -13.274 -31.249 22.511 1.00 0.00 O -ATOM 3720 C ASP 236 -14.273 -27.753 25.569 1.00 0.00 C -ATOM 3721 O ASP 236 -13.522 -27.928 26.547 1.00 0.00 O -ATOM 3722 N GLY 237 -14.651 -26.559 25.177 1.00 0.00 N -ATOM 3723 H GLY 237 -15.333 -26.502 24.434 1.00 0.00 H -ATOM 3724 CA GLY 237 -14.251 -25.283 25.772 1.00 0.00 C -ATOM 3725 HA2 GLY 237 -14.596 -24.480 25.121 1.00 0.00 H -ATOM 3726 HA3 GLY 237 -14.775 -25.154 26.719 1.00 0.00 H -ATOM 3727 C GLY 237 -12.738 -25.168 25.996 1.00 0.00 C -ATOM 3728 O GLY 237 -12.283 -24.809 27.112 1.00 0.00 O -ATOM 3729 N GLU 238 -11.930 -25.504 24.990 1.00 0.00 N -ATOM 3730 H GLU 238 -12.326 -25.713 24.085 1.00 0.00 H -ATOM 3731 CA GLU 238 -10.438 -25.274 25.000 1.00 0.00 C -ATOM 3732 HA GLU 238 -9.935 -25.841 25.784 1.00 0.00 H -ATOM 3733 CB GLU 238 -9.971 -25.793 23.575 1.00 0.00 C -ATOM 3734 HB2 GLU 238 -10.624 -25.197 22.937 1.00 0.00 H -ATOM 3735 HB3 GLU 238 -8.937 -25.458 23.487 1.00 0.00 H -ATOM 3736 CG GLU 238 -10.173 -27.289 23.367 1.00 0.00 C -ATOM 3737 HG2 GLU 238 -11.120 -27.660 23.759 1.00 0.00 H -ATOM 3738 HG3 GLU 238 -10.119 -27.321 22.279 1.00 0.00 H -ATOM 3739 CD GLU 238 -9.047 -28.138 23.901 1.00 0.00 C -ATOM 3740 OE1 GLU 238 -9.048 -28.294 25.103 1.00 0.00 O -ATOM 3741 OE2 GLU 238 -8.216 -28.751 23.141 1.00 0.00 O -ATOM 3742 C GLU 238 -9.990 -23.787 25.156 1.00 0.00 C -ATOM 3743 O GLU 238 -8.781 -23.607 25.338 1.00 0.00 O -ATOM 3744 N GLU 239 -10.912 -22.824 25.024 1.00 0.00 N -ATOM 3745 H GLU 239 -11.849 -23.095 24.761 1.00 0.00 H -ATOM 3746 CA GLU 239 -10.643 -21.370 24.860 1.00 0.00 C -ATOM 3747 HA GLU 239 -11.574 -20.842 24.654 1.00 0.00 H -ATOM 3748 CB GLU 239 -10.223 -20.688 26.218 1.00 0.00 C -ATOM 3749 HB2 GLU 239 -9.286 -21.083 26.609 1.00 0.00 H -ATOM 3750 HB3 GLU 239 -10.144 -19.619 26.019 1.00 0.00 H -ATOM 3751 CG GLU 239 -11.444 -20.871 27.170 1.00 0.00 C -ATOM 3752 HG2 GLU 239 -11.626 -21.890 27.511 1.00 0.00 H -ATOM 3753 HG3 GLU 239 -11.169 -20.320 28.070 1.00 0.00 H -ATOM 3754 CD GLU 239 -12.738 -20.184 26.666 1.00 0.00 C -ATOM 3755 OE1 GLU 239 -12.649 -19.032 26.083 1.00 0.00 O -ATOM 3756 OE2 GLU 239 -13.837 -20.718 26.851 1.00 0.00 O -ATOM 3757 C GLU 239 -9.767 -21.069 23.645 1.00 0.00 C -ATOM 3758 O GLU 239 -8.865 -20.265 23.730 1.00 0.00 O -ATOM 3759 N LEU 240 -9.981 -21.806 22.463 1.00 0.00 N -ATOM 3760 H LEU 240 -10.896 -22.180 22.253 1.00 0.00 H -ATOM 3761 CA LEU 240 -9.099 -21.621 21.259 1.00 0.00 C -ATOM 3762 HA LEU 240 -8.032 -21.595 21.483 1.00 0.00 H -ATOM 3763 CB LEU 240 -9.457 -22.699 20.201 1.00 0.00 C -ATOM 3764 HB2 LEU 240 -10.545 -22.735 20.239 1.00 0.00 H -ATOM 3765 HB3 LEU 240 -9.134 -22.577 19.167 1.00 0.00 H -ATOM 3766 CG LEU 240 -8.732 -24.037 20.671 1.00 0.00 C -ATOM 3767 HG LEU 240 -8.653 -24.083 21.757 1.00 0.00 H -ATOM 3768 CD1 LEU 240 -9.557 -25.205 20.149 1.00 0.00 C -ATOM 3769 HD11 LEU 240 -9.129 -26.146 20.497 1.00 0.00 H -ATOM 3770 HD12 LEU 240 -10.573 -25.155 20.543 1.00 0.00 H -ATOM 3771 HD13 LEU 240 -9.582 -25.194 19.060 1.00 0.00 H -ATOM 3772 CD2 LEU 240 -7.312 -24.173 20.074 1.00 0.00 C -ATOM 3773 HD21 LEU 240 -6.848 -24.948 20.683 1.00 0.00 H -ATOM 3774 HD22 LEU 240 -7.456 -24.493 19.042 1.00 0.00 H -ATOM 3775 HD23 LEU 240 -6.704 -23.275 20.183 1.00 0.00 H -ATOM 3776 C LEU 240 -9.421 -20.305 20.584 1.00 0.00 C -ATOM 3777 O LEU 240 -10.543 -19.839 20.587 1.00 0.00 O -ATOM 3778 N VAL 241 -8.404 -19.787 19.877 1.00 0.00 N -ATOM 3779 H VAL 241 -7.579 -20.360 19.767 1.00 0.00 H -ATOM 3780 CA VAL 241 -8.466 -18.558 19.141 1.00 0.00 C -ATOM 3781 HA VAL 241 -9.510 -18.434 18.852 1.00 0.00 H -ATOM 3782 CB VAL 241 -7.953 -17.374 19.956 1.00 0.00 C -ATOM 3783 HB VAL 241 -6.912 -17.645 20.132 1.00 0.00 H -ATOM 3784 CG1 VAL 241 -8.006 -15.995 19.319 1.00 0.00 C -ATOM 3785 HG11 VAL 241 -9.002 -15.568 19.197 1.00 0.00 H -ATOM 3786 HG12 VAL 241 -7.592 -15.233 19.979 1.00 0.00 H -ATOM 3787 HG13 VAL 241 -7.416 -15.882 18.409 1.00 0.00 H -ATOM 3788 CG2 VAL 241 -8.508 -17.185 21.414 1.00 0.00 C -ATOM 3789 HG21 VAL 241 -8.607 -18.177 21.855 1.00 0.00 H -ATOM 3790 HG22 VAL 241 -7.849 -16.508 21.957 1.00 0.00 H -ATOM 3791 HG23 VAL 241 -9.480 -16.696 21.476 1.00 0.00 H -ATOM 3792 C VAL 241 -7.742 -18.685 17.794 1.00 0.00 C -ATOM 3793 O VAL 241 -6.813 -19.505 17.620 1.00 0.00 O -ATOM 3794 N LYS 242 -8.267 -17.933 16.750 1.00 0.00 N -ATOM 3795 H LYS 242 -8.911 -17.186 16.964 1.00 0.00 H -ATOM 3796 CA LYS 242 -7.571 -17.860 15.435 1.00 0.00 C -ATOM 3797 HA LYS 242 -6.529 -18.076 15.672 1.00 0.00 H -ATOM 3798 CB LYS 242 -8.182 -18.819 14.428 1.00 0.00 C -ATOM 3799 HB2 LYS 242 -7.411 -19.169 13.741 1.00 0.00 H -ATOM 3800 HB3 LYS 242 -8.642 -19.626 14.999 1.00 0.00 H -ATOM 3801 CG LYS 242 -9.265 -18.186 13.522 1.00 0.00 C -ATOM 3802 HG2 LYS 242 -9.849 -17.528 14.165 1.00 0.00 H -ATOM 3803 HG3 LYS 242 -8.800 -17.678 12.677 1.00 0.00 H -ATOM 3804 CD LYS 242 -10.301 -19.092 12.867 1.00 0.00 C -ATOM 3805 HD2 LYS 242 -10.951 -19.302 13.717 1.00 0.00 H -ATOM 3806 HD3 LYS 242 -10.864 -18.527 12.124 1.00 0.00 H -ATOM 3807 CE LYS 242 -9.565 -20.354 12.284 1.00 0.00 C -ATOM 3808 HE2 LYS 242 -8.936 -19.974 11.479 1.00 0.00 H -ATOM 3809 HE3 LYS 242 -8.933 -20.780 13.063 1.00 0.00 H -ATOM 3810 NZ LYS 242 -10.572 -21.350 11.735 1.00 0.00 N -ATOM 3811 HZ1 LYS 242 -10.114 -22.221 11.510 1.00 0.00 H -ATOM 3812 HZ2 LYS 242 -11.227 -21.506 12.489 1.00 0.00 H -ATOM 3813 HZ3 LYS 242 -11.005 -20.995 10.894 1.00 0.00 H -ATOM 3814 C LYS 242 -7.403 -16.361 15.002 1.00 0.00 C -ATOM 3815 O LYS 242 -7.956 -15.516 15.714 1.00 0.00 O -ATOM 3816 N ILE 243 -6.490 -16.124 14.075 1.00 0.00 N -ATOM 3817 H ILE 243 -5.941 -16.866 13.665 1.00 0.00 H -ATOM 3818 CA ILE 243 -6.126 -14.744 13.677 1.00 0.00 C -ATOM 3819 HA ILE 243 -6.764 -13.945 14.055 1.00 0.00 H -ATOM 3820 CB ILE 243 -4.765 -14.421 14.236 1.00 0.00 C -ATOM 3821 HB ILE 243 -4.126 -15.304 14.234 1.00 0.00 H -ATOM 3822 CG2 ILE 243 -4.015 -13.373 13.367 1.00 0.00 C -ATOM 3823 HG21 ILE 243 -3.846 -13.729 12.351 1.00 0.00 H -ATOM 3824 HG22 ILE 243 -4.605 -12.458 13.416 1.00 0.00 H -ATOM 3825 HG23 ILE 243 -3.038 -13.093 13.762 1.00 0.00 H -ATOM 3826 CG1 ILE 243 -4.852 -14.046 15.739 1.00 0.00 C -ATOM 3827 HG12 ILE 243 -5.542 -13.214 15.881 1.00 0.00 H -ATOM 3828 HG13 ILE 243 -5.392 -14.939 16.052 1.00 0.00 H -ATOM 3829 CD1 ILE 243 -3.426 -13.926 16.360 1.00 0.00 C -ATOM 3830 HD11 ILE 243 -2.796 -14.671 15.875 1.00 0.00 H -ATOM 3831 HD12 ILE 243 -3.055 -12.935 16.098 1.00 0.00 H -ATOM 3832 HD13 ILE 243 -3.429 -14.019 17.446 1.00 0.00 H -ATOM 3833 C ILE 243 -6.298 -14.504 12.128 1.00 0.00 C -ATOM 3834 O ILE 243 -6.205 -15.412 11.285 1.00 0.00 O -ATOM 3835 N GLY 244 -6.743 -13.270 11.734 1.00 0.00 N -ATOM 3836 H GLY 244 -6.951 -12.608 12.468 1.00 0.00 H -ATOM 3837 CA GLY 244 -6.356 -12.725 10.394 1.00 0.00 C -ATOM 3838 HA2 GLY 244 -5.549 -13.343 10.002 1.00 0.00 H -ATOM 3839 HA3 GLY 244 -7.198 -12.652 9.706 1.00 0.00 H -ATOM 3840 C GLY 244 -5.720 -11.312 10.446 1.00 0.00 C -ATOM 3841 O GLY 244 -5.705 -10.723 11.529 1.00 0.00 O -ATOM 3842 N LYS 245 -5.184 -10.827 9.334 1.00 0.00 N -ATOM 3843 H LYS 245 -5.175 -11.459 8.546 1.00 0.00 H -ATOM 3844 CA LYS 245 -4.379 -9.648 9.259 1.00 0.00 C -ATOM 3845 HA LYS 245 -4.850 -9.007 10.004 1.00 0.00 H -ATOM 3846 CB LYS 245 -2.938 -9.937 9.799 1.00 0.00 C -ATOM 3847 HB2 LYS 245 -3.067 -10.432 10.761 1.00 0.00 H -ATOM 3848 HB3 LYS 245 -2.419 -10.607 9.115 1.00 0.00 H -ATOM 3849 CG LYS 245 -2.004 -8.822 10.162 1.00 0.00 C -ATOM 3850 HG2 LYS 245 -1.755 -8.318 9.229 1.00 0.00 H -ATOM 3851 HG3 LYS 245 -2.522 -7.988 10.635 1.00 0.00 H -ATOM 3852 CD LYS 245 -0.870 -9.218 11.127 1.00 0.00 C -ATOM 3853 HD2 LYS 245 -1.317 -9.687 12.004 1.00 0.00 H -ATOM 3854 HD3 LYS 245 -0.204 -9.933 10.643 1.00 0.00 H -ATOM 3855 CE LYS 245 0.067 -8.040 11.517 1.00 0.00 C -ATOM 3856 HE2 LYS 245 0.476 -7.520 10.651 1.00 0.00 H -ATOM 3857 HE3 LYS 245 -0.427 -7.247 12.080 1.00 0.00 H -ATOM 3858 NZ LYS 245 1.176 -8.489 12.302 1.00 0.00 N -ATOM 3859 HZ1 LYS 245 1.560 -9.307 11.851 1.00 0.00 H -ATOM 3860 HZ2 LYS 245 1.864 -7.758 12.411 1.00 0.00 H -ATOM 3861 HZ3 LYS 245 0.905 -8.793 13.227 1.00 0.00 H -ATOM 3862 C LYS 245 -4.395 -9.045 7.876 1.00 0.00 C -ATOM 3863 O LYS 245 -4.427 -9.759 6.866 1.00 0.00 O -ATOM 3864 N LEU 246 -4.248 -7.747 7.907 1.00 0.00 N -ATOM 3865 H LEU 246 -4.438 -7.209 8.740 1.00 0.00 H -ATOM 3866 CA LEU 246 -4.125 -6.948 6.705 1.00 0.00 C -ATOM 3867 HA LEU 246 -3.761 -7.660 5.965 1.00 0.00 H -ATOM 3868 CB LEU 246 -5.555 -6.549 6.393 1.00 0.00 C -ATOM 3869 HB2 LEU 246 -6.306 -6.624 7.179 1.00 0.00 H -ATOM 3870 HB3 LEU 246 -5.476 -5.464 6.333 1.00 0.00 H -ATOM 3871 CG LEU 246 -6.093 -7.013 4.978 1.00 0.00 C -ATOM 3872 HG LEU 246 -5.992 -8.095 4.900 1.00 0.00 H -ATOM 3873 CD1 LEU 246 -7.606 -6.738 4.873 1.00 0.00 C -ATOM 3874 HD11 LEU 246 -8.192 -7.212 5.660 1.00 0.00 H -ATOM 3875 HD12 LEU 246 -7.787 -5.663 4.865 1.00 0.00 H -ATOM 3876 HD13 LEU 246 -7.947 -7.176 3.935 1.00 0.00 H -ATOM 3877 CD2 LEU 246 -5.279 -6.401 3.852 1.00 0.00 C -ATOM 3878 HD21 LEU 246 -5.293 -6.900 2.883 1.00 0.00 H -ATOM 3879 HD22 LEU 246 -5.521 -5.346 3.721 1.00 0.00 H -ATOM 3880 HD23 LEU 246 -4.200 -6.467 3.994 1.00 0.00 H -ATOM 3881 C LEU 246 -3.103 -5.890 6.904 1.00 0.00 C -ATOM 3882 O LEU 246 -3.192 -5.131 7.871 1.00 0.00 O -ATOM 3883 N ASN 247 -2.182 -5.728 5.952 1.00 0.00 N -ATOM 3884 H ASN 247 -2.092 -6.519 5.330 1.00 0.00 H -ATOM 3885 CA ASN 247 -1.370 -4.514 5.709 1.00 0.00 C -ATOM 3886 HA ASN 247 -1.647 -3.843 6.522 1.00 0.00 H -ATOM 3887 CB ASN 247 0.129 -4.754 5.583 1.00 0.00 C -ATOM 3888 HB2 ASN 247 0.482 -5.099 4.612 1.00 0.00 H -ATOM 3889 HB3 ASN 247 0.710 -3.868 5.837 1.00 0.00 H -ATOM 3890 CG ASN 247 0.591 -5.791 6.620 1.00 0.00 C -ATOM 3891 OD1 ASN 247 0.831 -5.490 7.780 1.00 0.00 O -ATOM 3892 ND2 ASN 247 0.903 -6.972 6.145 1.00 0.00 N -ATOM 3893 HD21 ASN 247 1.191 -7.761 6.705 1.00 0.00 H -ATOM 3894 HD22 ASN 247 0.783 -7.142 5.157 1.00 0.00 H -ATOM 3895 C ASN 247 -1.769 -3.692 4.464 1.00 0.00 C -ATOM 3896 O ASN 247 -2.216 -4.244 3.503 1.00 0.00 O -ATOM 3897 N LEU 248 -1.506 -2.403 4.646 1.00 0.00 N -ATOM 3898 H LEU 248 -0.980 -2.203 5.485 1.00 0.00 H -ATOM 3899 CA LEU 248 -1.749 -1.458 3.647 1.00 0.00 C -ATOM 3900 HA LEU 248 -1.934 -1.950 2.692 1.00 0.00 H -ATOM 3901 CB LEU 248 -3.151 -0.769 3.922 1.00 0.00 C -ATOM 3902 HB2 LEU 248 -3.254 -0.476 4.967 1.00 0.00 H -ATOM 3903 HB3 LEU 248 -3.166 0.072 3.229 1.00 0.00 H -ATOM 3904 CG LEU 248 -4.341 -1.713 3.659 1.00 0.00 C -ATOM 3905 HG LEU 248 -4.168 -2.554 2.988 1.00 0.00 H -ATOM 3906 CD1 LEU 248 -4.861 -2.312 4.965 1.00 0.00 C -ATOM 3907 HD11 LEU 248 -5.448 -1.608 5.556 1.00 0.00 H -ATOM 3908 HD12 LEU 248 -5.664 -2.969 4.631 1.00 0.00 H -ATOM 3909 HD13 LEU 248 -4.119 -2.866 5.539 1.00 0.00 H -ATOM 3910 CD2 LEU 248 -5.536 -0.975 2.985 1.00 0.00 C -ATOM 3911 HD21 LEU 248 -6.163 -0.447 3.704 1.00 0.00 H -ATOM 3912 HD22 LEU 248 -5.250 -0.201 2.272 1.00 0.00 H -ATOM 3913 HD23 LEU 248 -6.084 -1.746 2.443 1.00 0.00 H -ATOM 3914 C LEU 248 -0.552 -0.460 3.571 1.00 0.00 C -ATOM 3915 O LEU 248 -0.248 0.337 4.448 1.00 0.00 O -ATOM 3916 N VAL 249 0.079 -0.493 2.318 1.00 0.00 N -ATOM 3917 H VAL 249 -0.233 -1.141 1.608 1.00 0.00 H -ATOM 3918 CA VAL 249 1.371 0.143 2.062 1.00 0.00 C -ATOM 3919 HA VAL 249 1.540 0.821 2.898 1.00 0.00 H -ATOM 3920 CB VAL 249 2.524 -0.916 1.874 1.00 0.00 C -ATOM 3921 HB VAL 249 2.331 -1.374 0.904 1.00 0.00 H -ATOM 3922 CG1 VAL 249 3.852 -0.172 1.867 1.00 0.00 C -ATOM 3923 HG11 VAL 249 3.842 0.604 1.102 1.00 0.00 H -ATOM 3924 HG12 VAL 249 3.860 0.411 2.788 1.00 0.00 H -ATOM 3925 HG13 VAL 249 4.748 -0.790 1.796 1.00 0.00 H -ATOM 3926 CG2 VAL 249 2.667 -2.003 3.012 1.00 0.00 C -ATOM 3927 HG21 VAL 249 1.759 -2.605 3.056 1.00 0.00 H -ATOM 3928 HG22 VAL 249 3.493 -2.691 2.833 1.00 0.00 H -ATOM 3929 HG23 VAL 249 2.818 -1.562 3.997 1.00 0.00 H -ATOM 3930 C VAL 249 1.269 1.026 0.790 1.00 0.00 C -ATOM 3931 O VAL 249 1.309 0.537 -0.345 1.00 0.00 O -ATOM 3932 N ASP 250 1.298 2.326 0.960 1.00 0.00 N -ATOM 3933 H ASP 250 1.253 2.542 1.946 1.00 0.00 H -ATOM 3934 CA ASP 250 1.488 3.401 -0.027 1.00 0.00 C -ATOM 3935 HA ASP 250 1.300 2.961 -1.007 1.00 0.00 H -ATOM 3936 CB ASP 250 0.552 4.654 0.074 1.00 0.00 C -ATOM 3937 HB2 ASP 250 1.022 5.542 -0.349 1.00 0.00 H -ATOM 3938 HB3 ASP 250 -0.326 4.359 -0.501 1.00 0.00 H -ATOM 3939 CG ASP 250 -0.025 5.028 1.459 1.00 0.00 C -ATOM 3940 OD1 ASP 250 -0.317 6.242 1.685 1.00 0.00 O -ATOM 3941 OD2 ASP 250 -0.410 4.095 2.216 1.00 0.00 O -ATOM 3942 C ASP 250 2.988 3.886 -0.074 1.00 0.00 C -ATOM 3943 O ASP 250 3.405 4.763 0.713 1.00 0.00 O -ATOM 3944 N LEU 251 3.803 3.281 -0.919 1.00 0.00 N -ATOM 3945 H LEU 251 3.378 2.483 -1.369 1.00 0.00 H -ATOM 3946 CA LEU 251 5.199 3.448 -1.150 1.00 0.00 C -ATOM 3947 HA LEU 251 5.679 3.349 -0.177 1.00 0.00 H -ATOM 3948 CB LEU 251 5.668 2.345 -2.173 1.00 0.00 C -ATOM 3949 HB2 LEU 251 4.974 2.519 -2.996 1.00 0.00 H -ATOM 3950 HB3 LEU 251 6.695 2.505 -2.500 1.00 0.00 H -ATOM 3951 CG LEU 251 5.472 0.817 -1.903 1.00 0.00 C -ATOM 3952 HG LEU 251 4.474 0.667 -1.490 1.00 0.00 H -ATOM 3953 CD1 LEU 251 5.669 -0.111 -3.130 1.00 0.00 C -ATOM 3954 HD11 LEU 251 5.485 -1.152 -2.864 1.00 0.00 H -ATOM 3955 HD12 LEU 251 5.014 0.204 -3.943 1.00 0.00 H -ATOM 3956 HD13 LEU 251 6.640 -0.010 -3.615 1.00 0.00 H -ATOM 3957 CD2 LEU 251 6.521 0.453 -0.853 1.00 0.00 C -ATOM 3958 HD21 LEU 251 6.308 -0.511 -0.391 1.00 0.00 H -ATOM 3959 HD22 LEU 251 7.446 0.317 -1.414 1.00 0.00 H -ATOM 3960 HD23 LEU 251 6.828 1.278 -0.209 1.00 0.00 H -ATOM 3961 C LEU 251 5.571 4.826 -1.678 1.00 0.00 C -ATOM 3962 O LEU 251 4.641 5.598 -2.149 1.00 0.00 O -ATOM 3963 N ALA 252 6.847 5.101 -1.620 1.00 0.00 N -ATOM 3964 H ALA 252 7.494 4.395 -1.301 1.00 0.00 H -ATOM 3965 CA ALA 252 7.502 6.237 -2.315 1.00 0.00 C -ATOM 3966 HA ALA 252 7.227 7.146 -1.780 1.00 0.00 H -ATOM 3967 CB ALA 252 9.011 6.070 -2.110 1.00 0.00 C -ATOM 3968 HB1 ALA 252 9.234 5.974 -1.047 1.00 0.00 H -ATOM 3969 HB2 ALA 252 9.410 5.230 -2.680 1.00 0.00 H -ATOM 3970 HB3 ALA 252 9.461 6.972 -2.523 1.00 0.00 H -ATOM 3971 C ALA 252 7.145 6.303 -3.824 1.00 0.00 C -ATOM 3972 O ALA 252 6.705 5.320 -4.433 1.00 0.00 O -ATOM 3973 N GLY 253 7.377 7.529 -4.473 1.00 0.00 N -ATOM 3974 H GLY 253 7.909 8.164 -3.895 1.00 0.00 H -ATOM 3975 CA GLY 253 7.145 7.781 -5.939 1.00 0.00 C -ATOM 3976 HA2 GLY 253 6.104 7.604 -6.210 1.00 0.00 H -ATOM 3977 HA3 GLY 253 7.470 8.805 -6.125 1.00 0.00 H -ATOM 3978 C GLY 253 7.968 6.831 -6.872 1.00 0.00 C -ATOM 3979 O GLY 253 9.088 6.446 -6.584 1.00 0.00 O -ATOM 3980 N SER 254 7.287 6.396 -7.930 1.00 0.00 N -ATOM 3981 H SER 254 6.301 6.590 -8.027 1.00 0.00 H -ATOM 3982 CA SER 254 7.848 5.658 -9.086 1.00 0.00 C -ATOM 3983 HA SER 254 8.520 4.939 -8.618 1.00 0.00 H -ATOM 3984 CB SER 254 6.848 4.893 -9.941 1.00 0.00 C -ATOM 3985 HB2 SER 254 7.389 4.265 -10.649 1.00 0.00 H -ATOM 3986 HB3 SER 254 6.230 4.308 -9.261 1.00 0.00 H -ATOM 3987 OG SER 254 6.069 5.766 -10.686 1.00 0.00 O -ATOM 3988 HG SER 254 5.874 5.303 -11.504 1.00 0.00 H -ATOM 3989 C SER 254 8.713 6.498 -10.044 1.00 0.00 C -ATOM 3990 O SER 254 9.399 5.983 -10.907 1.00 0.00 O -ATOM 3991 N GLU 255 8.738 7.799 -9.959 1.00 0.00 N -ATOM 3992 H GLU 255 8.000 8.171 -9.379 1.00 0.00 H -ATOM 3993 CA GLU 255 9.344 8.647 -10.981 1.00 0.00 C -ATOM 3994 HA GLU 255 8.959 8.210 -11.902 1.00 0.00 H -ATOM 3995 CB GLU 255 8.677 9.984 -11.043 1.00 0.00 C -ATOM 3996 HB2 GLU 255 9.034 10.375 -11.996 1.00 0.00 H -ATOM 3997 HB3 GLU 255 7.593 9.914 -11.135 1.00 0.00 H -ATOM 3998 CG GLU 255 9.129 10.952 -9.951 1.00 0.00 C -ATOM 3999 HG2 GLU 255 10.207 10.902 -9.797 1.00 0.00 H -ATOM 4000 HG3 GLU 255 9.051 11.984 -10.293 1.00 0.00 H -ATOM 4001 CD GLU 255 8.306 10.816 -8.626 1.00 0.00 C -ATOM 4002 OE1 GLU 255 7.458 9.942 -8.494 1.00 0.00 O -ATOM 4003 OE2 GLU 255 8.629 11.553 -7.694 1.00 0.00 O -ATOM 4004 C GLU 255 10.861 8.610 -11.071 1.00 0.00 C -ATOM 4005 O GLU 255 11.575 8.460 -10.064 1.00 0.00 O -ATOM 4006 N ASN 256 11.399 8.924 -12.274 1.00 0.00 N -ATOM 4007 H ASN 256 10.789 8.978 -13.077 1.00 0.00 H -ATOM 4008 CA ASN 256 12.835 9.022 -12.620 1.00 0.00 C -ATOM 4009 HA ASN 256 13.278 8.077 -12.308 1.00 0.00 H -ATOM 4010 CB ASN 256 13.087 9.312 -14.105 1.00 0.00 C -ATOM 4011 HB2 ASN 256 12.477 8.673 -14.743 1.00 0.00 H -ATOM 4012 HB3 ASN 256 12.758 10.327 -14.326 1.00 0.00 H -ATOM 4013 CG ASN 256 14.557 9.317 -14.391 1.00 0.00 C -ATOM 4014 OD1 ASN 256 15.266 8.267 -14.346 1.00 0.00 O -ATOM 4015 ND2 ASN 256 15.106 10.473 -14.471 1.00 0.00 N -ATOM 4016 HD21 ASN 256 16.113 10.533 -14.528 1.00 0.00 H -ATOM 4017 HD22 ASN 256 14.470 11.255 -14.408 1.00 0.00 H -ATOM 4018 C ASN 256 13.550 10.061 -11.708 1.00 0.00 C -ATOM 4019 O ASN 256 14.601 9.759 -11.152 1.00 0.00 O -ATOM 4020 N ILE 257 13.032 11.283 -11.519 1.00 0.00 N -ATOM 4021 H ILE 257 12.208 11.563 -12.032 1.00 0.00 H -ATOM 4022 CA ILE 257 13.632 12.268 -10.581 1.00 0.00 C -ATOM 4023 HA ILE 257 14.655 12.435 -10.916 1.00 0.00 H -ATOM 4024 CB ILE 257 13.001 13.701 -10.611 1.00 0.00 C -ATOM 4025 HB ILE 257 13.535 14.309 -9.881 1.00 0.00 H -ATOM 4026 CG2 ILE 257 12.952 14.375 -12.010 1.00 0.00 C -ATOM 4027 HG21 ILE 257 12.767 15.443 -11.895 1.00 0.00 H -ATOM 4028 HG22 ILE 257 13.860 14.251 -12.600 1.00 0.00 H -ATOM 4029 HG23 ILE 257 12.219 13.813 -12.588 1.00 0.00 H -ATOM 4030 CG1 ILE 257 11.580 13.882 -9.973 1.00 0.00 C -ATOM 4031 HG12 ILE 257 10.852 13.491 -10.683 1.00 0.00 H -ATOM 4032 HG13 ILE 257 11.529 13.223 -9.106 1.00 0.00 H -ATOM 4033 CD1 ILE 257 10.920 15.279 -9.605 1.00 0.00 C -ATOM 4034 HD11 ILE 257 10.708 15.772 -10.553 1.00 0.00 H -ATOM 4035 HD12 ILE 257 10.005 15.214 -9.017 1.00 0.00 H -ATOM 4036 HD13 ILE 257 11.613 15.902 -9.039 1.00 0.00 H -ATOM 4037 C ILE 257 13.747 11.795 -9.131 1.00 0.00 C -ATOM 4038 O ILE 257 14.598 12.226 -8.378 1.00 0.00 O -ATOM 4039 N GLY 258 13.020 10.736 -8.799 1.00 0.00 N -ATOM 4040 H GLY 258 12.446 10.363 -9.542 1.00 0.00 H -ATOM 4041 CA GLY 258 13.057 9.948 -7.582 1.00 0.00 C -ATOM 4042 HA2 GLY 258 13.385 10.545 -6.731 1.00 0.00 H -ATOM 4043 HA3 GLY 258 12.116 9.407 -7.477 1.00 0.00 H -ATOM 4044 C GLY 258 14.190 8.909 -7.559 1.00 0.00 C -ATOM 4045 O GLY 258 15.131 9.045 -6.796 1.00 0.00 O -ATOM 4046 N ARG 259 14.132 7.953 -8.460 1.00 0.00 N -ATOM 4047 H ARG 259 13.293 7.980 -9.022 1.00 0.00 H -ATOM 4048 CA ARG 259 15.301 6.925 -8.573 1.00 0.00 C -ATOM 4049 HA ARG 259 15.494 6.616 -7.545 1.00 0.00 H -ATOM 4050 CB ARG 259 14.889 5.663 -9.418 1.00 0.00 C -ATOM 4051 HB2 ARG 259 15.728 4.968 -9.443 1.00 0.00 H -ATOM 4052 HB3 ARG 259 14.089 5.180 -8.857 1.00 0.00 H -ATOM 4053 CG ARG 259 14.426 5.870 -10.838 1.00 0.00 C -ATOM 4054 HG2 ARG 259 13.363 6.076 -10.958 1.00 0.00 H -ATOM 4055 HG3 ARG 259 15.042 6.702 -11.180 1.00 0.00 H -ATOM 4056 CD ARG 259 14.690 4.699 -11.854 1.00 0.00 C -ATOM 4057 HD2 ARG 259 15.738 4.417 -11.961 1.00 0.00 H -ATOM 4058 HD3 ARG 259 14.179 3.804 -11.498 1.00 0.00 H -ATOM 4059 NE ARG 259 14.319 5.166 -13.200 1.00 0.00 N -ATOM 4060 HE ARG 259 15.097 5.397 -13.802 1.00 0.00 H -ATOM 4061 CZ ARG 259 13.139 5.284 -13.781 1.00 0.00 C -ATOM 4062 NH1 ARG 259 12.033 5.133 -13.193 1.00 0.00 N -ATOM 4063 HH11 ARG 259 11.981 4.951 -12.201 1.00 0.00 H -ATOM 4064 HH12 ARG 259 11.150 5.290 -13.657 1.00 0.00 H -ATOM 4065 NH2 ARG 259 13.119 5.554 -15.026 1.00 0.00 N -ATOM 4066 HH21 ARG 259 13.931 5.562 -15.626 1.00 0.00 H -ATOM 4067 HH22 ARG 259 12.382 6.186 -15.303 1.00 0.00 H -ATOM 4068 C ARG 259 16.689 7.488 -8.891 1.00 0.00 C -ATOM 4069 O ARG 259 17.734 6.973 -8.401 1.00 0.00 O -ATOM 4070 N SER 260 16.763 8.560 -9.629 1.00 0.00 N -ATOM 4071 H SER 260 15.906 8.927 -10.018 1.00 0.00 H -ATOM 4072 CA SER 260 18.105 8.855 -10.156 1.00 0.00 C -ATOM 4073 HA SER 260 18.459 7.846 -10.366 1.00 0.00 H -ATOM 4074 CB SER 260 18.057 9.645 -11.451 1.00 0.00 C -ATOM 4075 HB2 SER 260 19.069 9.944 -11.726 1.00 0.00 H -ATOM 4076 HB3 SER 260 17.643 8.914 -12.145 1.00 0.00 H -ATOM 4077 OG SER 260 17.215 10.828 -11.331 1.00 0.00 O -ATOM 4078 HG SER 260 16.303 10.527 -11.330 1.00 0.00 H -ATOM 4079 C SER 260 18.967 9.643 -9.136 1.00 0.00 C -ATOM 4080 O SER 260 18.420 10.582 -8.472 1.00 0.00 O -ATOM 4081 N GLY 261 20.270 9.316 -8.978 1.00 0.00 N -ATOM 4082 H GLY 261 20.725 8.721 -9.657 1.00 0.00 H -ATOM 4083 CA GLY 261 20.961 9.674 -7.751 1.00 0.00 C -ATOM 4084 HA2 GLY 261 20.729 10.711 -7.505 1.00 0.00 H -ATOM 4085 HA3 GLY 261 20.643 8.974 -6.978 1.00 0.00 H -ATOM 4086 C GLY 261 22.459 9.657 -7.816 1.00 0.00 C -ATOM 4087 O GLY 261 23.090 9.043 -8.608 1.00 0.00 O -ATOM 4088 N ALA 262 23.156 10.374 -6.925 1.00 0.00 N -ATOM 4089 H ALA 262 22.629 10.888 -6.234 1.00 0.00 H -ATOM 4090 CA ALA 262 24.574 10.261 -6.840 1.00 0.00 C -ATOM 4091 HA ALA 262 25.122 10.372 -7.776 1.00 0.00 H -ATOM 4092 CB ALA 262 25.145 11.460 -6.054 1.00 0.00 C -ATOM 4093 HB1 ALA 262 24.566 11.495 -5.131 1.00 0.00 H -ATOM 4094 HB2 ALA 262 26.192 11.352 -5.768 1.00 0.00 H -ATOM 4095 HB3 ALA 262 24.955 12.386 -6.597 1.00 0.00 H -ATOM 4096 C ALA 262 25.066 8.908 -6.173 1.00 0.00 C -ATOM 4097 O ALA 262 24.546 8.420 -5.167 1.00 0.00 O -ATOM 4098 N VAL 263 25.979 8.193 -6.771 1.00 0.00 N -ATOM 4099 H VAL 263 26.189 8.464 -7.721 1.00 0.00 H -ATOM 4100 CA VAL 263 26.541 6.905 -6.379 1.00 0.00 C -ATOM 4101 HA VAL 263 25.716 6.234 -6.141 1.00 0.00 H -ATOM 4102 CB VAL 263 27.419 6.134 -7.404 1.00 0.00 C -ATOM 4103 HB VAL 263 27.920 5.306 -6.904 1.00 0.00 H -ATOM 4104 CG1 VAL 263 26.619 5.488 -8.494 1.00 0.00 C -ATOM 4105 HG11 VAL 263 26.089 6.313 -8.971 1.00 0.00 H -ATOM 4106 HG12 VAL 263 27.256 5.068 -9.273 1.00 0.00 H -ATOM 4107 HG13 VAL 263 26.136 4.677 -7.950 1.00 0.00 H -ATOM 4108 CG2 VAL 263 28.546 7.000 -7.973 1.00 0.00 C -ATOM 4109 HG21 VAL 263 29.098 6.466 -8.747 1.00 0.00 H -ATOM 4110 HG22 VAL 263 28.196 7.934 -8.413 1.00 0.00 H -ATOM 4111 HG23 VAL 263 29.176 7.237 -7.116 1.00 0.00 H -ATOM 4112 C VAL 263 27.290 7.072 -5.070 1.00 0.00 C -ATOM 4113 O VAL 263 27.548 8.201 -4.619 1.00 0.00 O -ATOM 4114 N ASP 264 27.649 5.964 -4.349 1.00 0.00 N -ATOM 4115 H ASP 264 27.532 5.045 -4.751 1.00 0.00 H -ATOM 4116 CA ASP 264 28.114 6.061 -2.964 1.00 0.00 C -ATOM 4117 HA ASP 264 27.322 6.561 -2.406 1.00 0.00 H -ATOM 4118 CB ASP 264 28.143 4.676 -2.271 1.00 0.00 C -ATOM 4119 HB2 ASP 264 28.611 3.934 -2.918 1.00 0.00 H -ATOM 4120 HB3 ASP 264 28.665 4.753 -1.317 1.00 0.00 H -ATOM 4121 CG ASP 264 26.736 4.184 -1.935 1.00 0.00 C -ATOM 4122 OD1 ASP 264 26.678 2.977 -1.557 1.00 0.00 O -ATOM 4123 OD2 ASP 264 25.749 4.954 -1.970 1.00 0.00 O -ATOM 4124 C ASP 264 29.496 6.714 -2.812 1.00 0.00 C -ATOM 4125 O ASP 264 29.817 7.100 -1.666 1.00 0.00 O -ATOM 4126 N LYS 265 30.226 6.884 -3.901 1.00 0.00 N -ATOM 4127 H LYS 265 29.804 6.458 -4.713 1.00 0.00 H -ATOM 4128 CA LYS 265 31.535 7.603 -4.067 1.00 0.00 C -ATOM 4129 HA LYS 265 32.171 7.168 -3.296 1.00 0.00 H -ATOM 4130 CB LYS 265 32.107 7.297 -5.443 1.00 0.00 C -ATOM 4131 HB2 LYS 265 31.336 7.514 -6.182 1.00 0.00 H -ATOM 4132 HB3 LYS 265 32.983 7.926 -5.600 1.00 0.00 H -ATOM 4133 CG LYS 265 32.512 5.775 -5.502 1.00 0.00 C -ATOM 4134 HG2 LYS 265 33.261 5.575 -4.736 1.00 0.00 H -ATOM 4135 HG3 LYS 265 31.654 5.114 -5.377 1.00 0.00 H -ATOM 4136 CD LYS 265 33.208 5.476 -6.845 1.00 0.00 C -ATOM 4137 HD2 LYS 265 33.572 4.454 -6.956 1.00 0.00 H -ATOM 4138 HD3 LYS 265 32.527 5.737 -7.655 1.00 0.00 H -ATOM 4139 CE LYS 265 34.469 6.311 -7.021 1.00 0.00 C -ATOM 4140 HE2 LYS 265 34.305 7.358 -6.765 1.00 0.00 H -ATOM 4141 HE3 LYS 265 35.186 5.912 -6.304 1.00 0.00 H -ATOM 4142 NZ LYS 265 35.035 6.112 -8.286 1.00 0.00 N -ATOM 4143 HZ1 LYS 265 35.072 5.132 -8.529 1.00 0.00 H -ATOM 4144 HZ2 LYS 265 34.402 6.446 -8.999 1.00 0.00 H -ATOM 4145 HZ3 LYS 265 35.919 6.543 -8.516 1.00 0.00 H -ATOM 4146 C LYS 265 31.421 9.100 -3.719 1.00 0.00 C -ATOM 4147 O LYS 265 32.385 9.729 -3.340 1.00 0.00 O -ATOM 4148 N ARG 266 30.229 9.681 -4.032 1.00 0.00 N -ATOM 4149 H ARG 266 29.502 9.110 -4.438 1.00 0.00 H -ATOM 4150 CA ARG 266 29.828 11.099 -3.755 1.00 0.00 C -ATOM 4151 HA ARG 266 30.685 11.669 -3.396 1.00 0.00 H -ATOM 4152 CB ARG 266 29.407 11.793 -5.087 1.00 0.00 C -ATOM 4153 HB2 ARG 266 28.585 11.307 -5.612 1.00 0.00 H -ATOM 4154 HB3 ARG 266 29.172 12.839 -4.889 1.00 0.00 H -ATOM 4155 CG ARG 266 30.555 11.935 -6.088 1.00 0.00 C -ATOM 4156 HG2 ARG 266 31.517 12.027 -5.584 1.00 0.00 H -ATOM 4157 HG3 ARG 266 30.492 11.024 -6.684 1.00 0.00 H -ATOM 4158 CD ARG 266 30.510 13.157 -7.014 1.00 0.00 C -ATOM 4159 HD2 ARG 266 30.464 14.115 -6.496 1.00 0.00 H -ATOM 4160 HD3 ARG 266 31.497 13.250 -7.468 1.00 0.00 H -ATOM 4161 NE ARG 266 29.432 13.063 -8.005 1.00 0.00 N -ATOM 4162 HE ARG 266 29.620 12.408 -8.751 1.00 0.00 H -ATOM 4163 CZ ARG 266 28.253 13.749 -8.004 1.00 0.00 C -ATOM 4164 NH1 ARG 266 27.920 14.601 -7.021 1.00 0.00 N -ATOM 4165 HH11 ARG 266 28.628 14.864 -6.351 1.00 0.00 H -ATOM 4166 HH12 ARG 266 27.097 15.186 -6.995 1.00 0.00 H -ATOM 4167 NH2 ARG 266 27.316 13.446 -8.886 1.00 0.00 N -ATOM 4168 HH21 ARG 266 27.677 13.051 -9.743 1.00 0.00 H -ATOM 4169 HH22 ARG 266 26.446 13.958 -8.902 1.00 0.00 H -ATOM 4170 C ARG 266 28.681 11.377 -2.789 1.00 0.00 C -ATOM 4171 O ARG 266 28.675 12.444 -2.119 1.00 0.00 O -ATOM 4172 N ALA 267 27.744 10.483 -2.574 1.00 0.00 N -ATOM 4173 H ALA 267 27.690 9.638 -3.124 1.00 0.00 H -ATOM 4174 CA ALA 267 26.719 10.688 -1.527 1.00 0.00 C -ATOM 4175 HA ALA 267 27.261 10.947 -0.618 1.00 0.00 H -ATOM 4176 CB ALA 267 25.740 11.695 -2.124 1.00 0.00 C -ATOM 4177 HB1 ALA 267 25.212 12.189 -1.308 1.00 0.00 H -ATOM 4178 HB2 ALA 267 26.272 12.373 -2.791 1.00 0.00 H -ATOM 4179 HB3 ALA 267 25.006 11.196 -2.756 1.00 0.00 H -ATOM 4180 C ALA 267 25.989 9.361 -1.240 1.00 0.00 C -ATOM 4181 O ALA 267 24.767 9.119 -1.450 1.00 0.00 O -ATOM 4182 N ARG 268 26.704 8.524 -0.520 1.00 0.00 N -ATOM 4183 H ARG 268 27.667 8.807 -0.408 1.00 0.00 H -ATOM 4184 CA ARG 268 26.210 7.351 0.293 1.00 0.00 C -ATOM 4185 HA ARG 268 25.898 6.673 -0.501 1.00 0.00 H -ATOM 4186 CB ARG 268 27.432 6.746 1.031 1.00 0.00 C -ATOM 4187 HB2 ARG 268 28.154 6.449 0.270 1.00 0.00 H -ATOM 4188 HB3 ARG 268 27.795 7.547 1.676 1.00 0.00 H -ATOM 4189 CG ARG 268 27.109 5.533 2.009 1.00 0.00 C -ATOM 4190 HG2 ARG 268 27.938 5.193 2.629 1.00 0.00 H -ATOM 4191 HG3 ARG 268 26.473 6.020 2.748 1.00 0.00 H -ATOM 4192 CD ARG 268 26.444 4.382 1.294 1.00 0.00 C -ATOM 4193 HD2 ARG 268 25.444 4.623 0.934 1.00 0.00 H -ATOM 4194 HD3 ARG 268 27.175 4.075 0.546 1.00 0.00 H -ATOM 4195 NE ARG 268 26.213 3.217 2.208 1.00 0.00 N -ATOM 4196 HE ARG 268 26.483 3.339 3.174 1.00 0.00 H -ATOM 4197 CZ ARG 268 26.001 1.963 1.810 1.00 0.00 C -ATOM 4198 NH1 ARG 268 25.848 1.644 0.583 1.00 0.00 N -ATOM 4199 HH11 ARG 268 26.070 2.345 -0.109 1.00 0.00 H -ATOM 4200 HH12 ARG 268 25.507 0.758 0.238 1.00 0.00 H -ATOM 4201 NH2 ARG 268 25.787 1.070 2.802 1.00 0.00 N -ATOM 4202 HH21 ARG 268 25.908 1.338 3.768 1.00 0.00 H -ATOM 4203 HH22 ARG 268 25.563 0.113 2.569 1.00 0.00 H -ATOM 4204 C ARG 268 25.121 7.762 1.230 1.00 0.00 C -ATOM 4205 O ARG 268 24.243 6.912 1.424 1.00 0.00 O -ATOM 4206 N GLU 269 25.058 9.042 1.683 1.00 0.00 N -ATOM 4207 H GLU 269 25.787 9.646 1.329 1.00 0.00 H -ATOM 4208 CA GLU 269 24.165 9.401 2.751 1.00 0.00 C -ATOM 4209 HA GLU 269 24.054 8.607 3.489 1.00 0.00 H -ATOM 4210 CB GLU 269 24.771 10.680 3.466 1.00 0.00 C -ATOM 4211 HB2 GLU 269 24.817 11.488 2.736 1.00 0.00 H -ATOM 4212 HB3 GLU 269 24.112 10.974 4.283 1.00 0.00 H -ATOM 4213 CG GLU 269 26.053 10.331 4.128 1.00 0.00 C -ATOM 4214 HG2 GLU 269 26.153 11.093 4.902 1.00 0.00 H -ATOM 4215 HG3 GLU 269 25.832 9.342 4.530 1.00 0.00 H -ATOM 4216 CD GLU 269 27.320 10.296 3.331 1.00 0.00 C -ATOM 4217 OE1 GLU 269 27.377 10.574 2.117 1.00 0.00 O -ATOM 4218 OE2 GLU 269 28.370 10.046 3.995 1.00 0.00 O -ATOM 4219 C GLU 269 22.755 9.748 2.241 1.00 0.00 C -ATOM 4220 O GLU 269 21.795 9.704 2.964 1.00 0.00 O -ATOM 4221 N ALA 270 22.594 10.136 0.982 1.00 0.00 N -ATOM 4222 H ALA 270 23.401 10.118 0.375 1.00 0.00 H -ATOM 4223 CA ALA 270 21.305 10.328 0.267 1.00 0.00 C -ATOM 4224 HA ALA 270 20.610 10.675 1.031 1.00 0.00 H -ATOM 4225 CB ALA 270 21.470 11.420 -0.734 1.00 0.00 C -ATOM 4226 HB1 ALA 270 22.391 11.272 -1.298 1.00 0.00 H -ATOM 4227 HB2 ALA 270 20.606 11.562 -1.382 1.00 0.00 H -ATOM 4228 HB3 ALA 270 21.551 12.382 -0.230 1.00 0.00 H -ATOM 4229 C ALA 270 20.906 9.063 -0.540 1.00 0.00 C -ATOM 4230 O ALA 270 19.737 8.766 -0.704 1.00 0.00 O -ATOM 4231 N GLY 271 21.862 8.203 -0.822 1.00 0.00 N -ATOM 4232 H GLY 271 22.781 8.621 -0.864 1.00 0.00 H -ATOM 4233 CA GLY 271 21.680 6.779 -1.259 1.00 0.00 C -ATOM 4234 HA2 GLY 271 21.008 6.776 -2.117 1.00 0.00 H -ATOM 4235 HA3 GLY 271 22.633 6.424 -1.652 1.00 0.00 H -ATOM 4236 C GLY 271 21.063 5.839 -0.265 1.00 0.00 C -ATOM 4237 O GLY 271 20.280 5.034 -0.705 1.00 0.00 O -ATOM 4238 N ASN 272 21.128 6.218 1.037 1.00 0.00 N -ATOM 4239 H ASN 272 21.763 6.910 1.409 1.00 0.00 H -ATOM 4240 CA ASN 272 20.290 5.578 2.039 1.00 0.00 C -ATOM 4241 HA ASN 272 20.300 4.519 1.779 1.00 0.00 H -ATOM 4242 CB ASN 272 20.848 5.874 3.463 1.00 0.00 C -ATOM 4243 HB2 ASN 272 20.730 6.940 3.660 1.00 0.00 H -ATOM 4244 HB3 ASN 272 20.176 5.522 4.246 1.00 0.00 H -ATOM 4245 CG ASN 272 22.313 5.515 3.741 1.00 0.00 C -ATOM 4246 OD1 ASN 272 22.950 6.165 4.515 1.00 0.00 O -ATOM 4247 ND2 ASN 272 22.837 4.578 3.058 1.00 0.00 N -ATOM 4248 HD21 ASN 272 23.844 4.528 2.992 1.00 0.00 H -ATOM 4249 HD22 ASN 272 22.273 3.797 2.753 1.00 0.00 H -ATOM 4250 C ASN 272 18.773 5.906 1.917 1.00 0.00 C -ATOM 4251 O ASN 272 17.996 5.070 2.291 1.00 0.00 O -ATOM 4252 N ILE 273 18.344 6.993 1.297 1.00 0.00 N -ATOM 4253 H ILE 273 18.972 7.769 1.141 1.00 0.00 H -ATOM 4254 CA ILE 273 16.882 7.233 0.991 1.00 0.00 C -ATOM 4255 HA ILE 273 16.213 7.127 1.845 1.00 0.00 H -ATOM 4256 CB ILE 273 16.561 8.686 0.508 1.00 0.00 C -ATOM 4257 HB ILE 273 17.253 9.005 -0.272 1.00 0.00 H -ATOM 4258 CG2 ILE 273 15.123 8.739 -0.003 1.00 0.00 C -ATOM 4259 HG21 ILE 273 15.044 8.217 -0.957 1.00 0.00 H -ATOM 4260 HG22 ILE 273 14.438 8.420 0.783 1.00 0.00 H -ATOM 4261 HG23 ILE 273 14.774 9.770 -0.063 1.00 0.00 H -ATOM 4262 CG1 ILE 273 16.879 9.764 1.560 1.00 0.00 C -ATOM 4263 HG12 ILE 273 16.043 9.801 2.257 1.00 0.00 H -ATOM 4264 HG13 ILE 273 17.851 9.610 2.029 1.00 0.00 H -ATOM 4265 CD1 ILE 273 17.065 11.192 0.921 1.00 0.00 C -ATOM 4266 HD11 ILE 273 18.078 11.321 0.542 1.00 0.00 H -ATOM 4267 HD12 ILE 273 16.373 11.413 0.108 1.00 0.00 H -ATOM 4268 HD13 ILE 273 16.806 11.958 1.652 1.00 0.00 H -ATOM 4269 C ILE 273 16.438 6.207 0.017 1.00 0.00 C -ATOM 4270 O ILE 273 15.394 5.730 0.304 1.00 0.00 O -ATOM 4271 N ASN 274 17.118 5.958 -1.114 1.00 0.00 N -ATOM 4272 H ASN 274 17.978 6.438 -1.341 1.00 0.00 H -ATOM 4273 CA ASN 274 16.575 5.119 -2.193 1.00 0.00 C -ATOM 4274 HA ASN 274 15.489 5.201 -2.153 1.00 0.00 H -ATOM 4275 CB ASN 274 17.297 5.590 -3.504 1.00 0.00 C -ATOM 4276 HB2 ASN 274 17.350 6.679 -3.526 1.00 0.00 H -ATOM 4277 HB3 ASN 274 18.306 5.182 -3.576 1.00 0.00 H -ATOM 4278 CG ASN 274 16.609 5.133 -4.774 1.00 0.00 C -ATOM 4279 OD1 ASN 274 15.492 4.676 -4.783 1.00 0.00 O -ATOM 4280 ND2 ASN 274 17.282 5.287 -5.929 1.00 0.00 N -ATOM 4281 HD21 ASN 274 16.783 4.872 -6.702 1.00 0.00 H -ATOM 4282 HD22 ASN 274 18.200 5.708 -5.969 1.00 0.00 H -ATOM 4283 C ASN 274 16.874 3.612 -1.875 1.00 0.00 C -ATOM 4284 O ASN 274 16.482 2.687 -2.605 1.00 0.00 O -ATOM 4285 N GLN 275 17.560 3.240 -0.847 1.00 0.00 N -ATOM 4286 H GLN 275 17.911 3.883 -0.152 1.00 0.00 H -ATOM 4287 CA GLN 275 17.978 1.820 -0.607 1.00 0.00 C -ATOM 4288 HA GLN 275 18.637 1.459 -1.396 1.00 0.00 H -ATOM 4289 CB GLN 275 18.855 1.831 0.679 1.00 0.00 C -ATOM 4290 HB2 GLN 275 19.646 2.582 0.655 1.00 0.00 H -ATOM 4291 HB3 GLN 275 18.203 2.218 1.461 1.00 0.00 H -ATOM 4292 CG GLN 275 19.430 0.472 1.135 1.00 0.00 C -ATOM 4293 HG2 GLN 275 19.947 0.702 2.067 1.00 0.00 H -ATOM 4294 HG3 GLN 275 18.618 -0.196 1.422 1.00 0.00 H -ATOM 4295 CD GLN 275 20.335 -0.223 0.166 1.00 0.00 C -ATOM 4296 OE1 GLN 275 20.893 0.447 -0.731 1.00 0.00 O -ATOM 4297 NE2 GLN 275 20.618 -1.480 0.312 1.00 0.00 N -ATOM 4298 HE21 GLN 275 21.301 -1.808 -0.355 1.00 0.00 H -ATOM 4299 HE22 GLN 275 20.197 -2.106 0.983 1.00 0.00 H -ATOM 4300 C GLN 275 16.784 0.885 -0.535 1.00 0.00 C -ATOM 4301 O GLN 275 16.877 -0.152 -1.042 1.00 0.00 O -ATOM 4302 N SER 276 15.680 1.267 0.122 1.00 0.00 N -ATOM 4303 H SER 276 15.541 2.189 0.510 1.00 0.00 H -ATOM 4304 CA SER 276 14.409 0.536 0.101 1.00 0.00 C -ATOM 4305 HA SER 276 14.607 -0.377 0.662 1.00 0.00 H -ATOM 4306 CB SER 276 13.494 1.365 0.992 1.00 0.00 C -ATOM 4307 HB2 SER 276 12.520 0.880 1.064 1.00 0.00 H -ATOM 4308 HB3 SER 276 13.945 1.389 1.984 1.00 0.00 H -ATOM 4309 OG SER 276 13.315 2.697 0.538 1.00 0.00 O -ATOM 4310 HG SER 276 13.946 3.303 0.931 1.00 0.00 H -ATOM 4311 C SER 276 13.790 0.292 -1.239 1.00 0.00 C -ATOM 4312 O SER 276 13.144 -0.741 -1.417 1.00 0.00 O -ATOM 4313 N LEU 277 13.874 1.277 -2.137 1.00 0.00 N -ATOM 4314 H LEU 277 14.239 2.170 -1.838 1.00 0.00 H -ATOM 4315 CA LEU 277 13.165 1.184 -3.476 1.00 0.00 C -ATOM 4316 HA LEU 277 12.245 0.622 -3.315 1.00 0.00 H -ATOM 4317 CB LEU 277 12.739 2.547 -4.046 1.00 0.00 C -ATOM 4318 HB2 LEU 277 12.253 3.118 -3.255 1.00 0.00 H -ATOM 4319 HB3 LEU 277 13.640 3.035 -4.419 1.00 0.00 H -ATOM 4320 CG LEU 277 11.872 2.430 -5.331 1.00 0.00 C -ATOM 4321 HG LEU 277 12.210 1.867 -6.201 1.00 0.00 H -ATOM 4322 CD1 LEU 277 10.486 1.823 -5.020 1.00 0.00 C -ATOM 4323 HD11 LEU 277 9.930 2.345 -4.241 1.00 0.00 H -ATOM 4324 HD12 LEU 277 9.893 1.823 -5.934 1.00 0.00 H -ATOM 4325 HD13 LEU 277 10.603 0.783 -4.716 1.00 0.00 H -ATOM 4326 CD2 LEU 277 11.535 3.847 -5.932 1.00 0.00 C -ATOM 4327 HD21 LEU 277 12.444 4.377 -6.215 1.00 0.00 H -ATOM 4328 HD22 LEU 277 10.886 3.823 -6.808 1.00 0.00 H -ATOM 4329 HD23 LEU 277 11.060 4.565 -5.263 1.00 0.00 H -ATOM 4330 C LEU 277 14.012 0.303 -4.369 1.00 0.00 C -ATOM 4331 O LEU 277 13.533 -0.490 -5.145 1.00 0.00 O -ATOM 4332 N LEU 278 15.294 0.608 -4.351 1.00 0.00 N -ATOM 4333 H LEU 278 15.598 1.368 -3.760 1.00 0.00 H -ATOM 4334 CA LEU 278 16.334 -0.130 -5.078 1.00 0.00 C -ATOM 4335 HA LEU 278 16.023 -0.041 -6.119 1.00 0.00 H -ATOM 4336 CB LEU 278 17.663 0.529 -4.913 1.00 0.00 C -ATOM 4337 HB2 LEU 278 17.839 0.673 -3.847 1.00 0.00 H -ATOM 4338 HB3 LEU 278 18.437 -0.067 -5.396 1.00 0.00 H -ATOM 4339 CG LEU 278 17.767 1.913 -5.601 1.00 0.00 C -ATOM 4340 HG LEU 278 16.931 2.542 -5.295 1.00 0.00 H -ATOM 4341 CD1 LEU 278 19.126 2.545 -5.284 1.00 0.00 C -ATOM 4342 HD11 LEU 278 19.128 2.880 -4.246 1.00 0.00 H -ATOM 4343 HD12 LEU 278 19.966 1.894 -5.526 1.00 0.00 H -ATOM 4344 HD13 LEU 278 19.354 3.424 -5.886 1.00 0.00 H -ATOM 4345 CD2 LEU 278 17.821 1.806 -7.136 1.00 0.00 C -ATOM 4346 HD21 LEU 278 17.316 2.621 -7.654 1.00 0.00 H -ATOM 4347 HD22 LEU 278 18.827 1.876 -7.548 1.00 0.00 H -ATOM 4348 HD23 LEU 278 17.331 0.860 -7.371 1.00 0.00 H -ATOM 4349 C LEU 278 16.296 -1.611 -4.710 1.00 0.00 C -ATOM 4350 O LEU 278 16.336 -2.460 -5.569 1.00 0.00 O -ATOM 4351 N THR 279 16.242 -1.860 -3.370 1.00 0.00 N -ATOM 4352 H THR 279 16.413 -1.170 -2.652 1.00 0.00 H -ATOM 4353 CA THR 279 16.036 -3.200 -2.804 1.00 0.00 C -ATOM 4354 HA THR 279 16.739 -3.825 -3.354 1.00 0.00 H -ATOM 4355 CB THR 279 16.254 -3.247 -1.245 1.00 0.00 C -ATOM 4356 HB THR 279 15.418 -2.706 -0.802 1.00 0.00 H -ATOM 4357 CG2 THR 279 16.236 -4.631 -0.671 1.00 0.00 C -ATOM 4358 HG21 THR 279 15.223 -5.000 -0.832 1.00 0.00 H -ATOM 4359 HG22 THR 279 16.898 -5.352 -1.151 1.00 0.00 H -ATOM 4360 HG23 THR 279 16.403 -4.669 0.406 1.00 0.00 H -ATOM 4361 OG1 THR 279 17.503 -2.754 -0.759 1.00 0.00 O -ATOM 4362 HG1 THR 279 17.550 -1.800 -0.855 1.00 0.00 H -ATOM 4363 C THR 279 14.664 -3.781 -3.234 1.00 0.00 C -ATOM 4364 O THR 279 14.666 -4.980 -3.544 1.00 0.00 O -ATOM 4365 N LEU 280 13.553 -3.032 -3.299 1.00 0.00 N -ATOM 4366 H LEU 280 13.574 -2.048 -3.071 1.00 0.00 H -ATOM 4367 CA LEU 280 12.268 -3.583 -3.801 1.00 0.00 C -ATOM 4368 HA LEU 280 12.011 -4.447 -3.188 1.00 0.00 H -ATOM 4369 CB LEU 280 11.151 -2.523 -3.530 1.00 0.00 C -ATOM 4370 HB2 LEU 280 11.161 -2.467 -2.441 1.00 0.00 H -ATOM 4371 HB3 LEU 280 11.376 -1.564 -3.998 1.00 0.00 H -ATOM 4372 CG LEU 280 9.780 -3.132 -3.926 1.00 0.00 C -ATOM 4373 HG LEU 280 9.789 -3.743 -4.828 1.00 0.00 H -ATOM 4374 CD1 LEU 280 9.180 -4.084 -2.855 1.00 0.00 C -ATOM 4375 HD11 LEU 280 8.166 -4.372 -3.135 1.00 0.00 H -ATOM 4376 HD12 LEU 280 9.931 -4.827 -2.588 1.00 0.00 H -ATOM 4377 HD13 LEU 280 9.069 -3.506 -1.937 1.00 0.00 H -ATOM 4378 CD2 LEU 280 8.783 -1.991 -4.261 1.00 0.00 C -ATOM 4379 HD21 LEU 280 7.800 -2.434 -4.420 1.00 0.00 H -ATOM 4380 HD22 LEU 280 8.650 -1.229 -3.493 1.00 0.00 H -ATOM 4381 HD23 LEU 280 9.089 -1.579 -5.222 1.00 0.00 H -ATOM 4382 C LEU 280 12.460 -3.991 -5.307 1.00 0.00 C -ATOM 4383 O LEU 280 12.041 -5.087 -5.660 1.00 0.00 O -ATOM 4384 N GLY 281 13.148 -3.223 -6.144 1.00 0.00 N -ATOM 4385 H GLY 281 13.381 -2.321 -5.754 1.00 0.00 H -ATOM 4386 CA GLY 281 13.465 -3.471 -7.591 1.00 0.00 C -ATOM 4387 HA2 GLY 281 12.489 -3.588 -8.061 1.00 0.00 H -ATOM 4388 HA3 GLY 281 14.066 -2.641 -7.963 1.00 0.00 H -ATOM 4389 C GLY 281 14.246 -4.750 -7.729 1.00 0.00 C -ATOM 4390 O GLY 281 13.969 -5.529 -8.682 1.00 0.00 O -ATOM 4391 N ARG 282 15.258 -4.996 -6.917 1.00 0.00 N -ATOM 4392 H ARG 282 15.634 -4.265 -6.331 1.00 0.00 H -ATOM 4393 CA ARG 282 16.025 -6.252 -6.921 1.00 0.00 C -ATOM 4394 HA ARG 282 16.353 -6.485 -7.934 1.00 0.00 H -ATOM 4395 CB ARG 282 17.259 -6.057 -5.987 1.00 0.00 C -ATOM 4396 HB2 ARG 282 16.862 -5.604 -5.079 1.00 0.00 H -ATOM 4397 HB3 ARG 282 17.669 -7.040 -5.757 1.00 0.00 H -ATOM 4398 CG ARG 282 18.287 -5.138 -6.662 1.00 0.00 C -ATOM 4399 HG2 ARG 282 18.443 -5.466 -7.690 1.00 0.00 H -ATOM 4400 HG3 ARG 282 17.910 -4.118 -6.726 1.00 0.00 H -ATOM 4401 CD ARG 282 19.603 -4.864 -5.913 1.00 0.00 C -ATOM 4402 HD2 ARG 282 20.124 -4.131 -6.529 1.00 0.00 H -ATOM 4403 HD3 ARG 282 19.398 -4.456 -4.923 1.00 0.00 H -ATOM 4404 NE ARG 282 20.496 -6.046 -5.834 1.00 0.00 N -ATOM 4405 HE ARG 282 20.989 -6.219 -6.698 1.00 0.00 H -ATOM 4406 CZ ARG 282 20.652 -6.908 -4.856 1.00 0.00 C -ATOM 4407 NH1 ARG 282 20.329 -6.527 -3.606 1.00 0.00 N -ATOM 4408 HH11 ARG 282 20.131 -5.565 -3.372 1.00 0.00 H -ATOM 4409 HH12 ARG 282 20.626 -7.219 -2.932 1.00 0.00 H -ATOM 4410 NH2 ARG 282 21.193 -8.066 -4.980 1.00 0.00 N -ATOM 4411 HH21 ARG 282 21.375 -8.411 -5.912 1.00 0.00 H -ATOM 4412 HH22 ARG 282 21.336 -8.545 -4.103 1.00 0.00 H -ATOM 4413 C ARG 282 15.187 -7.456 -6.378 1.00 0.00 C -ATOM 4414 O ARG 282 15.357 -8.512 -6.979 1.00 0.00 O -ATOM 4415 N VAL 283 14.398 -7.282 -5.340 1.00 0.00 N -ATOM 4416 H VAL 283 14.290 -6.363 -4.935 1.00 0.00 H -ATOM 4417 CA VAL 283 13.469 -8.351 -4.876 1.00 0.00 C -ATOM 4418 HA VAL 283 14.119 -9.201 -4.666 1.00 0.00 H -ATOM 4419 CB VAL 283 12.752 -7.951 -3.566 1.00 0.00 C -ATOM 4420 HB VAL 283 12.417 -6.919 -3.675 1.00 0.00 H -ATOM 4421 CG1 VAL 283 11.552 -8.852 -3.158 1.00 0.00 C -ATOM 4422 HG11 VAL 283 11.282 -8.717 -2.110 1.00 0.00 H -ATOM 4423 HG12 VAL 283 10.659 -8.753 -3.775 1.00 0.00 H -ATOM 4424 HG13 VAL 283 11.863 -9.871 -3.387 1.00 0.00 H -ATOM 4425 CG2 VAL 283 13.678 -7.885 -2.317 1.00 0.00 C -ATOM 4426 HG21 VAL 283 14.661 -7.478 -2.553 1.00 0.00 H -ATOM 4427 HG22 VAL 283 13.096 -7.378 -1.548 1.00 0.00 H -ATOM 4428 HG23 VAL 283 13.831 -8.929 -2.045 1.00 0.00 H -ATOM 4429 C VAL 283 12.507 -8.708 -5.997 1.00 0.00 C -ATOM 4430 O VAL 283 12.483 -9.868 -6.308 1.00 0.00 O -ATOM 4431 N ILE 284 11.855 -7.807 -6.712 1.00 0.00 N -ATOM 4432 H ILE 284 11.956 -6.859 -6.377 1.00 0.00 H -ATOM 4433 CA ILE 284 10.943 -8.098 -7.863 1.00 0.00 C -ATOM 4434 HA ILE 284 10.318 -8.941 -7.570 1.00 0.00 H -ATOM 4435 CB ILE 284 10.141 -6.761 -8.219 1.00 0.00 C -ATOM 4436 HB ILE 284 10.790 -5.888 -8.284 1.00 0.00 H -ATOM 4437 CG2 ILE 284 9.537 -6.948 -9.630 1.00 0.00 C -ATOM 4438 HG21 ILE 284 8.954 -6.110 -10.011 1.00 0.00 H -ATOM 4439 HG22 ILE 284 10.367 -7.031 -10.332 1.00 0.00 H -ATOM 4440 HG23 ILE 284 9.034 -7.914 -9.671 1.00 0.00 H -ATOM 4441 CG1 ILE 284 9.149 -6.342 -7.095 1.00 0.00 C -ATOM 4442 HG12 ILE 284 8.376 -7.100 -6.967 1.00 0.00 H -ATOM 4443 HG13 ILE 284 9.769 -6.332 -6.198 1.00 0.00 H -ATOM 4444 CD1 ILE 284 8.516 -4.942 -7.368 1.00 0.00 C -ATOM 4445 HD11 ILE 284 9.240 -4.135 -7.252 1.00 0.00 H -ATOM 4446 HD12 ILE 284 8.046 -4.836 -8.346 1.00 0.00 H -ATOM 4447 HD13 ILE 284 7.754 -4.890 -6.591 1.00 0.00 H -ATOM 4448 C ILE 284 11.690 -8.686 -9.057 1.00 0.00 C -ATOM 4449 O ILE 284 11.237 -9.571 -9.680 1.00 0.00 O -ATOM 4450 N THR 285 12.994 -8.396 -9.171 1.00 0.00 N -ATOM 4451 H THR 285 13.353 -7.612 -8.645 1.00 0.00 H -ATOM 4452 CA THR 285 13.822 -9.053 -10.194 1.00 0.00 C -ATOM 4453 HA THR 285 13.259 -9.221 -11.113 1.00 0.00 H -ATOM 4454 CB THR 285 15.092 -8.242 -10.520 1.00 0.00 C -ATOM 4455 HB THR 285 15.695 -8.017 -9.640 1.00 0.00 H -ATOM 4456 CG2 THR 285 15.927 -9.015 -11.566 1.00 0.00 C -ATOM 4457 HG21 THR 285 16.316 -9.939 -11.137 1.00 0.00 H -ATOM 4458 HG22 THR 285 15.277 -9.303 -12.392 1.00 0.00 H -ATOM 4459 HG23 THR 285 16.675 -8.342 -11.986 1.00 0.00 H -ATOM 4460 OG1 THR 285 14.586 -6.974 -10.961 1.00 0.00 O -ATOM 4461 HG1 THR 285 14.267 -6.514 -10.181 1.00 0.00 H -ATOM 4462 C THR 285 14.177 -10.485 -9.756 1.00 0.00 C -ATOM 4463 O THR 285 13.844 -11.397 -10.541 1.00 0.00 O -ATOM 4464 N ALA 286 14.614 -10.775 -8.521 1.00 0.00 N -ATOM 4465 H ALA 286 14.832 -10.012 -7.895 1.00 0.00 H -ATOM 4466 CA ALA 286 15.048 -12.147 -8.157 1.00 0.00 C -ATOM 4467 HA ALA 286 15.767 -12.564 -8.861 1.00 0.00 H -ATOM 4468 CB ALA 286 15.586 -11.937 -6.710 1.00 0.00 C -ATOM 4469 HB1 ALA 286 14.832 -11.414 -6.121 1.00 0.00 H -ATOM 4470 HB2 ALA 286 15.977 -12.865 -6.293 1.00 0.00 H -ATOM 4471 HB3 ALA 286 16.487 -11.331 -6.799 1.00 0.00 H -ATOM 4472 C ALA 286 13.815 -13.101 -8.092 1.00 0.00 C -ATOM 4473 O ALA 286 13.913 -14.281 -8.337 1.00 0.00 O -ATOM 4474 N LEU 287 12.604 -12.624 -7.760 1.00 0.00 N -ATOM 4475 H LEU 287 12.379 -11.666 -7.534 1.00 0.00 H -ATOM 4476 CA LEU 287 11.407 -13.491 -7.719 1.00 0.00 C -ATOM 4477 HA LEU 287 11.600 -14.426 -7.194 1.00 0.00 H -ATOM 4478 CB LEU 287 10.319 -12.718 -6.919 1.00 0.00 C -ATOM 4479 HB2 LEU 287 10.248 -11.712 -7.332 1.00 0.00 H -ATOM 4480 HB3 LEU 287 9.378 -13.261 -7.013 1.00 0.00 H -ATOM 4481 CG LEU 287 10.689 -12.684 -5.442 1.00 0.00 C -ATOM 4482 HG LEU 287 11.629 -12.214 -5.154 1.00 0.00 H -ATOM 4483 CD1 LEU 287 9.688 -11.702 -4.778 1.00 0.00 C -ATOM 4484 HD11 LEU 287 9.902 -10.727 -5.215 1.00 0.00 H -ATOM 4485 HD12 LEU 287 8.691 -11.884 -5.177 1.00 0.00 H -ATOM 4486 HD13 LEU 287 9.865 -11.694 -3.702 1.00 0.00 H -ATOM 4487 CD2 LEU 287 10.510 -13.900 -4.662 1.00 0.00 C -ATOM 4488 HD21 LEU 287 9.542 -14.277 -4.992 1.00 0.00 H -ATOM 4489 HD22 LEU 287 11.281 -14.572 -5.040 1.00 0.00 H -ATOM 4490 HD23 LEU 287 10.622 -13.839 -3.580 1.00 0.00 H -ATOM 4491 C LEU 287 10.941 -13.914 -9.134 1.00 0.00 C -ATOM 4492 O LEU 287 10.232 -14.910 -9.266 1.00 0.00 O -ATOM 4493 N VAL 288 11.234 -13.087 -10.160 1.00 0.00 N -ATOM 4494 H VAL 288 11.897 -12.386 -9.861 1.00 0.00 H -ATOM 4495 CA VAL 288 10.918 -13.263 -11.600 1.00 0.00 C -ATOM 4496 HA VAL 288 10.119 -13.997 -11.696 1.00 0.00 H -ATOM 4497 CB VAL 288 10.434 -12.016 -12.401 1.00 0.00 C -ATOM 4498 HB VAL 288 11.208 -11.255 -12.311 1.00 0.00 H -ATOM 4499 CG1 VAL 288 10.175 -12.385 -13.911 1.00 0.00 C -ATOM 4500 HG11 VAL 288 9.482 -13.221 -13.818 1.00 0.00 H -ATOM 4501 HG12 VAL 288 9.667 -11.582 -14.445 1.00 0.00 H -ATOM 4502 HG13 VAL 288 11.111 -12.668 -14.392 1.00 0.00 H -ATOM 4503 CG2 VAL 288 9.216 -11.568 -11.530 1.00 0.00 C -ATOM 4504 HG21 VAL 288 9.595 -11.149 -10.598 1.00 0.00 H -ATOM 4505 HG22 VAL 288 8.633 -10.786 -12.017 1.00 0.00 H -ATOM 4506 HG23 VAL 288 8.734 -12.518 -11.298 1.00 0.00 H -ATOM 4507 C VAL 288 12.024 -14.004 -12.394 1.00 0.00 C -ATOM 4508 O VAL 288 11.813 -14.916 -13.213 1.00 0.00 O -ATOM 4509 N GLU 289 13.299 -13.760 -12.109 1.00 0.00 N -ATOM 4510 H GLU 289 13.468 -12.939 -11.546 1.00 0.00 H -ATOM 4511 CA GLU 289 14.423 -14.610 -12.560 1.00 0.00 C -ATOM 4512 HA GLU 289 14.176 -15.027 -13.537 1.00 0.00 H -ATOM 4513 CB GLU 289 15.633 -13.764 -12.826 1.00 0.00 C -ATOM 4514 HB2 GLU 289 16.027 -13.391 -11.881 1.00 0.00 H -ATOM 4515 HB3 GLU 289 16.391 -14.462 -13.182 1.00 0.00 H -ATOM 4516 CG GLU 289 15.383 -12.625 -13.801 1.00 0.00 C -ATOM 4517 HG2 GLU 289 14.583 -11.977 -13.443 1.00 0.00 H -ATOM 4518 HG3 GLU 289 16.233 -11.953 -13.923 1.00 0.00 H -ATOM 4519 CD GLU 289 14.898 -13.047 -15.230 1.00 0.00 C -ATOM 4520 OE1 GLU 289 15.340 -14.003 -15.842 1.00 0.00 O -ATOM 4521 OE2 GLU 289 14.078 -12.342 -15.842 1.00 0.00 O -ATOM 4522 C GLU 289 14.625 -15.888 -11.695 1.00 0.00 C -ATOM 4523 O GLU 289 15.493 -16.712 -11.917 1.00 0.00 O -ATOM 4524 N ARG 290 13.744 -16.070 -10.683 1.00 0.00 N -ATOM 4525 H ARG 290 13.061 -15.369 -10.432 1.00 0.00 H -ATOM 4526 CA ARG 290 13.708 -17.277 -9.776 1.00 0.00 C -ATOM 4527 HA ARG 290 12.952 -16.941 -9.066 1.00 0.00 H -ATOM 4528 CB ARG 290 13.238 -18.582 -10.437 1.00 0.00 C -ATOM 4529 HB2 ARG 290 14.003 -18.876 -11.156 1.00 0.00 H -ATOM 4530 HB3 ARG 290 13.191 -19.299 -9.618 1.00 0.00 H -ATOM 4531 CG ARG 290 11.767 -18.497 -11.017 1.00 0.00 C -ATOM 4532 HG2 ARG 290 11.166 -18.213 -10.153 1.00 0.00 H -ATOM 4533 HG3 ARG 290 11.654 -17.609 -11.638 1.00 0.00 H -ATOM 4534 CD ARG 290 11.185 -19.693 -11.750 1.00 0.00 C -ATOM 4535 HD2 ARG 290 12.085 -20.106 -12.207 1.00 0.00 H -ATOM 4536 HD3 ARG 290 10.802 -20.342 -10.962 1.00 0.00 H -ATOM 4537 NE ARG 290 10.231 -19.348 -12.724 1.00 0.00 N -ATOM 4538 HE ARG 290 9.952 -18.395 -12.909 1.00 0.00 H -ATOM 4539 CZ ARG 290 9.675 -20.209 -13.549 1.00 0.00 C -ATOM 4540 NH1 ARG 290 9.752 -21.480 -13.442 1.00 0.00 N -ATOM 4541 HH11 ARG 290 10.076 -21.883 -12.574 1.00 0.00 H -ATOM 4542 HH12 ARG 290 9.259 -22.099 -14.069 1.00 0.00 H -ATOM 4543 NH2 ARG 290 8.980 -19.832 -14.609 1.00 0.00 N -ATOM 4544 HH21 ARG 290 9.055 -18.878 -14.931 1.00 0.00 H -ATOM 4545 HH22 ARG 290 8.318 -20.434 -15.077 1.00 0.00 H -ATOM 4546 C ARG 290 15.008 -17.446 -8.963 1.00 0.00 C -ATOM 4547 O ARG 290 15.384 -18.619 -8.637 1.00 0.00 O -ATOM 4548 N THR 291 15.686 -16.325 -8.657 1.00 0.00 N -ATOM 4549 H THR 291 15.277 -15.449 -8.952 1.00 0.00 H -ATOM 4550 CA THR 291 16.976 -16.478 -8.072 1.00 0.00 C -ATOM 4551 HA THR 291 17.697 -17.148 -8.541 1.00 0.00 H -ATOM 4552 CB THR 291 17.611 -15.080 -8.099 1.00 0.00 C -ATOM 4553 HB THR 291 16.847 -14.465 -7.623 1.00 0.00 H -ATOM 4554 CG2 THR 291 19.024 -14.925 -7.464 1.00 0.00 C -ATOM 4555 HG21 THR 291 19.222 -13.857 -7.547 1.00 0.00 H -ATOM 4556 HG22 THR 291 19.063 -15.293 -6.438 1.00 0.00 H -ATOM 4557 HG23 THR 291 19.739 -15.378 -8.151 1.00 0.00 H -ATOM 4558 OG1 THR 291 17.697 -14.597 -9.437 1.00 0.00 O -ATOM 4559 HG1 THR 291 18.039 -15.274 -10.024 1.00 0.00 H -ATOM 4560 C THR 291 16.828 -16.799 -6.588 1.00 0.00 C -ATOM 4561 O THR 291 16.211 -16.054 -5.799 1.00 0.00 O -ATOM 4562 N PRO 292 17.401 -17.924 -6.102 1.00 0.00 N -ATOM 4563 CD PRO 292 18.019 -18.943 -6.825 1.00 0.00 C -ATOM 4564 HD2 PRO 292 19.039 -18.668 -7.092 1.00 0.00 H -ATOM 4565 HD3 PRO 292 17.428 -19.096 -7.728 1.00 0.00 H -ATOM 4566 CG PRO 292 17.946 -20.239 -6.025 1.00 0.00 C -ATOM 4567 HG2 PRO 292 18.816 -20.867 -6.216 1.00 0.00 H -ATOM 4568 HG3 PRO 292 17.030 -20.781 -6.258 1.00 0.00 H -ATOM 4569 CB PRO 292 17.941 -19.686 -4.620 1.00 0.00 C -ATOM 4570 HB2 PRO 292 18.989 -19.491 -4.394 1.00 0.00 H -ATOM 4571 HB3 PRO 292 17.466 -20.285 -3.844 1.00 0.00 H -ATOM 4572 CA PRO 292 17.176 -18.369 -4.755 1.00 0.00 C -ATOM 4573 HA PRO 292 16.107 -18.574 -4.813 1.00 0.00 H -ATOM 4574 C PRO 292 17.548 -17.333 -3.710 1.00 0.00 C -ATOM 4575 O PRO 292 16.853 -17.034 -2.701 1.00 0.00 O -ATOM 4576 N HIE 293 18.629 -16.581 -3.946 1.00 0.00 N -ATOM 4577 H HIE 293 19.174 -16.801 -4.767 1.00 0.00 H -ATOM 4578 CA HIE 293 19.213 -15.475 -3.248 1.00 0.00 C -ATOM 4579 HA HIE 293 19.522 -15.663 -2.220 1.00 0.00 H -ATOM 4580 CB HIE 293 20.662 -15.250 -3.859 1.00 0.00 C -ATOM 4581 HB2 HIE 293 20.631 -14.661 -4.776 1.00 0.00 H -ATOM 4582 HB3 HIE 293 21.282 -14.698 -3.153 1.00 0.00 H -ATOM 4583 CG HIE 293 21.405 -16.510 -4.235 1.00 0.00 C -ATOM 4584 ND1 HIE 293 21.481 -17.013 -5.574 1.00 0.00 N -ATOM 4585 CE1 HIE 293 21.977 -18.259 -5.509 1.00 0.00 C -ATOM 4586 HE1 HIE 293 22.185 -18.958 -6.306 1.00 0.00 H -ATOM 4587 NE2 HIE 293 22.271 -18.513 -4.215 1.00 0.00 N -ATOM 4588 HE2 HIE 293 22.756 -19.334 -3.881 1.00 0.00 H -ATOM 4589 CD2 HIE 293 21.877 -17.471 -3.381 1.00 0.00 C -ATOM 4590 HD2 HIE 293 22.052 -17.387 -2.318 1.00 0.00 H -ATOM 4591 C HIE 293 18.353 -14.245 -3.293 1.00 0.00 C -ATOM 4592 O HIE 293 18.786 -13.333 -3.960 1.00 0.00 O -ATOM 4593 N VAL 294 17.199 -14.181 -2.668 1.00 0.00 N -ATOM 4594 H VAL 294 16.824 -15.056 -2.330 1.00 0.00 H -ATOM 4595 CA VAL 294 16.313 -12.985 -2.798 1.00 0.00 C -ATOM 4596 HA VAL 294 16.421 -12.485 -3.761 1.00 0.00 H -ATOM 4597 CB VAL 294 14.787 -13.374 -2.839 1.00 0.00 C -ATOM 4598 HB VAL 294 14.470 -13.882 -1.928 1.00 0.00 H -ATOM 4599 CG1 VAL 294 13.787 -12.186 -3.035 1.00 0.00 C -ATOM 4600 HG11 VAL 294 14.002 -11.669 -3.970 1.00 0.00 H -ATOM 4601 HG12 VAL 294 12.763 -12.556 -2.986 1.00 0.00 H -ATOM 4602 HG13 VAL 294 13.943 -11.482 -2.217 1.00 0.00 H -ATOM 4603 CG2 VAL 294 14.423 -14.396 -3.972 1.00 0.00 C -ATOM 4604 HG21 VAL 294 14.791 -15.386 -3.703 1.00 0.00 H -ATOM 4605 HG22 VAL 294 13.336 -14.445 -3.913 1.00 0.00 H -ATOM 4606 HG23 VAL 294 14.785 -14.045 -4.939 1.00 0.00 H -ATOM 4607 C VAL 294 16.586 -11.932 -1.724 1.00 0.00 C -ATOM 4608 O VAL 294 16.538 -12.317 -0.553 1.00 0.00 O -ATOM 4609 N PRO 295 16.867 -10.610 -2.037 1.00 0.00 N -ATOM 4610 CD PRO 295 16.835 -9.989 -3.345 1.00 0.00 C -ATOM 4611 HD2 PRO 295 15.800 -9.821 -3.641 1.00 0.00 H -ATOM 4612 HD3 PRO 295 17.465 -10.585 -4.005 1.00 0.00 H -ATOM 4613 CG PRO 295 17.476 -8.584 -3.255 1.00 0.00 C -ATOM 4614 HG2 PRO 295 16.695 -7.856 -3.035 1.00 0.00 H -ATOM 4615 HG3 PRO 295 18.013 -8.332 -4.169 1.00 0.00 H -ATOM 4616 CB PRO 295 18.391 -8.857 -2.091 1.00 0.00 C -ATOM 4617 HB2 PRO 295 18.704 -7.907 -1.660 1.00 0.00 H -ATOM 4618 HB3 PRO 295 19.267 -9.416 -2.421 1.00 0.00 H -ATOM 4619 CA PRO 295 17.588 -9.736 -1.119 1.00 0.00 C -ATOM 4620 HA PRO 295 18.365 -10.322 -0.627 1.00 0.00 H -ATOM 4621 C PRO 295 16.699 -8.949 -0.079 1.00 0.00 C -ATOM 4622 O PRO 295 17.043 -7.819 0.153 1.00 0.00 O -ATOM 4623 N TYR 296 15.606 -9.550 0.449 1.00 0.00 N -ATOM 4624 H TYR 296 15.282 -10.431 0.076 1.00 0.00 H -ATOM 4625 CA TYR 296 14.893 -9.016 1.620 1.00 0.00 C -ATOM 4626 HA TYR 296 14.132 -8.375 1.174 1.00 0.00 H -ATOM 4627 CB TYR 296 14.148 -10.087 2.385 1.00 0.00 C -ATOM 4628 HB2 TYR 296 14.923 -10.653 2.901 1.00 0.00 H -ATOM 4629 HB3 TYR 296 13.512 -9.621 3.137 1.00 0.00 H -ATOM 4630 CG TYR 296 13.284 -10.949 1.538 1.00 0.00 C -ATOM 4631 CD1 TYR 296 12.110 -10.436 0.996 1.00 0.00 C -ATOM 4632 HD1 TYR 296 11.864 -9.413 1.240 1.00 0.00 H -ATOM 4633 CE1 TYR 296 11.377 -11.153 0.063 1.00 0.00 C -ATOM 4634 HE1 TYR 296 10.492 -10.753 -0.409 1.00 0.00 H -ATOM 4635 CZ TYR 296 11.611 -12.581 -0.127 1.00 0.00 C -ATOM 4636 OH TYR 296 10.694 -13.304 -0.855 1.00 0.00 O -ATOM 4637 HH TYR 296 9.895 -12.817 -1.069 1.00 0.00 H -ATOM 4638 CE2 TYR 296 12.869 -13.065 0.384 1.00 0.00 C -ATOM 4639 HE2 TYR 296 13.153 -14.055 0.059 1.00 0.00 H -ATOM 4640 CD2 TYR 296 13.746 -12.261 1.229 1.00 0.00 C -ATOM 4641 HD2 TYR 296 14.646 -12.665 1.668 1.00 0.00 H -ATOM 4642 C TYR 296 15.677 -8.270 2.729 1.00 0.00 C -ATOM 4643 O TYR 296 15.028 -7.352 3.226 1.00 0.00 O -ATOM 4644 N ARG 297 16.957 -8.689 3.061 1.00 0.00 N -ATOM 4645 H ARG 297 17.244 -9.565 2.650 1.00 0.00 H -ATOM 4646 CA ARG 297 17.773 -8.121 4.129 1.00 0.00 C -ATOM 4647 HA ARG 297 17.133 -7.889 4.981 1.00 0.00 H -ATOM 4648 CB ARG 297 18.626 -9.152 4.696 1.00 0.00 C -ATOM 4649 HB2 ARG 297 19.395 -9.503 4.009 1.00 0.00 H -ATOM 4650 HB3 ARG 297 19.196 -8.652 5.479 1.00 0.00 H -ATOM 4651 CG ARG 297 18.090 -10.372 5.472 1.00 0.00 C -ATOM 4652 HG2 ARG 297 17.560 -10.070 6.376 1.00 0.00 H -ATOM 4653 HG3 ARG 297 17.334 -10.848 4.847 1.00 0.00 H -ATOM 4654 CD ARG 297 19.209 -11.337 5.845 1.00 0.00 C -ATOM 4655 HD2 ARG 297 19.390 -11.823 4.886 1.00 0.00 H -ATOM 4656 HD3 ARG 297 20.098 -10.874 6.272 1.00 0.00 H -ATOM 4657 NE ARG 297 18.571 -12.374 6.790 1.00 0.00 N -ATOM 4658 HE ARG 297 18.400 -13.315 6.466 1.00 0.00 H -ATOM 4659 CZ ARG 297 18.484 -12.169 8.083 1.00 0.00 C -ATOM 4660 NH1 ARG 297 19.015 -11.121 8.627 1.00 0.00 N -ATOM 4661 HH11 ARG 297 19.266 -10.316 8.072 1.00 0.00 H -ATOM 4662 HH12 ARG 297 19.069 -11.079 9.635 1.00 0.00 H -ATOM 4663 NH2 ARG 297 17.925 -13.035 8.858 1.00 0.00 N -ATOM 4664 HH21 ARG 297 17.956 -14.011 8.598 1.00 0.00 H -ATOM 4665 HH22 ARG 297 17.802 -12.748 9.819 1.00 0.00 H -ATOM 4666 C ARG 297 18.482 -6.825 3.872 1.00 0.00 C -ATOM 4667 O ARG 297 18.982 -6.229 4.828 1.00 0.00 O -ATOM 4668 N GLU 298 18.551 -6.415 2.623 1.00 0.00 N -ATOM 4669 H GLU 298 18.147 -6.996 1.903 1.00 0.00 H -ATOM 4670 CA GLU 298 19.208 -5.172 2.253 1.00 0.00 C -ATOM 4671 HA GLU 298 20.137 -5.104 2.819 1.00 0.00 H -ATOM 4672 CB GLU 298 19.693 -5.170 0.809 1.00 0.00 C -ATOM 4673 HB2 GLU 298 18.891 -5.008 0.089 1.00 0.00 H -ATOM 4674 HB3 GLU 298 20.363 -4.318 0.696 1.00 0.00 H -ATOM 4675 CG GLU 298 20.538 -6.372 0.276 1.00 0.00 C -ATOM 4676 HG2 GLU 298 19.841 -7.206 0.352 1.00 0.00 H -ATOM 4677 HG3 GLU 298 20.855 -6.299 -0.764 1.00 0.00 H -ATOM 4678 CD GLU 298 21.792 -6.642 1.169 1.00 0.00 C -ATOM 4679 OE1 GLU 298 21.818 -7.636 1.921 1.00 0.00 O -ATOM 4680 OE2 GLU 298 22.836 -5.913 1.088 1.00 0.00 O -ATOM 4681 C GLU 298 18.477 -3.929 2.571 1.00 0.00 C -ATOM 4682 O GLU 298 19.071 -2.867 2.431 1.00 0.00 O -ATOM 4683 N SER 299 17.212 -4.048 2.978 1.00 0.00 N -ATOM 4684 H SER 299 16.852 -4.991 2.940 1.00 0.00 H -ATOM 4685 CA SER 299 16.402 -2.958 3.407 1.00 0.00 C -ATOM 4686 HA SER 299 17.129 -2.286 3.864 1.00 0.00 H -ATOM 4687 CB SER 299 15.833 -2.141 2.298 1.00 0.00 C -ATOM 4688 HB2 SER 299 16.642 -1.587 1.822 1.00 0.00 H -ATOM 4689 HB3 SER 299 15.270 -2.757 1.598 1.00 0.00 H -ATOM 4690 OG SER 299 15.013 -1.170 2.871 1.00 0.00 O -ATOM 4691 HG SER 299 15.578 -0.489 3.243 1.00 0.00 H -ATOM 4692 C SER 299 15.425 -3.376 4.452 1.00 0.00 C -ATOM 4693 O SER 299 14.726 -4.361 4.314 1.00 0.00 O -ATOM 4694 N LYS 300 15.202 -2.497 5.414 1.00 0.00 N -ATOM 4695 H LYS 300 15.705 -1.622 5.381 1.00 0.00 H -ATOM 4696 CA LYS 300 14.204 -2.700 6.544 1.00 0.00 C -ATOM 4697 HA LYS 300 14.451 -3.610 7.092 1.00 0.00 H -ATOM 4698 CB LYS 300 14.272 -1.483 7.528 1.00 0.00 C -ATOM 4699 HB2 LYS 300 14.195 -0.510 7.042 1.00 0.00 H -ATOM 4700 HB3 LYS 300 13.442 -1.658 8.212 1.00 0.00 H -ATOM 4701 CG LYS 300 15.478 -1.508 8.347 1.00 0.00 C -ATOM 4702 HG2 LYS 300 15.285 -2.091 9.247 1.00 0.00 H -ATOM 4703 HG3 LYS 300 16.235 -1.991 7.730 1.00 0.00 H -ATOM 4704 CD LYS 300 16.016 -0.106 8.771 1.00 0.00 C -ATOM 4705 HD2 LYS 300 16.044 0.516 7.877 1.00 0.00 H -ATOM 4706 HD3 LYS 300 15.404 0.401 9.517 1.00 0.00 H -ATOM 4707 CE LYS 300 17.467 -0.192 9.232 1.00 0.00 C -ATOM 4708 HE2 LYS 300 18.048 -0.784 8.525 1.00 0.00 H -ATOM 4709 HE3 LYS 300 17.802 0.845 9.229 1.00 0.00 H -ATOM 4710 NZ LYS 300 17.711 -0.620 10.631 1.00 0.00 N -ATOM 4711 HZ1 LYS 300 17.529 -1.596 10.815 1.00 0.00 H -ATOM 4712 HZ2 LYS 300 18.637 -0.399 10.968 1.00 0.00 H -ATOM 4713 HZ3 LYS 300 17.142 -0.163 11.329 1.00 0.00 H -ATOM 4714 C LYS 300 12.749 -2.883 6.089 1.00 0.00 C -ATOM 4715 O LYS 300 12.088 -3.773 6.602 1.00 0.00 O -ATOM 4716 N LEU 301 12.272 -1.965 5.209 1.00 0.00 N -ATOM 4717 H LEU 301 12.931 -1.283 4.863 1.00 0.00 H -ATOM 4718 CA LEU 301 10.935 -2.090 4.531 1.00 0.00 C -ATOM 4719 HA LEU 301 10.128 -1.822 5.213 1.00 0.00 H -ATOM 4720 CB LEU 301 10.878 -1.015 3.436 1.00 0.00 C -ATOM 4721 HB2 LEU 301 10.904 0.002 3.827 1.00 0.00 H -ATOM 4722 HB3 LEU 301 11.818 -1.022 2.884 1.00 0.00 H -ATOM 4723 CG LEU 301 9.733 -1.139 2.430 1.00 0.00 C -ATOM 4724 HG LEU 301 9.715 -2.152 2.029 1.00 0.00 H -ATOM 4725 CD1 LEU 301 8.409 -0.887 3.081 1.00 0.00 C -ATOM 4726 HD11 LEU 301 7.584 -1.022 2.382 1.00 0.00 H -ATOM 4727 HD12 LEU 301 8.205 -1.592 3.887 1.00 0.00 H -ATOM 4728 HD13 LEU 301 8.397 0.149 3.419 1.00 0.00 H -ATOM 4729 CD2 LEU 301 9.984 -0.150 1.244 1.00 0.00 C -ATOM 4730 HD21 LEU 301 9.097 -0.051 0.618 1.00 0.00 H -ATOM 4731 HD22 LEU 301 10.284 0.803 1.678 1.00 0.00 H -ATOM 4732 HD23 LEU 301 10.787 -0.592 0.654 1.00 0.00 H -ATOM 4733 C LEU 301 10.735 -3.469 3.957 1.00 0.00 C -ATOM 4734 O LEU 301 9.744 -4.154 4.297 1.00 0.00 O -ATOM 4735 N THR 302 11.715 -3.944 3.173 1.00 0.00 N -ATOM 4736 H THR 302 12.578 -3.422 3.107 1.00 0.00 H -ATOM 4737 CA THR 302 11.627 -5.300 2.638 1.00 0.00 C -ATOM 4738 HA THR 302 10.614 -5.477 2.276 1.00 0.00 H -ATOM 4739 CB THR 302 12.520 -5.574 1.385 1.00 0.00 C -ATOM 4740 HB THR 302 12.532 -6.660 1.291 1.00 0.00 H -ATOM 4741 CG2 THR 302 12.093 -4.848 0.104 1.00 0.00 C -ATOM 4742 HG21 THR 302 12.422 -3.811 0.038 1.00 0.00 H -ATOM 4743 HG22 THR 302 12.594 -5.407 -0.687 1.00 0.00 H -ATOM 4744 HG23 THR 302 11.046 -5.020 -0.145 1.00 0.00 H -ATOM 4745 OG1 THR 302 13.861 -5.157 1.705 1.00 0.00 O -ATOM 4746 HG1 THR 302 14.303 -5.806 2.257 1.00 0.00 H -ATOM 4747 C THR 302 11.863 -6.355 3.774 1.00 0.00 C -ATOM 4748 O THR 302 11.211 -7.399 3.737 1.00 0.00 O -ATOM 4749 N ARG 303 12.577 -6.047 4.867 1.00 0.00 N -ATOM 4750 H ARG 303 13.018 -5.139 4.873 1.00 0.00 H -ATOM 4751 CA ARG 303 12.691 -6.917 6.007 1.00 0.00 C -ATOM 4752 HA ARG 303 12.995 -7.896 5.636 1.00 0.00 H -ATOM 4753 CB ARG 303 13.881 -6.490 6.912 1.00 0.00 C -ATOM 4754 HB2 ARG 303 14.762 -6.159 6.362 1.00 0.00 H -ATOM 4755 HB3 ARG 303 13.555 -5.618 7.480 1.00 0.00 H -ATOM 4756 CG ARG 303 14.335 -7.666 7.839 1.00 0.00 C -ATOM 4757 HG2 ARG 303 14.615 -7.357 8.846 1.00 0.00 H -ATOM 4758 HG3 ARG 303 13.518 -8.381 7.941 1.00 0.00 H -ATOM 4759 CD ARG 303 15.454 -8.495 7.304 1.00 0.00 C -ATOM 4760 HD2 ARG 303 15.000 -8.932 6.415 1.00 0.00 H -ATOM 4761 HD3 ARG 303 16.380 -7.940 7.149 1.00 0.00 H -ATOM 4762 NE ARG 303 15.587 -9.653 8.229 1.00 0.00 N -ATOM 4763 HE ARG 303 15.177 -10.545 7.993 1.00 0.00 H -ATOM 4764 CZ ARG 303 16.192 -9.633 9.389 1.00 0.00 C -ATOM 4765 NH1 ARG 303 16.979 -8.702 9.844 1.00 0.00 N -ATOM 4766 HH11 ARG 303 16.946 -7.763 9.472 1.00 0.00 H -ATOM 4767 HH12 ARG 303 17.398 -8.785 10.759 1.00 0.00 H -ATOM 4768 NH2 ARG 303 16.029 -10.555 10.243 1.00 0.00 N -ATOM 4769 HH21 ARG 303 15.429 -11.342 10.040 1.00 0.00 H -ATOM 4770 HH22 ARG 303 16.467 -10.378 11.135 1.00 0.00 H -ATOM 4771 C ARG 303 11.361 -7.092 6.846 1.00 0.00 C -ATOM 4772 O ARG 303 11.027 -8.187 7.284 1.00 0.00 O -ATOM 4773 N ILE 304 10.638 -6.003 7.032 1.00 0.00 N -ATOM 4774 H ILE 304 11.009 -5.110 6.739 1.00 0.00 H -ATOM 4775 CA ILE 304 9.325 -6.063 7.646 1.00 0.00 C -ATOM 4776 HA ILE 304 9.560 -6.730 8.475 1.00 0.00 H -ATOM 4777 CB ILE 304 8.816 -4.674 8.279 1.00 0.00 C -ATOM 4778 HB ILE 304 9.732 -4.409 8.806 1.00 0.00 H -ATOM 4779 CG2 ILE 304 8.588 -3.536 7.226 1.00 0.00 C -ATOM 4780 HG21 ILE 304 8.019 -3.979 6.409 1.00 0.00 H -ATOM 4781 HG22 ILE 304 8.107 -2.635 7.608 1.00 0.00 H -ATOM 4782 HG23 ILE 304 9.615 -3.288 6.959 1.00 0.00 H -ATOM 4783 CG1 ILE 304 7.667 -4.804 9.293 1.00 0.00 C -ATOM 4784 HG12 ILE 304 7.303 -3.814 9.571 1.00 0.00 H -ATOM 4785 HG13 ILE 304 6.779 -5.207 8.805 1.00 0.00 H -ATOM 4786 CD1 ILE 304 7.992 -5.618 10.508 1.00 0.00 C -ATOM 4787 HD11 ILE 304 7.261 -5.424 11.293 1.00 0.00 H -ATOM 4788 HD12 ILE 304 8.184 -6.671 10.303 1.00 0.00 H -ATOM 4789 HD13 ILE 304 8.871 -5.181 10.983 1.00 0.00 H -ATOM 4790 C ILE 304 8.299 -6.683 6.666 1.00 0.00 C -ATOM 4791 O ILE 304 7.330 -7.312 7.166 1.00 0.00 O -ATOM 4792 N LEU 305 8.459 -6.643 5.263 1.00 0.00 N -ATOM 4793 H LEU 305 9.334 -6.272 4.921 1.00 0.00 H -ATOM 4794 CA LEU 305 7.403 -7.074 4.318 1.00 0.00 C -ATOM 4795 HA LEU 305 6.566 -7.370 4.950 1.00 0.00 H -ATOM 4796 CB LEU 305 6.920 -6.005 3.354 1.00 0.00 C -ATOM 4797 HB2 LEU 305 7.703 -5.724 2.650 1.00 0.00 H -ATOM 4798 HB3 LEU 305 6.129 -6.440 2.744 1.00 0.00 H -ATOM 4799 CG LEU 305 6.468 -4.697 3.972 1.00 0.00 C -ATOM 4800 HG LEU 305 7.271 -4.300 4.594 1.00 0.00 H -ATOM 4801 CD1 LEU 305 6.310 -3.563 2.918 1.00 0.00 C -ATOM 4802 HD11 LEU 305 5.955 -2.681 3.450 1.00 0.00 H -ATOM 4803 HD12 LEU 305 7.248 -3.319 2.419 1.00 0.00 H -ATOM 4804 HD13 LEU 305 5.576 -3.855 2.166 1.00 0.00 H -ATOM 4805 CD2 LEU 305 5.179 -4.744 4.692 1.00 0.00 C -ATOM 4806 HD21 LEU 305 5.065 -5.547 5.421 1.00 0.00 H -ATOM 4807 HD22 LEU 305 5.072 -3.797 5.221 1.00 0.00 H -ATOM 4808 HD23 LEU 305 4.327 -4.772 4.014 1.00 0.00 H -ATOM 4809 C LEU 305 7.739 -8.416 3.605 1.00 0.00 C -ATOM 4810 O LEU 305 7.096 -8.684 2.555 1.00 0.00 O -ATOM 4811 N GLN 306 8.794 -9.137 4.021 1.00 0.00 N -ATOM 4812 H GLN 306 9.195 -8.679 4.827 1.00 0.00 H -ATOM 4813 CA GLN 306 9.381 -10.275 3.302 1.00 0.00 C -ATOM 4814 HA GLN 306 9.719 -10.002 2.302 1.00 0.00 H -ATOM 4815 CB GLN 306 10.634 -10.883 4.075 1.00 0.00 C -ATOM 4816 HB2 GLN 306 11.037 -11.659 3.425 1.00 0.00 H -ATOM 4817 HB3 GLN 306 11.355 -10.067 4.126 1.00 0.00 H -ATOM 4818 CG GLN 306 10.358 -11.210 5.572 1.00 0.00 C -ATOM 4819 HG2 GLN 306 9.987 -10.322 6.084 1.00 0.00 H -ATOM 4820 HG3 GLN 306 9.521 -11.907 5.617 1.00 0.00 H -ATOM 4821 CD GLN 306 11.534 -11.851 6.195 1.00 0.00 C -ATOM 4822 OE1 GLN 306 12.377 -12.462 5.580 1.00 0.00 O -ATOM 4823 NE2 GLN 306 11.692 -11.762 7.464 1.00 0.00 N -ATOM 4824 HE21 GLN 306 12.482 -12.204 7.910 1.00 0.00 H -ATOM 4825 HE22 GLN 306 11.055 -11.178 7.988 1.00 0.00 H -ATOM 4826 C GLN 306 8.253 -11.336 3.102 1.00 0.00 C -ATOM 4827 O GLN 306 8.182 -11.831 1.974 1.00 0.00 O -ATOM 4828 N ASP 307 7.200 -11.435 3.918 1.00 0.00 N -ATOM 4829 H ASP 307 7.215 -10.914 4.783 1.00 0.00 H -ATOM 4830 CA ASP 307 6.145 -12.522 3.687 1.00 0.00 C -ATOM 4831 HA ASP 307 6.665 -13.342 3.193 1.00 0.00 H -ATOM 4832 CB ASP 307 5.470 -12.944 5.047 1.00 0.00 C -ATOM 4833 HB2 ASP 307 4.834 -12.114 5.354 1.00 0.00 H -ATOM 4834 HB3 ASP 307 4.878 -13.814 4.762 1.00 0.00 H -ATOM 4835 CG ASP 307 6.393 -13.459 6.085 1.00 0.00 C -ATOM 4836 OD1 ASP 307 6.168 -13.215 7.320 1.00 0.00 O -ATOM 4837 OD2 ASP 307 7.206 -14.298 5.663 1.00 0.00 O -ATOM 4838 C ASP 307 5.062 -12.158 2.669 1.00 0.00 C -ATOM 4839 O ASP 307 4.467 -13.030 2.041 1.00 0.00 O -ATOM 4840 N SER 308 4.855 -10.836 2.418 1.00 0.00 N -ATOM 4841 H SER 308 5.494 -10.153 2.797 1.00 0.00 H -ATOM 4842 CA SER 308 3.996 -10.390 1.357 1.00 0.00 C -ATOM 4843 HA SER 308 3.066 -10.953 1.434 1.00 0.00 H -ATOM 4844 CB SER 308 3.691 -8.878 1.557 1.00 0.00 C -ATOM 4845 HB2 SER 308 4.650 -8.372 1.450 1.00 0.00 H -ATOM 4846 HB3 SER 308 3.128 -8.433 0.736 1.00 0.00 H -ATOM 4847 OG SER 308 3.017 -8.563 2.807 1.00 0.00 O -ATOM 4848 HG SER 308 3.613 -8.812 3.517 1.00 0.00 H -ATOM 4849 C SER 308 4.725 -10.523 -0.033 1.00 0.00 C -ATOM 4850 O SER 308 4.012 -10.766 -0.977 1.00 0.00 O -ATOM 4851 N LEU 309 6.011 -10.229 -0.106 1.00 0.00 N -ATOM 4852 H LEU 309 6.505 -10.057 0.758 1.00 0.00 H -ATOM 4853 CA LEU 309 6.827 -10.151 -1.290 1.00 0.00 C -ATOM 4854 HA LEU 309 6.226 -9.766 -2.113 1.00 0.00 H -ATOM 4855 CB LEU 309 8.020 -9.138 -1.062 1.00 0.00 C -ATOM 4856 HB2 LEU 309 8.689 -9.438 -0.255 1.00 0.00 H -ATOM 4857 HB3 LEU 309 8.668 -9.046 -1.934 1.00 0.00 H -ATOM 4858 CG LEU 309 7.367 -7.765 -0.854 1.00 0.00 C -ATOM 4859 HG LEU 309 6.569 -7.851 -0.116 1.00 0.00 H -ATOM 4860 CD1 LEU 309 8.490 -6.879 -0.253 1.00 0.00 C -ATOM 4861 HD11 LEU 309 8.085 -5.914 0.052 1.00 0.00 H -ATOM 4862 HD12 LEU 309 8.921 -7.415 0.593 1.00 0.00 H -ATOM 4863 HD13 LEU 309 9.173 -6.730 -1.089 1.00 0.00 H -ATOM 4864 CD2 LEU 309 6.822 -7.020 -2.088 1.00 0.00 C -ATOM 4865 HD21 LEU 309 7.486 -7.166 -2.941 1.00 0.00 H -ATOM 4866 HD22 LEU 309 5.856 -7.509 -2.216 1.00 0.00 H -ATOM 4867 HD23 LEU 309 6.758 -5.938 -1.978 1.00 0.00 H -ATOM 4868 C LEU 309 7.240 -11.575 -1.680 1.00 0.00 C -ATOM 4869 O LEU 309 8.346 -11.977 -1.440 1.00 0.00 O -ATOM 4870 N GLY 310 6.391 -12.354 -2.383 1.00 0.00 N -ATOM 4871 H GLY 310 5.477 -11.940 -2.502 1.00 0.00 H -ATOM 4872 CA GLY 310 6.528 -13.745 -2.788 1.00 0.00 C -ATOM 4873 HA2 GLY 310 5.803 -14.047 -3.545 1.00 0.00 H -ATOM 4874 HA3 GLY 310 7.502 -13.868 -3.261 1.00 0.00 H -ATOM 4875 C GLY 310 6.446 -14.778 -1.697 1.00 0.00 C -ATOM 4876 O GLY 310 6.267 -15.957 -1.925 1.00 0.00 O -ATOM 4877 N GLY 311 6.362 -14.409 -0.408 1.00 0.00 N -ATOM 4878 H GLY 311 6.283 -13.421 -0.213 1.00 0.00 H -ATOM 4879 CA GLY 311 6.023 -15.321 0.688 1.00 0.00 C -ATOM 4880 HA2 GLY 311 6.563 -16.245 0.481 1.00 0.00 H -ATOM 4881 HA3 GLY 311 6.443 -14.875 1.589 1.00 0.00 H -ATOM 4882 C GLY 311 4.599 -15.714 0.993 1.00 0.00 C -ATOM 4883 O GLY 311 3.835 -15.729 0.057 1.00 0.00 O -ATOM 4884 N ARG 312 4.323 -16.066 2.237 1.00 0.00 N -ATOM 4885 H ARG 312 5.067 -16.068 2.920 1.00 0.00 H -ATOM 4886 CA ARG 312 2.874 -16.462 2.548 1.00 0.00 C -ATOM 4887 HA ARG 312 2.565 -17.258 1.870 1.00 0.00 H -ATOM 4888 CB ARG 312 2.732 -17.000 3.996 1.00 0.00 C -ATOM 4889 HB2 ARG 312 3.358 -16.424 4.678 1.00 0.00 H -ATOM 4890 HB3 ARG 312 1.708 -16.961 4.370 1.00 0.00 H -ATOM 4891 CG ARG 312 3.307 -18.402 4.052 1.00 0.00 C -ATOM 4892 HG2 ARG 312 4.070 -18.577 3.293 1.00 0.00 H -ATOM 4893 HG3 ARG 312 3.702 -18.607 5.047 1.00 0.00 H -ATOM 4894 CD ARG 312 2.079 -19.375 4.035 1.00 0.00 C -ATOM 4895 HD2 ARG 312 2.368 -20.119 4.777 1.00 0.00 H -ATOM 4896 HD3 ARG 312 1.171 -18.866 4.356 1.00 0.00 H -ATOM 4897 NE ARG 312 1.791 -20.047 2.718 1.00 0.00 N -ATOM 4898 HE ARG 312 2.201 -19.628 1.895 1.00 0.00 H -ATOM 4899 CZ ARG 312 0.765 -20.827 2.435 1.00 0.00 C -ATOM 4900 NH1 ARG 312 0.013 -21.335 3.396 1.00 0.00 N -ATOM 4901 HH11 ARG 312 0.172 -21.089 4.362 1.00 0.00 H -ATOM 4902 HH12 ARG 312 -0.504 -22.175 3.178 1.00 0.00 H -ATOM 4903 NH2 ARG 312 0.450 -21.117 1.233 1.00 0.00 N -ATOM 4904 HH21 ARG 312 0.954 -20.612 0.517 1.00 0.00 H -ATOM 4905 HH22 ARG 312 -0.230 -21.850 1.090 1.00 0.00 H -ATOM 4906 C ARG 312 1.771 -15.395 2.387 1.00 0.00 C -ATOM 4907 O ARG 312 0.669 -15.855 2.063 1.00 0.00 O -ATOM 4908 N THR 313 2.015 -14.099 2.582 1.00 0.00 N -ATOM 4909 H THR 313 2.962 -13.763 2.677 1.00 0.00 H -ATOM 4910 CA THR 313 0.902 -13.162 2.788 1.00 0.00 C -ATOM 4911 HA THR 313 0.156 -13.679 3.391 1.00 0.00 H -ATOM 4912 CB THR 313 1.351 -11.936 3.539 1.00 0.00 C -ATOM 4913 HB THR 313 2.385 -11.725 3.267 1.00 0.00 H -ATOM 4914 CG2 THR 313 0.527 -10.662 3.492 1.00 0.00 C -ATOM 4915 HG21 THR 313 -0.546 -10.845 3.549 1.00 0.00 H -ATOM 4916 HG22 THR 313 0.814 -9.992 4.302 1.00 0.00 H -ATOM 4917 HG23 THR 313 0.842 -10.134 2.592 1.00 0.00 H -ATOM 4918 OG1 THR 313 1.374 -12.273 4.911 1.00 0.00 O -ATOM 4919 HG1 THR 313 1.843 -13.090 5.091 1.00 0.00 H -ATOM 4920 C THR 313 0.254 -12.711 1.461 1.00 0.00 C -ATOM 4921 O THR 313 0.990 -12.232 0.604 1.00 0.00 O -ATOM 4922 N ARG 314 -0.976 -13.069 1.179 1.00 0.00 N -ATOM 4923 H ARG 314 -1.463 -13.603 1.885 1.00 0.00 H -ATOM 4924 CA ARG 314 -1.606 -13.039 -0.179 1.00 0.00 C -ATOM 4925 HA ARG 314 -1.085 -13.605 -0.952 1.00 0.00 H -ATOM 4926 CB ARG 314 -3.006 -13.551 -0.040 1.00 0.00 C -ATOM 4927 HB2 ARG 314 -2.903 -14.591 0.269 1.00 0.00 H -ATOM 4928 HB3 ARG 314 -3.510 -13.052 0.787 1.00 0.00 H -ATOM 4929 CG ARG 314 -3.809 -13.496 -1.287 1.00 0.00 C -ATOM 4930 HG2 ARG 314 -4.058 -12.467 -1.547 1.00 0.00 H -ATOM 4931 HG3 ARG 314 -3.202 -13.926 -2.083 1.00 0.00 H -ATOM 4932 CD ARG 314 -5.175 -14.150 -1.113 1.00 0.00 C -ATOM 4933 HD2 ARG 314 -4.926 -15.203 -0.987 1.00 0.00 H -ATOM 4934 HD3 ARG 314 -5.713 -13.826 -0.222 1.00 0.00 H -ATOM 4935 NE ARG 314 -5.934 -13.885 -2.409 1.00 0.00 N -ATOM 4936 HE ARG 314 -5.525 -13.189 -3.016 1.00 0.00 H -ATOM 4937 CZ ARG 314 -7.211 -14.085 -2.436 1.00 0.00 C -ATOM 4938 NH1 ARG 314 -7.815 -15.018 -1.646 1.00 0.00 N -ATOM 4939 HH11 ARG 314 -7.363 -15.799 -1.193 1.00 0.00 H -ATOM 4940 HH12 ARG 314 -8.823 -15.078 -1.621 1.00 0.00 H -ATOM 4941 NH2 ARG 314 -7.966 -13.445 -3.293 1.00 0.00 N -ATOM 4942 HH21 ARG 314 -7.566 -12.719 -3.870 1.00 0.00 H -ATOM 4943 HH22 ARG 314 -8.960 -13.620 -3.278 1.00 0.00 H -ATOM 4944 C ARG 314 -1.653 -11.538 -0.546 1.00 0.00 C -ATOM 4945 O ARG 314 -2.249 -10.740 0.196 1.00 0.00 O -ATOM 4946 N THR 315 -1.023 -11.260 -1.663 1.00 0.00 N -ATOM 4947 H THR 315 -0.415 -11.947 -2.087 1.00 0.00 H -ATOM 4948 CA THR 315 -0.683 -9.897 -2.027 1.00 0.00 C -ATOM 4949 HA THR 315 -0.947 -9.286 -1.164 1.00 0.00 H -ATOM 4950 CB THR 315 0.867 -9.736 -2.098 1.00 0.00 C -ATOM 4951 HB THR 315 1.169 -10.468 -2.846 1.00 0.00 H -ATOM 4952 CG2 THR 315 1.405 -8.403 -2.469 1.00 0.00 C -ATOM 4953 HG21 THR 315 1.211 -8.191 -3.521 1.00 0.00 H -ATOM 4954 HG22 THR 315 0.848 -7.569 -2.042 1.00 0.00 H -ATOM 4955 HG23 THR 315 2.485 -8.383 -2.319 1.00 0.00 H -ATOM 4956 OG1 THR 315 1.266 -9.924 -0.751 1.00 0.00 O -ATOM 4957 HG1 THR 315 1.395 -10.863 -0.598 1.00 0.00 H -ATOM 4958 C THR 315 -1.398 -9.375 -3.282 1.00 0.00 C -ATOM 4959 O THR 315 -1.497 -10.056 -4.299 1.00 0.00 O -ATOM 4960 N SER 316 -1.983 -8.142 -3.180 1.00 0.00 N -ATOM 4961 H SER 316 -2.103 -7.766 -2.251 1.00 0.00 H -ATOM 4962 CA SER 316 -2.432 -7.306 -4.312 1.00 0.00 C -ATOM 4963 HA SER 316 -2.323 -7.930 -5.199 1.00 0.00 H -ATOM 4964 CB SER 316 -3.866 -6.923 -3.999 1.00 0.00 C -ATOM 4965 HB2 SER 316 -4.436 -7.838 -3.843 1.00 0.00 H -ATOM 4966 HB3 SER 316 -3.825 -6.392 -3.048 1.00 0.00 H -ATOM 4967 OG SER 316 -4.543 -6.180 -5.046 1.00 0.00 O -ATOM 4968 HG SER 316 -5.492 -6.307 -4.973 1.00 0.00 H -ATOM 4969 C SER 316 -1.511 -6.106 -4.621 1.00 0.00 C -ATOM 4970 O SER 316 -1.014 -5.596 -3.657 1.00 0.00 O -ATOM 4971 N ILE 317 -1.361 -5.674 -5.909 1.00 0.00 N -ATOM 4972 H ILE 317 -1.851 -6.222 -6.602 1.00 0.00 H -ATOM 4973 CA ILE 317 -0.544 -4.507 -6.259 1.00 0.00 C -ATOM 4974 HA ILE 317 -0.319 -3.965 -5.341 1.00 0.00 H -ATOM 4975 CB ILE 317 0.754 -5.026 -6.866 1.00 0.00 C -ATOM 4976 HB ILE 317 0.567 -5.480 -7.838 1.00 0.00 H -ATOM 4977 CG2 ILE 317 1.648 -3.816 -7.250 1.00 0.00 C -ATOM 4978 HG21 ILE 317 1.148 -3.201 -7.999 1.00 0.00 H -ATOM 4979 HG22 ILE 317 1.841 -3.245 -6.342 1.00 0.00 H -ATOM 4980 HG23 ILE 317 2.621 -4.128 -7.630 1.00 0.00 H -ATOM 4981 CG1 ILE 317 1.620 -6.023 -6.024 1.00 0.00 C -ATOM 4982 HG12 ILE 317 1.775 -5.490 -5.086 1.00 0.00 H -ATOM 4983 HG13 ILE 317 1.050 -6.930 -5.823 1.00 0.00 H -ATOM 4984 CD1 ILE 317 2.954 -6.460 -6.568 1.00 0.00 C -ATOM 4985 HD11 ILE 317 2.725 -7.024 -7.471 1.00 0.00 H -ATOM 4986 HD12 ILE 317 3.679 -5.686 -6.822 1.00 0.00 H -ATOM 4987 HD13 ILE 317 3.422 -7.019 -5.758 1.00 0.00 H -ATOM 4988 C ILE 317 -1.327 -3.450 -7.034 1.00 0.00 C -ATOM 4989 O ILE 317 -1.645 -3.791 -8.170 1.00 0.00 O -ATOM 4990 N ILE 318 -1.555 -2.200 -6.474 1.00 0.00 N -ATOM 4991 H ILE 318 -1.261 -1.924 -5.548 1.00 0.00 H -ATOM 4992 CA ILE 318 -2.232 -1.101 -7.286 1.00 0.00 C -ATOM 4993 HA ILE 318 -2.788 -1.539 -8.115 1.00 0.00 H -ATOM 4994 CB ILE 318 -3.210 -0.375 -6.391 1.00 0.00 C -ATOM 4995 HB ILE 318 -2.696 0.168 -5.598 1.00 0.00 H -ATOM 4996 CG2 ILE 318 -4.033 0.722 -7.166 1.00 0.00 C -ATOM 4997 HG21 ILE 318 -4.672 1.336 -6.531 1.00 0.00 H -ATOM 4998 HG22 ILE 318 -3.346 1.299 -7.785 1.00 0.00 H -ATOM 4999 HG23 ILE 318 -4.845 0.313 -7.767 1.00 0.00 H -ATOM 5000 CG1 ILE 318 -4.292 -1.286 -5.798 1.00 0.00 C -ATOM 5001 HG12 ILE 318 -5.128 -1.512 -6.461 1.00 0.00 H -ATOM 5002 HG13 ILE 318 -3.882 -2.250 -5.498 1.00 0.00 H -ATOM 5003 CD1 ILE 318 -4.909 -0.800 -4.461 1.00 0.00 C -ATOM 5004 HD11 ILE 318 -4.135 -0.780 -3.693 1.00 0.00 H -ATOM 5005 HD12 ILE 318 -5.291 0.221 -4.473 1.00 0.00 H -ATOM 5006 HD13 ILE 318 -5.741 -1.476 -4.265 1.00 0.00 H -ATOM 5007 C ILE 318 -1.150 -0.214 -7.867 1.00 0.00 C -ATOM 5008 O ILE 318 -0.494 0.559 -7.147 1.00 0.00 O -ATOM 5009 N ALA 319 -1.111 -0.176 -9.179 1.00 0.00 N -ATOM 5010 H ALA 319 -1.774 -0.720 -9.712 1.00 0.00 H -ATOM 5011 CA ALA 319 -0.301 0.818 -9.874 1.00 0.00 C -ATOM 5012 HA ALA 319 0.512 1.120 -9.213 1.00 0.00 H -ATOM 5013 CB ALA 319 0.179 0.147 -11.185 1.00 0.00 C -ATOM 5014 HB1 ALA 319 0.868 0.814 -11.704 1.00 0.00 H -ATOM 5015 HB2 ALA 319 0.842 -0.680 -10.930 1.00 0.00 H -ATOM 5016 HB3 ALA 319 -0.694 -0.167 -11.758 1.00 0.00 H -ATOM 5017 C ALA 319 -1.179 2.077 -10.157 1.00 0.00 C -ATOM 5018 O ALA 319 -2.153 1.938 -10.906 1.00 0.00 O -ATOM 5019 N THR 320 -0.744 3.203 -9.599 1.00 0.00 N -ATOM 5020 H THR 320 0.094 3.231 -9.035 1.00 0.00 H -ATOM 5021 CA THR 320 -1.333 4.541 -9.823 1.00 0.00 C -ATOM 5022 HA THR 320 -2.293 4.378 -10.312 1.00 0.00 H -ATOM 5023 CB THR 320 -1.597 5.410 -8.524 1.00 0.00 C -ATOM 5024 HB THR 320 -2.116 6.318 -8.831 1.00 0.00 H -ATOM 5025 CG2 THR 320 -2.523 4.615 -7.606 1.00 0.00 C -ATOM 5026 HG21 THR 320 -1.974 4.153 -6.786 1.00 0.00 H -ATOM 5027 HG22 THR 320 -3.262 5.277 -7.155 1.00 0.00 H -ATOM 5028 HG23 THR 320 -3.077 3.872 -8.179 1.00 0.00 H -ATOM 5029 OG1 THR 320 -0.422 5.729 -7.843 1.00 0.00 O -ATOM 5030 HG1 THR 320 -0.090 6.523 -8.268 1.00 0.00 H -ATOM 5031 C THR 320 -0.578 5.278 -10.901 1.00 0.00 C -ATOM 5032 O THR 320 0.668 5.271 -10.938 1.00 0.00 O -ATOM 5033 N ILE 321 -1.358 5.912 -11.826 1.00 0.00 N -ATOM 5034 H ILE 321 -2.341 5.880 -11.597 1.00 0.00 H -ATOM 5035 CA ILE 321 -0.834 6.713 -12.987 1.00 0.00 C -ATOM 5036 HA ILE 321 0.123 7.168 -12.731 1.00 0.00 H -ATOM 5037 CB ILE 321 -0.717 5.837 -14.230 1.00 0.00 C -ATOM 5038 HB ILE 321 -0.405 6.473 -15.058 1.00 0.00 H -ATOM 5039 CG2 ILE 321 0.296 4.669 -14.092 1.00 0.00 C -ATOM 5040 HG21 ILE 321 1.272 4.991 -13.729 1.00 0.00 H -ATOM 5041 HG22 ILE 321 -0.083 4.046 -13.282 1.00 0.00 H -ATOM 5042 HG23 ILE 321 0.379 4.063 -14.994 1.00 0.00 H -ATOM 5043 CG1 ILE 321 -2.112 5.297 -14.657 1.00 0.00 C -ATOM 5044 HG12 ILE 321 -2.554 4.788 -13.800 1.00 0.00 H -ATOM 5045 HG13 ILE 321 -2.801 6.105 -14.905 1.00 0.00 H -ATOM 5046 CD1 ILE 321 -2.198 4.322 -15.864 1.00 0.00 C -ATOM 5047 HD11 ILE 321 -3.199 4.112 -16.242 1.00 0.00 H -ATOM 5048 HD12 ILE 321 -1.708 4.799 -16.713 1.00 0.00 H -ATOM 5049 HD13 ILE 321 -1.815 3.330 -15.624 1.00 0.00 H -ATOM 5050 C ILE 321 -1.765 7.938 -13.259 1.00 0.00 C -ATOM 5051 O ILE 321 -2.917 7.981 -12.800 1.00 0.00 O -ATOM 5052 N SER 322 -1.272 9.002 -13.918 1.00 0.00 N -ATOM 5053 H SER 322 -0.321 8.751 -14.150 1.00 0.00 H -ATOM 5054 CA SER 322 -1.892 10.104 -14.597 1.00 0.00 C -ATOM 5055 HA SER 322 -2.804 10.470 -14.126 1.00 0.00 H -ATOM 5056 CB SER 322 -0.893 11.242 -14.639 1.00 0.00 C -ATOM 5057 HB2 SER 322 -0.547 11.435 -13.624 1.00 0.00 H -ATOM 5058 HB3 SER 322 0.002 10.966 -15.197 1.00 0.00 H -ATOM 5059 OG SER 322 -1.626 12.305 -15.274 1.00 0.00 O -ATOM 5060 HG SER 322 -1.362 13.114 -14.830 1.00 0.00 H -ATOM 5061 C SER 322 -2.294 9.821 -16.078 1.00 0.00 C -ATOM 5062 O SER 322 -1.614 9.061 -16.785 1.00 0.00 O -ATOM 5063 N PRO 323 -3.393 10.346 -16.623 1.00 0.00 N -ATOM 5064 CD PRO 323 -4.458 10.989 -15.918 1.00 0.00 C -ATOM 5065 HD2 PRO 323 -4.038 11.706 -15.212 1.00 0.00 H -ATOM 5066 HD3 PRO 323 -5.088 10.286 -15.373 1.00 0.00 H -ATOM 5067 CG PRO 323 -5.298 11.748 -16.875 1.00 0.00 C -ATOM 5068 HG2 PRO 323 -4.872 12.745 -16.989 1.00 0.00 H -ATOM 5069 HG3 PRO 323 -6.283 11.761 -16.408 1.00 0.00 H -ATOM 5070 CB PRO 323 -5.173 10.916 -18.152 1.00 0.00 C -ATOM 5071 HB2 PRO 323 -5.289 11.497 -19.067 1.00 0.00 H -ATOM 5072 HB3 PRO 323 -5.892 10.096 -18.162 1.00 0.00 H -ATOM 5073 CA PRO 323 -3.771 10.380 -18.056 1.00 0.00 C -ATOM 5074 HA PRO 323 -3.762 9.397 -18.528 1.00 0.00 H -ATOM 5075 C PRO 323 -2.860 11.226 -18.945 1.00 0.00 C -ATOM 5076 O PRO 323 -2.413 10.864 -20.033 1.00 0.00 O -ATOM 5077 N ALA 324 -2.330 12.282 -18.310 1.00 0.00 N -ATOM 5078 H ALA 324 -2.649 12.425 -17.362 1.00 0.00 H -ATOM 5079 CA ALA 324 -1.751 13.430 -18.962 1.00 0.00 C -ATOM 5080 HA ALA 324 -2.542 13.732 -19.649 1.00 0.00 H -ATOM 5081 CB ALA 324 -1.568 14.420 -17.803 1.00 0.00 C -ATOM 5082 HB1 ALA 324 -2.557 14.621 -17.390 1.00 0.00 H -ATOM 5083 HB2 ALA 324 -0.818 14.055 -17.101 1.00 0.00 H -ATOM 5084 HB3 ALA 324 -1.217 15.331 -18.286 1.00 0.00 H -ATOM 5085 C ALA 324 -0.505 12.990 -19.677 1.00 0.00 C -ATOM 5086 O ALA 324 0.153 12.022 -19.314 1.00 0.00 O -ATOM 5087 N SER 325 -0.222 13.664 -20.826 1.00 0.00 N -ATOM 5088 H SER 325 -0.869 14.331 -21.220 1.00 0.00 H -ATOM 5089 CA SER 325 1.058 13.563 -21.477 1.00 0.00 C -ATOM 5090 HA SER 325 1.265 12.505 -21.634 1.00 0.00 H -ATOM 5091 CB SER 325 1.004 14.350 -22.802 1.00 0.00 C -ATOM 5092 HB2 SER 325 2.013 14.247 -23.203 1.00 0.00 H -ATOM 5093 HB3 SER 325 0.352 13.800 -23.481 1.00 0.00 H -ATOM 5094 OG SER 325 0.613 15.711 -22.585 1.00 0.00 O -ATOM 5095 HG SER 325 1.390 16.268 -22.669 1.00 0.00 H -ATOM 5096 C SER 325 2.250 14.085 -20.662 1.00 0.00 C -ATOM 5097 O SER 325 3.403 13.748 -20.935 1.00 0.00 O -ATOM 5098 N LEU 326 1.966 14.912 -19.595 1.00 0.00 N -ATOM 5099 H LEU 326 1.017 15.258 -19.596 1.00 0.00 H -ATOM 5100 CA LEU 326 2.984 15.739 -18.923 1.00 0.00 C -ATOM 5101 HA LEU 326 3.406 16.357 -19.715 1.00 0.00 H -ATOM 5102 CB LEU 326 2.258 16.573 -17.855 1.00 0.00 C -ATOM 5103 HB2 LEU 326 1.604 17.251 -18.403 1.00 0.00 H -ATOM 5104 HB3 LEU 326 1.650 15.914 -17.235 1.00 0.00 H -ATOM 5105 CG LEU 326 3.126 17.434 -16.991 1.00 0.00 C -ATOM 5106 HG LEU 326 3.865 16.823 -16.473 1.00 0.00 H -ATOM 5107 CD1 LEU 326 3.853 18.436 -17.809 1.00 0.00 C -ATOM 5108 HD11 LEU 326 4.559 18.115 -18.576 1.00 0.00 H -ATOM 5109 HD12 LEU 326 3.183 19.198 -18.208 1.00 0.00 H -ATOM 5110 HD13 LEU 326 4.535 18.872 -17.079 1.00 0.00 H -ATOM 5111 CD2 LEU 326 2.176 18.161 -15.989 1.00 0.00 C -ATOM 5112 HD21 LEU 326 2.760 18.600 -15.180 1.00 0.00 H -ATOM 5113 HD22 LEU 326 1.598 18.985 -16.406 1.00 0.00 H -ATOM 5114 HD23 LEU 326 1.563 17.429 -15.462 1.00 0.00 H -ATOM 5115 C LEU 326 4.192 14.888 -18.292 1.00 0.00 C -ATOM 5116 O LEU 326 5.255 15.367 -17.992 1.00 0.00 O -ATOM 5117 N ASN 327 3.965 13.610 -17.946 1.00 0.00 N -ATOM 5118 H ASN 327 3.061 13.253 -18.220 1.00 0.00 H -ATOM 5119 CA ASN 327 4.979 12.703 -17.391 1.00 0.00 C -ATOM 5120 HA ASN 327 5.978 13.065 -17.637 1.00 0.00 H -ATOM 5121 CB ASN 327 4.916 12.618 -15.855 1.00 0.00 C -ATOM 5122 HB2 ASN 327 3.986 12.167 -15.511 1.00 0.00 H -ATOM 5123 HB3 ASN 327 5.763 12.003 -15.548 1.00 0.00 H -ATOM 5124 CG ASN 327 5.175 13.983 -15.200 1.00 0.00 C -ATOM 5125 OD1 ASN 327 6.284 14.444 -15.059 1.00 0.00 O -ATOM 5126 ND2 ASN 327 4.225 14.700 -14.730 1.00 0.00 N -ATOM 5127 HD21 ASN 327 4.545 15.561 -14.309 1.00 0.00 H -ATOM 5128 HD22 ASN 327 3.298 14.319 -14.852 1.00 0.00 H -ATOM 5129 C ASN 327 4.827 11.323 -18.035 1.00 0.00 C -ATOM 5130 O ASN 327 4.759 10.297 -17.352 1.00 0.00 O -ATOM 5131 N LEU 328 4.485 11.238 -19.382 1.00 0.00 N -ATOM 5132 H LEU 328 4.460 12.105 -19.899 1.00 0.00 H -ATOM 5133 CA LEU 328 4.226 9.986 -20.141 1.00 0.00 C -ATOM 5134 HA LEU 328 3.226 9.629 -19.897 1.00 0.00 H -ATOM 5135 CB LEU 328 4.092 10.481 -21.589 1.00 0.00 C -ATOM 5136 HB2 LEU 328 3.222 11.133 -21.652 1.00 0.00 H -ATOM 5137 HB3 LEU 328 4.967 11.064 -21.877 1.00 0.00 H -ATOM 5138 CG LEU 328 3.947 9.369 -22.692 1.00 0.00 C -ATOM 5139 HG LEU 328 3.372 8.532 -22.296 1.00 0.00 H -ATOM 5140 CD1 LEU 328 3.269 9.912 -24.054 1.00 0.00 C -ATOM 5141 HD11 LEU 328 3.095 10.988 -24.042 1.00 0.00 H -ATOM 5142 HD12 LEU 328 3.820 9.743 -24.980 1.00 0.00 H -ATOM 5143 HD13 LEU 328 2.331 9.370 -24.172 1.00 0.00 H -ATOM 5144 CD2 LEU 328 5.267 8.763 -23.176 1.00 0.00 C -ATOM 5145 HD21 LEU 328 5.180 7.952 -23.899 1.00 0.00 H -ATOM 5146 HD22 LEU 328 5.880 9.514 -23.674 1.00 0.00 H -ATOM 5147 HD23 LEU 328 5.803 8.399 -22.299 1.00 0.00 H -ATOM 5148 C LEU 328 5.259 8.901 -19.922 1.00 0.00 C -ATOM 5149 O LEU 328 4.851 7.769 -19.797 1.00 0.00 O -ATOM 5150 N GLU 329 6.513 9.299 -19.731 1.00 0.00 N -ATOM 5151 H GLU 329 6.794 10.228 -20.009 1.00 0.00 H -ATOM 5152 CA GLU 329 7.568 8.296 -19.609 1.00 0.00 C -ATOM 5153 HA GLU 329 7.274 7.478 -20.268 1.00 0.00 H -ATOM 5154 CB GLU 329 8.893 8.932 -20.044 1.00 0.00 C -ATOM 5155 HB2 GLU 329 9.201 9.772 -19.421 1.00 0.00 H -ATOM 5156 HB3 GLU 329 9.605 8.115 -19.927 1.00 0.00 H -ATOM 5157 CG GLU 329 8.845 9.278 -21.516 1.00 0.00 C -ATOM 5158 HG2 GLU 329 9.794 9.125 -22.032 1.00 0.00 H -ATOM 5159 HG3 GLU 329 8.075 8.738 -22.066 1.00 0.00 H -ATOM 5160 CD GLU 329 8.530 10.709 -21.887 1.00 0.00 C -ATOM 5161 OE1 GLU 329 7.967 11.492 -21.071 1.00 0.00 O -ATOM 5162 OE2 GLU 329 8.577 11.087 -23.076 1.00 0.00 O -ATOM 5163 C GLU 329 7.666 7.734 -18.196 1.00 0.00 C -ATOM 5164 O GLU 329 8.158 6.571 -18.068 1.00 0.00 O -ATOM 5165 N GLU 330 7.218 8.444 -17.139 1.00 0.00 N -ATOM 5166 H GLU 330 6.904 9.376 -17.371 1.00 0.00 H -ATOM 5167 CA GLU 330 6.992 7.882 -15.775 1.00 0.00 C -ATOM 5168 HA GLU 330 7.812 7.240 -15.456 1.00 0.00 H -ATOM 5169 CB GLU 330 6.735 8.916 -14.656 1.00 0.00 C -ATOM 5170 HB2 GLU 330 5.799 9.416 -14.907 1.00 0.00 H -ATOM 5171 HB3 GLU 330 6.862 8.424 -13.692 1.00 0.00 H -ATOM 5172 CG GLU 330 7.759 10.061 -14.661 1.00 0.00 C -ATOM 5173 HG2 GLU 330 7.585 10.716 -15.515 1.00 0.00 H -ATOM 5174 HG3 GLU 330 7.712 10.685 -13.768 1.00 0.00 H -ATOM 5175 CD GLU 330 9.171 9.505 -14.853 1.00 0.00 C -ATOM 5176 OE1 GLU 330 9.989 10.306 -15.328 1.00 0.00 O -ATOM 5177 OE2 GLU 330 9.499 8.431 -14.371 1.00 0.00 O -ATOM 5178 C GLU 330 5.766 6.959 -15.787 1.00 0.00 C -ATOM 5179 O GLU 330 5.843 5.889 -15.135 1.00 0.00 O -ATOM 5180 N THR 331 4.673 7.370 -16.422 1.00 0.00 N -ATOM 5181 H THR 331 4.612 8.299 -16.814 1.00 0.00 H -ATOM 5182 CA THR 331 3.506 6.529 -16.577 1.00 0.00 C -ATOM 5183 HA THR 331 3.071 6.239 -15.620 1.00 0.00 H -ATOM 5184 CB THR 331 2.510 7.175 -17.668 1.00 0.00 C -ATOM 5185 HB THR 331 2.972 7.459 -18.613 1.00 0.00 H -ATOM 5186 CG2 THR 331 1.307 6.229 -17.903 1.00 0.00 C -ATOM 5187 HG21 THR 331 0.500 6.789 -18.376 1.00 0.00 H -ATOM 5188 HG22 THR 331 1.656 5.661 -18.766 1.00 0.00 H -ATOM 5189 HG23 THR 331 1.017 5.554 -17.098 1.00 0.00 H -ATOM 5190 OG1 THR 331 2.089 8.352 -17.153 1.00 0.00 O -ATOM 5191 HG1 THR 331 1.463 8.680 -17.802 1.00 0.00 H -ATOM 5192 C THR 331 3.876 5.179 -17.282 1.00 0.00 C -ATOM 5193 O THR 331 3.579 4.101 -16.763 1.00 0.00 O -ATOM 5194 N LEU 332 4.697 5.215 -18.329 1.00 0.00 N -ATOM 5195 H LEU 332 5.028 6.120 -18.631 1.00 0.00 H -ATOM 5196 CA LEU 332 5.104 4.058 -19.100 1.00 0.00 C -ATOM 5197 HA LEU 332 4.283 3.394 -19.373 1.00 0.00 H -ATOM 5198 CB LEU 332 5.658 4.603 -20.413 1.00 0.00 C -ATOM 5199 HB2 LEU 332 4.808 4.863 -21.044 1.00 0.00 H -ATOM 5200 HB3 LEU 332 6.235 5.491 -20.155 1.00 0.00 H -ATOM 5201 CG LEU 332 6.592 3.688 -21.231 1.00 0.00 C -ATOM 5202 HG LEU 332 7.436 3.295 -20.664 1.00 0.00 H -ATOM 5203 CD1 LEU 332 5.789 2.518 -21.858 1.00 0.00 C -ATOM 5204 HD11 LEU 332 6.335 2.058 -22.681 1.00 0.00 H -ATOM 5205 HD12 LEU 332 5.470 1.835 -21.069 1.00 0.00 H -ATOM 5206 HD13 LEU 332 4.851 2.725 -22.374 1.00 0.00 H -ATOM 5207 CD2 LEU 332 7.079 4.575 -22.385 1.00 0.00 C -ATOM 5208 HD21 LEU 332 7.514 5.465 -21.930 1.00 0.00 H -ATOM 5209 HD22 LEU 332 7.945 4.040 -22.774 1.00 0.00 H -ATOM 5210 HD23 LEU 332 6.236 4.766 -23.050 1.00 0.00 H -ATOM 5211 C LEU 332 6.097 3.146 -18.311 1.00 0.00 C -ATOM 5212 O LEU 332 5.735 1.939 -18.142 1.00 0.00 O -ATOM 5213 N SER 333 7.088 3.779 -17.663 1.00 0.00 N -ATOM 5214 H SER 333 7.269 4.768 -17.761 1.00 0.00 H -ATOM 5215 CA SER 333 7.935 3.191 -16.718 1.00 0.00 C -ATOM 5216 HA SER 333 8.442 2.490 -17.381 1.00 0.00 H -ATOM 5217 CB SER 333 9.029 4.116 -16.206 1.00 0.00 C -ATOM 5218 HB2 SER 333 9.519 4.408 -17.135 1.00 0.00 H -ATOM 5219 HB3 SER 333 8.568 4.977 -15.722 1.00 0.00 H -ATOM 5220 OG SER 333 9.868 3.440 -15.244 1.00 0.00 O -ATOM 5221 HG SER 333 9.418 3.322 -14.404 1.00 0.00 H -ATOM 5222 C SER 333 7.165 2.521 -15.541 1.00 0.00 C -ATOM 5223 O SER 333 7.566 1.430 -15.107 1.00 0.00 O -ATOM 5224 N THR 334 6.091 3.170 -14.957 1.00 0.00 N -ATOM 5225 H THR 334 5.883 4.083 -15.336 1.00 0.00 H -ATOM 5226 CA THR 334 5.282 2.534 -13.939 1.00 0.00 C -ATOM 5227 HA THR 334 5.977 2.135 -13.200 1.00 0.00 H -ATOM 5228 CB THR 334 4.207 3.435 -13.362 1.00 0.00 C -ATOM 5229 HB THR 334 3.390 3.578 -14.069 1.00 0.00 H -ATOM 5230 CG2 THR 334 3.630 3.166 -11.942 1.00 0.00 C -ATOM 5231 HG21 THR 334 3.100 2.215 -11.891 1.00 0.00 H -ATOM 5232 HG22 THR 334 4.332 3.353 -11.130 1.00 0.00 H -ATOM 5233 HG23 THR 334 2.849 3.860 -11.632 1.00 0.00 H -ATOM 5234 OG1 THR 334 4.807 4.677 -13.017 1.00 0.00 O -ATOM 5235 HG1 THR 334 5.286 5.082 -13.744 1.00 0.00 H -ATOM 5236 C THR 334 4.565 1.282 -14.477 1.00 0.00 C -ATOM 5237 O THR 334 4.523 0.263 -13.752 1.00 0.00 O -ATOM 5238 N LEU 335 4.067 1.252 -15.740 1.00 0.00 N -ATOM 5239 H LEU 335 4.118 2.097 -16.290 1.00 0.00 H -ATOM 5240 CA LEU 335 3.387 0.071 -16.277 1.00 0.00 C -ATOM 5241 HA LEU 335 2.813 -0.380 -15.467 1.00 0.00 H -ATOM 5242 CB LEU 335 2.564 0.430 -17.509 1.00 0.00 C -ATOM 5243 HB2 LEU 335 3.167 1.037 -18.185 1.00 0.00 H -ATOM 5244 HB3 LEU 335 2.262 -0.444 -18.085 1.00 0.00 H -ATOM 5245 CG LEU 335 1.237 1.105 -17.010 1.00 0.00 C -ATOM 5246 HG LEU 335 1.334 1.741 -16.129 1.00 0.00 H -ATOM 5247 CD1 LEU 335 0.724 2.155 -17.978 1.00 0.00 C -ATOM 5248 HD11 LEU 335 -0.255 2.582 -17.759 1.00 0.00 H -ATOM 5249 HD12 LEU 335 1.397 3.010 -17.919 1.00 0.00 H -ATOM 5250 HD13 LEU 335 0.852 1.749 -18.982 1.00 0.00 H -ATOM 5251 CD2 LEU 335 0.221 0.067 -16.686 1.00 0.00 C -ATOM 5252 HD21 LEU 335 -0.465 0.462 -15.937 1.00 0.00 H -ATOM 5253 HD22 LEU 335 -0.429 -0.182 -17.525 1.00 0.00 H -ATOM 5254 HD23 LEU 335 0.768 -0.798 -16.310 1.00 0.00 H -ATOM 5255 C LEU 335 4.428 -0.911 -16.678 1.00 0.00 C -ATOM 5256 O LEU 335 4.241 -2.108 -16.393 1.00 0.00 O -ATOM 5257 N GLU 336 5.546 -0.534 -17.264 1.00 0.00 N -ATOM 5258 H GLU 336 5.638 0.418 -17.589 1.00 0.00 H -ATOM 5259 CA GLU 336 6.617 -1.476 -17.649 1.00 0.00 C -ATOM 5260 HA GLU 336 6.259 -2.336 -18.213 1.00 0.00 H -ATOM 5261 CB GLU 336 7.590 -0.722 -18.633 1.00 0.00 C -ATOM 5262 HB2 GLU 336 6.993 -0.326 -19.455 1.00 0.00 H -ATOM 5263 HB3 GLU 336 8.118 0.068 -18.100 1.00 0.00 H -ATOM 5264 CG GLU 336 8.598 -1.636 -19.267 1.00 0.00 C -ATOM 5265 HG2 GLU 336 9.255 -1.096 -19.948 1.00 0.00 H -ATOM 5266 HG3 GLU 336 9.318 -2.012 -18.540 1.00 0.00 H -ATOM 5267 CD GLU 336 8.064 -2.804 -20.126 1.00 0.00 C -ATOM 5268 OE1 GLU 336 7.436 -2.520 -21.163 1.00 0.00 O -ATOM 5269 OE2 GLU 336 8.389 -3.936 -19.859 1.00 0.00 O -ATOM 5270 C GLU 336 7.290 -2.182 -16.477 1.00 0.00 C -ATOM 5271 O GLU 336 7.737 -3.356 -16.582 1.00 0.00 O -ATOM 5272 N TYR 337 7.143 -1.677 -15.286 1.00 0.00 N -ATOM 5273 H TYR 337 6.747 -0.748 -15.290 1.00 0.00 H -ATOM 5274 CA TYR 337 7.527 -2.255 -13.931 1.00 0.00 C -ATOM 5275 HA TYR 337 8.339 -2.951 -14.139 1.00 0.00 H -ATOM 5276 CB TYR 337 7.997 -1.119 -13.118 1.00 0.00 C -ATOM 5277 HB2 TYR 337 8.684 -0.522 -13.718 1.00 0.00 H -ATOM 5278 HB3 TYR 337 7.125 -0.502 -12.899 1.00 0.00 H -ATOM 5279 CG TYR 337 8.684 -1.412 -11.784 1.00 0.00 C -ATOM 5280 CD1 TYR 337 7.850 -1.569 -10.631 1.00 0.00 C -ATOM 5281 HD1 TYR 337 6.778 -1.599 -10.761 1.00 0.00 H -ATOM 5282 CE1 TYR 337 8.486 -1.602 -9.367 1.00 0.00 C -ATOM 5283 HE1 TYR 337 7.890 -1.727 -8.475 1.00 0.00 H -ATOM 5284 CZ TYR 337 9.914 -1.659 -9.235 1.00 0.00 C -ATOM 5285 OH TYR 337 10.492 -1.540 -8.018 1.00 0.00 O -ATOM 5286 HH TYR 337 11.353 -1.117 -8.014 1.00 0.00 H -ATOM 5287 CE2 TYR 337 10.709 -1.659 -10.408 1.00 0.00 C -ATOM 5288 HE2 TYR 337 11.788 -1.611 -10.443 1.00 0.00 H -ATOM 5289 CD2 TYR 337 10.072 -1.465 -11.653 1.00 0.00 C -ATOM 5290 HD2 TYR 337 10.712 -1.616 -12.510 1.00 0.00 H -ATOM 5291 C TYR 337 6.397 -3.007 -13.251 1.00 0.00 C -ATOM 5292 O TYR 337 6.608 -4.114 -12.750 1.00 0.00 O -ATOM 5293 N ALA 338 5.171 -2.578 -13.388 1.00 0.00 N -ATOM 5294 H ALA 338 5.121 -1.697 -13.879 1.00 0.00 H -ATOM 5295 CA ALA 338 4.027 -3.375 -12.997 1.00 0.00 C -ATOM 5296 HA ALA 338 4.167 -3.718 -11.972 1.00 0.00 H -ATOM 5297 CB ALA 338 2.770 -2.550 -13.098 1.00 0.00 C -ATOM 5298 HB1 ALA 338 2.495 -2.429 -14.146 1.00 0.00 H -ATOM 5299 HB2 ALA 338 1.965 -2.918 -12.462 1.00 0.00 H -ATOM 5300 HB3 ALA 338 3.022 -1.586 -12.656 1.00 0.00 H -ATOM 5301 C ALA 338 3.869 -4.651 -13.834 1.00 0.00 C -ATOM 5302 O ALA 338 3.581 -5.728 -13.283 1.00 0.00 O -ATOM 5303 N HIE 339 4.059 -4.595 -15.141 1.00 0.00 N -ATOM 5304 H HIE 339 4.447 -3.735 -15.503 1.00 0.00 H -ATOM 5305 CA HIE 339 4.210 -5.689 -16.102 1.00 0.00 C -ATOM 5306 HA HIE 339 3.303 -6.291 -16.134 1.00 0.00 H -ATOM 5307 CB HIE 339 4.508 -5.026 -17.424 1.00 0.00 C -ATOM 5308 HB2 HIE 339 3.689 -4.316 -17.546 1.00 0.00 H -ATOM 5309 HB3 HIE 339 5.441 -4.479 -17.287 1.00 0.00 H -ATOM 5310 CG HIE 339 4.775 -6.012 -18.514 1.00 0.00 C -ATOM 5311 ND1 HIE 339 3.982 -7.096 -18.864 1.00 0.00 N -ATOM 5312 CE1 HIE 339 4.718 -7.771 -19.785 1.00 0.00 C -ATOM 5313 HE1 HIE 339 4.457 -8.670 -20.324 1.00 0.00 H -ATOM 5314 NE2 HIE 339 5.870 -7.154 -20.042 1.00 0.00 N -ATOM 5315 HE2 HIE 339 6.443 -7.331 -20.855 1.00 0.00 H -ATOM 5316 CD2 HIE 339 5.954 -6.085 -19.216 1.00 0.00 C -ATOM 5317 HD2 HIE 339 6.679 -5.296 -19.076 1.00 0.00 H -ATOM 5318 C HIE 339 5.403 -6.653 -15.823 1.00 0.00 C -ATOM 5319 O HIE 339 5.334 -7.845 -16.057 1.00 0.00 O -ATOM 5320 N ARG 340 6.477 -6.110 -15.123 1.00 0.00 N -ATOM 5321 H ARG 340 6.580 -5.106 -15.098 1.00 0.00 H -ATOM 5322 CA ARG 340 7.537 -6.930 -14.457 1.00 0.00 C -ATOM 5323 HA ARG 340 7.967 -7.722 -15.070 1.00 0.00 H -ATOM 5324 CB ARG 340 8.762 -6.008 -14.222 1.00 0.00 C -ATOM 5325 HB2 ARG 340 9.041 -5.479 -15.133 1.00 0.00 H -ATOM 5326 HB3 ARG 340 8.496 -5.382 -13.370 1.00 0.00 H -ATOM 5327 CG ARG 340 10.070 -6.776 -13.926 1.00 0.00 C -ATOM 5328 HG2 ARG 340 10.902 -6.073 -13.950 1.00 0.00 H -ATOM 5329 HG3 ARG 340 9.841 -7.078 -12.904 1.00 0.00 H -ATOM 5330 CD ARG 340 10.373 -7.988 -14.803 1.00 0.00 C -ATOM 5331 HD2 ARG 340 9.618 -8.757 -14.641 1.00 0.00 H -ATOM 5332 HD3 ARG 340 10.293 -7.684 -15.846 1.00 0.00 H -ATOM 5333 NE ARG 340 11.712 -8.603 -14.615 1.00 0.00 N -ATOM 5334 HE ARG 340 12.427 -8.022 -14.201 1.00 0.00 H -ATOM 5335 CZ ARG 340 12.269 -9.521 -15.374 1.00 0.00 C -ATOM 5336 NH1 ARG 340 11.633 -10.271 -16.174 1.00 0.00 N -ATOM 5337 HH11 ARG 340 10.624 -10.294 -16.143 1.00 0.00 H -ATOM 5338 HH12 ARG 340 12.160 -11.001 -16.632 1.00 0.00 H -ATOM 5339 NH2 ARG 340 13.516 -9.598 -15.329 1.00 0.00 N -ATOM 5340 HH21 ARG 340 13.970 -8.754 -15.010 1.00 0.00 H -ATOM 5341 HH22 ARG 340 13.939 -10.381 -15.806 1.00 0.00 H -ATOM 5342 C ARG 340 7.072 -7.670 -13.238 1.00 0.00 C -ATOM 5343 O ARG 340 7.477 -8.814 -13.062 1.00 0.00 O -ATOM 5344 N ALA 341 6.196 -7.095 -12.372 1.00 0.00 N -ATOM 5345 H ALA 341 5.822 -6.162 -12.465 1.00 0.00 H -ATOM 5346 CA ALA 341 5.735 -7.845 -11.211 1.00 0.00 C -ATOM 5347 HA ALA 341 6.594 -8.366 -10.788 1.00 0.00 H -ATOM 5348 CB ALA 341 5.329 -6.740 -10.123 1.00 0.00 C -ATOM 5349 HB1 ALA 341 4.980 -7.336 -9.280 1.00 0.00 H -ATOM 5350 HB2 ALA 341 6.116 -6.037 -9.850 1.00 0.00 H -ATOM 5351 HB3 ALA 341 4.604 -6.014 -10.489 1.00 0.00 H -ATOM 5352 C ALA 341 4.715 -8.939 -11.421 1.00 0.00 C -ATOM 5353 O ALA 341 4.611 -9.825 -10.597 1.00 0.00 O -ATOM 5354 N LYS 342 3.990 -9.072 -12.549 1.00 0.00 N -ATOM 5355 H LYS 342 4.153 -8.409 -13.294 1.00 0.00 H -ATOM 5356 CA LYS 342 2.920 -10.035 -12.787 1.00 0.00 C -ATOM 5357 HA LYS 342 2.237 -9.816 -11.966 1.00 0.00 H -ATOM 5358 CB LYS 342 2.362 -9.939 -14.251 1.00 0.00 C -ATOM 5359 HB2 LYS 342 3.253 -9.984 -14.878 1.00 0.00 H -ATOM 5360 HB3 LYS 342 1.746 -10.809 -14.479 1.00 0.00 H -ATOM 5361 CG LYS 342 1.477 -8.743 -14.527 1.00 0.00 C -ATOM 5362 HG2 LYS 342 0.776 -8.754 -13.692 1.00 0.00 H -ATOM 5363 HG3 LYS 342 2.090 -7.844 -14.580 1.00 0.00 H -ATOM 5364 CD LYS 342 0.691 -8.685 -15.843 1.00 0.00 C -ATOM 5365 HD2 LYS 342 -0.061 -9.474 -15.836 1.00 0.00 H -ATOM 5366 HD3 LYS 342 0.049 -7.806 -15.776 1.00 0.00 H -ATOM 5367 CE LYS 342 1.423 -8.567 -17.145 1.00 0.00 C -ATOM 5368 HE2 LYS 342 1.969 -7.625 -17.113 1.00 0.00 H -ATOM 5369 HE3 LYS 342 2.095 -9.417 -17.265 1.00 0.00 H -ATOM 5370 NZ LYS 342 0.513 -8.518 -18.308 1.00 0.00 N -ATOM 5371 HZ1 LYS 342 -0.250 -9.179 -18.274 1.00 0.00 H -ATOM 5372 HZ2 LYS 342 -0.000 -7.649 -18.354 1.00 0.00 H -ATOM 5373 HZ3 LYS 342 1.054 -8.580 -19.158 1.00 0.00 H -ATOM 5374 C LYS 342 3.287 -11.490 -12.512 1.00 0.00 C -ATOM 5375 O LYS 342 2.384 -12.288 -12.161 1.00 0.00 O -ATOM 5376 N ASN 343 4.548 -11.924 -12.748 1.00 0.00 N -ATOM 5377 H ASN 343 5.263 -11.220 -12.862 1.00 0.00 H -ATOM 5378 CA ASN 343 4.955 -13.349 -12.719 1.00 0.00 C -ATOM 5379 HA ASN 343 4.123 -13.955 -13.079 1.00 0.00 H -ATOM 5380 CB ASN 343 6.059 -13.631 -13.782 1.00 0.00 C -ATOM 5381 HB2 ASN 343 6.952 -13.135 -13.400 1.00 0.00 H -ATOM 5382 HB3 ASN 343 6.045 -14.713 -13.911 1.00 0.00 H -ATOM 5383 CG ASN 343 5.719 -12.929 -15.068 1.00 0.00 C -ATOM 5384 OD1 ASN 343 5.827 -11.782 -15.389 1.00 0.00 O -ATOM 5385 ND2 ASN 343 5.258 -13.741 -16.045 1.00 0.00 N -ATOM 5386 HD21 ASN 343 4.885 -13.257 -16.849 1.00 0.00 H -ATOM 5387 HD22 ASN 343 4.953 -14.673 -15.803 1.00 0.00 H -ATOM 5388 C ASN 343 5.393 -13.871 -11.280 1.00 0.00 C -ATOM 5389 O ASN 343 6.047 -14.912 -11.227 1.00 0.00 O -ATOM 5390 N ILE 344 5.165 -13.076 -10.282 1.00 0.00 N -ATOM 5391 H ILE 344 4.746 -12.166 -10.413 1.00 0.00 H -ATOM 5392 CA ILE 344 5.293 -13.567 -8.844 1.00 0.00 C -ATOM 5393 HA ILE 344 6.028 -14.372 -8.804 1.00 0.00 H -ATOM 5394 CB ILE 344 5.897 -12.464 -7.964 1.00 0.00 C -ATOM 5395 HB ILE 344 5.141 -11.684 -7.876 1.00 0.00 H -ATOM 5396 CG2 ILE 344 6.203 -12.939 -6.525 1.00 0.00 C -ATOM 5397 HG21 ILE 344 6.316 -12.133 -5.800 1.00 0.00 H -ATOM 5398 HG22 ILE 344 5.279 -13.325 -6.096 1.00 0.00 H -ATOM 5399 HG23 ILE 344 6.969 -13.714 -6.488 1.00 0.00 H -ATOM 5400 CG1 ILE 344 7.159 -11.851 -8.581 1.00 0.00 C -ATOM 5401 HG12 ILE 344 8.048 -12.396 -8.265 1.00 0.00 H -ATOM 5402 HG13 ILE 344 7.141 -11.833 -9.670 1.00 0.00 H -ATOM 5403 CD1 ILE 344 7.445 -10.416 -8.056 1.00 0.00 C -ATOM 5404 HD11 ILE 344 6.552 -9.879 -8.378 1.00 0.00 H -ATOM 5405 HD12 ILE 344 7.477 -10.454 -6.967 1.00 0.00 H -ATOM 5406 HD13 ILE 344 8.349 -10.044 -8.537 1.00 0.00 H -ATOM 5407 C ILE 344 4.013 -14.210 -8.304 1.00 0.00 C -ATOM 5408 O ILE 344 2.952 -13.586 -8.392 1.00 0.00 O -ATOM 5409 N LEU 345 4.075 -15.419 -7.681 1.00 0.00 N -ATOM 5410 H LEU 345 4.998 -15.805 -7.538 1.00 0.00 H -ATOM 5411 CA LEU 345 3.086 -16.009 -6.801 1.00 0.00 C -ATOM 5412 HA LEU 345 2.112 -15.584 -7.042 1.00 0.00 H -ATOM 5413 CB LEU 345 2.980 -17.513 -7.065 1.00 0.00 C -ATOM 5414 HB2 LEU 345 3.896 -18.075 -6.885 1.00 0.00 H -ATOM 5415 HB3 LEU 345 2.368 -17.892 -6.248 1.00 0.00 H -ATOM 5416 CG LEU 345 2.500 -18.021 -8.366 1.00 0.00 C -ATOM 5417 HG LEU 345 1.428 -17.882 -8.506 1.00 0.00 H -ATOM 5418 CD1 LEU 345 3.072 -17.529 -9.678 1.00 0.00 C -ATOM 5419 HD11 LEU 345 2.825 -16.514 -9.990 1.00 0.00 H -ATOM 5420 HD12 LEU 345 4.158 -17.430 -9.670 1.00 0.00 H -ATOM 5421 HD13 LEU 345 2.802 -18.142 -10.538 1.00 0.00 H -ATOM 5422 CD2 LEU 345 2.678 -19.576 -8.480 1.00 0.00 C -ATOM 5423 HD21 LEU 345 2.155 -20.028 -9.323 1.00 0.00 H -ATOM 5424 HD22 LEU 345 3.726 -19.867 -8.543 1.00 0.00 H -ATOM 5425 HD23 LEU 345 2.374 -20.092 -7.569 1.00 0.00 H -ATOM 5426 C LEU 345 3.460 -15.772 -5.295 1.00 0.00 C -ATOM 5427 O LEU 345 4.624 -15.726 -4.949 1.00 0.00 O -ATOM 5428 N ASN 346 2.505 -15.754 -4.395 1.00 0.00 N -ATOM 5429 H ASN 346 1.549 -15.867 -4.700 1.00 0.00 H -ATOM 5430 CA ASN 346 2.718 -16.011 -2.900 1.00 0.00 C -ATOM 5431 HA ASN 346 3.626 -15.568 -2.490 1.00 0.00 H -ATOM 5432 CB ASN 346 1.531 -15.446 -2.142 1.00 0.00 C -ATOM 5433 HB2 ASN 346 0.552 -15.798 -2.468 1.00 0.00 H -ATOM 5434 HB3 ASN 346 1.673 -15.762 -1.109 1.00 0.00 H -ATOM 5435 CG ASN 346 1.772 -13.938 -2.081 1.00 0.00 C -ATOM 5436 OD1 ASN 346 0.981 -13.132 -2.426 1.00 0.00 O -ATOM 5437 ND2 ASN 346 2.842 -13.462 -1.528 1.00 0.00 N -ATOM 5438 HD21 ASN 346 2.847 -12.521 -1.161 1.00 0.00 H -ATOM 5439 HD22 ASN 346 3.472 -14.101 -1.064 1.00 0.00 H -ATOM 5440 C ASN 346 2.876 -17.549 -2.756 1.00 0.00 C -ATOM 5441 O ASN 346 2.160 -18.366 -3.355 1.00 0.00 O -ATOM 5442 N LYS 347 3.744 -17.926 -1.899 1.00 0.00 N -ATOM 5443 H LYS 347 4.436 -17.229 -1.662 1.00 0.00 H -ATOM 5444 CA LYS 347 4.042 -19.301 -1.358 1.00 0.00 C -ATOM 5445 HA LYS 347 4.244 -19.915 -2.235 1.00 0.00 H -ATOM 5446 CB LYS 347 5.203 -19.194 -0.323 1.00 0.00 C -ATOM 5447 HB2 LYS 347 6.042 -18.675 -0.786 1.00 0.00 H -ATOM 5448 HB3 LYS 347 4.753 -18.553 0.435 1.00 0.00 H -ATOM 5449 CG LYS 347 5.589 -20.571 0.317 1.00 0.00 C -ATOM 5450 HG2 LYS 347 4.875 -20.799 1.109 1.00 0.00 H -ATOM 5451 HG3 LYS 347 5.660 -21.338 -0.455 1.00 0.00 H -ATOM 5452 CD LYS 347 6.993 -20.352 0.847 1.00 0.00 C -ATOM 5453 HD2 LYS 347 7.747 -20.196 0.076 1.00 0.00 H -ATOM 5454 HD3 LYS 347 6.976 -19.505 1.532 1.00 0.00 H -ATOM 5455 CE LYS 347 7.376 -21.554 1.759 1.00 0.00 C -ATOM 5456 HE2 LYS 347 8.312 -21.219 2.206 1.00 0.00 H -ATOM 5457 HE3 LYS 347 6.645 -21.663 2.560 1.00 0.00 H -ATOM 5458 NZ LYS 347 7.599 -22.913 1.090 1.00 0.00 N -ATOM 5459 HZ1 LYS 347 6.767 -23.345 0.714 1.00 0.00 H -ATOM 5460 HZ2 LYS 347 8.190 -22.853 0.273 1.00 0.00 H -ATOM 5461 HZ3 LYS 347 7.978 -23.642 1.677 1.00 0.00 H -ATOM 5462 C LYS 347 2.844 -19.970 -0.773 1.00 0.00 C -ATOM 5463 O LYS 347 2.549 -21.143 -1.087 1.00 0.00 O -ATOM 5464 OXT LYS 347 2.190 -19.275 0.072 1.00 0.00 O -TER 5465 LYS 347 -HETATM 5466 O1B ADP 348 -0.425 9.776 -3.915 1.00 0.00 O -HETATM 5467 PB ADP 348 0.408 10.895 -4.280 1.00 0.00 P -HETATM 5468 O2B ADP 348 1.157 10.576 -5.527 1.00 0.00 O -HETATM 5469 O3B ADP 348 1.078 11.539 -3.143 1.00 0.00 O -HETATM 5470 O3A ADP 348 -0.559 11.872 -4.772 1.00 0.00 O -HETATM 5471 PA ADP 348 -0.931 13.210 -4.166 1.00 0.00 P -HETATM 5472 O1A ADP 348 0.266 14.141 -4.282 1.00 0.00 O -HETATM 5473 O2A ADP 348 -1.526 13.110 -2.839 1.00 0.00 O -HETATM 5474 O5* ADP 348 -2.139 13.808 -5.097 1.00 0.00 O -HETATM 5475 C5* ADP 348 -2.633 15.122 -4.847 1.00 0.00 C -HETATM 5476 H50 ADP 348 -2.545 15.750 -5.733 1.00 0.00 H -HETATM 5477 H51 ADP 348 -2.137 15.721 -4.083 1.00 0.00 H -HETATM 5478 C4* ADP 348 -4.063 15.070 -4.327 1.00 0.00 C -HETATM 5479 H40 ADP 348 -4.269 15.994 -3.787 1.00 0.00 H -HETATM 5480 O4* ADP 348 -5.042 14.959 -5.409 1.00 0.00 O -HETATM 5481 C1* ADP 348 -6.160 14.115 -5.092 1.00 0.00 C -HETATM 5482 H10 ADP 348 -7.059 14.716 -5.230 1.00 0.00 H -HETATM 5483 N9 ADP 348 -6.383 12.915 -5.898 1.00 0.00 N -HETATM 5484 C8 ADP 348 -5.524 11.937 -6.159 1.00 0.00 C -HETATM 5485 H80 ADP 348 -4.454 11.919 -6.011 1.00 0.00 H -HETATM 5486 N7 ADP 348 -5.996 10.887 -6.725 1.00 0.00 N -HETATM 5487 C5 ADP 348 -7.326 11.199 -6.909 1.00 0.00 C -HETATM 5488 C6 ADP 348 -8.457 10.643 -7.575 1.00 0.00 C -HETATM 5489 N6 ADP 348 -8.507 9.481 -8.174 1.00 0.00 N -HETATM 5490 H60 ADP 348 -7.742 8.838 -8.026 1.00 0.00 H -HETATM 5491 H61 ADP 348 -9.349 9.326 -8.710 1.00 0.00 H -HETATM 5492 N1 ADP 348 -9.599 11.323 -7.793 1.00 0.00 N -HETATM 5493 C2 ADP 348 -9.689 12.484 -7.278 1.00 0.00 C -HETATM 5494 H2 ADP 348 -10.636 12.979 -7.438 1.00 0.00 H -HETATM 5495 N3 ADP 348 -8.781 13.116 -6.523 1.00 0.00 N -HETATM 5496 C4 ADP 348 -7.615 12.475 -6.428 1.00 0.00 C -HETATM 5497 C3* ADP 348 -4.431 13.942 -3.411 1.00 0.00 C -HETATM 5498 H30 ADP 348 -3.956 13.033 -3.780 1.00 0.00 H -HETATM 5499 O3* ADP 348 -3.950 14.210 -2.080 1.00 0.00 O -HETATM 5500 H3* ADP 348 -3.036 13.920 -2.137 1.00 0.00 H -HETATM 5501 C2* ADP 348 -5.897 13.764 -3.617 1.00 0.00 C -HETATM 5502 H20 ADP 348 -6.150 12.721 -3.424 1.00 0.00 H -HETATM 5503 O2* ADP 348 -6.561 14.640 -2.774 1.00 0.00 O -HETATM 5504 H2* ADP 348 -6.472 14.295 -1.882 1.00 0.00 H -HETATM 5505 MG MG 349 1.634 11.755 -1.414 1.00 0.00 Mg -HETATM 5506 O WAT 438 3.546 11.634 -1.906 1.00 0.00 O -HETATM 5507 H1 WAT 438 3.928 10.929 -2.428 1.00 0.00 H -HETATM 5508 H2 WAT 438 4.300 12.110 -1.559 1.00 0.00 H -HETATM 5509 O WAT 439 1.896 9.719 -0.994 1.00 0.00 O -HETATM 5510 H1 WAT 439 2.702 9.275 -1.259 1.00 0.00 H -HETATM 5511 H2 WAT 439 1.465 9.101 -0.405 1.00 0.00 H -HETATM 5512 O WAT 440 -0.145 12.108 -0.647 1.00 0.00 O -HETATM 5513 H1 WAT 440 -0.658 12.695 -1.202 1.00 0.00 H -HETATM 5514 H2 WAT 440 -0.797 11.647 -0.119 1.00 0.00 H -HETATM 5515 O WAT 441 2.360 12.217 0.545 1.00 0.00 O -HETATM 5516 H1 WAT 441 3.104 12.547 1.049 1.00 0.00 H -HETATM 5517 H2 WAT 441 1.921 11.607 1.138 1.00 0.00 H -CONECT 5481 5480 5482 5483 5501 -CONECT 5493 5492 5494 5495 -CONECT 5501 5481 5497 5502 5503 -CONECT 5497 5478 5498 5499 5501 -CONECT 5496 5483 5487 5495 -CONECT 5478 5475 5479 5480 5497 -CONECT 5487 5486 5488 5496 -CONECT 5475 5474 5476 5477 5478 -CONECT 5488 5487 5489 5492 -CONECT 5484 5483 5485 5486 -CONECT 5482 5481 -CONECT 5494 5493 -CONECT 5504 5503 -CONECT 5502 5501 -CONECT 5500 5499 -CONECT 5498 5497 -CONECT 5479 5478 -CONECT 5476 5475 -CONECT 5477 5475 -CONECT 5490 5489 -CONECT 5491 5489 -CONECT 5485 5484 -CONECT 5492 5488 5493 -CONECT 5495 5493 5496 -CONECT 5489 5488 5490 5491 -CONECT 5486 5484 5487 -CONECT 5483 5481 5484 5496 -CONECT 5472 5471 -CONECT 5466 5467 -CONECT 5503 5501 5504 -CONECT 5473 5471 -CONECT 5468 5467 -CONECT 5499 5497 5500 -CONECT 5470 5467 5471 -CONECT 5469 5467 -CONECT 5480 5478 5481 -CONECT 5474 5471 5475 -CONECT 5471 5470 5472 5473 5474 -CONECT 5467 5466 5468 5469 5470 -CONECT 5507 5506 -CONECT 5508 5506 -CONECT 5506 5507 5508 -CONECT 5510 5509 -CONECT 5511 5509 -CONECT 5509 5510 5511 -CONECT 5513 5512 -CONECT 5514 5512 -CONECT 5512 5513 5514 -CONECT 5516 5515 -CONECT 5517 5515 -CONECT 5515 5516 5517 -END diff --git a/receptor/eg5_adp_mg_01000.pdb b/receptor/eg5_adp_mg_01000.pdb deleted file mode 100644 index 20e1822..0000000 --- a/receptor/eg5_adp_mg_01000.pdb +++ /dev/null @@ -1,5595 +0,0 @@ -HELIX 1 1 LEU 15 LYS 19 1 5 -HELIX 2 2 GLN 63 VAL 70 1 8 -HELIX 3 3 CYS 72 ILE 79 1 8 -HELIX 4 4 LYS 96 MET 100 1 5 -HELIX 5 5 ILE 121 ASN 135 1 15 -HELIX 6 6 LYS 192 LEU 212 1 21 -HELIX 7 7 ASN 214 SER 217 1 4 -HELIX 8 8 ASN 256 ARG 259 1 4 -HELIX 9 9 ASP 264 VAL 288 1 25 -HELIX 10 10 LYS 300 ILE 304 1 5 -HELIX 11 11 LEU 328 ASN 343 1 16 -SHEET 1 1 1 GLN 5 CYS 10 0 -SHEET 2 2 1 VAL 26 ASP 29 0 -SHEET 3 3 1 GLU 34 VAL 37 0 -SHEET 4 4 1 LYS 49 THR 52 0 -SHEET 5 5 1 MET 55 PHE 57 0 -SHEET 6 6 1 ASN 83 GLY 90 0 -SHEET 7 7 1 PHE 139 TYR 149 0 -SHEET 8 8 1 GLU 152 PHE 154 0 -SHEET 9 9 1 MET 169 ASP 171 0 -SHEET 10 10 1 VAL 179 ILE 181 0 -SHEET 11 11 1 ILE 187 VAL 189 0 -SHEET 12 12 1 HIE 221 GLU 232 0 -SHEET 13 13 1 LEU 240 ASP 250 0 -SHEET 14 14 1 ARG 314 ILE 321 0 -CRYST1 88.626 88.626 88.626 109.47 109.47 109.47 1 -ATOM 1 N GLY 1 0.977 -21.125 -3.548 1.00 0.00 N -ATOM 2 H1 GLY 1 0.646 -21.861 -4.156 1.00 0.00 H -ATOM 3 H2 GLY 1 1.491 -21.579 -2.806 1.00 0.00 H -ATOM 4 H3 GLY 1 1.696 -20.600 -4.024 1.00 0.00 H -ATOM 5 CA GLY 1 -0.145 -20.276 -3.147 1.00 0.00 C -ATOM 6 HA2 GLY 1 -0.907 -20.799 -2.569 1.00 0.00 H -ATOM 7 HA3 GLY 1 0.275 -19.465 -2.552 1.00 0.00 H -ATOM 8 C GLY 1 -0.782 -19.713 -4.402 1.00 0.00 C -ATOM 9 O GLY 1 -0.602 -20.197 -5.520 1.00 0.00 O -ATOM 10 N LYS 2 -1.394 -18.537 -4.281 1.00 0.00 N -ATOM 11 H LYS 2 -1.430 -18.067 -3.388 1.00 0.00 H -ATOM 12 CA LYS 2 -2.020 -17.741 -5.359 1.00 0.00 C -ATOM 13 HA LYS 2 -2.282 -18.418 -6.171 1.00 0.00 H -ATOM 14 CB LYS 2 -3.341 -17.119 -4.853 1.00 0.00 C -ATOM 15 HB2 LYS 2 -3.928 -17.988 -4.557 1.00 0.00 H -ATOM 16 HB3 LYS 2 -3.105 -16.583 -3.933 1.00 0.00 H -ATOM 17 CG LYS 2 -4.321 -16.267 -5.825 1.00 0.00 C -ATOM 18 HG2 LYS 2 -4.181 -15.186 -5.841 1.00 0.00 H -ATOM 19 HG3 LYS 2 -4.031 -16.533 -6.842 1.00 0.00 H -ATOM 20 CD LYS 2 -5.827 -16.512 -5.624 1.00 0.00 C -ATOM 21 HD2 LYS 2 -6.074 -17.574 -5.647 1.00 0.00 H -ATOM 22 HD3 LYS 2 -5.962 -16.245 -4.575 1.00 0.00 H -ATOM 23 CE LYS 2 -6.860 -15.762 -6.511 1.00 0.00 C -ATOM 24 HE2 LYS 2 -7.839 -16.153 -6.233 1.00 0.00 H -ATOM 25 HE3 LYS 2 -6.797 -14.701 -6.268 1.00 0.00 H -ATOM 26 NZ LYS 2 -6.436 -15.901 -7.909 1.00 0.00 N -ATOM 27 HZ1 LYS 2 -6.389 -16.860 -8.223 1.00 0.00 H -ATOM 28 HZ2 LYS 2 -6.994 -15.378 -8.569 1.00 0.00 H -ATOM 29 HZ3 LYS 2 -5.491 -15.561 -8.026 1.00 0.00 H -ATOM 30 C LYS 2 -1.108 -16.698 -6.086 1.00 0.00 C -ATOM 31 O LYS 2 -0.138 -16.155 -5.446 1.00 0.00 O -ATOM 32 N ASN 3 -1.257 -16.593 -7.409 1.00 0.00 N -ATOM 33 H ASN 3 -1.780 -17.332 -7.856 1.00 0.00 H -ATOM 34 CA ASN 3 -0.566 -15.537 -8.159 1.00 0.00 C -ATOM 35 HA ASN 3 0.509 -15.703 -8.091 1.00 0.00 H -ATOM 36 CB ASN 3 -1.048 -15.627 -9.659 1.00 0.00 C -ATOM 37 HB2 ASN 3 -1.281 -16.665 -9.898 1.00 0.00 H -ATOM 38 HB3 ASN 3 -2.022 -15.143 -9.729 1.00 0.00 H -ATOM 39 CG ASN 3 -0.107 -15.019 -10.614 1.00 0.00 C -ATOM 40 OD1 ASN 3 0.694 -15.792 -11.200 1.00 0.00 O -ATOM 41 ND2 ASN 3 0.078 -13.724 -10.682 1.00 0.00 N -ATOM 42 HD21 ASN 3 0.912 -13.399 -11.150 1.00 0.00 H -ATOM 43 HD22 ASN 3 -0.507 -13.009 -10.273 1.00 0.00 H -ATOM 44 C ASN 3 -0.815 -14.151 -7.518 1.00 0.00 C -ATOM 45 O ASN 3 -1.969 -13.962 -7.135 1.00 0.00 O -ATOM 46 N ILE 4 0.174 -13.294 -7.545 1.00 0.00 N -ATOM 47 H ILE 4 1.045 -13.583 -7.966 1.00 0.00 H -ATOM 48 CA ILE 4 -0.037 -11.964 -7.008 1.00 0.00 C -ATOM 49 HA ILE 4 -0.495 -12.099 -6.028 1.00 0.00 H -ATOM 50 CB ILE 4 1.304 -11.259 -6.737 1.00 0.00 C -ATOM 51 HB ILE 4 1.964 -11.428 -7.588 1.00 0.00 H -ATOM 52 CG2 ILE 4 1.137 -9.708 -6.578 1.00 0.00 C -ATOM 53 HG21 ILE 4 2.015 -9.147 -6.259 1.00 0.00 H -ATOM 54 HG22 ILE 4 0.810 -9.277 -7.525 1.00 0.00 H -ATOM 55 HG23 ILE 4 0.329 -9.520 -5.871 1.00 0.00 H -ATOM 56 CG1 ILE 4 1.946 -11.806 -5.465 1.00 0.00 C -ATOM 57 HG12 ILE 4 1.295 -11.538 -4.633 1.00 0.00 H -ATOM 58 HG13 ILE 4 1.876 -12.894 -5.458 1.00 0.00 H -ATOM 59 CD1 ILE 4 3.328 -11.312 -5.018 1.00 0.00 C -ATOM 60 HD11 ILE 4 4.029 -11.534 -5.823 1.00 0.00 H -ATOM 61 HD12 ILE 4 3.223 -10.248 -4.811 1.00 0.00 H -ATOM 62 HD13 ILE 4 3.653 -11.920 -4.173 1.00 0.00 H -ATOM 63 C ILE 4 -0.922 -11.254 -8.003 1.00 0.00 C -ATOM 64 O ILE 4 -0.736 -11.157 -9.219 1.00 0.00 O -ATOM 65 N GLN 5 -1.963 -10.668 -7.444 1.00 0.00 N -ATOM 66 H GLN 5 -2.087 -10.743 -6.444 1.00 0.00 H -ATOM 67 CA GLN 5 -2.843 -9.772 -8.232 1.00 0.00 C -ATOM 68 HA GLN 5 -3.174 -10.286 -9.134 1.00 0.00 H -ATOM 69 CB GLN 5 -4.200 -9.592 -7.476 1.00 0.00 C -ATOM 70 HB2 GLN 5 -4.640 -10.589 -7.465 1.00 0.00 H -ATOM 71 HB3 GLN 5 -4.026 -9.262 -6.451 1.00 0.00 H -ATOM 72 CG GLN 5 -5.281 -8.670 -8.151 1.00 0.00 C -ATOM 73 HG2 GLN 5 -4.795 -7.695 -8.117 1.00 0.00 H -ATOM 74 HG3 GLN 5 -5.309 -8.944 -9.205 1.00 0.00 H -ATOM 75 CD GLN 5 -6.664 -8.827 -7.523 1.00 0.00 C -ATOM 76 OE1 GLN 5 -6.741 -9.131 -6.333 1.00 0.00 O -ATOM 77 NE2 GLN 5 -7.790 -8.598 -8.133 1.00 0.00 N -ATOM 78 HE21 GLN 5 -8.620 -8.580 -7.559 1.00 0.00 H -ATOM 79 HE22 GLN 5 -7.840 -8.333 -9.106 1.00 0.00 H -ATOM 80 C GLN 5 -2.148 -8.477 -8.670 1.00 0.00 C -ATOM 81 O GLN 5 -1.703 -7.714 -7.818 1.00 0.00 O -ATOM 82 N VAL 6 -2.205 -8.026 -9.941 1.00 0.00 N -ATOM 83 H VAL 6 -2.699 -8.559 -10.643 1.00 0.00 H -ATOM 84 CA VAL 6 -1.643 -6.673 -10.326 1.00 0.00 C -ATOM 85 HA VAL 6 -1.377 -6.125 -9.422 1.00 0.00 H -ATOM 86 CB VAL 6 -0.295 -6.728 -11.121 1.00 0.00 C -ATOM 87 HB VAL 6 -0.378 -7.152 -12.121 1.00 0.00 H -ATOM 88 CG1 VAL 6 0.299 -5.268 -11.208 1.00 0.00 C -ATOM 89 HG11 VAL 6 0.650 -4.867 -10.257 1.00 0.00 H -ATOM 90 HG12 VAL 6 1.187 -5.182 -11.833 1.00 0.00 H -ATOM 91 HG13 VAL 6 -0.479 -4.574 -11.527 1.00 0.00 H -ATOM 92 CG2 VAL 6 0.690 -7.557 -10.337 1.00 0.00 C -ATOM 93 HG21 VAL 6 1.690 -7.423 -10.750 1.00 0.00 H -ATOM 94 HG22 VAL 6 0.652 -7.169 -9.318 1.00 0.00 H -ATOM 95 HG23 VAL 6 0.402 -8.603 -10.436 1.00 0.00 H -ATOM 96 C VAL 6 -2.753 -5.839 -11.002 1.00 0.00 C -ATOM 97 O VAL 6 -3.316 -6.232 -12.047 1.00 0.00 O -ATOM 98 N VAL 7 -3.131 -4.617 -10.532 1.00 0.00 N -ATOM 99 H VAL 7 -2.825 -4.262 -9.637 1.00 0.00 H -ATOM 100 CA VAL 7 -4.305 -3.815 -10.993 1.00 0.00 C -ATOM 101 HA VAL 7 -4.627 -4.234 -11.947 1.00 0.00 H -ATOM 102 CB VAL 7 -5.466 -4.013 -10.000 1.00 0.00 C -ATOM 103 HB VAL 7 -6.380 -3.696 -10.502 1.00 0.00 H -ATOM 104 CG1 VAL 7 -5.706 -5.493 -9.652 1.00 0.00 C -ATOM 105 HG11 VAL 7 -4.788 -5.799 -9.150 1.00 0.00 H -ATOM 106 HG12 VAL 7 -6.475 -5.585 -8.885 1.00 0.00 H -ATOM 107 HG13 VAL 7 -5.968 -6.091 -10.525 1.00 0.00 H -ATOM 108 CG2 VAL 7 -5.423 -3.218 -8.692 1.00 0.00 C -ATOM 109 HG21 VAL 7 -6.265 -3.467 -8.045 1.00 0.00 H -ATOM 110 HG22 VAL 7 -4.490 -3.463 -8.185 1.00 0.00 H -ATOM 111 HG23 VAL 7 -5.455 -2.145 -8.880 1.00 0.00 H -ATOM 112 C VAL 7 -3.955 -2.349 -11.141 1.00 0.00 C -ATOM 113 O VAL 7 -3.045 -1.775 -10.577 1.00 0.00 O -ATOM 114 N VAL 8 -4.722 -1.672 -12.065 1.00 0.00 N -ATOM 115 H VAL 8 -5.656 -1.959 -12.319 1.00 0.00 H -ATOM 116 CA VAL 8 -4.386 -0.331 -12.475 1.00 0.00 C -ATOM 117 HA VAL 8 -3.411 -0.173 -12.013 1.00 0.00 H -ATOM 118 CB VAL 8 -4.065 -0.291 -13.970 1.00 0.00 C -ATOM 119 HB VAL 8 -4.920 -0.413 -14.634 1.00 0.00 H -ATOM 120 CG1 VAL 8 -3.408 1.076 -14.252 1.00 0.00 C -ATOM 121 HG11 VAL 8 -3.146 1.116 -15.310 1.00 0.00 H -ATOM 122 HG12 VAL 8 -4.145 1.878 -14.292 1.00 0.00 H -ATOM 123 HG13 VAL 8 -2.535 1.242 -13.621 1.00 0.00 H -ATOM 124 CG2 VAL 8 -2.948 -1.286 -14.354 1.00 0.00 C -ATOM 125 HG21 VAL 8 -2.063 -1.240 -13.719 1.00 0.00 H -ATOM 126 HG22 VAL 8 -3.403 -2.272 -14.259 1.00 0.00 H -ATOM 127 HG23 VAL 8 -2.613 -1.109 -15.376 1.00 0.00 H -ATOM 128 C VAL 8 -5.412 0.644 -11.973 1.00 0.00 C -ATOM 129 O VAL 8 -6.587 0.263 -12.071 1.00 0.00 O -ATOM 130 N ARG 9 -5.010 1.844 -11.645 1.00 0.00 N -ATOM 131 H ARG 9 -4.008 1.889 -11.532 1.00 0.00 H -ATOM 132 CA ARG 9 -5.947 2.993 -11.458 1.00 0.00 C -ATOM 133 HA ARG 9 -6.872 2.829 -12.011 1.00 0.00 H -ATOM 134 CB ARG 9 -6.322 3.196 -10.012 1.00 0.00 C -ATOM 135 HB2 ARG 9 -6.703 2.239 -9.657 1.00 0.00 H -ATOM 136 HB3 ARG 9 -5.393 3.358 -9.465 1.00 0.00 H -ATOM 137 CG ARG 9 -7.267 4.330 -9.701 1.00 0.00 C -ATOM 138 HG2 ARG 9 -6.871 5.288 -10.040 1.00 0.00 H -ATOM 139 HG3 ARG 9 -8.196 4.151 -10.243 1.00 0.00 H -ATOM 140 CD ARG 9 -7.631 4.556 -8.196 1.00 0.00 C -ATOM 141 HD2 ARG 9 -7.961 3.599 -7.793 1.00 0.00 H -ATOM 142 HD3 ARG 9 -6.675 4.841 -7.756 1.00 0.00 H -ATOM 143 NE ARG 9 -8.760 5.488 -7.968 1.00 0.00 N -ATOM 144 HE ARG 9 -8.936 6.188 -8.675 1.00 0.00 H -ATOM 145 CZ ARG 9 -9.362 5.657 -6.826 1.00 0.00 C -ATOM 146 NH1 ARG 9 -8.965 5.067 -5.738 1.00 0.00 N -ATOM 147 HH11 ARG 9 -8.143 4.481 -5.704 1.00 0.00 H -ATOM 148 HH12 ARG 9 -9.414 5.234 -4.849 1.00 0.00 H -ATOM 149 NH2 ARG 9 -10.360 6.422 -6.716 1.00 0.00 N -ATOM 150 HH21 ARG 9 -10.813 6.849 -7.512 1.00 0.00 H -ATOM 151 HH22 ARG 9 -10.762 6.592 -5.806 1.00 0.00 H -ATOM 152 C ARG 9 -5.241 4.212 -12.050 1.00 0.00 C -ATOM 153 O ARG 9 -4.103 4.631 -11.679 1.00 0.00 O -ATOM 154 N CYS 10 -6.016 4.846 -12.921 1.00 0.00 N -ATOM 155 H CYS 10 -6.773 4.273 -13.266 1.00 0.00 H -ATOM 156 CA CYS 10 -5.892 6.217 -13.563 1.00 0.00 C -ATOM 157 HA CYS 10 -4.882 6.628 -13.552 1.00 0.00 H -ATOM 158 CB CYS 10 -6.218 6.027 -15.068 1.00 0.00 C -ATOM 159 HB2 CYS 10 -5.546 5.350 -15.594 1.00 0.00 H -ATOM 160 HB3 CYS 10 -7.221 5.616 -15.185 1.00 0.00 H -ATOM 161 SG CYS 10 -6.164 7.507 -16.018 1.00 0.00 S -ATOM 162 HG CYS 10 -6.150 6.819 -17.164 1.00 0.00 H -ATOM 163 C CYS 10 -6.827 7.163 -12.799 1.00 0.00 C -ATOM 164 O CYS 10 -7.820 6.756 -12.241 1.00 0.00 O -ATOM 165 N ARG 11 -6.356 8.445 -12.676 1.00 0.00 N -ATOM 166 H ARG 11 -5.470 8.668 -13.108 1.00 0.00 H -ATOM 167 CA ARG 11 -6.969 9.613 -11.898 1.00 0.00 C -ATOM 168 HA ARG 11 -7.796 9.104 -11.402 1.00 0.00 H -ATOM 169 CB ARG 11 -6.092 9.984 -10.753 1.00 0.00 C -ATOM 170 HB2 ARG 11 -6.611 10.647 -10.061 1.00 0.00 H -ATOM 171 HB3 ARG 11 -5.783 9.043 -10.297 1.00 0.00 H -ATOM 172 CG ARG 11 -4.766 10.614 -11.201 1.00 0.00 C -ATOM 173 HG2 ARG 11 -3.937 9.924 -11.046 1.00 0.00 H -ATOM 174 HG3 ARG 11 -4.885 10.745 -12.276 1.00 0.00 H -ATOM 175 CD ARG 11 -4.452 12.001 -10.520 1.00 0.00 C -ATOM 176 HD2 ARG 11 -5.237 12.689 -10.834 1.00 0.00 H -ATOM 177 HD3 ARG 11 -4.529 11.877 -9.440 1.00 0.00 H -ATOM 178 NE ARG 11 -3.146 12.519 -10.892 1.00 0.00 N -ATOM 179 HE ARG 11 -2.468 12.457 -10.147 1.00 0.00 H -ATOM 180 CZ ARG 11 -2.719 13.204 -11.916 1.00 0.00 C -ATOM 181 NH1 ARG 11 -3.488 13.608 -12.857 1.00 0.00 N -ATOM 182 HH11 ARG 11 -4.457 13.442 -12.626 1.00 0.00 H -ATOM 183 HH12 ARG 11 -3.202 14.320 -13.514 1.00 0.00 H -ATOM 184 NH2 ARG 11 -1.458 13.549 -11.947 1.00 0.00 N -ATOM 185 HH21 ARG 11 -0.851 13.349 -11.164 1.00 0.00 H -ATOM 186 HH22 ARG 11 -1.111 14.030 -12.764 1.00 0.00 H -ATOM 187 C ARG 11 -7.528 10.742 -12.796 1.00 0.00 C -ATOM 188 O ARG 11 -7.063 10.828 -13.905 1.00 0.00 O -ATOM 189 N PRO 12 -8.519 11.580 -12.387 1.00 0.00 N -ATOM 190 CD PRO 12 -9.317 11.611 -11.149 1.00 0.00 C -ATOM 191 HD2 PRO 12 -8.842 12.094 -10.295 1.00 0.00 H -ATOM 192 HD3 PRO 12 -9.617 10.629 -10.784 1.00 0.00 H -ATOM 193 CG PRO 12 -10.478 12.435 -11.455 1.00 0.00 C -ATOM 194 HG2 PRO 12 -10.826 13.030 -10.610 1.00 0.00 H -ATOM 195 HG3 PRO 12 -11.287 11.883 -11.935 1.00 0.00 H -ATOM 196 CB PRO 12 -9.906 13.496 -12.403 1.00 0.00 C -ATOM 197 HB2 PRO 12 -9.446 14.306 -11.838 1.00 0.00 H -ATOM 198 HB3 PRO 12 -10.662 13.841 -13.108 1.00 0.00 H -ATOM 199 CA PRO 12 -8.822 12.868 -13.190 1.00 0.00 C -ATOM 200 HA PRO 12 -9.174 12.605 -14.188 1.00 0.00 H -ATOM 201 C PRO 12 -7.536 13.765 -13.348 1.00 0.00 C -ATOM 202 O PRO 12 -6.577 13.541 -12.596 1.00 0.00 O -ATOM 203 N PHE 13 -7.548 14.748 -14.289 1.00 0.00 N -ATOM 204 H PHE 13 -8.397 14.993 -14.779 1.00 0.00 H -ATOM 205 CA PHE 13 -6.407 15.594 -14.517 1.00 0.00 C -ATOM 206 HA PHE 13 -5.578 14.900 -14.650 1.00 0.00 H -ATOM 207 CB PHE 13 -6.561 16.445 -15.813 1.00 0.00 C -ATOM 208 HB2 PHE 13 -7.549 16.904 -15.783 1.00 0.00 H -ATOM 209 HB3 PHE 13 -5.962 17.347 -15.688 1.00 0.00 H -ATOM 210 CG PHE 13 -6.285 15.848 -17.176 1.00 0.00 C -ATOM 211 CD1 PHE 13 -5.184 16.292 -17.989 1.00 0.00 C -ATOM 212 HD1 PHE 13 -4.540 17.022 -17.523 1.00 0.00 H -ATOM 213 CE1 PHE 13 -5.096 15.916 -19.348 1.00 0.00 C -ATOM 214 HE1 PHE 13 -4.456 16.439 -20.043 1.00 0.00 H -ATOM 215 CZ PHE 13 -5.997 14.999 -19.845 1.00 0.00 C -ATOM 216 HZ PHE 13 -5.895 14.647 -20.861 1.00 0.00 H -ATOM 217 CE2 PHE 13 -6.993 14.453 -19.016 1.00 0.00 C -ATOM 218 HE2 PHE 13 -7.597 13.646 -19.403 1.00 0.00 H -ATOM 219 CD2 PHE 13 -7.201 14.868 -17.699 1.00 0.00 C -ATOM 220 HD2 PHE 13 -8.060 14.499 -17.158 1.00 0.00 H -ATOM 221 C PHE 13 -6.153 16.447 -13.238 1.00 0.00 C -ATOM 222 O PHE 13 -7.098 16.958 -12.642 1.00 0.00 O -ATOM 223 N ASN 14 -4.890 16.661 -12.813 1.00 0.00 N -ATOM 224 H ASN 14 -4.180 16.324 -13.447 1.00 0.00 H -ATOM 225 CA ASN 14 -4.520 17.678 -11.762 1.00 0.00 C -ATOM 226 HA ASN 14 -5.416 17.751 -11.146 1.00 0.00 H -ATOM 227 CB ASN 14 -3.304 17.217 -10.970 1.00 0.00 C -ATOM 228 HB2 ASN 14 -3.213 17.796 -10.051 1.00 0.00 H -ATOM 229 HB3 ASN 14 -3.353 16.157 -10.720 1.00 0.00 H -ATOM 230 CG ASN 14 -1.973 17.314 -11.711 1.00 0.00 C -ATOM 231 OD1 ASN 14 -1.827 18.117 -12.633 1.00 0.00 O -ATOM 232 ND2 ASN 14 -0.967 16.650 -11.108 1.00 0.00 N -ATOM 233 HD21 ASN 14 -0.097 16.486 -11.596 1.00 0.00 H -ATOM 234 HD22 ASN 14 -1.163 16.175 -10.239 1.00 0.00 H -ATOM 235 C ASN 14 -4.508 19.140 -12.297 1.00 0.00 C -ATOM 236 O ASN 14 -4.748 19.419 -13.514 1.00 0.00 O -ATOM 237 N LEU 15 -4.164 20.099 -11.444 1.00 0.00 N -ATOM 238 H LEU 15 -3.954 19.967 -10.466 1.00 0.00 H -ATOM 239 CA LEU 15 -4.096 21.536 -11.922 1.00 0.00 C -ATOM 240 HA LEU 15 -4.963 21.919 -12.461 1.00 0.00 H -ATOM 241 CB LEU 15 -4.007 22.571 -10.794 1.00 0.00 C -ATOM 242 HB2 LEU 15 -4.943 22.547 -10.236 1.00 0.00 H -ATOM 243 HB3 LEU 15 -3.255 22.292 -10.055 1.00 0.00 H -ATOM 244 CG LEU 15 -3.674 24.005 -11.119 1.00 0.00 C -ATOM 245 HG LEU 15 -2.649 23.930 -11.482 1.00 0.00 H -ATOM 246 CD1 LEU 15 -4.776 24.637 -11.993 1.00 0.00 C -ATOM 247 HD11 LEU 15 -4.281 25.526 -12.385 1.00 0.00 H -ATOM 248 HD12 LEU 15 -5.017 23.976 -12.825 1.00 0.00 H -ATOM 249 HD13 LEU 15 -5.742 24.833 -11.527 1.00 0.00 H -ATOM 250 CD2 LEU 15 -3.512 24.888 -9.895 1.00 0.00 C -ATOM 251 HD21 LEU 15 -4.443 24.812 -9.333 1.00 0.00 H -ATOM 252 HD22 LEU 15 -2.698 24.555 -9.251 1.00 0.00 H -ATOM 253 HD23 LEU 15 -3.209 25.877 -10.239 1.00 0.00 H -ATOM 254 C LEU 15 -2.937 21.792 -12.906 1.00 0.00 C -ATOM 255 O LEU 15 -3.133 22.588 -13.862 1.00 0.00 O -ATOM 256 N ALA 16 -1.769 21.240 -12.735 1.00 0.00 N -ATOM 257 H ALA 16 -1.732 20.677 -11.897 1.00 0.00 H -ATOM 258 CA ALA 16 -0.449 21.456 -13.429 1.00 0.00 C -ATOM 259 HA ALA 16 -0.240 22.523 -13.513 1.00 0.00 H -ATOM 260 CB ALA 16 0.641 20.708 -12.566 1.00 0.00 C -ATOM 261 HB1 ALA 16 1.626 20.906 -12.988 1.00 0.00 H -ATOM 262 HB2 ALA 16 0.540 21.087 -11.549 1.00 0.00 H -ATOM 263 HB3 ALA 16 0.370 19.658 -12.463 1.00 0.00 H -ATOM 264 C ALA 16 -0.560 20.908 -14.857 1.00 0.00 C -ATOM 265 O ALA 16 -0.077 21.514 -15.750 1.00 0.00 O -ATOM 266 N GLU 17 -1.198 19.742 -15.056 1.00 0.00 N -ATOM 267 H GLU 17 -1.555 19.295 -14.224 1.00 0.00 H -ATOM 268 CA GLU 17 -1.502 19.085 -16.347 1.00 0.00 C -ATOM 269 HA GLU 17 -0.538 19.131 -16.853 1.00 0.00 H -ATOM 270 CB GLU 17 -2.087 17.694 -16.110 1.00 0.00 C -ATOM 271 HB2 GLU 17 -3.035 17.840 -15.593 1.00 0.00 H -ATOM 272 HB3 GLU 17 -2.284 17.237 -17.080 1.00 0.00 H -ATOM 273 CG GLU 17 -1.075 16.766 -15.462 1.00 0.00 C -ATOM 274 HG2 GLU 17 -0.325 16.507 -16.209 1.00 0.00 H -ATOM 275 HG3 GLU 17 -0.573 17.322 -14.670 1.00 0.00 H -ATOM 276 CD GLU 17 -1.736 15.557 -14.843 1.00 0.00 C -ATOM 277 OE1 GLU 17 -2.982 15.437 -14.751 1.00 0.00 O -ATOM 278 OE2 GLU 17 -0.968 14.630 -14.406 1.00 0.00 O -ATOM 279 C GLU 17 -2.450 19.939 -17.328 1.00 0.00 C -ATOM 280 O GLU 17 -2.149 20.090 -18.530 1.00 0.00 O -ATOM 281 N ARG 18 -3.532 20.624 -16.862 1.00 0.00 N -ATOM 282 H ARG 18 -3.795 20.404 -15.912 1.00 0.00 H -ATOM 283 CA ARG 18 -4.189 21.737 -17.674 1.00 0.00 C -ATOM 284 HA ARG 18 -4.633 21.268 -18.551 1.00 0.00 H -ATOM 285 CB ARG 18 -5.398 22.215 -16.945 1.00 0.00 C -ATOM 286 HB2 ARG 18 -5.987 21.398 -16.529 1.00 0.00 H -ATOM 287 HB3 ARG 18 -4.969 22.792 -16.126 1.00 0.00 H -ATOM 288 CG ARG 18 -6.300 23.110 -17.761 1.00 0.00 C -ATOM 289 HG2 ARG 18 -5.890 24.075 -18.061 1.00 0.00 H -ATOM 290 HG3 ARG 18 -6.606 22.672 -18.711 1.00 0.00 H -ATOM 291 CD ARG 18 -7.565 23.436 -16.965 1.00 0.00 C -ATOM 292 HD2 ARG 18 -7.785 22.610 -16.288 1.00 0.00 H -ATOM 293 HD3 ARG 18 -7.391 24.325 -16.359 1.00 0.00 H -ATOM 294 NE ARG 18 -8.730 23.755 -17.787 1.00 0.00 N -ATOM 295 HE ARG 18 -8.506 23.600 -18.759 1.00 0.00 H -ATOM 296 CZ ARG 18 -9.933 24.204 -17.510 1.00 0.00 C -ATOM 297 NH1 ARG 18 -10.315 24.491 -16.235 1.00 0.00 N -ATOM 298 HH11 ARG 18 -9.667 24.167 -15.532 1.00 0.00 H -ATOM 299 HH12 ARG 18 -11.049 25.153 -16.028 1.00 0.00 H -ATOM 300 NH2 ARG 18 -10.860 24.425 -18.362 1.00 0.00 N -ATOM 301 HH21 ARG 18 -10.652 24.450 -19.350 1.00 0.00 H -ATOM 302 HH22 ARG 18 -11.753 24.732 -18.004 1.00 0.00 H -ATOM 303 C ARG 18 -3.259 22.842 -18.116 1.00 0.00 C -ATOM 304 O ARG 18 -3.167 23.159 -19.329 1.00 0.00 O -ATOM 305 N LYS 19 -2.545 23.432 -17.136 1.00 0.00 N -ATOM 306 H LYS 19 -2.727 23.134 -16.188 1.00 0.00 H -ATOM 307 CA LYS 19 -1.402 24.372 -17.251 1.00 0.00 C -ATOM 308 HA LYS 19 -1.765 25.231 -17.815 1.00 0.00 H -ATOM 309 CB LYS 19 -0.803 24.812 -15.874 1.00 0.00 C -ATOM 310 HB2 LYS 19 -0.114 24.132 -15.371 1.00 0.00 H -ATOM 311 HB3 LYS 19 -0.069 25.593 -16.072 1.00 0.00 H -ATOM 312 CG LYS 19 -1.854 25.413 -14.918 1.00 0.00 C -ATOM 313 HG2 LYS 19 -2.181 26.314 -15.438 1.00 0.00 H -ATOM 314 HG3 LYS 19 -2.646 24.669 -14.833 1.00 0.00 H -ATOM 315 CD LYS 19 -1.404 25.872 -13.600 1.00 0.00 C -ATOM 316 HD2 LYS 19 -2.287 26.285 -13.112 1.00 0.00 H -ATOM 317 HD3 LYS 19 -1.156 24.982 -13.022 1.00 0.00 H -ATOM 318 CE LYS 19 -0.172 26.843 -13.689 1.00 0.00 C -ATOM 319 HE2 LYS 19 0.653 26.308 -14.160 1.00 0.00 H -ATOM 320 HE3 LYS 19 -0.555 27.661 -14.298 1.00 0.00 H -ATOM 321 NZ LYS 19 0.185 27.300 -12.323 1.00 0.00 N -ATOM 322 HZ1 LYS 19 -0.556 27.367 -11.640 1.00 0.00 H -ATOM 323 HZ2 LYS 19 0.793 26.597 -11.927 1.00 0.00 H -ATOM 324 HZ3 LYS 19 0.729 28.150 -12.350 1.00 0.00 H -ATOM 325 C LYS 19 -0.258 23.918 -18.120 1.00 0.00 C -ATOM 326 O LYS 19 0.599 24.804 -18.394 1.00 0.00 O -ATOM 327 N ALA 20 -0.080 22.652 -18.603 1.00 0.00 N -ATOM 328 H ALA 20 -0.651 21.958 -18.142 1.00 0.00 H -ATOM 329 CA ALA 20 0.936 22.190 -19.524 1.00 0.00 C -ATOM 330 HA ALA 20 1.662 22.964 -19.774 1.00 0.00 H -ATOM 331 CB ALA 20 1.788 21.173 -18.860 1.00 0.00 C -ATOM 332 HB1 ALA 20 2.758 21.033 -19.336 1.00 0.00 H -ATOM 333 HB2 ALA 20 1.851 21.407 -17.797 1.00 0.00 H -ATOM 334 HB3 ALA 20 1.314 20.192 -18.824 1.00 0.00 H -ATOM 335 C ALA 20 0.332 21.822 -20.916 1.00 0.00 C -ATOM 336 O ALA 20 0.926 21.208 -21.709 1.00 0.00 O -ATOM 337 N SER 21 -0.910 22.236 -21.157 1.00 0.00 N -ATOM 338 H SER 21 -1.425 22.585 -20.362 1.00 0.00 H -ATOM 339 CA SER 21 -1.660 21.869 -22.377 1.00 0.00 C -ATOM 340 HA SER 21 -2.716 22.089 -22.218 1.00 0.00 H -ATOM 341 CB SER 21 -1.232 22.694 -23.614 1.00 0.00 C -ATOM 342 HB2 SER 21 -0.170 22.609 -23.845 1.00 0.00 H -ATOM 343 HB3 SER 21 -1.814 22.333 -24.462 1.00 0.00 H -ATOM 344 OG SER 21 -1.512 24.056 -23.418 1.00 0.00 O -ATOM 345 HG SER 21 -0.957 24.267 -22.664 1.00 0.00 H -ATOM 346 C SER 21 -1.619 20.347 -22.713 1.00 0.00 C -ATOM 347 O SER 21 -1.560 19.968 -23.906 1.00 0.00 O -ATOM 348 N ALA 22 -1.514 19.494 -21.658 1.00 0.00 N -ATOM 349 H ALA 22 -1.669 19.850 -20.726 1.00 0.00 H -ATOM 350 CA ALA 22 -1.342 18.084 -21.706 1.00 0.00 C -ATOM 351 HA ALA 22 -0.376 18.018 -22.207 1.00 0.00 H -ATOM 352 CB ALA 22 -1.048 17.427 -20.292 1.00 0.00 C -ATOM 353 HB1 ALA 22 -0.884 16.358 -20.423 1.00 0.00 H -ATOM 354 HB2 ALA 22 -0.200 17.953 -19.854 1.00 0.00 H -ATOM 355 HB3 ALA 22 -1.964 17.615 -19.732 1.00 0.00 H -ATOM 356 C ALA 22 -2.594 17.498 -22.424 1.00 0.00 C -ATOM 357 O ALA 22 -3.691 17.968 -22.199 1.00 0.00 O -ATOM 358 N HIE 23 -2.460 16.453 -23.268 1.00 0.00 N -ATOM 359 H HIE 23 -1.536 16.160 -23.552 1.00 0.00 H -ATOM 360 CA HIE 23 -3.492 15.576 -23.811 1.00 0.00 C -ATOM 361 HA HIE 23 -4.472 16.046 -23.885 1.00 0.00 H -ATOM 362 CB HIE 23 -3.054 15.169 -25.189 1.00 0.00 C -ATOM 363 HB2 HIE 23 -2.025 14.811 -25.237 1.00 0.00 H -ATOM 364 HB3 HIE 23 -3.620 14.291 -25.498 1.00 0.00 H -ATOM 365 CG HIE 23 -3.186 16.121 -26.273 1.00 0.00 C -ATOM 366 ND1 HIE 23 -2.859 15.916 -27.586 1.00 0.00 N -ATOM 367 CE1 HIE 23 -3.449 16.910 -28.309 1.00 0.00 C -ATOM 368 HE1 HIE 23 -3.406 16.894 -29.388 1.00 0.00 H -ATOM 369 NE2 HIE 23 -4.151 17.682 -27.507 1.00 0.00 N -ATOM 370 HE2 HIE 23 -4.599 18.501 -27.893 1.00 0.00 H -ATOM 371 CD2 HIE 23 -3.920 17.281 -26.238 1.00 0.00 C -ATOM 372 HD2 HIE 23 -4.413 17.636 -25.345 1.00 0.00 H -ATOM 373 C HIE 23 -3.616 14.323 -22.908 1.00 0.00 C -ATOM 374 O HIE 23 -2.567 13.901 -22.319 1.00 0.00 O -ATOM 375 N SER 24 -4.871 13.769 -22.866 1.00 0.00 N -ATOM 376 H SER 24 -5.662 14.294 -23.210 1.00 0.00 H -ATOM 377 CA SER 24 -5.021 12.472 -22.258 1.00 0.00 C -ATOM 378 HA SER 24 -4.552 12.381 -21.278 1.00 0.00 H -ATOM 379 CB SER 24 -6.528 12.199 -22.080 1.00 0.00 C -ATOM 380 HB2 SER 24 -6.885 13.114 -21.608 1.00 0.00 H -ATOM 381 HB3 SER 24 -7.037 12.019 -23.027 1.00 0.00 H -ATOM 382 OG SER 24 -6.587 11.075 -21.280 1.00 0.00 O -ATOM 383 HG SER 24 -6.628 10.238 -21.747 1.00 0.00 H -ATOM 384 C SER 24 -4.400 11.338 -23.072 1.00 0.00 C -ATOM 385 O SER 24 -4.850 11.126 -24.174 1.00 0.00 O -ATOM 386 N ILE 25 -3.396 10.611 -22.623 1.00 0.00 N -ATOM 387 H ILE 25 -2.899 10.882 -21.786 1.00 0.00 H -ATOM 388 CA ILE 25 -2.580 9.689 -23.417 1.00 0.00 C -ATOM 389 HA ILE 25 -3.138 9.494 -24.333 1.00 0.00 H -ATOM 390 CB ILE 25 -1.269 10.248 -23.919 1.00 0.00 C -ATOM 391 HB ILE 25 -0.654 9.561 -24.501 1.00 0.00 H -ATOM 392 CG2 ILE 25 -1.680 11.460 -24.913 1.00 0.00 C -ATOM 393 HG21 ILE 25 -0.782 11.774 -25.445 1.00 0.00 H -ATOM 394 HG22 ILE 25 -2.432 11.115 -25.623 1.00 0.00 H -ATOM 395 HG23 ILE 25 -2.167 12.315 -24.445 1.00 0.00 H -ATOM 396 CG1 ILE 25 -0.325 10.837 -22.882 1.00 0.00 C -ATOM 397 HG12 ILE 25 0.447 11.378 -23.429 1.00 0.00 H -ATOM 398 HG13 ILE 25 -0.919 11.631 -22.429 1.00 0.00 H -ATOM 399 CD1 ILE 25 0.221 9.810 -21.872 1.00 0.00 C -ATOM 400 HD11 ILE 25 -0.564 9.521 -21.173 1.00 0.00 H -ATOM 401 HD12 ILE 25 0.528 8.921 -22.422 1.00 0.00 H -ATOM 402 HD13 ILE 25 1.082 10.181 -21.315 1.00 0.00 H -ATOM 403 C ILE 25 -2.566 8.251 -22.864 1.00 0.00 C -ATOM 404 O ILE 25 -1.771 7.478 -23.405 1.00 0.00 O -ATOM 405 N VAL 26 -3.426 7.866 -21.918 1.00 0.00 N -ATOM 406 H VAL 26 -3.908 8.574 -21.381 1.00 0.00 H -ATOM 407 CA VAL 26 -3.654 6.496 -21.449 1.00 0.00 C -ATOM 408 HA VAL 26 -2.955 5.913 -22.047 1.00 0.00 H -ATOM 409 CB VAL 26 -3.218 6.357 -19.934 1.00 0.00 C -ATOM 410 HB VAL 26 -3.839 7.059 -19.377 1.00 0.00 H -ATOM 411 CG1 VAL 26 -3.560 4.990 -19.361 1.00 0.00 C -ATOM 412 HG11 VAL 26 -3.104 4.252 -20.021 1.00 0.00 H -ATOM 413 HG12 VAL 26 -3.187 4.935 -18.338 1.00 0.00 H -ATOM 414 HG13 VAL 26 -4.632 4.794 -19.360 1.00 0.00 H -ATOM 415 CG2 VAL 26 -1.710 6.680 -19.724 1.00 0.00 C -ATOM 416 HG21 VAL 26 -1.545 7.754 -19.807 1.00 0.00 H -ATOM 417 HG22 VAL 26 -1.464 6.358 -18.712 1.00 0.00 H -ATOM 418 HG23 VAL 26 -1.115 6.195 -20.498 1.00 0.00 H -ATOM 419 C VAL 26 -5.081 6.061 -21.646 1.00 0.00 C -ATOM 420 O VAL 26 -6.001 6.697 -21.123 1.00 0.00 O -ATOM 421 N GLU 27 -5.279 4.934 -22.347 1.00 0.00 N -ATOM 422 H GLU 27 -4.403 4.493 -22.590 1.00 0.00 H -ATOM 423 CA GLU 27 -6.453 4.221 -22.797 1.00 0.00 C -ATOM 424 HA GLU 27 -7.359 4.790 -22.588 1.00 0.00 H -ATOM 425 CB GLU 27 -6.320 3.753 -24.245 1.00 0.00 C -ATOM 426 HB2 GLU 27 -5.542 2.993 -24.320 1.00 0.00 H -ATOM 427 HB3 GLU 27 -7.293 3.346 -24.519 1.00 0.00 H -ATOM 428 CG GLU 27 -5.892 4.921 -25.265 1.00 0.00 C -ATOM 429 HG2 GLU 27 -4.846 5.149 -25.063 1.00 0.00 H -ATOM 430 HG3 GLU 27 -6.165 4.634 -26.281 1.00 0.00 H -ATOM 431 CD GLU 27 -6.610 6.228 -24.943 1.00 0.00 C -ATOM 432 OE1 GLU 27 -7.887 6.245 -24.779 1.00 0.00 O -ATOM 433 OE2 GLU 27 -5.957 7.307 -24.858 1.00 0.00 O -ATOM 434 C GLU 27 -6.681 3.011 -21.863 1.00 0.00 C -ATOM 435 O GLU 27 -6.398 1.886 -22.175 1.00 0.00 O -ATOM 436 N CYS 28 -7.232 3.246 -20.644 1.00 0.00 N -ATOM 437 H CYS 28 -7.162 4.154 -20.207 1.00 0.00 H -ATOM 438 CA CYS 28 -7.693 2.176 -19.859 1.00 0.00 C -ATOM 439 HA CYS 28 -6.993 1.356 -19.701 1.00 0.00 H -ATOM 440 CB CYS 28 -8.144 2.687 -18.478 1.00 0.00 C -ATOM 441 HB2 CYS 28 -8.619 3.646 -18.681 1.00 0.00 H -ATOM 442 HB3 CYS 28 -8.840 2.012 -17.979 1.00 0.00 H -ATOM 443 SG CYS 28 -6.729 2.979 -17.411 1.00 0.00 S -ATOM 444 HG CYS 28 -5.960 3.779 -18.154 1.00 0.00 H -ATOM 445 C CYS 28 -8.948 1.620 -20.551 1.00 0.00 C -ATOM 446 O CYS 28 -9.863 2.432 -20.904 1.00 0.00 O -ATOM 447 N ASP 29 -9.012 0.328 -20.747 1.00 0.00 N -ATOM 448 H ASP 29 -8.240 -0.238 -20.425 1.00 0.00 H -ATOM 449 CA ASP 29 -10.162 -0.346 -21.369 1.00 0.00 C -ATOM 450 HA ASP 29 -11.047 0.290 -21.353 1.00 0.00 H -ATOM 451 CB ASP 29 -9.875 -0.659 -22.866 1.00 0.00 C -ATOM 452 HB2 ASP 29 -9.805 0.350 -23.274 1.00 0.00 H -ATOM 453 HB3 ASP 29 -8.946 -1.225 -22.927 1.00 0.00 H -ATOM 454 CG ASP 29 -11.081 -1.286 -23.514 1.00 0.00 C -ATOM 455 OD1 ASP 29 -11.285 -1.325 -24.768 1.00 0.00 O -ATOM 456 OD2 ASP 29 -11.924 -1.799 -22.735 1.00 0.00 O -ATOM 457 C ASP 29 -10.453 -1.587 -20.441 1.00 0.00 C -ATOM 458 O ASP 29 -9.816 -2.631 -20.415 1.00 0.00 O -ATOM 459 N PRO 30 -11.405 -1.342 -19.398 1.00 0.00 N -ATOM 460 CD PRO 30 -11.802 -0.024 -18.937 1.00 0.00 C -ATOM 461 HD2 PRO 30 -12.713 0.240 -19.473 1.00 0.00 H -ATOM 462 HD3 PRO 30 -11.005 0.715 -19.021 1.00 0.00 H -ATOM 463 CG PRO 30 -12.204 -0.082 -17.462 1.00 0.00 C -ATOM 464 HG2 PRO 30 -12.844 0.720 -17.093 1.00 0.00 H -ATOM 465 HG3 PRO 30 -11.284 -0.035 -16.879 1.00 0.00 H -ATOM 466 CB PRO 30 -12.691 -1.534 -17.440 1.00 0.00 C -ATOM 467 HB2 PRO 30 -13.671 -1.551 -17.917 1.00 0.00 H -ATOM 468 HB3 PRO 30 -12.854 -2.008 -16.472 1.00 0.00 H -ATOM 469 CA PRO 30 -11.744 -2.317 -18.355 1.00 0.00 C -ATOM 470 HA PRO 30 -10.910 -2.730 -17.787 1.00 0.00 H -ATOM 471 C PRO 30 -12.418 -3.612 -18.936 1.00 0.00 C -ATOM 472 O PRO 30 -12.135 -4.745 -18.392 1.00 0.00 O -ATOM 473 N VAL 31 -13.200 -3.450 -20.045 1.00 0.00 N -ATOM 474 H VAL 31 -13.293 -2.517 -20.420 1.00 0.00 H -ATOM 475 CA VAL 31 -13.785 -4.577 -20.781 1.00 0.00 C -ATOM 476 HA VAL 31 -14.412 -5.187 -20.132 1.00 0.00 H -ATOM 477 CB VAL 31 -14.784 -4.021 -21.818 1.00 0.00 C -ATOM 478 HB VAL 31 -14.401 -3.116 -22.289 1.00 0.00 H -ATOM 479 CG1 VAL 31 -15.346 -5.010 -22.891 1.00 0.00 C -ATOM 480 HG11 VAL 31 -16.187 -4.561 -23.421 1.00 0.00 H -ATOM 481 HG12 VAL 31 -14.615 -4.982 -23.699 1.00 0.00 H -ATOM 482 HG13 VAL 31 -15.554 -6.044 -22.615 1.00 0.00 H -ATOM 483 CG2 VAL 31 -15.992 -3.694 -20.970 1.00 0.00 C -ATOM 484 HG21 VAL 31 -16.418 -4.661 -20.704 1.00 0.00 H -ATOM 485 HG22 VAL 31 -15.754 -3.150 -20.056 1.00 0.00 H -ATOM 486 HG23 VAL 31 -16.627 -2.982 -21.498 1.00 0.00 H -ATOM 487 C VAL 31 -12.767 -5.485 -21.431 1.00 0.00 C -ATOM 488 O VAL 31 -12.937 -6.695 -21.442 1.00 0.00 O -ATOM 489 N ARG 32 -11.630 -4.880 -21.817 1.00 0.00 N -ATOM 490 H ARG 32 -11.763 -3.894 -21.992 1.00 0.00 H -ATOM 491 CA ARG 32 -10.517 -5.505 -22.387 1.00 0.00 C -ATOM 492 HA ARG 32 -10.810 -6.363 -22.992 1.00 0.00 H -ATOM 493 CB ARG 32 -9.858 -4.543 -23.357 1.00 0.00 C -ATOM 494 HB2 ARG 32 -10.631 -4.060 -23.954 1.00 0.00 H -ATOM 495 HB3 ARG 32 -9.355 -3.781 -22.762 1.00 0.00 H -ATOM 496 CG ARG 32 -8.853 -5.146 -24.370 1.00 0.00 C -ATOM 497 HG2 ARG 32 -8.593 -4.329 -25.043 1.00 0.00 H -ATOM 498 HG3 ARG 32 -7.937 -5.342 -23.814 1.00 0.00 H -ATOM 499 CD ARG 32 -9.235 -6.453 -25.143 1.00 0.00 C -ATOM 500 HD2 ARG 32 -8.281 -6.781 -25.556 1.00 0.00 H -ATOM 501 HD3 ARG 32 -9.497 -7.141 -24.339 1.00 0.00 H -ATOM 502 NE ARG 32 -10.349 -6.269 -26.083 1.00 0.00 N -ATOM 503 HE ARG 32 -10.622 -5.308 -26.227 1.00 0.00 H -ATOM 504 CZ ARG 32 -10.630 -7.040 -27.086 1.00 0.00 C -ATOM 505 NH1 ARG 32 -9.977 -8.171 -27.315 1.00 0.00 N -ATOM 506 HH11 ARG 32 -9.194 -8.411 -26.723 1.00 0.00 H -ATOM 507 HH12 ARG 32 -10.230 -8.874 -27.995 1.00 0.00 H -ATOM 508 NH2 ARG 32 -11.626 -6.740 -27.824 1.00 0.00 N -ATOM 509 HH21 ARG 32 -12.282 -6.044 -27.499 1.00 0.00 H -ATOM 510 HH22 ARG 32 -11.735 -7.229 -28.701 1.00 0.00 H -ATOM 511 C ARG 32 -9.496 -5.985 -21.362 1.00 0.00 C -ATOM 512 O ARG 32 -8.590 -6.674 -21.781 1.00 0.00 O -ATOM 513 N LYS 33 -9.562 -5.572 -20.116 1.00 0.00 N -ATOM 514 H LYS 33 -10.421 -5.127 -19.826 1.00 0.00 H -ATOM 515 CA LYS 33 -8.477 -5.700 -19.164 1.00 0.00 C -ATOM 516 HA LYS 33 -8.672 -4.982 -18.367 1.00 0.00 H -ATOM 517 CB LYS 33 -8.442 -7.142 -18.584 1.00 0.00 C -ATOM 518 HB2 LYS 33 -8.177 -7.954 -19.262 1.00 0.00 H -ATOM 519 HB3 LYS 33 -7.683 -7.101 -17.803 1.00 0.00 H -ATOM 520 CG LYS 33 -9.692 -7.596 -17.754 1.00 0.00 C -ATOM 521 HG2 LYS 33 -9.931 -6.706 -17.172 1.00 0.00 H -ATOM 522 HG3 LYS 33 -10.526 -7.797 -18.427 1.00 0.00 H -ATOM 523 CD LYS 33 -9.307 -8.814 -16.871 1.00 0.00 C -ATOM 524 HD2 LYS 33 -8.865 -9.636 -17.433 1.00 0.00 H -ATOM 525 HD3 LYS 33 -8.496 -8.454 -16.237 1.00 0.00 H -ATOM 526 CE LYS 33 -10.539 -9.235 -16.014 1.00 0.00 C -ATOM 527 HE2 LYS 33 -11.343 -9.343 -16.743 1.00 0.00 H -ATOM 528 HE3 LYS 33 -10.282 -10.137 -15.459 1.00 0.00 H -ATOM 529 NZ LYS 33 -10.985 -8.322 -15.011 1.00 0.00 N -ATOM 530 HZ1 LYS 33 -11.607 -7.623 -15.393 1.00 0.00 H -ATOM 531 HZ2 LYS 33 -11.626 -8.750 -14.358 1.00 0.00 H -ATOM 532 HZ3 LYS 33 -10.244 -7.967 -14.424 1.00 0.00 H -ATOM 533 C LYS 33 -7.077 -5.242 -19.740 1.00 0.00 C -ATOM 534 O LYS 33 -6.047 -5.820 -19.514 1.00 0.00 O -ATOM 535 N GLU 34 -7.113 -4.155 -20.583 1.00 0.00 N -ATOM 536 H GLU 34 -8.002 -3.678 -20.626 1.00 0.00 H -ATOM 537 CA GLU 34 -5.846 -3.565 -21.082 1.00 0.00 C -ATOM 538 HA GLU 34 -4.994 -4.008 -20.565 1.00 0.00 H -ATOM 539 CB GLU 34 -5.735 -3.751 -22.643 1.00 0.00 C -ATOM 540 HB2 GLU 34 -6.673 -3.446 -23.107 1.00 0.00 H -ATOM 541 HB3 GLU 34 -5.035 -2.987 -22.981 1.00 0.00 H -ATOM 542 CG GLU 34 -4.990 -5.032 -23.142 1.00 0.00 C -ATOM 543 HG2 GLU 34 -4.042 -5.277 -22.663 1.00 0.00 H -ATOM 544 HG3 GLU 34 -5.492 -5.943 -22.816 1.00 0.00 H -ATOM 545 CD GLU 34 -4.987 -5.185 -24.638 1.00 0.00 C -ATOM 546 OE1 GLU 34 -5.719 -4.407 -25.340 1.00 0.00 O -ATOM 547 OE2 GLU 34 -4.298 -6.053 -25.193 1.00 0.00 O -ATOM 548 C GLU 34 -5.862 -2.099 -20.739 1.00 0.00 C -ATOM 549 O GLU 34 -6.853 -1.393 -20.498 1.00 0.00 O -ATOM 550 N VAL 35 -4.676 -1.565 -20.852 1.00 0.00 N -ATOM 551 H VAL 35 -3.983 -2.233 -21.156 1.00 0.00 H -ATOM 552 CA VAL 35 -4.267 -0.171 -20.610 1.00 0.00 C -ATOM 553 HA VAL 35 -4.956 0.629 -20.881 1.00 0.00 H -ATOM 554 CB VAL 35 -3.638 0.002 -19.188 1.00 0.00 C -ATOM 555 HB VAL 35 -2.713 -0.573 -19.171 1.00 0.00 H -ATOM 556 CG1 VAL 35 -3.172 1.399 -18.936 1.00 0.00 C -ATOM 557 HG11 VAL 35 -2.418 1.525 -18.158 1.00 0.00 H -ATOM 558 HG12 VAL 35 -2.911 1.877 -19.880 1.00 0.00 H -ATOM 559 HG13 VAL 35 -4.051 1.949 -18.600 1.00 0.00 H -ATOM 560 CG2 VAL 35 -4.638 -0.458 -18.106 1.00 0.00 C -ATOM 561 HG21 VAL 35 -4.872 -1.506 -18.296 1.00 0.00 H -ATOM 562 HG22 VAL 35 -4.048 -0.406 -17.192 1.00 0.00 H -ATOM 563 HG23 VAL 35 -5.436 0.276 -18.218 1.00 0.00 H -ATOM 564 C VAL 35 -3.144 0.034 -21.690 1.00 0.00 C -ATOM 565 O VAL 35 -2.305 -0.796 -21.847 1.00 0.00 O -ATOM 566 N SER 36 -3.297 1.152 -22.508 1.00 0.00 N -ATOM 567 H SER 36 -3.997 1.865 -22.362 1.00 0.00 H -ATOM 568 CA SER 36 -2.328 1.400 -23.574 1.00 0.00 C -ATOM 569 HA SER 36 -1.471 0.731 -23.493 1.00 0.00 H -ATOM 570 CB SER 36 -3.077 1.090 -24.896 1.00 0.00 C -ATOM 571 HB2 SER 36 -3.471 0.074 -24.878 1.00 0.00 H -ATOM 572 HB3 SER 36 -3.780 1.899 -25.089 1.00 0.00 H -ATOM 573 OG SER 36 -2.069 1.061 -25.912 1.00 0.00 O -ATOM 574 HG SER 36 -1.799 0.151 -26.053 1.00 0.00 H -ATOM 575 C SER 36 -1.820 2.860 -23.517 1.00 0.00 C -ATOM 576 O SER 36 -2.699 3.693 -23.237 1.00 0.00 O -ATOM 577 N VAL 37 -0.555 3.188 -23.728 1.00 0.00 N -ATOM 578 H VAL 37 0.138 2.472 -23.891 1.00 0.00 H -ATOM 579 CA VAL 37 -0.013 4.515 -23.506 1.00 0.00 C -ATOM 580 HA VAL 37 -0.845 5.178 -23.271 1.00 0.00 H -ATOM 581 CB VAL 37 0.902 4.506 -22.310 1.00 0.00 C -ATOM 582 HB VAL 37 0.312 4.444 -21.395 1.00 0.00 H -ATOM 583 CG1 VAL 37 2.111 3.545 -22.343 1.00 0.00 C -ATOM 584 HG11 VAL 37 1.904 2.481 -22.459 1.00 0.00 H -ATOM 585 HG12 VAL 37 2.678 3.904 -23.202 1.00 0.00 H -ATOM 586 HG13 VAL 37 2.668 3.609 -21.408 1.00 0.00 H -ATOM 587 CG2 VAL 37 1.449 5.865 -22.060 1.00 0.00 C -ATOM 588 HG21 VAL 37 0.579 6.478 -21.821 1.00 0.00 H -ATOM 589 HG22 VAL 37 2.132 5.822 -21.212 1.00 0.00 H -ATOM 590 HG23 VAL 37 1.953 6.245 -22.949 1.00 0.00 H -ATOM 591 C VAL 37 0.601 5.053 -24.835 1.00 0.00 C -ATOM 592 O VAL 37 1.441 4.364 -25.432 1.00 0.00 O -ATOM 593 N ARG 38 0.166 6.139 -25.403 1.00 0.00 N -ATOM 594 H ARG 38 -0.482 6.659 -24.828 1.00 0.00 H -ATOM 595 CA ARG 38 0.365 6.674 -26.757 1.00 0.00 C -ATOM 596 HA ARG 38 0.197 5.856 -27.457 1.00 0.00 H -ATOM 597 CB ARG 38 -0.670 7.788 -27.071 1.00 0.00 C -ATOM 598 HB2 ARG 38 -0.561 8.565 -26.314 1.00 0.00 H -ATOM 599 HB3 ARG 38 -0.557 8.140 -28.096 1.00 0.00 H -ATOM 600 CG ARG 38 -2.149 7.294 -26.989 1.00 0.00 C -ATOM 601 HG2 ARG 38 -2.106 6.370 -27.565 1.00 0.00 H -ATOM 602 HG3 ARG 38 -2.377 6.892 -26.002 1.00 0.00 H -ATOM 603 CD ARG 38 -3.091 8.340 -27.605 1.00 0.00 C -ATOM 604 HD2 ARG 38 -2.600 9.307 -27.503 1.00 0.00 H -ATOM 605 HD3 ARG 38 -3.149 8.240 -28.689 1.00 0.00 H -ATOM 606 NE ARG 38 -4.467 8.368 -27.078 1.00 0.00 N -ATOM 607 HE ARG 38 -4.712 7.845 -26.249 1.00 0.00 H -ATOM 608 CZ ARG 38 -5.382 9.249 -27.364 1.00 0.00 C -ATOM 609 NH1 ARG 38 -5.233 10.126 -28.333 1.00 0.00 N -ATOM 610 HH11 ARG 38 -4.407 10.067 -28.912 1.00 0.00 H -ATOM 611 HH12 ARG 38 -5.907 10.857 -28.507 1.00 0.00 H -ATOM 612 NH2 ARG 38 -6.390 9.416 -26.636 1.00 0.00 N -ATOM 613 HH21 ARG 38 -6.409 8.936 -25.748 1.00 0.00 H -ATOM 614 HH22 ARG 38 -6.873 10.290 -26.791 1.00 0.00 H -ATOM 615 C ARG 38 1.755 7.216 -27.169 1.00 0.00 C -ATOM 616 O ARG 38 1.929 8.190 -27.896 1.00 0.00 O -ATOM 617 N THR 39 2.803 6.424 -26.930 1.00 0.00 N -ATOM 618 H THR 39 2.631 5.570 -26.419 1.00 0.00 H -ATOM 619 CA THR 39 4.205 6.496 -27.363 1.00 0.00 C -ATOM 620 HA THR 39 4.694 7.431 -27.088 1.00 0.00 H -ATOM 621 CB THR 39 4.958 5.283 -26.899 1.00 0.00 C -ATOM 622 HB THR 39 5.927 5.334 -27.397 1.00 0.00 H -ATOM 623 CG2 THR 39 5.340 5.271 -25.440 1.00 0.00 C -ATOM 624 HG21 THR 39 5.571 4.263 -25.095 1.00 0.00 H -ATOM 625 HG22 THR 39 6.201 5.919 -25.274 1.00 0.00 H -ATOM 626 HG23 THR 39 4.519 5.642 -24.826 1.00 0.00 H -ATOM 627 OG1 THR 39 4.344 4.101 -27.156 1.00 0.00 O -ATOM 628 HG1 THR 39 4.240 4.101 -28.111 1.00 0.00 H -ATOM 629 C THR 39 4.250 6.488 -28.874 1.00 0.00 C -ATOM 630 O THR 39 3.412 5.784 -29.484 1.00 0.00 O -ATOM 631 N GLY 40 5.271 7.129 -29.481 1.00 0.00 N -ATOM 632 H GLY 40 5.915 7.562 -28.834 1.00 0.00 H -ATOM 633 CA GLY 40 5.623 7.195 -30.867 1.00 0.00 C -ATOM 634 HA2 GLY 40 6.465 7.887 -30.862 1.00 0.00 H -ATOM 635 HA3 GLY 40 6.096 6.248 -31.129 1.00 0.00 H -ATOM 636 C GLY 40 4.577 7.603 -31.915 1.00 0.00 C -ATOM 637 O GLY 40 4.771 7.496 -33.102 1.00 0.00 O -ATOM 638 N GLY 41 3.478 8.146 -31.393 1.00 0.00 N -ATOM 639 H GLY 41 3.557 8.331 -30.403 1.00 0.00 H -ATOM 640 CA GLY 41 2.396 8.729 -32.196 1.00 0.00 C -ATOM 641 HA2 GLY 41 2.711 9.740 -32.455 1.00 0.00 H -ATOM 642 HA3 GLY 41 2.384 8.148 -33.118 1.00 0.00 H -ATOM 643 C GLY 41 1.025 8.791 -31.471 1.00 0.00 C -ATOM 644 O GLY 41 0.590 7.803 -30.890 1.00 0.00 O -ATOM 645 N LEU 42 0.361 9.953 -31.497 1.00 0.00 N -ATOM 646 H LEU 42 0.683 10.721 -32.069 1.00 0.00 H -ATOM 647 CA LEU 42 -0.705 10.244 -30.571 1.00 0.00 C -ATOM 648 HA LEU 42 -0.583 9.756 -29.604 1.00 0.00 H -ATOM 649 CB LEU 42 -0.679 11.752 -30.239 1.00 0.00 C -ATOM 650 HB2 LEU 42 -0.934 12.390 -31.085 1.00 0.00 H -ATOM 651 HB3 LEU 42 -1.487 11.984 -29.544 1.00 0.00 H -ATOM 652 CG LEU 42 0.688 12.209 -29.670 1.00 0.00 C -ATOM 653 HG LEU 42 1.480 12.027 -30.397 1.00 0.00 H -ATOM 654 CD1 LEU 42 0.654 13.761 -29.428 1.00 0.00 C -ATOM 655 HD11 LEU 42 0.459 14.268 -30.372 1.00 0.00 H -ATOM 656 HD12 LEU 42 -0.121 14.042 -28.715 1.00 0.00 H -ATOM 657 HD13 LEU 42 1.534 14.270 -29.034 1.00 0.00 H -ATOM 658 CD2 LEU 42 0.928 11.622 -28.277 1.00 0.00 C -ATOM 659 HD21 LEU 42 0.197 12.056 -27.595 1.00 0.00 H -ATOM 660 HD22 LEU 42 0.910 10.533 -28.244 1.00 0.00 H -ATOM 661 HD23 LEU 42 1.915 12.001 -28.013 1.00 0.00 H -ATOM 662 C LEU 42 -2.089 9.710 -31.104 1.00 0.00 C -ATOM 663 O LEU 42 -3.124 9.735 -30.469 1.00 0.00 O -ATOM 664 N ALA 43 -2.049 9.039 -32.266 1.00 0.00 N -ATOM 665 H ALA 43 -1.216 9.198 -32.814 1.00 0.00 H -ATOM 666 CA ALA 43 -3.225 8.495 -32.919 1.00 0.00 C -ATOM 667 HA ALA 43 -4.037 8.319 -32.214 1.00 0.00 H -ATOM 668 CB ALA 43 -3.831 9.621 -33.858 1.00 0.00 C -ATOM 669 HB1 ALA 43 -4.788 9.242 -34.215 1.00 0.00 H -ATOM 670 HB2 ALA 43 -4.057 10.482 -33.229 1.00 0.00 H -ATOM 671 HB3 ALA 43 -3.117 9.947 -34.615 1.00 0.00 H -ATOM 672 C ALA 43 -2.808 7.122 -33.681 1.00 0.00 C -ATOM 673 O ALA 43 -3.701 6.386 -34.122 1.00 0.00 O -ATOM 674 N ASP 44 -1.545 6.727 -33.726 1.00 0.00 N -ATOM 675 H ASP 44 -0.839 7.248 -33.225 1.00 0.00 H -ATOM 676 CA ASP 44 -1.052 5.517 -34.393 1.00 0.00 C -ATOM 677 HA ASP 44 -1.694 5.359 -35.259 1.00 0.00 H -ATOM 678 CB ASP 44 0.368 5.780 -34.883 1.00 0.00 C -ATOM 679 HB2 ASP 44 0.292 6.688 -35.482 1.00 0.00 H -ATOM 680 HB3 ASP 44 1.083 5.923 -34.072 1.00 0.00 H -ATOM 681 CG ASP 44 0.847 4.599 -35.684 1.00 0.00 C -ATOM 682 OD1 ASP 44 1.987 4.691 -36.187 1.00 0.00 O -ATOM 683 OD2 ASP 44 0.218 3.507 -35.907 1.00 0.00 O -ATOM 684 C ASP 44 -1.123 4.353 -33.518 1.00 0.00 C -ATOM 685 O ASP 44 -0.420 4.329 -32.484 1.00 0.00 O -ATOM 686 N LYS 45 -1.998 3.348 -33.804 1.00 0.00 N -ATOM 687 H LYS 45 -2.570 3.354 -34.636 1.00 0.00 H -ATOM 688 CA LYS 45 -2.207 2.211 -32.904 1.00 0.00 C -ATOM 689 HA LYS 45 -2.315 2.593 -31.889 1.00 0.00 H -ATOM 690 CB LYS 45 -3.487 1.390 -33.194 1.00 0.00 C -ATOM 691 HB2 LYS 45 -3.572 0.998 -34.207 1.00 0.00 H -ATOM 692 HB3 LYS 45 -3.483 0.573 -32.473 1.00 0.00 H -ATOM 693 CG LYS 45 -4.687 2.305 -32.890 1.00 0.00 C -ATOM 694 HG2 LYS 45 -4.614 2.566 -31.834 1.00 0.00 H -ATOM 695 HG3 LYS 45 -4.779 3.247 -33.429 1.00 0.00 H -ATOM 696 CD LYS 45 -5.954 1.546 -33.062 1.00 0.00 C -ATOM 697 HD2 LYS 45 -5.939 1.177 -34.087 1.00 0.00 H -ATOM 698 HD3 LYS 45 -5.974 0.644 -32.451 1.00 0.00 H -ATOM 699 CE LYS 45 -7.186 2.347 -32.809 1.00 0.00 C -ATOM 700 HE2 LYS 45 -7.074 2.767 -31.810 1.00 0.00 H -ATOM 701 HE3 LYS 45 -7.289 3.177 -33.507 1.00 0.00 H -ATOM 702 NZ LYS 45 -8.396 1.435 -32.923 1.00 0.00 N -ATOM 703 HZ1 LYS 45 -9.204 2.032 -32.821 1.00 0.00 H -ATOM 704 HZ2 LYS 45 -8.460 1.060 -33.859 1.00 0.00 H -ATOM 705 HZ3 LYS 45 -8.469 0.653 -32.288 1.00 0.00 H -ATOM 706 C LYS 45 -1.054 1.239 -32.906 1.00 0.00 C -ATOM 707 O LYS 45 -0.959 0.422 -31.985 1.00 0.00 O -ATOM 708 N SER 46 -0.198 1.343 -33.824 1.00 0.00 N -ATOM 709 H SER 46 -0.371 1.963 -34.603 1.00 0.00 H -ATOM 710 CA SER 46 1.068 0.503 -33.907 1.00 0.00 C -ATOM 711 HA SER 46 0.742 -0.500 -33.633 1.00 0.00 H -ATOM 712 CB SER 46 1.662 0.510 -35.359 1.00 0.00 C -ATOM 713 HB2 SER 46 2.439 -0.254 -35.392 1.00 0.00 H -ATOM 714 HB3 SER 46 0.956 0.232 -36.143 1.00 0.00 H -ATOM 715 OG SER 46 2.184 1.784 -35.741 1.00 0.00 O -ATOM 716 HG SER 46 1.422 2.365 -35.687 1.00 0.00 H -ATOM 717 C SER 46 2.190 0.951 -32.997 1.00 0.00 C -ATOM 718 O SER 46 3.013 0.148 -32.559 1.00 0.00 O -ATOM 719 N SER 47 2.285 2.195 -32.607 1.00 0.00 N -ATOM 720 H SER 47 1.531 2.782 -32.935 1.00 0.00 H -ATOM 721 CA SER 47 3.353 2.766 -31.808 1.00 0.00 C -ATOM 722 HA SER 47 4.290 2.211 -31.851 1.00 0.00 H -ATOM 723 CB SER 47 3.638 4.218 -32.317 1.00 0.00 C -ATOM 724 HB2 SER 47 4.527 4.562 -31.789 1.00 0.00 H -ATOM 725 HB3 SER 47 3.816 4.326 -33.387 1.00 0.00 H -ATOM 726 OG SER 47 2.634 5.158 -32.118 1.00 0.00 O -ATOM 727 HG SER 47 2.792 5.368 -31.194 1.00 0.00 H -ATOM 728 C SER 47 3.021 2.890 -30.340 1.00 0.00 C -ATOM 729 O SER 47 3.915 2.822 -29.507 1.00 0.00 O -ATOM 730 N ARG 48 1.728 2.933 -29.947 1.00 0.00 N -ATOM 731 H ARG 48 1.058 2.947 -30.703 1.00 0.00 H -ATOM 732 CA ARG 48 1.241 2.939 -28.583 1.00 0.00 C -ATOM 733 HA ARG 48 1.866 3.662 -28.059 1.00 0.00 H -ATOM 734 CB ARG 48 -0.250 3.410 -28.495 1.00 0.00 C -ATOM 735 HB2 ARG 48 -0.574 3.588 -27.470 1.00 0.00 H -ATOM 736 HB3 ARG 48 -0.321 4.311 -29.104 1.00 0.00 H -ATOM 737 CG ARG 48 -1.222 2.361 -29.058 1.00 0.00 C -ATOM 738 HG2 ARG 48 -0.995 2.133 -30.100 1.00 0.00 H -ATOM 739 HG3 ARG 48 -1.284 1.432 -28.492 1.00 0.00 H -ATOM 740 CD ARG 48 -2.682 2.825 -28.846 1.00 0.00 C -ATOM 741 HD2 ARG 48 -3.410 2.030 -29.011 1.00 0.00 H -ATOM 742 HD3 ARG 48 -2.903 2.912 -27.782 1.00 0.00 H -ATOM 743 NE ARG 48 -3.125 3.989 -29.687 1.00 0.00 N -ATOM 744 HE ARG 48 -2.404 4.616 -30.011 1.00 0.00 H -ATOM 745 CZ ARG 48 -4.303 4.598 -29.562 1.00 0.00 C -ATOM 746 NH1 ARG 48 -5.353 4.073 -28.994 1.00 0.00 N -ATOM 747 HH11 ARG 48 -5.383 3.090 -28.767 1.00 0.00 H -ATOM 748 HH12 ARG 48 -6.133 4.691 -28.822 1.00 0.00 H -ATOM 749 NH2 ARG 48 -4.416 5.840 -30.012 1.00 0.00 N -ATOM 750 HH21 ARG 48 -3.652 6.368 -30.409 1.00 0.00 H -ATOM 751 HH22 ARG 48 -5.313 6.294 -29.908 1.00 0.00 H -ATOM 752 C ARG 48 1.404 1.531 -27.945 1.00 0.00 C -ATOM 753 O ARG 48 1.171 0.482 -28.527 1.00 0.00 O -ATOM 754 N LYS 49 1.883 1.513 -26.699 1.00 0.00 N -ATOM 755 H LYS 49 2.118 2.429 -26.343 1.00 0.00 H -ATOM 756 CA LYS 49 2.424 0.311 -25.923 1.00 0.00 C -ATOM 757 HA LYS 49 2.763 -0.408 -26.668 1.00 0.00 H -ATOM 758 CB LYS 49 3.646 0.720 -25.064 1.00 0.00 C -ATOM 759 HB2 LYS 49 3.568 1.746 -24.705 1.00 0.00 H -ATOM 760 HB3 LYS 49 3.733 0.043 -24.214 1.00 0.00 H -ATOM 761 CG LYS 49 4.887 0.610 -25.919 1.00 0.00 C -ATOM 762 HG2 LYS 49 4.887 -0.416 -26.288 1.00 0.00 H -ATOM 763 HG3 LYS 49 4.891 1.279 -26.779 1.00 0.00 H -ATOM 764 CD LYS 49 6.132 0.873 -25.050 1.00 0.00 C -ATOM 765 HD2 LYS 49 6.113 1.955 -24.920 1.00 0.00 H -ATOM 766 HD3 LYS 49 6.033 0.340 -24.104 1.00 0.00 H -ATOM 767 CE LYS 49 7.377 0.355 -25.729 1.00 0.00 C -ATOM 768 HE2 LYS 49 7.283 -0.725 -25.835 1.00 0.00 H -ATOM 769 HE3 LYS 49 7.369 0.772 -26.736 1.00 0.00 H -ATOM 770 NZ LYS 49 8.573 0.652 -24.947 1.00 0.00 N -ATOM 771 HZ1 LYS 49 9.384 0.358 -25.472 1.00 0.00 H -ATOM 772 HZ2 LYS 49 8.668 1.652 -24.839 1.00 0.00 H -ATOM 773 HZ3 LYS 49 8.556 0.162 -24.064 1.00 0.00 H -ATOM 774 C LYS 49 1.280 -0.242 -25.030 1.00 0.00 C -ATOM 775 O LYS 49 0.794 0.381 -24.105 1.00 0.00 O -ATOM 776 N THR 50 0.807 -1.366 -25.491 1.00 0.00 N -ATOM 777 H THR 50 1.243 -1.819 -26.281 1.00 0.00 H -ATOM 778 CA THR 50 -0.254 -2.040 -24.715 1.00 0.00 C -ATOM 779 HA THR 50 -0.836 -1.313 -24.149 1.00 0.00 H -ATOM 780 CB THR 50 -1.183 -2.690 -25.801 1.00 0.00 C -ATOM 781 HB THR 50 -0.577 -3.490 -26.227 1.00 0.00 H -ATOM 782 CG2 THR 50 -2.461 -3.258 -25.336 1.00 0.00 C -ATOM 783 HG21 THR 50 -2.912 -2.397 -24.844 1.00 0.00 H -ATOM 784 HG22 THR 50 -3.117 -3.569 -26.150 1.00 0.00 H -ATOM 785 HG23 THR 50 -2.171 -4.033 -24.626 1.00 0.00 H -ATOM 786 OG1 THR 50 -1.480 -1.810 -26.818 1.00 0.00 O -ATOM 787 HG1 THR 50 -0.964 -1.970 -27.612 1.00 0.00 H -ATOM 788 C THR 50 0.218 -2.976 -23.645 1.00 0.00 C -ATOM 789 O THR 50 1.117 -3.831 -23.797 1.00 0.00 O -ATOM 790 N TYR 51 -0.343 -2.832 -22.470 1.00 0.00 N -ATOM 791 H TYR 51 -1.097 -2.204 -22.232 1.00 0.00 H -ATOM 792 CA TYR 51 -0.184 -3.693 -21.304 1.00 0.00 C -ATOM 793 HA TYR 51 0.496 -4.506 -21.560 1.00 0.00 H -ATOM 794 CB TYR 51 0.478 -2.854 -20.210 1.00 0.00 C -ATOM 795 HB2 TYR 51 -0.293 -2.154 -19.888 1.00 0.00 H -ATOM 796 HB3 TYR 51 0.662 -3.548 -19.390 1.00 0.00 H -ATOM 797 CG TYR 51 1.853 -2.304 -20.542 1.00 0.00 C -ATOM 798 CD1 TYR 51 2.992 -2.963 -20.201 1.00 0.00 C -ATOM 799 HD1 TYR 51 2.840 -3.903 -19.692 1.00 0.00 H -ATOM 800 CE1 TYR 51 4.226 -2.437 -20.457 1.00 0.00 C -ATOM 801 HE1 TYR 51 5.085 -3.027 -20.172 1.00 0.00 H -ATOM 802 CZ TYR 51 4.388 -1.205 -21.112 1.00 0.00 C -ATOM 803 OH TYR 51 5.605 -0.713 -21.525 1.00 0.00 O -ATOM 804 HH TYR 51 6.198 -1.457 -21.397 1.00 0.00 H -ATOM 805 CE2 TYR 51 3.222 -0.471 -21.421 1.00 0.00 C -ATOM 806 HE2 TYR 51 3.307 0.522 -21.836 1.00 0.00 H -ATOM 807 CD2 TYR 51 1.943 -0.977 -21.074 1.00 0.00 C -ATOM 808 HD2 TYR 51 1.123 -0.326 -21.338 1.00 0.00 H -ATOM 809 C TYR 51 -1.550 -4.357 -20.926 1.00 0.00 C -ATOM 810 O TYR 51 -2.621 -3.784 -21.182 1.00 0.00 O -ATOM 811 N THR 52 -1.635 -5.573 -20.353 1.00 0.00 N -ATOM 812 H THR 52 -0.779 -5.980 -20.005 1.00 0.00 H -ATOM 813 CA THR 52 -2.811 -6.175 -19.729 1.00 0.00 C -ATOM 814 HA THR 52 -3.577 -5.413 -19.877 1.00 0.00 H -ATOM 815 CB THR 52 -3.351 -7.358 -20.602 1.00 0.00 C -ATOM 816 HB THR 52 -3.354 -7.150 -21.672 1.00 0.00 H -ATOM 817 CG2 THR 52 -2.377 -8.462 -20.485 1.00 0.00 C -ATOM 818 HG21 THR 52 -2.197 -8.709 -19.439 1.00 0.00 H -ATOM 819 HG22 THR 52 -2.868 -9.325 -20.936 1.00 0.00 H -ATOM 820 HG23 THR 52 -1.470 -8.251 -21.051 1.00 0.00 H -ATOM 821 OG1 THR 52 -4.605 -7.843 -20.347 1.00 0.00 O -ATOM 822 HG1 THR 52 -5.239 -7.179 -20.066 1.00 0.00 H -ATOM 823 C THR 52 -2.681 -6.521 -18.278 1.00 0.00 C -ATOM 824 O THR 52 -1.581 -6.896 -17.826 1.00 0.00 O -ATOM 825 N PHE 53 -3.777 -6.421 -17.519 1.00 0.00 N -ATOM 826 H PHE 53 -4.621 -6.082 -17.958 1.00 0.00 H -ATOM 827 CA PHE 53 -3.805 -6.668 -16.067 1.00 0.00 C -ATOM 828 HA PHE 53 -2.839 -7.061 -15.750 1.00 0.00 H -ATOM 829 CB PHE 53 -3.775 -5.267 -15.355 1.00 0.00 C -ATOM 830 HB2 PHE 53 -4.563 -4.657 -15.798 1.00 0.00 H -ATOM 831 HB3 PHE 53 -4.077 -5.193 -14.310 1.00 0.00 H -ATOM 832 CG PHE 53 -2.429 -4.608 -15.517 1.00 0.00 C -ATOM 833 CD1 PHE 53 -1.285 -5.125 -14.848 1.00 0.00 C -ATOM 834 HD1 PHE 53 -1.460 -5.750 -13.985 1.00 0.00 H -ATOM 835 CE1 PHE 53 0.001 -4.650 -15.072 1.00 0.00 C -ATOM 836 HE1 PHE 53 0.712 -4.829 -14.278 1.00 0.00 H -ATOM 837 CZ PHE 53 0.260 -3.725 -16.082 1.00 0.00 C -ATOM 838 HZ PHE 53 1.247 -3.331 -16.273 1.00 0.00 H -ATOM 839 CE2 PHE 53 -0.890 -3.212 -16.780 1.00 0.00 C -ATOM 840 HE2 PHE 53 -0.774 -2.460 -17.546 1.00 0.00 H -ATOM 841 CD2 PHE 53 -2.190 -3.594 -16.445 1.00 0.00 C -ATOM 842 HD2 PHE 53 -3.017 -3.165 -16.992 1.00 0.00 H -ATOM 843 C PHE 53 -5.009 -7.478 -15.520 1.00 0.00 C -ATOM 844 O PHE 53 -5.791 -8.096 -16.278 1.00 0.00 O -ATOM 845 N ASP 54 -5.133 -7.513 -14.201 1.00 0.00 N -ATOM 846 H ASP 54 -4.452 -7.080 -13.593 1.00 0.00 H -ATOM 847 CA ASP 54 -6.242 -8.246 -13.475 1.00 0.00 C -ATOM 848 HA ASP 54 -6.586 -9.112 -14.040 1.00 0.00 H -ATOM 849 CB ASP 54 -5.720 -8.803 -12.090 1.00 0.00 C -ATOM 850 HB2 ASP 54 -5.273 -7.961 -11.562 1.00 0.00 H -ATOM 851 HB3 ASP 54 -6.536 -9.272 -11.540 1.00 0.00 H -ATOM 852 CG ASP 54 -4.644 -9.892 -12.297 1.00 0.00 C -ATOM 853 OD1 ASP 54 -3.668 -10.008 -11.538 1.00 0.00 O -ATOM 854 OD2 ASP 54 -4.695 -10.606 -13.344 1.00 0.00 O -ATOM 855 C ASP 54 -7.446 -7.435 -13.194 1.00 0.00 C -ATOM 856 O ASP 54 -8.571 -7.920 -13.362 1.00 0.00 O -ATOM 857 N MET 55 -7.311 -6.179 -12.853 1.00 0.00 N -ATOM 858 H MET 55 -6.362 -5.833 -12.842 1.00 0.00 H -ATOM 859 CA MET 55 -8.431 -5.184 -12.766 1.00 0.00 C -ATOM 860 HA MET 55 -9.241 -5.534 -13.406 1.00 0.00 H -ATOM 861 CB MET 55 -8.941 -5.082 -11.299 1.00 0.00 C -ATOM 862 HB2 MET 55 -8.366 -4.417 -10.654 1.00 0.00 H -ATOM 863 HB3 MET 55 -9.867 -4.515 -11.391 1.00 0.00 H -ATOM 864 CG MET 55 -9.141 -6.448 -10.627 1.00 0.00 C -ATOM 865 HG2 MET 55 -9.782 -6.916 -11.374 1.00 0.00 H -ATOM 866 HG3 MET 55 -8.163 -6.929 -10.603 1.00 0.00 H -ATOM 867 SD MET 55 -9.926 -6.505 -9.054 1.00 0.00 S -ATOM 868 CE MET 55 -11.698 -6.850 -9.543 1.00 0.00 C -ATOM 869 HE1 MET 55 -12.329 -6.851 -8.654 1.00 0.00 H -ATOM 870 HE2 MET 55 -12.143 -6.091 -10.185 1.00 0.00 H -ATOM 871 HE3 MET 55 -11.858 -7.771 -10.104 1.00 0.00 H -ATOM 872 C MET 55 -7.919 -3.837 -13.295 1.00 0.00 C -ATOM 873 O MET 55 -6.711 -3.559 -13.313 1.00 0.00 O -ATOM 874 N VAL 56 -8.844 -3.066 -13.874 1.00 0.00 N -ATOM 875 H VAL 56 -9.821 -3.318 -13.834 1.00 0.00 H -ATOM 876 CA VAL 56 -8.492 -1.735 -14.406 1.00 0.00 C -ATOM 877 HA VAL 56 -7.524 -1.452 -13.993 1.00 0.00 H -ATOM 878 CB VAL 56 -8.327 -1.779 -15.919 1.00 0.00 C -ATOM 879 HB VAL 56 -9.262 -2.061 -16.403 1.00 0.00 H -ATOM 880 CG1 VAL 56 -7.971 -0.392 -16.500 1.00 0.00 C -ATOM 881 HG11 VAL 56 -7.602 -0.597 -17.505 1.00 0.00 H -ATOM 882 HG12 VAL 56 -8.805 0.309 -16.528 1.00 0.00 H -ATOM 883 HG13 VAL 56 -7.085 -0.026 -15.982 1.00 0.00 H -ATOM 884 CG2 VAL 56 -7.196 -2.813 -16.327 1.00 0.00 C -ATOM 885 HG21 VAL 56 -6.900 -2.659 -17.365 1.00 0.00 H -ATOM 886 HG22 VAL 56 -6.311 -2.544 -15.750 1.00 0.00 H -ATOM 887 HG23 VAL 56 -7.430 -3.863 -16.156 1.00 0.00 H -ATOM 888 C VAL 56 -9.534 -0.697 -14.019 1.00 0.00 C -ATOM 889 O VAL 56 -10.693 -0.837 -14.397 1.00 0.00 O -ATOM 890 N PHE 57 -9.119 0.276 -13.191 1.00 0.00 N -ATOM 891 H PHE 57 -8.134 0.330 -12.977 1.00 0.00 H -ATOM 892 CA PHE 57 -9.977 1.396 -12.791 1.00 0.00 C -ATOM 893 HA PHE 57 -11.010 1.119 -13.004 1.00 0.00 H -ATOM 894 CB PHE 57 -9.841 1.600 -11.253 1.00 0.00 C -ATOM 895 HB2 PHE 57 -8.818 1.935 -11.081 1.00 0.00 H -ATOM 896 HB3 PHE 57 -10.496 2.439 -11.021 1.00 0.00 H -ATOM 897 CG PHE 57 -10.000 0.331 -10.458 1.00 0.00 C -ATOM 898 CD1 PHE 57 -11.240 -0.298 -10.311 1.00 0.00 C -ATOM 899 HD1 PHE 57 -12.159 0.137 -10.676 1.00 0.00 H -ATOM 900 CE1 PHE 57 -11.349 -1.529 -9.682 1.00 0.00 C -ATOM 901 HE1 PHE 57 -12.271 -2.091 -9.692 1.00 0.00 H -ATOM 902 CZ PHE 57 -10.213 -2.244 -9.220 1.00 0.00 C -ATOM 903 HZ PHE 57 -10.302 -3.241 -8.813 1.00 0.00 H -ATOM 904 CE2 PHE 57 -8.998 -1.620 -9.252 1.00 0.00 C -ATOM 905 HE2 PHE 57 -8.120 -2.143 -8.902 1.00 0.00 H -ATOM 906 CD2 PHE 57 -8.882 -0.307 -9.833 1.00 0.00 C -ATOM 907 HD2 PHE 57 -7.946 0.225 -9.911 1.00 0.00 H -ATOM 908 C PHE 57 -9.615 2.676 -13.589 1.00 0.00 C -ATOM 909 O PHE 57 -8.609 3.406 -13.508 1.00 0.00 O -ATOM 910 N GLY 58 -10.582 3.005 -14.451 1.00 0.00 N -ATOM 911 H GLY 58 -11.385 2.394 -14.495 1.00 0.00 H -ATOM 912 CA GLY 58 -10.653 4.288 -15.064 1.00 0.00 C -ATOM 913 HA2 GLY 58 -9.782 4.273 -15.721 1.00 0.00 H -ATOM 914 HA3 GLY 58 -11.595 4.262 -15.612 1.00 0.00 H -ATOM 915 C GLY 58 -10.751 5.482 -14.081 1.00 0.00 C -ATOM 916 O GLY 58 -11.231 5.327 -12.925 1.00 0.00 O -ATOM 917 N ALA 59 -10.376 6.665 -14.570 1.00 0.00 N -ATOM 918 H ALA 59 -9.977 6.558 -15.492 1.00 0.00 H -ATOM 919 CA ALA 59 -10.343 7.892 -13.812 1.00 0.00 C -ATOM 920 HA ALA 59 -9.617 7.835 -13.001 1.00 0.00 H -ATOM 921 CB ALA 59 -9.862 9.062 -14.692 1.00 0.00 C -ATOM 922 HB1 ALA 59 -10.322 9.038 -15.681 1.00 0.00 H -ATOM 923 HB2 ALA 59 -10.059 10.000 -14.173 1.00 0.00 H -ATOM 924 HB3 ALA 59 -8.820 8.857 -14.936 1.00 0.00 H -ATOM 925 C ALA 59 -11.765 8.254 -13.205 1.00 0.00 C -ATOM 926 O ALA 59 -11.895 8.742 -12.072 1.00 0.00 O -ATOM 927 N SER 60 -12.845 8.006 -13.956 1.00 0.00 N -ATOM 928 H SER 60 -12.775 7.444 -14.792 1.00 0.00 H -ATOM 929 CA SER 60 -14.245 8.242 -13.339 1.00 0.00 C -ATOM 930 HA SER 60 -14.384 9.231 -12.902 1.00 0.00 H -ATOM 931 CB SER 60 -15.287 8.284 -14.427 1.00 0.00 C -ATOM 932 HB2 SER 60 -16.283 8.444 -14.014 1.00 0.00 H -ATOM 933 HB3 SER 60 -15.111 9.170 -15.037 1.00 0.00 H -ATOM 934 OG SER 60 -15.314 7.021 -15.123 1.00 0.00 O -ATOM 935 HG SER 60 -15.728 7.212 -15.967 1.00 0.00 H -ATOM 936 C SER 60 -14.656 7.307 -12.158 1.00 0.00 C -ATOM 937 O SER 60 -15.595 7.648 -11.421 1.00 0.00 O -ATOM 938 N THR 61 -13.980 6.158 -11.989 1.00 0.00 N -ATOM 939 H THR 61 -13.239 5.922 -12.634 1.00 0.00 H -ATOM 940 CA THR 61 -14.546 5.178 -11.051 1.00 0.00 C -ATOM 941 HA THR 61 -15.604 5.031 -11.269 1.00 0.00 H -ATOM 942 CB THR 61 -13.713 3.884 -11.017 1.00 0.00 C -ATOM 943 HB THR 61 -12.706 4.186 -10.729 1.00 0.00 H -ATOM 944 CG2 THR 61 -14.162 2.700 -10.128 1.00 0.00 C -ATOM 945 HG21 THR 61 -13.340 2.019 -9.902 1.00 0.00 H -ATOM 946 HG22 THR 61 -14.503 3.079 -9.164 1.00 0.00 H -ATOM 947 HG23 THR 61 -15.042 2.219 -10.556 1.00 0.00 H -ATOM 948 OG1 THR 61 -13.585 3.296 -12.280 1.00 0.00 O -ATOM 949 HG1 THR 61 -13.578 3.924 -13.006 1.00 0.00 H -ATOM 950 C THR 61 -14.558 5.711 -9.633 1.00 0.00 C -ATOM 951 O THR 61 -13.525 6.192 -9.146 1.00 0.00 O -ATOM 952 N LYS 62 -15.659 5.432 -8.932 1.00 0.00 N -ATOM 953 H LYS 62 -16.351 4.782 -9.275 1.00 0.00 H -ATOM 954 CA LYS 62 -15.835 5.942 -7.550 1.00 0.00 C -ATOM 955 HA LYS 62 -15.397 6.939 -7.586 1.00 0.00 H -ATOM 956 CB LYS 62 -17.372 6.001 -7.245 1.00 0.00 C -ATOM 957 HB2 LYS 62 -17.774 5.056 -7.612 1.00 0.00 H -ATOM 958 HB3 LYS 62 -17.485 6.243 -6.189 1.00 0.00 H -ATOM 959 CG LYS 62 -17.944 7.149 -8.098 1.00 0.00 C -ATOM 960 HG2 LYS 62 -17.480 8.092 -7.808 1.00 0.00 H -ATOM 961 HG3 LYS 62 -17.610 7.060 -9.132 1.00 0.00 H -ATOM 962 CD LYS 62 -19.508 7.294 -8.022 1.00 0.00 C -ATOM 963 HD2 LYS 62 -19.697 7.630 -7.003 1.00 0.00 H -ATOM 964 HD3 LYS 62 -19.783 8.017 -8.790 1.00 0.00 H -ATOM 965 CE LYS 62 -20.389 6.075 -8.401 1.00 0.00 C -ATOM 966 HE2 LYS 62 -20.177 5.830 -9.441 1.00 0.00 H -ATOM 967 HE3 LYS 62 -20.010 5.252 -7.795 1.00 0.00 H -ATOM 968 NZ LYS 62 -21.875 6.280 -8.233 1.00 0.00 N -ATOM 969 HZ1 LYS 62 -22.401 5.418 -8.206 1.00 0.00 H -ATOM 970 HZ2 LYS 62 -22.014 6.587 -7.281 1.00 0.00 H -ATOM 971 HZ3 LYS 62 -22.326 6.942 -8.849 1.00 0.00 H -ATOM 972 C LYS 62 -14.991 5.133 -6.503 1.00 0.00 C -ATOM 973 O LYS 62 -14.794 3.896 -6.699 1.00 0.00 O -ATOM 974 N GLN 63 -14.579 5.698 -5.366 1.00 0.00 N -ATOM 975 H GLN 63 -14.786 6.665 -5.162 1.00 0.00 H -ATOM 976 CA GLN 63 -13.819 5.076 -4.301 1.00 0.00 C -ATOM 977 HA GLN 63 -12.813 4.777 -4.595 1.00 0.00 H -ATOM 978 CB GLN 63 -13.587 6.068 -3.179 1.00 0.00 C -ATOM 979 HB2 GLN 63 -14.574 6.489 -2.987 1.00 0.00 H -ATOM 980 HB3 GLN 63 -13.202 5.582 -2.283 1.00 0.00 H -ATOM 981 CG GLN 63 -12.612 7.213 -3.439 1.00 0.00 C -ATOM 982 HG2 GLN 63 -12.519 7.503 -4.486 1.00 0.00 H -ATOM 983 HG3 GLN 63 -12.902 8.130 -2.926 1.00 0.00 H -ATOM 984 CD GLN 63 -11.130 6.842 -3.092 1.00 0.00 C -ATOM 985 OE1 GLN 63 -10.530 6.020 -3.787 1.00 0.00 O -ATOM 986 NE2 GLN 63 -10.569 7.426 -2.126 1.00 0.00 N -ATOM 987 HE21 GLN 63 -9.642 7.136 -1.851 1.00 0.00 H -ATOM 988 HE22 GLN 63 -10.920 8.283 -1.724 1.00 0.00 H -ATOM 989 C GLN 63 -14.480 3.804 -3.618 1.00 0.00 C -ATOM 990 O GLN 63 -13.701 2.880 -3.293 1.00 0.00 O -ATOM 991 N ILE 64 -15.833 3.692 -3.539 1.00 0.00 N -ATOM 992 H ILE 64 -16.341 4.564 -3.495 1.00 0.00 H -ATOM 993 CA ILE 64 -16.528 2.436 -3.041 1.00 0.00 C -ATOM 994 HA ILE 64 -15.977 2.084 -2.169 1.00 0.00 H -ATOM 995 CB ILE 64 -17.961 2.771 -2.481 1.00 0.00 C -ATOM 996 HB ILE 64 -17.892 3.492 -1.667 1.00 0.00 H -ATOM 997 CG2 ILE 64 -18.849 3.501 -3.533 1.00 0.00 C -ATOM 998 HG21 ILE 64 -19.771 3.854 -3.071 1.00 0.00 H -ATOM 999 HG22 ILE 64 -18.410 4.446 -3.851 1.00 0.00 H -ATOM 1000 HG23 ILE 64 -19.053 2.806 -4.348 1.00 0.00 H -ATOM 1001 CG1 ILE 64 -18.632 1.552 -1.848 1.00 0.00 C -ATOM 1002 HG12 ILE 64 -19.708 1.682 -1.741 1.00 0.00 H -ATOM 1003 HG13 ILE 64 -18.686 0.745 -2.579 1.00 0.00 H -ATOM 1004 CD1 ILE 64 -17.967 1.119 -0.516 1.00 0.00 C -ATOM 1005 HD11 ILE 64 -18.462 0.254 -0.075 1.00 0.00 H -ATOM 1006 HD12 ILE 64 -16.935 0.861 -0.755 1.00 0.00 H -ATOM 1007 HD13 ILE 64 -18.009 1.902 0.241 1.00 0.00 H -ATOM 1008 C ILE 64 -16.479 1.304 -4.002 1.00 0.00 C -ATOM 1009 O ILE 64 -16.409 0.176 -3.704 1.00 0.00 O -ATOM 1010 N ASP 65 -16.675 1.595 -5.277 1.00 0.00 N -ATOM 1011 H ASP 65 -16.815 2.576 -5.472 1.00 0.00 H -ATOM 1012 CA ASP 65 -16.673 0.616 -6.397 1.00 0.00 C -ATOM 1013 HA ASP 65 -17.452 -0.130 -6.240 1.00 0.00 H -ATOM 1014 CB ASP 65 -17.003 1.216 -7.731 1.00 0.00 C -ATOM 1015 HB2 ASP 65 -16.299 2.020 -7.943 1.00 0.00 H -ATOM 1016 HB3 ASP 65 -17.002 0.403 -8.457 1.00 0.00 H -ATOM 1017 CG ASP 65 -18.432 1.812 -7.765 1.00 0.00 C -ATOM 1018 OD1 ASP 65 -19.233 1.768 -6.794 1.00 0.00 O -ATOM 1019 OD2 ASP 65 -18.754 2.288 -8.870 1.00 0.00 O -ATOM 1020 C ASP 65 -15.245 0.035 -6.550 1.00 0.00 C -ATOM 1021 O ASP 65 -15.123 -1.206 -6.784 1.00 0.00 O -ATOM 1022 N VAL 66 -14.173 0.861 -6.225 1.00 0.00 N -ATOM 1023 H VAL 66 -14.352 1.817 -5.952 1.00 0.00 H -ATOM 1024 CA VAL 66 -12.791 0.388 -6.151 1.00 0.00 C -ATOM 1025 HA VAL 66 -12.581 -0.186 -7.054 1.00 0.00 H -ATOM 1026 CB VAL 66 -11.726 1.475 -5.983 1.00 0.00 C -ATOM 1027 HB VAL 66 -12.114 2.283 -5.362 1.00 0.00 H -ATOM 1028 CG1 VAL 66 -10.335 0.957 -5.753 1.00 0.00 C -ATOM 1029 HG11 VAL 66 -10.273 0.591 -4.729 1.00 0.00 H -ATOM 1030 HG12 VAL 66 -10.161 0.226 -6.543 1.00 0.00 H -ATOM 1031 HG13 VAL 66 -9.617 1.776 -5.733 1.00 0.00 H -ATOM 1032 CG2 VAL 66 -11.640 2.131 -7.315 1.00 0.00 C -ATOM 1033 HG21 VAL 66 -10.945 2.970 -7.262 1.00 0.00 H -ATOM 1034 HG22 VAL 66 -11.377 1.543 -8.194 1.00 0.00 H -ATOM 1035 HG23 VAL 66 -12.593 2.619 -7.522 1.00 0.00 H -ATOM 1036 C VAL 66 -12.692 -0.546 -4.932 1.00 0.00 C -ATOM 1037 O VAL 66 -12.183 -1.696 -5.030 1.00 0.00 O -ATOM 1038 N TYR 67 -13.266 -0.213 -3.740 1.00 0.00 N -ATOM 1039 H TYR 67 -13.774 0.658 -3.798 1.00 0.00 H -ATOM 1040 CA TYR 67 -13.226 -1.009 -2.484 1.00 0.00 C -ATOM 1041 HA TYR 67 -12.217 -1.143 -2.097 1.00 0.00 H -ATOM 1042 CB TYR 67 -14.003 -0.192 -1.412 1.00 0.00 C -ATOM 1043 HB2 TYR 67 -13.735 0.864 -1.441 1.00 0.00 H -ATOM 1044 HB3 TYR 67 -15.049 -0.098 -1.706 1.00 0.00 H -ATOM 1045 CG TYR 67 -13.996 -0.875 -0.103 1.00 0.00 C -ATOM 1046 CD1 TYR 67 -15.072 -1.658 0.282 1.00 0.00 C -ATOM 1047 HD1 TYR 67 -15.944 -1.813 -0.336 1.00 0.00 H -ATOM 1048 CE1 TYR 67 -14.921 -2.298 1.466 1.00 0.00 C -ATOM 1049 HE1 TYR 67 -15.660 -3.008 1.804 1.00 0.00 H -ATOM 1050 CZ TYR 67 -13.854 -2.159 2.331 1.00 0.00 C -ATOM 1051 OH TYR 67 -13.800 -2.930 3.513 1.00 0.00 O -ATOM 1052 HH TYR 67 -14.670 -3.321 3.625 1.00 0.00 H -ATOM 1053 CE2 TYR 67 -12.792 -1.324 1.968 1.00 0.00 C -ATOM 1054 HE2 TYR 67 -11.912 -1.181 2.579 1.00 0.00 H -ATOM 1055 CD2 TYR 67 -12.835 -0.740 0.764 1.00 0.00 C -ATOM 1056 HD2 TYR 67 -12.056 -0.053 0.468 1.00 0.00 H -ATOM 1057 C TYR 67 -13.855 -2.363 -2.704 1.00 0.00 C -ATOM 1058 O TYR 67 -13.245 -3.418 -2.570 1.00 0.00 O -ATOM 1059 N ARG 68 -15.066 -2.370 -3.217 1.00 0.00 N -ATOM 1060 H ARG 68 -15.423 -1.456 -3.454 1.00 0.00 H -ATOM 1061 CA ARG 68 -15.883 -3.551 -3.477 1.00 0.00 C -ATOM 1062 HA ARG 68 -15.950 -4.011 -2.491 1.00 0.00 H -ATOM 1063 CB ARG 68 -17.208 -3.074 -4.043 1.00 0.00 C -ATOM 1064 HB2 ARG 68 -17.602 -2.121 -3.690 1.00 0.00 H -ATOM 1065 HB3 ARG 68 -17.114 -3.037 -5.128 1.00 0.00 H -ATOM 1066 CG ARG 68 -18.333 -4.045 -3.776 1.00 0.00 C -ATOM 1067 HG2 ARG 68 -18.215 -5.105 -4.004 1.00 0.00 H -ATOM 1068 HG3 ARG 68 -18.666 -4.067 -2.739 1.00 0.00 H -ATOM 1069 CD ARG 68 -19.584 -3.539 -4.533 1.00 0.00 C -ATOM 1070 HD2 ARG 68 -19.339 -3.358 -5.580 1.00 0.00 H -ATOM 1071 HD3 ARG 68 -20.265 -4.391 -4.531 1.00 0.00 H -ATOM 1072 NE ARG 68 -20.171 -2.337 -3.879 1.00 0.00 N -ATOM 1073 HE ARG 68 -20.373 -2.372 -2.890 1.00 0.00 H -ATOM 1074 CZ ARG 68 -20.362 -1.158 -4.481 1.00 0.00 C -ATOM 1075 NH1 ARG 68 -19.816 -0.815 -5.610 1.00 0.00 N -ATOM 1076 HH11 ARG 68 -19.506 -1.542 -6.240 1.00 0.00 H -ATOM 1077 HH12 ARG 68 -19.710 0.144 -5.907 1.00 0.00 H -ATOM 1078 NH2 ARG 68 -20.978 -0.150 -3.921 1.00 0.00 N -ATOM 1079 HH21 ARG 68 -21.412 -0.173 -3.009 1.00 0.00 H -ATOM 1080 HH22 ARG 68 -21.156 0.641 -4.524 1.00 0.00 H -ATOM 1081 C ARG 68 -15.183 -4.593 -4.420 1.00 0.00 C -ATOM 1082 O ARG 68 -15.441 -5.824 -4.245 1.00 0.00 O -ATOM 1083 N SER 69 -14.321 -4.117 -5.314 1.00 0.00 N -ATOM 1084 H SER 69 -14.306 -3.107 -5.315 1.00 0.00 H -ATOM 1085 CA SER 69 -13.670 -4.944 -6.311 1.00 0.00 C -ATOM 1086 HA SER 69 -14.295 -5.832 -6.410 1.00 0.00 H -ATOM 1087 CB SER 69 -13.721 -4.174 -7.669 1.00 0.00 C -ATOM 1088 HB2 SER 69 -13.101 -3.277 -7.666 1.00 0.00 H -ATOM 1089 HB3 SER 69 -13.388 -4.887 -8.423 1.00 0.00 H -ATOM 1090 OG SER 69 -15.071 -3.746 -7.889 1.00 0.00 O -ATOM 1091 HG SER 69 -15.082 -2.848 -7.549 1.00 0.00 H -ATOM 1092 C SER 69 -12.237 -5.251 -5.921 1.00 0.00 C -ATOM 1093 O SER 69 -11.806 -6.348 -6.240 1.00 0.00 O -ATOM 1094 N VAL 70 -11.525 -4.344 -5.245 1.00 0.00 N -ATOM 1095 H VAL 70 -11.921 -3.445 -5.009 1.00 0.00 H -ATOM 1096 CA VAL 70 -10.120 -4.611 -4.849 1.00 0.00 C -ATOM 1097 HA VAL 70 -9.715 -5.231 -5.649 1.00 0.00 H -ATOM 1098 CB VAL 70 -9.311 -3.243 -4.781 1.00 0.00 C -ATOM 1099 HB VAL 70 -9.772 -2.616 -4.018 1.00 0.00 H -ATOM 1100 CG1 VAL 70 -7.975 -3.512 -4.093 1.00 0.00 C -ATOM 1101 HG11 VAL 70 -7.982 -3.916 -3.081 1.00 0.00 H -ATOM 1102 HG12 VAL 70 -7.338 -4.151 -4.704 1.00 0.00 H -ATOM 1103 HG13 VAL 70 -7.437 -2.566 -4.030 1.00 0.00 H -ATOM 1104 CG2 VAL 70 -8.954 -2.614 -6.095 1.00 0.00 C -ATOM 1105 HG21 VAL 70 -8.197 -1.835 -6.003 1.00 0.00 H -ATOM 1106 HG22 VAL 70 -8.493 -3.391 -6.705 1.00 0.00 H -ATOM 1107 HG23 VAL 70 -9.802 -2.117 -6.566 1.00 0.00 H -ATOM 1108 C VAL 70 -10.121 -5.356 -3.501 1.00 0.00 C -ATOM 1109 O VAL 70 -9.226 -6.207 -3.290 1.00 0.00 O -ATOM 1110 N VAL 71 -11.059 -5.042 -2.594 1.00 0.00 N -ATOM 1111 H VAL 71 -11.769 -4.345 -2.764 1.00 0.00 H -ATOM 1112 CA VAL 71 -10.762 -5.296 -1.056 1.00 0.00 C -ATOM 1113 HA VAL 71 -9.702 -5.529 -0.961 1.00 0.00 H -ATOM 1114 CB VAL 71 -11.127 -4.186 -0.101 1.00 0.00 C -ATOM 1115 HB VAL 71 -12.192 -3.967 -0.182 1.00 0.00 H -ATOM 1116 CG1 VAL 71 -10.764 -4.466 1.401 1.00 0.00 C -ATOM 1117 HG11 VAL 71 -9.757 -4.882 1.433 1.00 0.00 H -ATOM 1118 HG12 VAL 71 -10.931 -3.588 2.025 1.00 0.00 H -ATOM 1119 HG13 VAL 71 -11.458 -5.172 1.859 1.00 0.00 H -ATOM 1120 CG2 VAL 71 -10.295 -2.916 -0.480 1.00 0.00 C -ATOM 1121 HG21 VAL 71 -10.630 -2.216 0.285 1.00 0.00 H -ATOM 1122 HG22 VAL 71 -9.240 -3.145 -0.328 1.00 0.00 H -ATOM 1123 HG23 VAL 71 -10.595 -2.574 -1.471 1.00 0.00 H -ATOM 1124 C VAL 71 -11.585 -6.449 -0.638 1.00 0.00 C -ATOM 1125 O VAL 71 -11.114 -7.372 0.017 1.00 0.00 O -ATOM 1126 N CYS 72 -12.822 -6.556 -1.091 1.00 0.00 N -ATOM 1127 H CYS 72 -13.194 -6.012 -1.856 1.00 0.00 H -ATOM 1128 CA CYS 72 -13.774 -7.429 -0.404 1.00 0.00 C -ATOM 1129 HA CYS 72 -13.641 -7.261 0.665 1.00 0.00 H -ATOM 1130 CB CYS 72 -15.209 -7.079 -0.795 1.00 0.00 C -ATOM 1131 HB2 CYS 72 -15.297 -6.917 -1.870 1.00 0.00 H -ATOM 1132 HB3 CYS 72 -15.933 -7.824 -0.466 1.00 0.00 H -ATOM 1133 SG CYS 72 -15.559 -5.456 -0.146 1.00 0.00 S -ATOM 1134 HG CYS 72 -16.847 -5.694 0.120 1.00 0.00 H -ATOM 1135 C CYS 72 -13.483 -9.026 -0.601 1.00 0.00 C -ATOM 1136 O CYS 72 -13.758 -9.730 0.385 1.00 0.00 O -ATOM 1137 N PRO 73 -12.964 -9.588 -1.728 1.00 0.00 N -ATOM 1138 CD PRO 73 -12.770 -8.906 -2.992 1.00 0.00 C -ATOM 1139 HD2 PRO 73 -11.888 -8.272 -2.905 1.00 0.00 H -ATOM 1140 HD3 PRO 73 -13.654 -8.422 -3.407 1.00 0.00 H -ATOM 1141 CG PRO 73 -12.538 -10.094 -3.967 1.00 0.00 C -ATOM 1142 HG2 PRO 73 -11.708 -9.964 -4.661 1.00 0.00 H -ATOM 1143 HG3 PRO 73 -13.457 -10.258 -4.530 1.00 0.00 H -ATOM 1144 CB PRO 73 -12.151 -11.305 -3.132 1.00 0.00 C -ATOM 1145 HB2 PRO 73 -11.072 -11.447 -3.189 1.00 0.00 H -ATOM 1146 HB3 PRO 73 -12.562 -12.273 -3.419 1.00 0.00 H -ATOM 1147 CA PRO 73 -12.577 -11.019 -1.684 1.00 0.00 C -ATOM 1148 HA PRO 73 -13.369 -11.681 -1.333 1.00 0.00 H -ATOM 1149 C PRO 73 -11.387 -11.235 -0.732 1.00 0.00 C -ATOM 1150 O PRO 73 -11.151 -12.319 -0.191 1.00 0.00 O -ATOM 1151 N ILE 74 -10.597 -10.224 -0.428 1.00 0.00 N -ATOM 1152 H ILE 74 -10.648 -9.345 -0.923 1.00 0.00 H -ATOM 1153 CA ILE 74 -9.415 -10.312 0.425 1.00 0.00 C -ATOM 1154 HA ILE 74 -8.973 -11.296 0.274 1.00 0.00 H -ATOM 1155 CB ILE 74 -8.362 -9.272 0.109 1.00 0.00 C -ATOM 1156 HB ILE 74 -8.791 -8.304 -0.150 1.00 0.00 H -ATOM 1157 CG2 ILE 74 -7.457 -8.989 1.286 1.00 0.00 C -ATOM 1158 HG21 ILE 74 -6.554 -8.532 0.882 1.00 0.00 H -ATOM 1159 HG22 ILE 74 -7.935 -8.157 1.804 1.00 0.00 H -ATOM 1160 HG23 ILE 74 -7.166 -9.930 1.751 1.00 0.00 H -ATOM 1161 CG1 ILE 74 -7.743 -9.841 -1.225 1.00 0.00 C -ATOM 1162 HG12 ILE 74 -7.455 -10.884 -1.093 1.00 0.00 H -ATOM 1163 HG13 ILE 74 -8.459 -9.807 -2.046 1.00 0.00 H -ATOM 1164 CD1 ILE 74 -6.524 -9.170 -1.698 1.00 0.00 C -ATOM 1165 HD11 ILE 74 -6.120 -9.708 -2.556 1.00 0.00 H -ATOM 1166 HD12 ILE 74 -6.697 -8.112 -1.896 1.00 0.00 H -ATOM 1167 HD13 ILE 74 -5.760 -9.224 -0.922 1.00 0.00 H -ATOM 1168 C ILE 74 -9.926 -10.206 1.835 1.00 0.00 C -ATOM 1169 O ILE 74 -9.546 -11.033 2.697 1.00 0.00 O -ATOM 1170 N LEU 75 -10.788 -9.284 2.185 1.00 0.00 N -ATOM 1171 H LEU 75 -11.148 -8.719 1.429 1.00 0.00 H -ATOM 1172 CA LEU 75 -11.416 -9.189 3.496 1.00 0.00 C -ATOM 1173 HA LEU 75 -10.580 -9.145 4.194 1.00 0.00 H -ATOM 1174 CB LEU 75 -12.071 -7.811 3.786 1.00 0.00 C -ATOM 1175 HB2 LEU 75 -11.403 -7.040 3.403 1.00 0.00 H -ATOM 1176 HB3 LEU 75 -12.968 -7.760 3.168 1.00 0.00 H -ATOM 1177 CG LEU 75 -12.624 -7.557 5.187 1.00 0.00 C -ATOM 1178 HG LEU 75 -13.436 -8.183 5.557 1.00 0.00 H -ATOM 1179 CD1 LEU 75 -11.733 -7.531 6.416 1.00 0.00 C -ATOM 1180 HD11 LEU 75 -11.104 -8.421 6.442 1.00 0.00 H -ATOM 1181 HD12 LEU 75 -11.134 -6.626 6.309 1.00 0.00 H -ATOM 1182 HD13 LEU 75 -12.377 -7.607 7.292 1.00 0.00 H -ATOM 1183 CD2 LEU 75 -13.253 -6.173 5.159 1.00 0.00 C -ATOM 1184 HD21 LEU 75 -12.555 -5.383 4.884 1.00 0.00 H -ATOM 1185 HD22 LEU 75 -14.008 -6.155 4.373 1.00 0.00 H -ATOM 1186 HD23 LEU 75 -13.738 -5.883 6.092 1.00 0.00 H -ATOM 1187 C LEU 75 -12.343 -10.389 3.814 1.00 0.00 C -ATOM 1188 O LEU 75 -12.260 -10.794 4.910 1.00 0.00 O -ATOM 1189 N ASP 76 -13.099 -10.980 2.828 1.00 0.00 N -ATOM 1190 H ASP 76 -13.032 -10.602 1.893 1.00 0.00 H -ATOM 1191 CA ASP 76 -13.454 -12.427 2.911 1.00 0.00 C -ATOM 1192 HA ASP 76 -14.207 -12.457 3.698 1.00 0.00 H -ATOM 1193 CB ASP 76 -14.058 -12.953 1.602 1.00 0.00 C -ATOM 1194 HB2 ASP 76 -13.392 -12.948 0.739 1.00 0.00 H -ATOM 1195 HB3 ASP 76 -14.169 -14.037 1.582 1.00 0.00 H -ATOM 1196 CG ASP 76 -15.416 -12.333 1.257 1.00 0.00 C -ATOM 1197 OD1 ASP 76 -16.020 -12.840 0.255 1.00 0.00 O -ATOM 1198 OD2 ASP 76 -16.016 -11.523 2.011 1.00 0.00 O -ATOM 1199 C ASP 76 -12.337 -13.519 3.267 1.00 0.00 C -ATOM 1200 O ASP 76 -12.555 -14.344 4.101 1.00 0.00 O -ATOM 1201 N GLU 77 -11.108 -13.483 2.736 1.00 0.00 N -ATOM 1202 H GLU 77 -10.904 -12.802 2.019 1.00 0.00 H -ATOM 1203 CA GLU 77 -9.975 -14.403 3.049 1.00 0.00 C -ATOM 1204 HA GLU 77 -10.441 -15.380 2.927 1.00 0.00 H -ATOM 1205 CB GLU 77 -8.845 -14.243 2.035 1.00 0.00 C -ATOM 1206 HB2 GLU 77 -9.282 -14.223 1.037 1.00 0.00 H -ATOM 1207 HB3 GLU 77 -8.428 -13.241 2.140 1.00 0.00 H -ATOM 1208 CG GLU 77 -7.649 -15.193 2.101 1.00 0.00 C -ATOM 1209 HG2 GLU 77 -6.752 -14.802 1.622 1.00 0.00 H -ATOM 1210 HG3 GLU 77 -7.465 -15.296 3.170 1.00 0.00 H -ATOM 1211 CD GLU 77 -7.872 -16.504 1.377 1.00 0.00 C -ATOM 1212 OE1 GLU 77 -8.690 -17.324 1.821 1.00 0.00 O -ATOM 1213 OE2 GLU 77 -7.246 -16.727 0.264 1.00 0.00 O -ATOM 1214 C GLU 77 -9.513 -14.084 4.450 1.00 0.00 C -ATOM 1215 O GLU 77 -9.298 -15.044 5.139 1.00 0.00 O -ATOM 1216 N VAL 78 -9.369 -12.809 4.816 1.00 0.00 N -ATOM 1217 H VAL 78 -9.508 -12.049 4.165 1.00 0.00 H -ATOM 1218 CA VAL 78 -8.820 -12.414 6.130 1.00 0.00 C -ATOM 1219 HA VAL 78 -7.880 -12.905 6.379 1.00 0.00 H -ATOM 1220 CB VAL 78 -8.518 -10.871 6.105 1.00 0.00 C -ATOM 1221 HB VAL 78 -9.414 -10.288 5.892 1.00 0.00 H -ATOM 1222 CG1 VAL 78 -8.082 -10.258 7.439 1.00 0.00 C -ATOM 1223 HG11 VAL 78 -7.132 -9.752 7.264 1.00 0.00 H -ATOM 1224 HG12 VAL 78 -8.799 -9.630 7.966 1.00 0.00 H -ATOM 1225 HG13 VAL 78 -7.831 -11.004 8.194 1.00 0.00 H -ATOM 1226 CG2 VAL 78 -7.345 -10.774 5.046 1.00 0.00 C -ATOM 1227 HG21 VAL 78 -7.607 -11.261 4.107 1.00 0.00 H -ATOM 1228 HG22 VAL 78 -7.260 -9.721 4.779 1.00 0.00 H -ATOM 1229 HG23 VAL 78 -6.491 -11.306 5.466 1.00 0.00 H -ATOM 1230 C VAL 78 -9.756 -12.681 7.277 1.00 0.00 C -ATOM 1231 O VAL 78 -9.360 -13.212 8.278 1.00 0.00 O -ATOM 1232 N ILE 79 -11.074 -12.407 7.089 1.00 0.00 N -ATOM 1233 H ILE 79 -11.407 -11.923 6.267 1.00 0.00 H -ATOM 1234 CA ILE 79 -12.081 -12.857 8.079 1.00 0.00 C -ATOM 1235 HA ILE 79 -11.639 -12.746 9.069 1.00 0.00 H -ATOM 1236 CB ILE 79 -13.299 -11.871 8.048 1.00 0.00 C -ATOM 1237 HB ILE 79 -13.604 -11.792 7.004 1.00 0.00 H -ATOM 1238 CG2 ILE 79 -14.563 -12.303 8.787 1.00 0.00 C -ATOM 1239 HG21 ILE 79 -14.849 -13.320 8.519 1.00 0.00 H -ATOM 1240 HG22 ILE 79 -14.483 -12.319 9.874 1.00 0.00 H -ATOM 1241 HG23 ILE 79 -15.405 -11.712 8.427 1.00 0.00 H -ATOM 1242 CG1 ILE 79 -13.050 -10.386 8.451 1.00 0.00 C -ATOM 1243 HG12 ILE 79 -12.362 -9.939 7.733 1.00 0.00 H -ATOM 1244 HG13 ILE 79 -13.989 -9.832 8.475 1.00 0.00 H -ATOM 1245 CD1 ILE 79 -12.457 -10.182 9.872 1.00 0.00 C -ATOM 1246 HD11 ILE 79 -13.198 -10.337 10.657 1.00 0.00 H -ATOM 1247 HD12 ILE 79 -11.562 -10.772 10.069 1.00 0.00 H -ATOM 1248 HD13 ILE 79 -12.232 -9.121 9.976 1.00 0.00 H -ATOM 1249 C ILE 79 -12.362 -14.389 8.095 1.00 0.00 C -ATOM 1250 O ILE 79 -12.675 -14.896 9.207 1.00 0.00 O -ATOM 1251 N MET 80 -12.077 -15.156 7.096 1.00 0.00 N -ATOM 1252 H MET 80 -11.856 -14.761 6.193 1.00 0.00 H -ATOM 1253 CA MET 80 -11.810 -16.636 7.257 1.00 0.00 C -ATOM 1254 HA MET 80 -12.579 -16.959 7.960 1.00 0.00 H -ATOM 1255 CB MET 80 -12.090 -17.326 5.880 1.00 0.00 C -ATOM 1256 HB2 MET 80 -13.002 -16.879 5.484 1.00 0.00 H -ATOM 1257 HB3 MET 80 -11.247 -17.069 5.238 1.00 0.00 H -ATOM 1258 CG MET 80 -12.284 -18.810 5.937 1.00 0.00 C -ATOM 1259 HG2 MET 80 -12.595 -19.145 4.948 1.00 0.00 H -ATOM 1260 HG3 MET 80 -11.332 -19.311 6.111 1.00 0.00 H -ATOM 1261 SD MET 80 -13.512 -19.412 7.078 1.00 0.00 S -ATOM 1262 CE MET 80 -13.421 -21.215 6.702 1.00 0.00 C -ATOM 1263 HE1 MET 80 -13.695 -21.293 5.650 1.00 0.00 H -ATOM 1264 HE2 MET 80 -12.412 -21.619 6.781 1.00 0.00 H -ATOM 1265 HE3 MET 80 -14.103 -21.855 7.262 1.00 0.00 H -ATOM 1266 C MET 80 -10.514 -17.184 7.956 1.00 0.00 C -ATOM 1267 O MET 80 -10.226 -18.393 7.997 1.00 0.00 O -ATOM 1268 N GLY 81 -9.692 -16.250 8.520 1.00 0.00 N -ATOM 1269 H GLY 81 -9.945 -15.272 8.532 1.00 0.00 H -ATOM 1270 CA GLY 81 -8.616 -16.466 9.408 1.00 0.00 C -ATOM 1271 HA2 GLY 81 -8.507 -15.583 10.037 1.00 0.00 H -ATOM 1272 HA3 GLY 81 -8.690 -17.377 10.002 1.00 0.00 H -ATOM 1273 C GLY 81 -7.250 -16.650 8.789 1.00 0.00 C -ATOM 1274 O GLY 81 -6.697 -17.777 8.883 1.00 0.00 O -ATOM 1275 N TYR 82 -6.833 -15.629 8.092 1.00 0.00 N -ATOM 1276 H TYR 82 -7.182 -14.730 8.391 1.00 0.00 H -ATOM 1277 CA TYR 82 -5.630 -15.635 7.228 1.00 0.00 C -ATOM 1278 HA TYR 82 -4.847 -16.177 7.759 1.00 0.00 H -ATOM 1279 CB TYR 82 -6.000 -16.319 5.884 1.00 0.00 C -ATOM 1280 HB2 TYR 82 -6.554 -17.238 6.073 1.00 0.00 H -ATOM 1281 HB3 TYR 82 -6.599 -15.577 5.357 1.00 0.00 H -ATOM 1282 CG TYR 82 -4.826 -16.732 4.958 1.00 0.00 C -ATOM 1283 CD1 TYR 82 -4.291 -15.854 3.973 1.00 0.00 C -ATOM 1284 HD1 TYR 82 -4.798 -14.924 3.763 1.00 0.00 H -ATOM 1285 CE1 TYR 82 -3.158 -16.218 3.216 1.00 0.00 C -ATOM 1286 HE1 TYR 82 -2.775 -15.521 2.486 1.00 0.00 H -ATOM 1287 CZ TYR 82 -2.510 -17.385 3.532 1.00 0.00 C -ATOM 1288 OH TYR 82 -1.352 -17.697 2.883 1.00 0.00 O -ATOM 1289 HH TYR 82 -0.919 -16.894 2.584 1.00 0.00 H -ATOM 1290 CE2 TYR 82 -2.897 -18.238 4.622 1.00 0.00 C -ATOM 1291 HE2 TYR 82 -2.404 -19.145 4.941 1.00 0.00 H -ATOM 1292 CD2 TYR 82 -4.109 -17.894 5.251 1.00 0.00 C -ATOM 1293 HD2 TYR 82 -4.314 -18.425 6.169 1.00 0.00 H -ATOM 1294 C TYR 82 -5.019 -14.202 6.998 1.00 0.00 C -ATOM 1295 O TYR 82 -5.626 -13.238 7.411 1.00 0.00 O -ATOM 1296 N ASN 83 -3.858 -14.084 6.407 1.00 0.00 N -ATOM 1297 H ASN 83 -3.435 -14.875 5.942 1.00 0.00 H -ATOM 1298 CA ASN 83 -3.165 -12.776 6.204 1.00 0.00 C -ATOM 1299 HA ASN 83 -3.605 -11.976 6.798 1.00 0.00 H -ATOM 1300 CB ASN 83 -1.773 -12.981 6.828 1.00 0.00 C -ATOM 1301 HB2 ASN 83 -1.115 -13.720 6.371 1.00 0.00 H -ATOM 1302 HB3 ASN 83 -1.146 -12.093 6.750 1.00 0.00 H -ATOM 1303 CG ASN 83 -1.789 -13.341 8.358 1.00 0.00 C -ATOM 1304 OD1 ASN 83 -2.824 -13.652 8.926 1.00 0.00 O -ATOM 1305 ND2 ASN 83 -0.708 -13.350 9.099 1.00 0.00 N -ATOM 1306 HD21 ASN 83 -0.701 -13.796 10.005 1.00 0.00 H -ATOM 1307 HD22 ASN 83 0.133 -12.978 8.682 1.00 0.00 H -ATOM 1308 C ASN 83 -3.095 -12.273 4.772 1.00 0.00 C -ATOM 1309 O ASN 83 -2.727 -13.035 3.851 1.00 0.00 O -ATOM 1310 N CYS 84 -3.375 -10.973 4.542 1.00 0.00 N -ATOM 1311 H CYS 84 -3.619 -10.366 5.312 1.00 0.00 H -ATOM 1312 CA CYS 84 -3.201 -10.427 3.164 1.00 0.00 C -ATOM 1313 HA CYS 84 -2.545 -11.068 2.574 1.00 0.00 H -ATOM 1314 CB CYS 84 -4.558 -10.384 2.469 1.00 0.00 C -ATOM 1315 HB2 CYS 84 -5.177 -9.662 3.001 1.00 0.00 H -ATOM 1316 HB3 CYS 84 -4.466 -10.072 1.428 1.00 0.00 H -ATOM 1317 SG CYS 84 -5.269 -11.967 2.303 1.00 0.00 S -ATOM 1318 HG CYS 84 -5.705 -12.041 3.564 1.00 0.00 H -ATOM 1319 C CYS 84 -2.591 -9.023 3.172 1.00 0.00 C -ATOM 1320 O CYS 84 -2.229 -8.585 4.223 1.00 0.00 O -ATOM 1321 N THR 85 -2.323 -8.385 2.032 1.00 0.00 N -ATOM 1322 H THR 85 -2.627 -8.871 1.201 1.00 0.00 H -ATOM 1323 CA THR 85 -1.624 -7.102 1.836 1.00 0.00 C -ATOM 1324 HA THR 85 -1.838 -6.403 2.644 1.00 0.00 H -ATOM 1325 CB THR 85 -0.094 -7.193 1.828 1.00 0.00 C -ATOM 1326 HB THR 85 0.199 -7.915 1.066 1.00 0.00 H -ATOM 1327 CG2 THR 85 0.568 -5.879 1.592 1.00 0.00 C -ATOM 1328 HG21 THR 85 0.084 -5.119 2.205 1.00 0.00 H -ATOM 1329 HG22 THR 85 1.647 -5.958 1.730 1.00 0.00 H -ATOM 1330 HG23 THR 85 0.375 -5.573 0.563 1.00 0.00 H -ATOM 1331 OG1 THR 85 0.311 -7.630 3.147 1.00 0.00 O -ATOM 1332 HG1 THR 85 1.176 -8.037 3.059 1.00 0.00 H -ATOM 1333 C THR 85 -2.131 -6.382 0.554 1.00 0.00 C -ATOM 1334 O THR 85 -2.160 -7.004 -0.511 1.00 0.00 O -ATOM 1335 N ILE 86 -2.367 -5.071 0.648 1.00 0.00 N -ATOM 1336 H ILE 86 -2.426 -4.685 1.579 1.00 0.00 H -ATOM 1337 CA ILE 86 -2.430 -4.181 -0.587 1.00 0.00 C -ATOM 1338 HA ILE 86 -2.408 -4.754 -1.515 1.00 0.00 H -ATOM 1339 CB ILE 86 -3.865 -3.612 -0.549 1.00 0.00 C -ATOM 1340 HB ILE 86 -3.886 -3.000 0.353 1.00 0.00 H -ATOM 1341 CG2 ILE 86 -4.054 -2.631 -1.778 1.00 0.00 C -ATOM 1342 HG21 ILE 86 -3.284 -1.860 -1.806 1.00 0.00 H -ATOM 1343 HG22 ILE 86 -4.039 -3.139 -2.742 1.00 0.00 H -ATOM 1344 HG23 ILE 86 -4.991 -2.094 -1.628 1.00 0.00 H -ATOM 1345 CG1 ILE 86 -5.034 -4.632 -0.545 1.00 0.00 C -ATOM 1346 HG12 ILE 86 -4.916 -5.160 -1.491 1.00 0.00 H -ATOM 1347 HG13 ILE 86 -4.867 -5.292 0.307 1.00 0.00 H -ATOM 1348 CD1 ILE 86 -6.511 -4.229 -0.515 1.00 0.00 C -ATOM 1349 HD11 ILE 86 -6.710 -3.679 -1.435 1.00 0.00 H -ATOM 1350 HD12 ILE 86 -7.107 -5.140 -0.447 1.00 0.00 H -ATOM 1351 HD13 ILE 86 -6.533 -3.577 0.358 1.00 0.00 H -ATOM 1352 C ILE 86 -1.252 -3.205 -0.578 1.00 0.00 C -ATOM 1353 O ILE 86 -1.037 -2.539 0.397 1.00 0.00 O -ATOM 1354 N PHE 87 -0.533 -3.114 -1.622 1.00 0.00 N -ATOM 1355 H PHE 87 -0.782 -3.804 -2.315 1.00 0.00 H -ATOM 1356 CA PHE 87 0.358 -2.028 -2.003 1.00 0.00 C -ATOM 1357 HA PHE 87 0.673 -1.526 -1.088 1.00 0.00 H -ATOM 1358 CB PHE 87 1.711 -2.516 -2.668 1.00 0.00 C -ATOM 1359 HB2 PHE 87 1.393 -2.966 -3.609 1.00 0.00 H -ATOM 1360 HB3 PHE 87 2.232 -1.586 -2.895 1.00 0.00 H -ATOM 1361 CG PHE 87 2.671 -3.339 -1.863 1.00 0.00 C -ATOM 1362 CD1 PHE 87 3.852 -2.782 -1.308 1.00 0.00 C -ATOM 1363 HD1 PHE 87 4.150 -1.752 -1.433 1.00 0.00 H -ATOM 1364 CE1 PHE 87 4.808 -3.622 -0.746 1.00 0.00 C -ATOM 1365 HE1 PHE 87 5.721 -3.166 -0.394 1.00 0.00 H -ATOM 1366 CZ PHE 87 4.611 -5.021 -0.665 1.00 0.00 C -ATOM 1367 HZ PHE 87 5.269 -5.720 -0.171 1.00 0.00 H -ATOM 1368 CE2 PHE 87 3.457 -5.552 -1.271 1.00 0.00 C -ATOM 1369 HE2 PHE 87 3.387 -6.621 -1.412 1.00 0.00 H -ATOM 1370 CD2 PHE 87 2.503 -4.732 -1.936 1.00 0.00 C -ATOM 1371 HD2 PHE 87 1.652 -5.134 -2.465 1.00 0.00 H -ATOM 1372 C PHE 87 -0.378 -1.077 -2.951 1.00 0.00 C -ATOM 1373 O PHE 87 -1.273 -1.527 -3.672 1.00 0.00 O -ATOM 1374 N ALA 88 0.050 0.182 -2.907 1.00 0.00 N -ATOM 1375 H ALA 88 0.749 0.384 -2.206 1.00 0.00 H -ATOM 1376 CA ALA 88 -0.141 1.208 -3.935 1.00 0.00 C -ATOM 1377 HA ALA 88 -0.479 0.713 -4.845 1.00 0.00 H -ATOM 1378 CB ALA 88 -1.213 2.220 -3.556 1.00 0.00 C -ATOM 1379 HB1 ALA 88 -1.404 2.860 -4.417 1.00 0.00 H -ATOM 1380 HB2 ALA 88 -2.143 1.731 -3.266 1.00 0.00 H -ATOM 1381 HB3 ALA 88 -0.931 2.794 -2.674 1.00 0.00 H -ATOM 1382 C ALA 88 1.243 1.909 -4.295 1.00 0.00 C -ATOM 1383 O ALA 88 1.936 2.396 -3.426 1.00 0.00 O -ATOM 1384 N TYR 89 1.482 1.978 -5.617 1.00 0.00 N -ATOM 1385 H TYR 89 0.781 1.671 -6.277 1.00 0.00 H -ATOM 1386 CA TYR 89 2.766 2.422 -6.260 1.00 0.00 C -ATOM 1387 HA TYR 89 3.233 3.110 -5.555 1.00 0.00 H -ATOM 1388 CB TYR 89 3.616 1.157 -6.506 1.00 0.00 C -ATOM 1389 HB2 TYR 89 3.726 0.534 -5.618 1.00 0.00 H -ATOM 1390 HB3 TYR 89 3.060 0.550 -7.221 1.00 0.00 H -ATOM 1391 CG TYR 89 4.948 1.593 -7.126 1.00 0.00 C -ATOM 1392 CD1 TYR 89 5.303 1.281 -8.462 1.00 0.00 C -ATOM 1393 HD1 TYR 89 4.626 0.906 -9.216 1.00 0.00 H -ATOM 1394 CE1 TYR 89 6.603 1.603 -8.915 1.00 0.00 C -ATOM 1395 HE1 TYR 89 6.778 1.486 -9.974 1.00 0.00 H -ATOM 1396 CZ TYR 89 7.571 2.234 -8.117 1.00 0.00 C -ATOM 1397 OH TYR 89 8.764 2.473 -8.603 1.00 0.00 O -ATOM 1398 HH TYR 89 8.999 1.885 -9.325 1.00 0.00 H -ATOM 1399 CE2 TYR 89 7.131 2.715 -6.833 1.00 0.00 C -ATOM 1400 HE2 TYR 89 7.738 3.276 -6.138 1.00 0.00 H -ATOM 1401 CD2 TYR 89 5.878 2.270 -6.348 1.00 0.00 C -ATOM 1402 HD2 TYR 89 5.638 2.509 -5.323 1.00 0.00 H -ATOM 1403 C TYR 89 2.604 3.292 -7.496 1.00 0.00 C -ATOM 1404 O TYR 89 1.632 3.150 -8.215 1.00 0.00 O -ATOM 1405 N GLY 90 3.450 4.278 -7.708 1.00 0.00 N -ATOM 1406 H GLY 90 4.237 4.437 -7.096 1.00 0.00 H -ATOM 1407 CA GLY 90 3.179 5.309 -8.750 1.00 0.00 C -ATOM 1408 HA2 GLY 90 3.650 4.972 -9.673 1.00 0.00 H -ATOM 1409 HA3 GLY 90 2.100 5.316 -8.907 1.00 0.00 H -ATOM 1410 C GLY 90 3.719 6.749 -8.493 1.00 0.00 C -ATOM 1411 O GLY 90 4.106 7.117 -7.414 1.00 0.00 O -ATOM 1412 N GLN 91 3.778 7.597 -9.536 1.00 0.00 N -ATOM 1413 H GLN 91 3.317 7.423 -10.417 1.00 0.00 H -ATOM 1414 CA GLN 91 4.518 8.898 -9.489 1.00 0.00 C -ATOM 1415 HA GLN 91 5.546 8.688 -9.194 1.00 0.00 H -ATOM 1416 CB GLN 91 4.546 9.645 -10.801 1.00 0.00 C -ATOM 1417 HB2 GLN 91 5.327 9.211 -11.426 1.00 0.00 H -ATOM 1418 HB3 GLN 91 3.538 9.540 -11.201 1.00 0.00 H -ATOM 1419 CG GLN 91 4.851 11.167 -10.751 1.00 0.00 C -ATOM 1420 HG2 GLN 91 4.032 11.769 -10.358 1.00 0.00 H -ATOM 1421 HG3 GLN 91 5.760 11.288 -10.162 1.00 0.00 H -ATOM 1422 CD GLN 91 5.004 11.943 -12.057 1.00 0.00 C -ATOM 1423 OE1 GLN 91 5.358 11.486 -13.150 1.00 0.00 O -ATOM 1424 NE2 GLN 91 4.987 13.270 -11.853 1.00 0.00 N -ATOM 1425 HE21 GLN 91 4.955 13.823 -12.698 1.00 0.00 H -ATOM 1426 HE22 GLN 91 4.586 13.487 -10.952 1.00 0.00 H -ATOM 1427 C GLN 91 3.870 9.769 -8.381 1.00 0.00 C -ATOM 1428 O GLN 91 2.678 9.792 -8.072 1.00 0.00 O -ATOM 1429 N THR 92 4.781 10.519 -7.805 1.00 0.00 N -ATOM 1430 H THR 92 5.740 10.380 -8.088 1.00 0.00 H -ATOM 1431 CA THR 92 4.482 11.515 -6.751 1.00 0.00 C -ATOM 1432 HA THR 92 3.941 11.119 -5.891 1.00 0.00 H -ATOM 1433 CB THR 92 5.751 12.224 -6.236 1.00 0.00 C -ATOM 1434 HB THR 92 6.167 12.792 -7.068 1.00 0.00 H -ATOM 1435 CG2 THR 92 5.427 13.150 -5.036 1.00 0.00 C -ATOM 1436 HG21 THR 92 6.308 13.754 -4.818 1.00 0.00 H -ATOM 1437 HG22 THR 92 4.601 13.800 -5.323 1.00 0.00 H -ATOM 1438 HG23 THR 92 5.284 12.583 -4.117 1.00 0.00 H -ATOM 1439 OG1 THR 92 6.635 11.240 -5.841 1.00 0.00 O -ATOM 1440 HG1 THR 92 7.282 11.112 -6.539 1.00 0.00 H -ATOM 1441 C THR 92 3.588 12.589 -7.391 1.00 0.00 C -ATOM 1442 O THR 92 4.086 13.427 -8.212 1.00 0.00 O -ATOM 1443 N GLY 93 2.239 12.526 -7.089 1.00 0.00 N -ATOM 1444 H GLY 93 1.934 11.813 -6.442 1.00 0.00 H -ATOM 1445 CA GLY 93 1.166 13.131 -7.852 1.00 0.00 C -ATOM 1446 HA2 GLY 93 0.574 13.769 -7.197 1.00 0.00 H -ATOM 1447 HA3 GLY 93 1.609 13.844 -8.547 1.00 0.00 H -ATOM 1448 C GLY 93 0.116 12.225 -8.586 1.00 0.00 C -ATOM 1449 O GLY 93 -0.688 12.761 -9.412 1.00 0.00 O -ATOM 1450 N THR 94 0.039 10.916 -8.263 1.00 0.00 N -ATOM 1451 H THR 94 0.838 10.678 -7.693 1.00 0.00 H -ATOM 1452 CA THR 94 -0.890 9.949 -8.794 1.00 0.00 C -ATOM 1453 HA THR 94 -1.386 10.517 -9.581 1.00 0.00 H -ATOM 1454 CB THR 94 -0.121 8.849 -9.636 1.00 0.00 C -ATOM 1455 HB THR 94 -0.815 8.117 -10.051 1.00 0.00 H -ATOM 1456 CG2 THR 94 0.729 9.592 -10.743 1.00 0.00 C -ATOM 1457 HG21 THR 94 0.047 10.215 -11.322 1.00 0.00 H -ATOM 1458 HG22 THR 94 1.500 10.174 -10.239 1.00 0.00 H -ATOM 1459 HG23 THR 94 1.188 8.863 -11.410 1.00 0.00 H -ATOM 1460 OG1 THR 94 0.747 8.182 -8.739 1.00 0.00 O -ATOM 1461 HG1 THR 94 1.317 8.854 -8.358 1.00 0.00 H -ATOM 1462 C THR 94 -2.054 9.421 -7.973 1.00 0.00 C -ATOM 1463 O THR 94 -2.811 8.659 -8.495 1.00 0.00 O -ATOM 1464 N GLY 95 -2.062 9.638 -6.664 1.00 0.00 N -ATOM 1465 H GLY 95 -1.363 10.220 -6.225 1.00 0.00 H -ATOM 1466 CA GLY 95 -3.180 9.144 -5.790 1.00 0.00 C -ATOM 1467 HA2 GLY 95 -3.271 9.866 -4.979 1.00 0.00 H -ATOM 1468 HA3 GLY 95 -4.106 9.009 -6.350 1.00 0.00 H -ATOM 1469 C GLY 95 -3.034 7.821 -5.087 1.00 0.00 C -ATOM 1470 O GLY 95 -4.039 7.156 -4.881 1.00 0.00 O -ATOM 1471 N LYS 96 -1.800 7.531 -4.594 1.00 0.00 N -ATOM 1472 H LYS 96 -1.111 8.264 -4.509 1.00 0.00 H -ATOM 1473 CA LYS 96 -1.591 6.307 -3.775 1.00 0.00 C -ATOM 1474 HA LYS 96 -2.027 5.435 -4.263 1.00 0.00 H -ATOM 1475 CB LYS 96 -0.129 6.034 -3.611 1.00 0.00 C -ATOM 1476 HB2 LYS 96 0.385 6.666 -2.887 1.00 0.00 H -ATOM 1477 HB3 LYS 96 -0.019 5.068 -3.119 1.00 0.00 H -ATOM 1478 CG LYS 96 0.703 5.999 -4.936 1.00 0.00 C -ATOM 1479 HG2 LYS 96 0.331 5.102 -5.431 1.00 0.00 H -ATOM 1480 HG3 LYS 96 0.445 6.867 -5.542 1.00 0.00 H -ATOM 1481 CD LYS 96 2.197 6.009 -4.780 1.00 0.00 C -ATOM 1482 HD2 LYS 96 2.576 5.226 -4.123 1.00 0.00 H -ATOM 1483 HD3 LYS 96 2.583 5.914 -5.795 1.00 0.00 H -ATOM 1484 CE LYS 96 2.710 7.365 -4.221 1.00 0.00 C -ATOM 1485 HE2 LYS 96 2.144 7.593 -3.318 1.00 0.00 H -ATOM 1486 HE3 LYS 96 3.757 7.147 -4.008 1.00 0.00 H -ATOM 1487 NZ LYS 96 2.600 8.435 -5.201 1.00 0.00 N -ATOM 1488 HZ1 LYS 96 3.035 8.158 -6.070 1.00 0.00 H -ATOM 1489 HZ2 LYS 96 1.670 8.824 -5.254 1.00 0.00 H -ATOM 1490 HZ3 LYS 96 3.217 9.180 -4.909 1.00 0.00 H -ATOM 1491 C LYS 96 -2.216 6.430 -2.467 1.00 0.00 C -ATOM 1492 O LYS 96 -3.055 5.648 -2.106 1.00 0.00 O -ATOM 1493 N THR 97 -1.897 7.439 -1.714 1.00 0.00 N -ATOM 1494 H THR 97 -1.250 8.111 -2.102 1.00 0.00 H -ATOM 1495 CA THR 97 -2.590 7.746 -0.395 1.00 0.00 C -ATOM 1496 HA THR 97 -2.633 6.865 0.245 1.00 0.00 H -ATOM 1497 CB THR 97 -1.939 8.928 0.405 1.00 0.00 C -ATOM 1498 HB THR 97 -2.027 9.826 -0.208 1.00 0.00 H -ATOM 1499 CG2 THR 97 -2.488 9.129 1.785 1.00 0.00 C -ATOM 1500 HG21 THR 97 -2.443 8.204 2.360 1.00 0.00 H -ATOM 1501 HG22 THR 97 -1.809 9.782 2.332 1.00 0.00 H -ATOM 1502 HG23 THR 97 -3.539 9.417 1.785 1.00 0.00 H -ATOM 1503 OG1 THR 97 -0.494 8.743 0.598 1.00 0.00 O -ATOM 1504 HG1 THR 97 -0.290 7.949 1.097 1.00 0.00 H -ATOM 1505 C THR 97 -4.055 8.049 -0.592 1.00 0.00 C -ATOM 1506 O THR 97 -4.789 7.683 0.317 1.00 0.00 O -ATOM 1507 N PHE 98 -4.436 8.650 -1.702 1.00 0.00 N -ATOM 1508 H PHE 98 -3.694 9.054 -2.255 1.00 0.00 H -ATOM 1509 CA PHE 98 -5.830 8.866 -1.927 1.00 0.00 C -ATOM 1510 HA PHE 98 -6.331 9.437 -1.146 1.00 0.00 H -ATOM 1511 CB PHE 98 -5.858 9.698 -3.229 1.00 0.00 C -ATOM 1512 HB2 PHE 98 -5.309 10.621 -3.046 1.00 0.00 H -ATOM 1513 HB3 PHE 98 -5.393 9.181 -4.069 1.00 0.00 H -ATOM 1514 CG PHE 98 -7.338 10.018 -3.680 1.00 0.00 C -ATOM 1515 CD1 PHE 98 -8.028 9.120 -4.556 1.00 0.00 C -ATOM 1516 HD1 PHE 98 -7.500 8.271 -4.963 1.00 0.00 H -ATOM 1517 CE1 PHE 98 -9.374 9.321 -4.893 1.00 0.00 C -ATOM 1518 HE1 PHE 98 -9.953 8.655 -5.515 1.00 0.00 H -ATOM 1519 CZ PHE 98 -10.061 10.489 -4.370 1.00 0.00 C -ATOM 1520 HZ PHE 98 -11.053 10.675 -4.756 1.00 0.00 H -ATOM 1521 CE2 PHE 98 -9.431 11.329 -3.463 1.00 0.00 C -ATOM 1522 HE2 PHE 98 -10.004 12.146 -3.048 1.00 0.00 H -ATOM 1523 CD2 PHE 98 -8.100 11.094 -3.152 1.00 0.00 C -ATOM 1524 HD2 PHE 98 -7.600 11.677 -2.393 1.00 0.00 H -ATOM 1525 C PHE 98 -6.670 7.582 -2.126 1.00 0.00 C -ATOM 1526 O PHE 98 -7.679 7.407 -1.404 1.00 0.00 O -ATOM 1527 N THR 99 -6.181 6.575 -2.817 1.00 0.00 N -ATOM 1528 H THR 99 -5.340 6.712 -3.360 1.00 0.00 H -ATOM 1529 CA THR 99 -6.781 5.277 -2.824 1.00 0.00 C -ATOM 1530 HA THR 99 -7.821 5.301 -3.147 1.00 0.00 H -ATOM 1531 CB THR 99 -6.034 4.419 -3.766 1.00 0.00 C -ATOM 1532 HB THR 99 -4.989 4.295 -3.481 1.00 0.00 H -ATOM 1533 CG2 THR 99 -6.589 3.021 -3.990 1.00 0.00 C -ATOM 1534 HG21 THR 99 -5.920 2.468 -4.651 1.00 0.00 H -ATOM 1535 HG22 THR 99 -6.674 2.459 -3.060 1.00 0.00 H -ATOM 1536 HG23 THR 99 -7.493 3.143 -4.587 1.00 0.00 H -ATOM 1537 OG1 THR 99 -6.064 4.926 -5.118 1.00 0.00 O -ATOM 1538 HG1 THR 99 -5.655 5.793 -5.175 1.00 0.00 H -ATOM 1539 C THR 99 -6.683 4.572 -1.418 1.00 0.00 C -ATOM 1540 O THR 99 -7.761 4.025 -1.005 1.00 0.00 O -ATOM 1541 N MET 100 -5.536 4.614 -0.668 1.00 0.00 N -ATOM 1542 H MET 100 -4.937 5.371 -0.964 1.00 0.00 H -ATOM 1543 CA MET 100 -5.363 4.062 0.667 1.00 0.00 C -ATOM 1544 HA MET 100 -5.814 3.071 0.614 1.00 0.00 H -ATOM 1545 CB MET 100 -3.942 4.030 1.047 1.00 0.00 C -ATOM 1546 HB2 MET 100 -3.583 5.054 0.952 1.00 0.00 H -ATOM 1547 HB3 MET 100 -3.850 3.692 2.080 1.00 0.00 H -ATOM 1548 CG MET 100 -3.107 3.101 0.233 1.00 0.00 C -ATOM 1549 HG2 MET 100 -3.048 3.470 -0.791 1.00 0.00 H -ATOM 1550 HG3 MET 100 -2.091 3.238 0.605 1.00 0.00 H -ATOM 1551 SD MET 100 -3.582 1.371 0.326 1.00 0.00 S -ATOM 1552 CE MET 100 -1.986 0.538 -0.230 1.00 0.00 C -ATOM 1553 HE1 MET 100 -1.870 0.492 -1.313 1.00 0.00 H -ATOM 1554 HE2 MET 100 -1.105 1.095 0.087 1.00 0.00 H -ATOM 1555 HE3 MET 100 -2.069 -0.534 -0.050 1.00 0.00 H -ATOM 1556 C MET 100 -6.360 4.716 1.703 1.00 0.00 C -ATOM 1557 O MET 100 -7.003 3.874 2.341 1.00 0.00 O -ATOM 1558 N GLU 101 -6.336 5.992 1.951 1.00 0.00 N -ATOM 1559 H GLU 101 -5.715 6.563 1.396 1.00 0.00 H -ATOM 1560 CA GLU 101 -7.015 6.670 3.020 1.00 0.00 C -ATOM 1561 HA GLU 101 -7.511 5.869 3.569 1.00 0.00 H -ATOM 1562 CB GLU 101 -5.957 7.259 3.975 1.00 0.00 C -ATOM 1563 HB2 GLU 101 -5.300 6.558 4.491 1.00 0.00 H -ATOM 1564 HB3 GLU 101 -5.291 7.769 3.280 1.00 0.00 H -ATOM 1565 CG GLU 101 -6.498 8.247 5.034 1.00 0.00 C -ATOM 1566 HG2 GLU 101 -7.315 8.828 4.606 1.00 0.00 H -ATOM 1567 HG3 GLU 101 -6.795 7.668 5.908 1.00 0.00 H -ATOM 1568 CD GLU 101 -5.400 9.232 5.477 1.00 0.00 C -ATOM 1569 OE1 GLU 101 -5.791 10.377 5.851 1.00 0.00 O -ATOM 1570 OE2 GLU 101 -4.199 8.909 5.504 1.00 0.00 O -ATOM 1571 C GLU 101 -8.058 7.735 2.496 1.00 0.00 C -ATOM 1572 O GLU 101 -9.191 7.891 3.072 1.00 0.00 O -ATOM 1573 N GLY 102 -7.684 8.459 1.433 1.00 0.00 N -ATOM 1574 H GLY 102 -6.775 8.362 1.005 1.00 0.00 H -ATOM 1575 CA GLY 102 -8.685 9.273 0.772 1.00 0.00 C -ATOM 1576 HA2 GLY 102 -8.239 9.476 -0.201 1.00 0.00 H -ATOM 1577 HA3 GLY 102 -9.611 8.711 0.652 1.00 0.00 H -ATOM 1578 C GLY 102 -8.961 10.628 1.468 1.00 0.00 C -ATOM 1579 O GLY 102 -8.554 10.987 2.592 1.00 0.00 O -ATOM 1580 N GLU 103 -9.861 11.402 0.821 1.00 0.00 N -ATOM 1581 H GLU 103 -10.235 11.066 -0.055 1.00 0.00 H -ATOM 1582 CA GLU 103 -10.407 12.620 1.419 1.00 0.00 C -ATOM 1583 HA GLU 103 -9.666 13.023 2.109 1.00 0.00 H -ATOM 1584 CB GLU 103 -10.592 13.811 0.448 1.00 0.00 C -ATOM 1585 HB2 GLU 103 -11.507 13.693 -0.132 1.00 0.00 H -ATOM 1586 HB3 GLU 103 -10.677 14.704 1.067 1.00 0.00 H -ATOM 1587 CG GLU 103 -9.371 13.982 -0.481 1.00 0.00 C -ATOM 1588 HG2 GLU 103 -9.253 13.176 -1.206 1.00 0.00 H -ATOM 1589 HG3 GLU 103 -9.670 14.870 -1.037 1.00 0.00 H -ATOM 1590 CD GLU 103 -8.065 14.258 0.222 1.00 0.00 C -ATOM 1591 OE1 GLU 103 -8.068 15.040 1.167 1.00 0.00 O -ATOM 1592 OE2 GLU 103 -6.972 13.924 -0.291 1.00 0.00 O -ATOM 1593 C GLU 103 -11.658 12.310 2.288 1.00 0.00 C -ATOM 1594 O GLU 103 -12.755 12.752 1.972 1.00 0.00 O -ATOM 1595 N ARG 104 -11.416 11.458 3.248 1.00 0.00 N -ATOM 1596 H ARG 104 -10.459 11.146 3.336 1.00 0.00 H -ATOM 1597 CA ARG 104 -12.349 10.951 4.238 1.00 0.00 C -ATOM 1598 HA ARG 104 -13.068 10.380 3.650 1.00 0.00 H -ATOM 1599 CB ARG 104 -11.554 10.145 5.262 1.00 0.00 C -ATOM 1600 HB2 ARG 104 -12.161 9.648 6.018 1.00 0.00 H -ATOM 1601 HB3 ARG 104 -11.037 9.424 4.629 1.00 0.00 H -ATOM 1602 CG ARG 104 -10.460 11.001 5.983 1.00 0.00 C -ATOM 1603 HG2 ARG 104 -9.903 11.623 5.282 1.00 0.00 H -ATOM 1604 HG3 ARG 104 -10.841 11.636 6.783 1.00 0.00 H -ATOM 1605 CD ARG 104 -9.469 10.098 6.762 1.00 0.00 C -ATOM 1606 HD2 ARG 104 -9.987 9.840 7.686 1.00 0.00 H -ATOM 1607 HD3 ARG 104 -9.306 9.231 6.122 1.00 0.00 H -ATOM 1608 NE ARG 104 -8.166 10.768 7.033 1.00 0.00 N -ATOM 1609 HE ARG 104 -7.394 10.449 6.466 1.00 0.00 H -ATOM 1610 CZ ARG 104 -7.766 11.757 7.886 1.00 0.00 C -ATOM 1611 NH1 ARG 104 -8.642 12.262 8.765 1.00 0.00 N -ATOM 1612 HH11 ARG 104 -9.613 11.990 8.708 1.00 0.00 H -ATOM 1613 HH12 ARG 104 -8.366 13.100 9.256 1.00 0.00 H -ATOM 1614 NH2 ARG 104 -6.517 12.186 7.827 1.00 0.00 N -ATOM 1615 HH21 ARG 104 -5.923 11.656 7.205 1.00 0.00 H -ATOM 1616 HH22 ARG 104 -6.177 12.805 8.550 1.00 0.00 H -ATOM 1617 C ARG 104 -13.149 12.031 5.024 1.00 0.00 C -ATOM 1618 O ARG 104 -12.579 13.056 5.505 1.00 0.00 O -ATOM 1619 N SER 105 -14.421 11.867 5.116 1.00 0.00 N -ATOM 1620 H SER 105 -14.793 11.077 4.609 1.00 0.00 H -ATOM 1621 CA SER 105 -15.289 12.586 6.062 1.00 0.00 C -ATOM 1622 HA SER 105 -15.109 13.660 6.011 1.00 0.00 H -ATOM 1623 CB SER 105 -16.780 12.430 5.606 1.00 0.00 C -ATOM 1624 HB2 SER 105 -17.263 11.613 6.142 1.00 0.00 H -ATOM 1625 HB3 SER 105 -17.338 13.324 5.887 1.00 0.00 H -ATOM 1626 OG SER 105 -16.933 12.264 4.243 1.00 0.00 O -ATOM 1627 HG SER 105 -16.622 11.359 4.157 1.00 0.00 H -ATOM 1628 C SER 105 -15.071 12.017 7.448 1.00 0.00 C -ATOM 1629 O SER 105 -14.756 10.832 7.583 1.00 0.00 O -ATOM 1630 N PRO 106 -15.318 12.734 8.534 1.00 0.00 N -ATOM 1631 CD PRO 106 -15.682 14.139 8.555 1.00 0.00 C -ATOM 1632 HD2 PRO 106 -16.385 14.516 7.812 1.00 0.00 H -ATOM 1633 HD3 PRO 106 -14.776 14.733 8.438 1.00 0.00 H -ATOM 1634 CG PRO 106 -16.320 14.411 9.934 1.00 0.00 C -ATOM 1635 HG2 PRO 106 -17.368 14.113 9.905 1.00 0.00 H -ATOM 1636 HG3 PRO 106 -16.233 15.433 10.303 1.00 0.00 H -ATOM 1637 CB PRO 106 -15.480 13.464 10.855 1.00 0.00 C -ATOM 1638 HB2 PRO 106 -16.084 13.150 11.706 1.00 0.00 H -ATOM 1639 HB3 PRO 106 -14.470 13.834 11.037 1.00 0.00 H -ATOM 1640 CA PRO 106 -15.279 12.256 9.916 1.00 0.00 C -ATOM 1641 HA PRO 106 -14.274 11.861 10.064 1.00 0.00 H -ATOM 1642 C PRO 106 -16.213 11.090 10.232 1.00 0.00 C -ATOM 1643 O PRO 106 -17.168 10.862 9.472 1.00 0.00 O -ATOM 1644 N ASN 107 -15.840 10.366 11.292 1.00 0.00 N -ATOM 1645 H ASN 107 -15.121 10.729 11.901 1.00 0.00 H -ATOM 1646 CA ASN 107 -16.471 9.202 11.754 1.00 0.00 C -ATOM 1647 HA ASN 107 -16.519 8.500 10.921 1.00 0.00 H -ATOM 1648 CB ASN 107 -15.575 8.597 12.831 1.00 0.00 C -ATOM 1649 HB2 ASN 107 -14.523 8.516 12.558 1.00 0.00 H -ATOM 1650 HB3 ASN 107 -15.448 9.283 13.669 1.00 0.00 H -ATOM 1651 CG ASN 107 -16.067 7.226 13.235 1.00 0.00 C -ATOM 1652 OD1 ASN 107 -16.244 6.390 12.374 1.00 0.00 O -ATOM 1653 ND2 ASN 107 -16.295 6.941 14.495 1.00 0.00 N -ATOM 1654 HD21 ASN 107 -16.621 5.992 14.609 1.00 0.00 H -ATOM 1655 HD22 ASN 107 -16.244 7.608 15.252 1.00 0.00 H -ATOM 1656 C ASN 107 -17.924 9.515 12.183 1.00 0.00 C -ATOM 1657 O ASN 107 -18.276 10.646 12.352 1.00 0.00 O -ATOM 1658 N GLU 108 -18.842 8.548 12.261 1.00 0.00 N -ATOM 1659 H GLU 108 -18.569 7.611 12.001 1.00 0.00 H -ATOM 1660 CA GLU 108 -20.292 8.677 12.438 1.00 0.00 C -ATOM 1661 HA GLU 108 -20.661 7.653 12.484 1.00 0.00 H -ATOM 1662 CB GLU 108 -20.587 9.309 13.808 1.00 0.00 C -ATOM 1663 HB2 GLU 108 -20.529 10.397 13.766 1.00 0.00 H -ATOM 1664 HB3 GLU 108 -21.607 9.111 14.139 1.00 0.00 H -ATOM 1665 CG GLU 108 -19.681 8.909 14.950 1.00 0.00 C -ATOM 1666 HG2 GLU 108 -18.692 9.249 14.643 1.00 0.00 H -ATOM 1667 HG3 GLU 108 -19.928 9.548 15.798 1.00 0.00 H -ATOM 1668 CD GLU 108 -19.659 7.462 15.320 1.00 0.00 C -ATOM 1669 OE1 GLU 108 -20.250 6.533 14.748 1.00 0.00 O -ATOM 1670 OE2 GLU 108 -18.897 7.218 16.324 1.00 0.00 O -ATOM 1671 C GLU 108 -21.052 9.415 11.352 1.00 0.00 C -ATOM 1672 O GLU 108 -22.285 9.299 11.395 1.00 0.00 O -ATOM 1673 N GLU 109 -20.441 10.128 10.421 1.00 0.00 N -ATOM 1674 H GLU 109 -19.431 10.128 10.395 1.00 0.00 H -ATOM 1675 CA GLU 109 -21.205 10.934 9.445 1.00 0.00 C -ATOM 1676 HA GLU 109 -21.975 11.484 9.985 1.00 0.00 H -ATOM 1677 CB GLU 109 -20.230 11.921 8.784 1.00 0.00 C -ATOM 1678 HB2 GLU 109 -19.821 12.496 9.615 1.00 0.00 H -ATOM 1679 HB3 GLU 109 -19.396 11.309 8.439 1.00 0.00 H -ATOM 1680 CG GLU 109 -20.656 12.913 7.648 1.00 0.00 C -ATOM 1681 HG2 GLU 109 -19.777 13.113 7.035 1.00 0.00 H -ATOM 1682 HG3 GLU 109 -21.456 12.500 7.032 1.00 0.00 H -ATOM 1683 CD GLU 109 -21.138 14.235 8.272 1.00 0.00 C -ATOM 1684 OE1 GLU 109 -22.214 14.207 8.911 1.00 0.00 O -ATOM 1685 OE2 GLU 109 -20.498 15.262 8.165 1.00 0.00 O -ATOM 1686 C GLU 109 -21.769 10.091 8.338 1.00 0.00 C -ATOM 1687 O GLU 109 -22.862 10.428 7.785 1.00 0.00 O -ATOM 1688 N TYR 110 -21.090 9.059 7.967 1.00 0.00 N -ATOM 1689 H TYR 110 -20.155 9.023 8.346 1.00 0.00 H -ATOM 1690 CA TYR 110 -21.502 8.024 6.988 1.00 0.00 C -ATOM 1691 HA TYR 110 -22.591 8.030 6.943 1.00 0.00 H -ATOM 1692 CB TYR 110 -20.915 8.401 5.680 1.00 0.00 C -ATOM 1693 HB2 TYR 110 -19.849 8.176 5.713 1.00 0.00 H -ATOM 1694 HB3 TYR 110 -21.233 7.748 4.867 1.00 0.00 H -ATOM 1695 CG TYR 110 -21.240 9.820 5.182 1.00 0.00 C -ATOM 1696 CD1 TYR 110 -22.519 10.171 4.758 1.00 0.00 C -ATOM 1697 HD1 TYR 110 -23.350 9.513 4.966 1.00 0.00 H -ATOM 1698 CE1 TYR 110 -22.781 11.445 4.144 1.00 0.00 C -ATOM 1699 HE1 TYR 110 -23.769 11.693 3.783 1.00 0.00 H -ATOM 1700 CZ TYR 110 -21.707 12.339 3.966 1.00 0.00 C -ATOM 1701 OH TYR 110 -21.918 13.543 3.345 1.00 0.00 O -ATOM 1702 HH TYR 110 -22.714 13.639 2.818 1.00 0.00 H -ATOM 1703 CE2 TYR 110 -20.406 11.923 4.265 1.00 0.00 C -ATOM 1704 HE2 TYR 110 -19.586 12.601 4.080 1.00 0.00 H -ATOM 1705 CD2 TYR 110 -20.185 10.663 4.827 1.00 0.00 C -ATOM 1706 HD2 TYR 110 -19.192 10.326 5.084 1.00 0.00 H -ATOM 1707 C TYR 110 -21.150 6.578 7.379 1.00 0.00 C -ATOM 1708 O TYR 110 -20.158 6.382 8.006 1.00 0.00 O -ATOM 1709 N THR 111 -21.942 5.615 6.899 1.00 0.00 N -ATOM 1710 H THR 111 -22.846 5.924 6.571 1.00 0.00 H -ATOM 1711 CA THR 111 -21.560 4.180 6.926 1.00 0.00 C -ATOM 1712 HA THR 111 -21.062 4.035 7.885 1.00 0.00 H -ATOM 1713 CB THR 111 -22.862 3.275 6.935 1.00 0.00 C -ATOM 1714 HB THR 111 -23.528 3.504 7.766 1.00 0.00 H -ATOM 1715 CG2 THR 111 -23.687 3.410 5.698 1.00 0.00 C -ATOM 1716 HG21 THR 111 -24.358 4.262 5.808 1.00 0.00 H -ATOM 1717 HG22 THR 111 -23.108 3.701 4.821 1.00 0.00 H -ATOM 1718 HG23 THR 111 -24.230 2.533 5.347 1.00 0.00 H -ATOM 1719 OG1 THR 111 -22.377 1.931 7.086 1.00 0.00 O -ATOM 1720 HG1 THR 111 -23.127 1.361 7.267 1.00 0.00 H -ATOM 1721 C THR 111 -20.611 3.850 5.829 1.00 0.00 C -ATOM 1722 O THR 111 -20.444 4.666 4.869 1.00 0.00 O -ATOM 1723 N TRP 112 -19.764 2.816 5.961 1.00 0.00 N -ATOM 1724 H TRP 112 -19.703 2.425 6.890 1.00 0.00 H -ATOM 1725 CA TRP 112 -18.700 2.543 5.066 1.00 0.00 C -ATOM 1726 HA TRP 112 -17.979 3.342 5.239 1.00 0.00 H -ATOM 1727 CB TRP 112 -18.004 1.252 5.433 1.00 0.00 C -ATOM 1728 HB2 TRP 112 -17.076 1.023 4.909 1.00 0.00 H -ATOM 1729 HB3 TRP 112 -17.599 1.408 6.433 1.00 0.00 H -ATOM 1730 CG TRP 112 -18.786 -0.049 5.286 1.00 0.00 C -ATOM 1731 CD1 TRP 112 -19.643 -0.549 6.225 1.00 0.00 C -ATOM 1732 HD1 TRP 112 -19.881 -0.078 7.168 1.00 0.00 H -ATOM 1733 NE1 TRP 112 -20.142 -1.718 5.726 1.00 0.00 N -ATOM 1734 HE1 TRP 112 -20.832 -2.357 6.094 1.00 0.00 H -ATOM 1735 CE2 TRP 112 -19.681 -1.999 4.448 1.00 0.00 C -ATOM 1736 CZ2 TRP 112 -19.965 -3.024 3.501 1.00 0.00 C -ATOM 1737 HZ2 TRP 112 -20.570 -3.885 3.744 1.00 0.00 H -ATOM 1738 CH2 TRP 112 -19.373 -2.921 2.288 1.00 0.00 C -ATOM 1739 HH2 TRP 112 -19.608 -3.685 1.562 1.00 0.00 H -ATOM 1740 CZ3 TRP 112 -18.444 -1.937 1.980 1.00 0.00 C -ATOM 1741 HZ3 TRP 112 -17.942 -1.957 1.024 1.00 0.00 H -ATOM 1742 CE3 TRP 112 -18.084 -1.026 2.945 1.00 0.00 C -ATOM 1743 HE3 TRP 112 -17.362 -0.255 2.723 1.00 0.00 H -ATOM 1744 CD2 TRP 112 -18.753 -0.945 4.138 1.00 0.00 C -ATOM 1745 C TRP 112 -18.996 2.546 3.568 1.00 0.00 C -ATOM 1746 O TRP 112 -18.104 2.877 2.771 1.00 0.00 O -ATOM 1747 N GLU 113 -20.248 2.300 3.105 1.00 0.00 N -ATOM 1748 H GLU 113 -20.955 2.010 3.767 1.00 0.00 H -ATOM 1749 CA GLU 113 -20.583 2.303 1.704 1.00 0.00 C -ATOM 1750 HA GLU 113 -19.761 2.021 1.046 1.00 0.00 H -ATOM 1751 CB GLU 113 -21.678 1.247 1.421 1.00 0.00 C -ATOM 1752 HB2 GLU 113 -21.816 1.196 0.341 1.00 0.00 H -ATOM 1753 HB3 GLU 113 -21.370 0.265 1.779 1.00 0.00 H -ATOM 1754 CG GLU 113 -22.919 1.650 2.273 1.00 0.00 C -ATOM 1755 HG2 GLU 113 -22.692 1.516 3.330 1.00 0.00 H -ATOM 1756 HG3 GLU 113 -23.062 2.723 2.148 1.00 0.00 H -ATOM 1757 CD GLU 113 -24.149 0.809 1.815 1.00 0.00 C -ATOM 1758 OE1 GLU 113 -25.316 1.119 2.151 1.00 0.00 O -ATOM 1759 OE2 GLU 113 -24.005 0.047 0.850 1.00 0.00 O -ATOM 1760 C GLU 113 -21.054 3.688 1.085 1.00 0.00 C -ATOM 1761 O GLU 113 -21.217 3.800 -0.123 1.00 0.00 O -ATOM 1762 N GLU 114 -21.196 4.766 1.974 1.00 0.00 N -ATOM 1763 H GLU 114 -20.852 4.737 2.923 1.00 0.00 H -ATOM 1764 CA GLU 114 -21.789 6.051 1.668 1.00 0.00 C -ATOM 1765 HA GLU 114 -22.248 5.979 0.682 1.00 0.00 H -ATOM 1766 CB GLU 114 -23.022 6.274 2.614 1.00 0.00 C -ATOM 1767 HB2 GLU 114 -23.624 5.394 2.389 1.00 0.00 H -ATOM 1768 HB3 GLU 114 -22.721 6.260 3.662 1.00 0.00 H -ATOM 1769 CG GLU 114 -23.816 7.589 2.418 1.00 0.00 C -ATOM 1770 HG2 GLU 114 -24.664 7.743 3.085 1.00 0.00 H -ATOM 1771 HG3 GLU 114 -23.204 8.419 2.774 1.00 0.00 H -ATOM 1772 CD GLU 114 -24.352 7.836 1.027 1.00 0.00 C -ATOM 1773 OE1 GLU 114 -24.591 6.821 0.349 1.00 0.00 O -ATOM 1774 OE2 GLU 114 -24.507 8.989 0.672 1.00 0.00 O -ATOM 1775 C GLU 114 -20.815 7.284 1.426 1.00 0.00 C -ATOM 1776 O GLU 114 -21.177 8.166 0.648 1.00 0.00 O -ATOM 1777 N ASP 115 -19.623 7.225 2.060 1.00 0.00 N -ATOM 1778 H ASP 115 -19.493 6.517 2.769 1.00 0.00 H -ATOM 1779 CA ASP 115 -18.638 8.274 1.862 1.00 0.00 C -ATOM 1780 HA ASP 115 -19.220 9.192 1.943 1.00 0.00 H -ATOM 1781 CB ASP 115 -17.582 8.309 2.980 1.00 0.00 C -ATOM 1782 HB2 ASP 115 -18.071 8.325 3.955 1.00 0.00 H -ATOM 1783 HB3 ASP 115 -17.026 7.382 2.838 1.00 0.00 H -ATOM 1784 CG ASP 115 -16.532 9.422 2.906 1.00 0.00 C -ATOM 1785 OD1 ASP 115 -16.056 9.792 1.862 1.00 0.00 O -ATOM 1786 OD2 ASP 115 -16.057 9.822 3.966 1.00 0.00 O -ATOM 1787 C ASP 115 -18.093 8.284 0.421 1.00 0.00 C -ATOM 1788 O ASP 115 -17.643 7.269 -0.063 1.00 0.00 O -ATOM 1789 N PRO 116 -17.936 9.446 -0.277 1.00 0.00 N -ATOM 1790 CD PRO 116 -18.620 10.677 0.147 1.00 0.00 C -ATOM 1791 HD2 PRO 116 -18.175 11.030 1.077 1.00 0.00 H -ATOM 1792 HD3 PRO 116 -19.681 10.474 0.287 1.00 0.00 H -ATOM 1793 CG PRO 116 -18.441 11.725 -0.893 1.00 0.00 C -ATOM 1794 HG2 PRO 116 -17.719 12.448 -0.514 1.00 0.00 H -ATOM 1795 HG3 PRO 116 -19.392 12.209 -1.112 1.00 0.00 H -ATOM 1796 CB PRO 116 -17.987 10.931 -2.173 1.00 0.00 C -ATOM 1797 HB2 PRO 116 -17.205 11.383 -2.783 1.00 0.00 H -ATOM 1798 HB3 PRO 116 -18.872 10.690 -2.763 1.00 0.00 H -ATOM 1799 CA PRO 116 -17.440 9.518 -1.619 1.00 0.00 C -ATOM 1800 HA PRO 116 -17.913 8.725 -2.199 1.00 0.00 H -ATOM 1801 C PRO 116 -15.948 9.417 -1.690 1.00 0.00 C -ATOM 1802 O PRO 116 -15.363 8.786 -2.540 1.00 0.00 O -ATOM 1803 N LEU 117 -15.305 10.212 -0.858 1.00 0.00 N -ATOM 1804 H LEU 117 -15.760 10.719 -0.112 1.00 0.00 H -ATOM 1805 CA LEU 117 -13.881 10.520 -1.112 1.00 0.00 C -ATOM 1806 HA LEU 117 -13.552 10.142 -2.080 1.00 0.00 H -ATOM 1807 CB LEU 117 -13.634 12.058 -1.110 1.00 0.00 C -ATOM 1808 HB2 LEU 117 -13.738 12.347 -0.064 1.00 0.00 H -ATOM 1809 HB3 LEU 117 -12.586 12.146 -1.397 1.00 0.00 H -ATOM 1810 CG LEU 117 -14.507 12.942 -2.028 1.00 0.00 C -ATOM 1811 HG LEU 117 -15.492 13.130 -1.599 1.00 0.00 H -ATOM 1812 CD1 LEU 117 -13.883 14.357 -2.126 1.00 0.00 C -ATOM 1813 HD11 LEU 117 -13.687 14.627 -1.089 1.00 0.00 H -ATOM 1814 HD12 LEU 117 -12.947 14.401 -2.683 1.00 0.00 H -ATOM 1815 HD13 LEU 117 -14.562 15.124 -2.500 1.00 0.00 H -ATOM 1816 CD2 LEU 117 -14.714 12.484 -3.514 1.00 0.00 C -ATOM 1817 HD21 LEU 117 -13.874 12.637 -4.192 1.00 0.00 H -ATOM 1818 HD22 LEU 117 -15.096 11.464 -3.479 1.00 0.00 H -ATOM 1819 HD23 LEU 117 -15.486 13.099 -3.976 1.00 0.00 H -ATOM 1820 C LEU 117 -13.004 9.697 -0.142 1.00 0.00 C -ATOM 1821 O LEU 117 -11.745 9.581 -0.371 1.00 0.00 O -ATOM 1822 N ALA 118 -13.581 9.177 1.012 1.00 0.00 N -ATOM 1823 H ALA 118 -14.442 9.513 1.421 1.00 0.00 H -ATOM 1824 CA ALA 118 -12.730 8.241 1.805 1.00 0.00 C -ATOM 1825 HA ALA 118 -11.949 8.807 2.312 1.00 0.00 H -ATOM 1826 CB ALA 118 -13.538 7.721 2.984 1.00 0.00 C -ATOM 1827 HB1 ALA 118 -13.764 8.458 3.755 1.00 0.00 H -ATOM 1828 HB2 ALA 118 -14.482 7.304 2.633 1.00 0.00 H -ATOM 1829 HB3 ALA 118 -13.015 6.889 3.455 1.00 0.00 H -ATOM 1830 C ALA 118 -12.110 7.137 0.900 1.00 0.00 C -ATOM 1831 O ALA 118 -12.756 6.468 0.063 1.00 0.00 O -ATOM 1832 N GLY 119 -10.907 6.790 1.201 1.00 0.00 N -ATOM 1833 H GLY 119 -10.401 7.265 1.935 1.00 0.00 H -ATOM 1834 CA GLY 119 -10.272 5.567 0.619 1.00 0.00 C -ATOM 1835 HA2 GLY 119 -10.588 5.505 -0.422 1.00 0.00 H -ATOM 1836 HA3 GLY 119 -9.190 5.669 0.710 1.00 0.00 H -ATOM 1837 C GLY 119 -10.629 4.194 1.152 1.00 0.00 C -ATOM 1838 O GLY 119 -11.716 3.985 1.680 1.00 0.00 O -ATOM 1839 N ILE 120 -9.627 3.357 1.190 1.00 0.00 N -ATOM 1840 H ILE 120 -8.765 3.580 0.714 1.00 0.00 H -ATOM 1841 CA ILE 120 -9.839 1.947 1.473 1.00 0.00 C -ATOM 1842 HA ILE 120 -10.836 1.587 1.219 1.00 0.00 H -ATOM 1843 CB ILE 120 -8.746 1.042 0.741 1.00 0.00 C -ATOM 1844 HB ILE 120 -7.812 1.592 0.857 1.00 0.00 H -ATOM 1845 CG2 ILE 120 -8.613 -0.357 1.440 1.00 0.00 C -ATOM 1846 HG21 ILE 120 -7.803 -0.791 0.853 1.00 0.00 H -ATOM 1847 HG22 ILE 120 -8.389 -0.159 2.488 1.00 0.00 H -ATOM 1848 HG23 ILE 120 -9.596 -0.827 1.401 1.00 0.00 H -ATOM 1849 CG1 ILE 120 -9.144 1.045 -0.724 1.00 0.00 C -ATOM 1850 HG12 ILE 120 -10.130 0.625 -0.924 1.00 0.00 H -ATOM 1851 HG13 ILE 120 -9.320 2.010 -1.198 1.00 0.00 H -ATOM 1852 CD1 ILE 120 -8.073 0.421 -1.561 1.00 0.00 C -ATOM 1853 HD11 ILE 120 -8.240 -0.653 -1.484 1.00 0.00 H -ATOM 1854 HD12 ILE 120 -8.094 0.711 -2.611 1.00 0.00 H -ATOM 1855 HD13 ILE 120 -7.107 0.627 -1.101 1.00 0.00 H -ATOM 1856 C ILE 120 -9.788 1.774 2.994 1.00 0.00 C -ATOM 1857 O ILE 120 -10.679 1.316 3.645 1.00 0.00 O -ATOM 1858 N ILE 121 -8.713 2.229 3.673 1.00 0.00 N -ATOM 1859 H ILE 121 -7.986 2.755 3.210 1.00 0.00 H -ATOM 1860 CA ILE 121 -8.446 2.072 5.126 1.00 0.00 C -ATOM 1861 HA ILE 121 -8.178 1.048 5.384 1.00 0.00 H -ATOM 1862 CB ILE 121 -7.089 2.835 5.485 1.00 0.00 C -ATOM 1863 HB ILE 121 -7.105 3.887 5.202 1.00 0.00 H -ATOM 1864 CG2 ILE 121 -6.937 2.701 6.995 1.00 0.00 C -ATOM 1865 HG21 ILE 121 -7.652 3.385 7.452 1.00 0.00 H -ATOM 1866 HG22 ILE 121 -7.228 1.700 7.313 1.00 0.00 H -ATOM 1867 HG23 ILE 121 -5.923 2.951 7.305 1.00 0.00 H -ATOM 1868 CG1 ILE 121 -5.869 2.200 4.798 1.00 0.00 C -ATOM 1869 HG12 ILE 121 -5.608 1.250 5.265 1.00 0.00 H -ATOM 1870 HG13 ILE 121 -5.989 2.047 3.725 1.00 0.00 H -ATOM 1871 CD1 ILE 121 -4.594 3.143 4.963 1.00 0.00 C -ATOM 1872 HD11 ILE 121 -4.412 3.500 5.976 1.00 0.00 H -ATOM 1873 HD12 ILE 121 -3.664 2.589 4.832 1.00 0.00 H -ATOM 1874 HD13 ILE 121 -4.624 4.037 4.340 1.00 0.00 H -ATOM 1875 C ILE 121 -9.620 2.375 6.037 1.00 0.00 C -ATOM 1876 O ILE 121 -10.052 1.433 6.716 1.00 0.00 O -ATOM 1877 N PRO 122 -10.218 3.595 6.033 1.00 0.00 N -ATOM 1878 CD PRO 122 -9.909 4.768 5.245 1.00 0.00 C -ATOM 1879 HD2 PRO 122 -10.189 4.731 4.193 1.00 0.00 H -ATOM 1880 HD3 PRO 122 -8.839 4.975 5.277 1.00 0.00 H -ATOM 1881 CG PRO 122 -10.619 6.038 5.881 1.00 0.00 C -ATOM 1882 HG2 PRO 122 -11.053 6.635 5.079 1.00 0.00 H -ATOM 1883 HG3 PRO 122 -9.981 6.571 6.586 1.00 0.00 H -ATOM 1884 CB PRO 122 -11.702 5.351 6.665 1.00 0.00 C -ATOM 1885 HB2 PRO 122 -12.569 5.427 6.010 1.00 0.00 H -ATOM 1886 HB3 PRO 122 -11.985 5.772 7.629 1.00 0.00 H -ATOM 1887 CA PRO 122 -11.241 3.922 6.998 1.00 0.00 C -ATOM 1888 HA PRO 122 -10.816 3.892 8.002 1.00 0.00 H -ATOM 1889 C PRO 122 -12.462 2.990 6.904 1.00 0.00 C -ATOM 1890 O PRO 122 -13.066 2.579 7.932 1.00 0.00 O -ATOM 1891 N ARG 123 -12.763 2.519 5.691 1.00 0.00 N -ATOM 1892 H ARG 123 -12.200 2.807 4.903 1.00 0.00 H -ATOM 1893 CA ARG 123 -13.853 1.582 5.414 1.00 0.00 C -ATOM 1894 HA ARG 123 -14.823 1.888 5.806 1.00 0.00 H -ATOM 1895 CB ARG 123 -14.105 1.508 3.902 1.00 0.00 C -ATOM 1896 HB2 ARG 123 -13.172 1.246 3.403 1.00 0.00 H -ATOM 1897 HB3 ARG 123 -14.851 0.721 3.790 1.00 0.00 H -ATOM 1898 CG ARG 123 -14.708 2.804 3.272 1.00 0.00 C -ATOM 1899 HG2 ARG 123 -15.669 2.928 3.770 1.00 0.00 H -ATOM 1900 HG3 ARG 123 -14.137 3.701 3.508 1.00 0.00 H -ATOM 1901 CD ARG 123 -14.812 2.575 1.787 1.00 0.00 C -ATOM 1902 HD2 ARG 123 -13.928 2.022 1.471 1.00 0.00 H -ATOM 1903 HD3 ARG 123 -15.725 2.062 1.486 1.00 0.00 H -ATOM 1904 NE ARG 123 -14.762 3.798 0.976 1.00 0.00 N -ATOM 1905 HE ARG 123 -13.843 4.157 0.758 1.00 0.00 H -ATOM 1906 CZ ARG 123 -15.721 4.534 0.491 1.00 0.00 C -ATOM 1907 NH1 ARG 123 -17.002 4.417 0.763 1.00 0.00 N -ATOM 1908 HH11 ARG 123 -17.282 3.831 1.537 1.00 0.00 H -ATOM 1909 HH12 ARG 123 -17.646 4.998 0.246 1.00 0.00 H -ATOM 1910 NH2 ARG 123 -15.348 5.538 -0.273 1.00 0.00 N -ATOM 1911 HH21 ARG 123 -14.378 5.807 -0.184 1.00 0.00 H -ATOM 1912 HH22 ARG 123 -16.069 6.179 -0.572 1.00 0.00 H -ATOM 1913 C ARG 123 -13.497 0.218 5.986 1.00 0.00 C -ATOM 1914 O ARG 123 -14.378 -0.327 6.617 1.00 0.00 O -ATOM 1915 N THR 124 -12.318 -0.265 5.749 1.00 0.00 N -ATOM 1916 H THR 124 -11.667 0.325 5.250 1.00 0.00 H -ATOM 1917 CA THR 124 -11.843 -1.561 6.314 1.00 0.00 C -ATOM 1918 HA THR 124 -12.535 -2.282 5.877 1.00 0.00 H -ATOM 1919 CB THR 124 -10.384 -1.950 5.997 1.00 0.00 C -ATOM 1920 HB THR 124 -9.634 -1.365 6.531 1.00 0.00 H -ATOM 1921 CG2 THR 124 -10.014 -3.421 6.138 1.00 0.00 C -ATOM 1922 HG21 THR 124 -10.259 -3.969 7.048 1.00 0.00 H -ATOM 1923 HG22 THR 124 -10.544 -3.998 5.380 1.00 0.00 H -ATOM 1924 HG23 THR 124 -8.958 -3.524 5.890 1.00 0.00 H -ATOM 1925 OG1 THR 124 -10.286 -1.726 4.634 1.00 0.00 O -ATOM 1926 HG1 THR 124 -10.248 -0.768 4.595 1.00 0.00 H -ATOM 1927 C THR 124 -11.958 -1.550 7.837 1.00 0.00 C -ATOM 1928 O THR 124 -12.642 -2.440 8.374 1.00 0.00 O -ATOM 1929 N LEU 125 -11.367 -0.595 8.514 1.00 0.00 N -ATOM 1930 H LEU 125 -10.764 0.059 8.035 1.00 0.00 H -ATOM 1931 CA LEU 125 -11.474 -0.457 9.955 1.00 0.00 C -ATOM 1932 HA LEU 125 -10.947 -1.265 10.461 1.00 0.00 H -ATOM 1933 CB LEU 125 -10.719 0.909 10.280 1.00 0.00 C -ATOM 1934 HB2 LEU 125 -9.813 0.927 9.673 1.00 0.00 H -ATOM 1935 HB3 LEU 125 -11.356 1.694 9.874 1.00 0.00 H -ATOM 1936 CG LEU 125 -10.588 1.396 11.723 1.00 0.00 C -ATOM 1937 HG LEU 125 -11.600 1.610 12.065 1.00 0.00 H -ATOM 1938 CD1 LEU 125 -9.876 0.338 12.563 1.00 0.00 C -ATOM 1939 HD11 LEU 125 -10.531 -0.524 12.433 1.00 0.00 H -ATOM 1940 HD12 LEU 125 -8.892 0.013 12.226 1.00 0.00 H -ATOM 1941 HD13 LEU 125 -9.907 0.636 13.611 1.00 0.00 H -ATOM 1942 CD2 LEU 125 -9.693 2.596 11.750 1.00 0.00 C -ATOM 1943 HD21 LEU 125 -10.016 3.414 11.107 1.00 0.00 H -ATOM 1944 HD22 LEU 125 -9.767 3.055 12.736 1.00 0.00 H -ATOM 1945 HD23 LEU 125 -8.680 2.342 11.439 1.00 0.00 H -ATOM 1946 C LEU 125 -12.877 -0.415 10.420 1.00 0.00 C -ATOM 1947 O LEU 125 -13.125 -0.781 11.561 1.00 0.00 O -ATOM 1948 N HIE 126 -13.852 0.071 9.618 1.00 0.00 N -ATOM 1949 H HIE 126 -13.633 0.501 8.731 1.00 0.00 H -ATOM 1950 CA HIE 126 -15.222 0.089 10.029 1.00 0.00 C -ATOM 1951 HA HIE 126 -15.420 0.356 11.067 1.00 0.00 H -ATOM 1952 CB HIE 126 -15.922 1.229 9.322 1.00 0.00 C -ATOM 1953 HB2 HIE 126 -15.287 2.114 9.363 1.00 0.00 H -ATOM 1954 HB3 HIE 126 -15.866 0.960 8.267 1.00 0.00 H -ATOM 1955 CG HIE 126 -17.470 1.495 9.575 1.00 0.00 C -ATOM 1956 ND1 HIE 126 -18.343 2.228 8.768 1.00 0.00 N -ATOM 1957 CE1 HIE 126 -19.553 2.138 9.314 1.00 0.00 C -ATOM 1958 HE1 HIE 126 -20.518 2.446 8.939 1.00 0.00 H -ATOM 1959 NE2 HIE 126 -19.474 1.356 10.369 1.00 0.00 N -ATOM 1960 HE2 HIE 126 -20.241 0.828 10.760 1.00 0.00 H -ATOM 1961 CD2 HIE 126 -18.163 0.964 10.580 1.00 0.00 C -ATOM 1962 HD2 HIE 126 -17.903 0.268 11.364 1.00 0.00 H -ATOM 1963 C HIE 126 -15.844 -1.294 9.730 1.00 0.00 C -ATOM 1964 O HIE 126 -16.442 -1.921 10.553 1.00 0.00 O -ATOM 1965 N GLN 127 -15.746 -1.771 8.486 1.00 0.00 N -ATOM 1966 H GLN 127 -15.299 -1.269 7.732 1.00 0.00 H -ATOM 1967 CA GLN 127 -16.410 -2.994 8.090 1.00 0.00 C -ATOM 1968 HA GLN 127 -17.465 -2.909 8.350 1.00 0.00 H -ATOM 1969 CB GLN 127 -16.304 -3.162 6.500 1.00 0.00 C -ATOM 1970 HB2 GLN 127 -16.783 -2.259 6.121 1.00 0.00 H -ATOM 1971 HB3 GLN 127 -15.265 -3.199 6.172 1.00 0.00 H -ATOM 1972 CG GLN 127 -17.088 -4.412 5.989 1.00 0.00 C -ATOM 1973 HG2 GLN 127 -16.667 -5.340 6.375 1.00 0.00 H -ATOM 1974 HG3 GLN 127 -18.129 -4.247 6.268 1.00 0.00 H -ATOM 1975 CD GLN 127 -16.997 -4.631 4.468 1.00 0.00 C -ATOM 1976 OE1 GLN 127 -16.061 -4.240 3.784 1.00 0.00 O -ATOM 1977 NE2 GLN 127 -17.809 -5.543 3.963 1.00 0.00 N -ATOM 1978 HE21 GLN 127 -17.684 -5.837 3.005 1.00 0.00 H -ATOM 1979 HE22 GLN 127 -18.613 -5.901 4.459 1.00 0.00 H -ATOM 1980 C GLN 127 -15.951 -4.241 8.830 1.00 0.00 C -ATOM 1981 O GLN 127 -16.723 -5.202 8.812 1.00 0.00 O -ATOM 1982 N ILE 128 -14.787 -4.230 9.505 1.00 0.00 N -ATOM 1983 H ILE 128 -14.192 -3.448 9.270 1.00 0.00 H -ATOM 1984 CA ILE 128 -14.355 -5.364 10.279 1.00 0.00 C -ATOM 1985 HA ILE 128 -14.308 -6.205 9.588 1.00 0.00 H -ATOM 1986 CB ILE 128 -13.007 -5.056 10.880 1.00 0.00 C -ATOM 1987 HB ILE 128 -12.947 -4.005 11.162 1.00 0.00 H -ATOM 1988 CG2 ILE 128 -12.625 -5.875 12.089 1.00 0.00 C -ATOM 1989 HG21 ILE 128 -12.831 -6.936 11.953 1.00 0.00 H -ATOM 1990 HG22 ILE 128 -11.558 -5.882 12.313 1.00 0.00 H -ATOM 1991 HG23 ILE 128 -13.159 -5.442 12.934 1.00 0.00 H -ATOM 1992 CG1 ILE 128 -11.941 -5.393 9.790 1.00 0.00 C -ATOM 1993 HG12 ILE 128 -11.761 -6.459 9.653 1.00 0.00 H -ATOM 1994 HG13 ILE 128 -12.373 -5.023 8.859 1.00 0.00 H -ATOM 1995 CD1 ILE 128 -10.606 -4.738 10.011 1.00 0.00 C -ATOM 1996 HD11 ILE 128 -10.648 -3.763 10.497 1.00 0.00 H -ATOM 1997 HD12 ILE 128 -9.931 -5.324 10.635 1.00 0.00 H -ATOM 1998 HD13 ILE 128 -10.099 -4.694 9.047 1.00 0.00 H -ATOM 1999 C ILE 128 -15.403 -5.653 11.388 1.00 0.00 C -ATOM 2000 O ILE 128 -15.987 -6.740 11.442 1.00 0.00 O -ATOM 2001 N PHE 129 -15.663 -4.601 12.183 1.00 0.00 N -ATOM 2002 H PHE 129 -15.132 -3.750 12.069 1.00 0.00 H -ATOM 2003 CA PHE 129 -16.733 -4.652 13.154 1.00 0.00 C -ATOM 2004 HA PHE 129 -16.555 -5.399 13.928 1.00 0.00 H -ATOM 2005 CB PHE 129 -16.744 -3.293 13.821 1.00 0.00 C -ATOM 2006 HB2 PHE 129 -16.763 -2.485 13.089 1.00 0.00 H -ATOM 2007 HB3 PHE 129 -17.609 -3.164 14.471 1.00 0.00 H -ATOM 2008 CG PHE 129 -15.516 -2.973 14.650 1.00 0.00 C -ATOM 2009 CD1 PHE 129 -14.468 -2.181 14.124 1.00 0.00 C -ATOM 2010 HD1 PHE 129 -14.608 -1.783 13.129 1.00 0.00 H -ATOM 2011 CE1 PHE 129 -13.301 -1.938 14.918 1.00 0.00 C -ATOM 2012 HE1 PHE 129 -12.478 -1.347 14.544 1.00 0.00 H -ATOM 2013 CZ PHE 129 -13.305 -2.481 16.218 1.00 0.00 C -ATOM 2014 HZ PHE 129 -12.451 -2.229 16.829 1.00 0.00 H -ATOM 2015 CE2 PHE 129 -14.354 -3.254 16.701 1.00 0.00 C -ATOM 2016 HE2 PHE 129 -14.251 -3.612 17.714 1.00 0.00 H -ATOM 2017 CD2 PHE 129 -15.441 -3.537 15.897 1.00 0.00 C -ATOM 2018 HD2 PHE 129 -16.286 -4.100 16.266 1.00 0.00 H -ATOM 2019 C PHE 129 -18.157 -4.914 12.706 1.00 0.00 C -ATOM 2020 O PHE 129 -18.908 -5.601 13.382 1.00 0.00 O -ATOM 2021 N GLU 130 -18.408 -4.519 11.451 1.00 0.00 N -ATOM 2022 H GLU 130 -17.701 -3.930 11.033 1.00 0.00 H -ATOM 2023 CA GLU 130 -19.657 -4.840 10.782 1.00 0.00 C -ATOM 2024 HA GLU 130 -20.400 -4.510 11.509 1.00 0.00 H -ATOM 2025 CB GLU 130 -19.879 -3.942 9.558 1.00 0.00 C -ATOM 2026 HB2 GLU 130 -19.123 -4.035 8.778 1.00 0.00 H -ATOM 2027 HB3 GLU 130 -20.758 -4.277 9.007 1.00 0.00 H -ATOM 2028 CG GLU 130 -19.968 -2.405 9.923 1.00 0.00 C -ATOM 2029 HG2 GLU 130 -19.056 -2.166 10.469 1.00 0.00 H -ATOM 2030 HG3 GLU 130 -20.069 -1.794 9.027 1.00 0.00 H -ATOM 2031 CD GLU 130 -21.296 -2.064 10.718 1.00 0.00 C -ATOM 2032 OE1 GLU 130 -21.576 -0.853 10.843 1.00 0.00 O -ATOM 2033 OE2 GLU 130 -22.097 -2.961 11.123 1.00 0.00 O -ATOM 2034 C GLU 130 -19.842 -6.356 10.305 1.00 0.00 C -ATOM 2035 O GLU 130 -20.865 -6.965 10.487 1.00 0.00 O -ATOM 2036 N LYS 131 -18.721 -6.940 9.766 1.00 0.00 N -ATOM 2037 H LYS 131 -17.902 -6.352 9.706 1.00 0.00 H -ATOM 2038 CA LYS 131 -18.610 -8.257 9.239 1.00 0.00 C -ATOM 2039 HA LYS 131 -19.415 -8.489 8.543 1.00 0.00 H -ATOM 2040 CB LYS 131 -17.381 -8.272 8.407 1.00 0.00 C -ATOM 2041 HB2 LYS 131 -17.318 -7.381 7.782 1.00 0.00 H -ATOM 2042 HB3 LYS 131 -16.567 -8.234 9.130 1.00 0.00 H -ATOM 2043 CG LYS 131 -17.281 -9.440 7.386 1.00 0.00 C -ATOM 2044 HG2 LYS 131 -17.091 -10.402 7.862 1.00 0.00 H -ATOM 2045 HG3 LYS 131 -18.182 -9.648 6.808 1.00 0.00 H -ATOM 2046 CD LYS 131 -16.324 -9.111 6.261 1.00 0.00 C -ATOM 2047 HD2 LYS 131 -16.840 -8.502 5.518 1.00 0.00 H -ATOM 2048 HD3 LYS 131 -15.417 -8.575 6.537 1.00 0.00 H -ATOM 2049 CE LYS 131 -15.755 -10.317 5.447 1.00 0.00 C -ATOM 2050 HE2 LYS 131 -14.988 -9.969 4.755 1.00 0.00 H -ATOM 2051 HE3 LYS 131 -15.206 -11.010 6.085 1.00 0.00 H -ATOM 2052 NZ LYS 131 -16.768 -11.021 4.581 1.00 0.00 N -ATOM 2053 HZ1 LYS 131 -17.298 -11.708 5.097 1.00 0.00 H -ATOM 2054 HZ2 LYS 131 -17.434 -10.421 4.114 1.00 0.00 H -ATOM 2055 HZ3 LYS 131 -16.272 -11.437 3.806 1.00 0.00 H -ATOM 2056 C LYS 131 -18.582 -9.316 10.402 1.00 0.00 C -ATOM 2057 O LYS 131 -18.984 -10.484 10.239 1.00 0.00 O -ATOM 2058 N LEU 132 -18.112 -8.919 11.601 1.00 0.00 N -ATOM 2059 H LEU 132 -17.733 -7.983 11.632 1.00 0.00 H -ATOM 2060 CA LEU 132 -18.035 -9.687 12.878 1.00 0.00 C -ATOM 2061 HA LEU 132 -17.971 -10.765 12.733 1.00 0.00 H -ATOM 2062 CB LEU 132 -16.929 -9.136 13.808 1.00 0.00 C -ATOM 2063 HB2 LEU 132 -17.048 -8.067 13.986 1.00 0.00 H -ATOM 2064 HB3 LEU 132 -17.074 -9.643 14.761 1.00 0.00 H -ATOM 2065 CG LEU 132 -15.571 -9.495 13.173 1.00 0.00 C -ATOM 2066 HG LEU 132 -15.519 -9.104 12.157 1.00 0.00 H -ATOM 2067 CD1 LEU 132 -14.549 -8.669 13.896 1.00 0.00 C -ATOM 2068 HD11 LEU 132 -14.571 -9.007 14.932 1.00 0.00 H -ATOM 2069 HD12 LEU 132 -13.609 -8.836 13.370 1.00 0.00 H -ATOM 2070 HD13 LEU 132 -14.764 -7.605 13.799 1.00 0.00 H -ATOM 2071 CD2 LEU 132 -15.297 -10.995 13.253 1.00 0.00 C -ATOM 2072 HD21 LEU 132 -15.638 -11.470 14.173 1.00 0.00 H -ATOM 2073 HD22 LEU 132 -15.750 -11.524 12.414 1.00 0.00 H -ATOM 2074 HD23 LEU 132 -14.242 -11.268 13.254 1.00 0.00 H -ATOM 2075 C LEU 132 -19.353 -9.624 13.672 1.00 0.00 C -ATOM 2076 O LEU 132 -19.813 -10.689 14.186 1.00 0.00 O -ATOM 2077 N THR 133 -19.983 -8.422 13.752 1.00 0.00 N -ATOM 2078 H THR 133 -19.561 -7.681 13.209 1.00 0.00 H -ATOM 2079 CA THR 133 -21.208 -8.204 14.543 1.00 0.00 C -ATOM 2080 HA THR 133 -21.001 -8.644 15.519 1.00 0.00 H -ATOM 2081 CB THR 133 -21.552 -6.667 14.714 1.00 0.00 C -ATOM 2082 HB THR 133 -21.632 -6.210 13.727 1.00 0.00 H -ATOM 2083 CG2 THR 133 -22.886 -6.426 15.410 1.00 0.00 C -ATOM 2084 HG21 THR 133 -22.987 -5.341 15.392 1.00 0.00 H -ATOM 2085 HG22 THR 133 -23.701 -6.978 14.942 1.00 0.00 H -ATOM 2086 HG23 THR 133 -22.635 -6.765 16.415 1.00 0.00 H -ATOM 2087 OG1 THR 133 -20.423 -6.159 15.443 1.00 0.00 O -ATOM 2088 HG1 THR 133 -19.823 -5.762 14.807 1.00 0.00 H -ATOM 2089 C THR 133 -22.353 -8.918 13.792 1.00 0.00 C -ATOM 2090 O THR 133 -23.266 -9.375 14.489 1.00 0.00 O -ATOM 2091 N ASP 134 -22.284 -9.106 12.512 1.00 0.00 N -ATOM 2092 H ASP 134 -21.658 -8.548 11.949 1.00 0.00 H -ATOM 2093 CA ASP 134 -23.217 -10.009 11.796 1.00 0.00 C -ATOM 2094 HA ASP 134 -24.250 -9.854 12.108 1.00 0.00 H -ATOM 2095 CB ASP 134 -22.983 -9.728 10.288 1.00 0.00 C -ATOM 2096 HB2 ASP 134 -23.289 -8.689 10.168 1.00 0.00 H -ATOM 2097 HB3 ASP 134 -21.981 -9.926 9.906 1.00 0.00 H -ATOM 2098 CG ASP 134 -23.976 -10.504 9.454 1.00 0.00 C -ATOM 2099 OD1 ASP 134 -23.501 -11.064 8.442 1.00 0.00 O -ATOM 2100 OD2 ASP 134 -25.178 -10.267 9.640 1.00 0.00 O -ATOM 2101 C ASP 134 -22.952 -11.509 12.070 1.00 0.00 C -ATOM 2102 O ASP 134 -23.999 -12.202 12.225 1.00 0.00 O -ATOM 2103 N ASN 135 -21.739 -12.058 12.419 1.00 0.00 N -ATOM 2104 H ASN 135 -20.909 -11.504 12.265 1.00 0.00 H -ATOM 2105 CA ASN 135 -21.473 -13.424 12.780 1.00 0.00 C -ATOM 2106 HA ASN 135 -22.189 -13.969 12.164 1.00 0.00 H -ATOM 2107 CB ASN 135 -20.107 -13.925 12.200 1.00 0.00 C -ATOM 2108 HB2 ASN 135 -20.105 -13.789 11.119 1.00 0.00 H -ATOM 2109 HB3 ASN 135 -19.339 -13.280 12.628 1.00 0.00 H -ATOM 2110 CG ASN 135 -19.698 -15.302 12.603 1.00 0.00 C -ATOM 2111 OD1 ASN 135 -19.308 -15.557 13.690 1.00 0.00 O -ATOM 2112 ND2 ASN 135 -19.859 -16.297 11.745 1.00 0.00 N -ATOM 2113 HD21 ASN 135 -19.508 -17.190 12.061 1.00 0.00 H -ATOM 2114 HD22 ASN 135 -20.264 -16.096 10.842 1.00 0.00 H -ATOM 2115 C ASN 135 -21.730 -13.816 14.272 1.00 0.00 C -ATOM 2116 O ASN 135 -22.127 -14.944 14.534 1.00 0.00 O -ATOM 2117 N GLY 136 -21.480 -12.906 15.204 1.00 0.00 N -ATOM 2118 H GLY 136 -21.190 -11.979 14.925 1.00 0.00 H -ATOM 2119 CA GLY 136 -21.770 -13.041 16.649 1.00 0.00 C -ATOM 2120 HA2 GLY 136 -21.830 -12.057 17.115 1.00 0.00 H -ATOM 2121 HA3 GLY 136 -22.724 -13.568 16.669 1.00 0.00 H -ATOM 2122 C GLY 136 -20.658 -13.849 17.270 1.00 0.00 C -ATOM 2123 O GLY 136 -20.809 -14.284 18.421 1.00 0.00 O -ATOM 2124 N THR 137 -19.473 -14.051 16.673 1.00 0.00 N -ATOM 2125 H THR 137 -19.363 -13.715 15.727 1.00 0.00 H -ATOM 2126 CA THR 137 -18.224 -14.559 17.301 1.00 0.00 C -ATOM 2127 HA THR 137 -18.398 -15.524 17.777 1.00 0.00 H -ATOM 2128 CB THR 137 -17.172 -14.883 16.276 1.00 0.00 C -ATOM 2129 HB THR 137 -17.469 -15.614 15.525 1.00 0.00 H -ATOM 2130 CG2 THR 137 -16.661 -13.670 15.505 1.00 0.00 C -ATOM 2131 HG21 THR 137 -17.403 -12.981 15.101 1.00 0.00 H -ATOM 2132 HG22 THR 137 -16.120 -13.029 16.200 1.00 0.00 H -ATOM 2133 HG23 THR 137 -15.936 -14.059 14.789 1.00 0.00 H -ATOM 2134 OG1 THR 137 -15.965 -15.417 16.835 1.00 0.00 O -ATOM 2135 HG1 THR 137 -16.111 -16.205 17.364 1.00 0.00 H -ATOM 2136 C THR 137 -17.826 -13.568 18.425 1.00 0.00 C -ATOM 2137 O THR 137 -18.160 -12.360 18.328 1.00 0.00 O -ATOM 2138 N GLU 138 -17.124 -13.977 19.474 1.00 0.00 N -ATOM 2139 H GLU 138 -16.935 -14.968 19.505 1.00 0.00 H -ATOM 2140 CA GLU 138 -16.274 -13.131 20.257 1.00 0.00 C -ATOM 2141 HA GLU 138 -16.802 -12.179 20.293 1.00 0.00 H -ATOM 2142 CB GLU 138 -16.174 -13.699 21.690 1.00 0.00 C -ATOM 2143 HB2 GLU 138 -17.163 -13.882 22.111 1.00 0.00 H -ATOM 2144 HB3 GLU 138 -15.764 -14.708 21.634 1.00 0.00 H -ATOM 2145 CG GLU 138 -15.316 -12.914 22.640 1.00 0.00 C -ATOM 2146 HG2 GLU 138 -15.532 -13.363 23.609 1.00 0.00 H -ATOM 2147 HG3 GLU 138 -14.261 -13.126 22.469 1.00 0.00 H -ATOM 2148 CD GLU 138 -15.477 -11.391 22.731 1.00 0.00 C -ATOM 2149 OE1 GLU 138 -15.970 -10.631 21.838 1.00 0.00 O -ATOM 2150 OE2 GLU 138 -15.126 -10.790 23.760 1.00 0.00 O -ATOM 2151 C GLU 138 -14.896 -12.860 19.604 1.00 0.00 C -ATOM 2152 O GLU 138 -14.196 -13.764 19.072 1.00 0.00 O -ATOM 2153 N PHE 139 -14.423 -11.638 19.704 1.00 0.00 N -ATOM 2154 H PHE 139 -15.014 -11.059 20.283 1.00 0.00 H -ATOM 2155 CA PHE 139 -13.271 -11.101 18.849 1.00 0.00 C -ATOM 2156 HA PHE 139 -12.586 -11.922 18.641 1.00 0.00 H -ATOM 2157 CB PHE 139 -13.867 -10.651 17.485 1.00 0.00 C -ATOM 2158 HB2 PHE 139 -13.044 -10.526 16.781 1.00 0.00 H -ATOM 2159 HB3 PHE 139 -14.366 -11.501 17.021 1.00 0.00 H -ATOM 2160 CG PHE 139 -14.728 -9.472 17.482 1.00 0.00 C -ATOM 2161 CD1 PHE 139 -16.146 -9.603 17.392 1.00 0.00 C -ATOM 2162 HD1 PHE 139 -16.611 -10.574 17.308 1.00 0.00 H -ATOM 2163 CE1 PHE 139 -16.942 -8.488 17.430 1.00 0.00 C -ATOM 2164 HE1 PHE 139 -17.990 -8.737 17.339 1.00 0.00 H -ATOM 2165 CZ PHE 139 -16.433 -7.206 17.371 1.00 0.00 C -ATOM 2166 HZ PHE 139 -17.095 -6.371 17.193 1.00 0.00 H -ATOM 2167 CE2 PHE 139 -15.070 -7.020 17.559 1.00 0.00 C -ATOM 2168 HE2 PHE 139 -14.719 -6.011 17.404 1.00 0.00 H -ATOM 2169 CD2 PHE 139 -14.219 -8.137 17.685 1.00 0.00 C -ATOM 2170 HD2 PHE 139 -13.141 -8.104 17.745 1.00 0.00 H -ATOM 2171 C PHE 139 -12.446 -10.020 19.547 1.00 0.00 C -ATOM 2172 O PHE 139 -12.894 -9.342 20.461 1.00 0.00 O -ATOM 2173 N SER 140 -11.288 -9.727 19.001 1.00 0.00 N -ATOM 2174 H SER 140 -10.923 -10.471 18.424 1.00 0.00 H -ATOM 2175 CA SER 140 -10.469 -8.596 19.517 1.00 0.00 C -ATOM 2176 HA SER 140 -11.173 -7.828 19.836 1.00 0.00 H -ATOM 2177 CB SER 140 -9.670 -8.934 20.727 1.00 0.00 C -ATOM 2178 HB2 SER 140 -10.229 -9.124 21.644 1.00 0.00 H -ATOM 2179 HB3 SER 140 -9.142 -9.863 20.513 1.00 0.00 H -ATOM 2180 OG SER 140 -8.715 -7.917 20.955 1.00 0.00 O -ATOM 2181 HG SER 140 -9.238 -7.199 21.319 1.00 0.00 H -ATOM 2182 C SER 140 -9.606 -7.994 18.432 1.00 0.00 C -ATOM 2183 O SER 140 -8.783 -8.672 17.780 1.00 0.00 O -ATOM 2184 N VAL 141 -9.783 -6.742 18.166 1.00 0.00 N -ATOM 2185 H VAL 141 -10.433 -6.199 18.717 1.00 0.00 H -ATOM 2186 CA VAL 141 -9.140 -6.019 17.030 1.00 0.00 C -ATOM 2187 HA VAL 141 -8.749 -6.771 16.345 1.00 0.00 H -ATOM 2188 CB VAL 141 -9.993 -5.105 16.168 1.00 0.00 C -ATOM 2189 HB VAL 141 -10.678 -4.424 16.673 1.00 0.00 H -ATOM 2190 CG1 VAL 141 -9.255 -4.327 15.065 1.00 0.00 C -ATOM 2191 HG11 VAL 141 -8.707 -3.454 15.418 1.00 0.00 H -ATOM 2192 HG12 VAL 141 -8.618 -4.962 14.449 1.00 0.00 H -ATOM 2193 HG13 VAL 141 -9.990 -3.920 14.370 1.00 0.00 H -ATOM 2194 CG2 VAL 141 -10.987 -5.984 15.421 1.00 0.00 C -ATOM 2195 HG21 VAL 141 -11.792 -5.346 15.056 1.00 0.00 H -ATOM 2196 HG22 VAL 141 -10.542 -6.604 14.643 1.00 0.00 H -ATOM 2197 HG23 VAL 141 -11.396 -6.710 16.124 1.00 0.00 H -ATOM 2198 C VAL 141 -7.940 -5.181 17.519 1.00 0.00 C -ATOM 2199 O VAL 141 -8.057 -4.404 18.453 1.00 0.00 O -ATOM 2200 N LYS 142 -6.743 -5.457 16.885 1.00 0.00 N -ATOM 2201 H LYS 142 -6.795 -6.081 16.092 1.00 0.00 H -ATOM 2202 CA LYS 142 -5.522 -4.633 17.201 1.00 0.00 C -ATOM 2203 HA LYS 142 -5.773 -3.861 17.928 1.00 0.00 H -ATOM 2204 CB LYS 142 -4.334 -5.486 17.739 1.00 0.00 C -ATOM 2205 HB2 LYS 142 -4.451 -6.448 17.241 1.00 0.00 H -ATOM 2206 HB3 LYS 142 -3.358 -5.090 17.460 1.00 0.00 H -ATOM 2207 CG LYS 142 -4.317 -5.621 19.259 1.00 0.00 C -ATOM 2208 HG2 LYS 142 -3.309 -5.965 19.490 1.00 0.00 H -ATOM 2209 HG3 LYS 142 -4.390 -4.681 19.806 1.00 0.00 H -ATOM 2210 CD LYS 142 -5.375 -6.542 19.915 1.00 0.00 C -ATOM 2211 HD2 LYS 142 -5.546 -6.359 20.975 1.00 0.00 H -ATOM 2212 HD3 LYS 142 -6.366 -6.393 19.485 1.00 0.00 H -ATOM 2213 CE LYS 142 -4.994 -8.031 19.754 1.00 0.00 C -ATOM 2214 HE2 LYS 142 -4.580 -8.280 18.777 1.00 0.00 H -ATOM 2215 HE3 LYS 142 -4.282 -8.241 20.551 1.00 0.00 H -ATOM 2216 NZ LYS 142 -6.201 -8.928 19.947 1.00 0.00 N -ATOM 2217 HZ1 LYS 142 -6.672 -8.623 20.786 1.00 0.00 H -ATOM 2218 HZ2 LYS 142 -6.793 -8.886 19.130 1.00 0.00 H -ATOM 2219 HZ3 LYS 142 -5.861 -9.866 20.108 1.00 0.00 H -ATOM 2220 C LYS 142 -5.050 -3.811 15.969 1.00 0.00 C -ATOM 2221 O LYS 142 -5.328 -4.241 14.826 1.00 0.00 O -ATOM 2222 N VAL 143 -4.353 -2.702 16.147 1.00 0.00 N -ATOM 2223 H VAL 143 -4.252 -2.333 17.081 1.00 0.00 H -ATOM 2224 CA VAL 143 -3.983 -1.792 15.054 1.00 0.00 C -ATOM 2225 HA VAL 143 -4.009 -2.399 14.149 1.00 0.00 H -ATOM 2226 CB VAL 143 -5.038 -0.731 14.841 1.00 0.00 C -ATOM 2227 HB VAL 143 -5.955 -1.301 14.695 1.00 0.00 H -ATOM 2228 CG1 VAL 143 -5.176 0.288 15.984 1.00 0.00 C -ATOM 2229 HG11 VAL 143 -5.894 1.051 15.684 1.00 0.00 H -ATOM 2230 HG12 VAL 143 -5.488 -0.189 16.914 1.00 0.00 H -ATOM 2231 HG13 VAL 143 -4.220 0.741 16.246 1.00 0.00 H -ATOM 2232 CG2 VAL 143 -4.978 0.070 13.596 1.00 0.00 C -ATOM 2233 HG21 VAL 143 -5.946 0.560 13.489 1.00 0.00 H -ATOM 2234 HG22 VAL 143 -4.184 0.815 13.642 1.00 0.00 H -ATOM 2235 HG23 VAL 143 -4.736 -0.654 12.818 1.00 0.00 H -ATOM 2236 C VAL 143 -2.586 -1.124 15.163 1.00 0.00 C -ATOM 2237 O VAL 143 -2.113 -0.739 16.301 1.00 0.00 O -ATOM 2238 N SER 144 -1.891 -0.989 14.025 1.00 0.00 N -ATOM 2239 H SER 144 -2.270 -1.413 13.190 1.00 0.00 H -ATOM 2240 CA SER 144 -0.502 -0.453 13.955 1.00 0.00 C -ATOM 2241 HA SER 144 -0.271 -0.064 14.947 1.00 0.00 H -ATOM 2242 CB SER 144 0.525 -1.573 13.628 1.00 0.00 C -ATOM 2243 HB2 SER 144 0.435 -2.453 14.265 1.00 0.00 H -ATOM 2244 HB3 SER 144 0.448 -1.845 12.575 1.00 0.00 H -ATOM 2245 OG SER 144 1.844 -1.190 13.642 1.00 0.00 O -ATOM 2246 HG SER 144 2.374 -1.877 14.054 1.00 0.00 H -ATOM 2247 C SER 144 -0.417 0.595 12.805 1.00 0.00 C -ATOM 2248 O SER 144 -1.185 0.526 11.867 1.00 0.00 O -ATOM 2249 N LEU 145 0.506 1.547 12.926 1.00 0.00 N -ATOM 2250 H LEU 145 1.048 1.493 13.777 1.00 0.00 H -ATOM 2251 CA LEU 145 0.594 2.669 12.035 1.00 0.00 C -ATOM 2252 HA LEU 145 0.373 2.286 11.038 1.00 0.00 H -ATOM 2253 CB LEU 145 -0.541 3.605 12.523 1.00 0.00 C -ATOM 2254 HB2 LEU 145 -1.519 3.142 12.389 1.00 0.00 H -ATOM 2255 HB3 LEU 145 -0.400 3.767 13.592 1.00 0.00 H -ATOM 2256 CG LEU 145 -0.602 4.990 11.778 1.00 0.00 C -ATOM 2257 HG LEU 145 0.332 5.527 11.945 1.00 0.00 H -ATOM 2258 CD1 LEU 145 -0.866 4.915 10.256 1.00 0.00 C -ATOM 2259 HD11 LEU 145 -0.040 4.556 9.642 1.00 0.00 H -ATOM 2260 HD12 LEU 145 -1.786 4.425 9.939 1.00 0.00 H -ATOM 2261 HD13 LEU 145 -0.966 5.979 10.037 1.00 0.00 H -ATOM 2262 CD2 LEU 145 -1.719 5.813 12.411 1.00 0.00 C -ATOM 2263 HD21 LEU 145 -2.655 5.253 12.436 1.00 0.00 H -ATOM 2264 HD22 LEU 145 -1.424 6.005 13.442 1.00 0.00 H -ATOM 2265 HD23 LEU 145 -2.025 6.747 11.940 1.00 0.00 H -ATOM 2266 C LEU 145 2.020 3.266 11.923 1.00 0.00 C -ATOM 2267 O LEU 145 2.497 3.584 13.005 1.00 0.00 O -ATOM 2268 N LEU 146 2.670 3.470 10.742 1.00 0.00 N -ATOM 2269 H LEU 146 2.149 3.251 9.905 1.00 0.00 H -ATOM 2270 CA LEU 146 4.128 3.615 10.554 1.00 0.00 C -ATOM 2271 HA LEU 146 4.563 4.112 11.421 1.00 0.00 H -ATOM 2272 CB LEU 146 4.626 2.169 10.402 1.00 0.00 C -ATOM 2273 HB2 LEU 146 4.414 1.599 11.306 1.00 0.00 H -ATOM 2274 HB3 LEU 146 3.985 1.760 9.621 1.00 0.00 H -ATOM 2275 CG LEU 146 6.107 1.838 10.075 1.00 0.00 C -ATOM 2276 HG LEU 146 6.393 2.136 9.066 1.00 0.00 H -ATOM 2277 CD1 LEU 146 7.063 2.371 11.095 1.00 0.00 C -ATOM 2278 HD11 LEU 146 8.114 2.184 10.879 1.00 0.00 H -ATOM 2279 HD12 LEU 146 7.005 3.460 11.082 1.00 0.00 H -ATOM 2280 HD13 LEU 146 6.954 2.021 12.122 1.00 0.00 H -ATOM 2281 CD2 LEU 146 6.313 0.342 10.247 1.00 0.00 C -ATOM 2282 HD21 LEU 146 7.375 0.097 10.283 1.00 0.00 H -ATOM 2283 HD22 LEU 146 5.822 0.053 11.175 1.00 0.00 H -ATOM 2284 HD23 LEU 146 5.860 -0.233 9.440 1.00 0.00 H -ATOM 2285 C LEU 146 4.511 4.500 9.255 1.00 0.00 C -ATOM 2286 O LEU 146 3.801 4.484 8.232 1.00 0.00 O -ATOM 2287 N GLU 147 5.565 5.304 9.399 1.00 0.00 N -ATOM 2288 H GLU 147 6.150 5.213 10.217 1.00 0.00 H -ATOM 2289 CA GLU 147 6.225 5.869 8.247 1.00 0.00 C -ATOM 2290 HA GLU 147 5.820 5.393 7.354 1.00 0.00 H -ATOM 2291 CB GLU 147 6.018 7.328 8.121 1.00 0.00 C -ATOM 2292 HB2 GLU 147 4.967 7.562 8.288 1.00 0.00 H -ATOM 2293 HB3 GLU 147 6.621 7.749 8.926 1.00 0.00 H -ATOM 2294 CG GLU 147 6.374 7.955 6.787 1.00 0.00 C -ATOM 2295 HG2 GLU 147 6.878 8.910 6.935 1.00 0.00 H -ATOM 2296 HG3 GLU 147 7.121 7.304 6.332 1.00 0.00 H -ATOM 2297 CD GLU 147 5.158 8.127 5.929 1.00 0.00 C -ATOM 2298 OE1 GLU 147 5.269 8.888 4.950 1.00 0.00 O -ATOM 2299 OE2 GLU 147 4.153 7.390 6.150 1.00 0.00 O -ATOM 2300 C GLU 147 7.697 5.383 8.180 1.00 0.00 C -ATOM 2301 O GLU 147 8.266 5.019 9.247 1.00 0.00 O -ATOM 2302 N ILE 148 8.277 5.212 7.016 1.00 0.00 N -ATOM 2303 H ILE 148 7.823 5.383 6.130 1.00 0.00 H -ATOM 2304 CA ILE 148 9.649 4.754 6.889 1.00 0.00 C -ATOM 2305 HA ILE 148 10.169 4.817 7.844 1.00 0.00 H -ATOM 2306 CB ILE 148 9.692 3.203 6.579 1.00 0.00 C -ATOM 2307 HB ILE 148 9.039 3.145 5.708 1.00 0.00 H -ATOM 2308 CG2 ILE 148 11.160 2.596 6.163 1.00 0.00 C -ATOM 2309 HG21 ILE 148 11.198 2.969 5.139 1.00 0.00 H -ATOM 2310 HG22 ILE 148 11.878 2.984 6.886 1.00 0.00 H -ATOM 2311 HG23 ILE 148 11.252 1.510 6.151 1.00 0.00 H -ATOM 2312 CG1 ILE 148 9.040 2.249 7.665 1.00 0.00 C -ATOM 2313 HG12 ILE 148 9.491 2.576 8.603 1.00 0.00 H -ATOM 2314 HG13 ILE 148 7.972 2.438 7.775 1.00 0.00 H -ATOM 2315 CD1 ILE 148 9.180 0.705 7.571 1.00 0.00 C -ATOM 2316 HD11 ILE 148 8.777 0.393 6.608 1.00 0.00 H -ATOM 2317 HD12 ILE 148 10.223 0.418 7.700 1.00 0.00 H -ATOM 2318 HD13 ILE 148 8.577 0.169 8.304 1.00 0.00 H -ATOM 2319 C ILE 148 10.417 5.537 5.886 1.00 0.00 C -ATOM 2320 O ILE 148 10.023 5.779 4.740 1.00 0.00 O -ATOM 2321 N TYR 149 11.656 6.062 6.309 1.00 0.00 N -ATOM 2322 H TYR 149 12.023 5.791 7.210 1.00 0.00 H -ATOM 2323 CA TYR 149 12.470 6.994 5.452 1.00 0.00 C -ATOM 2324 HA TYR 149 12.424 6.631 4.426 1.00 0.00 H -ATOM 2325 CB TYR 149 11.878 8.385 5.498 1.00 0.00 C -ATOM 2326 HB2 TYR 149 10.920 8.274 4.990 1.00 0.00 H -ATOM 2327 HB3 TYR 149 11.697 8.659 6.537 1.00 0.00 H -ATOM 2328 CG TYR 149 12.755 9.475 4.881 1.00 0.00 C -ATOM 2329 CD1 TYR 149 13.724 10.085 5.725 1.00 0.00 C -ATOM 2330 HD1 TYR 149 13.898 9.584 6.665 1.00 0.00 H -ATOM 2331 CE1 TYR 149 14.451 11.177 5.222 1.00 0.00 C -ATOM 2332 HE1 TYR 149 15.155 11.625 5.906 1.00 0.00 H -ATOM 2333 CZ TYR 149 14.263 11.625 3.861 1.00 0.00 C -ATOM 2334 OH TYR 149 14.973 12.663 3.437 1.00 0.00 O -ATOM 2335 HH TYR 149 15.738 12.754 4.010 1.00 0.00 H -ATOM 2336 CE2 TYR 149 13.396 10.906 3.040 1.00 0.00 C -ATOM 2337 HE2 TYR 149 13.338 11.213 2.006 1.00 0.00 H -ATOM 2338 CD2 TYR 149 12.610 9.824 3.544 1.00 0.00 C -ATOM 2339 HD2 TYR 149 11.906 9.353 2.874 1.00 0.00 H -ATOM 2340 C TYR 149 13.930 6.944 5.876 1.00 0.00 C -ATOM 2341 O TYR 149 14.226 6.978 7.074 1.00 0.00 O -ATOM 2342 N ASN 150 14.823 6.952 4.872 1.00 0.00 N -ATOM 2343 H ASN 150 14.541 6.799 3.915 1.00 0.00 H -ATOM 2344 CA ASN 150 16.230 6.895 5.122 1.00 0.00 C -ATOM 2345 HA ASN 150 16.643 6.737 4.126 1.00 0.00 H -ATOM 2346 CB ASN 150 16.746 8.268 5.497 1.00 0.00 C -ATOM 2347 HB2 ASN 150 16.308 9.007 4.826 1.00 0.00 H -ATOM 2348 HB3 ASN 150 16.460 8.476 6.528 1.00 0.00 H -ATOM 2349 CG ASN 150 18.224 8.530 5.410 1.00 0.00 C -ATOM 2350 OD1 ASN 150 18.748 8.419 4.325 1.00 0.00 O -ATOM 2351 ND2 ASN 150 18.876 8.993 6.457 1.00 0.00 N -ATOM 2352 HD21 ASN 150 19.865 9.182 6.387 1.00 0.00 H -ATOM 2353 HD22 ASN 150 18.423 9.041 7.359 1.00 0.00 H -ATOM 2354 C ASN 150 16.732 5.684 6.005 1.00 0.00 C -ATOM 2355 O ASN 150 17.587 5.838 6.881 1.00 0.00 O -ATOM 2356 N GLU 151 16.169 4.505 5.840 1.00 0.00 N -ATOM 2357 H GLU 151 15.482 4.325 5.121 1.00 0.00 H -ATOM 2358 CA GLU 151 16.463 3.290 6.658 1.00 0.00 C -ATOM 2359 HA GLU 151 15.712 2.574 6.324 1.00 0.00 H -ATOM 2360 CB GLU 151 17.780 2.598 6.271 1.00 0.00 C -ATOM 2361 HB2 GLU 151 18.536 3.363 6.446 1.00 0.00 H -ATOM 2362 HB3 GLU 151 17.856 1.812 7.022 1.00 0.00 H -ATOM 2363 CG GLU 151 17.935 1.934 4.860 1.00 0.00 C -ATOM 2364 HG2 GLU 151 17.790 2.743 4.145 1.00 0.00 H -ATOM 2365 HG3 GLU 151 18.973 1.600 4.830 1.00 0.00 H -ATOM 2366 CD GLU 151 16.883 0.845 4.559 1.00 0.00 C -ATOM 2367 OE1 GLU 151 16.174 1.032 3.576 1.00 0.00 O -ATOM 2368 OE2 GLU 151 16.725 -0.142 5.316 1.00 0.00 O -ATOM 2369 C GLU 151 16.294 3.567 8.206 1.00 0.00 C -ATOM 2370 O GLU 151 16.882 2.934 9.018 1.00 0.00 O -ATOM 2371 N GLU 152 15.327 4.396 8.529 1.00 0.00 N -ATOM 2372 H GLU 152 15.014 5.008 7.789 1.00 0.00 H -ATOM 2373 CA GLU 152 14.677 4.498 9.843 1.00 0.00 C -ATOM 2374 HA GLU 152 15.014 3.657 10.450 1.00 0.00 H -ATOM 2375 CB GLU 152 15.095 5.785 10.634 1.00 0.00 C -ATOM 2376 HB2 GLU 152 14.884 6.688 10.061 1.00 0.00 H -ATOM 2377 HB3 GLU 152 14.434 5.839 11.499 1.00 0.00 H -ATOM 2378 CG GLU 152 16.647 5.795 10.938 1.00 0.00 C -ATOM 2379 HG2 GLU 152 16.863 4.830 11.396 1.00 0.00 H -ATOM 2380 HG3 GLU 152 17.223 5.826 10.013 1.00 0.00 H -ATOM 2381 CD GLU 152 17.010 6.971 11.882 1.00 0.00 C -ATOM 2382 OE1 GLU 152 17.470 6.649 13.000 1.00 0.00 O -ATOM 2383 OE2 GLU 152 16.800 8.160 11.527 1.00 0.00 O -ATOM 2384 C GLU 152 13.175 4.377 9.815 1.00 0.00 C -ATOM 2385 O GLU 152 12.514 4.620 8.819 1.00 0.00 O -ATOM 2386 N LEU 153 12.566 4.014 10.925 1.00 0.00 N -ATOM 2387 H LEU 153 13.116 3.938 11.768 1.00 0.00 H -ATOM 2388 CA LEU 153 11.156 3.751 11.127 1.00 0.00 C -ATOM 2389 HA LEU 153 10.539 3.842 10.233 1.00 0.00 H -ATOM 2390 CB LEU 153 11.056 2.318 11.770 1.00 0.00 C -ATOM 2391 HB2 LEU 153 11.787 2.312 12.579 1.00 0.00 H -ATOM 2392 HB3 LEU 153 10.066 2.206 12.212 1.00 0.00 H -ATOM 2393 CG LEU 153 11.311 1.162 10.807 1.00 0.00 C -ATOM 2394 HG LEU 153 10.542 0.978 10.056 1.00 0.00 H -ATOM 2395 CD1 LEU 153 12.481 1.229 9.862 1.00 0.00 C -ATOM 2396 HD11 LEU 153 12.174 1.977 9.131 1.00 0.00 H -ATOM 2397 HD12 LEU 153 13.402 1.566 10.337 1.00 0.00 H -ATOM 2398 HD13 LEU 153 12.546 0.255 9.379 1.00 0.00 H -ATOM 2399 CD2 LEU 153 11.426 -0.031 11.717 1.00 0.00 C -ATOM 2400 HD21 LEU 153 12.299 0.041 12.366 1.00 0.00 H -ATOM 2401 HD22 LEU 153 10.506 0.000 12.302 1.00 0.00 H -ATOM 2402 HD23 LEU 153 11.518 -0.899 11.065 1.00 0.00 H -ATOM 2403 C LEU 153 10.603 4.766 12.150 1.00 0.00 C -ATOM 2404 O LEU 153 11.275 5.186 13.075 1.00 0.00 O -ATOM 2405 N PHE 154 9.350 5.234 11.877 1.00 0.00 N -ATOM 2406 H PHE 154 8.902 5.098 10.983 1.00 0.00 H -ATOM 2407 CA PHE 154 8.754 6.354 12.607 1.00 0.00 C -ATOM 2408 HA PHE 154 9.549 6.589 13.314 1.00 0.00 H -ATOM 2409 CB PHE 154 8.710 7.625 11.687 1.00 0.00 C -ATOM 2410 HB2 PHE 154 8.094 7.409 10.815 1.00 0.00 H -ATOM 2411 HB3 PHE 154 8.212 8.362 12.317 1.00 0.00 H -ATOM 2412 CG PHE 154 10.056 8.248 11.389 1.00 0.00 C -ATOM 2413 CD1 PHE 154 10.684 9.120 12.247 1.00 0.00 C -ATOM 2414 HD1 PHE 154 10.060 9.425 13.074 1.00 0.00 H -ATOM 2415 CE1 PHE 154 12.060 9.564 12.111 1.00 0.00 C -ATOM 2416 HE1 PHE 154 12.571 10.079 12.911 1.00 0.00 H -ATOM 2417 CZ PHE 154 12.797 9.152 10.966 1.00 0.00 C -ATOM 2418 HZ PHE 154 13.866 9.269 10.875 1.00 0.00 H -ATOM 2419 CE2 PHE 154 12.079 8.399 9.993 1.00 0.00 C -ATOM 2420 HE2 PHE 154 12.707 8.072 9.178 1.00 0.00 H -ATOM 2421 CD2 PHE 154 10.791 7.918 10.218 1.00 0.00 C -ATOM 2422 HD2 PHE 154 10.303 7.383 9.416 1.00 0.00 H -ATOM 2423 C PHE 154 7.508 6.023 13.297 1.00 0.00 C -ATOM 2424 O PHE 154 6.584 5.589 12.639 1.00 0.00 O -ATOM 2425 N ASP 155 7.421 6.378 14.635 1.00 0.00 N -ATOM 2426 H ASP 155 8.164 6.890 15.088 1.00 0.00 H -ATOM 2427 CA ASP 155 6.356 5.978 15.559 1.00 0.00 C -ATOM 2428 HA ASP 155 6.026 4.982 15.265 1.00 0.00 H -ATOM 2429 CB ASP 155 6.903 6.094 17.025 1.00 0.00 C -ATOM 2430 HB2 ASP 155 7.908 5.689 17.137 1.00 0.00 H -ATOM 2431 HB3 ASP 155 6.868 7.121 17.391 1.00 0.00 H -ATOM 2432 CG ASP 155 5.892 5.370 17.929 1.00 0.00 C -ATOM 2433 OD1 ASP 155 4.687 5.070 17.653 1.00 0.00 O -ATOM 2434 OD2 ASP 155 6.271 5.067 19.121 1.00 0.00 O -ATOM 2435 C ASP 155 5.047 6.765 15.389 1.00 0.00 C -ATOM 2436 O ASP 155 4.662 7.628 16.148 1.00 0.00 O -ATOM 2437 N LEU 156 4.486 6.578 14.140 1.00 0.00 N -ATOM 2438 H LEU 156 4.993 5.967 13.515 1.00 0.00 H -ATOM 2439 CA LEU 156 3.249 7.212 13.825 1.00 0.00 C -ATOM 2440 HA LEU 156 3.419 8.258 14.079 1.00 0.00 H -ATOM 2441 CB LEU 156 2.912 7.159 12.290 1.00 0.00 C -ATOM 2442 HB2 LEU 156 3.115 6.192 11.831 1.00 0.00 H -ATOM 2443 HB3 LEU 156 1.836 7.240 12.136 1.00 0.00 H -ATOM 2444 CG LEU 156 3.551 8.378 11.523 1.00 0.00 C -ATOM 2445 HG LEU 156 3.240 9.356 11.892 1.00 0.00 H -ATOM 2446 CD1 LEU 156 5.058 8.381 11.543 1.00 0.00 C -ATOM 2447 HD11 LEU 156 5.433 9.145 10.862 1.00 0.00 H -ATOM 2448 HD12 LEU 156 5.368 8.573 12.570 1.00 0.00 H -ATOM 2449 HD13 LEU 156 5.463 7.418 11.235 1.00 0.00 H -ATOM 2450 CD2 LEU 156 2.965 8.345 10.086 1.00 0.00 C -ATOM 2451 HD21 LEU 156 3.457 9.141 9.527 1.00 0.00 H -ATOM 2452 HD22 LEU 156 3.171 7.390 9.602 1.00 0.00 H -ATOM 2453 HD23 LEU 156 1.906 8.606 10.074 1.00 0.00 H -ATOM 2454 C LEU 156 2.121 6.744 14.741 1.00 0.00 C -ATOM 2455 O LEU 156 1.097 7.439 14.923 1.00 0.00 O -ATOM 2456 N LEU 157 2.207 5.526 15.296 1.00 0.00 N -ATOM 2457 H LEU 157 3.029 4.982 15.074 1.00 0.00 H -ATOM 2458 CA LEU 157 1.237 4.956 16.116 1.00 0.00 C -ATOM 2459 HA LEU 157 0.330 5.037 15.518 1.00 0.00 H -ATOM 2460 CB LEU 157 1.664 3.488 16.363 1.00 0.00 C -ATOM 2461 HB2 LEU 157 1.677 3.051 15.365 1.00 0.00 H -ATOM 2462 HB3 LEU 157 2.625 3.430 16.874 1.00 0.00 H -ATOM 2463 CG LEU 157 0.677 2.684 17.253 1.00 0.00 C -ATOM 2464 HG LEU 157 0.660 3.185 18.221 1.00 0.00 H -ATOM 2465 CD1 LEU 157 -0.715 2.772 16.702 1.00 0.00 C -ATOM 2466 HD11 LEU 157 -1.406 1.976 16.982 1.00 0.00 H -ATOM 2467 HD12 LEU 157 -1.299 3.611 17.080 1.00 0.00 H -ATOM 2468 HD13 LEU 157 -0.627 2.912 15.625 1.00 0.00 H -ATOM 2469 CD2 LEU 157 1.042 1.259 17.513 1.00 0.00 C -ATOM 2470 HD21 LEU 157 1.128 0.768 16.544 1.00 0.00 H -ATOM 2471 HD22 LEU 157 1.871 1.161 18.214 1.00 0.00 H -ATOM 2472 HD23 LEU 157 0.225 0.699 17.968 1.00 0.00 H -ATOM 2473 C LEU 157 0.942 5.657 17.431 1.00 0.00 C -ATOM 2474 O LEU 157 -0.264 5.828 17.719 1.00 0.00 O -ATOM 2475 N ASN 158 1.921 5.989 18.218 1.00 0.00 N -ATOM 2476 H ASN 158 2.890 5.802 18.004 1.00 0.00 H -ATOM 2477 CA ASN 158 1.715 6.424 19.556 1.00 0.00 C -ATOM 2478 HA ASN 158 0.894 5.810 19.927 1.00 0.00 H -ATOM 2479 CB ASN 158 2.915 5.839 20.392 1.00 0.00 C -ATOM 2480 HB2 ASN 158 3.874 6.054 19.920 1.00 0.00 H -ATOM 2481 HB3 ASN 158 2.988 6.232 21.406 1.00 0.00 H -ATOM 2482 CG ASN 158 2.838 4.330 20.550 1.00 0.00 C -ATOM 2483 OD1 ASN 158 2.112 3.800 21.359 1.00 0.00 O -ATOM 2484 ND2 ASN 158 3.717 3.617 19.807 1.00 0.00 N -ATOM 2485 HD21 ASN 158 3.772 2.617 19.671 1.00 0.00 H -ATOM 2486 HD22 ASN 158 4.177 4.213 19.135 1.00 0.00 H -ATOM 2487 C ASN 158 1.308 7.968 19.689 1.00 0.00 C -ATOM 2488 O ASN 158 1.668 8.734 18.850 1.00 0.00 O -ATOM 2489 N PRO 159 0.798 8.379 20.849 1.00 0.00 N -ATOM 2490 CD PRO 159 0.523 7.527 22.000 1.00 0.00 C -ATOM 2491 HD2 PRO 159 1.503 7.281 22.408 1.00 0.00 H -ATOM 2492 HD3 PRO 159 -0.059 6.640 21.748 1.00 0.00 H -ATOM 2493 CG PRO 159 -0.232 8.403 22.964 1.00 0.00 C -ATOM 2494 HG2 PRO 159 0.044 8.237 24.005 1.00 0.00 H -ATOM 2495 HG3 PRO 159 -1.277 8.103 22.887 1.00 0.00 H -ATOM 2496 CB PRO 159 0.044 9.904 22.578 1.00 0.00 C -ATOM 2497 HB2 PRO 159 0.812 10.294 23.247 1.00 0.00 H -ATOM 2498 HB3 PRO 159 -0.948 10.353 22.542 1.00 0.00 H -ATOM 2499 CA PRO 159 0.394 9.822 21.054 1.00 0.00 C -ATOM 2500 HA PRO 159 -0.444 9.955 20.370 1.00 0.00 H -ATOM 2501 C PRO 159 1.316 11.003 20.769 1.00 0.00 C -ATOM 2502 O PRO 159 0.773 12.011 20.278 1.00 0.00 O -ATOM 2503 N SER 160 2.658 10.960 20.977 1.00 0.00 N -ATOM 2504 H SER 160 3.081 10.090 21.267 1.00 0.00 H -ATOM 2505 CA SER 160 3.580 12.111 20.700 1.00 0.00 C -ATOM 2506 HA SER 160 3.253 12.924 21.350 1.00 0.00 H -ATOM 2507 CB SER 160 4.908 11.646 21.193 1.00 0.00 C -ATOM 2508 HB2 SER 160 4.824 11.408 22.253 1.00 0.00 H -ATOM 2509 HB3 SER 160 5.232 10.784 20.610 1.00 0.00 H -ATOM 2510 OG SER 160 5.757 12.725 21.041 1.00 0.00 O -ATOM 2511 HG SER 160 6.612 12.409 21.342 1.00 0.00 H -ATOM 2512 C SER 160 3.556 12.489 19.235 1.00 0.00 C -ATOM 2513 O SER 160 4.063 11.728 18.367 1.00 0.00 O -ATOM 2514 N SER 161 3.059 13.689 19.045 1.00 0.00 N -ATOM 2515 H SER 161 2.736 14.162 19.878 1.00 0.00 H -ATOM 2516 CA SER 161 2.801 14.376 17.760 1.00 0.00 C -ATOM 2517 HA SER 161 2.216 13.667 17.175 1.00 0.00 H -ATOM 2518 CB SER 161 1.928 15.558 18.010 1.00 0.00 C -ATOM 2519 HB2 SER 161 1.675 15.966 17.031 1.00 0.00 H -ATOM 2520 HB3 SER 161 0.979 15.309 18.485 1.00 0.00 H -ATOM 2521 OG SER 161 2.581 16.411 18.932 1.00 0.00 O -ATOM 2522 HG SER 161 2.303 16.243 19.836 1.00 0.00 H -ATOM 2523 C SER 161 4.095 14.881 16.955 1.00 0.00 C -ATOM 2524 O SER 161 3.893 15.171 15.767 1.00 0.00 O -ATOM 2525 N ASP 162 5.306 14.790 17.600 1.00 0.00 N -ATOM 2526 H ASP 162 5.277 14.326 18.497 1.00 0.00 H -ATOM 2527 CA ASP 162 6.528 15.179 16.895 1.00 0.00 C -ATOM 2528 HA ASP 162 6.322 16.047 16.269 1.00 0.00 H -ATOM 2529 CB ASP 162 7.601 15.564 17.872 1.00 0.00 C -ATOM 2530 HB2 ASP 162 7.308 16.483 18.379 1.00 0.00 H -ATOM 2531 HB3 ASP 162 7.765 14.730 18.554 1.00 0.00 H -ATOM 2532 CG ASP 162 8.973 15.861 17.231 1.00 0.00 C -ATOM 2533 OD1 ASP 162 9.855 16.331 17.957 1.00 0.00 O -ATOM 2534 OD2 ASP 162 9.173 15.893 15.975 1.00 0.00 O -ATOM 2535 C ASP 162 7.015 13.959 16.002 1.00 0.00 C -ATOM 2536 O ASP 162 7.100 12.739 16.398 1.00 0.00 O -ATOM 2537 N VAL 163 7.250 14.293 14.734 1.00 0.00 N -ATOM 2538 H VAL 163 7.075 15.256 14.483 1.00 0.00 H -ATOM 2539 CA VAL 163 7.664 13.343 13.705 1.00 0.00 C -ATOM 2540 HA VAL 163 7.002 12.483 13.800 1.00 0.00 H -ATOM 2541 CB VAL 163 7.216 13.960 12.299 1.00 0.00 C -ATOM 2542 HB VAL 163 6.182 14.270 12.447 1.00 0.00 H -ATOM 2543 CG1 VAL 163 8.014 15.239 11.793 1.00 0.00 C -ATOM 2544 HG11 VAL 163 7.420 15.815 11.084 1.00 0.00 H -ATOM 2545 HG12 VAL 163 8.366 15.787 12.667 1.00 0.00 H -ATOM 2546 HG13 VAL 163 8.934 14.860 11.348 1.00 0.00 H -ATOM 2547 CG2 VAL 163 7.185 12.852 11.241 1.00 0.00 C -ATOM 2548 HG21 VAL 163 8.256 12.651 11.199 1.00 0.00 H -ATOM 2549 HG22 VAL 163 6.701 11.910 11.497 1.00 0.00 H -ATOM 2550 HG23 VAL 163 6.725 13.251 10.338 1.00 0.00 H -ATOM 2551 C VAL 163 9.084 12.745 13.726 1.00 0.00 C -ATOM 2552 O VAL 163 9.351 11.742 13.065 1.00 0.00 O -ATOM 2553 N SER 164 9.869 13.269 14.631 1.00 0.00 N -ATOM 2554 H SER 164 9.586 14.145 15.048 1.00 0.00 H -ATOM 2555 CA SER 164 11.155 12.731 15.030 1.00 0.00 C -ATOM 2556 HA SER 164 11.628 12.357 14.122 1.00 0.00 H -ATOM 2557 CB SER 164 12.041 13.792 15.632 1.00 0.00 C -ATOM 2558 HB2 SER 164 12.977 13.249 15.763 1.00 0.00 H -ATOM 2559 HB3 SER 164 12.236 14.594 14.920 1.00 0.00 H -ATOM 2560 OG SER 164 11.475 14.312 16.820 1.00 0.00 O -ATOM 2561 HG SER 164 10.759 14.945 16.723 1.00 0.00 H -ATOM 2562 C SER 164 11.020 11.503 16.016 1.00 0.00 C -ATOM 2563 O SER 164 12.081 11.002 16.470 1.00 0.00 O -ATOM 2564 N GLU 165 9.788 11.064 16.425 1.00 0.00 N -ATOM 2565 H GLU 165 8.994 11.674 16.291 1.00 0.00 H -ATOM 2566 CA GLU 165 9.703 9.895 17.251 1.00 0.00 C -ATOM 2567 HA GLU 165 10.451 10.129 18.008 1.00 0.00 H -ATOM 2568 CB GLU 165 8.346 9.814 17.907 1.00 0.00 C -ATOM 2569 HB2 GLU 165 7.681 10.094 17.089 1.00 0.00 H -ATOM 2570 HB3 GLU 165 8.296 8.775 18.231 1.00 0.00 H -ATOM 2571 CG GLU 165 7.884 10.683 19.127 1.00 0.00 C -ATOM 2572 HG2 GLU 165 8.166 11.722 18.956 1.00 0.00 H -ATOM 2573 HG3 GLU 165 6.828 10.480 19.306 1.00 0.00 H -ATOM 2574 CD GLU 165 8.437 10.132 20.394 1.00 0.00 C -ATOM 2575 OE1 GLU 165 9.273 9.244 20.441 1.00 0.00 O -ATOM 2576 OE2 GLU 165 8.045 10.739 21.440 1.00 0.00 O -ATOM 2577 C GLU 165 10.077 8.700 16.500 1.00 0.00 C -ATOM 2578 O GLU 165 9.534 8.409 15.460 1.00 0.00 O -ATOM 2579 N ARG 166 11.074 7.967 17.028 1.00 0.00 N -ATOM 2580 H ARG 166 11.382 8.129 17.977 1.00 0.00 H -ATOM 2581 CA ARG 166 11.678 6.786 16.355 1.00 0.00 C -ATOM 2582 HA ARG 166 11.371 6.688 15.314 1.00 0.00 H -ATOM 2583 CB ARG 166 13.151 7.015 16.262 1.00 0.00 C -ATOM 2584 HB2 ARG 166 13.505 7.240 17.268 1.00 0.00 H -ATOM 2585 HB3 ARG 166 13.686 6.105 15.990 1.00 0.00 H -ATOM 2586 CG ARG 166 13.619 8.091 15.356 1.00 0.00 C -ATOM 2587 HG2 ARG 166 13.274 7.813 14.360 1.00 0.00 H -ATOM 2588 HG3 ARG 166 13.197 9.075 15.559 1.00 0.00 H -ATOM 2589 CD ARG 166 15.142 8.237 15.348 1.00 0.00 C -ATOM 2590 HD2 ARG 166 15.492 8.603 16.313 1.00 0.00 H -ATOM 2591 HD3 ARG 166 15.431 7.199 15.179 1.00 0.00 H -ATOM 2592 NE ARG 166 15.669 8.952 14.199 1.00 0.00 N -ATOM 2593 HE ARG 166 16.012 8.429 13.406 1.00 0.00 H -ATOM 2594 CZ ARG 166 15.729 10.252 14.070 1.00 0.00 C -ATOM 2595 NH1 ARG 166 15.240 11.114 14.875 1.00 0.00 N -ATOM 2596 HH11 ARG 166 14.626 10.836 15.628 1.00 0.00 H -ATOM 2597 HH12 ARG 166 15.559 12.057 14.703 1.00 0.00 H -ATOM 2598 NH2 ARG 166 16.443 10.657 13.016 1.00 0.00 N -ATOM 2599 HH21 ARG 166 16.857 9.935 12.444 1.00 0.00 H -ATOM 2600 HH22 ARG 166 16.412 11.612 12.687 1.00 0.00 H -ATOM 2601 C ARG 166 11.338 5.495 17.098 1.00 0.00 C -ATOM 2602 O ARG 166 11.082 5.445 18.278 1.00 0.00 O -ATOM 2603 N LEU 167 11.526 4.432 16.288 1.00 0.00 N -ATOM 2604 H LEU 167 11.872 4.655 15.366 1.00 0.00 H -ATOM 2605 CA LEU 167 11.368 3.052 16.671 1.00 0.00 C -ATOM 2606 HA LEU 167 10.977 2.875 17.673 1.00 0.00 H -ATOM 2607 CB LEU 167 10.306 2.500 15.725 1.00 0.00 C -ATOM 2608 HB2 LEU 167 10.687 2.773 14.741 1.00 0.00 H -ATOM 2609 HB3 LEU 167 10.215 1.437 15.950 1.00 0.00 H -ATOM 2610 CG LEU 167 8.923 3.173 15.854 1.00 0.00 C -ATOM 2611 HG LEU 167 9.134 4.242 15.829 1.00 0.00 H -ATOM 2612 CD1 LEU 167 8.017 2.775 14.670 1.00 0.00 C -ATOM 2613 HD11 LEU 167 7.987 1.688 14.605 1.00 0.00 H -ATOM 2614 HD12 LEU 167 7.022 3.195 14.820 1.00 0.00 H -ATOM 2615 HD13 LEU 167 8.406 3.284 13.788 1.00 0.00 H -ATOM 2616 CD2 LEU 167 8.216 2.663 17.019 1.00 0.00 C -ATOM 2617 HD21 LEU 167 8.730 2.911 17.948 1.00 0.00 H -ATOM 2618 HD22 LEU 167 7.215 3.092 17.042 1.00 0.00 H -ATOM 2619 HD23 LEU 167 8.338 1.579 17.014 1.00 0.00 H -ATOM 2620 C LEU 167 12.653 2.224 16.338 1.00 0.00 C -ATOM 2621 O LEU 167 13.351 2.474 15.346 1.00 0.00 O -ATOM 2622 N GLN 168 13.006 1.348 17.252 1.00 0.00 N -ATOM 2623 H GLN 168 12.471 1.219 18.099 1.00 0.00 H -ATOM 2624 CA GLN 168 14.157 0.472 17.029 1.00 0.00 C -ATOM 2625 HA GLN 168 14.647 0.784 16.106 1.00 0.00 H -ATOM 2626 CB GLN 168 15.118 0.495 18.209 1.00 0.00 C -ATOM 2627 HB2 GLN 168 14.559 0.274 19.118 1.00 0.00 H -ATOM 2628 HB3 GLN 168 15.885 -0.277 18.141 1.00 0.00 H -ATOM 2629 CG GLN 168 15.739 1.944 18.422 1.00 0.00 C -ATOM 2630 HG2 GLN 168 16.662 2.065 18.988 1.00 0.00 H -ATOM 2631 HG3 GLN 168 15.910 2.365 17.432 1.00 0.00 H -ATOM 2632 CD GLN 168 14.761 2.832 19.199 1.00 0.00 C -ATOM 2633 OE1 GLN 168 14.006 2.425 20.120 1.00 0.00 O -ATOM 2634 NE2 GLN 168 14.758 4.139 18.998 1.00 0.00 N -ATOM 2635 HE21 GLN 168 14.248 4.577 19.751 1.00 0.00 H -ATOM 2636 HE22 GLN 168 15.098 4.679 18.215 1.00 0.00 H -ATOM 2637 C GLN 168 13.624 -0.952 16.884 1.00 0.00 C -ATOM 2638 O GLN 168 12.558 -1.283 17.327 1.00 0.00 O -ATOM 2639 N MET 169 14.418 -1.844 16.315 1.00 0.00 N -ATOM 2640 H MET 169 15.266 -1.435 15.950 1.00 0.00 H -ATOM 2641 CA MET 169 14.010 -3.165 15.932 1.00 0.00 C -ATOM 2642 HA MET 169 13.280 -3.538 16.650 1.00 0.00 H -ATOM 2643 CB MET 169 13.365 -3.145 14.548 1.00 0.00 C -ATOM 2644 HB2 MET 169 13.329 -4.175 14.193 1.00 0.00 H -ATOM 2645 HB3 MET 169 12.361 -2.732 14.646 1.00 0.00 H -ATOM 2646 CG MET 169 14.137 -2.433 13.450 1.00 0.00 C -ATOM 2647 HG2 MET 169 14.012 -1.367 13.636 1.00 0.00 H -ATOM 2648 HG3 MET 169 15.213 -2.607 13.416 1.00 0.00 H -ATOM 2649 SD MET 169 13.473 -2.790 11.730 1.00 0.00 S -ATOM 2650 CE MET 169 14.276 -4.386 11.306 1.00 0.00 C -ATOM 2651 HE1 MET 169 13.918 -4.697 10.324 1.00 0.00 H -ATOM 2652 HE2 MET 169 15.364 -4.320 11.309 1.00 0.00 H -ATOM 2653 HE3 MET 169 13.984 -5.013 12.148 1.00 0.00 H -ATOM 2654 C MET 169 15.177 -4.187 16.019 1.00 0.00 C -ATOM 2655 O MET 169 16.304 -3.976 15.726 1.00 0.00 O -ATOM 2656 N PHE 170 14.789 -5.484 16.244 1.00 0.00 N -ATOM 2657 H PHE 170 13.795 -5.665 16.220 1.00 0.00 H -ATOM 2658 CA PHE 170 15.667 -6.604 16.488 1.00 0.00 C -ATOM 2659 HA PHE 170 16.578 -6.335 15.954 1.00 0.00 H -ATOM 2660 CB PHE 170 16.013 -6.767 18.001 1.00 0.00 C -ATOM 2661 HB2 PHE 170 16.757 -7.562 18.041 1.00 0.00 H -ATOM 2662 HB3 PHE 170 16.482 -5.820 18.270 1.00 0.00 H -ATOM 2663 CG PHE 170 14.915 -7.173 18.875 1.00 0.00 C -ATOM 2664 CD1 PHE 170 14.250 -6.146 19.563 1.00 0.00 C -ATOM 2665 HD1 PHE 170 14.416 -5.103 19.338 1.00 0.00 H -ATOM 2666 CE1 PHE 170 13.308 -6.456 20.498 1.00 0.00 C -ATOM 2667 HE1 PHE 170 12.800 -5.718 21.101 1.00 0.00 H -ATOM 2668 CZ PHE 170 12.932 -7.767 20.719 1.00 0.00 C -ATOM 2669 HZ PHE 170 12.120 -7.983 21.397 1.00 0.00 H -ATOM 2670 CE2 PHE 170 13.597 -8.833 20.059 1.00 0.00 C -ATOM 2671 HE2 PHE 170 13.256 -9.854 20.147 1.00 0.00 H -ATOM 2672 CD2 PHE 170 14.503 -8.551 19.032 1.00 0.00 C -ATOM 2673 HD2 PHE 170 14.930 -9.299 18.380 1.00 0.00 H -ATOM 2674 C PHE 170 15.194 -7.960 15.931 1.00 0.00 C -ATOM 2675 O PHE 170 13.983 -8.174 15.844 1.00 0.00 O -ATOM 2676 N ASP 171 16.111 -8.791 15.538 1.00 0.00 N -ATOM 2677 H ASP 171 17.081 -8.570 15.713 1.00 0.00 H -ATOM 2678 CA ASP 171 15.819 -10.090 14.899 1.00 0.00 C -ATOM 2679 HA ASP 171 15.287 -9.903 13.966 1.00 0.00 H -ATOM 2680 CB ASP 171 17.115 -10.678 14.442 1.00 0.00 C -ATOM 2681 HB2 ASP 171 17.665 -10.918 15.351 1.00 0.00 H -ATOM 2682 HB3 ASP 171 16.886 -11.651 14.007 1.00 0.00 H -ATOM 2683 CG ASP 171 17.949 -9.852 13.468 1.00 0.00 C -ATOM 2684 OD1 ASP 171 17.369 -9.391 12.382 1.00 0.00 O -ATOM 2685 OD2 ASP 171 19.104 -9.621 13.804 1.00 0.00 O -ATOM 2686 C ASP 171 15.069 -10.944 15.922 1.00 0.00 C -ATOM 2687 O ASP 171 15.488 -11.127 17.055 1.00 0.00 O -ATOM 2688 N ASP 172 13.959 -11.567 15.457 1.00 0.00 N -ATOM 2689 H ASP 172 13.735 -11.337 14.500 1.00 0.00 H -ATOM 2690 CA ASP 172 13.100 -12.412 16.302 1.00 0.00 C -ATOM 2691 HA ASP 172 12.641 -11.849 17.114 1.00 0.00 H -ATOM 2692 CB ASP 172 11.927 -12.823 15.411 1.00 0.00 C -ATOM 2693 HB2 ASP 172 11.402 -11.939 15.049 1.00 0.00 H -ATOM 2694 HB3 ASP 172 12.216 -13.265 14.457 1.00 0.00 H -ATOM 2695 CG ASP 172 10.772 -13.591 16.016 1.00 0.00 C -ATOM 2696 OD1 ASP 172 9.711 -13.738 15.319 1.00 0.00 O -ATOM 2697 OD2 ASP 172 10.927 -13.982 17.202 1.00 0.00 O -ATOM 2698 C ASP 172 13.887 -13.622 16.713 1.00 0.00 C -ATOM 2699 O ASP 172 14.284 -14.352 15.828 1.00 0.00 O -ATOM 2700 N PRO 173 14.064 -13.914 18.034 1.00 0.00 N -ATOM 2701 CD PRO 173 13.619 -13.168 19.178 1.00 0.00 C -ATOM 2702 HD2 PRO 173 12.539 -13.187 19.326 1.00 0.00 H -ATOM 2703 HD3 PRO 173 13.927 -12.124 19.114 1.00 0.00 H -ATOM 2704 CG PRO 173 14.386 -13.602 20.389 1.00 0.00 C -ATOM 2705 HG2 PRO 173 13.782 -13.584 21.296 1.00 0.00 H -ATOM 2706 HG3 PRO 173 15.286 -12.992 20.469 1.00 0.00 H -ATOM 2707 CB PRO 173 14.863 -15.032 20.013 1.00 0.00 C -ATOM 2708 HB2 PRO 173 14.242 -15.782 20.502 1.00 0.00 H -ATOM 2709 HB3 PRO 173 15.908 -15.131 20.309 1.00 0.00 H -ATOM 2710 CA PRO 173 14.743 -15.168 18.476 1.00 0.00 C -ATOM 2711 HA PRO 173 15.737 -15.164 18.029 1.00 0.00 H -ATOM 2712 C PRO 173 14.162 -16.562 18.044 1.00 0.00 C -ATOM 2713 O PRO 173 14.941 -17.554 18.166 1.00 0.00 O -ATOM 2714 N ARG 174 12.892 -16.546 17.563 1.00 0.00 N -ATOM 2715 H ARG 174 12.400 -15.667 17.497 1.00 0.00 H -ATOM 2716 CA ARG 174 12.229 -17.798 17.096 1.00 0.00 C -ATOM 2717 HA ARG 174 12.298 -18.536 17.895 1.00 0.00 H -ATOM 2718 CB ARG 174 10.741 -17.447 16.888 1.00 0.00 C -ATOM 2719 HB2 ARG 174 10.736 -16.593 16.211 1.00 0.00 H -ATOM 2720 HB3 ARG 174 10.258 -18.347 16.507 1.00 0.00 H -ATOM 2721 CG ARG 174 9.982 -17.114 18.238 1.00 0.00 C -ATOM 2722 HG2 ARG 174 10.109 -18.030 18.815 1.00 0.00 H -ATOM 2723 HG3 ARG 174 10.355 -16.179 18.656 1.00 0.00 H -ATOM 2724 CD ARG 174 8.520 -16.886 17.904 1.00 0.00 C -ATOM 2725 HD2 ARG 174 8.143 -17.694 17.275 1.00 0.00 H -ATOM 2726 HD3 ARG 174 7.926 -16.886 18.818 1.00 0.00 H -ATOM 2727 NE ARG 174 8.284 -15.679 17.183 1.00 0.00 N -ATOM 2728 HE ARG 174 9.130 -15.221 16.874 1.00 0.00 H -ATOM 2729 CZ ARG 174 7.246 -14.880 17.319 1.00 0.00 C -ATOM 2730 NH1 ARG 174 6.092 -15.153 17.948 1.00 0.00 N -ATOM 2731 HH11 ARG 174 5.864 -16.001 18.446 1.00 0.00 H -ATOM 2732 HH12 ARG 174 5.427 -14.397 18.023 1.00 0.00 H -ATOM 2733 NH2 ARG 174 7.376 -13.703 16.784 1.00 0.00 N -ATOM 2734 HH21 ARG 174 8.021 -13.709 16.007 1.00 0.00 H -ATOM 2735 HH22 ARG 174 6.631 -13.024 16.716 1.00 0.00 H -ATOM 2736 C ARG 174 12.944 -18.390 15.881 1.00 0.00 C -ATOM 2737 O ARG 174 13.039 -19.642 15.721 1.00 0.00 O -ATOM 2738 N ASN 175 13.530 -17.569 14.979 1.00 0.00 N -ATOM 2739 H ASN 175 13.421 -16.567 15.052 1.00 0.00 H -ATOM 2740 CA ASN 175 14.136 -18.015 13.695 1.00 0.00 C -ATOM 2741 HA ASN 175 14.696 -18.912 13.957 1.00 0.00 H -ATOM 2742 CB ASN 175 13.027 -18.371 12.714 1.00 0.00 C -ATOM 2743 HB2 ASN 175 13.416 -18.598 11.722 1.00 0.00 H -ATOM 2744 HB3 ASN 175 12.443 -19.228 13.051 1.00 0.00 H -ATOM 2745 CG ASN 175 12.037 -17.225 12.631 1.00 0.00 C -ATOM 2746 OD1 ASN 175 12.439 -16.102 12.367 1.00 0.00 O -ATOM 2747 ND2 ASN 175 10.732 -17.475 12.747 1.00 0.00 N -ATOM 2748 HD21 ASN 175 10.105 -16.731 12.476 1.00 0.00 H -ATOM 2749 HD22 ASN 175 10.370 -18.418 12.773 1.00 0.00 H -ATOM 2750 C ASN 175 15.124 -17.085 13.054 1.00 0.00 C -ATOM 2751 O ASN 175 15.720 -17.471 12.111 1.00 0.00 O -ATOM 2752 N LYS 176 15.359 -15.862 13.572 1.00 0.00 N -ATOM 2753 H LYS 176 14.706 -15.631 14.307 1.00 0.00 H -ATOM 2754 CA LYS 176 16.336 -14.805 13.185 1.00 0.00 C -ATOM 2755 HA LYS 176 16.150 -13.906 13.772 1.00 0.00 H -ATOM 2756 CB LYS 176 17.843 -15.204 13.365 1.00 0.00 C -ATOM 2757 HB2 LYS 176 18.087 -16.190 12.968 1.00 0.00 H -ATOM 2758 HB3 LYS 176 18.339 -14.444 12.762 1.00 0.00 H -ATOM 2759 CG LYS 176 18.363 -15.301 14.836 1.00 0.00 C -ATOM 2760 HG2 LYS 176 18.469 -14.321 15.300 1.00 0.00 H -ATOM 2761 HG3 LYS 176 17.600 -15.725 15.489 1.00 0.00 H -ATOM 2762 CD LYS 176 19.570 -16.266 14.915 1.00 0.00 C -ATOM 2763 HD2 LYS 176 19.406 -17.270 14.524 1.00 0.00 H -ATOM 2764 HD3 LYS 176 20.442 -15.887 14.384 1.00 0.00 H -ATOM 2765 CE LYS 176 20.032 -16.473 16.380 1.00 0.00 C -ATOM 2766 HE2 LYS 176 20.028 -15.495 16.863 1.00 0.00 H -ATOM 2767 HE3 LYS 176 19.278 -17.043 16.924 1.00 0.00 H -ATOM 2768 NZ LYS 176 21.362 -17.159 16.448 1.00 0.00 N -ATOM 2769 HZ1 LYS 176 21.671 -17.099 17.408 1.00 0.00 H -ATOM 2770 HZ2 LYS 176 21.342 -18.087 16.049 1.00 0.00 H -ATOM 2771 HZ3 LYS 176 22.136 -16.689 16.001 1.00 0.00 H -ATOM 2772 C LYS 176 16.002 -14.222 11.754 1.00 0.00 C -ATOM 2773 O LYS 176 16.352 -13.102 11.470 1.00 0.00 O -ATOM 2774 N ARG 177 15.300 -14.949 10.867 1.00 0.00 N -ATOM 2775 H ARG 177 14.986 -15.828 11.253 1.00 0.00 H -ATOM 2776 CA ARG 177 14.710 -14.432 9.656 1.00 0.00 C -ATOM 2777 HA ARG 177 15.527 -14.008 9.073 1.00 0.00 H -ATOM 2778 CB ARG 177 14.045 -15.601 8.805 1.00 0.00 C -ATOM 2779 HB2 ARG 177 14.775 -16.126 8.189 1.00 0.00 H -ATOM 2780 HB3 ARG 177 13.475 -16.234 9.484 1.00 0.00 H -ATOM 2781 CG ARG 177 13.085 -15.024 7.736 1.00 0.00 C -ATOM 2782 HG2 ARG 177 12.306 -14.460 8.248 1.00 0.00 H -ATOM 2783 HG3 ARG 177 13.694 -14.371 7.111 1.00 0.00 H -ATOM 2784 CD ARG 177 12.449 -16.231 6.995 1.00 0.00 C -ATOM 2785 HD2 ARG 177 13.185 -16.922 6.584 1.00 0.00 H -ATOM 2786 HD3 ARG 177 11.901 -16.868 7.690 1.00 0.00 H -ATOM 2787 NE ARG 177 11.603 -15.786 5.904 1.00 0.00 N -ATOM 2788 HE ARG 177 12.008 -15.702 4.982 1.00 0.00 H -ATOM 2789 CZ ARG 177 10.362 -15.304 5.924 1.00 0.00 C -ATOM 2790 NH1 ARG 177 9.654 -15.380 6.994 1.00 0.00 N -ATOM 2791 HH11 ARG 177 9.996 -15.842 7.825 1.00 0.00 H -ATOM 2792 HH12 ARG 177 8.692 -15.088 7.095 1.00 0.00 H -ATOM 2793 NH2 ARG 177 9.793 -14.750 4.895 1.00 0.00 N -ATOM 2794 HH21 ARG 177 10.271 -14.818 4.007 1.00 0.00 H -ATOM 2795 HH22 ARG 177 8.886 -14.319 4.998 1.00 0.00 H -ATOM 2796 C ARG 177 13.720 -13.273 10.041 1.00 0.00 C -ATOM 2797 O ARG 177 13.845 -12.244 9.376 1.00 0.00 O -ATOM 2798 N GLY 178 12.859 -13.387 11.093 1.00 0.00 N -ATOM 2799 H GLY 178 12.752 -14.228 11.642 1.00 0.00 H -ATOM 2800 CA GLY 178 11.921 -12.276 11.377 1.00 0.00 C -ATOM 2801 HA2 GLY 178 11.447 -11.903 10.469 1.00 0.00 H -ATOM 2802 HA3 GLY 178 11.138 -12.651 12.037 1.00 0.00 H -ATOM 2803 C GLY 178 12.516 -11.014 12.132 1.00 0.00 C -ATOM 2804 O GLY 178 13.489 -11.051 12.784 1.00 0.00 O -ATOM 2805 N VAL 179 11.675 -9.963 12.196 1.00 0.00 N -ATOM 2806 H VAL 179 10.949 -9.983 11.494 1.00 0.00 H -ATOM 2807 CA VAL 179 11.951 -8.728 13.026 1.00 0.00 C -ATOM 2808 HA VAL 179 12.600 -9.230 13.743 1.00 0.00 H -ATOM 2809 CB VAL 179 12.683 -7.547 12.322 1.00 0.00 C -ATOM 2810 HB VAL 179 12.838 -6.803 13.104 1.00 0.00 H -ATOM 2811 CG1 VAL 179 14.148 -7.807 11.897 1.00 0.00 C -ATOM 2812 HG11 VAL 179 14.567 -6.983 11.321 1.00 0.00 H -ATOM 2813 HG12 VAL 179 14.774 -7.940 12.779 1.00 0.00 H -ATOM 2814 HG13 VAL 179 14.044 -8.722 11.314 1.00 0.00 H -ATOM 2815 CG2 VAL 179 11.875 -6.789 11.243 1.00 0.00 C -ATOM 2816 HG21 VAL 179 12.264 -5.808 10.972 1.00 0.00 H -ATOM 2817 HG22 VAL 179 12.057 -7.336 10.318 1.00 0.00 H -ATOM 2818 HG23 VAL 179 10.802 -6.735 11.429 1.00 0.00 H -ATOM 2819 C VAL 179 10.841 -8.311 13.979 1.00 0.00 C -ATOM 2820 O VAL 179 9.736 -8.191 13.473 1.00 0.00 O -ATOM 2821 N ILE 180 11.162 -7.914 15.190 1.00 0.00 N -ATOM 2822 H ILE 180 12.116 -8.035 15.498 1.00 0.00 H -ATOM 2823 CA ILE 180 10.255 -7.281 16.190 1.00 0.00 C -ATOM 2824 HA ILE 180 9.247 -7.457 15.815 1.00 0.00 H -ATOM 2825 CB ILE 180 10.418 -8.042 17.560 1.00 0.00 C -ATOM 2826 HB ILE 180 11.446 -7.954 17.912 1.00 0.00 H -ATOM 2827 CG2 ILE 180 9.464 -7.582 18.649 1.00 0.00 C -ATOM 2828 HG21 ILE 180 8.436 -7.793 18.356 1.00 0.00 H -ATOM 2829 HG22 ILE 180 9.698 -8.255 19.474 1.00 0.00 H -ATOM 2830 HG23 ILE 180 9.687 -6.605 19.078 1.00 0.00 H -ATOM 2831 CG1 ILE 180 10.101 -9.519 17.251 1.00 0.00 C -ATOM 2832 HG12 ILE 180 9.135 -9.551 16.747 1.00 0.00 H -ATOM 2833 HG13 ILE 180 10.732 -9.941 16.469 1.00 0.00 H -ATOM 2834 CD1 ILE 180 10.120 -10.590 18.362 1.00 0.00 C -ATOM 2835 HD11 ILE 180 9.995 -11.622 18.035 1.00 0.00 H -ATOM 2836 HD12 ILE 180 11.112 -10.633 18.812 1.00 0.00 H -ATOM 2837 HD13 ILE 180 9.430 -10.298 19.154 1.00 0.00 H -ATOM 2838 C ILE 180 10.537 -5.772 16.225 1.00 0.00 C -ATOM 2839 O ILE 180 11.604 -5.372 16.610 1.00 0.00 O -ATOM 2840 N ILE 181 9.581 -4.890 15.935 1.00 0.00 N -ATOM 2841 H ILE 181 8.680 -5.284 15.705 1.00 0.00 H -ATOM 2842 CA ILE 181 9.788 -3.467 16.098 1.00 0.00 C -ATOM 2843 HA ILE 181 10.843 -3.217 15.982 1.00 0.00 H -ATOM 2844 CB ILE 181 9.081 -2.662 14.971 1.00 0.00 C -ATOM 2845 HB ILE 181 8.009 -2.844 15.045 1.00 0.00 H -ATOM 2846 CG2 ILE 181 9.317 -1.215 15.168 1.00 0.00 C -ATOM 2847 HG21 ILE 181 8.751 -1.040 16.083 1.00 0.00 H -ATOM 2848 HG22 ILE 181 10.378 -0.993 15.287 1.00 0.00 H -ATOM 2849 HG23 ILE 181 8.881 -0.672 14.330 1.00 0.00 H -ATOM 2850 CG1 ILE 181 9.459 -3.109 13.526 1.00 0.00 C -ATOM 2851 HG12 ILE 181 10.517 -2.991 13.289 1.00 0.00 H -ATOM 2852 HG13 ILE 181 9.283 -4.180 13.427 1.00 0.00 H -ATOM 2853 CD1 ILE 181 8.547 -2.519 12.502 1.00 0.00 C -ATOM 2854 HD11 ILE 181 7.528 -2.879 12.644 1.00 0.00 H -ATOM 2855 HD12 ILE 181 8.727 -1.450 12.389 1.00 0.00 H -ATOM 2856 HD13 ILE 181 8.832 -2.943 11.538 1.00 0.00 H -ATOM 2857 C ILE 181 9.386 -3.104 17.517 1.00 0.00 C -ATOM 2858 O ILE 181 8.219 -3.408 17.947 1.00 0.00 O -ATOM 2859 N LYS 182 10.308 -2.694 18.367 1.00 0.00 N -ATOM 2860 H LYS 182 11.181 -2.454 17.920 1.00 0.00 H -ATOM 2861 CA LYS 182 10.142 -2.061 19.725 1.00 0.00 C -ATOM 2862 HA LYS 182 9.576 -2.728 20.376 1.00 0.00 H -ATOM 2863 CB LYS 182 11.607 -1.820 20.300 1.00 0.00 C -ATOM 2864 HB2 LYS 182 12.240 -1.234 19.634 1.00 0.00 H -ATOM 2865 HB3 LYS 182 11.537 -1.124 21.136 1.00 0.00 H -ATOM 2866 CG LYS 182 12.274 -3.139 20.709 1.00 0.00 C -ATOM 2867 HG2 LYS 182 11.551 -3.733 21.268 1.00 0.00 H -ATOM 2868 HG3 LYS 182 12.526 -3.567 19.738 1.00 0.00 H -ATOM 2869 CD LYS 182 13.573 -2.855 21.439 1.00 0.00 C -ATOM 2870 HD2 LYS 182 14.248 -3.704 21.548 1.00 0.00 H -ATOM 2871 HD3 LYS 182 14.154 -2.140 20.856 1.00 0.00 H -ATOM 2872 CE LYS 182 13.424 -2.266 22.850 1.00 0.00 C -ATOM 2873 HE2 LYS 182 13.090 -1.239 22.699 1.00 0.00 H -ATOM 2874 HE3 LYS 182 12.772 -2.836 23.513 1.00 0.00 H -ATOM 2875 NZ LYS 182 14.726 -2.237 23.502 1.00 0.00 N -ATOM 2876 HZ1 LYS 182 14.743 -1.983 24.479 1.00 0.00 H -ATOM 2877 HZ2 LYS 182 15.149 -3.153 23.459 1.00 0.00 H -ATOM 2878 HZ3 LYS 182 15.320 -1.541 23.075 1.00 0.00 H -ATOM 2879 C LYS 182 9.408 -0.770 19.621 1.00 0.00 C -ATOM 2880 O LYS 182 9.278 -0.262 18.530 1.00 0.00 O -ATOM 2881 N GLY 183 8.760 -0.278 20.666 1.00 0.00 N -ATOM 2882 H GLY 183 8.891 -0.823 21.506 1.00 0.00 H -ATOM 2883 CA GLY 183 7.846 0.870 20.695 1.00 0.00 C -ATOM 2884 HA2 GLY 183 7.623 1.171 21.719 1.00 0.00 H -ATOM 2885 HA3 GLY 183 8.357 1.723 20.250 1.00 0.00 H -ATOM 2886 C GLY 183 6.498 0.760 19.987 1.00 0.00 C -ATOM 2887 O GLY 183 5.486 1.184 20.543 1.00 0.00 O -ATOM 2888 N LEU 184 6.452 0.092 18.785 1.00 0.00 N -ATOM 2889 H LEU 184 7.330 -0.365 18.586 1.00 0.00 H -ATOM 2890 CA LEU 184 5.306 -0.024 17.876 1.00 0.00 C -ATOM 2891 HA LEU 184 4.864 0.963 18.006 1.00 0.00 H -ATOM 2892 CB LEU 184 5.761 -0.331 16.393 1.00 0.00 C -ATOM 2893 HB2 LEU 184 6.560 0.402 16.274 1.00 0.00 H -ATOM 2894 HB3 LEU 184 6.270 -1.294 16.353 1.00 0.00 H -ATOM 2895 CG LEU 184 4.742 -0.258 15.153 1.00 0.00 C -ATOM 2896 HG LEU 184 3.960 -0.998 15.318 1.00 0.00 H -ATOM 2897 CD1 LEU 184 4.135 1.104 15.034 1.00 0.00 C -ATOM 2898 HD11 LEU 184 3.767 1.386 16.021 1.00 0.00 H -ATOM 2899 HD12 LEU 184 4.952 1.820 14.937 1.00 0.00 H -ATOM 2900 HD13 LEU 184 3.409 1.105 14.222 1.00 0.00 H -ATOM 2901 CD2 LEU 184 5.444 -0.590 13.802 1.00 0.00 C -ATOM 2902 HD21 LEU 184 6.056 -1.464 14.025 1.00 0.00 H -ATOM 2903 HD22 LEU 184 4.767 -0.810 12.977 1.00 0.00 H -ATOM 2904 HD23 LEU 184 6.173 0.154 13.481 1.00 0.00 H -ATOM 2905 C LEU 184 4.269 -1.071 18.321 1.00 0.00 C -ATOM 2906 O LEU 184 3.554 -1.620 17.482 1.00 0.00 O -ATOM 2907 N GLU 185 4.255 -1.474 19.602 1.00 0.00 N -ATOM 2908 H GLU 185 4.861 -0.883 20.153 1.00 0.00 H -ATOM 2909 CA GLU 185 3.379 -2.495 20.209 1.00 0.00 C -ATOM 2910 HA GLU 185 3.662 -3.477 19.832 1.00 0.00 H -ATOM 2911 CB GLU 185 3.695 -2.525 21.713 1.00 0.00 C -ATOM 2912 HB2 GLU 185 4.758 -2.510 21.952 1.00 0.00 H -ATOM 2913 HB3 GLU 185 3.345 -1.596 22.163 1.00 0.00 H -ATOM 2914 CG GLU 185 2.827 -3.570 22.465 1.00 0.00 C -ATOM 2915 HG2 GLU 185 2.869 -3.313 23.524 1.00 0.00 H -ATOM 2916 HG3 GLU 185 1.769 -3.559 22.202 1.00 0.00 H -ATOM 2917 CD GLU 185 3.340 -5.005 22.247 1.00 0.00 C -ATOM 2918 OE1 GLU 185 2.541 -5.893 21.873 1.00 0.00 O -ATOM 2919 OE2 GLU 185 4.591 -5.270 22.225 1.00 0.00 O -ATOM 2920 C GLU 185 1.902 -2.058 19.917 1.00 0.00 C -ATOM 2921 O GLU 185 1.617 -0.844 20.085 1.00 0.00 O -ATOM 2922 N GLU 186 1.052 -3.041 19.415 1.00 0.00 N -ATOM 2923 H GLU 186 1.235 -4.027 19.293 1.00 0.00 H -ATOM 2924 CA GLU 186 -0.223 -2.565 18.831 1.00 0.00 C -ATOM 2925 HA GLU 186 -0.013 -1.740 18.151 1.00 0.00 H -ATOM 2926 CB GLU 186 -1.033 -3.606 18.066 1.00 0.00 C -ATOM 2927 HB2 GLU 186 -1.303 -4.340 18.826 1.00 0.00 H -ATOM 2928 HB3 GLU 186 -1.923 -3.103 17.688 1.00 0.00 H -ATOM 2929 CG GLU 186 -0.334 -4.372 16.890 1.00 0.00 C -ATOM 2930 HG2 GLU 186 -0.976 -5.080 16.367 1.00 0.00 H -ATOM 2931 HG3 GLU 186 0.091 -3.680 16.163 1.00 0.00 H -ATOM 2932 CD GLU 186 0.780 -5.285 17.379 1.00 0.00 C -ATOM 2933 OE1 GLU 186 0.568 -6.155 18.240 1.00 0.00 O -ATOM 2934 OE2 GLU 186 1.918 -5.164 16.886 1.00 0.00 O -ATOM 2935 C GLU 186 -1.134 -1.890 19.904 1.00 0.00 C -ATOM 2936 O GLU 186 -1.164 -2.223 21.110 1.00 0.00 O -ATOM 2937 N ILE 187 -2.044 -1.066 19.356 1.00 0.00 N -ATOM 2938 H ILE 187 -1.915 -0.859 18.376 1.00 0.00 H -ATOM 2939 CA ILE 187 -3.173 -0.492 20.062 1.00 0.00 C -ATOM 2940 HA ILE 187 -2.920 -0.456 21.122 1.00 0.00 H -ATOM 2941 CB ILE 187 -3.416 0.996 19.689 1.00 0.00 C -ATOM 2942 HB ILE 187 -3.247 1.217 18.635 1.00 0.00 H -ATOM 2943 CG2 ILE 187 -4.934 1.431 19.935 1.00 0.00 C -ATOM 2944 HG21 ILE 187 -5.059 2.470 19.630 1.00 0.00 H -ATOM 2945 HG22 ILE 187 -5.505 0.972 19.127 1.00 0.00 H -ATOM 2946 HG23 ILE 187 -5.363 1.208 20.912 1.00 0.00 H -ATOM 2947 CG1 ILE 187 -2.360 1.878 20.366 1.00 0.00 C -ATOM 2948 HG12 ILE 187 -2.556 1.881 21.438 1.00 0.00 H -ATOM 2949 HG13 ILE 187 -1.336 1.528 20.236 1.00 0.00 H -ATOM 2950 CD1 ILE 187 -2.486 3.338 19.940 1.00 0.00 C -ATOM 2951 HD11 ILE 187 -3.498 3.719 20.076 1.00 0.00 H -ATOM 2952 HD12 ILE 187 -1.724 4.021 20.316 1.00 0.00 H -ATOM 2953 HD13 ILE 187 -2.407 3.447 18.858 1.00 0.00 H -ATOM 2954 C ILE 187 -4.418 -1.481 20.029 1.00 0.00 C -ATOM 2955 O ILE 187 -5.016 -1.687 18.961 1.00 0.00 O -ATOM 2956 N THR 188 -4.858 -2.018 21.128 1.00 0.00 N -ATOM 2957 H THR 188 -4.435 -1.757 22.007 1.00 0.00 H -ATOM 2958 CA THR 188 -6.216 -2.627 21.211 1.00 0.00 C -ATOM 2959 HA THR 188 -6.276 -3.427 20.473 1.00 0.00 H -ATOM 2960 CB THR 188 -6.495 -3.170 22.610 1.00 0.00 C -ATOM 2961 HB THR 188 -6.240 -2.320 23.242 1.00 0.00 H -ATOM 2962 CG2 THR 188 -7.958 -3.585 22.937 1.00 0.00 C -ATOM 2963 HG21 THR 188 -8.143 -4.554 22.473 1.00 0.00 H -ATOM 2964 HG22 THR 188 -7.961 -3.641 24.025 1.00 0.00 H -ATOM 2965 HG23 THR 188 -8.628 -2.796 22.596 1.00 0.00 H -ATOM 2966 OG1 THR 188 -5.728 -4.253 22.903 1.00 0.00 O -ATOM 2967 HG1 THR 188 -4.841 -3.906 23.022 1.00 0.00 H -ATOM 2968 C THR 188 -7.302 -1.622 20.759 1.00 0.00 C -ATOM 2969 O THR 188 -7.359 -0.471 21.241 1.00 0.00 O -ATOM 2970 N VAL 189 -8.253 -2.031 19.944 1.00 0.00 N -ATOM 2971 H VAL 189 -8.333 -2.947 19.525 1.00 0.00 H -ATOM 2972 CA VAL 189 -9.397 -1.257 19.501 1.00 0.00 C -ATOM 2973 HA VAL 189 -9.197 -0.214 19.749 1.00 0.00 H -ATOM 2974 CB VAL 189 -9.662 -1.334 18.008 1.00 0.00 C -ATOM 2975 HB VAL 189 -9.902 -2.382 17.831 1.00 0.00 H -ATOM 2976 CG1 VAL 189 -10.770 -0.339 17.460 1.00 0.00 C -ATOM 2977 HG11 VAL 189 -11.679 -0.463 18.049 1.00 0.00 H -ATOM 2978 HG12 VAL 189 -10.484 0.708 17.559 1.00 0.00 H -ATOM 2979 HG13 VAL 189 -11.025 -0.381 16.401 1.00 0.00 H -ATOM 2980 CG2 VAL 189 -8.395 -1.053 17.113 1.00 0.00 C -ATOM 2981 HG21 VAL 189 -7.863 -0.145 17.395 1.00 0.00 H -ATOM 2982 HG22 VAL 189 -7.737 -1.917 17.203 1.00 0.00 H -ATOM 2983 HG23 VAL 189 -8.639 -0.928 16.058 1.00 0.00 H -ATOM 2984 C VAL 189 -10.719 -1.710 20.182 1.00 0.00 C -ATOM 2985 O VAL 189 -10.934 -2.912 20.153 1.00 0.00 O -ATOM 2986 N HIE 190 -11.613 -0.784 20.627 1.00 0.00 N -ATOM 2987 H HIE 190 -11.310 0.175 20.719 1.00 0.00 H -ATOM 2988 CA HIE 190 -12.933 -1.018 21.222 1.00 0.00 C -ATOM 2989 HA HIE 190 -13.045 -2.098 21.130 1.00 0.00 H -ATOM 2990 CB HIE 190 -12.820 -0.633 22.696 1.00 0.00 C -ATOM 2991 HB2 HIE 190 -12.536 0.408 22.848 1.00 0.00 H -ATOM 2992 HB3 HIE 190 -13.761 -0.893 23.181 1.00 0.00 H -ATOM 2993 CG HIE 190 -11.842 -1.357 23.577 1.00 0.00 C -ATOM 2994 ND1 HIE 190 -11.897 -2.675 23.919 1.00 0.00 N -ATOM 2995 CE1 HIE 190 -10.821 -2.953 24.687 1.00 0.00 C -ATOM 2996 HE1 HIE 190 -10.567 -3.961 24.980 1.00 0.00 H -ATOM 2997 NE2 HIE 190 -10.064 -1.888 24.868 1.00 0.00 N -ATOM 2998 HE2 HIE 190 -9.191 -1.852 25.375 1.00 0.00 H -ATOM 2999 CD2 HIE 190 -10.734 -0.849 24.188 1.00 0.00 C -ATOM 3000 HD2 HIE 190 -10.412 0.174 24.059 1.00 0.00 H -ATOM 3001 C HIE 190 -14.106 -0.256 20.455 1.00 0.00 C -ATOM 3002 O HIE 190 -15.161 -0.841 20.280 1.00 0.00 O -ATOM 3003 N ASN 191 -13.862 0.880 19.937 1.00 0.00 N -ATOM 3004 H ASN 191 -13.017 1.364 20.204 1.00 0.00 H -ATOM 3005 CA ASN 191 -14.692 1.649 19.008 1.00 0.00 C -ATOM 3006 HA ASN 191 -15.382 0.963 18.516 1.00 0.00 H -ATOM 3007 CB ASN 191 -15.394 2.668 19.883 1.00 0.00 C -ATOM 3008 HB2 ASN 191 -15.908 2.194 20.719 1.00 0.00 H -ATOM 3009 HB3 ASN 191 -14.635 3.333 20.295 1.00 0.00 H -ATOM 3010 CG ASN 191 -16.452 3.476 19.082 1.00 0.00 C -ATOM 3011 OD1 ASN 191 -16.195 4.109 18.059 1.00 0.00 O -ATOM 3012 ND2 ASN 191 -17.721 3.406 19.468 1.00 0.00 N -ATOM 3013 HD21 ASN 191 -18.370 3.936 18.905 1.00 0.00 H -ATOM 3014 HD22 ASN 191 -17.901 2.768 20.230 1.00 0.00 H -ATOM 3015 C ASN 191 -13.730 2.366 18.001 1.00 0.00 C -ATOM 3016 O ASN 191 -12.743 3.006 18.454 1.00 0.00 O -ATOM 3017 N LYS 192 -13.886 2.235 16.650 1.00 0.00 N -ATOM 3018 H LYS 192 -14.706 1.775 16.282 1.00 0.00 H -ATOM 3019 CA LYS 192 -13.025 2.869 15.691 1.00 0.00 C -ATOM 3020 HA LYS 192 -12.008 2.480 15.726 1.00 0.00 H -ATOM 3021 CB LYS 192 -13.368 2.667 14.164 1.00 0.00 C -ATOM 3022 HB2 LYS 192 -12.573 3.103 13.558 1.00 0.00 H -ATOM 3023 HB3 LYS 192 -13.336 1.580 14.090 1.00 0.00 H -ATOM 3024 CG LYS 192 -14.685 3.178 13.539 1.00 0.00 C -ATOM 3025 HG2 LYS 192 -14.713 4.261 13.652 1.00 0.00 H -ATOM 3026 HG3 LYS 192 -14.537 3.033 12.469 1.00 0.00 H -ATOM 3027 CD LYS 192 -15.954 2.465 14.060 1.00 0.00 C -ATOM 3028 HD2 LYS 192 -16.041 1.431 13.726 1.00 0.00 H -ATOM 3029 HD3 LYS 192 -16.020 2.641 15.134 1.00 0.00 H -ATOM 3030 CE LYS 192 -17.146 3.240 13.364 1.00 0.00 C -ATOM 3031 HE2 LYS 192 -17.059 4.326 13.357 1.00 0.00 H -ATOM 3032 HE3 LYS 192 -17.127 2.893 12.331 1.00 0.00 H -ATOM 3033 NZ LYS 192 -18.412 2.791 13.923 1.00 0.00 N -ATOM 3034 HZ1 LYS 192 -18.416 1.782 13.952 1.00 0.00 H -ATOM 3035 HZ2 LYS 192 -18.579 3.155 14.850 1.00 0.00 H -ATOM 3036 HZ3 LYS 192 -19.194 3.091 13.359 1.00 0.00 H -ATOM 3037 C LYS 192 -12.873 4.393 15.824 1.00 0.00 C -ATOM 3038 O LYS 192 -11.869 4.989 15.313 1.00 0.00 O -ATOM 3039 N ASP 193 -13.835 5.083 16.457 1.00 0.00 N -ATOM 3040 H ASP 193 -14.645 4.505 16.627 1.00 0.00 H -ATOM 3041 CA ASP 193 -13.763 6.514 16.753 1.00 0.00 C -ATOM 3042 HA ASP 193 -13.932 7.070 15.831 1.00 0.00 H -ATOM 3043 CB ASP 193 -14.949 6.852 17.706 1.00 0.00 C -ATOM 3044 HB2 ASP 193 -15.936 6.551 17.356 1.00 0.00 H -ATOM 3045 HB3 ASP 193 -14.781 6.230 18.585 1.00 0.00 H -ATOM 3046 CG ASP 193 -14.960 8.347 17.935 1.00 0.00 C -ATOM 3047 OD1 ASP 193 -14.679 8.689 19.061 1.00 0.00 O -ATOM 3048 OD2 ASP 193 -15.283 9.088 16.976 1.00 0.00 O -ATOM 3049 C ASP 193 -12.396 7.028 17.350 1.00 0.00 C -ATOM 3050 O ASP 193 -11.745 7.938 16.747 1.00 0.00 O -ATOM 3051 N GLU 194 -11.869 6.322 18.363 1.00 0.00 N -ATOM 3052 H GLU 194 -12.407 5.541 18.709 1.00 0.00 H -ATOM 3053 CA GLU 194 -10.576 6.594 19.017 1.00 0.00 C -ATOM 3054 HA GLU 194 -10.579 7.655 19.267 1.00 0.00 H -ATOM 3055 CB GLU 194 -10.315 5.720 20.218 1.00 0.00 C -ATOM 3056 HB2 GLU 194 -10.381 4.695 19.856 1.00 0.00 H -ATOM 3057 HB3 GLU 194 -9.330 5.974 20.610 1.00 0.00 H -ATOM 3058 CG GLU 194 -11.369 5.864 21.322 1.00 0.00 C -ATOM 3059 HG2 GLU 194 -12.296 5.734 20.764 1.00 0.00 H -ATOM 3060 HG3 GLU 194 -11.224 5.043 22.024 1.00 0.00 H -ATOM 3061 CD GLU 194 -11.303 7.239 21.974 1.00 0.00 C -ATOM 3062 OE1 GLU 194 -12.233 7.464 22.755 1.00 0.00 O -ATOM 3063 OE2 GLU 194 -10.363 8.045 21.818 1.00 0.00 O -ATOM 3064 C GLU 194 -9.429 6.409 18.026 1.00 0.00 C -ATOM 3065 O GLU 194 -8.520 7.201 18.039 1.00 0.00 O -ATOM 3066 N VAL 195 -9.475 5.477 17.079 1.00 0.00 N -ATOM 3067 H VAL 195 -10.268 4.852 17.108 1.00 0.00 H -ATOM 3068 CA VAL 195 -8.403 5.100 16.133 1.00 0.00 C -ATOM 3069 HA VAL 195 -7.422 5.097 16.607 1.00 0.00 H -ATOM 3070 CB VAL 195 -8.624 3.665 15.695 1.00 0.00 C -ATOM 3071 HB VAL 195 -9.647 3.523 15.346 1.00 0.00 H -ATOM 3072 CG1 VAL 195 -7.568 3.138 14.710 1.00 0.00 C -ATOM 3073 HG11 VAL 195 -6.593 3.424 15.105 1.00 0.00 H -ATOM 3074 HG12 VAL 195 -7.610 2.052 14.630 1.00 0.00 H -ATOM 3075 HG13 VAL 195 -7.776 3.517 13.709 1.00 0.00 H -ATOM 3076 CG2 VAL 195 -8.542 2.779 16.929 1.00 0.00 C -ATOM 3077 HG21 VAL 195 -9.280 3.034 17.689 1.00 0.00 H -ATOM 3078 HG22 VAL 195 -8.661 1.785 16.496 1.00 0.00 H -ATOM 3079 HG23 VAL 195 -7.518 2.759 17.301 1.00 0.00 H -ATOM 3080 C VAL 195 -8.355 6.006 14.865 1.00 0.00 C -ATOM 3081 O VAL 195 -7.321 6.242 14.208 1.00 0.00 O -ATOM 3082 N TYR 196 -9.548 6.519 14.463 1.00 0.00 N -ATOM 3083 H TYR 196 -10.395 6.097 14.814 1.00 0.00 H -ATOM 3084 CA TYR 196 -9.634 7.568 13.412 1.00 0.00 C -ATOM 3085 HA TYR 196 -9.060 7.246 12.543 1.00 0.00 H -ATOM 3086 CB TYR 196 -11.165 7.828 13.032 1.00 0.00 C -ATOM 3087 HB2 TYR 196 -11.505 6.903 12.568 1.00 0.00 H -ATOM 3088 HB3 TYR 196 -11.672 7.895 13.994 1.00 0.00 H -ATOM 3089 CG TYR 196 -11.501 8.959 12.098 1.00 0.00 C -ATOM 3090 CD1 TYR 196 -11.486 10.272 12.565 1.00 0.00 C -ATOM 3091 HD1 TYR 196 -11.358 10.525 13.608 1.00 0.00 H -ATOM 3092 CE1 TYR 196 -11.565 11.415 11.740 1.00 0.00 C -ATOM 3093 HE1 TYR 196 -11.306 12.370 12.172 1.00 0.00 H -ATOM 3094 CZ TYR 196 -11.675 11.220 10.361 1.00 0.00 C -ATOM 3095 OH TYR 196 -11.603 12.217 9.474 1.00 0.00 O -ATOM 3096 HH TYR 196 -11.345 13.060 9.855 1.00 0.00 H -ATOM 3097 CE2 TYR 196 -11.812 9.888 9.926 1.00 0.00 C -ATOM 3098 HE2 TYR 196 -12.001 9.672 8.885 1.00 0.00 H -ATOM 3099 CD2 TYR 196 -11.698 8.778 10.746 1.00 0.00 C -ATOM 3100 HD2 TYR 196 -11.731 7.775 10.347 1.00 0.00 H -ATOM 3101 C TYR 196 -8.904 8.858 13.773 1.00 0.00 C -ATOM 3102 O TYR 196 -8.059 9.353 13.028 1.00 0.00 O -ATOM 3103 N GLN 197 -9.078 9.377 15.008 1.00 0.00 N -ATOM 3104 H GLN 197 -9.823 8.945 15.536 1.00 0.00 H -ATOM 3105 CA GLN 197 -8.190 10.414 15.624 1.00 0.00 C -ATOM 3106 HA GLN 197 -8.334 11.313 15.025 1.00 0.00 H -ATOM 3107 CB GLN 197 -8.711 10.786 17.047 1.00 0.00 C -ATOM 3108 HB2 GLN 197 -8.455 9.902 17.631 1.00 0.00 H -ATOM 3109 HB3 GLN 197 -8.077 11.553 17.493 1.00 0.00 H -ATOM 3110 CG GLN 197 -10.137 11.116 17.460 1.00 0.00 C -ATOM 3111 HG2 GLN 197 -10.770 10.228 17.439 1.00 0.00 H -ATOM 3112 HG3 GLN 197 -10.145 11.611 18.431 1.00 0.00 H -ATOM 3113 CD GLN 197 -10.669 12.228 16.579 1.00 0.00 C -ATOM 3114 OE1 GLN 197 -9.924 13.089 16.022 1.00 0.00 O -ATOM 3115 NE2 GLN 197 -11.996 12.291 16.406 1.00 0.00 N -ATOM 3116 HE21 GLN 197 -12.384 13.011 15.813 1.00 0.00 H -ATOM 3117 HE22 GLN 197 -12.532 11.490 16.707 1.00 0.00 H -ATOM 3118 C GLN 197 -6.685 10.065 15.546 1.00 0.00 C -ATOM 3119 O GLN 197 -5.876 10.853 15.083 1.00 0.00 O -ATOM 3120 N ILE 198 -6.293 8.855 16.010 1.00 0.00 N -ATOM 3121 H ILE 198 -6.922 8.205 16.460 1.00 0.00 H -ATOM 3122 CA ILE 198 -4.935 8.338 15.942 1.00 0.00 C -ATOM 3123 HA ILE 198 -4.280 8.933 16.579 1.00 0.00 H -ATOM 3124 CB ILE 198 -4.720 6.935 16.634 1.00 0.00 C -ATOM 3125 HB ILE 198 -5.379 6.202 16.167 1.00 0.00 H -ATOM 3126 CG2 ILE 198 -3.329 6.339 16.378 1.00 0.00 C -ATOM 3127 HG21 ILE 198 -3.330 6.111 15.313 1.00 0.00 H -ATOM 3128 HG22 ILE 198 -2.588 7.126 16.518 1.00 0.00 H -ATOM 3129 HG23 ILE 198 -3.202 5.386 16.892 1.00 0.00 H -ATOM 3130 CG1 ILE 198 -4.936 7.040 18.134 1.00 0.00 C -ATOM 3131 HG12 ILE 198 -4.107 7.577 18.595 1.00 0.00 H -ATOM 3132 HG13 ILE 198 -5.820 7.656 18.298 1.00 0.00 H -ATOM 3133 CD1 ILE 198 -5.161 5.683 18.773 1.00 0.00 C -ATOM 3134 HD11 ILE 198 -5.130 5.873 19.846 1.00 0.00 H -ATOM 3135 HD12 ILE 198 -6.158 5.291 18.573 1.00 0.00 H -ATOM 3136 HD13 ILE 198 -4.382 4.955 18.545 1.00 0.00 H -ATOM 3137 C ILE 198 -4.452 8.418 14.452 1.00 0.00 C -ATOM 3138 O ILE 198 -3.383 8.903 14.225 1.00 0.00 O -ATOM 3139 N LEU 199 -5.211 7.892 13.515 1.00 0.00 N -ATOM 3140 H LEU 199 -6.062 7.501 13.893 1.00 0.00 H -ATOM 3141 CA LEU 199 -5.005 7.883 12.004 1.00 0.00 C -ATOM 3142 HA LEU 199 -4.025 7.475 11.758 1.00 0.00 H -ATOM 3143 CB LEU 199 -6.182 7.087 11.390 1.00 0.00 C -ATOM 3144 HB2 LEU 199 -6.140 6.074 11.793 1.00 0.00 H -ATOM 3145 HB3 LEU 199 -7.091 7.516 11.811 1.00 0.00 H -ATOM 3146 CG LEU 199 -6.293 7.079 9.821 1.00 0.00 C -ATOM 3147 HG LEU 199 -5.303 7.139 9.368 1.00 0.00 H -ATOM 3148 CD1 LEU 199 -7.106 5.904 9.316 1.00 0.00 C -ATOM 3149 HD11 LEU 199 -7.529 6.063 8.325 1.00 0.00 H -ATOM 3150 HD12 LEU 199 -6.481 5.011 9.281 1.00 0.00 H -ATOM 3151 HD13 LEU 199 -7.994 5.794 9.939 1.00 0.00 H -ATOM 3152 CD2 LEU 199 -7.006 8.333 9.139 1.00 0.00 C -ATOM 3153 HD21 LEU 199 -8.084 8.321 9.304 1.00 0.00 H -ATOM 3154 HD22 LEU 199 -6.598 9.222 9.620 1.00 0.00 H -ATOM 3155 HD23 LEU 199 -6.754 8.418 8.082 1.00 0.00 H -ATOM 3156 C LEU 199 -4.889 9.335 11.536 1.00 0.00 C -ATOM 3157 O LEU 199 -4.054 9.536 10.665 1.00 0.00 O -ATOM 3158 N GLU 200 -5.591 10.353 12.134 1.00 0.00 N -ATOM 3159 H GLU 200 -6.268 10.110 12.843 1.00 0.00 H -ATOM 3160 CA GLU 200 -5.420 11.819 11.813 1.00 0.00 C -ATOM 3161 HA GLU 200 -5.554 11.836 10.731 1.00 0.00 H -ATOM 3162 CB GLU 200 -6.566 12.690 12.400 1.00 0.00 C -ATOM 3163 HB2 GLU 200 -7.550 12.280 12.172 1.00 0.00 H -ATOM 3164 HB3 GLU 200 -6.568 12.720 13.489 1.00 0.00 H -ATOM 3165 CG GLU 200 -6.518 14.203 12.051 1.00 0.00 C -ATOM 3166 HG2 GLU 200 -7.259 14.739 12.645 1.00 0.00 H -ATOM 3167 HG3 GLU 200 -5.502 14.546 12.243 1.00 0.00 H -ATOM 3168 CD GLU 200 -6.845 14.431 10.590 1.00 0.00 C -ATOM 3169 OE1 GLU 200 -8.009 14.646 10.229 1.00 0.00 O -ATOM 3170 OE2 GLU 200 -5.996 14.346 9.692 1.00 0.00 O -ATOM 3171 C GLU 200 -3.995 12.317 12.260 1.00 0.00 C -ATOM 3172 O GLU 200 -3.386 12.989 11.428 1.00 0.00 O -ATOM 3173 N LYS 201 -3.521 11.964 13.460 1.00 0.00 N -ATOM 3174 H LYS 201 -4.199 11.654 14.141 1.00 0.00 H -ATOM 3175 CA LYS 201 -2.108 12.190 13.860 1.00 0.00 C -ATOM 3176 HA LYS 201 -1.917 13.230 13.596 1.00 0.00 H -ATOM 3177 CB LYS 201 -2.031 12.050 15.378 1.00 0.00 C -ATOM 3178 HB2 LYS 201 -2.768 12.727 15.809 1.00 0.00 H -ATOM 3179 HB3 LYS 201 -2.498 11.117 15.696 1.00 0.00 H -ATOM 3180 CG LYS 201 -0.605 12.362 15.964 1.00 0.00 C -ATOM 3181 HG2 LYS 201 0.209 11.800 15.506 1.00 0.00 H -ATOM 3182 HG3 LYS 201 -0.414 13.431 15.873 1.00 0.00 H -ATOM 3183 CD LYS 201 -0.597 12.221 17.519 1.00 0.00 C -ATOM 3184 HD2 LYS 201 -0.620 11.188 17.865 1.00 0.00 H -ATOM 3185 HD3 LYS 201 0.342 12.613 17.908 1.00 0.00 H -ATOM 3186 CE LYS 201 -1.680 13.127 18.234 1.00 0.00 C -ATOM 3187 HE2 LYS 201 -1.461 14.174 18.021 1.00 0.00 H -ATOM 3188 HE3 LYS 201 -2.651 12.794 17.867 1.00 0.00 H -ATOM 3189 NZ LYS 201 -1.744 12.882 19.709 1.00 0.00 N -ATOM 3190 HZ1 LYS 201 -2.372 13.565 20.107 1.00 0.00 H -ATOM 3191 HZ2 LYS 201 -2.185 12.012 19.972 1.00 0.00 H -ATOM 3192 HZ3 LYS 201 -0.880 12.937 20.230 1.00 0.00 H -ATOM 3193 C LYS 201 -1.045 11.282 13.170 1.00 0.00 C -ATOM 3194 O LYS 201 0.069 11.709 12.960 1.00 0.00 O -ATOM 3195 N GLY 202 -1.513 10.194 12.588 1.00 0.00 N -ATOM 3196 H GLY 202 -2.372 9.822 12.970 1.00 0.00 H -ATOM 3197 CA GLY 202 -0.799 9.569 11.444 1.00 0.00 C -ATOM 3198 HA2 GLY 202 0.211 9.419 11.828 1.00 0.00 H -ATOM 3199 HA3 GLY 202 -1.152 8.617 11.049 1.00 0.00 H -ATOM 3200 C GLY 202 -0.604 10.605 10.251 1.00 0.00 C -ATOM 3201 O GLY 202 0.577 10.890 9.896 1.00 0.00 O -ATOM 3202 N ALA 203 -1.697 11.152 9.711 1.00 0.00 N -ATOM 3203 H ALA 203 -2.654 10.898 9.909 1.00 0.00 H -ATOM 3204 CA ALA 203 -1.590 12.183 8.682 1.00 0.00 C -ATOM 3205 HA ALA 203 -1.005 11.867 7.818 1.00 0.00 H -ATOM 3206 CB ALA 203 -2.935 12.492 8.093 1.00 0.00 C -ATOM 3207 HB1 ALA 203 -2.832 13.163 7.240 1.00 0.00 H -ATOM 3208 HB2 ALA 203 -3.466 11.614 7.725 1.00 0.00 H -ATOM 3209 HB3 ALA 203 -3.502 13.036 8.848 1.00 0.00 H -ATOM 3210 C ALA 203 -0.927 13.554 9.044 1.00 0.00 C -ATOM 3211 O ALA 203 -0.136 14.148 8.240 1.00 0.00 O -ATOM 3212 N ALA 204 -1.087 14.049 10.221 1.00 0.00 N -ATOM 3213 H ALA 204 -1.753 13.536 10.781 1.00 0.00 H -ATOM 3214 CA ALA 204 -0.429 15.307 10.718 1.00 0.00 C -ATOM 3215 HA ALA 204 -0.776 16.139 10.106 1.00 0.00 H -ATOM 3216 CB ALA 204 -0.892 15.548 12.136 1.00 0.00 C -ATOM 3217 HB1 ALA 204 -0.621 16.558 12.440 1.00 0.00 H -ATOM 3218 HB2 ALA 204 -1.979 15.463 12.147 1.00 0.00 H -ATOM 3219 HB3 ALA 204 -0.388 14.869 12.824 1.00 0.00 H -ATOM 3220 C ALA 204 1.090 15.218 10.614 1.00 0.00 C -ATOM 3221 O ALA 204 1.651 16.111 10.084 1.00 0.00 O -ATOM 3222 N LYS 205 1.690 14.108 11.139 1.00 0.00 N -ATOM 3223 H LYS 205 1.150 13.361 11.551 1.00 0.00 H -ATOM 3224 CA LYS 205 3.182 13.925 11.016 1.00 0.00 C -ATOM 3225 HA LYS 205 3.641 14.767 11.533 1.00 0.00 H -ATOM 3226 CB LYS 205 3.566 12.701 11.800 1.00 0.00 C -ATOM 3227 HB2 LYS 205 3.044 11.780 11.539 1.00 0.00 H -ATOM 3228 HB3 LYS 205 4.599 12.514 11.508 1.00 0.00 H -ATOM 3229 CG LYS 205 3.474 12.910 13.262 1.00 0.00 C -ATOM 3230 HG2 LYS 205 4.202 13.659 13.574 1.00 0.00 H -ATOM 3231 HG3 LYS 205 2.474 13.258 13.523 1.00 0.00 H -ATOM 3232 CD LYS 205 3.965 11.584 13.898 1.00 0.00 C -ATOM 3233 HD2 LYS 205 3.244 10.772 13.801 1.00 0.00 H -ATOM 3234 HD3 LYS 205 4.927 11.288 13.480 1.00 0.00 H -ATOM 3235 CE LYS 205 4.278 11.740 15.362 1.00 0.00 C -ATOM 3236 HE2 LYS 205 4.922 12.591 15.581 1.00 0.00 H -ATOM 3237 HE3 LYS 205 3.358 11.930 15.915 1.00 0.00 H -ATOM 3238 NZ LYS 205 4.927 10.593 16.048 1.00 0.00 N -ATOM 3239 HZ1 LYS 205 5.896 10.498 15.779 1.00 0.00 H -ATOM 3240 HZ2 LYS 205 4.797 10.754 17.036 1.00 0.00 H -ATOM 3241 HZ3 LYS 205 4.356 9.791 15.822 1.00 0.00 H -ATOM 3242 C LYS 205 3.713 13.860 9.596 1.00 0.00 C -ATOM 3243 O LYS 205 4.726 14.535 9.420 1.00 0.00 O -ATOM 3244 N ARG 206 3.035 13.151 8.640 1.00 0.00 N -ATOM 3245 H ARG 206 2.265 12.583 8.961 1.00 0.00 H -ATOM 3246 CA ARG 206 3.356 13.237 7.223 1.00 0.00 C -ATOM 3247 HA ARG 206 4.366 12.866 7.046 1.00 0.00 H -ATOM 3248 CB ARG 206 2.406 12.365 6.433 1.00 0.00 C -ATOM 3249 HB2 ARG 206 1.371 12.599 6.680 1.00 0.00 H -ATOM 3250 HB3 ARG 206 2.559 12.539 5.368 1.00 0.00 H -ATOM 3251 CG ARG 206 2.671 10.872 6.675 1.00 0.00 C -ATOM 3252 HG2 ARG 206 3.688 10.599 6.395 1.00 0.00 H -ATOM 3253 HG3 ARG 206 2.718 10.677 7.746 1.00 0.00 H -ATOM 3254 CD ARG 206 1.593 10.049 6.030 1.00 0.00 C -ATOM 3255 HD2 ARG 206 0.677 10.454 6.460 1.00 0.00 H -ATOM 3256 HD3 ARG 206 1.518 10.176 4.950 1.00 0.00 H -ATOM 3257 NE ARG 206 1.757 8.686 6.522 1.00 0.00 N -ATOM 3258 HE ARG 206 2.557 8.157 6.207 1.00 0.00 H -ATOM 3259 CZ ARG 206 0.952 8.040 7.289 1.00 0.00 C -ATOM 3260 NH1 ARG 206 -0.245 8.408 7.476 1.00 0.00 N -ATOM 3261 HH11 ARG 206 -0.680 9.074 6.854 1.00 0.00 H -ATOM 3262 HH12 ARG 206 -0.899 7.873 8.029 1.00 0.00 H -ATOM 3263 NH2 ARG 206 1.390 6.966 7.863 1.00 0.00 N -ATOM 3264 HH21 ARG 206 2.338 6.763 7.582 1.00 0.00 H -ATOM 3265 HH22 ARG 206 0.768 6.238 8.184 1.00 0.00 H -ATOM 3266 C ARG 206 3.347 14.636 6.605 1.00 0.00 C -ATOM 3267 O ARG 206 4.283 14.984 5.907 1.00 0.00 O -ATOM 3268 N THR 207 2.277 15.389 6.864 1.00 0.00 N -ATOM 3269 H THR 207 1.527 14.933 7.364 1.00 0.00 H -ATOM 3270 CA THR 207 2.152 16.770 6.452 1.00 0.00 C -ATOM 3271 HA THR 207 2.382 16.797 5.387 1.00 0.00 H -ATOM 3272 CB THR 207 0.698 17.271 6.735 1.00 0.00 C -ATOM 3273 HB THR 207 0.508 16.905 7.744 1.00 0.00 H -ATOM 3274 CG2 THR 207 0.381 18.748 6.701 1.00 0.00 C -ATOM 3275 HG21 THR 207 0.382 19.021 5.645 1.00 0.00 H -ATOM 3276 HG22 THR 207 -0.627 19.035 7.000 1.00 0.00 H -ATOM 3277 HG23 THR 207 1.136 19.366 7.186 1.00 0.00 H -ATOM 3278 OG1 THR 207 -0.164 16.666 5.863 1.00 0.00 O -ATOM 3279 HG1 THR 207 -1.017 16.594 6.298 1.00 0.00 H -ATOM 3280 C THR 207 3.185 17.722 7.082 1.00 0.00 C -ATOM 3281 O THR 207 3.820 18.456 6.371 1.00 0.00 O -ATOM 3282 N THR 208 3.435 17.495 8.382 1.00 0.00 N -ATOM 3283 H THR 208 3.000 16.654 8.733 1.00 0.00 H -ATOM 3284 CA THR 208 4.625 18.093 9.073 1.00 0.00 C -ATOM 3285 HA THR 208 4.514 19.172 9.180 1.00 0.00 H -ATOM 3286 CB THR 208 4.607 17.695 10.542 1.00 0.00 C -ATOM 3287 HB THR 208 4.585 16.611 10.654 1.00 0.00 H -ATOM 3288 CG2 THR 208 5.715 18.335 11.374 1.00 0.00 C -ATOM 3289 HG21 THR 208 6.688 17.883 11.181 1.00 0.00 H -ATOM 3290 HG22 THR 208 5.833 19.369 11.049 1.00 0.00 H -ATOM 3291 HG23 THR 208 5.439 18.444 12.423 1.00 0.00 H -ATOM 3292 OG1 THR 208 3.341 18.106 11.076 1.00 0.00 O -ATOM 3293 HG1 THR 208 2.662 17.621 10.601 1.00 0.00 H -ATOM 3294 C THR 208 6.019 17.719 8.444 1.00 0.00 C -ATOM 3295 O THR 208 6.822 18.593 8.276 1.00 0.00 O -ATOM 3296 N ALA 209 6.245 16.532 7.956 1.00 0.00 N -ATOM 3297 H ALA 209 5.603 15.800 8.226 1.00 0.00 H -ATOM 3298 CA ALA 209 7.599 16.123 7.545 1.00 0.00 C -ATOM 3299 HA ALA 209 8.331 16.400 8.305 1.00 0.00 H -ATOM 3300 CB ALA 209 7.597 14.625 7.527 1.00 0.00 C -ATOM 3301 HB1 ALA 209 7.045 14.231 8.380 1.00 0.00 H -ATOM 3302 HB2 ALA 209 6.993 14.226 6.712 1.00 0.00 H -ATOM 3303 HB3 ALA 209 8.626 14.266 7.503 1.00 0.00 H -ATOM 3304 C ALA 209 8.161 16.867 6.373 1.00 0.00 C -ATOM 3305 O ALA 209 9.350 17.220 6.342 1.00 0.00 O -ATOM 3306 N ALA 210 7.330 17.032 5.388 1.00 0.00 N -ATOM 3307 H ALA 210 6.380 16.788 5.628 1.00 0.00 H -ATOM 3308 CA ALA 210 7.530 17.897 4.149 1.00 0.00 C -ATOM 3309 HA ALA 210 8.329 17.484 3.532 1.00 0.00 H -ATOM 3310 CB ALA 210 6.225 17.871 3.317 1.00 0.00 C -ATOM 3311 HB1 ALA 210 6.422 18.219 2.303 1.00 0.00 H -ATOM 3312 HB2 ALA 210 5.820 16.859 3.301 1.00 0.00 H -ATOM 3313 HB3 ALA 210 5.453 18.502 3.757 1.00 0.00 H -ATOM 3314 C ALA 210 7.919 19.375 4.478 1.00 0.00 C -ATOM 3315 O ALA 210 8.575 19.989 3.604 1.00 0.00 O -ATOM 3316 N THR 211 7.436 19.891 5.578 1.00 0.00 N -ATOM 3317 H THR 211 6.855 19.352 6.204 1.00 0.00 H -ATOM 3318 CA THR 211 7.883 21.153 6.062 1.00 0.00 C -ATOM 3319 HA THR 211 7.927 21.830 5.209 1.00 0.00 H -ATOM 3320 CB THR 211 6.839 21.703 7.035 1.00 0.00 C -ATOM 3321 HB THR 211 6.626 21.042 7.875 1.00 0.00 H -ATOM 3322 CG2 THR 211 7.199 23.063 7.626 1.00 0.00 C -ATOM 3323 HG21 THR 211 7.333 23.614 6.695 1.00 0.00 H -ATOM 3324 HG22 THR 211 6.393 23.445 8.252 1.00 0.00 H -ATOM 3325 HG23 THR 211 8.166 22.950 8.117 1.00 0.00 H -ATOM 3326 OG1 THR 211 5.564 21.770 6.489 1.00 0.00 O -ATOM 3327 HG1 THR 211 5.327 20.999 5.967 1.00 0.00 H -ATOM 3328 C THR 211 9.375 21.100 6.599 1.00 0.00 C -ATOM 3329 O THR 211 10.137 21.976 6.290 1.00 0.00 O -ATOM 3330 N LEU 212 9.814 20.034 7.330 1.00 0.00 N -ATOM 3331 H LEU 212 9.153 19.334 7.638 1.00 0.00 H -ATOM 3332 CA LEU 212 11.171 19.885 7.883 1.00 0.00 C -ATOM 3333 HA LEU 212 11.547 20.808 8.324 1.00 0.00 H -ATOM 3334 CB LEU 212 11.201 18.828 8.995 1.00 0.00 C -ATOM 3335 HB2 LEU 212 11.000 17.857 8.543 1.00 0.00 H -ATOM 3336 HB3 LEU 212 12.256 18.690 9.234 1.00 0.00 H -ATOM 3337 CG LEU 212 10.280 19.009 10.218 1.00 0.00 C -ATOM 3338 HG LEU 212 9.286 19.296 9.875 1.00 0.00 H -ATOM 3339 CD1 LEU 212 10.157 17.776 11.081 1.00 0.00 C -ATOM 3340 HD11 LEU 212 9.658 16.999 10.501 1.00 0.00 H -ATOM 3341 HD12 LEU 212 11.152 17.502 11.431 1.00 0.00 H -ATOM 3342 HD13 LEU 212 9.482 18.141 11.855 1.00 0.00 H -ATOM 3343 CD2 LEU 212 10.744 20.194 11.108 1.00 0.00 C -ATOM 3344 HD21 LEU 212 10.729 21.114 10.523 1.00 0.00 H -ATOM 3345 HD22 LEU 212 10.116 20.253 11.997 1.00 0.00 H -ATOM 3346 HD23 LEU 212 11.779 19.971 11.370 1.00 0.00 H -ATOM 3347 C LEU 212 12.215 19.580 6.735 1.00 0.00 C -ATOM 3348 O LEU 212 13.191 20.326 6.562 1.00 0.00 O -ATOM 3349 N MET 213 11.947 18.543 5.880 1.00 0.00 N -ATOM 3350 H MET 213 11.089 18.032 6.033 1.00 0.00 H -ATOM 3351 CA MET 213 12.725 18.331 4.679 1.00 0.00 C -ATOM 3352 HA MET 213 13.292 19.168 4.270 1.00 0.00 H -ATOM 3353 CB MET 213 13.807 17.301 4.966 1.00 0.00 C -ATOM 3354 HB2 MET 213 13.327 16.359 5.231 1.00 0.00 H -ATOM 3355 HB3 MET 213 14.269 17.047 4.012 1.00 0.00 H -ATOM 3356 CG MET 213 14.864 17.682 5.989 1.00 0.00 C -ATOM 3357 HG2 MET 213 15.113 18.707 5.712 1.00 0.00 H -ATOM 3358 HG3 MET 213 14.423 17.794 6.979 1.00 0.00 H -ATOM 3359 SD MET 213 16.523 16.735 5.981 1.00 0.00 S -ATOM 3360 CE MET 213 17.047 16.954 4.288 1.00 0.00 C -ATOM 3361 HE1 MET 213 18.014 16.504 4.064 1.00 0.00 H -ATOM 3362 HE2 MET 213 16.341 16.358 3.709 1.00 0.00 H -ATOM 3363 HE3 MET 213 17.039 18.023 4.073 1.00 0.00 H -ATOM 3364 C MET 213 11.837 17.878 3.526 1.00 0.00 C -ATOM 3365 O MET 213 11.190 16.814 3.623 1.00 0.00 O -ATOM 3366 N ASN 214 11.816 18.619 2.436 1.00 0.00 N -ATOM 3367 H ASN 214 12.447 19.408 2.419 1.00 0.00 H -ATOM 3368 CA ASN 214 10.735 18.502 1.378 1.00 0.00 C -ATOM 3369 HA ASN 214 9.766 18.821 1.760 1.00 0.00 H -ATOM 3370 CB ASN 214 11.084 19.366 0.156 1.00 0.00 C -ATOM 3371 HB2 ASN 214 11.053 20.414 0.454 1.00 0.00 H -ATOM 3372 HB3 ASN 214 12.114 19.184 -0.151 1.00 0.00 H -ATOM 3373 CG ASN 214 10.266 19.147 -1.110 1.00 0.00 C -ATOM 3374 OD1 ASN 214 10.761 18.520 -2.000 1.00 0.00 O -ATOM 3375 ND2 ASN 214 9.115 19.680 -1.299 1.00 0.00 N -ATOM 3376 HD21 ASN 214 8.617 19.644 -2.177 1.00 0.00 H -ATOM 3377 HD22 ASN 214 8.666 20.296 -0.636 1.00 0.00 H -ATOM 3378 C ASN 214 10.531 17.096 0.902 1.00 0.00 C -ATOM 3379 O ASN 214 9.445 16.708 0.581 1.00 0.00 O -ATOM 3380 N ALA 215 11.611 16.286 0.858 1.00 0.00 N -ATOM 3381 H ALA 215 12.524 16.683 1.029 1.00 0.00 H -ATOM 3382 CA ALA 215 11.715 14.900 0.388 1.00 0.00 C -ATOM 3383 HA ALA 215 11.362 14.975 -0.640 1.00 0.00 H -ATOM 3384 CB ALA 215 13.123 14.397 0.478 1.00 0.00 C -ATOM 3385 HB1 ALA 215 13.410 14.334 1.528 1.00 0.00 H -ATOM 3386 HB2 ALA 215 13.159 13.391 0.060 1.00 0.00 H -ATOM 3387 HB3 ALA 215 13.688 15.135 -0.091 1.00 0.00 H -ATOM 3388 C ALA 215 10.826 13.954 1.201 1.00 0.00 C -ATOM 3389 O ALA 215 10.398 13.006 0.567 1.00 0.00 O -ATOM 3390 N TYR 216 10.415 14.225 2.413 1.00 0.00 N -ATOM 3391 H TYR 216 10.804 15.012 2.913 1.00 0.00 H -ATOM 3392 CA TYR 216 9.346 13.489 3.072 1.00 0.00 C -ATOM 3393 HA TYR 216 9.708 12.463 3.135 1.00 0.00 H -ATOM 3394 CB TYR 216 9.213 13.993 4.527 1.00 0.00 C -ATOM 3395 HB2 TYR 216 9.444 15.054 4.620 1.00 0.00 H -ATOM 3396 HB3 TYR 216 8.167 14.048 4.828 1.00 0.00 H -ATOM 3397 CG TYR 216 9.950 13.224 5.565 1.00 0.00 C -ATOM 3398 CD1 TYR 216 9.417 12.015 6.038 1.00 0.00 C -ATOM 3399 HD1 TYR 216 8.409 11.743 5.759 1.00 0.00 H -ATOM 3400 CE1 TYR 216 10.204 11.224 6.946 1.00 0.00 C -ATOM 3401 HE1 TYR 216 9.801 10.269 7.248 1.00 0.00 H -ATOM 3402 CZ TYR 216 11.426 11.724 7.479 1.00 0.00 C -ATOM 3403 OH TYR 216 12.213 10.896 8.217 1.00 0.00 O -ATOM 3404 HH TYR 216 13.120 11.209 8.202 1.00 0.00 H -ATOM 3405 CE2 TYR 216 11.932 12.961 7.000 1.00 0.00 C -ATOM 3406 HE2 TYR 216 12.910 13.305 7.303 1.00 0.00 H -ATOM 3407 CD2 TYR 216 11.246 13.699 5.962 1.00 0.00 C -ATOM 3408 HD2 TYR 216 11.746 14.536 5.497 1.00 0.00 H -ATOM 3409 C TYR 216 7.948 13.573 2.366 1.00 0.00 C -ATOM 3410 O TYR 216 7.095 12.722 2.589 1.00 0.00 O -ATOM 3411 N SER 217 7.689 14.594 1.527 1.00 0.00 N -ATOM 3412 H SER 217 8.392 15.310 1.410 1.00 0.00 H -ATOM 3413 CA SER 217 6.473 14.687 0.689 1.00 0.00 C -ATOM 3414 HA SER 217 5.612 14.604 1.352 1.00 0.00 H -ATOM 3415 CB SER 217 6.343 16.063 0.062 1.00 0.00 C -ATOM 3416 HB2 SER 217 5.350 16.135 -0.381 1.00 0.00 H -ATOM 3417 HB3 SER 217 6.358 16.792 0.871 1.00 0.00 H -ATOM 3418 OG SER 217 7.328 16.419 -0.949 1.00 0.00 O -ATOM 3419 HG SER 217 8.182 16.691 -0.605 1.00 0.00 H -ATOM 3420 C SER 217 6.376 13.599 -0.391 1.00 0.00 C -ATOM 3421 O SER 217 5.298 13.358 -1.006 1.00 0.00 O -ATOM 3422 N SER 218 7.522 12.887 -0.642 1.00 0.00 N -ATOM 3423 H SER 218 8.418 13.163 -0.267 1.00 0.00 H -ATOM 3424 CA SER 218 7.611 12.049 -1.883 1.00 0.00 C -ATOM 3425 HA SER 218 6.578 11.773 -2.093 1.00 0.00 H -ATOM 3426 CB SER 218 8.252 12.899 -3.034 1.00 0.00 C -ATOM 3427 HB2 SER 218 8.313 12.345 -3.971 1.00 0.00 H -ATOM 3428 HB3 SER 218 7.644 13.799 -3.127 1.00 0.00 H -ATOM 3429 OG SER 218 9.574 13.378 -2.701 1.00 0.00 O -ATOM 3430 HG SER 218 9.459 14.323 -2.820 1.00 0.00 H -ATOM 3431 C SER 218 8.446 10.764 -1.699 1.00 0.00 C -ATOM 3432 O SER 218 8.094 9.750 -2.333 1.00 0.00 O -ATOM 3433 N ARG 219 9.594 10.763 -0.969 1.00 0.00 N -ATOM 3434 H ARG 219 9.929 11.645 -0.610 1.00 0.00 H -ATOM 3435 CA ARG 219 10.518 9.567 -0.814 1.00 0.00 C -ATOM 3436 HA ARG 219 10.309 8.805 -1.565 1.00 0.00 H -ATOM 3437 CB ARG 219 12.012 10.054 -0.910 1.00 0.00 C -ATOM 3438 HB2 ARG 219 12.345 10.484 0.035 1.00 0.00 H -ATOM 3439 HB3 ARG 219 12.667 9.194 -1.051 1.00 0.00 H -ATOM 3440 CG ARG 219 12.326 11.223 -1.802 1.00 0.00 C -ATOM 3441 HG2 ARG 219 11.698 12.086 -1.579 1.00 0.00 H -ATOM 3442 HG3 ARG 219 13.389 11.436 -1.681 1.00 0.00 H -ATOM 3443 CD ARG 219 11.994 10.780 -3.247 1.00 0.00 C -ATOM 3444 HD2 ARG 219 12.727 10.038 -3.566 1.00 0.00 H -ATOM 3445 HD3 ARG 219 11.110 10.150 -3.146 1.00 0.00 H -ATOM 3446 NE ARG 219 11.895 11.897 -4.177 1.00 0.00 N -ATOM 3447 HE ARG 219 12.344 12.726 -3.814 1.00 0.00 H -ATOM 3448 CZ ARG 219 11.174 11.913 -5.257 1.00 0.00 C -ATOM 3449 NH1 ARG 219 10.426 10.913 -5.603 1.00 0.00 N -ATOM 3450 HH11 ARG 219 10.451 10.080 -5.031 1.00 0.00 H -ATOM 3451 HH12 ARG 219 9.862 11.028 -6.433 1.00 0.00 H -ATOM 3452 NH2 ARG 219 11.106 12.899 -6.103 1.00 0.00 N -ATOM 3453 HH21 ARG 219 11.617 13.769 -6.061 1.00 0.00 H -ATOM 3454 HH22 ARG 219 10.496 12.858 -6.907 1.00 0.00 H -ATOM 3455 C ARG 219 10.313 8.772 0.522 1.00 0.00 C -ATOM 3456 O ARG 219 11.123 7.822 0.701 1.00 0.00 O -ATOM 3457 N SER 220 9.350 9.019 1.349 1.00 0.00 N -ATOM 3458 H SER 220 8.773 9.821 1.143 1.00 0.00 H -ATOM 3459 CA SER 220 8.928 8.195 2.540 1.00 0.00 C -ATOM 3460 HA SER 220 9.728 7.572 2.939 1.00 0.00 H -ATOM 3461 CB SER 220 8.712 9.112 3.769 1.00 0.00 C -ATOM 3462 HB2 SER 220 8.542 8.554 4.690 1.00 0.00 H -ATOM 3463 HB3 SER 220 9.573 9.779 3.805 1.00 0.00 H -ATOM 3464 OG SER 220 7.553 9.865 3.522 1.00 0.00 O -ATOM 3465 HG SER 220 6.732 9.513 3.875 1.00 0.00 H -ATOM 3466 C SER 220 7.772 7.285 2.242 1.00 0.00 C -ATOM 3467 O SER 220 6.862 7.674 1.476 1.00 0.00 O -ATOM 3468 N HIE 221 7.806 6.086 2.780 1.00 0.00 N -ATOM 3469 H HIE 221 8.522 5.883 3.463 1.00 0.00 H -ATOM 3470 CA HIE 221 6.794 4.961 2.581 1.00 0.00 C -ATOM 3471 HA HIE 221 6.202 5.057 1.671 1.00 0.00 H -ATOM 3472 CB HIE 221 7.592 3.672 2.418 1.00 0.00 C -ATOM 3473 HB2 HIE 221 8.042 3.484 3.393 1.00 0.00 H -ATOM 3474 HB3 HIE 221 6.820 2.932 2.212 1.00 0.00 H -ATOM 3475 CG HIE 221 8.694 3.630 1.346 1.00 0.00 C -ATOM 3476 ND1 HIE 221 8.552 3.152 0.065 1.00 0.00 N -ATOM 3477 CE1 HIE 221 9.784 3.084 -0.469 1.00 0.00 C -ATOM 3478 HE1 HIE 221 10.040 2.767 -1.469 1.00 0.00 H -ATOM 3479 NE2 HIE 221 10.619 3.642 0.380 1.00 0.00 N -ATOM 3480 HE2 HIE 221 11.602 3.614 0.150 1.00 0.00 H -ATOM 3481 CD2 HIE 221 9.971 4.010 1.549 1.00 0.00 C -ATOM 3482 HD2 HIE 221 10.385 4.145 2.537 1.00 0.00 H -ATOM 3483 C HIE 221 5.879 4.876 3.811 1.00 0.00 C -ATOM 3484 O HIE 221 6.373 4.736 4.974 1.00 0.00 O -ATOM 3485 N SER 222 4.532 4.931 3.629 1.00 0.00 N -ATOM 3486 H SER 222 4.236 4.796 2.672 1.00 0.00 H -ATOM 3487 CA SER 222 3.538 4.612 4.747 1.00 0.00 C -ATOM 3488 HA SER 222 4.066 4.845 5.671 1.00 0.00 H -ATOM 3489 CB SER 222 2.263 5.443 4.503 1.00 0.00 C -ATOM 3490 HB2 SER 222 1.736 4.952 3.685 1.00 0.00 H -ATOM 3491 HB3 SER 222 1.658 5.219 5.381 1.00 0.00 H -ATOM 3492 OG SER 222 2.544 6.837 4.248 1.00 0.00 O -ATOM 3493 HG SER 222 3.210 7.141 4.869 1.00 0.00 H -ATOM 3494 C SER 222 3.031 3.157 4.795 1.00 0.00 C -ATOM 3495 O SER 222 2.785 2.586 3.756 1.00 0.00 O -ATOM 3496 N VAL 223 2.887 2.602 6.033 1.00 0.00 N -ATOM 3497 H VAL 223 3.301 3.105 6.805 1.00 0.00 H -ATOM 3498 CA VAL 223 2.318 1.278 6.331 1.00 0.00 C -ATOM 3499 HA VAL 223 1.804 0.876 5.458 1.00 0.00 H -ATOM 3500 CB VAL 223 3.376 0.276 6.840 1.00 0.00 C -ATOM 3501 HB VAL 223 3.771 0.672 7.775 1.00 0.00 H -ATOM 3502 CG1 VAL 223 2.712 -1.066 7.091 1.00 0.00 C -ATOM 3503 HG11 VAL 223 2.069 -1.386 6.270 1.00 0.00 H -ATOM 3504 HG12 VAL 223 3.501 -1.806 7.228 1.00 0.00 H -ATOM 3505 HG13 VAL 223 2.054 -1.115 7.959 1.00 0.00 H -ATOM 3506 CG2 VAL 223 4.602 0.078 6.002 1.00 0.00 C -ATOM 3507 HG21 VAL 223 4.348 -0.340 5.028 1.00 0.00 H -ATOM 3508 HG22 VAL 223 5.016 1.085 5.946 1.00 0.00 H -ATOM 3509 HG23 VAL 223 5.375 -0.533 6.469 1.00 0.00 H -ATOM 3510 C VAL 223 1.259 1.380 7.433 1.00 0.00 C -ATOM 3511 O VAL 223 1.598 1.873 8.473 1.00 0.00 O -ATOM 3512 N PHE 224 0.047 0.809 7.193 1.00 0.00 N -ATOM 3513 H PHE 224 -0.118 0.414 6.278 1.00 0.00 H -ATOM 3514 CA PHE 224 -0.955 0.519 8.156 1.00 0.00 C -ATOM 3515 HA PHE 224 -0.710 0.976 9.114 1.00 0.00 H -ATOM 3516 CB PHE 224 -2.265 1.164 7.708 1.00 0.00 C -ATOM 3517 HB2 PHE 224 -2.144 2.247 7.719 1.00 0.00 H -ATOM 3518 HB3 PHE 224 -2.446 0.896 6.667 1.00 0.00 H -ATOM 3519 CG PHE 224 -3.437 0.806 8.530 1.00 0.00 C -ATOM 3520 CD1 PHE 224 -4.298 -0.214 8.131 1.00 0.00 C -ATOM 3521 HD1 PHE 224 -4.047 -0.930 7.363 1.00 0.00 H -ATOM 3522 CE1 PHE 224 -5.491 -0.477 8.779 1.00 0.00 C -ATOM 3523 HE1 PHE 224 -6.154 -1.289 8.520 1.00 0.00 H -ATOM 3524 CZ PHE 224 -5.907 0.458 9.744 1.00 0.00 C -ATOM 3525 HZ PHE 224 -6.897 0.284 10.139 1.00 0.00 H -ATOM 3526 CE2 PHE 224 -5.087 1.496 10.147 1.00 0.00 C -ATOM 3527 HE2 PHE 224 -5.452 2.251 10.827 1.00 0.00 H -ATOM 3528 CD2 PHE 224 -3.828 1.688 9.566 1.00 0.00 C -ATOM 3529 HD2 PHE 224 -3.237 2.566 9.779 1.00 0.00 H -ATOM 3530 C PHE 224 -0.982 -1.014 8.344 1.00 0.00 C -ATOM 3531 O PHE 224 -0.728 -1.735 7.406 1.00 0.00 O -ATOM 3532 N SER 225 -1.374 -1.486 9.556 1.00 0.00 N -ATOM 3533 H SER 225 -1.410 -0.835 10.328 1.00 0.00 H -ATOM 3534 CA SER 225 -1.533 -2.885 9.801 1.00 0.00 C -ATOM 3535 HA SER 225 -1.953 -3.304 8.886 1.00 0.00 H -ATOM 3536 CB SER 225 -0.266 -3.573 10.266 1.00 0.00 C -ATOM 3537 HB2 SER 225 0.567 -3.456 9.573 1.00 0.00 H -ATOM 3538 HB3 SER 225 -0.026 -3.304 11.294 1.00 0.00 H -ATOM 3539 OG SER 225 -0.556 -4.943 10.263 1.00 0.00 O -ATOM 3540 HG SER 225 -0.386 -5.236 9.365 1.00 0.00 H -ATOM 3541 C SER 225 -2.667 -3.086 10.851 1.00 0.00 C -ATOM 3542 O SER 225 -2.676 -2.493 11.936 1.00 0.00 O -ATOM 3543 N VAL 226 -3.658 -3.934 10.465 1.00 0.00 N -ATOM 3544 H VAL 226 -3.672 -4.425 9.582 1.00 0.00 H -ATOM 3545 CA VAL 226 -4.795 -4.361 11.363 1.00 0.00 C -ATOM 3546 HA VAL 226 -4.742 -3.828 12.312 1.00 0.00 H -ATOM 3547 CB VAL 226 -6.106 -3.713 10.810 1.00 0.00 C -ATOM 3548 HB VAL 226 -5.906 -2.642 10.774 1.00 0.00 H -ATOM 3549 CG1 VAL 226 -6.599 -4.229 9.473 1.00 0.00 C -ATOM 3550 HG11 VAL 226 -6.810 -5.295 9.560 1.00 0.00 H -ATOM 3551 HG12 VAL 226 -7.454 -3.644 9.136 1.00 0.00 H -ATOM 3552 HG13 VAL 226 -5.795 -4.141 8.742 1.00 0.00 H -ATOM 3553 CG2 VAL 226 -7.259 -3.838 11.820 1.00 0.00 C -ATOM 3554 HG21 VAL 226 -6.893 -3.532 12.800 1.00 0.00 H -ATOM 3555 HG22 VAL 226 -8.062 -3.139 11.588 1.00 0.00 H -ATOM 3556 HG23 VAL 226 -7.566 -4.882 11.765 1.00 0.00 H -ATOM 3557 C VAL 226 -4.907 -5.869 11.480 1.00 0.00 C -ATOM 3558 O VAL 226 -4.863 -6.643 10.510 1.00 0.00 O -ATOM 3559 N THR 227 -4.880 -6.336 12.750 1.00 0.00 N -ATOM 3560 H THR 227 -4.936 -5.724 13.551 1.00 0.00 H -ATOM 3561 CA THR 227 -4.922 -7.729 13.103 1.00 0.00 C -ATOM 3562 HA THR 227 -4.927 -8.441 12.277 1.00 0.00 H -ATOM 3563 CB THR 227 -3.718 -8.009 14.101 1.00 0.00 C -ATOM 3564 HB THR 227 -3.727 -7.445 15.034 1.00 0.00 H -ATOM 3565 CG2 THR 227 -3.663 -9.464 14.301 1.00 0.00 C -ATOM 3566 HG21 THR 227 -2.828 -9.806 14.913 1.00 0.00 H -ATOM 3567 HG22 THR 227 -4.518 -9.701 14.933 1.00 0.00 H -ATOM 3568 HG23 THR 227 -3.855 -9.984 13.363 1.00 0.00 H -ATOM 3569 OG1 THR 227 -2.551 -7.643 13.353 1.00 0.00 O -ATOM 3570 HG1 THR 227 -2.621 -6.690 13.264 1.00 0.00 H -ATOM 3571 C THR 227 -6.260 -8.030 13.865 1.00 0.00 C -ATOM 3572 O THR 227 -6.577 -7.297 14.772 1.00 0.00 O -ATOM 3573 N ILE 228 -6.904 -9.162 13.514 1.00 0.00 N -ATOM 3574 H ILE 228 -6.533 -9.702 12.746 1.00 0.00 H -ATOM 3575 CA ILE 228 -8.327 -9.446 13.905 1.00 0.00 C -ATOM 3576 HA ILE 228 -8.580 -8.725 14.682 1.00 0.00 H -ATOM 3577 CB ILE 228 -9.290 -9.309 12.653 1.00 0.00 C -ATOM 3578 HB ILE 228 -9.021 -10.109 11.964 1.00 0.00 H -ATOM 3579 CG2 ILE 228 -10.810 -9.590 13.100 1.00 0.00 C -ATOM 3580 HG21 ILE 228 -11.183 -8.772 13.716 1.00 0.00 H -ATOM 3581 HG22 ILE 228 -11.474 -9.755 12.252 1.00 0.00 H -ATOM 3582 HG23 ILE 228 -10.774 -10.576 13.565 1.00 0.00 H -ATOM 3583 CG1 ILE 228 -9.100 -7.896 11.964 1.00 0.00 C -ATOM 3584 HG12 ILE 228 -10.091 -7.653 11.580 1.00 0.00 H -ATOM 3585 HG13 ILE 228 -8.817 -7.092 12.643 1.00 0.00 H -ATOM 3586 CD1 ILE 228 -8.125 -7.974 10.802 1.00 0.00 C -ATOM 3587 HD11 ILE 228 -8.492 -8.657 10.036 1.00 0.00 H -ATOM 3588 HD12 ILE 228 -8.168 -6.967 10.386 1.00 0.00 H -ATOM 3589 HD13 ILE 228 -7.177 -8.304 11.227 1.00 0.00 H -ATOM 3590 C ILE 228 -8.349 -10.793 14.640 1.00 0.00 C -ATOM 3591 O ILE 228 -8.513 -11.843 14.001 1.00 0.00 O -ATOM 3592 N HIE 229 -8.272 -10.826 15.929 1.00 0.00 N -ATOM 3593 H HIE 229 -8.265 -9.955 16.441 1.00 0.00 H -ATOM 3594 CA HIE 229 -8.545 -12.048 16.688 1.00 0.00 C -ATOM 3595 HA HIE 229 -7.887 -12.810 16.273 1.00 0.00 H -ATOM 3596 CB HIE 229 -7.853 -11.874 18.106 1.00 0.00 C -ATOM 3597 HB2 HIE 229 -8.201 -10.966 18.598 1.00 0.00 H -ATOM 3598 HB3 HIE 229 -7.934 -12.708 18.802 1.00 0.00 H -ATOM 3599 CG HIE 229 -6.351 -11.607 18.066 1.00 0.00 C -ATOM 3600 ND1 HIE 229 -5.699 -10.454 17.508 1.00 0.00 N -ATOM 3601 CE1 HIE 229 -4.423 -10.529 17.872 1.00 0.00 C -ATOM 3602 HE1 HIE 229 -3.702 -9.765 17.623 1.00 0.00 H -ATOM 3603 NE2 HIE 229 -4.226 -11.625 18.600 1.00 0.00 N -ATOM 3604 HE2 HIE 229 -3.402 -11.808 19.155 1.00 0.00 H -ATOM 3605 CD2 HIE 229 -5.375 -12.293 18.729 1.00 0.00 C -ATOM 3606 HD2 HIE 229 -5.553 -13.172 19.330 1.00 0.00 H -ATOM 3607 C HIE 229 -10.039 -12.490 16.717 1.00 0.00 C -ATOM 3608 O HIE 229 -10.935 -11.674 16.677 1.00 0.00 O -ATOM 3609 N MET 230 -10.259 -13.796 16.665 1.00 0.00 N -ATOM 3610 H MET 230 -9.481 -14.425 16.801 1.00 0.00 H -ATOM 3611 CA MET 230 -11.609 -14.408 16.461 1.00 0.00 C -ATOM 3612 HA MET 230 -12.375 -13.759 16.886 1.00 0.00 H -ATOM 3613 CB MET 230 -11.852 -14.726 14.936 1.00 0.00 C -ATOM 3614 HB2 MET 230 -11.013 -15.248 14.475 1.00 0.00 H -ATOM 3615 HB3 MET 230 -12.762 -15.312 14.807 1.00 0.00 H -ATOM 3616 CG MET 230 -12.084 -13.425 14.159 1.00 0.00 C -ATOM 3617 HG2 MET 230 -12.968 -12.936 14.567 1.00 0.00 H -ATOM 3618 HG3 MET 230 -11.225 -12.772 14.317 1.00 0.00 H -ATOM 3619 SD MET 230 -12.414 -13.712 12.433 1.00 0.00 S -ATOM 3620 CE MET 230 -10.685 -13.621 11.853 1.00 0.00 C -ATOM 3621 HE1 MET 230 -9.998 -14.233 12.437 1.00 0.00 H -ATOM 3622 HE2 MET 230 -10.656 -13.711 10.767 1.00 0.00 H -ATOM 3623 HE3 MET 230 -10.349 -12.595 12.001 1.00 0.00 H -ATOM 3624 C MET 230 -11.606 -15.699 17.304 1.00 0.00 C -ATOM 3625 O MET 230 -10.614 -16.418 17.262 1.00 0.00 O -ATOM 3626 N LYS 231 -12.732 -16.068 17.959 1.00 0.00 N -ATOM 3627 H LYS 231 -13.537 -15.555 17.630 1.00 0.00 H -ATOM 3628 CA LYS 231 -12.841 -17.251 18.746 1.00 0.00 C -ATOM 3629 HA LYS 231 -11.856 -17.425 19.179 1.00 0.00 H -ATOM 3630 CB LYS 231 -13.846 -17.028 19.885 1.00 0.00 C -ATOM 3631 HB2 LYS 231 -13.789 -16.006 20.260 1.00 0.00 H -ATOM 3632 HB3 LYS 231 -14.885 -17.158 19.583 1.00 0.00 H -ATOM 3633 CG LYS 231 -13.606 -17.979 21.056 1.00 0.00 C -ATOM 3634 HG2 LYS 231 -13.539 -19.006 20.699 1.00 0.00 H -ATOM 3635 HG3 LYS 231 -12.680 -17.595 21.483 1.00 0.00 H -ATOM 3636 CD LYS 231 -14.640 -17.921 22.204 1.00 0.00 C -ATOM 3637 HD2 LYS 231 -14.433 -16.940 22.631 1.00 0.00 H -ATOM 3638 HD3 LYS 231 -15.699 -18.045 21.977 1.00 0.00 H -ATOM 3639 CE LYS 231 -14.167 -18.977 23.192 1.00 0.00 C -ATOM 3640 HE2 LYS 231 -14.211 -19.973 22.752 1.00 0.00 H -ATOM 3641 HE3 LYS 231 -13.110 -18.792 23.384 1.00 0.00 H -ATOM 3642 NZ LYS 231 -14.962 -18.998 24.375 1.00 0.00 N -ATOM 3643 HZ1 LYS 231 -15.809 -19.534 24.250 1.00 0.00 H -ATOM 3644 HZ2 LYS 231 -14.352 -19.319 25.114 1.00 0.00 H -ATOM 3645 HZ3 LYS 231 -15.217 -18.055 24.634 1.00 0.00 H -ATOM 3646 C LYS 231 -13.188 -18.481 17.929 1.00 0.00 C -ATOM 3647 O LYS 231 -14.110 -18.412 17.183 1.00 0.00 O -ATOM 3648 N GLU 232 -12.376 -19.549 18.115 1.00 0.00 N -ATOM 3649 H GLU 232 -11.770 -19.605 18.921 1.00 0.00 H -ATOM 3650 CA GLU 232 -12.656 -20.837 17.443 1.00 0.00 C -ATOM 3651 HA GLU 232 -13.273 -20.539 16.595 1.00 0.00 H -ATOM 3652 CB GLU 232 -11.322 -21.383 16.840 1.00 0.00 C -ATOM 3653 HB2 GLU 232 -10.732 -20.578 16.403 1.00 0.00 H -ATOM 3654 HB3 GLU 232 -10.640 -21.726 17.618 1.00 0.00 H -ATOM 3655 CG GLU 232 -11.446 -22.595 15.906 1.00 0.00 C -ATOM 3656 HG2 GLU 232 -10.502 -22.827 15.414 1.00 0.00 H -ATOM 3657 HG3 GLU 232 -11.744 -23.452 16.510 1.00 0.00 H -ATOM 3658 CD GLU 232 -12.561 -22.380 14.857 1.00 0.00 C -ATOM 3659 OE1 GLU 232 -13.525 -23.186 14.838 1.00 0.00 O -ATOM 3660 OE2 GLU 232 -12.413 -21.432 14.067 1.00 0.00 O -ATOM 3661 C GLU 232 -13.469 -21.782 18.356 1.00 0.00 C -ATOM 3662 O GLU 232 -12.941 -22.309 19.317 1.00 0.00 O -ATOM 3663 N THR 233 -14.741 -21.926 18.144 1.00 0.00 N -ATOM 3664 H THR 233 -15.191 -21.660 17.280 1.00 0.00 H -ATOM 3665 CA THR 233 -15.697 -22.465 19.183 1.00 0.00 C -ATOM 3666 HA THR 233 -15.457 -22.085 20.176 1.00 0.00 H -ATOM 3667 CB THR 233 -17.153 -22.131 18.772 1.00 0.00 C -ATOM 3668 HB THR 233 -17.219 -22.259 17.692 1.00 0.00 H -ATOM 3669 CG2 THR 233 -18.361 -22.755 19.516 1.00 0.00 C -ATOM 3670 HG21 THR 233 -19.296 -22.251 19.270 1.00 0.00 H -ATOM 3671 HG22 THR 233 -18.400 -23.750 19.072 1.00 0.00 H -ATOM 3672 HG23 THR 233 -18.215 -22.978 20.573 1.00 0.00 H -ATOM 3673 OG1 THR 233 -17.430 -20.741 19.049 1.00 0.00 O -ATOM 3674 HG1 THR 233 -17.241 -20.183 18.291 1.00 0.00 H -ATOM 3675 C THR 233 -15.639 -23.990 19.279 1.00 0.00 C -ATOM 3676 O THR 233 -15.530 -24.670 18.216 1.00 0.00 O -ATOM 3677 N THR 234 -15.790 -24.596 20.488 1.00 0.00 N -ATOM 3678 H THR 234 -16.012 -23.996 21.270 1.00 0.00 H -ATOM 3679 CA THR 234 -16.143 -26.045 20.773 1.00 0.00 C -ATOM 3680 HA THR 234 -16.872 -26.390 20.040 1.00 0.00 H -ATOM 3681 CB THR 234 -14.883 -26.828 20.558 1.00 0.00 C -ATOM 3682 HB THR 234 -14.741 -26.857 19.478 1.00 0.00 H -ATOM 3683 CG2 THR 234 -13.581 -26.404 21.267 1.00 0.00 C -ATOM 3684 HG21 THR 234 -12.956 -27.273 21.474 1.00 0.00 H -ATOM 3685 HG22 THR 234 -12.974 -25.737 20.654 1.00 0.00 H -ATOM 3686 HG23 THR 234 -13.801 -25.907 22.211 1.00 0.00 H -ATOM 3687 OG1 THR 234 -15.150 -28.160 20.875 1.00 0.00 O -ATOM 3688 HG1 THR 234 -15.685 -28.502 20.155 1.00 0.00 H -ATOM 3689 C THR 234 -16.772 -26.232 22.188 1.00 0.00 C -ATOM 3690 O THR 234 -16.444 -25.531 23.142 1.00 0.00 O -ATOM 3691 N ILE 235 -17.684 -27.155 22.308 1.00 0.00 N -ATOM 3692 H ILE 235 -17.950 -27.560 21.423 1.00 0.00 H -ATOM 3693 CA ILE 235 -18.237 -27.674 23.591 1.00 0.00 C -ATOM 3694 HA ILE 235 -18.680 -26.789 24.048 1.00 0.00 H -ATOM 3695 CB ILE 235 -19.406 -28.586 23.196 1.00 0.00 C -ATOM 3696 HB ILE 235 -19.899 -28.025 22.401 1.00 0.00 H -ATOM 3697 CG2 ILE 235 -18.965 -29.840 22.468 1.00 0.00 C -ATOM 3698 HG21 ILE 235 -18.104 -29.733 21.808 1.00 0.00 H -ATOM 3699 HG22 ILE 235 -18.522 -30.564 23.151 1.00 0.00 H -ATOM 3700 HG23 ILE 235 -19.824 -30.214 21.910 1.00 0.00 H -ATOM 3701 CG1 ILE 235 -20.501 -28.896 24.258 1.00 0.00 C -ATOM 3702 HG12 ILE 235 -20.089 -29.586 24.994 1.00 0.00 H -ATOM 3703 HG13 ILE 235 -20.788 -27.999 24.806 1.00 0.00 H -ATOM 3704 CD1 ILE 235 -21.836 -29.299 23.743 1.00 0.00 C -ATOM 3705 HD11 ILE 235 -22.655 -28.955 24.375 1.00 0.00 H -ATOM 3706 HD12 ILE 235 -22.041 -28.788 22.803 1.00 0.00 H -ATOM 3707 HD13 ILE 235 -21.919 -30.382 23.837 1.00 0.00 H -ATOM 3708 C ILE 235 -17.223 -28.192 24.581 1.00 0.00 C -ATOM 3709 O ILE 235 -17.534 -28.584 25.666 1.00 0.00 O -ATOM 3710 N ASP 236 -16.018 -28.525 24.078 1.00 0.00 N -ATOM 3711 H ASP 236 -15.966 -28.495 23.070 1.00 0.00 H -ATOM 3712 CA ASP 236 -14.829 -28.929 24.883 1.00 0.00 C -ATOM 3713 HA ASP 236 -15.033 -29.656 25.670 1.00 0.00 H -ATOM 3714 CB ASP 236 -13.761 -29.517 23.953 1.00 0.00 C -ATOM 3715 HB2 ASP 236 -13.638 -28.882 23.076 1.00 0.00 H -ATOM 3716 HB3 ASP 236 -12.757 -29.575 24.374 1.00 0.00 H -ATOM 3717 CG ASP 236 -14.030 -30.889 23.433 1.00 0.00 C -ATOM 3718 OD1 ASP 236 -15.088 -31.477 23.748 1.00 0.00 O -ATOM 3719 OD2 ASP 236 -13.274 -31.249 22.511 1.00 0.00 O -ATOM 3720 C ASP 236 -14.273 -27.753 25.569 1.00 0.00 C -ATOM 3721 O ASP 236 -13.522 -27.928 26.547 1.00 0.00 O -ATOM 3722 N GLY 237 -14.651 -26.559 25.177 1.00 0.00 N -ATOM 3723 H GLY 237 -15.333 -26.502 24.434 1.00 0.00 H -ATOM 3724 CA GLY 237 -14.251 -25.283 25.772 1.00 0.00 C -ATOM 3725 HA2 GLY 237 -14.596 -24.480 25.121 1.00 0.00 H -ATOM 3726 HA3 GLY 237 -14.775 -25.154 26.719 1.00 0.00 H -ATOM 3727 C GLY 237 -12.738 -25.168 25.996 1.00 0.00 C -ATOM 3728 O GLY 237 -12.283 -24.809 27.112 1.00 0.00 O -ATOM 3729 N GLU 238 -11.930 -25.504 24.990 1.00 0.00 N -ATOM 3730 H GLU 238 -12.326 -25.713 24.085 1.00 0.00 H -ATOM 3731 CA GLU 238 -10.438 -25.274 25.000 1.00 0.00 C -ATOM 3732 HA GLU 238 -9.935 -25.841 25.784 1.00 0.00 H -ATOM 3733 CB GLU 238 -9.971 -25.793 23.575 1.00 0.00 C -ATOM 3734 HB2 GLU 238 -10.624 -25.197 22.937 1.00 0.00 H -ATOM 3735 HB3 GLU 238 -8.937 -25.458 23.487 1.00 0.00 H -ATOM 3736 CG GLU 238 -10.173 -27.289 23.367 1.00 0.00 C -ATOM 3737 HG2 GLU 238 -11.120 -27.660 23.759 1.00 0.00 H -ATOM 3738 HG3 GLU 238 -10.119 -27.321 22.279 1.00 0.00 H -ATOM 3739 CD GLU 238 -9.047 -28.138 23.901 1.00 0.00 C -ATOM 3740 OE1 GLU 238 -9.048 -28.294 25.103 1.00 0.00 O -ATOM 3741 OE2 GLU 238 -8.216 -28.751 23.141 1.00 0.00 O -ATOM 3742 C GLU 238 -9.990 -23.787 25.156 1.00 0.00 C -ATOM 3743 O GLU 238 -8.781 -23.607 25.338 1.00 0.00 O -ATOM 3744 N GLU 239 -10.912 -22.824 25.024 1.00 0.00 N -ATOM 3745 H GLU 239 -11.849 -23.095 24.761 1.00 0.00 H -ATOM 3746 CA GLU 239 -10.643 -21.370 24.860 1.00 0.00 C -ATOM 3747 HA GLU 239 -11.574 -20.842 24.654 1.00 0.00 H -ATOM 3748 CB GLU 239 -10.223 -20.688 26.218 1.00 0.00 C -ATOM 3749 HB2 GLU 239 -9.286 -21.083 26.609 1.00 0.00 H -ATOM 3750 HB3 GLU 239 -10.144 -19.619 26.019 1.00 0.00 H -ATOM 3751 CG GLU 239 -11.444 -20.871 27.170 1.00 0.00 C -ATOM 3752 HG2 GLU 239 -11.626 -21.890 27.511 1.00 0.00 H -ATOM 3753 HG3 GLU 239 -11.169 -20.320 28.070 1.00 0.00 H -ATOM 3754 CD GLU 239 -12.738 -20.184 26.666 1.00 0.00 C -ATOM 3755 OE1 GLU 239 -12.649 -19.032 26.083 1.00 0.00 O -ATOM 3756 OE2 GLU 239 -13.837 -20.718 26.851 1.00 0.00 O -ATOM 3757 C GLU 239 -9.767 -21.069 23.645 1.00 0.00 C -ATOM 3758 O GLU 239 -8.865 -20.265 23.730 1.00 0.00 O -ATOM 3759 N LEU 240 -9.981 -21.806 22.463 1.00 0.00 N -ATOM 3760 H LEU 240 -10.896 -22.180 22.253 1.00 0.00 H -ATOM 3761 CA LEU 240 -9.099 -21.621 21.259 1.00 0.00 C -ATOM 3762 HA LEU 240 -8.032 -21.595 21.483 1.00 0.00 H -ATOM 3763 CB LEU 240 -9.457 -22.699 20.201 1.00 0.00 C -ATOM 3764 HB2 LEU 240 -10.545 -22.735 20.239 1.00 0.00 H -ATOM 3765 HB3 LEU 240 -9.134 -22.577 19.167 1.00 0.00 H -ATOM 3766 CG LEU 240 -8.732 -24.037 20.671 1.00 0.00 C -ATOM 3767 HG LEU 240 -8.653 -24.083 21.757 1.00 0.00 H -ATOM 3768 CD1 LEU 240 -9.557 -25.205 20.149 1.00 0.00 C -ATOM 3769 HD11 LEU 240 -9.129 -26.146 20.497 1.00 0.00 H -ATOM 3770 HD12 LEU 240 -10.573 -25.155 20.543 1.00 0.00 H -ATOM 3771 HD13 LEU 240 -9.582 -25.194 19.060 1.00 0.00 H -ATOM 3772 CD2 LEU 240 -7.312 -24.173 20.074 1.00 0.00 C -ATOM 3773 HD21 LEU 240 -6.848 -24.948 20.683 1.00 0.00 H -ATOM 3774 HD22 LEU 240 -7.456 -24.493 19.042 1.00 0.00 H -ATOM 3775 HD23 LEU 240 -6.704 -23.275 20.183 1.00 0.00 H -ATOM 3776 C LEU 240 -9.421 -20.305 20.584 1.00 0.00 C -ATOM 3777 O LEU 240 -10.543 -19.839 20.587 1.00 0.00 O -ATOM 3778 N VAL 241 -8.404 -19.787 19.877 1.00 0.00 N -ATOM 3779 H VAL 241 -7.579 -20.360 19.767 1.00 0.00 H -ATOM 3780 CA VAL 241 -8.466 -18.558 19.141 1.00 0.00 C -ATOM 3781 HA VAL 241 -9.510 -18.434 18.852 1.00 0.00 H -ATOM 3782 CB VAL 241 -7.953 -17.374 19.956 1.00 0.00 C -ATOM 3783 HB VAL 241 -6.912 -17.645 20.132 1.00 0.00 H -ATOM 3784 CG1 VAL 241 -8.006 -15.995 19.319 1.00 0.00 C -ATOM 3785 HG11 VAL 241 -9.002 -15.568 19.197 1.00 0.00 H -ATOM 3786 HG12 VAL 241 -7.592 -15.233 19.979 1.00 0.00 H -ATOM 3787 HG13 VAL 241 -7.416 -15.882 18.409 1.00 0.00 H -ATOM 3788 CG2 VAL 241 -8.508 -17.185 21.414 1.00 0.00 C -ATOM 3789 HG21 VAL 241 -8.607 -18.177 21.855 1.00 0.00 H -ATOM 3790 HG22 VAL 241 -7.849 -16.508 21.957 1.00 0.00 H -ATOM 3791 HG23 VAL 241 -9.480 -16.696 21.476 1.00 0.00 H -ATOM 3792 C VAL 241 -7.742 -18.685 17.794 1.00 0.00 C -ATOM 3793 O VAL 241 -6.813 -19.505 17.620 1.00 0.00 O -ATOM 3794 N LYS 242 -8.267 -17.933 16.750 1.00 0.00 N -ATOM 3795 H LYS 242 -8.911 -17.186 16.964 1.00 0.00 H -ATOM 3796 CA LYS 242 -7.571 -17.860 15.435 1.00 0.00 C -ATOM 3797 HA LYS 242 -6.529 -18.076 15.672 1.00 0.00 H -ATOM 3798 CB LYS 242 -8.182 -18.819 14.428 1.00 0.00 C -ATOM 3799 HB2 LYS 242 -7.411 -19.169 13.741 1.00 0.00 H -ATOM 3800 HB3 LYS 242 -8.642 -19.626 14.999 1.00 0.00 H -ATOM 3801 CG LYS 242 -9.265 -18.186 13.522 1.00 0.00 C -ATOM 3802 HG2 LYS 242 -9.849 -17.528 14.165 1.00 0.00 H -ATOM 3803 HG3 LYS 242 -8.800 -17.678 12.677 1.00 0.00 H -ATOM 3804 CD LYS 242 -10.301 -19.092 12.867 1.00 0.00 C -ATOM 3805 HD2 LYS 242 -10.951 -19.302 13.717 1.00 0.00 H -ATOM 3806 HD3 LYS 242 -10.864 -18.527 12.124 1.00 0.00 H -ATOM 3807 CE LYS 242 -9.565 -20.354 12.284 1.00 0.00 C -ATOM 3808 HE2 LYS 242 -8.936 -19.974 11.479 1.00 0.00 H -ATOM 3809 HE3 LYS 242 -8.933 -20.780 13.063 1.00 0.00 H -ATOM 3810 NZ LYS 242 -10.572 -21.350 11.735 1.00 0.00 N -ATOM 3811 HZ1 LYS 242 -10.114 -22.221 11.510 1.00 0.00 H -ATOM 3812 HZ2 LYS 242 -11.227 -21.506 12.489 1.00 0.00 H -ATOM 3813 HZ3 LYS 242 -11.005 -20.995 10.894 1.00 0.00 H -ATOM 3814 C LYS 242 -7.403 -16.361 15.002 1.00 0.00 C -ATOM 3815 O LYS 242 -7.956 -15.516 15.714 1.00 0.00 O -ATOM 3816 N ILE 243 -6.490 -16.124 14.075 1.00 0.00 N -ATOM 3817 H ILE 243 -5.941 -16.866 13.665 1.00 0.00 H -ATOM 3818 CA ILE 243 -6.126 -14.744 13.677 1.00 0.00 C -ATOM 3819 HA ILE 243 -6.764 -13.945 14.055 1.00 0.00 H -ATOM 3820 CB ILE 243 -4.765 -14.421 14.236 1.00 0.00 C -ATOM 3821 HB ILE 243 -4.126 -15.304 14.234 1.00 0.00 H -ATOM 3822 CG2 ILE 243 -4.015 -13.373 13.367 1.00 0.00 C -ATOM 3823 HG21 ILE 243 -3.846 -13.729 12.351 1.00 0.00 H -ATOM 3824 HG22 ILE 243 -4.605 -12.458 13.416 1.00 0.00 H -ATOM 3825 HG23 ILE 243 -3.038 -13.093 13.762 1.00 0.00 H -ATOM 3826 CG1 ILE 243 -4.852 -14.046 15.739 1.00 0.00 C -ATOM 3827 HG12 ILE 243 -5.542 -13.214 15.881 1.00 0.00 H -ATOM 3828 HG13 ILE 243 -5.392 -14.939 16.052 1.00 0.00 H -ATOM 3829 CD1 ILE 243 -3.426 -13.926 16.360 1.00 0.00 C -ATOM 3830 HD11 ILE 243 -2.796 -14.671 15.875 1.00 0.00 H -ATOM 3831 HD12 ILE 243 -3.055 -12.935 16.098 1.00 0.00 H -ATOM 3832 HD13 ILE 243 -3.429 -14.019 17.446 1.00 0.00 H -ATOM 3833 C ILE 243 -6.298 -14.504 12.128 1.00 0.00 C -ATOM 3834 O ILE 243 -6.205 -15.412 11.285 1.00 0.00 O -ATOM 3835 N GLY 244 -6.743 -13.270 11.734 1.00 0.00 N -ATOM 3836 H GLY 244 -6.951 -12.608 12.468 1.00 0.00 H -ATOM 3837 CA GLY 244 -6.356 -12.725 10.394 1.00 0.00 C -ATOM 3838 HA2 GLY 244 -5.549 -13.343 10.002 1.00 0.00 H -ATOM 3839 HA3 GLY 244 -7.198 -12.652 9.706 1.00 0.00 H -ATOM 3840 C GLY 244 -5.720 -11.312 10.446 1.00 0.00 C -ATOM 3841 O GLY 244 -5.705 -10.723 11.529 1.00 0.00 O -ATOM 3842 N LYS 245 -5.184 -10.827 9.334 1.00 0.00 N -ATOM 3843 H LYS 245 -5.175 -11.459 8.546 1.00 0.00 H -ATOM 3844 CA LYS 245 -4.379 -9.648 9.259 1.00 0.00 C -ATOM 3845 HA LYS 245 -4.850 -9.007 10.004 1.00 0.00 H -ATOM 3846 CB LYS 245 -2.938 -9.937 9.799 1.00 0.00 C -ATOM 3847 HB2 LYS 245 -3.067 -10.432 10.761 1.00 0.00 H -ATOM 3848 HB3 LYS 245 -2.419 -10.607 9.115 1.00 0.00 H -ATOM 3849 CG LYS 245 -2.004 -8.822 10.162 1.00 0.00 C -ATOM 3850 HG2 LYS 245 -1.755 -8.318 9.229 1.00 0.00 H -ATOM 3851 HG3 LYS 245 -2.522 -7.988 10.635 1.00 0.00 H -ATOM 3852 CD LYS 245 -0.870 -9.218 11.127 1.00 0.00 C -ATOM 3853 HD2 LYS 245 -1.317 -9.687 12.004 1.00 0.00 H -ATOM 3854 HD3 LYS 245 -0.204 -9.933 10.643 1.00 0.00 H -ATOM 3855 CE LYS 245 0.067 -8.040 11.517 1.00 0.00 C -ATOM 3856 HE2 LYS 245 0.476 -7.520 10.651 1.00 0.00 H -ATOM 3857 HE3 LYS 245 -0.427 -7.247 12.080 1.00 0.00 H -ATOM 3858 NZ LYS 245 1.176 -8.489 12.302 1.00 0.00 N -ATOM 3859 HZ1 LYS 245 1.560 -9.307 11.851 1.00 0.00 H -ATOM 3860 HZ2 LYS 245 1.864 -7.758 12.411 1.00 0.00 H -ATOM 3861 HZ3 LYS 245 0.905 -8.793 13.227 1.00 0.00 H -ATOM 3862 C LYS 245 -4.395 -9.045 7.876 1.00 0.00 C -ATOM 3863 O LYS 245 -4.427 -9.759 6.866 1.00 0.00 O -ATOM 3864 N LEU 246 -4.248 -7.747 7.907 1.00 0.00 N -ATOM 3865 H LEU 246 -4.438 -7.209 8.740 1.00 0.00 H -ATOM 3866 CA LEU 246 -4.125 -6.948 6.705 1.00 0.00 C -ATOM 3867 HA LEU 246 -3.761 -7.660 5.965 1.00 0.00 H -ATOM 3868 CB LEU 246 -5.555 -6.549 6.393 1.00 0.00 C -ATOM 3869 HB2 LEU 246 -6.306 -6.624 7.179 1.00 0.00 H -ATOM 3870 HB3 LEU 246 -5.476 -5.464 6.333 1.00 0.00 H -ATOM 3871 CG LEU 246 -6.093 -7.013 4.978 1.00 0.00 C -ATOM 3872 HG LEU 246 -5.992 -8.095 4.900 1.00 0.00 H -ATOM 3873 CD1 LEU 246 -7.606 -6.738 4.873 1.00 0.00 C -ATOM 3874 HD11 LEU 246 -8.192 -7.212 5.660 1.00 0.00 H -ATOM 3875 HD12 LEU 246 -7.787 -5.663 4.865 1.00 0.00 H -ATOM 3876 HD13 LEU 246 -7.947 -7.176 3.935 1.00 0.00 H -ATOM 3877 CD2 LEU 246 -5.279 -6.401 3.852 1.00 0.00 C -ATOM 3878 HD21 LEU 246 -5.293 -6.900 2.883 1.00 0.00 H -ATOM 3879 HD22 LEU 246 -5.521 -5.346 3.721 1.00 0.00 H -ATOM 3880 HD23 LEU 246 -4.200 -6.467 3.994 1.00 0.00 H -ATOM 3881 C LEU 246 -3.103 -5.890 6.904 1.00 0.00 C -ATOM 3882 O LEU 246 -3.192 -5.131 7.871 1.00 0.00 O -ATOM 3883 N ASN 247 -2.182 -5.728 5.952 1.00 0.00 N -ATOM 3884 H ASN 247 -2.092 -6.519 5.330 1.00 0.00 H -ATOM 3885 CA ASN 247 -1.370 -4.514 5.709 1.00 0.00 C -ATOM 3886 HA ASN 247 -1.647 -3.843 6.522 1.00 0.00 H -ATOM 3887 CB ASN 247 0.129 -4.754 5.583 1.00 0.00 C -ATOM 3888 HB2 ASN 247 0.482 -5.099 4.612 1.00 0.00 H -ATOM 3889 HB3 ASN 247 0.710 -3.868 5.837 1.00 0.00 H -ATOM 3890 CG ASN 247 0.591 -5.791 6.620 1.00 0.00 C -ATOM 3891 OD1 ASN 247 0.831 -5.490 7.780 1.00 0.00 O -ATOM 3892 ND2 ASN 247 0.903 -6.972 6.145 1.00 0.00 N -ATOM 3893 HD21 ASN 247 1.191 -7.761 6.705 1.00 0.00 H -ATOM 3894 HD22 ASN 247 0.783 -7.142 5.157 1.00 0.00 H -ATOM 3895 C ASN 247 -1.769 -3.692 4.464 1.00 0.00 C -ATOM 3896 O ASN 247 -2.216 -4.244 3.503 1.00 0.00 O -ATOM 3897 N LEU 248 -1.506 -2.403 4.646 1.00 0.00 N -ATOM 3898 H LEU 248 -0.980 -2.203 5.485 1.00 0.00 H -ATOM 3899 CA LEU 248 -1.749 -1.458 3.647 1.00 0.00 C -ATOM 3900 HA LEU 248 -1.934 -1.950 2.692 1.00 0.00 H -ATOM 3901 CB LEU 248 -3.151 -0.769 3.922 1.00 0.00 C -ATOM 3902 HB2 LEU 248 -3.254 -0.476 4.967 1.00 0.00 H -ATOM 3903 HB3 LEU 248 -3.166 0.072 3.229 1.00 0.00 H -ATOM 3904 CG LEU 248 -4.341 -1.713 3.659 1.00 0.00 C -ATOM 3905 HG LEU 248 -4.168 -2.554 2.988 1.00 0.00 H -ATOM 3906 CD1 LEU 248 -4.861 -2.312 4.965 1.00 0.00 C -ATOM 3907 HD11 LEU 248 -5.448 -1.608 5.556 1.00 0.00 H -ATOM 3908 HD12 LEU 248 -5.664 -2.969 4.631 1.00 0.00 H -ATOM 3909 HD13 LEU 248 -4.119 -2.866 5.539 1.00 0.00 H -ATOM 3910 CD2 LEU 248 -5.536 -0.975 2.985 1.00 0.00 C -ATOM 3911 HD21 LEU 248 -6.163 -0.447 3.704 1.00 0.00 H -ATOM 3912 HD22 LEU 248 -5.250 -0.201 2.272 1.00 0.00 H -ATOM 3913 HD23 LEU 248 -6.084 -1.746 2.443 1.00 0.00 H -ATOM 3914 C LEU 248 -0.552 -0.460 3.571 1.00 0.00 C -ATOM 3915 O LEU 248 -0.248 0.337 4.448 1.00 0.00 O -ATOM 3916 N VAL 249 0.079 -0.493 2.318 1.00 0.00 N -ATOM 3917 H VAL 249 -0.233 -1.141 1.608 1.00 0.00 H -ATOM 3918 CA VAL 249 1.371 0.143 2.062 1.00 0.00 C -ATOM 3919 HA VAL 249 1.540 0.821 2.898 1.00 0.00 H -ATOM 3920 CB VAL 249 2.524 -0.916 1.874 1.00 0.00 C -ATOM 3921 HB VAL 249 2.331 -1.374 0.904 1.00 0.00 H -ATOM 3922 CG1 VAL 249 3.852 -0.172 1.867 1.00 0.00 C -ATOM 3923 HG11 VAL 249 3.842 0.604 1.102 1.00 0.00 H -ATOM 3924 HG12 VAL 249 3.860 0.411 2.788 1.00 0.00 H -ATOM 3925 HG13 VAL 249 4.748 -0.790 1.796 1.00 0.00 H -ATOM 3926 CG2 VAL 249 2.667 -2.003 3.012 1.00 0.00 C -ATOM 3927 HG21 VAL 249 1.759 -2.605 3.056 1.00 0.00 H -ATOM 3928 HG22 VAL 249 3.493 -2.691 2.833 1.00 0.00 H -ATOM 3929 HG23 VAL 249 2.818 -1.562 3.997 1.00 0.00 H -ATOM 3930 C VAL 249 1.269 1.026 0.790 1.00 0.00 C -ATOM 3931 O VAL 249 1.309 0.537 -0.345 1.00 0.00 O -ATOM 3932 N ASP 250 1.298 2.326 0.960 1.00 0.00 N -ATOM 3933 H ASP 250 1.253 2.542 1.946 1.00 0.00 H -ATOM 3934 CA ASP 250 1.488 3.401 -0.027 1.00 0.00 C -ATOM 3935 HA ASP 250 1.300 2.961 -1.007 1.00 0.00 H -ATOM 3936 CB ASP 250 0.552 4.654 0.074 1.00 0.00 C -ATOM 3937 HB2 ASP 250 1.022 5.542 -0.349 1.00 0.00 H -ATOM 3938 HB3 ASP 250 -0.326 4.359 -0.501 1.00 0.00 H -ATOM 3939 CG ASP 250 -0.025 5.028 1.459 1.00 0.00 C -ATOM 3940 OD1 ASP 250 -0.317 6.242 1.685 1.00 0.00 O -ATOM 3941 OD2 ASP 250 -0.410 4.095 2.216 1.00 0.00 O -ATOM 3942 C ASP 250 2.988 3.886 -0.074 1.00 0.00 C -ATOM 3943 O ASP 250 3.405 4.763 0.713 1.00 0.00 O -ATOM 3944 N LEU 251 3.803 3.281 -0.919 1.00 0.00 N -ATOM 3945 H LEU 251 3.378 2.483 -1.369 1.00 0.00 H -ATOM 3946 CA LEU 251 5.199 3.448 -1.150 1.00 0.00 C -ATOM 3947 HA LEU 251 5.679 3.349 -0.177 1.00 0.00 H -ATOM 3948 CB LEU 251 5.668 2.345 -2.173 1.00 0.00 C -ATOM 3949 HB2 LEU 251 4.974 2.519 -2.996 1.00 0.00 H -ATOM 3950 HB3 LEU 251 6.695 2.505 -2.500 1.00 0.00 H -ATOM 3951 CG LEU 251 5.472 0.817 -1.903 1.00 0.00 C -ATOM 3952 HG LEU 251 4.474 0.667 -1.490 1.00 0.00 H -ATOM 3953 CD1 LEU 251 5.669 -0.111 -3.130 1.00 0.00 C -ATOM 3954 HD11 LEU 251 5.485 -1.152 -2.864 1.00 0.00 H -ATOM 3955 HD12 LEU 251 5.014 0.204 -3.943 1.00 0.00 H -ATOM 3956 HD13 LEU 251 6.640 -0.010 -3.615 1.00 0.00 H -ATOM 3957 CD2 LEU 251 6.521 0.453 -0.853 1.00 0.00 C -ATOM 3958 HD21 LEU 251 6.308 -0.511 -0.391 1.00 0.00 H -ATOM 3959 HD22 LEU 251 7.446 0.317 -1.414 1.00 0.00 H -ATOM 3960 HD23 LEU 251 6.828 1.278 -0.209 1.00 0.00 H -ATOM 3961 C LEU 251 5.571 4.826 -1.678 1.00 0.00 C -ATOM 3962 O LEU 251 4.641 5.598 -2.149 1.00 0.00 O -ATOM 3963 N ALA 252 6.847 5.101 -1.620 1.00 0.00 N -ATOM 3964 H ALA 252 7.494 4.395 -1.301 1.00 0.00 H -ATOM 3965 CA ALA 252 7.502 6.237 -2.315 1.00 0.00 C -ATOM 3966 HA ALA 252 7.227 7.146 -1.780 1.00 0.00 H -ATOM 3967 CB ALA 252 9.011 6.070 -2.110 1.00 0.00 C -ATOM 3968 HB1 ALA 252 9.234 5.974 -1.047 1.00 0.00 H -ATOM 3969 HB2 ALA 252 9.410 5.230 -2.680 1.00 0.00 H -ATOM 3970 HB3 ALA 252 9.461 6.972 -2.523 1.00 0.00 H -ATOM 3971 C ALA 252 7.145 6.303 -3.824 1.00 0.00 C -ATOM 3972 O ALA 252 6.705 5.320 -4.433 1.00 0.00 O -ATOM 3973 N GLY 253 7.377 7.529 -4.473 1.00 0.00 N -ATOM 3974 H GLY 253 7.909 8.164 -3.895 1.00 0.00 H -ATOM 3975 CA GLY 253 7.145 7.781 -5.939 1.00 0.00 C -ATOM 3976 HA2 GLY 253 6.104 7.604 -6.210 1.00 0.00 H -ATOM 3977 HA3 GLY 253 7.470 8.805 -6.125 1.00 0.00 H -ATOM 3978 C GLY 253 7.968 6.831 -6.872 1.00 0.00 C -ATOM 3979 O GLY 253 9.088 6.446 -6.584 1.00 0.00 O -ATOM 3980 N SER 254 7.287 6.396 -7.930 1.00 0.00 N -ATOM 3981 H SER 254 6.301 6.590 -8.027 1.00 0.00 H -ATOM 3982 CA SER 254 7.848 5.658 -9.086 1.00 0.00 C -ATOM 3983 HA SER 254 8.520 4.939 -8.618 1.00 0.00 H -ATOM 3984 CB SER 254 6.848 4.893 -9.941 1.00 0.00 C -ATOM 3985 HB2 SER 254 7.389 4.265 -10.649 1.00 0.00 H -ATOM 3986 HB3 SER 254 6.230 4.308 -9.261 1.00 0.00 H -ATOM 3987 OG SER 254 6.069 5.766 -10.686 1.00 0.00 O -ATOM 3988 HG SER 254 5.874 5.303 -11.504 1.00 0.00 H -ATOM 3989 C SER 254 8.713 6.498 -10.044 1.00 0.00 C -ATOM 3990 O SER 254 9.399 5.983 -10.907 1.00 0.00 O -ATOM 3991 N GLU 255 8.738 7.799 -9.959 1.00 0.00 N -ATOM 3992 H GLU 255 8.000 8.171 -9.379 1.00 0.00 H -ATOM 3993 CA GLU 255 9.344 8.647 -10.981 1.00 0.00 C -ATOM 3994 HA GLU 255 8.959 8.210 -11.902 1.00 0.00 H -ATOM 3995 CB GLU 255 8.677 9.984 -11.043 1.00 0.00 C -ATOM 3996 HB2 GLU 255 9.034 10.375 -11.996 1.00 0.00 H -ATOM 3997 HB3 GLU 255 7.593 9.914 -11.135 1.00 0.00 H -ATOM 3998 CG GLU 255 9.129 10.952 -9.951 1.00 0.00 C -ATOM 3999 HG2 GLU 255 10.207 10.902 -9.797 1.00 0.00 H -ATOM 4000 HG3 GLU 255 9.051 11.984 -10.293 1.00 0.00 H -ATOM 4001 CD GLU 255 8.306 10.816 -8.626 1.00 0.00 C -ATOM 4002 OE1 GLU 255 7.458 9.942 -8.494 1.00 0.00 O -ATOM 4003 OE2 GLU 255 8.629 11.553 -7.694 1.00 0.00 O -ATOM 4004 C GLU 255 10.861 8.610 -11.071 1.00 0.00 C -ATOM 4005 O GLU 255 11.575 8.460 -10.064 1.00 0.00 O -ATOM 4006 N ASN 256 11.399 8.924 -12.274 1.00 0.00 N -ATOM 4007 H ASN 256 10.789 8.978 -13.077 1.00 0.00 H -ATOM 4008 CA ASN 256 12.835 9.022 -12.620 1.00 0.00 C -ATOM 4009 HA ASN 256 13.278 8.077 -12.308 1.00 0.00 H -ATOM 4010 CB ASN 256 13.087 9.312 -14.105 1.00 0.00 C -ATOM 4011 HB2 ASN 256 12.477 8.673 -14.743 1.00 0.00 H -ATOM 4012 HB3 ASN 256 12.758 10.327 -14.326 1.00 0.00 H -ATOM 4013 CG ASN 256 14.557 9.317 -14.391 1.00 0.00 C -ATOM 4014 OD1 ASN 256 15.266 8.267 -14.346 1.00 0.00 O -ATOM 4015 ND2 ASN 256 15.106 10.473 -14.471 1.00 0.00 N -ATOM 4016 HD21 ASN 256 16.113 10.533 -14.528 1.00 0.00 H -ATOM 4017 HD22 ASN 256 14.470 11.255 -14.408 1.00 0.00 H -ATOM 4018 C ASN 256 13.550 10.061 -11.708 1.00 0.00 C -ATOM 4019 O ASN 256 14.601 9.759 -11.152 1.00 0.00 O -ATOM 4020 N ILE 257 13.032 11.283 -11.519 1.00 0.00 N -ATOM 4021 H ILE 257 12.208 11.563 -12.032 1.00 0.00 H -ATOM 4022 CA ILE 257 13.632 12.268 -10.581 1.00 0.00 C -ATOM 4023 HA ILE 257 14.655 12.435 -10.916 1.00 0.00 H -ATOM 4024 CB ILE 257 13.001 13.701 -10.611 1.00 0.00 C -ATOM 4025 HB ILE 257 13.535 14.309 -9.881 1.00 0.00 H -ATOM 4026 CG2 ILE 257 12.952 14.375 -12.010 1.00 0.00 C -ATOM 4027 HG21 ILE 257 12.767 15.443 -11.895 1.00 0.00 H -ATOM 4028 HG22 ILE 257 13.860 14.251 -12.600 1.00 0.00 H -ATOM 4029 HG23 ILE 257 12.219 13.813 -12.588 1.00 0.00 H -ATOM 4030 CG1 ILE 257 11.580 13.882 -9.973 1.00 0.00 C -ATOM 4031 HG12 ILE 257 10.852 13.491 -10.683 1.00 0.00 H -ATOM 4032 HG13 ILE 257 11.529 13.223 -9.106 1.00 0.00 H -ATOM 4033 CD1 ILE 257 10.920 15.279 -9.605 1.00 0.00 C -ATOM 4034 HD11 ILE 257 10.708 15.772 -10.553 1.00 0.00 H -ATOM 4035 HD12 ILE 257 10.005 15.214 -9.017 1.00 0.00 H -ATOM 4036 HD13 ILE 257 11.613 15.902 -9.039 1.00 0.00 H -ATOM 4037 C ILE 257 13.747 11.795 -9.131 1.00 0.00 C -ATOM 4038 O ILE 257 14.598 12.226 -8.378 1.00 0.00 O -ATOM 4039 N GLY 258 13.020 10.736 -8.799 1.00 0.00 N -ATOM 4040 H GLY 258 12.446 10.363 -9.542 1.00 0.00 H -ATOM 4041 CA GLY 258 13.057 9.948 -7.582 1.00 0.00 C -ATOM 4042 HA2 GLY 258 13.385 10.545 -6.731 1.00 0.00 H -ATOM 4043 HA3 GLY 258 12.116 9.407 -7.477 1.00 0.00 H -ATOM 4044 C GLY 258 14.190 8.909 -7.559 1.00 0.00 C -ATOM 4045 O GLY 258 15.131 9.045 -6.796 1.00 0.00 O -ATOM 4046 N ARG 259 14.132 7.953 -8.460 1.00 0.00 N -ATOM 4047 H ARG 259 13.293 7.980 -9.022 1.00 0.00 H -ATOM 4048 CA ARG 259 15.301 6.925 -8.573 1.00 0.00 C -ATOM 4049 HA ARG 259 15.494 6.616 -7.545 1.00 0.00 H -ATOM 4050 CB ARG 259 14.889 5.663 -9.418 1.00 0.00 C -ATOM 4051 HB2 ARG 259 15.728 4.968 -9.443 1.00 0.00 H -ATOM 4052 HB3 ARG 259 14.089 5.180 -8.857 1.00 0.00 H -ATOM 4053 CG ARG 259 14.426 5.870 -10.838 1.00 0.00 C -ATOM 4054 HG2 ARG 259 13.363 6.076 -10.958 1.00 0.00 H -ATOM 4055 HG3 ARG 259 15.042 6.702 -11.180 1.00 0.00 H -ATOM 4056 CD ARG 259 14.690 4.699 -11.854 1.00 0.00 C -ATOM 4057 HD2 ARG 259 15.738 4.417 -11.961 1.00 0.00 H -ATOM 4058 HD3 ARG 259 14.179 3.804 -11.498 1.00 0.00 H -ATOM 4059 NE ARG 259 14.319 5.166 -13.200 1.00 0.00 N -ATOM 4060 HE ARG 259 15.097 5.397 -13.802 1.00 0.00 H -ATOM 4061 CZ ARG 259 13.139 5.284 -13.781 1.00 0.00 C -ATOM 4062 NH1 ARG 259 12.033 5.133 -13.193 1.00 0.00 N -ATOM 4063 HH11 ARG 259 11.981 4.951 -12.201 1.00 0.00 H -ATOM 4064 HH12 ARG 259 11.150 5.290 -13.657 1.00 0.00 H -ATOM 4065 NH2 ARG 259 13.119 5.554 -15.026 1.00 0.00 N -ATOM 4066 HH21 ARG 259 13.931 5.562 -15.626 1.00 0.00 H -ATOM 4067 HH22 ARG 259 12.382 6.186 -15.303 1.00 0.00 H -ATOM 4068 C ARG 259 16.689 7.488 -8.891 1.00 0.00 C -ATOM 4069 O ARG 259 17.734 6.973 -8.401 1.00 0.00 O -ATOM 4070 N SER 260 16.763 8.560 -9.629 1.00 0.00 N -ATOM 4071 H SER 260 15.906 8.927 -10.018 1.00 0.00 H -ATOM 4072 CA SER 260 18.105 8.855 -10.156 1.00 0.00 C -ATOM 4073 HA SER 260 18.459 7.846 -10.366 1.00 0.00 H -ATOM 4074 CB SER 260 18.057 9.645 -11.451 1.00 0.00 C -ATOM 4075 HB2 SER 260 19.069 9.944 -11.726 1.00 0.00 H -ATOM 4076 HB3 SER 260 17.643 8.914 -12.145 1.00 0.00 H -ATOM 4077 OG SER 260 17.215 10.828 -11.331 1.00 0.00 O -ATOM 4078 HG SER 260 16.303 10.527 -11.330 1.00 0.00 H -ATOM 4079 C SER 260 18.967 9.643 -9.136 1.00 0.00 C -ATOM 4080 O SER 260 18.420 10.582 -8.472 1.00 0.00 O -ATOM 4081 N GLY 261 20.270 9.316 -8.978 1.00 0.00 N -ATOM 4082 H GLY 261 20.725 8.721 -9.657 1.00 0.00 H -ATOM 4083 CA GLY 261 20.961 9.674 -7.751 1.00 0.00 C -ATOM 4084 HA2 GLY 261 20.729 10.711 -7.505 1.00 0.00 H -ATOM 4085 HA3 GLY 261 20.643 8.974 -6.978 1.00 0.00 H -ATOM 4086 C GLY 261 22.459 9.657 -7.816 1.00 0.00 C -ATOM 4087 O GLY 261 23.090 9.043 -8.608 1.00 0.00 O -ATOM 4088 N ALA 262 23.156 10.374 -6.925 1.00 0.00 N -ATOM 4089 H ALA 262 22.629 10.888 -6.234 1.00 0.00 H -ATOM 4090 CA ALA 262 24.574 10.261 -6.840 1.00 0.00 C -ATOM 4091 HA ALA 262 25.122 10.372 -7.776 1.00 0.00 H -ATOM 4092 CB ALA 262 25.145 11.460 -6.054 1.00 0.00 C -ATOM 4093 HB1 ALA 262 24.566 11.495 -5.131 1.00 0.00 H -ATOM 4094 HB2 ALA 262 26.192 11.352 -5.768 1.00 0.00 H -ATOM 4095 HB3 ALA 262 24.955 12.386 -6.597 1.00 0.00 H -ATOM 4096 C ALA 262 25.066 8.908 -6.173 1.00 0.00 C -ATOM 4097 O ALA 262 24.546 8.420 -5.167 1.00 0.00 O -ATOM 4098 N VAL 263 25.979 8.193 -6.771 1.00 0.00 N -ATOM 4099 H VAL 263 26.189 8.464 -7.721 1.00 0.00 H -ATOM 4100 CA VAL 263 26.541 6.905 -6.379 1.00 0.00 C -ATOM 4101 HA VAL 263 25.716 6.234 -6.141 1.00 0.00 H -ATOM 4102 CB VAL 263 27.419 6.134 -7.404 1.00 0.00 C -ATOM 4103 HB VAL 263 27.920 5.306 -6.904 1.00 0.00 H -ATOM 4104 CG1 VAL 263 26.619 5.488 -8.494 1.00 0.00 C -ATOM 4105 HG11 VAL 263 26.089 6.313 -8.971 1.00 0.00 H -ATOM 4106 HG12 VAL 263 27.256 5.068 -9.273 1.00 0.00 H -ATOM 4107 HG13 VAL 263 26.136 4.677 -7.950 1.00 0.00 H -ATOM 4108 CG2 VAL 263 28.546 7.000 -7.973 1.00 0.00 C -ATOM 4109 HG21 VAL 263 29.098 6.466 -8.747 1.00 0.00 H -ATOM 4110 HG22 VAL 263 28.196 7.934 -8.413 1.00 0.00 H -ATOM 4111 HG23 VAL 263 29.176 7.237 -7.116 1.00 0.00 H -ATOM 4112 C VAL 263 27.290 7.072 -5.070 1.00 0.00 C -ATOM 4113 O VAL 263 27.548 8.201 -4.619 1.00 0.00 O -ATOM 4114 N ASP 264 27.649 5.964 -4.349 1.00 0.00 N -ATOM 4115 H ASP 264 27.532 5.045 -4.751 1.00 0.00 H -ATOM 4116 CA ASP 264 28.114 6.061 -2.964 1.00 0.00 C -ATOM 4117 HA ASP 264 27.322 6.561 -2.406 1.00 0.00 H -ATOM 4118 CB ASP 264 28.143 4.676 -2.271 1.00 0.00 C -ATOM 4119 HB2 ASP 264 28.611 3.934 -2.918 1.00 0.00 H -ATOM 4120 HB3 ASP 264 28.665 4.753 -1.317 1.00 0.00 H -ATOM 4121 CG ASP 264 26.736 4.184 -1.935 1.00 0.00 C -ATOM 4122 OD1 ASP 264 26.678 2.977 -1.557 1.00 0.00 O -ATOM 4123 OD2 ASP 264 25.749 4.954 -1.970 1.00 0.00 O -ATOM 4124 C ASP 264 29.496 6.714 -2.812 1.00 0.00 C -ATOM 4125 O ASP 264 29.817 7.100 -1.666 1.00 0.00 O -ATOM 4126 N LYS 265 30.226 6.884 -3.901 1.00 0.00 N -ATOM 4127 H LYS 265 29.804 6.458 -4.713 1.00 0.00 H -ATOM 4128 CA LYS 265 31.535 7.603 -4.067 1.00 0.00 C -ATOM 4129 HA LYS 265 32.171 7.168 -3.296 1.00 0.00 H -ATOM 4130 CB LYS 265 32.107 7.297 -5.443 1.00 0.00 C -ATOM 4131 HB2 LYS 265 31.336 7.514 -6.182 1.00 0.00 H -ATOM 4132 HB3 LYS 265 32.983 7.926 -5.600 1.00 0.00 H -ATOM 4133 CG LYS 265 32.512 5.775 -5.502 1.00 0.00 C -ATOM 4134 HG2 LYS 265 33.261 5.575 -4.736 1.00 0.00 H -ATOM 4135 HG3 LYS 265 31.654 5.114 -5.377 1.00 0.00 H -ATOM 4136 CD LYS 265 33.208 5.476 -6.845 1.00 0.00 C -ATOM 4137 HD2 LYS 265 33.572 4.454 -6.956 1.00 0.00 H -ATOM 4138 HD3 LYS 265 32.527 5.737 -7.655 1.00 0.00 H -ATOM 4139 CE LYS 265 34.469 6.311 -7.021 1.00 0.00 C -ATOM 4140 HE2 LYS 265 34.305 7.358 -6.765 1.00 0.00 H -ATOM 4141 HE3 LYS 265 35.186 5.912 -6.304 1.00 0.00 H -ATOM 4142 NZ LYS 265 35.035 6.112 -8.286 1.00 0.00 N -ATOM 4143 HZ1 LYS 265 35.072 5.132 -8.529 1.00 0.00 H -ATOM 4144 HZ2 LYS 265 34.402 6.446 -8.999 1.00 0.00 H -ATOM 4145 HZ3 LYS 265 35.919 6.543 -8.516 1.00 0.00 H -ATOM 4146 C LYS 265 31.421 9.100 -3.719 1.00 0.00 C -ATOM 4147 O LYS 265 32.385 9.729 -3.340 1.00 0.00 O -ATOM 4148 N ARG 266 30.229 9.681 -4.032 1.00 0.00 N -ATOM 4149 H ARG 266 29.502 9.110 -4.438 1.00 0.00 H -ATOM 4150 CA ARG 266 29.828 11.099 -3.755 1.00 0.00 C -ATOM 4151 HA ARG 266 30.685 11.669 -3.396 1.00 0.00 H -ATOM 4152 CB ARG 266 29.407 11.793 -5.087 1.00 0.00 C -ATOM 4153 HB2 ARG 266 28.585 11.307 -5.612 1.00 0.00 H -ATOM 4154 HB3 ARG 266 29.172 12.839 -4.889 1.00 0.00 H -ATOM 4155 CG ARG 266 30.555 11.935 -6.088 1.00 0.00 C -ATOM 4156 HG2 ARG 266 31.517 12.027 -5.584 1.00 0.00 H -ATOM 4157 HG3 ARG 266 30.492 11.024 -6.684 1.00 0.00 H -ATOM 4158 CD ARG 266 30.510 13.157 -7.014 1.00 0.00 C -ATOM 4159 HD2 ARG 266 30.464 14.115 -6.496 1.00 0.00 H -ATOM 4160 HD3 ARG 266 31.497 13.250 -7.468 1.00 0.00 H -ATOM 4161 NE ARG 266 29.432 13.063 -8.005 1.00 0.00 N -ATOM 4162 HE ARG 266 29.620 12.408 -8.751 1.00 0.00 H -ATOM 4163 CZ ARG 266 28.253 13.749 -8.004 1.00 0.00 C -ATOM 4164 NH1 ARG 266 27.920 14.601 -7.021 1.00 0.00 N -ATOM 4165 HH11 ARG 266 28.628 14.864 -6.351 1.00 0.00 H -ATOM 4166 HH12 ARG 266 27.097 15.186 -6.995 1.00 0.00 H -ATOM 4167 NH2 ARG 266 27.316 13.446 -8.886 1.00 0.00 N -ATOM 4168 HH21 ARG 266 27.677 13.051 -9.743 1.00 0.00 H -ATOM 4169 HH22 ARG 266 26.446 13.958 -8.902 1.00 0.00 H -ATOM 4170 C ARG 266 28.681 11.377 -2.789 1.00 0.00 C -ATOM 4171 O ARG 266 28.675 12.444 -2.119 1.00 0.00 O -ATOM 4172 N ALA 267 27.744 10.483 -2.574 1.00 0.00 N -ATOM 4173 H ALA 267 27.690 9.638 -3.124 1.00 0.00 H -ATOM 4174 CA ALA 267 26.719 10.688 -1.527 1.00 0.00 C -ATOM 4175 HA ALA 267 27.261 10.947 -0.618 1.00 0.00 H -ATOM 4176 CB ALA 267 25.740 11.695 -2.124 1.00 0.00 C -ATOM 4177 HB1 ALA 267 25.212 12.189 -1.308 1.00 0.00 H -ATOM 4178 HB2 ALA 267 26.272 12.373 -2.791 1.00 0.00 H -ATOM 4179 HB3 ALA 267 25.006 11.196 -2.756 1.00 0.00 H -ATOM 4180 C ALA 267 25.989 9.361 -1.240 1.00 0.00 C -ATOM 4181 O ALA 267 24.767 9.119 -1.450 1.00 0.00 O -ATOM 4182 N ARG 268 26.704 8.524 -0.520 1.00 0.00 N -ATOM 4183 H ARG 268 27.667 8.807 -0.408 1.00 0.00 H -ATOM 4184 CA ARG 268 26.210 7.351 0.293 1.00 0.00 C -ATOM 4185 HA ARG 268 25.898 6.673 -0.501 1.00 0.00 H -ATOM 4186 CB ARG 268 27.432 6.746 1.031 1.00 0.00 C -ATOM 4187 HB2 ARG 268 28.154 6.449 0.270 1.00 0.00 H -ATOM 4188 HB3 ARG 268 27.795 7.547 1.676 1.00 0.00 H -ATOM 4189 CG ARG 268 27.109 5.533 2.009 1.00 0.00 C -ATOM 4190 HG2 ARG 268 27.938 5.193 2.629 1.00 0.00 H -ATOM 4191 HG3 ARG 268 26.473 6.020 2.748 1.00 0.00 H -ATOM 4192 CD ARG 268 26.444 4.382 1.294 1.00 0.00 C -ATOM 4193 HD2 ARG 268 25.444 4.623 0.934 1.00 0.00 H -ATOM 4194 HD3 ARG 268 27.175 4.075 0.546 1.00 0.00 H -ATOM 4195 NE ARG 268 26.213 3.217 2.208 1.00 0.00 N -ATOM 4196 HE ARG 268 26.483 3.339 3.174 1.00 0.00 H -ATOM 4197 CZ ARG 268 26.001 1.963 1.810 1.00 0.00 C -ATOM 4198 NH1 ARG 268 25.848 1.644 0.583 1.00 0.00 N -ATOM 4199 HH11 ARG 268 26.070 2.345 -0.109 1.00 0.00 H -ATOM 4200 HH12 ARG 268 25.507 0.758 0.238 1.00 0.00 H -ATOM 4201 NH2 ARG 268 25.787 1.070 2.802 1.00 0.00 N -ATOM 4202 HH21 ARG 268 25.908 1.338 3.768 1.00 0.00 H -ATOM 4203 HH22 ARG 268 25.563 0.113 2.569 1.00 0.00 H -ATOM 4204 C ARG 268 25.121 7.762 1.230 1.00 0.00 C -ATOM 4205 O ARG 268 24.243 6.912 1.424 1.00 0.00 O -ATOM 4206 N GLU 269 25.058 9.042 1.683 1.00 0.00 N -ATOM 4207 H GLU 269 25.787 9.646 1.329 1.00 0.00 H -ATOM 4208 CA GLU 269 24.165 9.401 2.751 1.00 0.00 C -ATOM 4209 HA GLU 269 24.054 8.607 3.489 1.00 0.00 H -ATOM 4210 CB GLU 269 24.771 10.680 3.466 1.00 0.00 C -ATOM 4211 HB2 GLU 269 24.817 11.488 2.736 1.00 0.00 H -ATOM 4212 HB3 GLU 269 24.112 10.974 4.283 1.00 0.00 H -ATOM 4213 CG GLU 269 26.053 10.331 4.128 1.00 0.00 C -ATOM 4214 HG2 GLU 269 26.153 11.093 4.902 1.00 0.00 H -ATOM 4215 HG3 GLU 269 25.832 9.342 4.530 1.00 0.00 H -ATOM 4216 CD GLU 269 27.320 10.296 3.331 1.00 0.00 C -ATOM 4217 OE1 GLU 269 27.377 10.574 2.117 1.00 0.00 O -ATOM 4218 OE2 GLU 269 28.370 10.046 3.995 1.00 0.00 O -ATOM 4219 C GLU 269 22.755 9.748 2.241 1.00 0.00 C -ATOM 4220 O GLU 269 21.795 9.704 2.964 1.00 0.00 O -ATOM 4221 N ALA 270 22.594 10.136 0.982 1.00 0.00 N -ATOM 4222 H ALA 270 23.401 10.118 0.375 1.00 0.00 H -ATOM 4223 CA ALA 270 21.305 10.328 0.267 1.00 0.00 C -ATOM 4224 HA ALA 270 20.610 10.675 1.031 1.00 0.00 H -ATOM 4225 CB ALA 270 21.470 11.420 -0.734 1.00 0.00 C -ATOM 4226 HB1 ALA 270 22.391 11.272 -1.298 1.00 0.00 H -ATOM 4227 HB2 ALA 270 20.606 11.562 -1.382 1.00 0.00 H -ATOM 4228 HB3 ALA 270 21.551 12.382 -0.230 1.00 0.00 H -ATOM 4229 C ALA 270 20.906 9.063 -0.540 1.00 0.00 C -ATOM 4230 O ALA 270 19.737 8.766 -0.704 1.00 0.00 O -ATOM 4231 N GLY 271 21.862 8.203 -0.822 1.00 0.00 N -ATOM 4232 H GLY 271 22.781 8.621 -0.864 1.00 0.00 H -ATOM 4233 CA GLY 271 21.680 6.779 -1.259 1.00 0.00 C -ATOM 4234 HA2 GLY 271 21.008 6.776 -2.117 1.00 0.00 H -ATOM 4235 HA3 GLY 271 22.633 6.424 -1.652 1.00 0.00 H -ATOM 4236 C GLY 271 21.063 5.839 -0.265 1.00 0.00 C -ATOM 4237 O GLY 271 20.280 5.034 -0.705 1.00 0.00 O -ATOM 4238 N ASN 272 21.128 6.218 1.037 1.00 0.00 N -ATOM 4239 H ASN 272 21.763 6.910 1.409 1.00 0.00 H -ATOM 4240 CA ASN 272 20.290 5.578 2.039 1.00 0.00 C -ATOM 4241 HA ASN 272 20.300 4.519 1.779 1.00 0.00 H -ATOM 4242 CB ASN 272 20.848 5.874 3.463 1.00 0.00 C -ATOM 4243 HB2 ASN 272 20.730 6.940 3.660 1.00 0.00 H -ATOM 4244 HB3 ASN 272 20.176 5.522 4.246 1.00 0.00 H -ATOM 4245 CG ASN 272 22.313 5.515 3.741 1.00 0.00 C -ATOM 4246 OD1 ASN 272 22.950 6.165 4.515 1.00 0.00 O -ATOM 4247 ND2 ASN 272 22.837 4.578 3.058 1.00 0.00 N -ATOM 4248 HD21 ASN 272 23.844 4.528 2.992 1.00 0.00 H -ATOM 4249 HD22 ASN 272 22.273 3.797 2.753 1.00 0.00 H -ATOM 4250 C ASN 272 18.773 5.906 1.917 1.00 0.00 C -ATOM 4251 O ASN 272 17.996 5.070 2.291 1.00 0.00 O -ATOM 4252 N ILE 273 18.344 6.993 1.297 1.00 0.00 N -ATOM 4253 H ILE 273 18.972 7.769 1.141 1.00 0.00 H -ATOM 4254 CA ILE 273 16.882 7.233 0.991 1.00 0.00 C -ATOM 4255 HA ILE 273 16.213 7.127 1.845 1.00 0.00 H -ATOM 4256 CB ILE 273 16.561 8.686 0.508 1.00 0.00 C -ATOM 4257 HB ILE 273 17.253 9.005 -0.272 1.00 0.00 H -ATOM 4258 CG2 ILE 273 15.123 8.739 -0.003 1.00 0.00 C -ATOM 4259 HG21 ILE 273 15.044 8.217 -0.957 1.00 0.00 H -ATOM 4260 HG22 ILE 273 14.438 8.420 0.783 1.00 0.00 H -ATOM 4261 HG23 ILE 273 14.774 9.770 -0.063 1.00 0.00 H -ATOM 4262 CG1 ILE 273 16.879 9.764 1.560 1.00 0.00 C -ATOM 4263 HG12 ILE 273 16.043 9.801 2.257 1.00 0.00 H -ATOM 4264 HG13 ILE 273 17.851 9.610 2.029 1.00 0.00 H -ATOM 4265 CD1 ILE 273 17.065 11.192 0.921 1.00 0.00 C -ATOM 4266 HD11 ILE 273 18.078 11.321 0.542 1.00 0.00 H -ATOM 4267 HD12 ILE 273 16.373 11.413 0.108 1.00 0.00 H -ATOM 4268 HD13 ILE 273 16.806 11.958 1.652 1.00 0.00 H -ATOM 4269 C ILE 273 16.438 6.207 0.017 1.00 0.00 C -ATOM 4270 O ILE 273 15.394 5.730 0.304 1.00 0.00 O -ATOM 4271 N ASN 274 17.118 5.958 -1.114 1.00 0.00 N -ATOM 4272 H ASN 274 17.978 6.438 -1.341 1.00 0.00 H -ATOM 4273 CA ASN 274 16.575 5.119 -2.193 1.00 0.00 C -ATOM 4274 HA ASN 274 15.489 5.201 -2.153 1.00 0.00 H -ATOM 4275 CB ASN 274 17.297 5.590 -3.504 1.00 0.00 C -ATOM 4276 HB2 ASN 274 17.350 6.679 -3.526 1.00 0.00 H -ATOM 4277 HB3 ASN 274 18.306 5.182 -3.576 1.00 0.00 H -ATOM 4278 CG ASN 274 16.609 5.133 -4.774 1.00 0.00 C -ATOM 4279 OD1 ASN 274 15.492 4.676 -4.783 1.00 0.00 O -ATOM 4280 ND2 ASN 274 17.282 5.287 -5.929 1.00 0.00 N -ATOM 4281 HD21 ASN 274 16.783 4.872 -6.702 1.00 0.00 H -ATOM 4282 HD22 ASN 274 18.200 5.708 -5.969 1.00 0.00 H -ATOM 4283 C ASN 274 16.874 3.612 -1.875 1.00 0.00 C -ATOM 4284 O ASN 274 16.482 2.687 -2.605 1.00 0.00 O -ATOM 4285 N GLN 275 17.560 3.240 -0.847 1.00 0.00 N -ATOM 4286 H GLN 275 17.911 3.883 -0.152 1.00 0.00 H -ATOM 4287 CA GLN 275 17.978 1.820 -0.607 1.00 0.00 C -ATOM 4288 HA GLN 275 18.637 1.459 -1.396 1.00 0.00 H -ATOM 4289 CB GLN 275 18.855 1.831 0.679 1.00 0.00 C -ATOM 4290 HB2 GLN 275 19.646 2.582 0.655 1.00 0.00 H -ATOM 4291 HB3 GLN 275 18.203 2.218 1.461 1.00 0.00 H -ATOM 4292 CG GLN 275 19.430 0.472 1.135 1.00 0.00 C -ATOM 4293 HG2 GLN 275 19.947 0.702 2.067 1.00 0.00 H -ATOM 4294 HG3 GLN 275 18.618 -0.196 1.422 1.00 0.00 H -ATOM 4295 CD GLN 275 20.335 -0.223 0.166 1.00 0.00 C -ATOM 4296 OE1 GLN 275 20.893 0.447 -0.731 1.00 0.00 O -ATOM 4297 NE2 GLN 275 20.618 -1.480 0.312 1.00 0.00 N -ATOM 4298 HE21 GLN 275 21.301 -1.808 -0.355 1.00 0.00 H -ATOM 4299 HE22 GLN 275 20.197 -2.106 0.983 1.00 0.00 H -ATOM 4300 C GLN 275 16.784 0.885 -0.535 1.00 0.00 C -ATOM 4301 O GLN 275 16.877 -0.152 -1.042 1.00 0.00 O -ATOM 4302 N SER 276 15.680 1.267 0.122 1.00 0.00 N -ATOM 4303 H SER 276 15.541 2.189 0.510 1.00 0.00 H -ATOM 4304 CA SER 276 14.409 0.536 0.101 1.00 0.00 C -ATOM 4305 HA SER 276 14.607 -0.377 0.662 1.00 0.00 H -ATOM 4306 CB SER 276 13.494 1.365 0.992 1.00 0.00 C -ATOM 4307 HB2 SER 276 12.520 0.880 1.064 1.00 0.00 H -ATOM 4308 HB3 SER 276 13.945 1.389 1.984 1.00 0.00 H -ATOM 4309 OG SER 276 13.315 2.697 0.538 1.00 0.00 O -ATOM 4310 HG SER 276 13.946 3.303 0.931 1.00 0.00 H -ATOM 4311 C SER 276 13.790 0.292 -1.239 1.00 0.00 C -ATOM 4312 O SER 276 13.144 -0.741 -1.417 1.00 0.00 O -ATOM 4313 N LEU 277 13.874 1.277 -2.137 1.00 0.00 N -ATOM 4314 H LEU 277 14.239 2.170 -1.838 1.00 0.00 H -ATOM 4315 CA LEU 277 13.165 1.184 -3.476 1.00 0.00 C -ATOM 4316 HA LEU 277 12.245 0.622 -3.315 1.00 0.00 H -ATOM 4317 CB LEU 277 12.739 2.547 -4.046 1.00 0.00 C -ATOM 4318 HB2 LEU 277 12.253 3.118 -3.255 1.00 0.00 H -ATOM 4319 HB3 LEU 277 13.640 3.035 -4.419 1.00 0.00 H -ATOM 4320 CG LEU 277 11.872 2.430 -5.331 1.00 0.00 C -ATOM 4321 HG LEU 277 12.210 1.867 -6.201 1.00 0.00 H -ATOM 4322 CD1 LEU 277 10.486 1.823 -5.020 1.00 0.00 C -ATOM 4323 HD11 LEU 277 9.930 2.345 -4.241 1.00 0.00 H -ATOM 4324 HD12 LEU 277 9.893 1.823 -5.934 1.00 0.00 H -ATOM 4325 HD13 LEU 277 10.603 0.783 -4.716 1.00 0.00 H -ATOM 4326 CD2 LEU 277 11.535 3.847 -5.932 1.00 0.00 C -ATOM 4327 HD21 LEU 277 12.444 4.377 -6.215 1.00 0.00 H -ATOM 4328 HD22 LEU 277 10.886 3.823 -6.808 1.00 0.00 H -ATOM 4329 HD23 LEU 277 11.060 4.565 -5.263 1.00 0.00 H -ATOM 4330 C LEU 277 14.012 0.303 -4.369 1.00 0.00 C -ATOM 4331 O LEU 277 13.533 -0.490 -5.145 1.00 0.00 O -ATOM 4332 N LEU 278 15.294 0.608 -4.351 1.00 0.00 N -ATOM 4333 H LEU 278 15.598 1.368 -3.760 1.00 0.00 H -ATOM 4334 CA LEU 278 16.334 -0.130 -5.078 1.00 0.00 C -ATOM 4335 HA LEU 278 16.023 -0.041 -6.119 1.00 0.00 H -ATOM 4336 CB LEU 278 17.663 0.529 -4.913 1.00 0.00 C -ATOM 4337 HB2 LEU 278 17.839 0.673 -3.847 1.00 0.00 H -ATOM 4338 HB3 LEU 278 18.437 -0.067 -5.396 1.00 0.00 H -ATOM 4339 CG LEU 278 17.767 1.913 -5.601 1.00 0.00 C -ATOM 4340 HG LEU 278 16.931 2.542 -5.295 1.00 0.00 H -ATOM 4341 CD1 LEU 278 19.126 2.545 -5.284 1.00 0.00 C -ATOM 4342 HD11 LEU 278 19.128 2.880 -4.246 1.00 0.00 H -ATOM 4343 HD12 LEU 278 19.966 1.894 -5.526 1.00 0.00 H -ATOM 4344 HD13 LEU 278 19.354 3.424 -5.886 1.00 0.00 H -ATOM 4345 CD2 LEU 278 17.821 1.806 -7.136 1.00 0.00 C -ATOM 4346 HD21 LEU 278 17.316 2.621 -7.654 1.00 0.00 H -ATOM 4347 HD22 LEU 278 18.827 1.876 -7.548 1.00 0.00 H -ATOM 4348 HD23 LEU 278 17.331 0.860 -7.371 1.00 0.00 H -ATOM 4349 C LEU 278 16.296 -1.611 -4.710 1.00 0.00 C -ATOM 4350 O LEU 278 16.336 -2.460 -5.569 1.00 0.00 O -ATOM 4351 N THR 279 16.242 -1.860 -3.370 1.00 0.00 N -ATOM 4352 H THR 279 16.413 -1.170 -2.652 1.00 0.00 H -ATOM 4353 CA THR 279 16.036 -3.200 -2.804 1.00 0.00 C -ATOM 4354 HA THR 279 16.739 -3.825 -3.354 1.00 0.00 H -ATOM 4355 CB THR 279 16.254 -3.247 -1.245 1.00 0.00 C -ATOM 4356 HB THR 279 15.418 -2.706 -0.802 1.00 0.00 H -ATOM 4357 CG2 THR 279 16.236 -4.631 -0.671 1.00 0.00 C -ATOM 4358 HG21 THR 279 15.223 -5.000 -0.832 1.00 0.00 H -ATOM 4359 HG22 THR 279 16.898 -5.352 -1.151 1.00 0.00 H -ATOM 4360 HG23 THR 279 16.403 -4.669 0.406 1.00 0.00 H -ATOM 4361 OG1 THR 279 17.503 -2.754 -0.759 1.00 0.00 O -ATOM 4362 HG1 THR 279 17.550 -1.800 -0.855 1.00 0.00 H -ATOM 4363 C THR 279 14.664 -3.781 -3.234 1.00 0.00 C -ATOM 4364 O THR 279 14.666 -4.980 -3.544 1.00 0.00 O -ATOM 4365 N LEU 280 13.553 -3.032 -3.299 1.00 0.00 N -ATOM 4366 H LEU 280 13.574 -2.048 -3.071 1.00 0.00 H -ATOM 4367 CA LEU 280 12.268 -3.583 -3.801 1.00 0.00 C -ATOM 4368 HA LEU 280 12.011 -4.447 -3.188 1.00 0.00 H -ATOM 4369 CB LEU 280 11.151 -2.523 -3.530 1.00 0.00 C -ATOM 4370 HB2 LEU 280 11.161 -2.467 -2.441 1.00 0.00 H -ATOM 4371 HB3 LEU 280 11.376 -1.564 -3.998 1.00 0.00 H -ATOM 4372 CG LEU 280 9.780 -3.132 -3.926 1.00 0.00 C -ATOM 4373 HG LEU 280 9.789 -3.743 -4.828 1.00 0.00 H -ATOM 4374 CD1 LEU 280 9.180 -4.084 -2.855 1.00 0.00 C -ATOM 4375 HD11 LEU 280 8.166 -4.372 -3.135 1.00 0.00 H -ATOM 4376 HD12 LEU 280 9.931 -4.827 -2.588 1.00 0.00 H -ATOM 4377 HD13 LEU 280 9.069 -3.506 -1.937 1.00 0.00 H -ATOM 4378 CD2 LEU 280 8.783 -1.991 -4.261 1.00 0.00 C -ATOM 4379 HD21 LEU 280 7.800 -2.434 -4.420 1.00 0.00 H -ATOM 4380 HD22 LEU 280 8.650 -1.229 -3.493 1.00 0.00 H -ATOM 4381 HD23 LEU 280 9.089 -1.579 -5.222 1.00 0.00 H -ATOM 4382 C LEU 280 12.460 -3.991 -5.307 1.00 0.00 C -ATOM 4383 O LEU 280 12.041 -5.087 -5.660 1.00 0.00 O -ATOM 4384 N GLY 281 13.148 -3.223 -6.144 1.00 0.00 N -ATOM 4385 H GLY 281 13.381 -2.321 -5.754 1.00 0.00 H -ATOM 4386 CA GLY 281 13.465 -3.471 -7.591 1.00 0.00 C -ATOM 4387 HA2 GLY 281 12.489 -3.588 -8.061 1.00 0.00 H -ATOM 4388 HA3 GLY 281 14.066 -2.641 -7.963 1.00 0.00 H -ATOM 4389 C GLY 281 14.246 -4.750 -7.729 1.00 0.00 C -ATOM 4390 O GLY 281 13.969 -5.529 -8.682 1.00 0.00 O -ATOM 4391 N ARG 282 15.258 -4.996 -6.917 1.00 0.00 N -ATOM 4392 H ARG 282 15.634 -4.265 -6.331 1.00 0.00 H -ATOM 4393 CA ARG 282 16.025 -6.252 -6.921 1.00 0.00 C -ATOM 4394 HA ARG 282 16.353 -6.485 -7.934 1.00 0.00 H -ATOM 4395 CB ARG 282 17.259 -6.057 -5.987 1.00 0.00 C -ATOM 4396 HB2 ARG 282 16.862 -5.604 -5.079 1.00 0.00 H -ATOM 4397 HB3 ARG 282 17.669 -7.040 -5.757 1.00 0.00 H -ATOM 4398 CG ARG 282 18.287 -5.138 -6.662 1.00 0.00 C -ATOM 4399 HG2 ARG 282 18.443 -5.466 -7.690 1.00 0.00 H -ATOM 4400 HG3 ARG 282 17.910 -4.118 -6.726 1.00 0.00 H -ATOM 4401 CD ARG 282 19.603 -4.864 -5.913 1.00 0.00 C -ATOM 4402 HD2 ARG 282 20.124 -4.131 -6.529 1.00 0.00 H -ATOM 4403 HD3 ARG 282 19.398 -4.456 -4.923 1.00 0.00 H -ATOM 4404 NE ARG 282 20.496 -6.046 -5.834 1.00 0.00 N -ATOM 4405 HE ARG 282 20.989 -6.219 -6.698 1.00 0.00 H -ATOM 4406 CZ ARG 282 20.652 -6.908 -4.856 1.00 0.00 C -ATOM 4407 NH1 ARG 282 20.329 -6.527 -3.606 1.00 0.00 N -ATOM 4408 HH11 ARG 282 20.131 -5.565 -3.372 1.00 0.00 H -ATOM 4409 HH12 ARG 282 20.626 -7.219 -2.932 1.00 0.00 H -ATOM 4410 NH2 ARG 282 21.193 -8.066 -4.980 1.00 0.00 N -ATOM 4411 HH21 ARG 282 21.375 -8.411 -5.912 1.00 0.00 H -ATOM 4412 HH22 ARG 282 21.336 -8.545 -4.103 1.00 0.00 H -ATOM 4413 C ARG 282 15.187 -7.456 -6.378 1.00 0.00 C -ATOM 4414 O ARG 282 15.357 -8.512 -6.979 1.00 0.00 O -ATOM 4415 N VAL 283 14.398 -7.282 -5.340 1.00 0.00 N -ATOM 4416 H VAL 283 14.290 -6.363 -4.935 1.00 0.00 H -ATOM 4417 CA VAL 283 13.469 -8.351 -4.876 1.00 0.00 C -ATOM 4418 HA VAL 283 14.119 -9.201 -4.666 1.00 0.00 H -ATOM 4419 CB VAL 283 12.752 -7.951 -3.566 1.00 0.00 C -ATOM 4420 HB VAL 283 12.417 -6.919 -3.675 1.00 0.00 H -ATOM 4421 CG1 VAL 283 11.552 -8.852 -3.158 1.00 0.00 C -ATOM 4422 HG11 VAL 283 11.282 -8.717 -2.110 1.00 0.00 H -ATOM 4423 HG12 VAL 283 10.659 -8.753 -3.775 1.00 0.00 H -ATOM 4424 HG13 VAL 283 11.863 -9.871 -3.387 1.00 0.00 H -ATOM 4425 CG2 VAL 283 13.678 -7.885 -2.317 1.00 0.00 C -ATOM 4426 HG21 VAL 283 14.661 -7.478 -2.553 1.00 0.00 H -ATOM 4427 HG22 VAL 283 13.096 -7.378 -1.548 1.00 0.00 H -ATOM 4428 HG23 VAL 283 13.831 -8.929 -2.045 1.00 0.00 H -ATOM 4429 C VAL 283 12.507 -8.708 -5.997 1.00 0.00 C -ATOM 4430 O VAL 283 12.483 -9.868 -6.308 1.00 0.00 O -ATOM 4431 N ILE 284 11.855 -7.807 -6.712 1.00 0.00 N -ATOM 4432 H ILE 284 11.956 -6.859 -6.377 1.00 0.00 H -ATOM 4433 CA ILE 284 10.943 -8.098 -7.863 1.00 0.00 C -ATOM 4434 HA ILE 284 10.318 -8.941 -7.570 1.00 0.00 H -ATOM 4435 CB ILE 284 10.141 -6.761 -8.219 1.00 0.00 C -ATOM 4436 HB ILE 284 10.790 -5.888 -8.284 1.00 0.00 H -ATOM 4437 CG2 ILE 284 9.537 -6.948 -9.630 1.00 0.00 C -ATOM 4438 HG21 ILE 284 8.954 -6.110 -10.011 1.00 0.00 H -ATOM 4439 HG22 ILE 284 10.367 -7.031 -10.332 1.00 0.00 H -ATOM 4440 HG23 ILE 284 9.034 -7.914 -9.671 1.00 0.00 H -ATOM 4441 CG1 ILE 284 9.149 -6.342 -7.095 1.00 0.00 C -ATOM 4442 HG12 ILE 284 8.376 -7.100 -6.967 1.00 0.00 H -ATOM 4443 HG13 ILE 284 9.769 -6.332 -6.198 1.00 0.00 H -ATOM 4444 CD1 ILE 284 8.516 -4.942 -7.368 1.00 0.00 C -ATOM 4445 HD11 ILE 284 9.240 -4.135 -7.252 1.00 0.00 H -ATOM 4446 HD12 ILE 284 8.046 -4.836 -8.346 1.00 0.00 H -ATOM 4447 HD13 ILE 284 7.754 -4.890 -6.591 1.00 0.00 H -ATOM 4448 C ILE 284 11.690 -8.686 -9.057 1.00 0.00 C -ATOM 4449 O ILE 284 11.237 -9.571 -9.680 1.00 0.00 O -ATOM 4450 N THR 285 12.994 -8.396 -9.171 1.00 0.00 N -ATOM 4451 H THR 285 13.353 -7.612 -8.645 1.00 0.00 H -ATOM 4452 CA THR 285 13.822 -9.053 -10.194 1.00 0.00 C -ATOM 4453 HA THR 285 13.259 -9.221 -11.113 1.00 0.00 H -ATOM 4454 CB THR 285 15.092 -8.242 -10.520 1.00 0.00 C -ATOM 4455 HB THR 285 15.695 -8.017 -9.640 1.00 0.00 H -ATOM 4456 CG2 THR 285 15.927 -9.015 -11.566 1.00 0.00 C -ATOM 4457 HG21 THR 285 16.316 -9.939 -11.137 1.00 0.00 H -ATOM 4458 HG22 THR 285 15.277 -9.303 -12.392 1.00 0.00 H -ATOM 4459 HG23 THR 285 16.675 -8.342 -11.986 1.00 0.00 H -ATOM 4460 OG1 THR 285 14.586 -6.974 -10.961 1.00 0.00 O -ATOM 4461 HG1 THR 285 14.267 -6.514 -10.181 1.00 0.00 H -ATOM 4462 C THR 285 14.177 -10.485 -9.756 1.00 0.00 C -ATOM 4463 O THR 285 13.844 -11.397 -10.541 1.00 0.00 O -ATOM 4464 N ALA 286 14.614 -10.775 -8.521 1.00 0.00 N -ATOM 4465 H ALA 286 14.832 -10.012 -7.895 1.00 0.00 H -ATOM 4466 CA ALA 286 15.048 -12.147 -8.157 1.00 0.00 C -ATOM 4467 HA ALA 286 15.767 -12.564 -8.861 1.00 0.00 H -ATOM 4468 CB ALA 286 15.586 -11.937 -6.710 1.00 0.00 C -ATOM 4469 HB1 ALA 286 14.832 -11.414 -6.121 1.00 0.00 H -ATOM 4470 HB2 ALA 286 15.977 -12.865 -6.293 1.00 0.00 H -ATOM 4471 HB3 ALA 286 16.487 -11.331 -6.799 1.00 0.00 H -ATOM 4472 C ALA 286 13.815 -13.101 -8.092 1.00 0.00 C -ATOM 4473 O ALA 286 13.913 -14.281 -8.337 1.00 0.00 O -ATOM 4474 N LEU 287 12.604 -12.624 -7.760 1.00 0.00 N -ATOM 4475 H LEU 287 12.379 -11.666 -7.534 1.00 0.00 H -ATOM 4476 CA LEU 287 11.407 -13.491 -7.719 1.00 0.00 C -ATOM 4477 HA LEU 287 11.600 -14.426 -7.194 1.00 0.00 H -ATOM 4478 CB LEU 287 10.319 -12.718 -6.919 1.00 0.00 C -ATOM 4479 HB2 LEU 287 10.248 -11.712 -7.332 1.00 0.00 H -ATOM 4480 HB3 LEU 287 9.378 -13.261 -7.013 1.00 0.00 H -ATOM 4481 CG LEU 287 10.689 -12.684 -5.442 1.00 0.00 C -ATOM 4482 HG LEU 287 11.629 -12.214 -5.154 1.00 0.00 H -ATOM 4483 CD1 LEU 287 9.688 -11.702 -4.778 1.00 0.00 C -ATOM 4484 HD11 LEU 287 9.902 -10.727 -5.215 1.00 0.00 H -ATOM 4485 HD12 LEU 287 8.691 -11.884 -5.177 1.00 0.00 H -ATOM 4486 HD13 LEU 287 9.865 -11.694 -3.702 1.00 0.00 H -ATOM 4487 CD2 LEU 287 10.510 -13.900 -4.662 1.00 0.00 C -ATOM 4488 HD21 LEU 287 9.542 -14.277 -4.992 1.00 0.00 H -ATOM 4489 HD22 LEU 287 11.281 -14.572 -5.040 1.00 0.00 H -ATOM 4490 HD23 LEU 287 10.622 -13.839 -3.580 1.00 0.00 H -ATOM 4491 C LEU 287 10.941 -13.914 -9.134 1.00 0.00 C -ATOM 4492 O LEU 287 10.232 -14.910 -9.266 1.00 0.00 O -ATOM 4493 N VAL 288 11.234 -13.087 -10.160 1.00 0.00 N -ATOM 4494 H VAL 288 11.897 -12.386 -9.861 1.00 0.00 H -ATOM 4495 CA VAL 288 10.918 -13.263 -11.600 1.00 0.00 C -ATOM 4496 HA VAL 288 10.119 -13.997 -11.696 1.00 0.00 H -ATOM 4497 CB VAL 288 10.434 -12.016 -12.401 1.00 0.00 C -ATOM 4498 HB VAL 288 11.208 -11.255 -12.311 1.00 0.00 H -ATOM 4499 CG1 VAL 288 10.175 -12.385 -13.911 1.00 0.00 C -ATOM 4500 HG11 VAL 288 9.482 -13.221 -13.818 1.00 0.00 H -ATOM 4501 HG12 VAL 288 9.667 -11.582 -14.445 1.00 0.00 H -ATOM 4502 HG13 VAL 288 11.111 -12.668 -14.392 1.00 0.00 H -ATOM 4503 CG2 VAL 288 9.216 -11.568 -11.530 1.00 0.00 C -ATOM 4504 HG21 VAL 288 9.595 -11.149 -10.598 1.00 0.00 H -ATOM 4505 HG22 VAL 288 8.633 -10.786 -12.017 1.00 0.00 H -ATOM 4506 HG23 VAL 288 8.734 -12.518 -11.298 1.00 0.00 H -ATOM 4507 C VAL 288 12.024 -14.004 -12.394 1.00 0.00 C -ATOM 4508 O VAL 288 11.813 -14.916 -13.213 1.00 0.00 O -ATOM 4509 N GLU 289 13.299 -13.760 -12.109 1.00 0.00 N -ATOM 4510 H GLU 289 13.468 -12.939 -11.546 1.00 0.00 H -ATOM 4511 CA GLU 289 14.423 -14.610 -12.560 1.00 0.00 C -ATOM 4512 HA GLU 289 14.176 -15.027 -13.537 1.00 0.00 H -ATOM 4513 CB GLU 289 15.633 -13.764 -12.826 1.00 0.00 C -ATOM 4514 HB2 GLU 289 16.027 -13.391 -11.881 1.00 0.00 H -ATOM 4515 HB3 GLU 289 16.391 -14.462 -13.182 1.00 0.00 H -ATOM 4516 CG GLU 289 15.383 -12.625 -13.801 1.00 0.00 C -ATOM 4517 HG2 GLU 289 14.583 -11.977 -13.443 1.00 0.00 H -ATOM 4518 HG3 GLU 289 16.233 -11.953 -13.923 1.00 0.00 H -ATOM 4519 CD GLU 289 14.898 -13.047 -15.230 1.00 0.00 C -ATOM 4520 OE1 GLU 289 15.340 -14.003 -15.842 1.00 0.00 O -ATOM 4521 OE2 GLU 289 14.078 -12.342 -15.842 1.00 0.00 O -ATOM 4522 C GLU 289 14.625 -15.888 -11.695 1.00 0.00 C -ATOM 4523 O GLU 289 15.493 -16.712 -11.917 1.00 0.00 O -ATOM 4524 N ARG 290 13.744 -16.070 -10.683 1.00 0.00 N -ATOM 4525 H ARG 290 13.061 -15.369 -10.432 1.00 0.00 H -ATOM 4526 CA ARG 290 13.708 -17.277 -9.776 1.00 0.00 C -ATOM 4527 HA ARG 290 12.952 -16.941 -9.066 1.00 0.00 H -ATOM 4528 CB ARG 290 13.238 -18.582 -10.437 1.00 0.00 C -ATOM 4529 HB2 ARG 290 14.003 -18.876 -11.156 1.00 0.00 H -ATOM 4530 HB3 ARG 290 13.191 -19.299 -9.618 1.00 0.00 H -ATOM 4531 CG ARG 290 11.767 -18.497 -11.017 1.00 0.00 C -ATOM 4532 HG2 ARG 290 11.166 -18.213 -10.153 1.00 0.00 H -ATOM 4533 HG3 ARG 290 11.654 -17.609 -11.638 1.00 0.00 H -ATOM 4534 CD ARG 290 11.185 -19.693 -11.750 1.00 0.00 C -ATOM 4535 HD2 ARG 290 12.085 -20.106 -12.207 1.00 0.00 H -ATOM 4536 HD3 ARG 290 10.802 -20.342 -10.962 1.00 0.00 H -ATOM 4537 NE ARG 290 10.231 -19.348 -12.724 1.00 0.00 N -ATOM 4538 HE ARG 290 9.952 -18.395 -12.909 1.00 0.00 H -ATOM 4539 CZ ARG 290 9.675 -20.209 -13.549 1.00 0.00 C -ATOM 4540 NH1 ARG 290 9.752 -21.480 -13.442 1.00 0.00 N -ATOM 4541 HH11 ARG 290 10.076 -21.883 -12.574 1.00 0.00 H -ATOM 4542 HH12 ARG 290 9.259 -22.099 -14.069 1.00 0.00 H -ATOM 4543 NH2 ARG 290 8.980 -19.832 -14.609 1.00 0.00 N -ATOM 4544 HH21 ARG 290 9.055 -18.878 -14.931 1.00 0.00 H -ATOM 4545 HH22 ARG 290 8.318 -20.434 -15.077 1.00 0.00 H -ATOM 4546 C ARG 290 15.008 -17.446 -8.963 1.00 0.00 C -ATOM 4547 O ARG 290 15.384 -18.619 -8.637 1.00 0.00 O -ATOM 4548 N THR 291 15.686 -16.325 -8.657 1.00 0.00 N -ATOM 4549 H THR 291 15.277 -15.449 -8.952 1.00 0.00 H -ATOM 4550 CA THR 291 16.976 -16.478 -8.072 1.00 0.00 C -ATOM 4551 HA THR 291 17.697 -17.148 -8.541 1.00 0.00 H -ATOM 4552 CB THR 291 17.611 -15.080 -8.099 1.00 0.00 C -ATOM 4553 HB THR 291 16.847 -14.465 -7.623 1.00 0.00 H -ATOM 4554 CG2 THR 291 19.024 -14.925 -7.464 1.00 0.00 C -ATOM 4555 HG21 THR 291 19.222 -13.857 -7.547 1.00 0.00 H -ATOM 4556 HG22 THR 291 19.063 -15.293 -6.438 1.00 0.00 H -ATOM 4557 HG23 THR 291 19.739 -15.378 -8.151 1.00 0.00 H -ATOM 4558 OG1 THR 291 17.697 -14.597 -9.437 1.00 0.00 O -ATOM 4559 HG1 THR 291 18.039 -15.274 -10.024 1.00 0.00 H -ATOM 4560 C THR 291 16.828 -16.799 -6.588 1.00 0.00 C -ATOM 4561 O THR 291 16.211 -16.054 -5.799 1.00 0.00 O -ATOM 4562 N PRO 292 17.401 -17.924 -6.102 1.00 0.00 N -ATOM 4563 CD PRO 292 18.019 -18.943 -6.825 1.00 0.00 C -ATOM 4564 HD2 PRO 292 19.039 -18.668 -7.092 1.00 0.00 H -ATOM 4565 HD3 PRO 292 17.428 -19.096 -7.728 1.00 0.00 H -ATOM 4566 CG PRO 292 17.946 -20.239 -6.025 1.00 0.00 C -ATOM 4567 HG2 PRO 292 18.816 -20.867 -6.216 1.00 0.00 H -ATOM 4568 HG3 PRO 292 17.030 -20.781 -6.258 1.00 0.00 H -ATOM 4569 CB PRO 292 17.941 -19.686 -4.620 1.00 0.00 C -ATOM 4570 HB2 PRO 292 18.989 -19.491 -4.394 1.00 0.00 H -ATOM 4571 HB3 PRO 292 17.466 -20.285 -3.844 1.00 0.00 H -ATOM 4572 CA PRO 292 17.176 -18.369 -4.755 1.00 0.00 C -ATOM 4573 HA PRO 292 16.107 -18.574 -4.813 1.00 0.00 H -ATOM 4574 C PRO 292 17.548 -17.333 -3.710 1.00 0.00 C -ATOM 4575 O PRO 292 16.853 -17.034 -2.701 1.00 0.00 O -ATOM 4576 N HIE 293 18.629 -16.581 -3.946 1.00 0.00 N -ATOM 4577 H HIE 293 19.174 -16.801 -4.767 1.00 0.00 H -ATOM 4578 CA HIE 293 19.213 -15.475 -3.248 1.00 0.00 C -ATOM 4579 HA HIE 293 19.522 -15.663 -2.220 1.00 0.00 H -ATOM 4580 CB HIE 293 20.662 -15.250 -3.859 1.00 0.00 C -ATOM 4581 HB2 HIE 293 20.631 -14.661 -4.776 1.00 0.00 H -ATOM 4582 HB3 HIE 293 21.282 -14.698 -3.153 1.00 0.00 H -ATOM 4583 CG HIE 293 21.405 -16.510 -4.235 1.00 0.00 C -ATOM 4584 ND1 HIE 293 21.481 -17.013 -5.574 1.00 0.00 N -ATOM 4585 CE1 HIE 293 21.977 -18.259 -5.509 1.00 0.00 C -ATOM 4586 HE1 HIE 293 22.185 -18.958 -6.306 1.00 0.00 H -ATOM 4587 NE2 HIE 293 22.271 -18.513 -4.215 1.00 0.00 N -ATOM 4588 HE2 HIE 293 22.756 -19.334 -3.881 1.00 0.00 H -ATOM 4589 CD2 HIE 293 21.877 -17.471 -3.381 1.00 0.00 C -ATOM 4590 HD2 HIE 293 22.052 -17.387 -2.318 1.00 0.00 H -ATOM 4591 C HIE 293 18.353 -14.245 -3.293 1.00 0.00 C -ATOM 4592 O HIE 293 18.786 -13.333 -3.960 1.00 0.00 O -ATOM 4593 N VAL 294 17.199 -14.181 -2.668 1.00 0.00 N -ATOM 4594 H VAL 294 16.824 -15.056 -2.330 1.00 0.00 H -ATOM 4595 CA VAL 294 16.313 -12.985 -2.798 1.00 0.00 C -ATOM 4596 HA VAL 294 16.421 -12.485 -3.761 1.00 0.00 H -ATOM 4597 CB VAL 294 14.787 -13.374 -2.839 1.00 0.00 C -ATOM 4598 HB VAL 294 14.470 -13.882 -1.928 1.00 0.00 H -ATOM 4599 CG1 VAL 294 13.787 -12.186 -3.035 1.00 0.00 C -ATOM 4600 HG11 VAL 294 14.002 -11.669 -3.970 1.00 0.00 H -ATOM 4601 HG12 VAL 294 12.763 -12.556 -2.986 1.00 0.00 H -ATOM 4602 HG13 VAL 294 13.943 -11.482 -2.217 1.00 0.00 H -ATOM 4603 CG2 VAL 294 14.423 -14.396 -3.972 1.00 0.00 C -ATOM 4604 HG21 VAL 294 14.791 -15.386 -3.703 1.00 0.00 H -ATOM 4605 HG22 VAL 294 13.336 -14.445 -3.913 1.00 0.00 H -ATOM 4606 HG23 VAL 294 14.785 -14.045 -4.939 1.00 0.00 H -ATOM 4607 C VAL 294 16.586 -11.932 -1.724 1.00 0.00 C -ATOM 4608 O VAL 294 16.538 -12.317 -0.553 1.00 0.00 O -ATOM 4609 N PRO 295 16.867 -10.610 -2.037 1.00 0.00 N -ATOM 4610 CD PRO 295 16.835 -9.989 -3.345 1.00 0.00 C -ATOM 4611 HD2 PRO 295 15.800 -9.821 -3.641 1.00 0.00 H -ATOM 4612 HD3 PRO 295 17.465 -10.585 -4.005 1.00 0.00 H -ATOM 4613 CG PRO 295 17.476 -8.584 -3.255 1.00 0.00 C -ATOM 4614 HG2 PRO 295 16.695 -7.856 -3.035 1.00 0.00 H -ATOM 4615 HG3 PRO 295 18.013 -8.332 -4.169 1.00 0.00 H -ATOM 4616 CB PRO 295 18.391 -8.857 -2.091 1.00 0.00 C -ATOM 4617 HB2 PRO 295 18.704 -7.907 -1.660 1.00 0.00 H -ATOM 4618 HB3 PRO 295 19.267 -9.416 -2.421 1.00 0.00 H -ATOM 4619 CA PRO 295 17.588 -9.736 -1.119 1.00 0.00 C -ATOM 4620 HA PRO 295 18.365 -10.322 -0.627 1.00 0.00 H -ATOM 4621 C PRO 295 16.699 -8.949 -0.079 1.00 0.00 C -ATOM 4622 O PRO 295 17.043 -7.819 0.153 1.00 0.00 O -ATOM 4623 N TYR 296 15.606 -9.550 0.449 1.00 0.00 N -ATOM 4624 H TYR 296 15.282 -10.431 0.076 1.00 0.00 H -ATOM 4625 CA TYR 296 14.893 -9.016 1.620 1.00 0.00 C -ATOM 4626 HA TYR 296 14.132 -8.375 1.174 1.00 0.00 H -ATOM 4627 CB TYR 296 14.148 -10.087 2.385 1.00 0.00 C -ATOM 4628 HB2 TYR 296 14.923 -10.653 2.901 1.00 0.00 H -ATOM 4629 HB3 TYR 296 13.512 -9.621 3.137 1.00 0.00 H -ATOM 4630 CG TYR 296 13.284 -10.949 1.538 1.00 0.00 C -ATOM 4631 CD1 TYR 296 12.110 -10.436 0.996 1.00 0.00 C -ATOM 4632 HD1 TYR 296 11.864 -9.413 1.240 1.00 0.00 H -ATOM 4633 CE1 TYR 296 11.377 -11.153 0.063 1.00 0.00 C -ATOM 4634 HE1 TYR 296 10.492 -10.753 -0.409 1.00 0.00 H -ATOM 4635 CZ TYR 296 11.611 -12.581 -0.127 1.00 0.00 C -ATOM 4636 OH TYR 296 10.694 -13.304 -0.855 1.00 0.00 O -ATOM 4637 HH TYR 296 9.895 -12.817 -1.069 1.00 0.00 H -ATOM 4638 CE2 TYR 296 12.869 -13.065 0.384 1.00 0.00 C -ATOM 4639 HE2 TYR 296 13.153 -14.055 0.059 1.00 0.00 H -ATOM 4640 CD2 TYR 296 13.746 -12.261 1.229 1.00 0.00 C -ATOM 4641 HD2 TYR 296 14.646 -12.665 1.668 1.00 0.00 H -ATOM 4642 C TYR 296 15.677 -8.270 2.729 1.00 0.00 C -ATOM 4643 O TYR 296 15.028 -7.352 3.226 1.00 0.00 O -ATOM 4644 N ARG 297 16.957 -8.689 3.061 1.00 0.00 N -ATOM 4645 H ARG 297 17.244 -9.565 2.650 1.00 0.00 H -ATOM 4646 CA ARG 297 17.773 -8.121 4.129 1.00 0.00 C -ATOM 4647 HA ARG 297 17.133 -7.889 4.981 1.00 0.00 H -ATOM 4648 CB ARG 297 18.626 -9.152 4.696 1.00 0.00 C -ATOM 4649 HB2 ARG 297 19.395 -9.503 4.009 1.00 0.00 H -ATOM 4650 HB3 ARG 297 19.196 -8.652 5.479 1.00 0.00 H -ATOM 4651 CG ARG 297 18.090 -10.372 5.472 1.00 0.00 C -ATOM 4652 HG2 ARG 297 17.560 -10.070 6.376 1.00 0.00 H -ATOM 4653 HG3 ARG 297 17.334 -10.848 4.847 1.00 0.00 H -ATOM 4654 CD ARG 297 19.209 -11.337 5.845 1.00 0.00 C -ATOM 4655 HD2 ARG 297 19.390 -11.823 4.886 1.00 0.00 H -ATOM 4656 HD3 ARG 297 20.098 -10.874 6.272 1.00 0.00 H -ATOM 4657 NE ARG 297 18.571 -12.374 6.790 1.00 0.00 N -ATOM 4658 HE ARG 297 18.400 -13.315 6.466 1.00 0.00 H -ATOM 4659 CZ ARG 297 18.484 -12.169 8.083 1.00 0.00 C -ATOM 4660 NH1 ARG 297 19.015 -11.121 8.627 1.00 0.00 N -ATOM 4661 HH11 ARG 297 19.266 -10.316 8.072 1.00 0.00 H -ATOM 4662 HH12 ARG 297 19.069 -11.079 9.635 1.00 0.00 H -ATOM 4663 NH2 ARG 297 17.925 -13.035 8.858 1.00 0.00 N -ATOM 4664 HH21 ARG 297 17.956 -14.011 8.598 1.00 0.00 H -ATOM 4665 HH22 ARG 297 17.802 -12.748 9.819 1.00 0.00 H -ATOM 4666 C ARG 297 18.482 -6.825 3.872 1.00 0.00 C -ATOM 4667 O ARG 297 18.982 -6.229 4.828 1.00 0.00 O -ATOM 4668 N GLU 298 18.551 -6.415 2.623 1.00 0.00 N -ATOM 4669 H GLU 298 18.147 -6.996 1.903 1.00 0.00 H -ATOM 4670 CA GLU 298 19.208 -5.172 2.253 1.00 0.00 C -ATOM 4671 HA GLU 298 20.137 -5.104 2.819 1.00 0.00 H -ATOM 4672 CB GLU 298 19.693 -5.170 0.809 1.00 0.00 C -ATOM 4673 HB2 GLU 298 18.891 -5.008 0.089 1.00 0.00 H -ATOM 4674 HB3 GLU 298 20.363 -4.318 0.696 1.00 0.00 H -ATOM 4675 CG GLU 298 20.538 -6.372 0.276 1.00 0.00 C -ATOM 4676 HG2 GLU 298 19.841 -7.206 0.352 1.00 0.00 H -ATOM 4677 HG3 GLU 298 20.855 -6.299 -0.764 1.00 0.00 H -ATOM 4678 CD GLU 298 21.792 -6.642 1.169 1.00 0.00 C -ATOM 4679 OE1 GLU 298 21.818 -7.636 1.921 1.00 0.00 O -ATOM 4680 OE2 GLU 298 22.836 -5.913 1.088 1.00 0.00 O -ATOM 4681 C GLU 298 18.477 -3.929 2.571 1.00 0.00 C -ATOM 4682 O GLU 298 19.071 -2.867 2.431 1.00 0.00 O -ATOM 4683 N SER 299 17.212 -4.048 2.978 1.00 0.00 N -ATOM 4684 H SER 299 16.852 -4.991 2.940 1.00 0.00 H -ATOM 4685 CA SER 299 16.402 -2.958 3.407 1.00 0.00 C -ATOM 4686 HA SER 299 17.129 -2.286 3.864 1.00 0.00 H -ATOM 4687 CB SER 299 15.833 -2.141 2.298 1.00 0.00 C -ATOM 4688 HB2 SER 299 16.642 -1.587 1.822 1.00 0.00 H -ATOM 4689 HB3 SER 299 15.270 -2.757 1.598 1.00 0.00 H -ATOM 4690 OG SER 299 15.013 -1.170 2.871 1.00 0.00 O -ATOM 4691 HG SER 299 15.578 -0.489 3.243 1.00 0.00 H -ATOM 4692 C SER 299 15.425 -3.376 4.452 1.00 0.00 C -ATOM 4693 O SER 299 14.726 -4.361 4.314 1.00 0.00 O -ATOM 4694 N LYS 300 15.202 -2.497 5.414 1.00 0.00 N -ATOM 4695 H LYS 300 15.705 -1.622 5.381 1.00 0.00 H -ATOM 4696 CA LYS 300 14.204 -2.700 6.544 1.00 0.00 C -ATOM 4697 HA LYS 300 14.451 -3.610 7.092 1.00 0.00 H -ATOM 4698 CB LYS 300 14.272 -1.483 7.528 1.00 0.00 C -ATOM 4699 HB2 LYS 300 14.195 -0.510 7.042 1.00 0.00 H -ATOM 4700 HB3 LYS 300 13.442 -1.658 8.212 1.00 0.00 H -ATOM 4701 CG LYS 300 15.478 -1.508 8.347 1.00 0.00 C -ATOM 4702 HG2 LYS 300 15.285 -2.091 9.247 1.00 0.00 H -ATOM 4703 HG3 LYS 300 16.235 -1.991 7.730 1.00 0.00 H -ATOM 4704 CD LYS 300 16.016 -0.106 8.771 1.00 0.00 C -ATOM 4705 HD2 LYS 300 16.044 0.516 7.877 1.00 0.00 H -ATOM 4706 HD3 LYS 300 15.404 0.401 9.517 1.00 0.00 H -ATOM 4707 CE LYS 300 17.467 -0.192 9.232 1.00 0.00 C -ATOM 4708 HE2 LYS 300 18.048 -0.784 8.525 1.00 0.00 H -ATOM 4709 HE3 LYS 300 17.802 0.845 9.229 1.00 0.00 H -ATOM 4710 NZ LYS 300 17.711 -0.620 10.631 1.00 0.00 N -ATOM 4711 HZ1 LYS 300 17.529 -1.596 10.815 1.00 0.00 H -ATOM 4712 HZ2 LYS 300 18.637 -0.399 10.968 1.00 0.00 H -ATOM 4713 HZ3 LYS 300 17.142 -0.163 11.329 1.00 0.00 H -ATOM 4714 C LYS 300 12.749 -2.883 6.089 1.00 0.00 C -ATOM 4715 O LYS 300 12.088 -3.773 6.602 1.00 0.00 O -ATOM 4716 N LEU 301 12.272 -1.965 5.209 1.00 0.00 N -ATOM 4717 H LEU 301 12.931 -1.283 4.863 1.00 0.00 H -ATOM 4718 CA LEU 301 10.935 -2.090 4.531 1.00 0.00 C -ATOM 4719 HA LEU 301 10.128 -1.822 5.213 1.00 0.00 H -ATOM 4720 CB LEU 301 10.878 -1.015 3.436 1.00 0.00 C -ATOM 4721 HB2 LEU 301 10.904 0.002 3.827 1.00 0.00 H -ATOM 4722 HB3 LEU 301 11.818 -1.022 2.884 1.00 0.00 H -ATOM 4723 CG LEU 301 9.733 -1.139 2.430 1.00 0.00 C -ATOM 4724 HG LEU 301 9.715 -2.152 2.029 1.00 0.00 H -ATOM 4725 CD1 LEU 301 8.409 -0.887 3.081 1.00 0.00 C -ATOM 4726 HD11 LEU 301 7.584 -1.022 2.382 1.00 0.00 H -ATOM 4727 HD12 LEU 301 8.205 -1.592 3.887 1.00 0.00 H -ATOM 4728 HD13 LEU 301 8.397 0.149 3.419 1.00 0.00 H -ATOM 4729 CD2 LEU 301 9.984 -0.150 1.244 1.00 0.00 C -ATOM 4730 HD21 LEU 301 9.097 -0.051 0.618 1.00 0.00 H -ATOM 4731 HD22 LEU 301 10.284 0.803 1.678 1.00 0.00 H -ATOM 4732 HD23 LEU 301 10.787 -0.592 0.654 1.00 0.00 H -ATOM 4733 C LEU 301 10.735 -3.469 3.957 1.00 0.00 C -ATOM 4734 O LEU 301 9.744 -4.154 4.297 1.00 0.00 O -ATOM 4735 N THR 302 11.715 -3.944 3.173 1.00 0.00 N -ATOM 4736 H THR 302 12.578 -3.422 3.107 1.00 0.00 H -ATOM 4737 CA THR 302 11.627 -5.300 2.638 1.00 0.00 C -ATOM 4738 HA THR 302 10.614 -5.477 2.276 1.00 0.00 H -ATOM 4739 CB THR 302 12.520 -5.574 1.385 1.00 0.00 C -ATOM 4740 HB THR 302 12.532 -6.660 1.291 1.00 0.00 H -ATOM 4741 CG2 THR 302 12.093 -4.848 0.104 1.00 0.00 C -ATOM 4742 HG21 THR 302 12.422 -3.811 0.038 1.00 0.00 H -ATOM 4743 HG22 THR 302 12.594 -5.407 -0.687 1.00 0.00 H -ATOM 4744 HG23 THR 302 11.046 -5.020 -0.145 1.00 0.00 H -ATOM 4745 OG1 THR 302 13.861 -5.157 1.705 1.00 0.00 O -ATOM 4746 HG1 THR 302 14.303 -5.806 2.257 1.00 0.00 H -ATOM 4747 C THR 302 11.863 -6.355 3.774 1.00 0.00 C -ATOM 4748 O THR 302 11.211 -7.399 3.737 1.00 0.00 O -ATOM 4749 N ARG 303 12.577 -6.047 4.867 1.00 0.00 N -ATOM 4750 H ARG 303 13.018 -5.139 4.873 1.00 0.00 H -ATOM 4751 CA ARG 303 12.691 -6.917 6.007 1.00 0.00 C -ATOM 4752 HA ARG 303 12.995 -7.896 5.636 1.00 0.00 H -ATOM 4753 CB ARG 303 13.881 -6.490 6.912 1.00 0.00 C -ATOM 4754 HB2 ARG 303 14.762 -6.159 6.362 1.00 0.00 H -ATOM 4755 HB3 ARG 303 13.555 -5.618 7.480 1.00 0.00 H -ATOM 4756 CG ARG 303 14.335 -7.666 7.839 1.00 0.00 C -ATOM 4757 HG2 ARG 303 14.615 -7.357 8.846 1.00 0.00 H -ATOM 4758 HG3 ARG 303 13.518 -8.381 7.941 1.00 0.00 H -ATOM 4759 CD ARG 303 15.454 -8.495 7.304 1.00 0.00 C -ATOM 4760 HD2 ARG 303 15.000 -8.932 6.415 1.00 0.00 H -ATOM 4761 HD3 ARG 303 16.380 -7.940 7.149 1.00 0.00 H -ATOM 4762 NE ARG 303 15.587 -9.653 8.229 1.00 0.00 N -ATOM 4763 HE ARG 303 15.177 -10.545 7.993 1.00 0.00 H -ATOM 4764 CZ ARG 303 16.192 -9.633 9.389 1.00 0.00 C -ATOM 4765 NH1 ARG 303 16.979 -8.702 9.844 1.00 0.00 N -ATOM 4766 HH11 ARG 303 16.946 -7.763 9.472 1.00 0.00 H -ATOM 4767 HH12 ARG 303 17.398 -8.785 10.759 1.00 0.00 H -ATOM 4768 NH2 ARG 303 16.029 -10.555 10.243 1.00 0.00 N -ATOM 4769 HH21 ARG 303 15.429 -11.342 10.040 1.00 0.00 H -ATOM 4770 HH22 ARG 303 16.467 -10.378 11.135 1.00 0.00 H -ATOM 4771 C ARG 303 11.361 -7.092 6.846 1.00 0.00 C -ATOM 4772 O ARG 303 11.027 -8.187 7.284 1.00 0.00 O -ATOM 4773 N ILE 304 10.638 -6.003 7.032 1.00 0.00 N -ATOM 4774 H ILE 304 11.009 -5.110 6.739 1.00 0.00 H -ATOM 4775 CA ILE 304 9.325 -6.063 7.646 1.00 0.00 C -ATOM 4776 HA ILE 304 9.560 -6.730 8.475 1.00 0.00 H -ATOM 4777 CB ILE 304 8.816 -4.674 8.279 1.00 0.00 C -ATOM 4778 HB ILE 304 9.732 -4.409 8.806 1.00 0.00 H -ATOM 4779 CG2 ILE 304 8.588 -3.536 7.226 1.00 0.00 C -ATOM 4780 HG21 ILE 304 8.019 -3.979 6.409 1.00 0.00 H -ATOM 4781 HG22 ILE 304 8.107 -2.635 7.608 1.00 0.00 H -ATOM 4782 HG23 ILE 304 9.615 -3.288 6.959 1.00 0.00 H -ATOM 4783 CG1 ILE 304 7.667 -4.804 9.293 1.00 0.00 C -ATOM 4784 HG12 ILE 304 7.303 -3.814 9.571 1.00 0.00 H -ATOM 4785 HG13 ILE 304 6.779 -5.207 8.805 1.00 0.00 H -ATOM 4786 CD1 ILE 304 7.992 -5.618 10.508 1.00 0.00 C -ATOM 4787 HD11 ILE 304 7.261 -5.424 11.293 1.00 0.00 H -ATOM 4788 HD12 ILE 304 8.184 -6.671 10.303 1.00 0.00 H -ATOM 4789 HD13 ILE 304 8.871 -5.181 10.983 1.00 0.00 H -ATOM 4790 C ILE 304 8.299 -6.683 6.666 1.00 0.00 C -ATOM 4791 O ILE 304 7.330 -7.312 7.166 1.00 0.00 O -ATOM 4792 N LEU 305 8.459 -6.643 5.263 1.00 0.00 N -ATOM 4793 H LEU 305 9.334 -6.272 4.921 1.00 0.00 H -ATOM 4794 CA LEU 305 7.403 -7.074 4.318 1.00 0.00 C -ATOM 4795 HA LEU 305 6.566 -7.370 4.950 1.00 0.00 H -ATOM 4796 CB LEU 305 6.920 -6.005 3.354 1.00 0.00 C -ATOM 4797 HB2 LEU 305 7.703 -5.724 2.650 1.00 0.00 H -ATOM 4798 HB3 LEU 305 6.129 -6.440 2.744 1.00 0.00 H -ATOM 4799 CG LEU 305 6.468 -4.697 3.972 1.00 0.00 C -ATOM 4800 HG LEU 305 7.271 -4.300 4.594 1.00 0.00 H -ATOM 4801 CD1 LEU 305 6.310 -3.563 2.918 1.00 0.00 C -ATOM 4802 HD11 LEU 305 5.955 -2.681 3.450 1.00 0.00 H -ATOM 4803 HD12 LEU 305 7.248 -3.319 2.419 1.00 0.00 H -ATOM 4804 HD13 LEU 305 5.576 -3.855 2.166 1.00 0.00 H -ATOM 4805 CD2 LEU 305 5.179 -4.744 4.692 1.00 0.00 C -ATOM 4806 HD21 LEU 305 5.065 -5.547 5.421 1.00 0.00 H -ATOM 4807 HD22 LEU 305 5.072 -3.797 5.221 1.00 0.00 H -ATOM 4808 HD23 LEU 305 4.327 -4.772 4.014 1.00 0.00 H -ATOM 4809 C LEU 305 7.739 -8.416 3.605 1.00 0.00 C -ATOM 4810 O LEU 305 7.096 -8.684 2.555 1.00 0.00 O -ATOM 4811 N GLN 306 8.794 -9.137 4.021 1.00 0.00 N -ATOM 4812 H GLN 306 9.195 -8.679 4.827 1.00 0.00 H -ATOM 4813 CA GLN 306 9.381 -10.275 3.302 1.00 0.00 C -ATOM 4814 HA GLN 306 9.719 -10.002 2.302 1.00 0.00 H -ATOM 4815 CB GLN 306 10.634 -10.883 4.075 1.00 0.00 C -ATOM 4816 HB2 GLN 306 11.037 -11.659 3.425 1.00 0.00 H -ATOM 4817 HB3 GLN 306 11.355 -10.067 4.126 1.00 0.00 H -ATOM 4818 CG GLN 306 10.358 -11.210 5.572 1.00 0.00 C -ATOM 4819 HG2 GLN 306 9.987 -10.322 6.084 1.00 0.00 H -ATOM 4820 HG3 GLN 306 9.521 -11.907 5.617 1.00 0.00 H -ATOM 4821 CD GLN 306 11.534 -11.851 6.195 1.00 0.00 C -ATOM 4822 OE1 GLN 306 12.377 -12.462 5.580 1.00 0.00 O -ATOM 4823 NE2 GLN 306 11.692 -11.762 7.464 1.00 0.00 N -ATOM 4824 HE21 GLN 306 12.482 -12.204 7.910 1.00 0.00 H -ATOM 4825 HE22 GLN 306 11.055 -11.178 7.988 1.00 0.00 H -ATOM 4826 C GLN 306 8.253 -11.336 3.102 1.00 0.00 C -ATOM 4827 O GLN 306 8.182 -11.831 1.974 1.00 0.00 O -ATOM 4828 N ASP 307 7.200 -11.435 3.918 1.00 0.00 N -ATOM 4829 H ASP 307 7.215 -10.914 4.783 1.00 0.00 H -ATOM 4830 CA ASP 307 6.145 -12.522 3.687 1.00 0.00 C -ATOM 4831 HA ASP 307 6.665 -13.342 3.193 1.00 0.00 H -ATOM 4832 CB ASP 307 5.470 -12.944 5.047 1.00 0.00 C -ATOM 4833 HB2 ASP 307 4.834 -12.114 5.354 1.00 0.00 H -ATOM 4834 HB3 ASP 307 4.878 -13.814 4.762 1.00 0.00 H -ATOM 4835 CG ASP 307 6.393 -13.459 6.085 1.00 0.00 C -ATOM 4836 OD1 ASP 307 6.168 -13.215 7.320 1.00 0.00 O -ATOM 4837 OD2 ASP 307 7.206 -14.298 5.663 1.00 0.00 O -ATOM 4838 C ASP 307 5.062 -12.158 2.669 1.00 0.00 C -ATOM 4839 O ASP 307 4.467 -13.030 2.041 1.00 0.00 O -ATOM 4840 N SER 308 4.855 -10.836 2.418 1.00 0.00 N -ATOM 4841 H SER 308 5.494 -10.153 2.797 1.00 0.00 H -ATOM 4842 CA SER 308 3.996 -10.390 1.357 1.00 0.00 C -ATOM 4843 HA SER 308 3.066 -10.953 1.434 1.00 0.00 H -ATOM 4844 CB SER 308 3.691 -8.878 1.557 1.00 0.00 C -ATOM 4845 HB2 SER 308 4.650 -8.372 1.450 1.00 0.00 H -ATOM 4846 HB3 SER 308 3.128 -8.433 0.736 1.00 0.00 H -ATOM 4847 OG SER 308 3.017 -8.563 2.807 1.00 0.00 O -ATOM 4848 HG SER 308 3.613 -8.812 3.517 1.00 0.00 H -ATOM 4849 C SER 308 4.725 -10.523 -0.033 1.00 0.00 C -ATOM 4850 O SER 308 4.012 -10.766 -0.977 1.00 0.00 O -ATOM 4851 N LEU 309 6.011 -10.229 -0.106 1.00 0.00 N -ATOM 4852 H LEU 309 6.505 -10.057 0.758 1.00 0.00 H -ATOM 4853 CA LEU 309 6.827 -10.151 -1.290 1.00 0.00 C -ATOM 4854 HA LEU 309 6.226 -9.766 -2.113 1.00 0.00 H -ATOM 4855 CB LEU 309 8.020 -9.138 -1.062 1.00 0.00 C -ATOM 4856 HB2 LEU 309 8.689 -9.438 -0.255 1.00 0.00 H -ATOM 4857 HB3 LEU 309 8.668 -9.046 -1.934 1.00 0.00 H -ATOM 4858 CG LEU 309 7.367 -7.765 -0.854 1.00 0.00 C -ATOM 4859 HG LEU 309 6.569 -7.851 -0.116 1.00 0.00 H -ATOM 4860 CD1 LEU 309 8.490 -6.879 -0.253 1.00 0.00 C -ATOM 4861 HD11 LEU 309 8.085 -5.914 0.052 1.00 0.00 H -ATOM 4862 HD12 LEU 309 8.921 -7.415 0.593 1.00 0.00 H -ATOM 4863 HD13 LEU 309 9.173 -6.730 -1.089 1.00 0.00 H -ATOM 4864 CD2 LEU 309 6.822 -7.020 -2.088 1.00 0.00 C -ATOM 4865 HD21 LEU 309 7.486 -7.166 -2.941 1.00 0.00 H -ATOM 4866 HD22 LEU 309 5.856 -7.509 -2.216 1.00 0.00 H -ATOM 4867 HD23 LEU 309 6.758 -5.938 -1.978 1.00 0.00 H -ATOM 4868 C LEU 309 7.240 -11.575 -1.680 1.00 0.00 C -ATOM 4869 O LEU 309 8.346 -11.977 -1.440 1.00 0.00 O -ATOM 4870 N GLY 310 6.391 -12.354 -2.383 1.00 0.00 N -ATOM 4871 H GLY 310 5.477 -11.940 -2.502 1.00 0.00 H -ATOM 4872 CA GLY 310 6.528 -13.745 -2.788 1.00 0.00 C -ATOM 4873 HA2 GLY 310 5.803 -14.047 -3.545 1.00 0.00 H -ATOM 4874 HA3 GLY 310 7.502 -13.868 -3.261 1.00 0.00 H -ATOM 4875 C GLY 310 6.446 -14.778 -1.697 1.00 0.00 C -ATOM 4876 O GLY 310 6.267 -15.957 -1.925 1.00 0.00 O -ATOM 4877 N GLY 311 6.362 -14.409 -0.408 1.00 0.00 N -ATOM 4878 H GLY 311 6.283 -13.421 -0.213 1.00 0.00 H -ATOM 4879 CA GLY 311 6.023 -15.321 0.688 1.00 0.00 C -ATOM 4880 HA2 GLY 311 6.563 -16.245 0.481 1.00 0.00 H -ATOM 4881 HA3 GLY 311 6.443 -14.875 1.589 1.00 0.00 H -ATOM 4882 C GLY 311 4.599 -15.714 0.993 1.00 0.00 C -ATOM 4883 O GLY 311 3.835 -15.729 0.057 1.00 0.00 O -ATOM 4884 N ARG 312 4.323 -16.066 2.237 1.00 0.00 N -ATOM 4885 H ARG 312 5.067 -16.068 2.920 1.00 0.00 H -ATOM 4886 CA ARG 312 2.874 -16.462 2.548 1.00 0.00 C -ATOM 4887 HA ARG 312 2.565 -17.258 1.870 1.00 0.00 H -ATOM 4888 CB ARG 312 2.732 -17.000 3.996 1.00 0.00 C -ATOM 4889 HB2 ARG 312 3.358 -16.424 4.678 1.00 0.00 H -ATOM 4890 HB3 ARG 312 1.708 -16.961 4.370 1.00 0.00 H -ATOM 4891 CG ARG 312 3.307 -18.402 4.052 1.00 0.00 C -ATOM 4892 HG2 ARG 312 4.070 -18.577 3.293 1.00 0.00 H -ATOM 4893 HG3 ARG 312 3.702 -18.607 5.047 1.00 0.00 H -ATOM 4894 CD ARG 312 2.079 -19.375 4.035 1.00 0.00 C -ATOM 4895 HD2 ARG 312 2.368 -20.119 4.777 1.00 0.00 H -ATOM 4896 HD3 ARG 312 1.171 -18.866 4.356 1.00 0.00 H -ATOM 4897 NE ARG 312 1.791 -20.047 2.718 1.00 0.00 N -ATOM 4898 HE ARG 312 2.201 -19.628 1.895 1.00 0.00 H -ATOM 4899 CZ ARG 312 0.765 -20.827 2.435 1.00 0.00 C -ATOM 4900 NH1 ARG 312 0.013 -21.335 3.396 1.00 0.00 N -ATOM 4901 HH11 ARG 312 0.172 -21.089 4.362 1.00 0.00 H -ATOM 4902 HH12 ARG 312 -0.504 -22.175 3.178 1.00 0.00 H -ATOM 4903 NH2 ARG 312 0.450 -21.117 1.233 1.00 0.00 N -ATOM 4904 HH21 ARG 312 0.954 -20.612 0.517 1.00 0.00 H -ATOM 4905 HH22 ARG 312 -0.230 -21.850 1.090 1.00 0.00 H -ATOM 4906 C ARG 312 1.771 -15.395 2.387 1.00 0.00 C -ATOM 4907 O ARG 312 0.669 -15.855 2.063 1.00 0.00 O -ATOM 4908 N THR 313 2.015 -14.099 2.582 1.00 0.00 N -ATOM 4909 H THR 313 2.962 -13.763 2.677 1.00 0.00 H -ATOM 4910 CA THR 313 0.902 -13.162 2.788 1.00 0.00 C -ATOM 4911 HA THR 313 0.156 -13.679 3.391 1.00 0.00 H -ATOM 4912 CB THR 313 1.351 -11.936 3.539 1.00 0.00 C -ATOM 4913 HB THR 313 2.385 -11.725 3.267 1.00 0.00 H -ATOM 4914 CG2 THR 313 0.527 -10.662 3.492 1.00 0.00 C -ATOM 4915 HG21 THR 313 -0.546 -10.845 3.549 1.00 0.00 H -ATOM 4916 HG22 THR 313 0.814 -9.992 4.302 1.00 0.00 H -ATOM 4917 HG23 THR 313 0.842 -10.134 2.592 1.00 0.00 H -ATOM 4918 OG1 THR 313 1.374 -12.273 4.911 1.00 0.00 O -ATOM 4919 HG1 THR 313 1.843 -13.090 5.091 1.00 0.00 H -ATOM 4920 C THR 313 0.254 -12.711 1.461 1.00 0.00 C -ATOM 4921 O THR 313 0.990 -12.232 0.604 1.00 0.00 O -ATOM 4922 N ARG 314 -0.976 -13.069 1.179 1.00 0.00 N -ATOM 4923 H ARG 314 -1.463 -13.603 1.885 1.00 0.00 H -ATOM 4924 CA ARG 314 -1.606 -13.039 -0.179 1.00 0.00 C -ATOM 4925 HA ARG 314 -1.085 -13.605 -0.952 1.00 0.00 H -ATOM 4926 CB ARG 314 -3.006 -13.551 -0.040 1.00 0.00 C -ATOM 4927 HB2 ARG 314 -2.903 -14.591 0.269 1.00 0.00 H -ATOM 4928 HB3 ARG 314 -3.510 -13.052 0.787 1.00 0.00 H -ATOM 4929 CG ARG 314 -3.809 -13.496 -1.287 1.00 0.00 C -ATOM 4930 HG2 ARG 314 -4.058 -12.467 -1.547 1.00 0.00 H -ATOM 4931 HG3 ARG 314 -3.202 -13.926 -2.083 1.00 0.00 H -ATOM 4932 CD ARG 314 -5.175 -14.150 -1.113 1.00 0.00 C -ATOM 4933 HD2 ARG 314 -4.926 -15.203 -0.987 1.00 0.00 H -ATOM 4934 HD3 ARG 314 -5.713 -13.826 -0.222 1.00 0.00 H -ATOM 4935 NE ARG 314 -5.934 -13.885 -2.409 1.00 0.00 N -ATOM 4936 HE ARG 314 -5.525 -13.189 -3.016 1.00 0.00 H -ATOM 4937 CZ ARG 314 -7.211 -14.085 -2.436 1.00 0.00 C -ATOM 4938 NH1 ARG 314 -7.815 -15.018 -1.646 1.00 0.00 N -ATOM 4939 HH11 ARG 314 -7.363 -15.799 -1.193 1.00 0.00 H -ATOM 4940 HH12 ARG 314 -8.823 -15.078 -1.621 1.00 0.00 H -ATOM 4941 NH2 ARG 314 -7.966 -13.445 -3.293 1.00 0.00 N -ATOM 4942 HH21 ARG 314 -7.566 -12.719 -3.870 1.00 0.00 H -ATOM 4943 HH22 ARG 314 -8.960 -13.620 -3.278 1.00 0.00 H -ATOM 4944 C ARG 314 -1.653 -11.538 -0.546 1.00 0.00 C -ATOM 4945 O ARG 314 -2.249 -10.740 0.196 1.00 0.00 O -ATOM 4946 N THR 315 -1.023 -11.260 -1.663 1.00 0.00 N -ATOM 4947 H THR 315 -0.415 -11.947 -2.087 1.00 0.00 H -ATOM 4948 CA THR 315 -0.683 -9.897 -2.027 1.00 0.00 C -ATOM 4949 HA THR 315 -0.947 -9.286 -1.164 1.00 0.00 H -ATOM 4950 CB THR 315 0.867 -9.736 -2.098 1.00 0.00 C -ATOM 4951 HB THR 315 1.169 -10.468 -2.846 1.00 0.00 H -ATOM 4952 CG2 THR 315 1.405 -8.403 -2.469 1.00 0.00 C -ATOM 4953 HG21 THR 315 1.211 -8.191 -3.521 1.00 0.00 H -ATOM 4954 HG22 THR 315 0.848 -7.569 -2.042 1.00 0.00 H -ATOM 4955 HG23 THR 315 2.485 -8.383 -2.319 1.00 0.00 H -ATOM 4956 OG1 THR 315 1.266 -9.924 -0.751 1.00 0.00 O -ATOM 4957 HG1 THR 315 1.395 -10.863 -0.598 1.00 0.00 H -ATOM 4958 C THR 315 -1.398 -9.375 -3.282 1.00 0.00 C -ATOM 4959 O THR 315 -1.497 -10.056 -4.299 1.00 0.00 O -ATOM 4960 N SER 316 -1.983 -8.142 -3.180 1.00 0.00 N -ATOM 4961 H SER 316 -2.103 -7.766 -2.251 1.00 0.00 H -ATOM 4962 CA SER 316 -2.432 -7.306 -4.312 1.00 0.00 C -ATOM 4963 HA SER 316 -2.323 -7.930 -5.199 1.00 0.00 H -ATOM 4964 CB SER 316 -3.866 -6.923 -3.999 1.00 0.00 C -ATOM 4965 HB2 SER 316 -4.436 -7.838 -3.843 1.00 0.00 H -ATOM 4966 HB3 SER 316 -3.825 -6.392 -3.048 1.00 0.00 H -ATOM 4967 OG SER 316 -4.543 -6.180 -5.046 1.00 0.00 O -ATOM 4968 HG SER 316 -5.492 -6.307 -4.973 1.00 0.00 H -ATOM 4969 C SER 316 -1.511 -6.106 -4.621 1.00 0.00 C -ATOM 4970 O SER 316 -1.014 -5.596 -3.657 1.00 0.00 O -ATOM 4971 N ILE 317 -1.361 -5.674 -5.909 1.00 0.00 N -ATOM 4972 H ILE 317 -1.851 -6.222 -6.602 1.00 0.00 H -ATOM 4973 CA ILE 317 -0.544 -4.507 -6.259 1.00 0.00 C -ATOM 4974 HA ILE 317 -0.319 -3.965 -5.341 1.00 0.00 H -ATOM 4975 CB ILE 317 0.754 -5.026 -6.866 1.00 0.00 C -ATOM 4976 HB ILE 317 0.567 -5.480 -7.838 1.00 0.00 H -ATOM 4977 CG2 ILE 317 1.648 -3.816 -7.250 1.00 0.00 C -ATOM 4978 HG21 ILE 317 1.148 -3.201 -7.999 1.00 0.00 H -ATOM 4979 HG22 ILE 317 1.841 -3.245 -6.342 1.00 0.00 H -ATOM 4980 HG23 ILE 317 2.621 -4.128 -7.630 1.00 0.00 H -ATOM 4981 CG1 ILE 317 1.620 -6.023 -6.024 1.00 0.00 C -ATOM 4982 HG12 ILE 317 1.775 -5.490 -5.086 1.00 0.00 H -ATOM 4983 HG13 ILE 317 1.050 -6.930 -5.823 1.00 0.00 H -ATOM 4984 CD1 ILE 317 2.954 -6.460 -6.568 1.00 0.00 C -ATOM 4985 HD11 ILE 317 2.725 -7.024 -7.471 1.00 0.00 H -ATOM 4986 HD12 ILE 317 3.679 -5.686 -6.822 1.00 0.00 H -ATOM 4987 HD13 ILE 317 3.422 -7.019 -5.758 1.00 0.00 H -ATOM 4988 C ILE 317 -1.327 -3.450 -7.034 1.00 0.00 C -ATOM 4989 O ILE 317 -1.645 -3.791 -8.170 1.00 0.00 O -ATOM 4990 N ILE 318 -1.555 -2.200 -6.474 1.00 0.00 N -ATOM 4991 H ILE 318 -1.261 -1.924 -5.548 1.00 0.00 H -ATOM 4992 CA ILE 318 -2.232 -1.101 -7.286 1.00 0.00 C -ATOM 4993 HA ILE 318 -2.788 -1.539 -8.115 1.00 0.00 H -ATOM 4994 CB ILE 318 -3.210 -0.375 -6.391 1.00 0.00 C -ATOM 4995 HB ILE 318 -2.696 0.168 -5.598 1.00 0.00 H -ATOM 4996 CG2 ILE 318 -4.033 0.722 -7.166 1.00 0.00 C -ATOM 4997 HG21 ILE 318 -4.672 1.336 -6.531 1.00 0.00 H -ATOM 4998 HG22 ILE 318 -3.346 1.299 -7.785 1.00 0.00 H -ATOM 4999 HG23 ILE 318 -4.845 0.313 -7.767 1.00 0.00 H -ATOM 5000 CG1 ILE 318 -4.292 -1.286 -5.798 1.00 0.00 C -ATOM 5001 HG12 ILE 318 -5.128 -1.512 -6.461 1.00 0.00 H -ATOM 5002 HG13 ILE 318 -3.882 -2.250 -5.498 1.00 0.00 H -ATOM 5003 CD1 ILE 318 -4.909 -0.800 -4.461 1.00 0.00 C -ATOM 5004 HD11 ILE 318 -4.135 -0.780 -3.693 1.00 0.00 H -ATOM 5005 HD12 ILE 318 -5.291 0.221 -4.473 1.00 0.00 H -ATOM 5006 HD13 ILE 318 -5.741 -1.476 -4.265 1.00 0.00 H -ATOM 5007 C ILE 318 -1.150 -0.214 -7.867 1.00 0.00 C -ATOM 5008 O ILE 318 -0.494 0.559 -7.147 1.00 0.00 O -ATOM 5009 N ALA 319 -1.111 -0.176 -9.179 1.00 0.00 N -ATOM 5010 H ALA 319 -1.774 -0.720 -9.712 1.00 0.00 H -ATOM 5011 CA ALA 319 -0.301 0.818 -9.874 1.00 0.00 C -ATOM 5012 HA ALA 319 0.512 1.120 -9.213 1.00 0.00 H -ATOM 5013 CB ALA 319 0.179 0.147 -11.185 1.00 0.00 C -ATOM 5014 HB1 ALA 319 0.868 0.814 -11.704 1.00 0.00 H -ATOM 5015 HB2 ALA 319 0.842 -0.680 -10.930 1.00 0.00 H -ATOM 5016 HB3 ALA 319 -0.694 -0.167 -11.758 1.00 0.00 H -ATOM 5017 C ALA 319 -1.179 2.077 -10.157 1.00 0.00 C -ATOM 5018 O ALA 319 -2.153 1.938 -10.906 1.00 0.00 O -ATOM 5019 N THR 320 -0.744 3.203 -9.599 1.00 0.00 N -ATOM 5020 H THR 320 0.094 3.231 -9.035 1.00 0.00 H -ATOM 5021 CA THR 320 -1.333 4.541 -9.823 1.00 0.00 C -ATOM 5022 HA THR 320 -2.293 4.378 -10.312 1.00 0.00 H -ATOM 5023 CB THR 320 -1.597 5.410 -8.524 1.00 0.00 C -ATOM 5024 HB THR 320 -2.116 6.318 -8.831 1.00 0.00 H -ATOM 5025 CG2 THR 320 -2.523 4.615 -7.606 1.00 0.00 C -ATOM 5026 HG21 THR 320 -1.974 4.153 -6.786 1.00 0.00 H -ATOM 5027 HG22 THR 320 -3.262 5.277 -7.155 1.00 0.00 H -ATOM 5028 HG23 THR 320 -3.077 3.872 -8.179 1.00 0.00 H -ATOM 5029 OG1 THR 320 -0.422 5.729 -7.843 1.00 0.00 O -ATOM 5030 HG1 THR 320 -0.090 6.523 -8.268 1.00 0.00 H -ATOM 5031 C THR 320 -0.578 5.278 -10.901 1.00 0.00 C -ATOM 5032 O THR 320 0.668 5.271 -10.938 1.00 0.00 O -ATOM 5033 N ILE 321 -1.358 5.912 -11.826 1.00 0.00 N -ATOM 5034 H ILE 321 -2.341 5.880 -11.597 1.00 0.00 H -ATOM 5035 CA ILE 321 -0.834 6.713 -12.987 1.00 0.00 C -ATOM 5036 HA ILE 321 0.123 7.168 -12.731 1.00 0.00 H -ATOM 5037 CB ILE 321 -0.717 5.837 -14.230 1.00 0.00 C -ATOM 5038 HB ILE 321 -0.405 6.473 -15.058 1.00 0.00 H -ATOM 5039 CG2 ILE 321 0.296 4.669 -14.092 1.00 0.00 C -ATOM 5040 HG21 ILE 321 1.272 4.991 -13.729 1.00 0.00 H -ATOM 5041 HG22 ILE 321 -0.083 4.046 -13.282 1.00 0.00 H -ATOM 5042 HG23 ILE 321 0.379 4.063 -14.994 1.00 0.00 H -ATOM 5043 CG1 ILE 321 -2.112 5.297 -14.657 1.00 0.00 C -ATOM 5044 HG12 ILE 321 -2.554 4.788 -13.800 1.00 0.00 H -ATOM 5045 HG13 ILE 321 -2.801 6.105 -14.905 1.00 0.00 H -ATOM 5046 CD1 ILE 321 -2.198 4.322 -15.864 1.00 0.00 C -ATOM 5047 HD11 ILE 321 -3.199 4.112 -16.242 1.00 0.00 H -ATOM 5048 HD12 ILE 321 -1.708 4.799 -16.713 1.00 0.00 H -ATOM 5049 HD13 ILE 321 -1.815 3.330 -15.624 1.00 0.00 H -ATOM 5050 C ILE 321 -1.765 7.938 -13.259 1.00 0.00 C -ATOM 5051 O ILE 321 -2.917 7.981 -12.800 1.00 0.00 O -ATOM 5052 N SER 322 -1.272 9.002 -13.918 1.00 0.00 N -ATOM 5053 H SER 322 -0.321 8.751 -14.150 1.00 0.00 H -ATOM 5054 CA SER 322 -1.892 10.104 -14.597 1.00 0.00 C -ATOM 5055 HA SER 322 -2.804 10.470 -14.126 1.00 0.00 H -ATOM 5056 CB SER 322 -0.893 11.242 -14.639 1.00 0.00 C -ATOM 5057 HB2 SER 322 -0.547 11.435 -13.624 1.00 0.00 H -ATOM 5058 HB3 SER 322 0.002 10.966 -15.197 1.00 0.00 H -ATOM 5059 OG SER 322 -1.626 12.305 -15.274 1.00 0.00 O -ATOM 5060 HG SER 322 -1.362 13.114 -14.830 1.00 0.00 H -ATOM 5061 C SER 322 -2.294 9.821 -16.078 1.00 0.00 C -ATOM 5062 O SER 322 -1.614 9.061 -16.785 1.00 0.00 O -ATOM 5063 N PRO 323 -3.393 10.346 -16.623 1.00 0.00 N -ATOM 5064 CD PRO 323 -4.458 10.989 -15.918 1.00 0.00 C -ATOM 5065 HD2 PRO 323 -4.038 11.706 -15.212 1.00 0.00 H -ATOM 5066 HD3 PRO 323 -5.088 10.286 -15.373 1.00 0.00 H -ATOM 5067 CG PRO 323 -5.298 11.748 -16.875 1.00 0.00 C -ATOM 5068 HG2 PRO 323 -4.872 12.745 -16.989 1.00 0.00 H -ATOM 5069 HG3 PRO 323 -6.283 11.761 -16.408 1.00 0.00 H -ATOM 5070 CB PRO 323 -5.173 10.916 -18.152 1.00 0.00 C -ATOM 5071 HB2 PRO 323 -5.289 11.497 -19.067 1.00 0.00 H -ATOM 5072 HB3 PRO 323 -5.892 10.096 -18.162 1.00 0.00 H -ATOM 5073 CA PRO 323 -3.771 10.380 -18.056 1.00 0.00 C -ATOM 5074 HA PRO 323 -3.762 9.397 -18.528 1.00 0.00 H -ATOM 5075 C PRO 323 -2.860 11.226 -18.945 1.00 0.00 C -ATOM 5076 O PRO 323 -2.413 10.864 -20.033 1.00 0.00 O -ATOM 5077 N ALA 324 -2.330 12.282 -18.310 1.00 0.00 N -ATOM 5078 H ALA 324 -2.649 12.425 -17.362 1.00 0.00 H -ATOM 5079 CA ALA 324 -1.751 13.430 -18.962 1.00 0.00 C -ATOM 5080 HA ALA 324 -2.542 13.732 -19.649 1.00 0.00 H -ATOM 5081 CB ALA 324 -1.568 14.420 -17.803 1.00 0.00 C -ATOM 5082 HB1 ALA 324 -2.557 14.621 -17.390 1.00 0.00 H -ATOM 5083 HB2 ALA 324 -0.818 14.055 -17.101 1.00 0.00 H -ATOM 5084 HB3 ALA 324 -1.217 15.331 -18.286 1.00 0.00 H -ATOM 5085 C ALA 324 -0.505 12.990 -19.677 1.00 0.00 C -ATOM 5086 O ALA 324 0.153 12.022 -19.314 1.00 0.00 O -ATOM 5087 N SER 325 -0.222 13.664 -20.826 1.00 0.00 N -ATOM 5088 H SER 325 -0.869 14.331 -21.220 1.00 0.00 H -ATOM 5089 CA SER 325 1.058 13.563 -21.477 1.00 0.00 C -ATOM 5090 HA SER 325 1.265 12.505 -21.634 1.00 0.00 H -ATOM 5091 CB SER 325 1.004 14.350 -22.802 1.00 0.00 C -ATOM 5092 HB2 SER 325 2.013 14.247 -23.203 1.00 0.00 H -ATOM 5093 HB3 SER 325 0.352 13.800 -23.481 1.00 0.00 H -ATOM 5094 OG SER 325 0.613 15.711 -22.585 1.00 0.00 O -ATOM 5095 HG SER 325 1.390 16.268 -22.669 1.00 0.00 H -ATOM 5096 C SER 325 2.250 14.085 -20.662 1.00 0.00 C -ATOM 5097 O SER 325 3.403 13.748 -20.935 1.00 0.00 O -ATOM 5098 N LEU 326 1.966 14.912 -19.595 1.00 0.00 N -ATOM 5099 H LEU 326 1.017 15.258 -19.596 1.00 0.00 H -ATOM 5100 CA LEU 326 2.984 15.739 -18.923 1.00 0.00 C -ATOM 5101 HA LEU 326 3.406 16.357 -19.715 1.00 0.00 H -ATOM 5102 CB LEU 326 2.258 16.573 -17.855 1.00 0.00 C -ATOM 5103 HB2 LEU 326 1.604 17.251 -18.403 1.00 0.00 H -ATOM 5104 HB3 LEU 326 1.650 15.914 -17.235 1.00 0.00 H -ATOM 5105 CG LEU 326 3.126 17.434 -16.991 1.00 0.00 C -ATOM 5106 HG LEU 326 3.865 16.823 -16.473 1.00 0.00 H -ATOM 5107 CD1 LEU 326 3.853 18.436 -17.809 1.00 0.00 C -ATOM 5108 HD11 LEU 326 4.559 18.115 -18.576 1.00 0.00 H -ATOM 5109 HD12 LEU 326 3.183 19.198 -18.208 1.00 0.00 H -ATOM 5110 HD13 LEU 326 4.535 18.872 -17.079 1.00 0.00 H -ATOM 5111 CD2 LEU 326 2.176 18.161 -15.989 1.00 0.00 C -ATOM 5112 HD21 LEU 326 2.760 18.600 -15.180 1.00 0.00 H -ATOM 5113 HD22 LEU 326 1.598 18.985 -16.406 1.00 0.00 H -ATOM 5114 HD23 LEU 326 1.563 17.429 -15.462 1.00 0.00 H -ATOM 5115 C LEU 326 4.192 14.888 -18.292 1.00 0.00 C -ATOM 5116 O LEU 326 5.255 15.367 -17.992 1.00 0.00 O -ATOM 5117 N ASN 327 3.965 13.610 -17.946 1.00 0.00 N -ATOM 5118 H ASN 327 3.061 13.253 -18.220 1.00 0.00 H -ATOM 5119 CA ASN 327 4.979 12.703 -17.391 1.00 0.00 C -ATOM 5120 HA ASN 327 5.978 13.065 -17.637 1.00 0.00 H -ATOM 5121 CB ASN 327 4.916 12.618 -15.855 1.00 0.00 C -ATOM 5122 HB2 ASN 327 3.986 12.167 -15.511 1.00 0.00 H -ATOM 5123 HB3 ASN 327 5.763 12.003 -15.548 1.00 0.00 H -ATOM 5124 CG ASN 327 5.175 13.983 -15.200 1.00 0.00 C -ATOM 5125 OD1 ASN 327 6.284 14.444 -15.059 1.00 0.00 O -ATOM 5126 ND2 ASN 327 4.225 14.700 -14.730 1.00 0.00 N -ATOM 5127 HD21 ASN 327 4.545 15.561 -14.309 1.00 0.00 H -ATOM 5128 HD22 ASN 327 3.298 14.319 -14.852 1.00 0.00 H -ATOM 5129 C ASN 327 4.827 11.323 -18.035 1.00 0.00 C -ATOM 5130 O ASN 327 4.759 10.297 -17.352 1.00 0.00 O -ATOM 5131 N LEU 328 4.485 11.238 -19.382 1.00 0.00 N -ATOM 5132 H LEU 328 4.460 12.105 -19.899 1.00 0.00 H -ATOM 5133 CA LEU 328 4.226 9.986 -20.141 1.00 0.00 C -ATOM 5134 HA LEU 328 3.226 9.629 -19.897 1.00 0.00 H -ATOM 5135 CB LEU 328 4.092 10.481 -21.589 1.00 0.00 C -ATOM 5136 HB2 LEU 328 3.222 11.133 -21.652 1.00 0.00 H -ATOM 5137 HB3 LEU 328 4.967 11.064 -21.877 1.00 0.00 H -ATOM 5138 CG LEU 328 3.947 9.369 -22.692 1.00 0.00 C -ATOM 5139 HG LEU 328 3.372 8.532 -22.296 1.00 0.00 H -ATOM 5140 CD1 LEU 328 3.269 9.912 -24.054 1.00 0.00 C -ATOM 5141 HD11 LEU 328 3.095 10.988 -24.042 1.00 0.00 H -ATOM 5142 HD12 LEU 328 3.820 9.743 -24.980 1.00 0.00 H -ATOM 5143 HD13 LEU 328 2.331 9.370 -24.172 1.00 0.00 H -ATOM 5144 CD2 LEU 328 5.267 8.763 -23.176 1.00 0.00 C -ATOM 5145 HD21 LEU 328 5.180 7.952 -23.899 1.00 0.00 H -ATOM 5146 HD22 LEU 328 5.880 9.514 -23.674 1.00 0.00 H -ATOM 5147 HD23 LEU 328 5.803 8.399 -22.299 1.00 0.00 H -ATOM 5148 C LEU 328 5.259 8.901 -19.922 1.00 0.00 C -ATOM 5149 O LEU 328 4.851 7.769 -19.797 1.00 0.00 O -ATOM 5150 N GLU 329 6.513 9.299 -19.731 1.00 0.00 N -ATOM 5151 H GLU 329 6.794 10.228 -20.009 1.00 0.00 H -ATOM 5152 CA GLU 329 7.568 8.296 -19.609 1.00 0.00 C -ATOM 5153 HA GLU 329 7.274 7.478 -20.268 1.00 0.00 H -ATOM 5154 CB GLU 329 8.893 8.932 -20.044 1.00 0.00 C -ATOM 5155 HB2 GLU 329 9.201 9.772 -19.421 1.00 0.00 H -ATOM 5156 HB3 GLU 329 9.605 8.115 -19.927 1.00 0.00 H -ATOM 5157 CG GLU 329 8.845 9.278 -21.516 1.00 0.00 C -ATOM 5158 HG2 GLU 329 9.794 9.125 -22.032 1.00 0.00 H -ATOM 5159 HG3 GLU 329 8.075 8.738 -22.066 1.00 0.00 H -ATOM 5160 CD GLU 329 8.530 10.709 -21.887 1.00 0.00 C -ATOM 5161 OE1 GLU 329 7.967 11.492 -21.071 1.00 0.00 O -ATOM 5162 OE2 GLU 329 8.577 11.087 -23.076 1.00 0.00 O -ATOM 5163 C GLU 329 7.666 7.734 -18.196 1.00 0.00 C -ATOM 5164 O GLU 329 8.158 6.571 -18.068 1.00 0.00 O -ATOM 5165 N GLU 330 7.218 8.444 -17.139 1.00 0.00 N -ATOM 5166 H GLU 330 6.904 9.376 -17.371 1.00 0.00 H -ATOM 5167 CA GLU 330 6.992 7.882 -15.775 1.00 0.00 C -ATOM 5168 HA GLU 330 7.812 7.240 -15.456 1.00 0.00 H -ATOM 5169 CB GLU 330 6.735 8.916 -14.656 1.00 0.00 C -ATOM 5170 HB2 GLU 330 5.799 9.416 -14.907 1.00 0.00 H -ATOM 5171 HB3 GLU 330 6.862 8.424 -13.692 1.00 0.00 H -ATOM 5172 CG GLU 330 7.759 10.061 -14.661 1.00 0.00 C -ATOM 5173 HG2 GLU 330 7.585 10.716 -15.515 1.00 0.00 H -ATOM 5174 HG3 GLU 330 7.712 10.685 -13.768 1.00 0.00 H -ATOM 5175 CD GLU 330 9.171 9.505 -14.853 1.00 0.00 C -ATOM 5176 OE1 GLU 330 9.989 10.306 -15.328 1.00 0.00 O -ATOM 5177 OE2 GLU 330 9.499 8.431 -14.371 1.00 0.00 O -ATOM 5178 C GLU 330 5.766 6.959 -15.787 1.00 0.00 C -ATOM 5179 O GLU 330 5.843 5.889 -15.135 1.00 0.00 O -ATOM 5180 N THR 331 4.673 7.370 -16.422 1.00 0.00 N -ATOM 5181 H THR 331 4.612 8.299 -16.814 1.00 0.00 H -ATOM 5182 CA THR 331 3.506 6.529 -16.577 1.00 0.00 C -ATOM 5183 HA THR 331 3.071 6.239 -15.620 1.00 0.00 H -ATOM 5184 CB THR 331 2.510 7.175 -17.668 1.00 0.00 C -ATOM 5185 HB THR 331 2.972 7.459 -18.613 1.00 0.00 H -ATOM 5186 CG2 THR 331 1.307 6.229 -17.903 1.00 0.00 C -ATOM 5187 HG21 THR 331 0.500 6.789 -18.376 1.00 0.00 H -ATOM 5188 HG22 THR 331 1.656 5.661 -18.766 1.00 0.00 H -ATOM 5189 HG23 THR 331 1.017 5.554 -17.098 1.00 0.00 H -ATOM 5190 OG1 THR 331 2.089 8.352 -17.153 1.00 0.00 O -ATOM 5191 HG1 THR 331 1.463 8.680 -17.802 1.00 0.00 H -ATOM 5192 C THR 331 3.876 5.179 -17.282 1.00 0.00 C -ATOM 5193 O THR 331 3.579 4.101 -16.763 1.00 0.00 O -ATOM 5194 N LEU 332 4.697 5.215 -18.329 1.00 0.00 N -ATOM 5195 H LEU 332 5.028 6.120 -18.631 1.00 0.00 H -ATOM 5196 CA LEU 332 5.104 4.058 -19.100 1.00 0.00 C -ATOM 5197 HA LEU 332 4.283 3.394 -19.373 1.00 0.00 H -ATOM 5198 CB LEU 332 5.658 4.603 -20.413 1.00 0.00 C -ATOM 5199 HB2 LEU 332 4.808 4.863 -21.044 1.00 0.00 H -ATOM 5200 HB3 LEU 332 6.235 5.491 -20.155 1.00 0.00 H -ATOM 5201 CG LEU 332 6.592 3.688 -21.231 1.00 0.00 C -ATOM 5202 HG LEU 332 7.436 3.295 -20.664 1.00 0.00 H -ATOM 5203 CD1 LEU 332 5.789 2.518 -21.858 1.00 0.00 C -ATOM 5204 HD11 LEU 332 6.335 2.058 -22.681 1.00 0.00 H -ATOM 5205 HD12 LEU 332 5.470 1.835 -21.069 1.00 0.00 H -ATOM 5206 HD13 LEU 332 4.851 2.725 -22.374 1.00 0.00 H -ATOM 5207 CD2 LEU 332 7.079 4.575 -22.385 1.00 0.00 C -ATOM 5208 HD21 LEU 332 7.514 5.465 -21.930 1.00 0.00 H -ATOM 5209 HD22 LEU 332 7.945 4.040 -22.774 1.00 0.00 H -ATOM 5210 HD23 LEU 332 6.236 4.766 -23.050 1.00 0.00 H -ATOM 5211 C LEU 332 6.097 3.146 -18.311 1.00 0.00 C -ATOM 5212 O LEU 332 5.735 1.939 -18.142 1.00 0.00 O -ATOM 5213 N SER 333 7.088 3.779 -17.663 1.00 0.00 N -ATOM 5214 H SER 333 7.269 4.768 -17.761 1.00 0.00 H -ATOM 5215 CA SER 333 7.935 3.191 -16.718 1.00 0.00 C -ATOM 5216 HA SER 333 8.442 2.490 -17.381 1.00 0.00 H -ATOM 5217 CB SER 333 9.029 4.116 -16.206 1.00 0.00 C -ATOM 5218 HB2 SER 333 9.519 4.408 -17.135 1.00 0.00 H -ATOM 5219 HB3 SER 333 8.568 4.977 -15.722 1.00 0.00 H -ATOM 5220 OG SER 333 9.868 3.440 -15.244 1.00 0.00 O -ATOM 5221 HG SER 333 9.418 3.322 -14.404 1.00 0.00 H -ATOM 5222 C SER 333 7.165 2.521 -15.541 1.00 0.00 C -ATOM 5223 O SER 333 7.566 1.430 -15.107 1.00 0.00 O -ATOM 5224 N THR 334 6.091 3.170 -14.957 1.00 0.00 N -ATOM 5225 H THR 334 5.883 4.083 -15.336 1.00 0.00 H -ATOM 5226 CA THR 334 5.282 2.534 -13.939 1.00 0.00 C -ATOM 5227 HA THR 334 5.977 2.135 -13.200 1.00 0.00 H -ATOM 5228 CB THR 334 4.207 3.435 -13.362 1.00 0.00 C -ATOM 5229 HB THR 334 3.390 3.578 -14.069 1.00 0.00 H -ATOM 5230 CG2 THR 334 3.630 3.166 -11.942 1.00 0.00 C -ATOM 5231 HG21 THR 334 3.100 2.215 -11.891 1.00 0.00 H -ATOM 5232 HG22 THR 334 4.332 3.353 -11.130 1.00 0.00 H -ATOM 5233 HG23 THR 334 2.849 3.860 -11.632 1.00 0.00 H -ATOM 5234 OG1 THR 334 4.807 4.677 -13.017 1.00 0.00 O -ATOM 5235 HG1 THR 334 5.286 5.082 -13.744 1.00 0.00 H -ATOM 5236 C THR 334 4.565 1.282 -14.477 1.00 0.00 C -ATOM 5237 O THR 334 4.523 0.263 -13.752 1.00 0.00 O -ATOM 5238 N LEU 335 4.067 1.252 -15.740 1.00 0.00 N -ATOM 5239 H LEU 335 4.118 2.097 -16.290 1.00 0.00 H -ATOM 5240 CA LEU 335 3.387 0.071 -16.277 1.00 0.00 C -ATOM 5241 HA LEU 335 2.813 -0.380 -15.467 1.00 0.00 H -ATOM 5242 CB LEU 335 2.564 0.430 -17.509 1.00 0.00 C -ATOM 5243 HB2 LEU 335 3.167 1.037 -18.185 1.00 0.00 H -ATOM 5244 HB3 LEU 335 2.262 -0.444 -18.085 1.00 0.00 H -ATOM 5245 CG LEU 335 1.237 1.105 -17.010 1.00 0.00 C -ATOM 5246 HG LEU 335 1.334 1.741 -16.129 1.00 0.00 H -ATOM 5247 CD1 LEU 335 0.724 2.155 -17.978 1.00 0.00 C -ATOM 5248 HD11 LEU 335 -0.255 2.582 -17.759 1.00 0.00 H -ATOM 5249 HD12 LEU 335 1.397 3.010 -17.919 1.00 0.00 H -ATOM 5250 HD13 LEU 335 0.852 1.749 -18.982 1.00 0.00 H -ATOM 5251 CD2 LEU 335 0.221 0.067 -16.686 1.00 0.00 C -ATOM 5252 HD21 LEU 335 -0.465 0.462 -15.937 1.00 0.00 H -ATOM 5253 HD22 LEU 335 -0.429 -0.182 -17.525 1.00 0.00 H -ATOM 5254 HD23 LEU 335 0.768 -0.798 -16.310 1.00 0.00 H -ATOM 5255 C LEU 335 4.428 -0.911 -16.678 1.00 0.00 C -ATOM 5256 O LEU 335 4.241 -2.108 -16.393 1.00 0.00 O -ATOM 5257 N GLU 336 5.546 -0.534 -17.264 1.00 0.00 N -ATOM 5258 H GLU 336 5.638 0.418 -17.589 1.00 0.00 H -ATOM 5259 CA GLU 336 6.617 -1.476 -17.649 1.00 0.00 C -ATOM 5260 HA GLU 336 6.259 -2.336 -18.213 1.00 0.00 H -ATOM 5261 CB GLU 336 7.590 -0.722 -18.633 1.00 0.00 C -ATOM 5262 HB2 GLU 336 6.993 -0.326 -19.455 1.00 0.00 H -ATOM 5263 HB3 GLU 336 8.118 0.068 -18.100 1.00 0.00 H -ATOM 5264 CG GLU 336 8.598 -1.636 -19.267 1.00 0.00 C -ATOM 5265 HG2 GLU 336 9.255 -1.096 -19.948 1.00 0.00 H -ATOM 5266 HG3 GLU 336 9.318 -2.012 -18.540 1.00 0.00 H -ATOM 5267 CD GLU 336 8.064 -2.804 -20.126 1.00 0.00 C -ATOM 5268 OE1 GLU 336 7.436 -2.520 -21.163 1.00 0.00 O -ATOM 5269 OE2 GLU 336 8.389 -3.936 -19.859 1.00 0.00 O -ATOM 5270 C GLU 336 7.290 -2.182 -16.477 1.00 0.00 C -ATOM 5271 O GLU 336 7.737 -3.356 -16.582 1.00 0.00 O -ATOM 5272 N TYR 337 7.143 -1.677 -15.286 1.00 0.00 N -ATOM 5273 H TYR 337 6.747 -0.748 -15.290 1.00 0.00 H -ATOM 5274 CA TYR 337 7.527 -2.255 -13.931 1.00 0.00 C -ATOM 5275 HA TYR 337 8.339 -2.951 -14.139 1.00 0.00 H -ATOM 5276 CB TYR 337 7.997 -1.119 -13.118 1.00 0.00 C -ATOM 5277 HB2 TYR 337 8.684 -0.522 -13.718 1.00 0.00 H -ATOM 5278 HB3 TYR 337 7.125 -0.502 -12.899 1.00 0.00 H -ATOM 5279 CG TYR 337 8.684 -1.412 -11.784 1.00 0.00 C -ATOM 5280 CD1 TYR 337 7.850 -1.569 -10.631 1.00 0.00 C -ATOM 5281 HD1 TYR 337 6.778 -1.599 -10.761 1.00 0.00 H -ATOM 5282 CE1 TYR 337 8.486 -1.602 -9.367 1.00 0.00 C -ATOM 5283 HE1 TYR 337 7.890 -1.727 -8.475 1.00 0.00 H -ATOM 5284 CZ TYR 337 9.914 -1.659 -9.235 1.00 0.00 C -ATOM 5285 OH TYR 337 10.492 -1.540 -8.018 1.00 0.00 O -ATOM 5286 HH TYR 337 11.353 -1.117 -8.014 1.00 0.00 H -ATOM 5287 CE2 TYR 337 10.709 -1.659 -10.408 1.00 0.00 C -ATOM 5288 HE2 TYR 337 11.788 -1.611 -10.443 1.00 0.00 H -ATOM 5289 CD2 TYR 337 10.072 -1.465 -11.653 1.00 0.00 C -ATOM 5290 HD2 TYR 337 10.712 -1.616 -12.510 1.00 0.00 H -ATOM 5291 C TYR 337 6.397 -3.007 -13.251 1.00 0.00 C -ATOM 5292 O TYR 337 6.608 -4.114 -12.750 1.00 0.00 O -ATOM 5293 N ALA 338 5.171 -2.578 -13.388 1.00 0.00 N -ATOM 5294 H ALA 338 5.121 -1.697 -13.879 1.00 0.00 H -ATOM 5295 CA ALA 338 4.027 -3.375 -12.997 1.00 0.00 C -ATOM 5296 HA ALA 338 4.167 -3.718 -11.972 1.00 0.00 H -ATOM 5297 CB ALA 338 2.770 -2.550 -13.098 1.00 0.00 C -ATOM 5298 HB1 ALA 338 2.495 -2.429 -14.146 1.00 0.00 H -ATOM 5299 HB2 ALA 338 1.965 -2.918 -12.462 1.00 0.00 H -ATOM 5300 HB3 ALA 338 3.022 -1.586 -12.656 1.00 0.00 H -ATOM 5301 C ALA 338 3.869 -4.651 -13.834 1.00 0.00 C -ATOM 5302 O ALA 338 3.581 -5.728 -13.283 1.00 0.00 O -ATOM 5303 N HIE 339 4.059 -4.595 -15.141 1.00 0.00 N -ATOM 5304 H HIE 339 4.447 -3.735 -15.503 1.00 0.00 H -ATOM 5305 CA HIE 339 4.210 -5.689 -16.102 1.00 0.00 C -ATOM 5306 HA HIE 339 3.303 -6.291 -16.134 1.00 0.00 H -ATOM 5307 CB HIE 339 4.508 -5.026 -17.424 1.00 0.00 C -ATOM 5308 HB2 HIE 339 3.689 -4.316 -17.546 1.00 0.00 H -ATOM 5309 HB3 HIE 339 5.441 -4.479 -17.287 1.00 0.00 H -ATOM 5310 CG HIE 339 4.775 -6.012 -18.514 1.00 0.00 C -ATOM 5311 ND1 HIE 339 3.982 -7.096 -18.864 1.00 0.00 N -ATOM 5312 CE1 HIE 339 4.718 -7.771 -19.785 1.00 0.00 C -ATOM 5313 HE1 HIE 339 4.457 -8.670 -20.324 1.00 0.00 H -ATOM 5314 NE2 HIE 339 5.870 -7.154 -20.042 1.00 0.00 N -ATOM 5315 HE2 HIE 339 6.443 -7.331 -20.855 1.00 0.00 H -ATOM 5316 CD2 HIE 339 5.954 -6.085 -19.216 1.00 0.00 C -ATOM 5317 HD2 HIE 339 6.679 -5.296 -19.076 1.00 0.00 H -ATOM 5318 C HIE 339 5.403 -6.653 -15.823 1.00 0.00 C -ATOM 5319 O HIE 339 5.334 -7.845 -16.057 1.00 0.00 O -ATOM 5320 N ARG 340 6.477 -6.110 -15.123 1.00 0.00 N -ATOM 5321 H ARG 340 6.580 -5.106 -15.098 1.00 0.00 H -ATOM 5322 CA ARG 340 7.537 -6.930 -14.457 1.00 0.00 C -ATOM 5323 HA ARG 340 7.967 -7.722 -15.070 1.00 0.00 H -ATOM 5324 CB ARG 340 8.762 -6.008 -14.222 1.00 0.00 C -ATOM 5325 HB2 ARG 340 9.041 -5.479 -15.133 1.00 0.00 H -ATOM 5326 HB3 ARG 340 8.496 -5.382 -13.370 1.00 0.00 H -ATOM 5327 CG ARG 340 10.070 -6.776 -13.926 1.00 0.00 C -ATOM 5328 HG2 ARG 340 10.902 -6.073 -13.950 1.00 0.00 H -ATOM 5329 HG3 ARG 340 9.841 -7.078 -12.904 1.00 0.00 H -ATOM 5330 CD ARG 340 10.373 -7.988 -14.803 1.00 0.00 C -ATOM 5331 HD2 ARG 340 9.618 -8.757 -14.641 1.00 0.00 H -ATOM 5332 HD3 ARG 340 10.293 -7.684 -15.846 1.00 0.00 H -ATOM 5333 NE ARG 340 11.712 -8.603 -14.615 1.00 0.00 N -ATOM 5334 HE ARG 340 12.427 -8.022 -14.201 1.00 0.00 H -ATOM 5335 CZ ARG 340 12.269 -9.521 -15.374 1.00 0.00 C -ATOM 5336 NH1 ARG 340 11.633 -10.271 -16.174 1.00 0.00 N -ATOM 5337 HH11 ARG 340 10.624 -10.294 -16.143 1.00 0.00 H -ATOM 5338 HH12 ARG 340 12.160 -11.001 -16.632 1.00 0.00 H -ATOM 5339 NH2 ARG 340 13.516 -9.598 -15.329 1.00 0.00 N -ATOM 5340 HH21 ARG 340 13.970 -8.754 -15.010 1.00 0.00 H -ATOM 5341 HH22 ARG 340 13.939 -10.381 -15.806 1.00 0.00 H -ATOM 5342 C ARG 340 7.072 -7.670 -13.238 1.00 0.00 C -ATOM 5343 O ARG 340 7.477 -8.814 -13.062 1.00 0.00 O -ATOM 5344 N ALA 341 6.196 -7.095 -12.372 1.00 0.00 N -ATOM 5345 H ALA 341 5.822 -6.162 -12.465 1.00 0.00 H -ATOM 5346 CA ALA 341 5.735 -7.845 -11.211 1.00 0.00 C -ATOM 5347 HA ALA 341 6.594 -8.366 -10.788 1.00 0.00 H -ATOM 5348 CB ALA 341 5.329 -6.740 -10.123 1.00 0.00 C -ATOM 5349 HB1 ALA 341 4.980 -7.336 -9.280 1.00 0.00 H -ATOM 5350 HB2 ALA 341 6.116 -6.037 -9.850 1.00 0.00 H -ATOM 5351 HB3 ALA 341 4.604 -6.014 -10.489 1.00 0.00 H -ATOM 5352 C ALA 341 4.715 -8.939 -11.421 1.00 0.00 C -ATOM 5353 O ALA 341 4.611 -9.825 -10.597 1.00 0.00 O -ATOM 5354 N LYS 342 3.990 -9.072 -12.549 1.00 0.00 N -ATOM 5355 H LYS 342 4.153 -8.409 -13.294 1.00 0.00 H -ATOM 5356 CA LYS 342 2.920 -10.035 -12.787 1.00 0.00 C -ATOM 5357 HA LYS 342 2.237 -9.816 -11.966 1.00 0.00 H -ATOM 5358 CB LYS 342 2.362 -9.939 -14.251 1.00 0.00 C -ATOM 5359 HB2 LYS 342 3.253 -9.984 -14.878 1.00 0.00 H -ATOM 5360 HB3 LYS 342 1.746 -10.809 -14.479 1.00 0.00 H -ATOM 5361 CG LYS 342 1.477 -8.743 -14.527 1.00 0.00 C -ATOM 5362 HG2 LYS 342 0.776 -8.754 -13.692 1.00 0.00 H -ATOM 5363 HG3 LYS 342 2.090 -7.844 -14.580 1.00 0.00 H -ATOM 5364 CD LYS 342 0.691 -8.685 -15.843 1.00 0.00 C -ATOM 5365 HD2 LYS 342 -0.061 -9.474 -15.836 1.00 0.00 H -ATOM 5366 HD3 LYS 342 0.049 -7.806 -15.776 1.00 0.00 H -ATOM 5367 CE LYS 342 1.423 -8.567 -17.145 1.00 0.00 C -ATOM 5368 HE2 LYS 342 1.969 -7.625 -17.113 1.00 0.00 H -ATOM 5369 HE3 LYS 342 2.095 -9.417 -17.265 1.00 0.00 H -ATOM 5370 NZ LYS 342 0.513 -8.518 -18.308 1.00 0.00 N -ATOM 5371 HZ1 LYS 342 -0.250 -9.179 -18.274 1.00 0.00 H -ATOM 5372 HZ2 LYS 342 -0.000 -7.649 -18.354 1.00 0.00 H -ATOM 5373 HZ3 LYS 342 1.054 -8.580 -19.158 1.00 0.00 H -ATOM 5374 C LYS 342 3.287 -11.490 -12.512 1.00 0.00 C -ATOM 5375 O LYS 342 2.384 -12.288 -12.161 1.00 0.00 O -ATOM 5376 N ASN 343 4.548 -11.924 -12.748 1.00 0.00 N -ATOM 5377 H ASN 343 5.263 -11.220 -12.862 1.00 0.00 H -ATOM 5378 CA ASN 343 4.955 -13.349 -12.719 1.00 0.00 C -ATOM 5379 HA ASN 343 4.123 -13.955 -13.079 1.00 0.00 H -ATOM 5380 CB ASN 343 6.059 -13.631 -13.782 1.00 0.00 C -ATOM 5381 HB2 ASN 343 6.952 -13.135 -13.400 1.00 0.00 H -ATOM 5382 HB3 ASN 343 6.045 -14.713 -13.911 1.00 0.00 H -ATOM 5383 CG ASN 343 5.719 -12.929 -15.068 1.00 0.00 C -ATOM 5384 OD1 ASN 343 5.827 -11.782 -15.389 1.00 0.00 O -ATOM 5385 ND2 ASN 343 5.258 -13.741 -16.045 1.00 0.00 N -ATOM 5386 HD21 ASN 343 4.885 -13.257 -16.849 1.00 0.00 H -ATOM 5387 HD22 ASN 343 4.953 -14.673 -15.803 1.00 0.00 H -ATOM 5388 C ASN 343 5.393 -13.871 -11.280 1.00 0.00 C -ATOM 5389 O ASN 343 6.047 -14.912 -11.227 1.00 0.00 O -ATOM 5390 N ILE 344 5.165 -13.076 -10.282 1.00 0.00 N -ATOM 5391 H ILE 344 4.746 -12.166 -10.413 1.00 0.00 H -ATOM 5392 CA ILE 344 5.293 -13.567 -8.844 1.00 0.00 C -ATOM 5393 HA ILE 344 6.028 -14.372 -8.804 1.00 0.00 H -ATOM 5394 CB ILE 344 5.897 -12.464 -7.964 1.00 0.00 C -ATOM 5395 HB ILE 344 5.141 -11.684 -7.876 1.00 0.00 H -ATOM 5396 CG2 ILE 344 6.203 -12.939 -6.525 1.00 0.00 C -ATOM 5397 HG21 ILE 344 6.316 -12.133 -5.800 1.00 0.00 H -ATOM 5398 HG22 ILE 344 5.279 -13.325 -6.096 1.00 0.00 H -ATOM 5399 HG23 ILE 344 6.969 -13.714 -6.488 1.00 0.00 H -ATOM 5400 CG1 ILE 344 7.159 -11.851 -8.581 1.00 0.00 C -ATOM 5401 HG12 ILE 344 8.048 -12.396 -8.265 1.00 0.00 H -ATOM 5402 HG13 ILE 344 7.141 -11.833 -9.670 1.00 0.00 H -ATOM 5403 CD1 ILE 344 7.445 -10.416 -8.056 1.00 0.00 C -ATOM 5404 HD11 ILE 344 6.552 -9.879 -8.378 1.00 0.00 H -ATOM 5405 HD12 ILE 344 7.477 -10.454 -6.967 1.00 0.00 H -ATOM 5406 HD13 ILE 344 8.349 -10.044 -8.537 1.00 0.00 H -ATOM 5407 C ILE 344 4.013 -14.210 -8.304 1.00 0.00 C -ATOM 5408 O ILE 344 2.952 -13.586 -8.392 1.00 0.00 O -ATOM 5409 N LEU 345 4.075 -15.419 -7.681 1.00 0.00 N -ATOM 5410 H LEU 345 4.998 -15.805 -7.538 1.00 0.00 H -ATOM 5411 CA LEU 345 3.086 -16.009 -6.801 1.00 0.00 C -ATOM 5412 HA LEU 345 2.112 -15.584 -7.042 1.00 0.00 H -ATOM 5413 CB LEU 345 2.980 -17.513 -7.065 1.00 0.00 C -ATOM 5414 HB2 LEU 345 3.896 -18.075 -6.885 1.00 0.00 H -ATOM 5415 HB3 LEU 345 2.368 -17.892 -6.248 1.00 0.00 H -ATOM 5416 CG LEU 345 2.500 -18.021 -8.366 1.00 0.00 C -ATOM 5417 HG LEU 345 1.428 -17.882 -8.506 1.00 0.00 H -ATOM 5418 CD1 LEU 345 3.072 -17.529 -9.678 1.00 0.00 C -ATOM 5419 HD11 LEU 345 2.825 -16.514 -9.990 1.00 0.00 H -ATOM 5420 HD12 LEU 345 4.158 -17.430 -9.670 1.00 0.00 H -ATOM 5421 HD13 LEU 345 2.802 -18.142 -10.538 1.00 0.00 H -ATOM 5422 CD2 LEU 345 2.678 -19.576 -8.480 1.00 0.00 C -ATOM 5423 HD21 LEU 345 2.155 -20.028 -9.323 1.00 0.00 H -ATOM 5424 HD22 LEU 345 3.726 -19.867 -8.543 1.00 0.00 H -ATOM 5425 HD23 LEU 345 2.374 -20.092 -7.569 1.00 0.00 H -ATOM 5426 C LEU 345 3.460 -15.772 -5.295 1.00 0.00 C -ATOM 5427 O LEU 345 4.624 -15.726 -4.949 1.00 0.00 O -ATOM 5428 N ASN 346 2.505 -15.754 -4.395 1.00 0.00 N -ATOM 5429 H ASN 346 1.549 -15.867 -4.700 1.00 0.00 H -ATOM 5430 CA ASN 346 2.718 -16.011 -2.900 1.00 0.00 C -ATOM 5431 HA ASN 346 3.626 -15.568 -2.490 1.00 0.00 H -ATOM 5432 CB ASN 346 1.531 -15.446 -2.142 1.00 0.00 C -ATOM 5433 HB2 ASN 346 0.552 -15.798 -2.468 1.00 0.00 H -ATOM 5434 HB3 ASN 346 1.673 -15.762 -1.109 1.00 0.00 H -ATOM 5435 CG ASN 346 1.772 -13.938 -2.081 1.00 0.00 C -ATOM 5436 OD1 ASN 346 0.981 -13.132 -2.426 1.00 0.00 O -ATOM 5437 ND2 ASN 346 2.842 -13.462 -1.528 1.00 0.00 N -ATOM 5438 HD21 ASN 346 2.847 -12.521 -1.161 1.00 0.00 H -ATOM 5439 HD22 ASN 346 3.472 -14.101 -1.064 1.00 0.00 H -ATOM 5440 C ASN 346 2.876 -17.549 -2.756 1.00 0.00 C -ATOM 5441 O ASN 346 2.160 -18.366 -3.355 1.00 0.00 O -ATOM 5442 N LYS 347 3.744 -17.926 -1.899 1.00 0.00 N -ATOM 5443 H LYS 347 4.436 -17.229 -1.662 1.00 0.00 H -ATOM 5444 CA LYS 347 4.042 -19.301 -1.358 1.00 0.00 C -ATOM 5445 HA LYS 347 4.244 -19.915 -2.235 1.00 0.00 H -ATOM 5446 CB LYS 347 5.203 -19.194 -0.323 1.00 0.00 C -ATOM 5447 HB2 LYS 347 6.042 -18.675 -0.786 1.00 0.00 H -ATOM 5448 HB3 LYS 347 4.753 -18.553 0.435 1.00 0.00 H -ATOM 5449 CG LYS 347 5.589 -20.571 0.317 1.00 0.00 C -ATOM 5450 HG2 LYS 347 4.875 -20.799 1.109 1.00 0.00 H -ATOM 5451 HG3 LYS 347 5.660 -21.338 -0.455 1.00 0.00 H -ATOM 5452 CD LYS 347 6.993 -20.352 0.847 1.00 0.00 C -ATOM 5453 HD2 LYS 347 7.747 -20.196 0.076 1.00 0.00 H -ATOM 5454 HD3 LYS 347 6.976 -19.505 1.532 1.00 0.00 H -ATOM 5455 CE LYS 347 7.376 -21.554 1.759 1.00 0.00 C -ATOM 5456 HE2 LYS 347 8.312 -21.219 2.206 1.00 0.00 H -ATOM 5457 HE3 LYS 347 6.645 -21.663 2.560 1.00 0.00 H -ATOM 5458 NZ LYS 347 7.599 -22.913 1.090 1.00 0.00 N -ATOM 5459 HZ1 LYS 347 6.767 -23.345 0.714 1.00 0.00 H -ATOM 5460 HZ2 LYS 347 8.190 -22.853 0.273 1.00 0.00 H -ATOM 5461 HZ3 LYS 347 7.978 -23.642 1.677 1.00 0.00 H -ATOM 5462 C LYS 347 2.844 -19.970 -0.773 1.00 0.00 C -ATOM 5463 O LYS 347 2.549 -21.143 -1.087 1.00 0.00 O -ATOM 5464 OXT LYS 347 2.190 -19.275 0.072 1.00 0.00 O -TER 5465 LYS 347 -HETATM 5466 O1B ADP 348 -0.425 9.776 -3.915 1.00 0.00 O -HETATM 5467 PB ADP 348 0.408 10.895 -4.280 1.00 0.00 P -HETATM 5468 O2B ADP 348 1.157 10.576 -5.527 1.00 0.00 O -HETATM 5469 O3B ADP 348 1.078 11.539 -3.143 1.00 0.00 O -HETATM 5470 O3A ADP 348 -0.559 11.872 -4.772 1.00 0.00 O -HETATM 5471 PA ADP 348 -0.931 13.210 -4.166 1.00 0.00 P -HETATM 5472 O1A ADP 348 0.266 14.141 -4.282 1.00 0.00 O -HETATM 5473 O2A ADP 348 -1.526 13.110 -2.839 1.00 0.00 O -HETATM 5474 O5* ADP 348 -2.139 13.808 -5.097 1.00 0.00 O -HETATM 5475 C5* ADP 348 -2.633 15.122 -4.847 1.00 0.00 C -HETATM 5476 H50 ADP 348 -2.545 15.750 -5.733 1.00 0.00 H -HETATM 5477 H51 ADP 348 -2.137 15.721 -4.083 1.00 0.00 H -HETATM 5478 C4* ADP 348 -4.063 15.070 -4.327 1.00 0.00 C -HETATM 5479 H40 ADP 348 -4.269 15.994 -3.787 1.00 0.00 H -HETATM 5480 O4* ADP 348 -5.042 14.959 -5.409 1.00 0.00 O -HETATM 5481 C1* ADP 348 -6.160 14.115 -5.092 1.00 0.00 C -HETATM 5482 H10 ADP 348 -7.059 14.716 -5.230 1.00 0.00 H -HETATM 5483 N9 ADP 348 -6.383 12.915 -5.898 1.00 0.00 N -HETATM 5484 C8 ADP 348 -5.524 11.937 -6.159 1.00 0.00 C -HETATM 5485 H80 ADP 348 -4.454 11.919 -6.011 1.00 0.00 H -HETATM 5486 N7 ADP 348 -5.996 10.887 -6.725 1.00 0.00 N -HETATM 5487 C5 ADP 348 -7.326 11.199 -6.909 1.00 0.00 C -HETATM 5488 C6 ADP 348 -8.457 10.643 -7.575 1.00 0.00 C -HETATM 5489 N6 ADP 348 -8.507 9.481 -8.174 1.00 0.00 N -HETATM 5490 H60 ADP 348 -7.742 8.838 -8.026 1.00 0.00 H -HETATM 5491 H61 ADP 348 -9.349 9.326 -8.710 1.00 0.00 H -HETATM 5492 N1 ADP 348 -9.599 11.323 -7.793 1.00 0.00 N -HETATM 5493 C2 ADP 348 -9.689 12.484 -7.278 1.00 0.00 C -HETATM 5494 H2 ADP 348 -10.636 12.979 -7.438 1.00 0.00 H -HETATM 5495 N3 ADP 348 -8.781 13.116 -6.523 1.00 0.00 N -HETATM 5496 C4 ADP 348 -7.615 12.475 -6.428 1.00 0.00 C -HETATM 5497 C3* ADP 348 -4.431 13.942 -3.411 1.00 0.00 C -HETATM 5498 H30 ADP 348 -3.956 13.033 -3.780 1.00 0.00 H -HETATM 5499 O3* ADP 348 -3.950 14.210 -2.080 1.00 0.00 O -HETATM 5500 H3* ADP 348 -3.036 13.920 -2.137 1.00 0.00 H -HETATM 5501 C2* ADP 348 -5.897 13.764 -3.617 1.00 0.00 C -HETATM 5502 H20 ADP 348 -6.150 12.721 -3.424 1.00 0.00 H -HETATM 5503 O2* ADP 348 -6.561 14.640 -2.774 1.00 0.00 O -HETATM 5504 H2* ADP 348 -6.472 14.295 -1.882 1.00 0.00 H -HETATM 5505 MG MG 349 1.634 11.755 -1.414 1.00 0.00 Mg -HETATM 5506 O WAT 438 3.546 11.634 -1.906 1.00 0.00 O -HETATM 5507 H1 WAT 438 3.928 10.929 -2.428 1.00 0.00 H -HETATM 5508 H2 WAT 438 4.300 12.110 -1.559 1.00 0.00 H -HETATM 5509 O WAT 439 1.896 9.719 -0.994 1.00 0.00 O -HETATM 5510 H1 WAT 439 2.702 9.275 -1.259 1.00 0.00 H -HETATM 5511 H2 WAT 439 1.465 9.101 -0.405 1.00 0.00 H -HETATM 5512 O WAT 440 -0.145 12.108 -0.647 1.00 0.00 O -HETATM 5513 H1 WAT 440 -0.658 12.695 -1.202 1.00 0.00 H -HETATM 5514 H2 WAT 440 -0.797 11.647 -0.119 1.00 0.00 H -HETATM 5515 O WAT 441 2.360 12.217 0.545 1.00 0.00 O -HETATM 5516 H1 WAT 441 3.104 12.547 1.049 1.00 0.00 H -HETATM 5517 H2 WAT 441 1.921 11.607 1.138 1.00 0.00 H -CONECT 5481 5480 5482 5483 5501 -CONECT 5493 5492 5494 5495 -CONECT 5501 5481 5497 5502 5503 -CONECT 5497 5478 5498 5499 5501 -CONECT 5496 5483 5487 5495 -CONECT 5478 5475 5479 5480 5497 -CONECT 5487 5486 5488 5496 -CONECT 5475 5474 5476 5477 5478 -CONECT 5488 5487 5489 5492 -CONECT 5484 5483 5485 5486 -CONECT 5482 5481 -CONECT 5494 5493 -CONECT 5504 5503 -CONECT 5502 5501 -CONECT 5500 5499 -CONECT 5498 5497 -CONECT 5479 5478 -CONECT 5476 5475 -CONECT 5477 5475 -CONECT 5490 5489 -CONECT 5491 5489 -CONECT 5485 5484 -CONECT 5492 5488 5493 -CONECT 5495 5493 5496 -CONECT 5489 5488 5490 5491 -CONECT 5486 5484 5487 -CONECT 5483 5481 5484 5496 -CONECT 5472 5471 -CONECT 5466 5467 -CONECT 5503 5501 5504 -CONECT 5473 5471 -CONECT 5468 5467 -CONECT 5499 5497 5500 -CONECT 5470 5467 5471 -CONECT 5469 5467 -CONECT 5480 5478 5481 -CONECT 5474 5471 5475 -CONECT 5471 5470 5472 5473 5474 -CONECT 5467 5466 5468 5469 5470 -CONECT 5507 5506 -CONECT 5508 5506 -CONECT 5506 5507 5508 -CONECT 5510 5509 -CONECT 5511 5509 -CONECT 5509 5510 5511 -CONECT 5513 5512 -CONECT 5514 5512 -CONECT 5512 5513 5514 -CONECT 5516 5515 -CONECT 5517 5515 -CONECT 5515 5516 5517 -END diff --git a/receptor/eg5_adp_mg_02000.pdb b/receptor/eg5_adp_mg_02000.pdb deleted file mode 100644 index 1cab0ce..0000000 --- a/receptor/eg5_adp_mg_02000.pdb +++ /dev/null @@ -1,5596 +0,0 @@ -HELIX 1 1 LEU 15 ARG 18 1 4 -HELIX 2 2 LYS 45 SER 47 1 3 -HELIX 3 3 GLN 63 MET 80 1 18 -HELIX 4 4 LYS 96 MET 100 1 5 -HELIX 5 5 ILE 120 LEU 125 1 6 -HELIX 6 6 ILE 128 ASP 134 1 7 -HELIX 7 7 LYS 192 LEU 212 1 21 -HELIX 8 8 TYR 216 ARG 219 1 4 -HELIX 9 9 VAL 263 ARG 266 1 4 -HELIX 10 10 ARG 268 GLU 289 1 22 -HELIX 11 11 TYR 296 GLU 298 1 3 -HELIX 12 12 LYS 300 ILE 304 1 5 -HELIX 13 13 SER 325 ASN 343 1 19 -SHEET 1 1 1 GLN 5 CYS 10 0 -SHEET 2 2 1 VAL 26 ASP 29 0 -SHEET 3 3 1 GLU 34 VAL 37 0 -SHEET 4 4 1 LYS 49 THR 52 0 -SHEET 5 5 1 MET 55 PHE 57 0 -SHEET 6 6 1 ASN 83 TYR 89 0 -SHEET 7 7 1 PHE 139 TYR 149 0 -SHEET 8 8 1 GLU 152 PHE 154 0 -SHEET 9 9 1 GLN 168 ASP 172 0 -SHEET 10 10 1 LYS 176 LYS 182 0 -SHEET 11 11 1 HIE 221 LYS 231 0 -SHEET 12 12 1 VAL 241 ASP 250 0 -SHEET 13 13 1 ARG 314 ILE 321 0 -CRYST1 88.526 88.526 88.526 109.47 109.47 109.47 1 -ATOM 1 N GLY 1 1.162 -20.706 -4.084 1.00 0.00 N -ATOM 2 H1 GLY 1 1.700 -19.881 -3.860 1.00 0.00 H -ATOM 3 H2 GLY 1 1.418 -21.018 -5.010 1.00 0.00 H -ATOM 4 H3 GLY 1 1.484 -21.320 -3.350 1.00 0.00 H -ATOM 5 CA GLY 1 -0.188 -20.390 -4.106 1.00 0.00 C -ATOM 6 HA2 GLY 1 -0.756 -21.312 -4.235 1.00 0.00 H -ATOM 7 HA3 GLY 1 -0.507 -19.735 -3.295 1.00 0.00 H -ATOM 8 C GLY 1 -0.477 -19.596 -5.426 1.00 0.00 C -ATOM 9 O GLY 1 0.164 -19.854 -6.420 1.00 0.00 O -ATOM 10 N LYS 2 -1.454 -18.688 -5.401 1.00 0.00 N -ATOM 11 H LYS 2 -1.888 -18.460 -4.519 1.00 0.00 H -ATOM 12 CA LYS 2 -1.884 -17.799 -6.495 1.00 0.00 C -ATOM 13 HA LYS 2 -1.830 -18.325 -7.449 1.00 0.00 H -ATOM 14 CB LYS 2 -3.255 -17.201 -6.229 1.00 0.00 C -ATOM 15 HB2 LYS 2 -3.201 -16.595 -5.325 1.00 0.00 H -ATOM 16 HB3 LYS 2 -3.476 -16.464 -7.001 1.00 0.00 H -ATOM 17 CG LYS 2 -4.365 -18.222 -6.203 1.00 0.00 C -ATOM 18 HG2 LYS 2 -4.581 -18.681 -7.167 1.00 0.00 H -ATOM 19 HG3 LYS 2 -4.119 -19.049 -5.538 1.00 0.00 H -ATOM 20 CD LYS 2 -5.663 -17.532 -5.802 1.00 0.00 C -ATOM 21 HD2 LYS 2 -5.563 -17.101 -4.806 1.00 0.00 H -ATOM 22 HD3 LYS 2 -5.958 -16.715 -6.460 1.00 0.00 H -ATOM 23 CE LYS 2 -6.787 -18.631 -5.843 1.00 0.00 C -ATOM 24 HE2 LYS 2 -6.679 -19.292 -6.703 1.00 0.00 H -ATOM 25 HE3 LYS 2 -6.546 -19.268 -4.992 1.00 0.00 H -ATOM 26 NZ LYS 2 -8.142 -18.105 -5.818 1.00 0.00 N -ATOM 27 HZ1 LYS 2 -8.294 -17.365 -5.148 1.00 0.00 H -ATOM 28 HZ2 LYS 2 -8.519 -17.787 -6.699 1.00 0.00 H -ATOM 29 HZ3 LYS 2 -8.820 -18.804 -5.550 1.00 0.00 H -ATOM 30 C LYS 2 -0.845 -16.777 -6.764 1.00 0.00 C -ATOM 31 O LYS 2 0.025 -16.596 -5.947 1.00 0.00 O -ATOM 32 N ASN 3 -0.825 -16.038 -7.877 1.00 0.00 N -ATOM 33 H ASN 3 -1.510 -16.300 -8.571 1.00 0.00 H -ATOM 34 CA ASN 3 0.091 -14.888 -8.168 1.00 0.00 C -ATOM 35 HA ASN 3 1.103 -15.264 -8.015 1.00 0.00 H -ATOM 36 CB ASN 3 -0.052 -14.408 -9.667 1.00 0.00 C -ATOM 37 HB2 ASN 3 -1.079 -14.101 -9.862 1.00 0.00 H -ATOM 38 HB3 ASN 3 0.618 -13.565 -9.834 1.00 0.00 H -ATOM 39 CG ASN 3 0.353 -15.475 -10.545 1.00 0.00 C -ATOM 40 OD1 ASN 3 -0.326 -16.497 -10.720 1.00 0.00 O -ATOM 41 ND2 ASN 3 1.392 -15.301 -11.282 1.00 0.00 N -ATOM 42 HD21 ASN 3 1.621 -16.001 -11.972 1.00 0.00 H -ATOM 43 HD22 ASN 3 1.976 -14.496 -11.107 1.00 0.00 H -ATOM 44 C ASN 3 -0.100 -13.726 -7.197 1.00 0.00 C -ATOM 45 O ASN 3 -1.140 -13.560 -6.542 1.00 0.00 O -ATOM 46 N ILE 4 0.894 -12.827 -7.131 1.00 0.00 N -ATOM 47 H ILE 4 1.669 -12.876 -7.777 1.00 0.00 H -ATOM 48 CA ILE 4 0.692 -11.459 -6.584 1.00 0.00 C -ATOM 49 HA ILE 4 0.087 -11.523 -5.680 1.00 0.00 H -ATOM 50 CB ILE 4 1.963 -10.629 -6.398 1.00 0.00 C -ATOM 51 HB ILE 4 2.631 -10.745 -7.251 1.00 0.00 H -ATOM 52 CG2 ILE 4 1.796 -9.101 -6.336 1.00 0.00 C -ATOM 53 HG21 ILE 4 1.867 -8.746 -7.365 1.00 0.00 H -ATOM 54 HG22 ILE 4 0.918 -8.784 -5.774 1.00 0.00 H -ATOM 55 HG23 ILE 4 2.645 -8.583 -5.891 1.00 0.00 H -ATOM 56 CG1 ILE 4 2.722 -11.231 -5.166 1.00 0.00 C -ATOM 57 HG12 ILE 4 2.220 -11.012 -4.224 1.00 0.00 H -ATOM 58 HG13 ILE 4 2.561 -12.310 -5.179 1.00 0.00 H -ATOM 59 CD1 ILE 4 4.256 -11.037 -4.970 1.00 0.00 C -ATOM 60 HD11 ILE 4 4.758 -11.006 -5.938 1.00 0.00 H -ATOM 61 HD12 ILE 4 4.369 -10.015 -4.609 1.00 0.00 H -ATOM 62 HD13 ILE 4 4.679 -11.758 -4.271 1.00 0.00 H -ATOM 63 C ILE 4 -0.246 -10.640 -7.514 1.00 0.00 C -ATOM 64 O ILE 4 0.060 -10.352 -8.687 1.00 0.00 O -ATOM 65 N GLN 5 -1.378 -10.140 -6.999 1.00 0.00 N -ATOM 66 H GLN 5 -1.549 -10.336 -6.023 1.00 0.00 H -ATOM 67 CA GLN 5 -2.315 -9.325 -7.808 1.00 0.00 C -ATOM 68 HA GLN 5 -2.404 -9.820 -8.775 1.00 0.00 H -ATOM 69 CB GLN 5 -3.616 -9.229 -7.128 1.00 0.00 C -ATOM 70 HB2 GLN 5 -3.976 -10.254 -7.058 1.00 0.00 H -ATOM 71 HB3 GLN 5 -3.528 -8.760 -6.148 1.00 0.00 H -ATOM 72 CG GLN 5 -4.713 -8.436 -7.887 1.00 0.00 C -ATOM 73 HG2 GLN 5 -4.411 -7.396 -8.009 1.00 0.00 H -ATOM 74 HG3 GLN 5 -4.851 -8.770 -8.916 1.00 0.00 H -ATOM 75 CD GLN 5 -6.011 -8.389 -7.173 1.00 0.00 C -ATOM 76 OE1 GLN 5 -6.203 -7.656 -6.243 1.00 0.00 O -ATOM 77 NE2 GLN 5 -6.987 -9.198 -7.508 1.00 0.00 N -ATOM 78 HE21 GLN 5 -7.816 -9.162 -6.931 1.00 0.00 H -ATOM 79 HE22 GLN 5 -6.843 -9.934 -8.183 1.00 0.00 H -ATOM 80 C GLN 5 -1.753 -7.962 -8.169 1.00 0.00 C -ATOM 81 O GLN 5 -1.136 -7.317 -7.332 1.00 0.00 O -ATOM 82 N VAL 6 -2.193 -7.434 -9.365 1.00 0.00 N -ATOM 83 H VAL 6 -2.824 -7.927 -9.981 1.00 0.00 H -ATOM 84 CA VAL 6 -1.768 -6.086 -9.874 1.00 0.00 C -ATOM 85 HA VAL 6 -1.543 -5.497 -8.985 1.00 0.00 H -ATOM 86 CB VAL 6 -0.490 -6.136 -10.688 1.00 0.00 C -ATOM 87 HB VAL 6 -0.642 -6.671 -11.626 1.00 0.00 H -ATOM 88 CG1 VAL 6 -0.083 -4.755 -10.941 1.00 0.00 C -ATOM 89 HG11 VAL 6 -0.858 -4.259 -11.526 1.00 0.00 H -ATOM 90 HG12 VAL 6 -0.051 -4.186 -10.012 1.00 0.00 H -ATOM 91 HG13 VAL 6 0.893 -4.666 -11.419 1.00 0.00 H -ATOM 92 CG2 VAL 6 0.631 -6.893 -10.017 1.00 0.00 C -ATOM 93 HG21 VAL 6 1.531 -6.791 -10.623 1.00 0.00 H -ATOM 94 HG22 VAL 6 0.828 -6.767 -8.953 1.00 0.00 H -ATOM 95 HG23 VAL 6 0.347 -7.919 -10.252 1.00 0.00 H -ATOM 96 C VAL 6 -2.902 -5.458 -10.660 1.00 0.00 C -ATOM 97 O VAL 6 -3.437 -6.012 -11.666 1.00 0.00 O -ATOM 98 N VAL 7 -3.360 -4.302 -10.167 1.00 0.00 N -ATOM 99 H VAL 7 -2.962 -3.913 -9.323 1.00 0.00 H -ATOM 100 CA VAL 7 -4.412 -3.523 -10.835 1.00 0.00 C -ATOM 101 HA VAL 7 -4.703 -3.970 -11.784 1.00 0.00 H -ATOM 102 CB VAL 7 -5.730 -3.463 -10.013 1.00 0.00 C -ATOM 103 HB VAL 7 -6.438 -3.091 -10.755 1.00 0.00 H -ATOM 104 CG1 VAL 7 -6.153 -4.854 -9.666 1.00 0.00 C -ATOM 105 HG11 VAL 7 -7.102 -4.853 -9.130 1.00 0.00 H -ATOM 106 HG12 VAL 7 -6.155 -5.371 -10.625 1.00 0.00 H -ATOM 107 HG13 VAL 7 -5.473 -5.312 -8.947 1.00 0.00 H -ATOM 108 CG2 VAL 7 -5.812 -2.604 -8.732 1.00 0.00 C -ATOM 109 HG21 VAL 7 -5.360 -3.059 -7.850 1.00 0.00 H -ATOM 110 HG22 VAL 7 -5.297 -1.649 -8.828 1.00 0.00 H -ATOM 111 HG23 VAL 7 -6.878 -2.417 -8.601 1.00 0.00 H -ATOM 112 C VAL 7 -3.923 -2.150 -11.132 1.00 0.00 C -ATOM 113 O VAL 7 -3.249 -1.514 -10.303 1.00 0.00 O -ATOM 114 N VAL 8 -4.230 -1.677 -12.303 1.00 0.00 N -ATOM 115 H VAL 8 -4.760 -2.246 -12.948 1.00 0.00 H -ATOM 116 CA VAL 8 -3.903 -0.296 -12.688 1.00 0.00 C -ATOM 117 HA VAL 8 -2.943 0.038 -12.295 1.00 0.00 H -ATOM 118 CB VAL 8 -3.533 -0.259 -14.202 1.00 0.00 C -ATOM 119 HB VAL 8 -4.293 -0.905 -14.640 1.00 0.00 H -ATOM 120 CG1 VAL 8 -3.550 1.160 -14.890 1.00 0.00 C -ATOM 121 HG11 VAL 8 -4.583 1.508 -14.898 1.00 0.00 H -ATOM 122 HG12 VAL 8 -2.868 1.794 -14.324 1.00 0.00 H -ATOM 123 HG13 VAL 8 -3.228 1.118 -15.930 1.00 0.00 H -ATOM 124 CG2 VAL 8 -2.202 -0.883 -14.548 1.00 0.00 C -ATOM 125 HG21 VAL 8 -1.450 -0.094 -14.545 1.00 0.00 H -ATOM 126 HG22 VAL 8 -1.954 -1.694 -13.864 1.00 0.00 H -ATOM 127 HG23 VAL 8 -2.228 -1.236 -15.578 1.00 0.00 H -ATOM 128 C VAL 8 -5.031 0.652 -12.286 1.00 0.00 C -ATOM 129 O VAL 8 -6.158 0.427 -12.655 1.00 0.00 O -ATOM 130 N ARG 9 -4.800 1.785 -11.615 1.00 0.00 N -ATOM 131 H ARG 9 -3.846 1.957 -11.332 1.00 0.00 H -ATOM 132 CA ARG 9 -5.827 2.851 -11.313 1.00 0.00 C -ATOM 133 HA ARG 9 -6.684 2.594 -11.935 1.00 0.00 H -ATOM 134 CB ARG 9 -6.236 2.980 -9.898 1.00 0.00 C -ATOM 135 HB2 ARG 9 -6.593 2.016 -9.535 1.00 0.00 H -ATOM 136 HB3 ARG 9 -5.279 3.184 -9.417 1.00 0.00 H -ATOM 137 CG ARG 9 -7.274 4.086 -9.650 1.00 0.00 C -ATOM 138 HG2 ARG 9 -6.866 5.010 -10.059 1.00 0.00 H -ATOM 139 HG3 ARG 9 -8.222 3.774 -10.089 1.00 0.00 H -ATOM 140 CD ARG 9 -7.402 4.368 -8.169 1.00 0.00 C -ATOM 141 HD2 ARG 9 -7.507 3.376 -7.727 1.00 0.00 H -ATOM 142 HD3 ARG 9 -6.469 4.782 -7.787 1.00 0.00 H -ATOM 143 NE ARG 9 -8.459 5.313 -7.819 1.00 0.00 N -ATOM 144 HE ARG 9 -9.107 5.630 -8.526 1.00 0.00 H -ATOM 145 CZ ARG 9 -8.696 5.766 -6.604 1.00 0.00 C -ATOM 146 NH1 ARG 9 -7.875 5.424 -5.616 1.00 0.00 N -ATOM 147 HH11 ARG 9 -7.002 4.945 -5.784 1.00 0.00 H -ATOM 148 HH12 ARG 9 -8.048 5.712 -4.664 1.00 0.00 H -ATOM 149 NH2 ARG 9 -9.783 6.270 -6.245 1.00 0.00 N -ATOM 150 HH21 ARG 9 -10.572 6.366 -6.869 1.00 0.00 H -ATOM 151 HH22 ARG 9 -9.947 6.279 -5.248 1.00 0.00 H -ATOM 152 C ARG 9 -5.354 4.226 -11.823 1.00 0.00 C -ATOM 153 O ARG 9 -4.428 4.939 -11.316 1.00 0.00 O -ATOM 154 N CYS 10 -6.037 4.783 -12.859 1.00 0.00 N -ATOM 155 H CYS 10 -6.576 4.125 -13.405 1.00 0.00 H -ATOM 156 CA CYS 10 -5.803 6.094 -13.446 1.00 0.00 C -ATOM 157 HA CYS 10 -4.722 6.217 -13.379 1.00 0.00 H -ATOM 158 CB CYS 10 -6.283 6.087 -14.871 1.00 0.00 C -ATOM 159 HB2 CYS 10 -6.039 5.120 -15.310 1.00 0.00 H -ATOM 160 HB3 CYS 10 -7.373 6.068 -14.873 1.00 0.00 H -ATOM 161 SG CYS 10 -5.585 7.462 -15.751 1.00 0.00 S -ATOM 162 HG CYS 10 -6.439 8.424 -15.390 1.00 0.00 H -ATOM 163 C CYS 10 -6.501 7.198 -12.591 1.00 0.00 C -ATOM 164 O CYS 10 -7.618 7.017 -12.058 1.00 0.00 O -ATOM 165 N ARG 11 -5.882 8.372 -12.484 1.00 0.00 N -ATOM 166 H ARG 11 -4.918 8.554 -12.721 1.00 0.00 H -ATOM 167 CA ARG 11 -6.501 9.490 -11.826 1.00 0.00 C -ATOM 168 HA ARG 11 -7.389 9.133 -11.304 1.00 0.00 H -ATOM 169 CB ARG 11 -5.544 10.186 -10.794 1.00 0.00 C -ATOM 170 HB2 ARG 11 -6.080 11.036 -10.372 1.00 0.00 H -ATOM 171 HB3 ARG 11 -5.299 9.544 -9.949 1.00 0.00 H -ATOM 172 CG ARG 11 -4.240 10.651 -11.482 1.00 0.00 C -ATOM 173 HG2 ARG 11 -3.482 9.871 -11.563 1.00 0.00 H -ATOM 174 HG3 ARG 11 -4.475 10.858 -12.527 1.00 0.00 H -ATOM 175 CD ARG 11 -3.637 11.816 -10.851 1.00 0.00 C -ATOM 176 HD2 ARG 11 -4.295 12.682 -10.909 1.00 0.00 H -ATOM 177 HD3 ARG 11 -3.449 11.751 -9.779 1.00 0.00 H -ATOM 178 NE ARG 11 -2.372 12.144 -11.466 1.00 0.00 N -ATOM 179 HE ARG 11 -1.519 12.024 -10.938 1.00 0.00 H -ATOM 180 CZ ARG 11 -2.104 12.907 -12.498 1.00 0.00 C -ATOM 181 NH1 ARG 11 -2.991 13.200 -13.344 1.00 0.00 N -ATOM 182 HH11 ARG 11 -3.945 12.894 -13.219 1.00 0.00 H -ATOM 183 HH12 ARG 11 -2.790 13.931 -14.012 1.00 0.00 H -ATOM 184 NH2 ARG 11 -0.924 13.262 -12.804 1.00 0.00 N -ATOM 185 HH21 ARG 11 -0.110 13.228 -12.208 1.00 0.00 H -ATOM 186 HH22 ARG 11 -0.798 13.879 -13.594 1.00 0.00 H -ATOM 187 C ARG 11 -7.088 10.353 -13.034 1.00 0.00 C -ATOM 188 O ARG 11 -6.620 10.313 -14.143 1.00 0.00 O -ATOM 189 N PRO 12 -7.973 11.329 -12.799 1.00 0.00 N -ATOM 190 CD PRO 12 -8.658 11.629 -11.549 1.00 0.00 C -ATOM 191 HD2 PRO 12 -8.048 11.442 -10.666 1.00 0.00 H -ATOM 192 HD3 PRO 12 -9.579 11.048 -11.508 1.00 0.00 H -ATOM 193 CG PRO 12 -9.105 13.044 -11.653 1.00 0.00 C -ATOM 194 HG2 PRO 12 -8.291 13.711 -11.368 1.00 0.00 H -ATOM 195 HG3 PRO 12 -10.042 13.224 -11.124 1.00 0.00 H -ATOM 196 CB PRO 12 -9.341 13.195 -13.150 1.00 0.00 C -ATOM 197 HB2 PRO 12 -9.358 14.223 -13.513 1.00 0.00 H -ATOM 198 HB3 PRO 12 -10.244 12.684 -13.482 1.00 0.00 H -ATOM 199 CA PRO 12 -8.147 12.434 -13.683 1.00 0.00 C -ATOM 200 HA PRO 12 -8.367 12.114 -14.701 1.00 0.00 H -ATOM 201 C PRO 12 -6.952 13.310 -13.929 1.00 0.00 C -ATOM 202 O PRO 12 -5.868 13.016 -13.347 1.00 0.00 O -ATOM 203 N PHE 13 -7.023 14.430 -14.724 1.00 0.00 N -ATOM 204 H PHE 13 -7.919 14.671 -15.123 1.00 0.00 H -ATOM 205 CA PHE 13 -5.918 15.429 -14.778 1.00 0.00 C -ATOM 206 HA PHE 13 -5.013 14.897 -15.075 1.00 0.00 H -ATOM 207 CB PHE 13 -6.167 16.515 -15.869 1.00 0.00 C -ATOM 208 HB2 PHE 13 -7.135 16.998 -15.737 1.00 0.00 H -ATOM 209 HB3 PHE 13 -5.391 17.261 -15.701 1.00 0.00 H -ATOM 210 CG PHE 13 -6.075 15.985 -17.347 1.00 0.00 C -ATOM 211 CD1 PHE 13 -7.141 15.247 -17.907 1.00 0.00 C -ATOM 212 HD1 PHE 13 -8.054 15.009 -17.383 1.00 0.00 H -ATOM 213 CE1 PHE 13 -7.057 14.835 -19.282 1.00 0.00 C -ATOM 214 HE1 PHE 13 -7.899 14.373 -19.775 1.00 0.00 H -ATOM 215 CZ PHE 13 -5.980 15.171 -20.074 1.00 0.00 C -ATOM 216 HZ PHE 13 -5.895 14.849 -21.101 1.00 0.00 H -ATOM 217 CE2 PHE 13 -4.934 15.818 -19.447 1.00 0.00 C -ATOM 218 HE2 PHE 13 -4.084 16.078 -20.060 1.00 0.00 H -ATOM 219 CD2 PHE 13 -5.012 16.235 -18.109 1.00 0.00 C -ATOM 220 HD2 PHE 13 -4.124 16.698 -17.706 1.00 0.00 H -ATOM 221 C PHE 13 -5.549 16.057 -13.421 1.00 0.00 C -ATOM 222 O PHE 13 -6.367 16.473 -12.625 1.00 0.00 O -ATOM 223 N ASN 14 -4.266 16.393 -13.287 1.00 0.00 N -ATOM 224 H ASN 14 -3.583 16.247 -14.017 1.00 0.00 H -ATOM 225 CA ASN 14 -3.785 17.467 -12.297 1.00 0.00 C -ATOM 226 HA ASN 14 -4.486 17.492 -11.463 1.00 0.00 H -ATOM 227 CB ASN 14 -2.452 17.093 -11.742 1.00 0.00 C -ATOM 228 HB2 ASN 14 -1.651 16.864 -12.446 1.00 0.00 H -ATOM 229 HB3 ASN 14 -2.032 17.883 -11.119 1.00 0.00 H -ATOM 230 CG ASN 14 -2.431 15.875 -10.860 1.00 0.00 C -ATOM 231 OD1 ASN 14 -3.428 15.163 -10.564 1.00 0.00 O -ATOM 232 ND2 ASN 14 -1.250 15.561 -10.410 1.00 0.00 N -ATOM 233 HD21 ASN 14 -1.152 14.657 -9.970 1.00 0.00 H -ATOM 234 HD22 ASN 14 -0.414 16.117 -10.515 1.00 0.00 H -ATOM 235 C ASN 14 -3.782 18.814 -12.855 1.00 0.00 C -ATOM 236 O ASN 14 -3.542 19.009 -14.008 1.00 0.00 O -ATOM 237 N LEU 15 -4.115 19.905 -12.102 1.00 0.00 N -ATOM 238 H LEU 15 -4.625 19.764 -11.241 1.00 0.00 H -ATOM 239 CA LEU 15 -3.985 21.269 -12.625 1.00 0.00 C -ATOM 240 HA LEU 15 -4.639 21.479 -13.472 1.00 0.00 H -ATOM 241 CB LEU 15 -4.350 22.288 -11.494 1.00 0.00 C -ATOM 242 HB2 LEU 15 -5.271 21.955 -11.015 1.00 0.00 H -ATOM 243 HB3 LEU 15 -3.563 22.310 -10.741 1.00 0.00 H -ATOM 244 CG LEU 15 -4.396 23.821 -11.936 1.00 0.00 C -ATOM 245 HG LEU 15 -3.424 24.132 -12.321 1.00 0.00 H -ATOM 246 CD1 LEU 15 -5.438 24.058 -13.045 1.00 0.00 C -ATOM 247 HD11 LEU 15 -5.627 25.123 -13.183 1.00 0.00 H -ATOM 248 HD12 LEU 15 -5.099 23.579 -13.962 1.00 0.00 H -ATOM 249 HD13 LEU 15 -6.362 23.668 -12.618 1.00 0.00 H -ATOM 250 CD2 LEU 15 -4.666 24.751 -10.701 1.00 0.00 C -ATOM 251 HD21 LEU 15 -4.112 24.322 -9.866 1.00 0.00 H -ATOM 252 HD22 LEU 15 -4.426 25.800 -10.871 1.00 0.00 H -ATOM 253 HD23 LEU 15 -5.716 24.695 -10.417 1.00 0.00 H -ATOM 254 C LEU 15 -2.571 21.643 -13.303 1.00 0.00 C -ATOM 255 O LEU 15 -2.588 22.319 -14.341 1.00 0.00 O -ATOM 256 N ALA 16 -1.518 21.032 -12.812 1.00 0.00 N -ATOM 257 H ALA 16 -1.555 20.693 -11.861 1.00 0.00 H -ATOM 258 CA ALA 16 -0.229 21.162 -13.444 1.00 0.00 C -ATOM 259 HA ALA 16 -0.087 22.229 -13.614 1.00 0.00 H -ATOM 260 CB ALA 16 0.780 20.733 -12.366 1.00 0.00 C -ATOM 261 HB1 ALA 16 1.213 21.564 -11.809 1.00 0.00 H -ATOM 262 HB2 ALA 16 0.401 19.911 -11.759 1.00 0.00 H -ATOM 263 HB3 ALA 16 1.585 20.210 -12.884 1.00 0.00 H -ATOM 264 C ALA 16 -0.021 20.473 -14.808 1.00 0.00 C -ATOM 265 O ALA 16 0.938 20.889 -15.488 1.00 0.00 O -ATOM 266 N GLU 17 -0.943 19.590 -15.284 1.00 0.00 N -ATOM 267 H GLU 17 -1.827 19.563 -14.794 1.00 0.00 H -ATOM 268 CA GLU 17 -1.009 19.061 -16.629 1.00 0.00 C -ATOM 269 HA GLU 17 -0.044 19.128 -17.135 1.00 0.00 H -ATOM 270 CB GLU 17 -1.502 17.553 -16.649 1.00 0.00 C -ATOM 271 HB2 GLU 17 -2.375 17.525 -15.999 1.00 0.00 H -ATOM 272 HB3 GLU 17 -1.730 17.245 -17.669 1.00 0.00 H -ATOM 273 CG GLU 17 -0.480 16.548 -16.081 1.00 0.00 C -ATOM 274 HG2 GLU 17 0.154 16.195 -16.893 1.00 0.00 H -ATOM 275 HG3 GLU 17 0.245 16.979 -15.391 1.00 0.00 H -ATOM 276 CD GLU 17 -1.173 15.304 -15.466 1.00 0.00 C -ATOM 277 OE1 GLU 17 -2.358 15.331 -15.084 1.00 0.00 O -ATOM 278 OE2 GLU 17 -0.561 14.204 -15.284 1.00 0.00 O -ATOM 279 C GLU 17 -1.894 19.990 -17.518 1.00 0.00 C -ATOM 280 O GLU 17 -1.483 20.038 -18.704 1.00 0.00 O -ATOM 281 N ARG 18 -2.824 20.761 -16.930 1.00 0.00 N -ATOM 282 H ARG 18 -3.226 20.497 -16.042 1.00 0.00 H -ATOM 283 CA ARG 18 -3.549 21.764 -17.647 1.00 0.00 C -ATOM 284 HA ARG 18 -3.898 21.527 -18.651 1.00 0.00 H -ATOM 285 CB ARG 18 -4.831 22.157 -16.895 1.00 0.00 C -ATOM 286 HB2 ARG 18 -4.564 22.605 -15.937 1.00 0.00 H -ATOM 287 HB3 ARG 18 -5.413 22.950 -17.365 1.00 0.00 H -ATOM 288 CG ARG 18 -5.888 20.992 -16.618 1.00 0.00 C -ATOM 289 HG2 ARG 18 -5.512 20.387 -15.792 1.00 0.00 H -ATOM 290 HG3 ARG 18 -6.717 21.508 -16.136 1.00 0.00 H -ATOM 291 CD ARG 18 -6.254 20.172 -17.908 1.00 0.00 C -ATOM 292 HD2 ARG 18 -6.470 20.906 -18.685 1.00 0.00 H -ATOM 293 HD3 ARG 18 -5.453 19.462 -18.108 1.00 0.00 H -ATOM 294 NE ARG 18 -7.486 19.378 -17.635 1.00 0.00 N -ATOM 295 HE ARG 18 -7.776 19.220 -16.680 1.00 0.00 H -ATOM 296 CZ ARG 18 -8.159 18.574 -18.439 1.00 0.00 C -ATOM 297 NH1 ARG 18 -7.811 18.344 -19.671 1.00 0.00 N -ATOM 298 HH11 ARG 18 -6.900 18.724 -19.886 1.00 0.00 H -ATOM 299 HH12 ARG 18 -8.308 17.748 -20.317 1.00 0.00 H -ATOM 300 NH2 ARG 18 -9.225 17.936 -18.026 1.00 0.00 N -ATOM 301 HH21 ARG 18 -9.530 18.050 -17.071 1.00 0.00 H -ATOM 302 HH22 ARG 18 -9.767 17.363 -18.657 1.00 0.00 H -ATOM 303 C ARG 18 -2.654 22.958 -17.918 1.00 0.00 C -ATOM 304 O ARG 18 -2.501 23.462 -19.039 1.00 0.00 O -ATOM 305 N LYS 19 -1.957 23.483 -16.913 1.00 0.00 N -ATOM 306 H LYS 19 -2.043 23.053 -16.004 1.00 0.00 H -ATOM 307 CA LYS 19 -0.756 24.437 -16.975 1.00 0.00 C -ATOM 308 HA LYS 19 -1.145 25.368 -17.387 1.00 0.00 H -ATOM 309 CB LYS 19 -0.153 24.771 -15.645 1.00 0.00 C -ATOM 310 HB2 LYS 19 0.044 23.823 -15.148 1.00 0.00 H -ATOM 311 HB3 LYS 19 0.744 25.370 -15.805 1.00 0.00 H -ATOM 312 CG LYS 19 -1.077 25.584 -14.777 1.00 0.00 C -ATOM 313 HG2 LYS 19 -1.075 26.592 -15.192 1.00 0.00 H -ATOM 314 HG3 LYS 19 -2.028 25.056 -14.720 1.00 0.00 H -ATOM 315 CD LYS 19 -0.560 25.686 -13.354 1.00 0.00 C -ATOM 316 HD2 LYS 19 -0.294 24.707 -12.956 1.00 0.00 H -ATOM 317 HD3 LYS 19 0.379 26.238 -13.403 1.00 0.00 H -ATOM 318 CE LYS 19 -1.420 26.487 -12.313 1.00 0.00 C -ATOM 319 HE2 LYS 19 -1.258 27.557 -12.442 1.00 0.00 H -ATOM 320 HE3 LYS 19 -2.490 26.335 -12.453 1.00 0.00 H -ATOM 321 NZ LYS 19 -1.178 26.018 -10.916 1.00 0.00 N -ATOM 322 HZ1 LYS 19 -1.642 26.529 -10.179 1.00 0.00 H -ATOM 323 HZ2 LYS 19 -1.487 25.089 -10.667 1.00 0.00 H -ATOM 324 HZ3 LYS 19 -0.209 26.123 -10.649 1.00 0.00 H -ATOM 325 C LYS 19 0.323 24.119 -18.023 1.00 0.00 C -ATOM 326 O LYS 19 0.842 25.006 -18.751 1.00 0.00 O -ATOM 327 N ALA 20 0.377 22.813 -18.352 1.00 0.00 N -ATOM 328 H ALA 20 -0.085 22.210 -17.685 1.00 0.00 H -ATOM 329 CA ALA 20 1.154 22.238 -19.453 1.00 0.00 C -ATOM 330 HA ALA 20 1.990 22.867 -19.755 1.00 0.00 H -ATOM 331 CB ALA 20 1.818 20.923 -18.887 1.00 0.00 C -ATOM 332 HB1 ALA 20 2.366 20.405 -19.673 1.00 0.00 H -ATOM 333 HB2 ALA 20 2.489 21.088 -18.043 1.00 0.00 H -ATOM 334 HB3 ALA 20 1.104 20.137 -18.639 1.00 0.00 H -ATOM 335 C ALA 20 0.426 21.999 -20.770 1.00 0.00 C -ATOM 336 O ALA 20 1.057 21.627 -21.746 1.00 0.00 O -ATOM 337 N SER 21 -0.880 22.223 -20.895 1.00 0.00 N -ATOM 338 H SER 21 -1.338 22.442 -20.021 1.00 0.00 H -ATOM 339 CA SER 21 -1.728 21.942 -22.097 1.00 0.00 C -ATOM 340 HA SER 21 -2.758 22.175 -21.823 1.00 0.00 H -ATOM 341 CB SER 21 -1.456 22.904 -23.251 1.00 0.00 C -ATOM 342 HB2 SER 21 -2.162 22.559 -24.006 1.00 0.00 H -ATOM 343 HB3 SER 21 -1.764 23.936 -23.082 1.00 0.00 H -ATOM 344 OG SER 21 -0.176 22.882 -23.879 1.00 0.00 O -ATOM 345 HG SER 21 0.443 22.369 -23.355 1.00 0.00 H -ATOM 346 C SER 21 -1.697 20.493 -22.563 1.00 0.00 C -ATOM 347 O SER 21 -1.674 20.212 -23.775 1.00 0.00 O -ATOM 348 N ALA 22 -1.572 19.513 -21.629 1.00 0.00 N -ATOM 349 H ALA 22 -1.274 19.748 -20.693 1.00 0.00 H -ATOM 350 CA ALA 22 -1.498 18.073 -21.911 1.00 0.00 C -ATOM 351 HA ALA 22 -0.669 17.989 -22.615 1.00 0.00 H -ATOM 352 CB ALA 22 -1.089 17.377 -20.646 1.00 0.00 C -ATOM 353 HB1 ALA 22 -1.953 17.396 -19.982 1.00 0.00 H -ATOM 354 HB2 ALA 22 -0.855 16.333 -20.854 1.00 0.00 H -ATOM 355 HB3 ALA 22 -0.274 17.868 -20.114 1.00 0.00 H -ATOM 356 C ALA 22 -2.796 17.421 -22.527 1.00 0.00 C -ATOM 357 O ALA 22 -3.854 17.932 -22.373 1.00 0.00 O -ATOM 358 N HIE 23 -2.630 16.224 -23.137 1.00 0.00 N -ATOM 359 H HIE 23 -1.666 15.924 -23.168 1.00 0.00 H -ATOM 360 CA HIE 23 -3.722 15.420 -23.617 1.00 0.00 C -ATOM 361 HA HIE 23 -4.646 15.893 -23.287 1.00 0.00 H -ATOM 362 CB HIE 23 -3.631 15.519 -25.150 1.00 0.00 C -ATOM 363 HB2 HIE 23 -4.377 14.885 -25.629 1.00 0.00 H -ATOM 364 HB3 HIE 23 -3.821 16.565 -25.394 1.00 0.00 H -ATOM 365 CG HIE 23 -2.365 15.182 -25.841 1.00 0.00 C -ATOM 366 ND1 HIE 23 -1.453 16.073 -26.367 1.00 0.00 N -ATOM 367 CE1 HIE 23 -0.541 15.323 -26.985 1.00 0.00 C -ATOM 368 HE1 HIE 23 0.264 15.655 -27.624 1.00 0.00 H -ATOM 369 NE2 HIE 23 -0.812 14.019 -26.811 1.00 0.00 N -ATOM 370 HE2 HIE 23 -0.269 13.245 -27.167 1.00 0.00 H -ATOM 371 CD2 HIE 23 -1.896 13.880 -26.047 1.00 0.00 C -ATOM 372 HD2 HIE 23 -2.341 12.946 -25.736 1.00 0.00 H -ATOM 373 C HIE 23 -3.638 14.015 -23.142 1.00 0.00 C -ATOM 374 O HIE 23 -2.623 13.575 -22.616 1.00 0.00 O -ATOM 375 N SER 24 -4.805 13.329 -23.144 1.00 0.00 N -ATOM 376 H SER 24 -5.599 13.767 -23.589 1.00 0.00 H -ATOM 377 CA SER 24 -4.905 11.957 -22.699 1.00 0.00 C -ATOM 378 HA SER 24 -4.345 11.978 -21.763 1.00 0.00 H -ATOM 379 CB SER 24 -6.333 11.509 -22.406 1.00 0.00 C -ATOM 380 HB2 SER 24 -6.796 11.906 -21.503 1.00 0.00 H -ATOM 381 HB3 SER 24 -6.925 11.724 -23.296 1.00 0.00 H -ATOM 382 OG SER 24 -6.413 10.067 -22.325 1.00 0.00 O -ATOM 383 HG SER 24 -6.953 9.787 -23.069 1.00 0.00 H -ATOM 384 C SER 24 -4.254 10.979 -23.667 1.00 0.00 C -ATOM 385 O SER 24 -4.339 11.158 -24.877 1.00 0.00 O -ATOM 386 N ILE 25 -3.466 10.026 -23.161 1.00 0.00 N -ATOM 387 H ILE 25 -3.499 10.049 -22.152 1.00 0.00 H -ATOM 388 CA ILE 25 -2.675 9.045 -23.915 1.00 0.00 C -ATOM 389 HA ILE 25 -3.041 9.078 -24.941 1.00 0.00 H -ATOM 390 CB ILE 25 -1.184 9.398 -23.832 1.00 0.00 C -ATOM 391 HB ILE 25 -0.636 8.550 -24.241 1.00 0.00 H -ATOM 392 CG2 ILE 25 -0.816 10.594 -24.710 1.00 0.00 C -ATOM 393 HG21 ILE 25 0.245 10.608 -24.964 1.00 0.00 H -ATOM 394 HG22 ILE 25 -1.451 10.581 -25.597 1.00 0.00 H -ATOM 395 HG23 ILE 25 -1.112 11.468 -24.130 1.00 0.00 H -ATOM 396 CG1 ILE 25 -0.627 9.729 -22.424 1.00 0.00 C -ATOM 397 HG12 ILE 25 0.391 10.117 -22.444 1.00 0.00 H -ATOM 398 HG13 ILE 25 -1.144 10.609 -22.041 1.00 0.00 H -ATOM 399 CD1 ILE 25 -0.658 8.538 -21.434 1.00 0.00 C -ATOM 400 HD11 ILE 25 -0.155 7.750 -21.996 1.00 0.00 H -ATOM 401 HD12 ILE 25 -0.165 8.836 -20.509 1.00 0.00 H -ATOM 402 HD13 ILE 25 -1.721 8.423 -21.221 1.00 0.00 H -ATOM 403 C ILE 25 -2.970 7.588 -23.586 1.00 0.00 C -ATOM 404 O ILE 25 -2.401 6.692 -24.225 1.00 0.00 O -ATOM 405 N VAL 26 -3.907 7.308 -22.643 1.00 0.00 N -ATOM 406 H VAL 26 -4.329 8.129 -22.233 1.00 0.00 H -ATOM 407 CA VAL 26 -4.224 5.988 -22.058 1.00 0.00 C -ATOM 408 HA VAL 26 -3.447 5.298 -22.389 1.00 0.00 H -ATOM 409 CB VAL 26 -4.140 6.089 -20.468 1.00 0.00 C -ATOM 410 HB VAL 26 -4.416 7.093 -20.144 1.00 0.00 H -ATOM 411 CG1 VAL 26 -5.104 5.083 -19.733 1.00 0.00 C -ATOM 412 HG11 VAL 26 -4.821 4.059 -19.979 1.00 0.00 H -ATOM 413 HG12 VAL 26 -5.051 5.193 -18.651 1.00 0.00 H -ATOM 414 HG13 VAL 26 -6.150 5.273 -19.977 1.00 0.00 H -ATOM 415 CG2 VAL 26 -2.731 5.715 -20.084 1.00 0.00 C -ATOM 416 HG21 VAL 26 -2.503 4.651 -20.143 1.00 0.00 H -ATOM 417 HG22 VAL 26 -2.015 6.135 -20.790 1.00 0.00 H -ATOM 418 HG23 VAL 26 -2.487 6.134 -19.108 1.00 0.00 H -ATOM 419 C VAL 26 -5.581 5.530 -22.639 1.00 0.00 C -ATOM 420 O VAL 26 -6.390 6.340 -22.957 1.00 0.00 O -ATOM 421 N GLU 27 -5.802 4.251 -22.703 1.00 0.00 N -ATOM 422 H GLU 27 -5.084 3.547 -22.603 1.00 0.00 H -ATOM 423 CA GLU 27 -7.163 3.746 -22.894 1.00 0.00 C -ATOM 424 HA GLU 27 -7.857 4.514 -22.551 1.00 0.00 H -ATOM 425 CB GLU 27 -7.419 3.519 -24.413 1.00 0.00 C -ATOM 426 HB2 GLU 27 -7.270 4.411 -25.023 1.00 0.00 H -ATOM 427 HB3 GLU 27 -6.669 2.782 -24.699 1.00 0.00 H -ATOM 428 CG GLU 27 -8.779 2.925 -24.753 1.00 0.00 C -ATOM 429 HG2 GLU 27 -8.765 2.928 -25.843 1.00 0.00 H -ATOM 430 HG3 GLU 27 -8.796 1.903 -24.375 1.00 0.00 H -ATOM 431 CD GLU 27 -9.949 3.666 -24.163 1.00 0.00 C -ATOM 432 OE1 GLU 27 -9.811 4.848 -23.776 1.00 0.00 O -ATOM 433 OE2 GLU 27 -11.069 3.086 -24.247 1.00 0.00 O -ATOM 434 C GLU 27 -7.424 2.502 -21.961 1.00 0.00 C -ATOM 435 O GLU 27 -6.855 1.451 -22.170 1.00 0.00 O -ATOM 436 N CYS 28 -8.149 2.714 -20.869 1.00 0.00 N -ATOM 437 H CYS 28 -8.615 3.593 -20.691 1.00 0.00 H -ATOM 438 CA CYS 28 -8.506 1.607 -19.980 1.00 0.00 C -ATOM 439 HA CYS 28 -7.665 0.924 -19.862 1.00 0.00 H -ATOM 440 CB CYS 28 -9.009 1.974 -18.531 1.00 0.00 C -ATOM 441 HB2 CYS 28 -9.674 2.836 -18.605 1.00 0.00 H -ATOM 442 HB3 CYS 28 -9.527 1.097 -18.143 1.00 0.00 H -ATOM 443 SG CYS 28 -7.650 2.219 -17.457 1.00 0.00 S -ATOM 444 HG CYS 28 -7.404 3.497 -17.761 1.00 0.00 H -ATOM 445 C CYS 28 -9.531 0.747 -20.754 1.00 0.00 C -ATOM 446 O CYS 28 -10.361 1.297 -21.511 1.00 0.00 O -ATOM 447 N ASP 29 -9.597 -0.565 -20.567 1.00 0.00 N -ATOM 448 H ASP 29 -8.858 -0.863 -19.946 1.00 0.00 H -ATOM 449 CA ASP 29 -10.612 -1.606 -20.925 1.00 0.00 C -ATOM 450 HA ASP 29 -11.518 -1.000 -20.941 1.00 0.00 H -ATOM 451 CB ASP 29 -10.421 -2.162 -22.352 1.00 0.00 C -ATOM 452 HB2 ASP 29 -10.214 -1.285 -22.966 1.00 0.00 H -ATOM 453 HB3 ASP 29 -9.500 -2.739 -22.442 1.00 0.00 H -ATOM 454 CG ASP 29 -11.554 -2.931 -22.903 1.00 0.00 C -ATOM 455 OD1 ASP 29 -11.867 -2.687 -24.134 1.00 0.00 O -ATOM 456 OD2 ASP 29 -12.163 -3.742 -22.179 1.00 0.00 O -ATOM 457 C ASP 29 -10.954 -2.667 -19.836 1.00 0.00 C -ATOM 458 O ASP 29 -10.139 -3.581 -19.647 1.00 0.00 O -ATOM 459 N PRO 30 -12.107 -2.663 -19.090 1.00 0.00 N -ATOM 460 CD PRO 30 -12.866 -1.535 -18.883 1.00 0.00 C -ATOM 461 HD2 PRO 30 -13.274 -1.109 -19.799 1.00 0.00 H -ATOM 462 HD3 PRO 30 -12.292 -0.645 -18.625 1.00 0.00 H -ATOM 463 CG PRO 30 -13.797 -1.784 -17.706 1.00 0.00 C -ATOM 464 HG2 PRO 30 -14.774 -2.132 -18.039 1.00 0.00 H -ATOM 465 HG3 PRO 30 -13.920 -0.842 -17.172 1.00 0.00 H -ATOM 466 CB PRO 30 -13.134 -2.947 -16.933 1.00 0.00 C -ATOM 467 HB2 PRO 30 -13.872 -3.545 -16.398 1.00 0.00 H -ATOM 468 HB3 PRO 30 -12.542 -2.468 -16.152 1.00 0.00 H -ATOM 469 CA PRO 30 -12.396 -3.701 -18.012 1.00 0.00 C -ATOM 470 HA PRO 30 -11.483 -4.062 -17.540 1.00 0.00 H -ATOM 471 C PRO 30 -13.061 -4.940 -18.513 1.00 0.00 C -ATOM 472 O PRO 30 -13.372 -5.902 -17.745 1.00 0.00 O -ATOM 473 N VAL 31 -13.344 -5.034 -19.816 1.00 0.00 N -ATOM 474 H VAL 31 -13.018 -4.324 -20.456 1.00 0.00 H -ATOM 475 CA VAL 31 -14.026 -6.200 -20.426 1.00 0.00 C -ATOM 476 HA VAL 31 -14.675 -6.723 -19.725 1.00 0.00 H -ATOM 477 CB VAL 31 -14.833 -5.796 -21.706 1.00 0.00 C -ATOM 478 HB VAL 31 -14.470 -5.012 -22.369 1.00 0.00 H -ATOM 479 CG1 VAL 31 -15.168 -6.915 -22.685 1.00 0.00 C -ATOM 480 HG11 VAL 31 -14.349 -7.223 -23.335 1.00 0.00 H -ATOM 481 HG12 VAL 31 -15.536 -7.756 -22.097 1.00 0.00 H -ATOM 482 HG13 VAL 31 -15.984 -6.600 -23.333 1.00 0.00 H -ATOM 483 CG2 VAL 31 -16.123 -5.231 -21.039 1.00 0.00 C -ATOM 484 HG21 VAL 31 -16.875 -4.963 -21.782 1.00 0.00 H -ATOM 485 HG22 VAL 31 -16.703 -5.953 -20.465 1.00 0.00 H -ATOM 486 HG23 VAL 31 -15.902 -4.401 -20.367 1.00 0.00 H -ATOM 487 C VAL 31 -12.781 -7.104 -20.846 1.00 0.00 C -ATOM 488 O VAL 31 -12.838 -8.317 -20.737 1.00 0.00 O -ATOM 489 N ARG 32 -11.737 -6.525 -21.400 1.00 0.00 N -ATOM 490 H ARG 32 -11.756 -5.538 -21.609 1.00 0.00 H -ATOM 491 CA ARG 32 -10.430 -7.221 -21.530 1.00 0.00 C -ATOM 492 HA ARG 32 -10.595 -8.254 -21.834 1.00 0.00 H -ATOM 493 CB ARG 32 -9.659 -6.439 -22.618 1.00 0.00 C -ATOM 494 HB2 ARG 32 -9.420 -5.467 -22.186 1.00 0.00 H -ATOM 495 HB3 ARG 32 -8.717 -6.942 -22.840 1.00 0.00 H -ATOM 496 CG ARG 32 -10.408 -6.114 -24.003 1.00 0.00 C -ATOM 497 HG2 ARG 32 -10.625 -7.056 -24.506 1.00 0.00 H -ATOM 498 HG3 ARG 32 -11.342 -5.643 -23.695 1.00 0.00 H -ATOM 499 CD ARG 32 -9.608 -5.259 -24.986 1.00 0.00 C -ATOM 500 HD2 ARG 32 -10.299 -5.008 -25.792 1.00 0.00 H -ATOM 501 HD3 ARG 32 -9.338 -4.389 -24.386 1.00 0.00 H -ATOM 502 NE ARG 32 -8.405 -5.886 -25.537 1.00 0.00 N -ATOM 503 HE ARG 32 -7.499 -5.487 -25.335 1.00 0.00 H -ATOM 504 CZ ARG 32 -8.260 -7.090 -26.105 1.00 0.00 C -ATOM 505 NH1 ARG 32 -9.237 -7.790 -26.666 1.00 0.00 N -ATOM 506 HH11 ARG 32 -10.186 -7.448 -26.626 1.00 0.00 H -ATOM 507 HH12 ARG 32 -9.117 -8.726 -27.025 1.00 0.00 H -ATOM 508 NH2 ARG 32 -7.047 -7.590 -26.170 1.00 0.00 N -ATOM 509 HH21 ARG 32 -6.404 -7.144 -25.533 1.00 0.00 H -ATOM 510 HH22 ARG 32 -6.928 -8.535 -26.509 1.00 0.00 H -ATOM 511 C ARG 32 -9.496 -7.222 -20.376 1.00 0.00 C -ATOM 512 O ARG 32 -8.422 -7.833 -20.403 1.00 0.00 O -ATOM 513 N LYS 33 -9.785 -6.409 -19.323 1.00 0.00 N -ATOM 514 H LYS 33 -10.636 -5.870 -19.376 1.00 0.00 H -ATOM 515 CA LYS 33 -8.978 -6.084 -18.134 1.00 0.00 C -ATOM 516 HA LYS 33 -9.399 -5.281 -17.528 1.00 0.00 H -ATOM 517 CB LYS 33 -8.926 -7.317 -17.226 1.00 0.00 C -ATOM 518 HB2 LYS 33 -8.356 -8.108 -17.713 1.00 0.00 H -ATOM 519 HB3 LYS 33 -8.365 -6.944 -16.369 1.00 0.00 H -ATOM 520 CG LYS 33 -10.267 -7.897 -16.779 1.00 0.00 C -ATOM 521 HG2 LYS 33 -10.746 -7.143 -16.155 1.00 0.00 H -ATOM 522 HG3 LYS 33 -10.925 -7.996 -17.642 1.00 0.00 H -ATOM 523 CD LYS 33 -10.055 -9.243 -16.082 1.00 0.00 C -ATOM 524 HD2 LYS 33 -9.944 -9.952 -16.902 1.00 0.00 H -ATOM 525 HD3 LYS 33 -9.125 -9.352 -15.524 1.00 0.00 H -ATOM 526 CE LYS 33 -11.186 -9.521 -15.119 1.00 0.00 C -ATOM 527 HE2 LYS 33 -11.103 -8.824 -14.285 1.00 0.00 H -ATOM 528 HE3 LYS 33 -12.148 -9.409 -15.617 1.00 0.00 H -ATOM 529 NZ LYS 33 -10.994 -10.844 -14.509 1.00 0.00 N -ATOM 530 HZ1 LYS 33 -10.157 -10.804 -13.946 1.00 0.00 H -ATOM 531 HZ2 LYS 33 -11.736 -11.035 -13.851 1.00 0.00 H -ATOM 532 HZ3 LYS 33 -10.889 -11.599 -15.173 1.00 0.00 H -ATOM 533 C LYS 33 -7.605 -5.565 -18.584 1.00 0.00 C -ATOM 534 O LYS 33 -6.606 -6.000 -18.143 1.00 0.00 O -ATOM 535 N GLU 34 -7.614 -4.675 -19.489 1.00 0.00 N -ATOM 536 H GLU 34 -8.422 -4.141 -19.778 1.00 0.00 H -ATOM 537 CA GLU 34 -6.437 -4.391 -20.364 1.00 0.00 C -ATOM 538 HA GLU 34 -5.526 -4.803 -19.933 1.00 0.00 H -ATOM 539 CB GLU 34 -6.582 -5.080 -21.733 1.00 0.00 C -ATOM 540 HB2 GLU 34 -6.747 -6.119 -21.449 1.00 0.00 H -ATOM 541 HB3 GLU 34 -7.393 -4.670 -22.337 1.00 0.00 H -ATOM 542 CG GLU 34 -5.307 -5.003 -22.515 1.00 0.00 C -ATOM 543 HG2 GLU 34 -5.009 -3.954 -22.534 1.00 0.00 H -ATOM 544 HG3 GLU 34 -4.501 -5.531 -22.007 1.00 0.00 H -ATOM 545 CD GLU 34 -5.431 -5.518 -23.977 1.00 0.00 C -ATOM 546 OE1 GLU 34 -4.935 -6.630 -24.278 1.00 0.00 O -ATOM 547 OE2 GLU 34 -5.995 -4.754 -24.806 1.00 0.00 O -ATOM 548 C GLU 34 -6.284 -2.916 -20.446 1.00 0.00 C -ATOM 549 O GLU 34 -7.248 -2.129 -20.493 1.00 0.00 O -ATOM 550 N VAL 35 -5.077 -2.342 -20.449 1.00 0.00 N -ATOM 551 H VAL 35 -4.290 -2.961 -20.587 1.00 0.00 H -ATOM 552 CA VAL 35 -4.707 -0.943 -20.729 1.00 0.00 C -ATOM 553 HA VAL 35 -5.648 -0.472 -21.014 1.00 0.00 H -ATOM 554 CB VAL 35 -4.107 -0.276 -19.457 1.00 0.00 C -ATOM 555 HB VAL 35 -4.716 -0.597 -18.614 1.00 0.00 H -ATOM 556 CG1 VAL 35 -2.668 -0.658 -19.121 1.00 0.00 C -ATOM 557 HG11 VAL 35 -2.675 -0.822 -18.043 1.00 0.00 H -ATOM 558 HG12 VAL 35 -2.375 -1.619 -19.542 1.00 0.00 H -ATOM 559 HG13 VAL 35 -1.923 0.119 -19.297 1.00 0.00 H -ATOM 560 CG2 VAL 35 -4.165 1.267 -19.673 1.00 0.00 C -ATOM 561 HG21 VAL 35 -3.748 1.739 -18.783 1.00 0.00 H -ATOM 562 HG22 VAL 35 -3.667 1.621 -20.574 1.00 0.00 H -ATOM 563 HG23 VAL 35 -5.197 1.606 -19.765 1.00 0.00 H -ATOM 564 C VAL 35 -3.799 -0.942 -22.010 1.00 0.00 C -ATOM 565 O VAL 35 -2.765 -1.596 -22.173 1.00 0.00 O -ATOM 566 N SER 36 -4.165 -0.010 -22.940 1.00 0.00 N -ATOM 567 H SER 36 -4.999 0.508 -22.699 1.00 0.00 H -ATOM 568 CA SER 36 -3.417 0.377 -24.179 1.00 0.00 C -ATOM 569 HA SER 36 -2.554 -0.277 -24.306 1.00 0.00 H -ATOM 570 CB SER 36 -4.269 0.056 -25.375 1.00 0.00 C -ATOM 571 HB2 SER 36 -4.498 -1.008 -25.326 1.00 0.00 H -ATOM 572 HB3 SER 36 -5.124 0.730 -25.415 1.00 0.00 H -ATOM 573 OG SER 36 -3.534 0.199 -26.521 1.00 0.00 O -ATOM 574 HG SER 36 -2.840 -0.465 -26.506 1.00 0.00 H -ATOM 575 C SER 36 -2.907 1.814 -24.057 1.00 0.00 C -ATOM 576 O SER 36 -3.624 2.582 -23.405 1.00 0.00 O -ATOM 577 N VAL 37 -1.784 2.144 -24.704 1.00 0.00 N -ATOM 578 H VAL 37 -1.303 1.444 -25.251 1.00 0.00 H -ATOM 579 CA VAL 37 -1.005 3.367 -24.443 1.00 0.00 C -ATOM 580 HA VAL 37 -1.730 4.114 -24.121 1.00 0.00 H -ATOM 581 CB VAL 37 0.139 3.069 -23.395 1.00 0.00 C -ATOM 582 HB VAL 37 0.991 2.719 -23.978 1.00 0.00 H -ATOM 583 CG1 VAL 37 0.570 4.445 -22.814 1.00 0.00 C -ATOM 584 HG11 VAL 37 -0.323 4.702 -22.244 1.00 0.00 H -ATOM 585 HG12 VAL 37 1.428 4.385 -22.143 1.00 0.00 H -ATOM 586 HG13 VAL 37 0.774 5.235 -23.537 1.00 0.00 H -ATOM 587 CG2 VAL 37 -0.256 2.143 -22.226 1.00 0.00 C -ATOM 588 HG21 VAL 37 -1.192 2.371 -21.715 1.00 0.00 H -ATOM 589 HG22 VAL 37 -0.242 1.134 -22.637 1.00 0.00 H -ATOM 590 HG23 VAL 37 0.554 2.078 -21.501 1.00 0.00 H -ATOM 591 C VAL 37 -0.406 3.960 -25.709 1.00 0.00 C -ATOM 592 O VAL 37 0.128 3.180 -26.506 1.00 0.00 O -ATOM 593 N ARG 38 -0.727 5.191 -26.083 1.00 0.00 N -ATOM 594 H ARG 38 -1.207 5.779 -25.416 1.00 0.00 H -ATOM 595 CA ARG 38 -0.022 5.804 -27.221 1.00 0.00 C -ATOM 596 HA ARG 38 -0.005 5.110 -28.061 1.00 0.00 H -ATOM 597 CB ARG 38 -0.725 7.133 -27.469 1.00 0.00 C -ATOM 598 HB2 ARG 38 -0.897 7.631 -26.514 1.00 0.00 H -ATOM 599 HB3 ARG 38 -0.040 7.783 -28.013 1.00 0.00 H -ATOM 600 CG ARG 38 -2.052 6.958 -28.227 1.00 0.00 C -ATOM 601 HG2 ARG 38 -1.915 6.421 -29.165 1.00 0.00 H -ATOM 602 HG3 ARG 38 -2.739 6.281 -27.719 1.00 0.00 H -ATOM 603 CD ARG 38 -2.835 8.252 -28.404 1.00 0.00 C -ATOM 604 HD2 ARG 38 -3.721 8.007 -28.989 1.00 0.00 H -ATOM 605 HD3 ARG 38 -3.203 8.663 -27.463 1.00 0.00 H -ATOM 606 NE ARG 38 -2.027 9.231 -29.273 1.00 0.00 N -ATOM 607 HE ARG 38 -1.085 8.976 -29.536 1.00 0.00 H -ATOM 608 CZ ARG 38 -2.415 10.444 -29.549 1.00 0.00 C -ATOM 609 NH1 ARG 38 -3.416 11.032 -28.975 1.00 0.00 N -ATOM 610 HH11 ARG 38 -4.074 10.470 -28.454 1.00 0.00 H -ATOM 611 HH12 ARG 38 -3.743 11.941 -29.269 1.00 0.00 H -ATOM 612 NH2 ARG 38 -1.743 11.145 -30.405 1.00 0.00 N -ATOM 613 HH21 ARG 38 -1.117 10.718 -31.073 1.00 0.00 H -ATOM 614 HH22 ARG 38 -1.983 12.123 -30.482 1.00 0.00 H -ATOM 615 C ARG 38 1.430 6.048 -26.924 1.00 0.00 C -ATOM 616 O ARG 38 1.796 6.767 -26.015 1.00 0.00 O -ATOM 617 N THR 39 2.347 5.545 -27.748 1.00 0.00 N -ATOM 618 H THR 39 2.073 4.973 -28.533 1.00 0.00 H -ATOM 619 CA THR 39 3.817 5.712 -27.600 1.00 0.00 C -ATOM 620 HA THR 39 4.003 6.541 -26.917 1.00 0.00 H -ATOM 621 CB THR 39 4.333 4.448 -26.911 1.00 0.00 C -ATOM 622 HB THR 39 5.419 4.364 -26.892 1.00 0.00 H -ATOM 623 CG2 THR 39 4.000 4.181 -25.449 1.00 0.00 C -ATOM 624 HG21 THR 39 4.418 3.198 -25.230 1.00 0.00 H -ATOM 625 HG22 THR 39 4.308 4.975 -24.768 1.00 0.00 H -ATOM 626 HG23 THR 39 2.922 4.088 -25.320 1.00 0.00 H -ATOM 627 OG1 THR 39 3.759 3.335 -27.577 1.00 0.00 O -ATOM 628 HG1 THR 39 4.060 3.276 -28.486 1.00 0.00 H -ATOM 629 C THR 39 4.593 6.075 -28.895 1.00 0.00 C -ATOM 630 O THR 39 5.781 6.369 -28.810 1.00 0.00 O -ATOM 631 N GLY 40 3.915 6.062 -30.043 1.00 0.00 N -ATOM 632 H GLY 40 2.917 5.915 -29.976 1.00 0.00 H -ATOM 633 CA GLY 40 4.542 6.378 -31.399 1.00 0.00 C -ATOM 634 HA2 GLY 40 5.414 7.024 -31.291 1.00 0.00 H -ATOM 635 HA3 GLY 40 4.988 5.483 -31.831 1.00 0.00 H -ATOM 636 C GLY 40 3.546 7.091 -32.301 1.00 0.00 C -ATOM 637 O GLY 40 2.363 7.211 -31.867 1.00 0.00 O -ATOM 638 N GLY 41 3.954 7.544 -33.487 1.00 0.00 N -ATOM 639 H GLY 41 4.925 7.521 -33.762 1.00 0.00 H -ATOM 640 CA GLY 41 3.015 8.151 -34.490 1.00 0.00 C -ATOM 641 HA2 GLY 41 2.482 8.950 -33.973 1.00 0.00 H -ATOM 642 HA3 GLY 41 3.691 8.609 -35.211 1.00 0.00 H -ATOM 643 C GLY 41 1.970 7.207 -35.023 1.00 0.00 C -ATOM 644 O GLY 41 2.290 5.992 -35.121 1.00 0.00 O -ATOM 645 N LEU 42 0.701 7.589 -35.263 1.00 0.00 N -ATOM 646 H LEU 42 0.575 8.590 -35.308 1.00 0.00 H -ATOM 647 CA LEU 42 -0.496 6.730 -35.444 1.00 0.00 C -ATOM 648 HA LEU 42 -0.197 5.822 -34.921 1.00 0.00 H -ATOM 649 CB LEU 42 -1.620 7.513 -34.737 1.00 0.00 C -ATOM 650 HB2 LEU 42 -1.864 8.481 -35.174 1.00 0.00 H -ATOM 651 HB3 LEU 42 -2.490 6.864 -34.823 1.00 0.00 H -ATOM 652 CG LEU 42 -1.469 7.783 -33.251 1.00 0.00 C -ATOM 653 HG LEU 42 -0.581 8.394 -33.091 1.00 0.00 H -ATOM 654 CD1 LEU 42 -2.825 8.438 -32.875 1.00 0.00 C -ATOM 655 HD11 LEU 42 -2.849 9.441 -33.302 1.00 0.00 H -ATOM 656 HD12 LEU 42 -3.642 7.805 -33.219 1.00 0.00 H -ATOM 657 HD13 LEU 42 -2.810 8.495 -31.786 1.00 0.00 H -ATOM 658 CD2 LEU 42 -1.310 6.498 -32.443 1.00 0.00 C -ATOM 659 HD21 LEU 42 -1.327 6.756 -31.385 1.00 0.00 H -ATOM 660 HD22 LEU 42 -2.156 5.819 -32.552 1.00 0.00 H -ATOM 661 HD23 LEU 42 -0.359 6.055 -32.743 1.00 0.00 H -ATOM 662 C LEU 42 -0.860 6.285 -36.840 1.00 0.00 C -ATOM 663 O LEU 42 -2.010 6.039 -37.111 1.00 0.00 O -ATOM 664 N ALA 43 0.112 6.214 -37.796 1.00 0.00 N -ATOM 665 H ALA 43 1.061 6.450 -37.544 1.00 0.00 H -ATOM 666 CA ALA 43 -0.020 5.408 -38.974 1.00 0.00 C -ATOM 667 HA ALA 43 -0.880 5.746 -39.552 1.00 0.00 H -ATOM 668 CB ALA 43 1.185 5.699 -39.865 1.00 0.00 C -ATOM 669 HB1 ALA 43 1.103 5.146 -40.801 1.00 0.00 H -ATOM 670 HB2 ALA 43 1.086 6.732 -40.199 1.00 0.00 H -ATOM 671 HB3 ALA 43 2.146 5.511 -39.386 1.00 0.00 H -ATOM 672 C ALA 43 -0.242 3.888 -38.760 1.00 0.00 C -ATOM 673 O ALA 43 -1.049 3.290 -39.515 1.00 0.00 O -ATOM 674 N ASP 44 0.304 3.281 -37.678 1.00 0.00 N -ATOM 675 H ASP 44 1.034 3.799 -37.211 1.00 0.00 H -ATOM 676 CA ASP 44 0.088 1.876 -37.381 1.00 0.00 C -ATOM 677 HA ASP 44 -0.726 1.522 -38.014 1.00 0.00 H -ATOM 678 CB ASP 44 1.454 1.165 -37.679 1.00 0.00 C -ATOM 679 HB2 ASP 44 1.820 1.426 -38.671 1.00 0.00 H -ATOM 680 HB3 ASP 44 2.079 1.471 -36.840 1.00 0.00 H -ATOM 681 CG ASP 44 1.162 -0.390 -37.712 1.00 0.00 C -ATOM 682 OD1 ASP 44 1.279 -0.964 -38.860 1.00 0.00 O -ATOM 683 OD2 ASP 44 0.702 -0.962 -36.742 1.00 0.00 O -ATOM 684 C ASP 44 -0.372 1.730 -35.861 1.00 0.00 C -ATOM 685 O ASP 44 0.106 2.421 -35.028 1.00 0.00 O -ATOM 686 N LYS 45 -1.257 0.731 -35.600 1.00 0.00 N -ATOM 687 H LYS 45 -1.504 0.236 -36.445 1.00 0.00 H -ATOM 688 CA LYS 45 -1.687 0.329 -34.282 1.00 0.00 C -ATOM 689 HA LYS 45 -2.037 1.204 -33.734 1.00 0.00 H -ATOM 690 CB LYS 45 -2.917 -0.608 -34.265 1.00 0.00 C -ATOM 691 HB2 LYS 45 -3.382 -0.408 -33.299 1.00 0.00 H -ATOM 692 HB3 LYS 45 -3.653 -0.338 -35.021 1.00 0.00 H -ATOM 693 CG LYS 45 -2.546 -2.065 -34.598 1.00 0.00 C -ATOM 694 HG2 LYS 45 -1.994 -2.063 -35.539 1.00 0.00 H -ATOM 695 HG3 LYS 45 -2.080 -2.498 -33.713 1.00 0.00 H -ATOM 696 CD LYS 45 -3.735 -2.959 -34.917 1.00 0.00 C -ATOM 697 HD2 LYS 45 -4.284 -2.909 -33.978 1.00 0.00 H -ATOM 698 HD3 LYS 45 -4.179 -2.735 -35.888 1.00 0.00 H -ATOM 699 CE LYS 45 -3.044 -4.374 -34.932 1.00 0.00 C -ATOM 700 HE2 LYS 45 -2.211 -4.404 -35.635 1.00 0.00 H -ATOM 701 HE3 LYS 45 -2.643 -4.585 -33.940 1.00 0.00 H -ATOM 702 NZ LYS 45 -3.966 -5.430 -35.325 1.00 0.00 N -ATOM 703 HZ1 LYS 45 -3.540 -6.337 -35.453 1.00 0.00 H -ATOM 704 HZ2 LYS 45 -4.661 -5.649 -34.626 1.00 0.00 H -ATOM 705 HZ3 LYS 45 -4.502 -5.215 -36.154 1.00 0.00 H -ATOM 706 C LYS 45 -0.523 -0.201 -33.360 1.00 0.00 C -ATOM 707 O LYS 45 -0.595 -0.054 -32.182 1.00 0.00 O -ATOM 708 N SER 46 0.471 -0.735 -34.045 1.00 0.00 N -ATOM 709 H SER 46 0.342 -0.919 -35.029 1.00 0.00 H -ATOM 710 CA SER 46 1.757 -1.254 -33.417 1.00 0.00 C -ATOM 711 HA SER 46 1.480 -1.940 -32.616 1.00 0.00 H -ATOM 712 CB SER 46 2.438 -2.141 -34.482 1.00 0.00 C -ATOM 713 HB2 SER 46 3.102 -2.872 -34.021 1.00 0.00 H -ATOM 714 HB3 SER 46 1.681 -2.671 -35.060 1.00 0.00 H -ATOM 715 OG SER 46 3.213 -1.398 -35.321 1.00 0.00 O -ATOM 716 HG SER 46 2.625 -0.970 -35.949 1.00 0.00 H -ATOM 717 C SER 46 2.700 -0.173 -32.808 1.00 0.00 C -ATOM 718 O SER 46 3.675 -0.553 -32.126 1.00 0.00 O -ATOM 719 N SER 47 2.435 1.104 -33.105 1.00 0.00 N -ATOM 720 H SER 47 1.528 1.230 -33.531 1.00 0.00 H -ATOM 721 CA SER 47 3.126 2.288 -32.574 1.00 0.00 C -ATOM 722 HA SER 47 4.184 2.319 -32.834 1.00 0.00 H -ATOM 723 CB SER 47 2.546 3.498 -33.203 1.00 0.00 C -ATOM 724 HB2 SER 47 2.959 4.455 -32.885 1.00 0.00 H -ATOM 725 HB3 SER 47 2.637 3.431 -34.287 1.00 0.00 H -ATOM 726 OG SER 47 1.153 3.692 -32.906 1.00 0.00 O -ATOM 727 HG SER 47 0.692 3.310 -33.657 1.00 0.00 H -ATOM 728 C SER 47 2.940 2.387 -31.027 1.00 0.00 C -ATOM 729 O SER 47 3.620 3.089 -30.315 1.00 0.00 O -ATOM 730 N ARG 48 1.868 1.778 -30.516 1.00 0.00 N -ATOM 731 H ARG 48 1.348 1.175 -31.137 1.00 0.00 H -ATOM 732 CA ARG 48 1.303 1.768 -29.171 1.00 0.00 C -ATOM 733 HA ARG 48 1.410 2.754 -28.717 1.00 0.00 H -ATOM 734 CB ARG 48 -0.235 1.466 -29.305 1.00 0.00 C -ATOM 735 HB2 ARG 48 -0.241 0.524 -29.853 1.00 0.00 H -ATOM 736 HB3 ARG 48 -0.672 1.254 -28.329 1.00 0.00 H -ATOM 737 CG ARG 48 -1.059 2.530 -30.052 1.00 0.00 C -ATOM 738 HG2 ARG 48 -1.021 3.389 -29.382 1.00 0.00 H -ATOM 739 HG3 ARG 48 -0.552 2.714 -30.999 1.00 0.00 H -ATOM 740 CD ARG 48 -2.533 2.247 -30.288 1.00 0.00 C -ATOM 741 HD2 ARG 48 -2.615 1.189 -30.535 1.00 0.00 H -ATOM 742 HD3 ARG 48 -2.962 2.354 -29.292 1.00 0.00 H -ATOM 743 NE ARG 48 -3.185 3.208 -31.228 1.00 0.00 N -ATOM 744 HE ARG 48 -3.073 3.066 -32.222 1.00 0.00 H -ATOM 745 CZ ARG 48 -4.044 4.190 -30.977 1.00 0.00 C -ATOM 746 NH1 ARG 48 -4.384 4.481 -29.752 1.00 0.00 N -ATOM 747 HH11 ARG 48 -3.952 3.904 -29.046 1.00 0.00 H -ATOM 748 HH12 ARG 48 -5.130 5.117 -29.505 1.00 0.00 H -ATOM 749 NH2 ARG 48 -4.678 4.820 -31.950 1.00 0.00 N -ATOM 750 HH21 ARG 48 -4.664 4.380 -32.859 1.00 0.00 H -ATOM 751 HH22 ARG 48 -5.329 5.578 -31.804 1.00 0.00 H -ATOM 752 C ARG 48 1.907 0.605 -28.216 1.00 0.00 C -ATOM 753 O ARG 48 2.102 -0.496 -28.728 1.00 0.00 O -ATOM 754 N LYS 49 2.198 0.830 -26.944 1.00 0.00 N -ATOM 755 H LYS 49 1.706 1.611 -26.532 1.00 0.00 H -ATOM 756 CA LYS 49 2.288 -0.249 -25.991 1.00 0.00 C -ATOM 757 HA LYS 49 2.593 -1.152 -26.519 1.00 0.00 H -ATOM 758 CB LYS 49 3.270 0.186 -24.813 1.00 0.00 C -ATOM 759 HB2 LYS 49 2.843 1.067 -24.333 1.00 0.00 H -ATOM 760 HB3 LYS 49 3.106 -0.622 -24.101 1.00 0.00 H -ATOM 761 CG LYS 49 4.789 0.358 -24.946 1.00 0.00 C -ATOM 762 HG2 LYS 49 4.995 1.116 -25.701 1.00 0.00 H -ATOM 763 HG3 LYS 49 5.165 0.816 -24.031 1.00 0.00 H -ATOM 764 CD LYS 49 5.614 -0.949 -25.326 1.00 0.00 C -ATOM 765 HD2 LYS 49 5.103 -1.452 -26.148 1.00 0.00 H -ATOM 766 HD3 LYS 49 6.520 -0.557 -25.786 1.00 0.00 H -ATOM 767 CE LYS 49 5.900 -1.866 -24.109 1.00 0.00 C -ATOM 768 HE2 LYS 49 6.463 -1.251 -23.405 1.00 0.00 H -ATOM 769 HE3 LYS 49 4.991 -2.217 -23.621 1.00 0.00 H -ATOM 770 NZ LYS 49 6.694 -3.072 -24.510 1.00 0.00 N -ATOM 771 HZ1 LYS 49 6.236 -3.788 -25.054 1.00 0.00 H -ATOM 772 HZ2 LYS 49 7.477 -2.776 -25.075 1.00 0.00 H -ATOM 773 HZ3 LYS 49 6.977 -3.566 -23.676 1.00 0.00 H -ATOM 774 C LYS 49 0.934 -0.643 -25.387 1.00 0.00 C -ATOM 775 O LYS 49 0.029 0.203 -25.285 1.00 0.00 O -ATOM 776 N THR 50 0.788 -1.932 -25.024 1.00 0.00 N -ATOM 777 H THR 50 1.603 -2.511 -25.175 1.00 0.00 H -ATOM 778 CA THR 50 -0.330 -2.579 -24.365 1.00 0.00 C -ATOM 779 HA THR 50 -0.883 -1.750 -23.925 1.00 0.00 H -ATOM 780 CB THR 50 -1.386 -3.251 -25.352 1.00 0.00 C -ATOM 781 HB THR 50 -0.946 -4.100 -25.875 1.00 0.00 H -ATOM 782 CG2 THR 50 -2.727 -3.654 -24.794 1.00 0.00 C -ATOM 783 HG21 THR 50 -2.665 -4.601 -24.257 1.00 0.00 H -ATOM 784 HG22 THR 50 -3.156 -2.900 -24.135 1.00 0.00 H -ATOM 785 HG23 THR 50 -3.518 -3.768 -25.535 1.00 0.00 H -ATOM 786 OG1 THR 50 -1.557 -2.240 -26.337 1.00 0.00 O -ATOM 787 HG1 THR 50 -0.966 -2.459 -27.062 1.00 0.00 H -ATOM 788 C THR 50 0.054 -3.690 -23.338 1.00 0.00 C -ATOM 789 O THR 50 1.153 -4.238 -23.462 1.00 0.00 O -ATOM 790 N TYR 51 -0.851 -3.864 -22.356 1.00 0.00 N -ATOM 791 H TYR 51 -1.517 -3.113 -22.239 1.00 0.00 H -ATOM 792 CA TYR 51 -0.667 -4.652 -21.203 1.00 0.00 C -ATOM 793 HA TYR 51 -0.186 -5.575 -21.527 1.00 0.00 H -ATOM 794 CB TYR 51 0.139 -3.925 -20.152 1.00 0.00 C -ATOM 795 HB2 TYR 51 -0.550 -3.252 -19.643 1.00 0.00 H -ATOM 796 HB3 TYR 51 0.440 -4.546 -19.308 1.00 0.00 H -ATOM 797 CG TYR 51 1.322 -3.204 -20.535 1.00 0.00 C -ATOM 798 CD1 TYR 51 2.552 -3.794 -20.568 1.00 0.00 C -ATOM 799 HD1 TYR 51 2.705 -4.821 -20.272 1.00 0.00 H -ATOM 800 CE1 TYR 51 3.721 -3.009 -20.864 1.00 0.00 C -ATOM 801 HE1 TYR 51 4.662 -3.526 -20.757 1.00 0.00 H -ATOM 802 CZ TYR 51 3.675 -1.654 -21.178 1.00 0.00 C -ATOM 803 OH TYR 51 4.748 -0.947 -21.569 1.00 0.00 O -ATOM 804 HH TYR 51 5.501 -1.520 -21.407 1.00 0.00 H -ATOM 805 CE2 TYR 51 2.356 -1.123 -21.353 1.00 0.00 C -ATOM 806 HE2 TYR 51 2.152 -0.119 -21.694 1.00 0.00 H -ATOM 807 CD2 TYR 51 1.230 -1.859 -20.973 1.00 0.00 C -ATOM 808 HD2 TYR 51 0.285 -1.336 -20.997 1.00 0.00 H -ATOM 809 C TYR 51 -2.027 -5.182 -20.592 1.00 0.00 C -ATOM 810 O TYR 51 -2.964 -4.464 -20.368 1.00 0.00 O -ATOM 811 N THR 52 -2.129 -6.441 -20.278 1.00 0.00 N -ATOM 812 H THR 52 -1.255 -6.945 -20.225 1.00 0.00 H -ATOM 813 CA THR 52 -3.231 -6.971 -19.460 1.00 0.00 C -ATOM 814 HA THR 52 -4.099 -6.332 -19.625 1.00 0.00 H -ATOM 815 CB THR 52 -3.764 -8.308 -20.054 1.00 0.00 C -ATOM 816 HB THR 52 -2.919 -8.972 -20.237 1.00 0.00 H -ATOM 817 CG2 THR 52 -4.756 -9.130 -19.185 1.00 0.00 C -ATOM 818 HG21 THR 52 -5.173 -9.925 -19.804 1.00 0.00 H -ATOM 819 HG22 THR 52 -4.264 -9.573 -18.320 1.00 0.00 H -ATOM 820 HG23 THR 52 -5.635 -8.530 -18.951 1.00 0.00 H -ATOM 821 OG1 THR 52 -4.449 -8.147 -21.354 1.00 0.00 O -ATOM 822 HG1 THR 52 -3.725 -7.933 -21.945 1.00 0.00 H -ATOM 823 C THR 52 -2.842 -7.064 -17.994 1.00 0.00 C -ATOM 824 O THR 52 -1.722 -7.372 -17.591 1.00 0.00 O -ATOM 825 N PHE 53 -3.808 -6.883 -17.156 1.00 0.00 N -ATOM 826 H PHE 53 -4.741 -6.645 -17.462 1.00 0.00 H -ATOM 827 CA PHE 53 -3.702 -6.971 -15.683 1.00 0.00 C -ATOM 828 HA PHE 53 -2.866 -7.585 -15.347 1.00 0.00 H -ATOM 829 CB PHE 53 -3.478 -5.576 -15.162 1.00 0.00 C -ATOM 830 HB2 PHE 53 -4.106 -4.889 -15.730 1.00 0.00 H -ATOM 831 HB3 PHE 53 -3.772 -5.595 -14.114 1.00 0.00 H -ATOM 832 CG PHE 53 -2.110 -4.978 -15.394 1.00 0.00 C -ATOM 833 CD1 PHE 53 -0.986 -5.391 -14.659 1.00 0.00 C -ATOM 834 HD1 PHE 53 -1.130 -6.011 -13.788 1.00 0.00 H -ATOM 835 CE1 PHE 53 0.309 -4.981 -15.002 1.00 0.00 C -ATOM 836 HE1 PHE 53 1.154 -5.454 -14.527 1.00 0.00 H -ATOM 837 CZ PHE 53 0.482 -4.007 -15.959 1.00 0.00 C -ATOM 838 HZ PHE 53 1.486 -3.636 -16.107 1.00 0.00 H -ATOM 839 CE2 PHE 53 -0.670 -3.413 -16.511 1.00 0.00 C -ATOM 840 HE2 PHE 53 -0.455 -2.663 -17.258 1.00 0.00 H -ATOM 841 CD2 PHE 53 -1.939 -3.977 -16.349 1.00 0.00 C -ATOM 842 HD2 PHE 53 -2.797 -3.529 -16.828 1.00 0.00 H -ATOM 843 C PHE 53 -4.962 -7.605 -15.081 1.00 0.00 C -ATOM 844 O PHE 53 -5.956 -7.845 -15.762 1.00 0.00 O -ATOM 845 N ASP 54 -4.942 -7.797 -13.749 1.00 0.00 N -ATOM 846 H ASP 54 -4.142 -7.483 -13.220 1.00 0.00 H -ATOM 847 CA ASP 54 -6.056 -8.316 -12.958 1.00 0.00 C -ATOM 848 HA ASP 54 -6.304 -9.314 -13.318 1.00 0.00 H -ATOM 849 CB ASP 54 -5.581 -8.491 -11.534 1.00 0.00 C -ATOM 850 HB2 ASP 54 -5.206 -7.535 -11.169 1.00 0.00 H -ATOM 851 HB3 ASP 54 -6.336 -8.850 -10.835 1.00 0.00 H -ATOM 852 CG ASP 54 -4.444 -9.572 -11.534 1.00 0.00 C -ATOM 853 OD1 ASP 54 -3.347 -9.348 -11.042 1.00 0.00 O -ATOM 854 OD2 ASP 54 -4.780 -10.686 -12.093 1.00 0.00 O -ATOM 855 C ASP 54 -7.356 -7.502 -13.001 1.00 0.00 C -ATOM 856 O ASP 54 -8.433 -7.997 -13.174 1.00 0.00 O -ATOM 857 N MET 55 -7.225 -6.170 -12.942 1.00 0.00 N -ATOM 858 H MET 55 -6.292 -5.795 -12.850 1.00 0.00 H -ATOM 859 CA MET 55 -8.289 -5.135 -13.059 1.00 0.00 C -ATOM 860 HA MET 55 -8.987 -5.356 -13.867 1.00 0.00 H -ATOM 861 CB MET 55 -9.056 -4.865 -11.785 1.00 0.00 C -ATOM 862 HB2 MET 55 -8.327 -4.685 -10.994 1.00 0.00 H -ATOM 863 HB3 MET 55 -9.563 -3.935 -12.040 1.00 0.00 H -ATOM 864 CG MET 55 -10.051 -5.931 -11.309 1.00 0.00 C -ATOM 865 HG2 MET 55 -10.970 -6.044 -11.883 1.00 0.00 H -ATOM 866 HG3 MET 55 -9.499 -6.833 -11.575 1.00 0.00 H -ATOM 867 SD MET 55 -10.548 -5.906 -9.623 1.00 0.00 S -ATOM 868 CE MET 55 -9.662 -7.369 -9.071 1.00 0.00 C -ATOM 869 HE1 MET 55 -8.607 -7.153 -9.240 1.00 0.00 H -ATOM 870 HE2 MET 55 -9.780 -7.688 -8.035 1.00 0.00 H -ATOM 871 HE3 MET 55 -10.049 -8.124 -9.753 1.00 0.00 H -ATOM 872 C MET 55 -7.559 -3.851 -13.544 1.00 0.00 C -ATOM 873 O MET 55 -6.372 -3.645 -13.338 1.00 0.00 O -ATOM 874 N VAL 56 -8.291 -2.993 -14.299 1.00 0.00 N -ATOM 875 H VAL 56 -9.189 -3.262 -14.674 1.00 0.00 H -ATOM 876 CA VAL 56 -7.871 -1.722 -14.689 1.00 0.00 C -ATOM 877 HA VAL 56 -6.943 -1.419 -14.205 1.00 0.00 H -ATOM 878 CB VAL 56 -7.577 -1.697 -16.180 1.00 0.00 C -ATOM 879 HB VAL 56 -7.301 -0.676 -16.445 1.00 0.00 H -ATOM 880 CG1 VAL 56 -6.400 -2.666 -16.571 1.00 0.00 C -ATOM 881 HG11 VAL 56 -6.736 -3.697 -16.460 1.00 0.00 H -ATOM 882 HG12 VAL 56 -6.271 -2.519 -17.644 1.00 0.00 H -ATOM 883 HG13 VAL 56 -5.564 -2.330 -15.958 1.00 0.00 H -ATOM 884 CG2 VAL 56 -8.794 -1.962 -17.029 1.00 0.00 C -ATOM 885 HG21 VAL 56 -9.639 -1.409 -16.617 1.00 0.00 H -ATOM 886 HG22 VAL 56 -8.553 -1.896 -18.090 1.00 0.00 H -ATOM 887 HG23 VAL 56 -9.066 -3.003 -16.852 1.00 0.00 H -ATOM 888 C VAL 56 -8.952 -0.731 -14.236 1.00 0.00 C -ATOM 889 O VAL 56 -10.141 -1.077 -14.331 1.00 0.00 O -ATOM 890 N PHE 57 -8.655 0.496 -13.865 1.00 0.00 N -ATOM 891 H PHE 57 -7.669 0.713 -13.862 1.00 0.00 H -ATOM 892 CA PHE 57 -9.605 1.579 -13.533 1.00 0.00 C -ATOM 893 HA PHE 57 -10.600 1.304 -13.882 1.00 0.00 H -ATOM 894 CB PHE 57 -9.773 1.800 -12.060 1.00 0.00 C -ATOM 895 HB2 PHE 57 -8.758 2.034 -11.737 1.00 0.00 H -ATOM 896 HB3 PHE 57 -10.411 2.646 -11.806 1.00 0.00 H -ATOM 897 CG PHE 57 -10.112 0.440 -11.421 1.00 0.00 C -ATOM 898 CD1 PHE 57 -11.442 -0.008 -11.322 1.00 0.00 C -ATOM 899 HD1 PHE 57 -12.226 0.644 -11.678 1.00 0.00 H -ATOM 900 CE1 PHE 57 -11.738 -1.299 -10.901 1.00 0.00 C -ATOM 901 HE1 PHE 57 -12.772 -1.607 -10.966 1.00 0.00 H -ATOM 902 CZ PHE 57 -10.722 -2.131 -10.388 1.00 0.00 C -ATOM 903 HZ PHE 57 -10.970 -3.150 -10.128 1.00 0.00 H -ATOM 904 CE2 PHE 57 -9.376 -1.789 -10.583 1.00 0.00 C -ATOM 905 HE2 PHE 57 -8.604 -2.513 -10.372 1.00 0.00 H -ATOM 906 CD2 PHE 57 -9.107 -0.439 -10.998 1.00 0.00 C -ATOM 907 HD2 PHE 57 -8.067 -0.158 -11.086 1.00 0.00 H -ATOM 908 C PHE 57 -9.279 2.850 -14.242 1.00 0.00 C -ATOM 909 O PHE 57 -8.290 3.534 -13.938 1.00 0.00 O -ATOM 910 N GLY 58 -10.164 3.232 -15.160 1.00 0.00 N -ATOM 911 H GLY 58 -10.916 2.564 -15.260 1.00 0.00 H -ATOM 912 CA GLY 58 -10.349 4.505 -15.768 1.00 0.00 C -ATOM 913 HA2 GLY 58 -9.398 4.757 -16.236 1.00 0.00 H -ATOM 914 HA3 GLY 58 -11.111 4.388 -16.538 1.00 0.00 H -ATOM 915 C GLY 58 -10.760 5.646 -14.829 1.00 0.00 C -ATOM 916 O GLY 58 -11.481 5.476 -13.939 1.00 0.00 O -ATOM 917 N ALA 59 -10.370 6.894 -15.179 1.00 0.00 N -ATOM 918 H ALA 59 -10.039 7.063 -16.118 1.00 0.00 H -ATOM 919 CA ALA 59 -10.424 7.987 -14.238 1.00 0.00 C -ATOM 920 HA ALA 59 -9.893 7.646 -13.350 1.00 0.00 H -ATOM 921 CB ALA 59 -9.630 9.180 -14.788 1.00 0.00 C -ATOM 922 HB1 ALA 59 -10.101 9.634 -15.660 1.00 0.00 H -ATOM 923 HB2 ALA 59 -9.679 9.913 -13.983 1.00 0.00 H -ATOM 924 HB3 ALA 59 -8.600 8.852 -14.933 1.00 0.00 H -ATOM 925 C ALA 59 -11.879 8.385 -13.808 1.00 0.00 C -ATOM 926 O ALA 59 -11.996 9.070 -12.859 1.00 0.00 O -ATOM 927 N SER 60 -12.978 8.015 -14.439 1.00 0.00 N -ATOM 928 H SER 60 -12.823 7.373 -15.205 1.00 0.00 H -ATOM 929 CA SER 60 -14.370 8.346 -14.052 1.00 0.00 C -ATOM 930 HA SER 60 -14.577 9.399 -13.861 1.00 0.00 H -ATOM 931 CB SER 60 -15.286 8.079 -15.278 1.00 0.00 C -ATOM 932 HB2 SER 60 -16.323 8.330 -15.055 1.00 0.00 H -ATOM 933 HB3 SER 60 -15.027 8.662 -16.162 1.00 0.00 H -ATOM 934 OG SER 60 -15.201 6.739 -15.803 1.00 0.00 O -ATOM 935 HG SER 60 -14.438 6.678 -16.382 1.00 0.00 H -ATOM 936 C SER 60 -14.808 7.549 -12.828 1.00 0.00 C -ATOM 937 O SER 60 -15.954 7.680 -12.381 1.00 0.00 O -ATOM 938 N THR 61 -14.028 6.559 -12.334 1.00 0.00 N -ATOM 939 H THR 61 -13.129 6.606 -12.792 1.00 0.00 H -ATOM 940 CA THR 61 -14.271 5.642 -11.178 1.00 0.00 C -ATOM 941 HA THR 61 -15.232 5.129 -11.224 1.00 0.00 H -ATOM 942 CB THR 61 -13.195 4.546 -11.168 1.00 0.00 C -ATOM 943 HB THR 61 -12.168 4.883 -11.027 1.00 0.00 H -ATOM 944 CG2 THR 61 -13.489 3.367 -10.172 1.00 0.00 C -ATOM 945 HG21 THR 61 -14.389 2.921 -10.596 1.00 0.00 H -ATOM 946 HG22 THR 61 -12.693 2.623 -10.115 1.00 0.00 H -ATOM 947 HG23 THR 61 -13.683 3.808 -9.194 1.00 0.00 H -ATOM 948 OG1 THR 61 -13.259 3.996 -12.508 1.00 0.00 O -ATOM 949 HG1 THR 61 -12.732 4.599 -13.038 1.00 0.00 H -ATOM 950 C THR 61 -14.198 6.403 -9.829 1.00 0.00 C -ATOM 951 O THR 61 -13.277 7.142 -9.492 1.00 0.00 O -ATOM 952 N LYS 62 -15.292 6.314 -8.985 1.00 0.00 N -ATOM 953 H LYS 62 -16.089 5.904 -9.453 1.00 0.00 H -ATOM 954 CA LYS 62 -15.351 6.653 -7.508 1.00 0.00 C -ATOM 955 HA LYS 62 -15.011 7.660 -7.268 1.00 0.00 H -ATOM 956 CB LYS 62 -16.817 6.753 -7.030 1.00 0.00 C -ATOM 957 HB2 LYS 62 -16.867 7.019 -5.974 1.00 0.00 H -ATOM 958 HB3 LYS 62 -17.230 7.639 -7.510 1.00 0.00 H -ATOM 959 CG LYS 62 -17.667 5.549 -7.383 1.00 0.00 C -ATOM 960 HG2 LYS 62 -17.637 5.484 -8.472 1.00 0.00 H -ATOM 961 HG3 LYS 62 -17.213 4.677 -6.913 1.00 0.00 H -ATOM 962 CD LYS 62 -19.161 5.679 -7.071 1.00 0.00 C -ATOM 963 HD2 LYS 62 -19.285 6.080 -6.065 1.00 0.00 H -ATOM 964 HD3 LYS 62 -19.647 6.451 -7.668 1.00 0.00 H -ATOM 965 CE LYS 62 -20.049 4.416 -7.189 1.00 0.00 C -ATOM 966 HE2 LYS 62 -19.683 3.570 -6.609 1.00 0.00 H -ATOM 967 HE3 LYS 62 -20.982 4.727 -6.718 1.00 0.00 H -ATOM 968 NZ LYS 62 -20.256 4.059 -8.591 1.00 0.00 N -ATOM 969 HZ1 LYS 62 -20.463 4.903 -9.105 1.00 0.00 H -ATOM 970 HZ2 LYS 62 -19.412 3.547 -8.803 1.00 0.00 H -ATOM 971 HZ3 LYS 62 -20.984 3.361 -8.637 1.00 0.00 H -ATOM 972 C LYS 62 -14.501 5.681 -6.620 1.00 0.00 C -ATOM 973 O LYS 62 -14.360 4.538 -6.994 1.00 0.00 O -ATOM 974 N GLN 63 -14.060 6.063 -5.420 1.00 0.00 N -ATOM 975 H GLN 63 -14.325 6.987 -5.107 1.00 0.00 H -ATOM 976 CA GLN 63 -13.264 5.155 -4.581 1.00 0.00 C -ATOM 977 HA GLN 63 -12.449 4.780 -5.201 1.00 0.00 H -ATOM 978 CB GLN 63 -12.809 5.803 -3.269 1.00 0.00 C -ATOM 979 HB2 GLN 63 -13.717 6.004 -2.702 1.00 0.00 H -ATOM 980 HB3 GLN 63 -12.267 5.052 -2.695 1.00 0.00 H -ATOM 981 CG GLN 63 -11.944 7.078 -3.459 1.00 0.00 C -ATOM 982 HG2 GLN 63 -11.988 7.419 -4.494 1.00 0.00 H -ATOM 983 HG3 GLN 63 -12.488 7.810 -2.861 1.00 0.00 H -ATOM 984 CD GLN 63 -10.520 6.897 -2.899 1.00 0.00 C -ATOM 985 OE1 GLN 63 -9.666 6.100 -3.284 1.00 0.00 O -ATOM 986 NE2 GLN 63 -10.115 7.762 -1.971 1.00 0.00 N -ATOM 987 HE21 GLN 63 -9.191 7.691 -1.567 1.00 0.00 H -ATOM 988 HE22 GLN 63 -10.770 8.249 -1.376 1.00 0.00 H -ATOM 989 C GLN 63 -14.018 3.883 -4.137 1.00 0.00 C -ATOM 990 O GLN 63 -13.469 2.759 -4.016 1.00 0.00 O -ATOM 991 N ILE 64 -15.334 3.938 -3.951 1.00 0.00 N -ATOM 992 H ILE 64 -15.842 4.806 -4.032 1.00 0.00 H -ATOM 993 CA ILE 64 -16.123 2.696 -3.536 1.00 0.00 C -ATOM 994 HA ILE 64 -15.717 2.247 -2.630 1.00 0.00 H -ATOM 995 CB ILE 64 -17.562 3.068 -3.171 1.00 0.00 C -ATOM 996 HB ILE 64 -17.581 3.802 -2.365 1.00 0.00 H -ATOM 997 CG2 ILE 64 -18.338 3.675 -4.346 1.00 0.00 C -ATOM 998 HG21 ILE 64 -18.519 2.939 -5.129 1.00 0.00 H -ATOM 999 HG22 ILE 64 -19.313 4.069 -4.059 1.00 0.00 H -ATOM 1000 HG23 ILE 64 -17.695 4.504 -4.642 1.00 0.00 H -ATOM 1001 CG1 ILE 64 -18.308 1.808 -2.709 1.00 0.00 C -ATOM 1002 HG12 ILE 64 -19.338 2.082 -2.485 1.00 0.00 H -ATOM 1003 HG13 ILE 64 -18.488 1.123 -3.538 1.00 0.00 H -ATOM 1004 CD1 ILE 64 -17.836 0.907 -1.539 1.00 0.00 C -ATOM 1005 HD11 ILE 64 -18.421 -0.012 -1.510 1.00 0.00 H -ATOM 1006 HD12 ILE 64 -16.804 0.608 -1.729 1.00 0.00 H -ATOM 1007 HD13 ILE 64 -17.828 1.442 -0.590 1.00 0.00 H -ATOM 1008 C ILE 64 -16.077 1.586 -4.557 1.00 0.00 C -ATOM 1009 O ILE 64 -16.083 0.433 -4.159 1.00 0.00 O -ATOM 1010 N ASP 65 -15.910 1.904 -5.840 1.00 0.00 N -ATOM 1011 H ASP 65 -15.906 2.907 -5.962 1.00 0.00 H -ATOM 1012 CA ASP 65 -15.833 0.969 -6.986 1.00 0.00 C -ATOM 1013 HA ASP 65 -16.580 0.198 -6.796 1.00 0.00 H -ATOM 1014 CB ASP 65 -16.133 1.652 -8.290 1.00 0.00 C -ATOM 1015 HB2 ASP 65 -15.606 2.599 -8.402 1.00 0.00 H -ATOM 1016 HB3 ASP 65 -15.728 0.996 -9.060 1.00 0.00 H -ATOM 1017 CG ASP 65 -17.673 2.025 -8.558 1.00 0.00 C -ATOM 1018 OD1 ASP 65 -17.976 2.719 -9.529 1.00 0.00 O -ATOM 1019 OD2 ASP 65 -18.562 1.538 -7.841 1.00 0.00 O -ATOM 1020 C ASP 65 -14.478 0.287 -7.010 1.00 0.00 C -ATOM 1021 O ASP 65 -14.387 -0.861 -7.516 1.00 0.00 O -ATOM 1022 N VAL 66 -13.416 0.943 -6.517 1.00 0.00 N -ATOM 1023 H VAL 66 -13.587 1.876 -6.168 1.00 0.00 H -ATOM 1024 CA VAL 66 -12.067 0.352 -6.321 1.00 0.00 C -ATOM 1025 HA VAL 66 -11.909 -0.166 -7.266 1.00 0.00 H -ATOM 1026 CB VAL 66 -10.988 1.378 -5.966 1.00 0.00 C -ATOM 1027 HB VAL 66 -11.448 2.252 -5.505 1.00 0.00 H -ATOM 1028 CG1 VAL 66 -9.901 0.972 -5.011 1.00 0.00 C -ATOM 1029 HG11 VAL 66 -9.440 0.063 -5.397 1.00 0.00 H -ATOM 1030 HG12 VAL 66 -9.074 1.680 -5.073 1.00 0.00 H -ATOM 1031 HG13 VAL 66 -10.203 0.921 -3.965 1.00 0.00 H -ATOM 1032 CG2 VAL 66 -10.385 1.874 -7.292 1.00 0.00 C -ATOM 1033 HG21 VAL 66 -9.726 2.736 -7.190 1.00 0.00 H -ATOM 1034 HG22 VAL 66 -9.896 1.098 -7.879 1.00 0.00 H -ATOM 1035 HG23 VAL 66 -11.203 2.158 -7.954 1.00 0.00 H -ATOM 1036 C VAL 66 -12.041 -0.737 -5.213 1.00 0.00 C -ATOM 1037 O VAL 66 -11.489 -1.820 -5.355 1.00 0.00 O -ATOM 1038 N TYR 67 -12.870 -0.533 -4.132 1.00 0.00 N -ATOM 1039 H TYR 67 -13.214 0.416 -4.129 1.00 0.00 H -ATOM 1040 CA TYR 67 -13.089 -1.376 -2.929 1.00 0.00 C -ATOM 1041 HA TYR 67 -12.114 -1.834 -2.759 1.00 0.00 H -ATOM 1042 CB TYR 67 -13.432 -0.551 -1.744 1.00 0.00 C -ATOM 1043 HB2 TYR 67 -12.635 0.192 -1.701 1.00 0.00 H -ATOM 1044 HB3 TYR 67 -14.320 0.021 -2.013 1.00 0.00 H -ATOM 1045 CG TYR 67 -13.657 -1.095 -0.356 1.00 0.00 C -ATOM 1046 CD1 TYR 67 -14.961 -1.529 0.114 1.00 0.00 C -ATOM 1047 HD1 TYR 67 -15.783 -1.711 -0.564 1.00 0.00 H -ATOM 1048 CE1 TYR 67 -15.079 -1.789 1.482 1.00 0.00 C -ATOM 1049 HE1 TYR 67 -16.019 -2.186 1.836 1.00 0.00 H -ATOM 1050 CZ TYR 67 -13.909 -1.781 2.365 1.00 0.00 C -ATOM 1051 OH TYR 67 -14.101 -2.263 3.614 1.00 0.00 O -ATOM 1052 HH TYR 67 -14.894 -2.793 3.730 1.00 0.00 H -ATOM 1053 CE2 TYR 67 -12.646 -1.307 1.894 1.00 0.00 C -ATOM 1054 HE2 TYR 67 -11.749 -1.249 2.493 1.00 0.00 H -ATOM 1055 CD2 TYR 67 -12.542 -0.971 0.559 1.00 0.00 C -ATOM 1056 HD2 TYR 67 -11.545 -0.735 0.217 1.00 0.00 H -ATOM 1057 C TYR 67 -14.035 -2.571 -3.321 1.00 0.00 C -ATOM 1058 O TYR 67 -13.604 -3.677 -3.064 1.00 0.00 O -ATOM 1059 N ARG 68 -15.191 -2.393 -3.929 1.00 0.00 N -ATOM 1060 H ARG 68 -15.426 -1.447 -4.193 1.00 0.00 H -ATOM 1061 CA ARG 68 -15.998 -3.499 -4.461 1.00 0.00 C -ATOM 1062 HA ARG 68 -16.147 -4.302 -3.738 1.00 0.00 H -ATOM 1063 CB ARG 68 -17.392 -2.863 -4.776 1.00 0.00 C -ATOM 1064 HB2 ARG 68 -17.150 -2.029 -5.435 1.00 0.00 H -ATOM 1065 HB3 ARG 68 -18.005 -3.615 -5.273 1.00 0.00 H -ATOM 1066 CG ARG 68 -18.257 -2.496 -3.522 1.00 0.00 C -ATOM 1067 HG2 ARG 68 -18.317 -3.390 -2.903 1.00 0.00 H -ATOM 1068 HG3 ARG 68 -17.814 -1.630 -3.029 1.00 0.00 H -ATOM 1069 CD ARG 68 -19.802 -2.201 -3.889 1.00 0.00 C -ATOM 1070 HD2 ARG 68 -20.305 -3.038 -4.371 1.00 0.00 H -ATOM 1071 HD3 ARG 68 -20.321 -2.010 -2.949 1.00 0.00 H -ATOM 1072 NE ARG 68 -19.908 -1.058 -4.817 1.00 0.00 N -ATOM 1073 HE ARG 68 -19.177 -0.921 -5.502 1.00 0.00 H -ATOM 1074 CZ ARG 68 -20.866 -0.113 -4.933 1.00 0.00 C -ATOM 1075 NH1 ARG 68 -21.924 -0.155 -4.203 1.00 0.00 N -ATOM 1076 HH11 ARG 68 -22.084 -0.720 -3.381 1.00 0.00 H -ATOM 1077 HH12 ARG 68 -22.632 0.540 -4.396 1.00 0.00 H -ATOM 1078 NH2 ARG 68 -20.725 0.839 -5.799 1.00 0.00 N -ATOM 1079 HH21 ARG 68 -20.191 0.582 -6.617 1.00 0.00 H -ATOM 1080 HH22 ARG 68 -21.499 1.469 -5.953 1.00 0.00 H -ATOM 1081 C ARG 68 -15.517 -4.212 -5.699 1.00 0.00 C -ATOM 1082 O ARG 68 -16.119 -5.218 -6.091 1.00 0.00 O -ATOM 1083 N SER 69 -14.308 -3.905 -6.220 1.00 0.00 N -ATOM 1084 H SER 69 -13.816 -3.096 -5.867 1.00 0.00 H -ATOM 1085 CA SER 69 -13.656 -4.798 -7.196 1.00 0.00 C -ATOM 1086 HA SER 69 -14.242 -5.651 -7.538 1.00 0.00 H -ATOM 1087 CB SER 69 -13.154 -3.878 -8.332 1.00 0.00 C -ATOM 1088 HB2 SER 69 -12.494 -3.130 -7.893 1.00 0.00 H -ATOM 1089 HB3 SER 69 -12.633 -4.503 -9.057 1.00 0.00 H -ATOM 1090 OG SER 69 -14.272 -3.183 -8.868 1.00 0.00 O -ATOM 1091 HG SER 69 -14.353 -2.288 -8.530 1.00 0.00 H -ATOM 1092 C SER 69 -12.353 -5.413 -6.547 1.00 0.00 C -ATOM 1093 O SER 69 -12.193 -6.639 -6.715 1.00 0.00 O -ATOM 1094 N VAL 70 -11.545 -4.788 -5.767 1.00 0.00 N -ATOM 1095 H VAL 70 -11.683 -3.790 -5.697 1.00 0.00 H -ATOM 1096 CA VAL 70 -10.283 -5.273 -5.328 1.00 0.00 C -ATOM 1097 HA VAL 70 -9.884 -6.131 -5.867 1.00 0.00 H -ATOM 1098 CB VAL 70 -9.188 -4.258 -5.591 1.00 0.00 C -ATOM 1099 HB VAL 70 -9.499 -3.260 -5.282 1.00 0.00 H -ATOM 1100 CG1 VAL 70 -7.929 -4.553 -4.777 1.00 0.00 C -ATOM 1101 HG11 VAL 70 -7.497 -5.541 -4.936 1.00 0.00 H -ATOM 1102 HG12 VAL 70 -7.257 -3.698 -4.860 1.00 0.00 H -ATOM 1103 HG13 VAL 70 -8.115 -4.442 -3.708 1.00 0.00 H -ATOM 1104 CG2 VAL 70 -8.950 -4.155 -7.031 1.00 0.00 C -ATOM 1105 HG21 VAL 70 -8.794 -5.106 -7.540 1.00 0.00 H -ATOM 1106 HG22 VAL 70 -9.699 -3.614 -7.608 1.00 0.00 H -ATOM 1107 HG23 VAL 70 -8.089 -3.528 -7.258 1.00 0.00 H -ATOM 1108 C VAL 70 -10.377 -5.545 -3.820 1.00 0.00 C -ATOM 1109 O VAL 70 -9.861 -6.573 -3.368 1.00 0.00 O -ATOM 1110 N VAL 71 -10.955 -4.702 -2.925 1.00 0.00 N -ATOM 1111 H VAL 71 -11.457 -3.945 -3.367 1.00 0.00 H -ATOM 1112 CA VAL 71 -10.706 -4.865 -1.422 1.00 0.00 C -ATOM 1113 HA VAL 71 -9.758 -5.397 -1.344 1.00 0.00 H -ATOM 1114 CB VAL 71 -10.583 -3.481 -0.735 1.00 0.00 C -ATOM 1115 HB VAL 71 -11.531 -2.968 -0.896 1.00 0.00 H -ATOM 1116 CG1 VAL 71 -10.315 -3.637 0.800 1.00 0.00 C -ATOM 1117 HG11 VAL 71 -11.046 -4.193 1.387 1.00 0.00 H -ATOM 1118 HG12 VAL 71 -9.334 -4.113 0.829 1.00 0.00 H -ATOM 1119 HG13 VAL 71 -10.261 -2.724 1.393 1.00 0.00 H -ATOM 1120 CG2 VAL 71 -9.577 -2.474 -1.284 1.00 0.00 C -ATOM 1121 HG21 VAL 71 -9.952 -1.796 -2.050 1.00 0.00 H -ATOM 1122 HG22 VAL 71 -9.197 -1.790 -0.526 1.00 0.00 H -ATOM 1123 HG23 VAL 71 -8.829 -3.070 -1.806 1.00 0.00 H -ATOM 1124 C VAL 71 -11.658 -5.813 -0.698 1.00 0.00 C -ATOM 1125 O VAL 71 -11.251 -6.704 0.072 1.00 0.00 O -ATOM 1126 N CYS 72 -12.965 -5.704 -1.037 1.00 0.00 N -ATOM 1127 H CYS 72 -12.993 -5.010 -1.771 1.00 0.00 H -ATOM 1128 CA CYS 72 -14.000 -6.580 -0.619 1.00 0.00 C -ATOM 1129 HA CYS 72 -14.066 -6.480 0.464 1.00 0.00 H -ATOM 1130 CB CYS 72 -15.402 -6.219 -1.202 1.00 0.00 C -ATOM 1131 HB2 CYS 72 -15.482 -6.348 -2.282 1.00 0.00 H -ATOM 1132 HB3 CYS 72 -16.110 -6.943 -0.798 1.00 0.00 H -ATOM 1133 SG CYS 72 -15.988 -4.507 -0.946 1.00 0.00 S -ATOM 1134 HG CYS 72 -16.807 -4.893 0.037 1.00 0.00 H -ATOM 1135 C CYS 72 -13.751 -8.108 -0.871 1.00 0.00 C -ATOM 1136 O CYS 72 -13.971 -8.753 0.064 1.00 0.00 O -ATOM 1137 N PRO 73 -13.248 -8.599 -1.983 1.00 0.00 N -ATOM 1138 CD PRO 73 -13.227 -7.923 -3.254 1.00 0.00 C -ATOM 1139 HD2 PRO 73 -12.705 -6.967 -3.212 1.00 0.00 H -ATOM 1140 HD3 PRO 73 -14.259 -7.820 -3.589 1.00 0.00 H -ATOM 1141 CG PRO 73 -12.371 -8.893 -4.131 1.00 0.00 C -ATOM 1142 HG2 PRO 73 -11.323 -8.803 -3.845 1.00 0.00 H -ATOM 1143 HG3 PRO 73 -12.627 -8.798 -5.186 1.00 0.00 H -ATOM 1144 CB PRO 73 -12.829 -10.246 -3.615 1.00 0.00 C -ATOM 1145 HB2 PRO 73 -12.209 -11.114 -3.839 1.00 0.00 H -ATOM 1146 HB3 PRO 73 -13.829 -10.381 -4.027 1.00 0.00 H -ATOM 1147 CA PRO 73 -12.930 -9.997 -2.102 1.00 0.00 C -ATOM 1148 HA PRO 73 -13.667 -10.611 -1.585 1.00 0.00 H -ATOM 1149 C PRO 73 -11.669 -10.412 -1.319 1.00 0.00 C -ATOM 1150 O PRO 73 -11.563 -11.618 -1.082 1.00 0.00 O -ATOM 1151 N ILE 74 -10.777 -9.507 -0.905 1.00 0.00 N -ATOM 1152 H ILE 74 -11.008 -8.553 -1.141 1.00 0.00 H -ATOM 1153 CA ILE 74 -9.611 -9.713 -0.049 1.00 0.00 C -ATOM 1154 HA ILE 74 -9.111 -10.668 -0.214 1.00 0.00 H -ATOM 1155 CB ILE 74 -8.575 -8.565 -0.273 1.00 0.00 C -ATOM 1156 HB ILE 74 -9.150 -7.642 -0.333 1.00 0.00 H -ATOM 1157 CG2 ILE 74 -7.579 -8.541 0.898 1.00 0.00 C -ATOM 1158 HG21 ILE 74 -6.957 -9.434 0.947 1.00 0.00 H -ATOM 1159 HG22 ILE 74 -6.967 -7.647 0.767 1.00 0.00 H -ATOM 1160 HG23 ILE 74 -8.169 -8.434 1.809 1.00 0.00 H -ATOM 1161 CG1 ILE 74 -7.910 -8.999 -1.682 1.00 0.00 C -ATOM 1162 HG12 ILE 74 -7.451 -9.982 -1.580 1.00 0.00 H -ATOM 1163 HG13 ILE 74 -8.676 -9.021 -2.458 1.00 0.00 H -ATOM 1164 CD1 ILE 74 -6.952 -7.988 -2.242 1.00 0.00 C -ATOM 1165 HD11 ILE 74 -6.636 -8.121 -3.277 1.00 0.00 H -ATOM 1166 HD12 ILE 74 -7.444 -7.014 -2.242 1.00 0.00 H -ATOM 1167 HD13 ILE 74 -6.182 -7.890 -1.478 1.00 0.00 H -ATOM 1168 C ILE 74 -10.163 -9.800 1.420 1.00 0.00 C -ATOM 1169 O ILE 74 -9.869 -10.723 2.166 1.00 0.00 O -ATOM 1170 N LEU 75 -11.115 -8.919 1.809 1.00 0.00 N -ATOM 1171 H LEU 75 -11.545 -8.250 1.187 1.00 0.00 H -ATOM 1172 CA LEU 75 -11.592 -8.833 3.154 1.00 0.00 C -ATOM 1173 HA LEU 75 -10.823 -8.945 3.918 1.00 0.00 H -ATOM 1174 CB LEU 75 -12.283 -7.471 3.487 1.00 0.00 C -ATOM 1175 HB2 LEU 75 -11.594 -6.681 3.189 1.00 0.00 H -ATOM 1176 HB3 LEU 75 -13.225 -7.424 2.940 1.00 0.00 H -ATOM 1177 CG LEU 75 -12.645 -7.171 5.006 1.00 0.00 C -ATOM 1178 HG LEU 75 -13.305 -8.001 5.261 1.00 0.00 H -ATOM 1179 CD1 LEU 75 -11.545 -7.160 6.048 1.00 0.00 C -ATOM 1180 HD11 LEU 75 -11.093 -8.151 6.071 1.00 0.00 H -ATOM 1181 HD12 LEU 75 -10.832 -6.371 5.811 1.00 0.00 H -ATOM 1182 HD13 LEU 75 -11.999 -7.004 7.027 1.00 0.00 H -ATOM 1183 CD2 LEU 75 -13.399 -5.897 5.220 1.00 0.00 C -ATOM 1184 HD21 LEU 75 -12.942 -4.914 5.110 1.00 0.00 H -ATOM 1185 HD22 LEU 75 -14.174 -5.874 4.455 1.00 0.00 H -ATOM 1186 HD23 LEU 75 -13.967 -5.999 6.145 1.00 0.00 H -ATOM 1187 C LEU 75 -12.436 -10.073 3.489 1.00 0.00 C -ATOM 1188 O LEU 75 -12.438 -10.444 4.685 1.00 0.00 O -ATOM 1189 N ASP 76 -13.046 -10.802 2.598 1.00 0.00 N -ATOM 1190 H ASP 76 -13.112 -10.340 1.702 1.00 0.00 H -ATOM 1191 CA ASP 76 -13.461 -12.202 2.757 1.00 0.00 C -ATOM 1192 HA ASP 76 -14.207 -12.287 3.546 1.00 0.00 H -ATOM 1193 CB ASP 76 -14.080 -12.648 1.496 1.00 0.00 C -ATOM 1194 HB2 ASP 76 -13.373 -12.427 0.697 1.00 0.00 H -ATOM 1195 HB3 ASP 76 -14.257 -13.720 1.591 1.00 0.00 H -ATOM 1196 CG ASP 76 -15.529 -12.059 1.202 1.00 0.00 C -ATOM 1197 OD1 ASP 76 -16.020 -12.132 0.022 1.00 0.00 O -ATOM 1198 OD2 ASP 76 -16.162 -11.512 2.138 1.00 0.00 O -ATOM 1199 C ASP 76 -12.334 -13.122 3.256 1.00 0.00 C -ATOM 1200 O ASP 76 -12.545 -13.827 4.210 1.00 0.00 O -ATOM 1201 N GLU 77 -11.139 -13.180 2.616 1.00 0.00 N -ATOM 1202 H GLU 77 -10.883 -12.601 1.828 1.00 0.00 H -ATOM 1203 CA GLU 77 -10.061 -14.093 3.002 1.00 0.00 C -ATOM 1204 HA GLU 77 -10.526 -15.058 3.203 1.00 0.00 H -ATOM 1205 CB GLU 77 -9.002 -14.232 1.921 1.00 0.00 C -ATOM 1206 HB2 GLU 77 -8.598 -13.224 1.821 1.00 0.00 H -ATOM 1207 HB3 GLU 77 -8.186 -14.895 2.208 1.00 0.00 H -ATOM 1208 CG GLU 77 -9.576 -14.673 0.502 1.00 0.00 C -ATOM 1209 HG2 GLU 77 -10.335 -15.443 0.642 1.00 0.00 H -ATOM 1210 HG3 GLU 77 -10.083 -13.848 0.002 1.00 0.00 H -ATOM 1211 CD GLU 77 -8.454 -15.135 -0.464 1.00 0.00 C -ATOM 1212 OE1 GLU 77 -7.280 -14.722 -0.390 1.00 0.00 O -ATOM 1213 OE2 GLU 77 -8.731 -15.973 -1.387 1.00 0.00 O -ATOM 1214 C GLU 77 -9.349 -13.566 4.276 1.00 0.00 C -ATOM 1215 O GLU 77 -8.934 -14.361 5.138 1.00 0.00 O -ATOM 1216 N VAL 78 -9.336 -12.266 4.556 1.00 0.00 N -ATOM 1217 H VAL 78 -9.518 -11.664 3.765 1.00 0.00 H -ATOM 1218 CA VAL 78 -8.808 -11.761 5.856 1.00 0.00 C -ATOM 1219 HA VAL 78 -7.843 -12.113 6.221 1.00 0.00 H -ATOM 1220 CB VAL 78 -8.849 -10.205 5.875 1.00 0.00 C -ATOM 1221 HB VAL 78 -9.858 -9.907 5.588 1.00 0.00 H -ATOM 1222 CG1 VAL 78 -8.611 -9.616 7.254 1.00 0.00 C -ATOM 1223 HG11 VAL 78 -7.598 -9.875 7.558 1.00 0.00 H -ATOM 1224 HG12 VAL 78 -8.605 -8.526 7.265 1.00 0.00 H -ATOM 1225 HG13 VAL 78 -9.362 -9.893 7.994 1.00 0.00 H -ATOM 1226 CG2 VAL 78 -7.874 -9.608 4.886 1.00 0.00 C -ATOM 1227 HG21 VAL 78 -6.819 -9.776 5.097 1.00 0.00 H -ATOM 1228 HG22 VAL 78 -7.940 -9.954 3.854 1.00 0.00 H -ATOM 1229 HG23 VAL 78 -8.194 -8.567 4.875 1.00 0.00 H -ATOM 1230 C VAL 78 -9.758 -12.192 6.938 1.00 0.00 C -ATOM 1231 O VAL 78 -9.274 -12.618 7.967 1.00 0.00 O -ATOM 1232 N ILE 79 -11.092 -12.269 6.726 1.00 0.00 N -ATOM 1233 H ILE 79 -11.455 -11.814 5.901 1.00 0.00 H -ATOM 1234 CA ILE 79 -12.067 -12.877 7.697 1.00 0.00 C -ATOM 1235 HA ILE 79 -11.697 -12.645 8.696 1.00 0.00 H -ATOM 1236 CB ILE 79 -13.433 -12.187 7.428 1.00 0.00 C -ATOM 1237 HB ILE 79 -13.520 -12.250 6.342 1.00 0.00 H -ATOM 1238 CG2 ILE 79 -14.663 -12.865 8.120 1.00 0.00 C -ATOM 1239 HG21 ILE 79 -15.614 -12.379 7.899 1.00 0.00 H -ATOM 1240 HG22 ILE 79 -14.758 -13.883 7.742 1.00 0.00 H -ATOM 1241 HG23 ILE 79 -14.465 -12.799 9.190 1.00 0.00 H -ATOM 1242 CG1 ILE 79 -13.268 -10.724 7.873 1.00 0.00 C -ATOM 1243 HG12 ILE 79 -12.788 -10.711 8.852 1.00 0.00 H -ATOM 1244 HG13 ILE 79 -12.548 -10.200 7.243 1.00 0.00 H -ATOM 1245 CD1 ILE 79 -14.439 -9.761 7.868 1.00 0.00 C -ATOM 1246 HD11 ILE 79 -14.018 -8.769 8.038 1.00 0.00 H -ATOM 1247 HD12 ILE 79 -14.951 -9.712 6.907 1.00 0.00 H -ATOM 1248 HD13 ILE 79 -15.197 -9.957 8.626 1.00 0.00 H -ATOM 1249 C ILE 79 -12.049 -14.471 7.746 1.00 0.00 C -ATOM 1250 O ILE 79 -12.340 -15.134 8.732 1.00 0.00 O -ATOM 1251 N MET 80 -11.543 -15.079 6.724 1.00 0.00 N -ATOM 1252 H MET 80 -11.292 -14.597 5.873 1.00 0.00 H -ATOM 1253 CA MET 80 -11.335 -16.566 6.737 1.00 0.00 C -ATOM 1254 HA MET 80 -12.262 -17.010 7.102 1.00 0.00 H -ATOM 1255 CB MET 80 -11.093 -17.218 5.347 1.00 0.00 C -ATOM 1256 HB2 MET 80 -11.710 -16.752 4.578 1.00 0.00 H -ATOM 1257 HB3 MET 80 -10.061 -17.004 5.066 1.00 0.00 H -ATOM 1258 CG MET 80 -11.463 -18.674 5.340 1.00 0.00 C -ATOM 1259 HG2 MET 80 -11.179 -19.097 6.303 1.00 0.00 H -ATOM 1260 HG3 MET 80 -12.509 -18.901 5.137 1.00 0.00 H -ATOM 1261 SD MET 80 -10.460 -19.649 4.194 1.00 0.00 S -ATOM 1262 CE MET 80 -11.405 -19.200 2.726 1.00 0.00 C -ATOM 1263 HE1 MET 80 -11.125 -18.206 2.374 1.00 0.00 H -ATOM 1264 HE2 MET 80 -10.996 -19.872 1.971 1.00 0.00 H -ATOM 1265 HE3 MET 80 -12.461 -19.430 2.868 1.00 0.00 H -ATOM 1266 C MET 80 -10.099 -16.994 7.627 1.00 0.00 C -ATOM 1267 O MET 80 -10.057 -18.142 8.048 1.00 0.00 O -ATOM 1268 N GLY 81 -9.195 -16.021 7.951 1.00 0.00 N -ATOM 1269 H GLY 81 -9.437 -15.101 7.614 1.00 0.00 H -ATOM 1270 CA GLY 81 -8.018 -16.184 8.892 1.00 0.00 C -ATOM 1271 HA2 GLY 81 -8.042 -15.541 9.771 1.00 0.00 H -ATOM 1272 HA3 GLY 81 -7.955 -17.236 9.170 1.00 0.00 H -ATOM 1273 C GLY 81 -6.638 -15.972 8.277 1.00 0.00 C -ATOM 1274 O GLY 81 -5.575 -16.291 8.822 1.00 0.00 O -ATOM 1275 N TYR 82 -6.572 -15.533 7.015 1.00 0.00 N -ATOM 1276 H TYR 82 -7.442 -15.324 6.547 1.00 0.00 H -ATOM 1277 CA TYR 82 -5.313 -15.226 6.363 1.00 0.00 C -ATOM 1278 HA TYR 82 -4.569 -15.902 6.785 1.00 0.00 H -ATOM 1279 CB TYR 82 -5.458 -15.574 4.906 1.00 0.00 C -ATOM 1280 HB2 TYR 82 -6.358 -15.096 4.517 1.00 0.00 H -ATOM 1281 HB3 TYR 82 -4.671 -15.076 4.340 1.00 0.00 H -ATOM 1282 CG TYR 82 -5.653 -17.003 4.545 1.00 0.00 C -ATOM 1283 CD1 TYR 82 -6.815 -17.440 3.901 1.00 0.00 C -ATOM 1284 HD1 TYR 82 -7.590 -16.712 3.713 1.00 0.00 H -ATOM 1285 CE1 TYR 82 -7.028 -18.774 3.422 1.00 0.00 C -ATOM 1286 HE1 TYR 82 -7.894 -19.094 2.861 1.00 0.00 H -ATOM 1287 CZ TYR 82 -5.975 -19.700 3.695 1.00 0.00 C -ATOM 1288 OH TYR 82 -5.919 -20.950 3.070 1.00 0.00 O -ATOM 1289 HH TYR 82 -6.691 -21.032 2.506 1.00 0.00 H -ATOM 1290 CE2 TYR 82 -4.761 -19.299 4.270 1.00 0.00 C -ATOM 1291 HE2 TYR 82 -4.018 -20.080 4.337 1.00 0.00 H -ATOM 1292 CD2 TYR 82 -4.624 -17.926 4.723 1.00 0.00 C -ATOM 1293 HD2 TYR 82 -3.651 -17.735 5.151 1.00 0.00 H -ATOM 1294 C TYR 82 -4.743 -13.772 6.629 1.00 0.00 C -ATOM 1295 O TYR 82 -5.452 -12.780 6.653 1.00 0.00 O -ATOM 1296 N ASN 83 -3.377 -13.737 6.665 1.00 0.00 N -ATOM 1297 H ASN 83 -2.870 -14.608 6.746 1.00 0.00 H -ATOM 1298 CA ASN 83 -2.634 -12.504 6.586 1.00 0.00 C -ATOM 1299 HA ASN 83 -3.144 -11.744 7.177 1.00 0.00 H -ATOM 1300 CB ASN 83 -1.257 -12.529 7.230 1.00 0.00 C -ATOM 1301 HB2 ASN 83 -0.524 -13.076 6.638 1.00 0.00 H -ATOM 1302 HB3 ASN 83 -0.846 -11.520 7.191 1.00 0.00 H -ATOM 1303 CG ASN 83 -1.178 -13.031 8.666 1.00 0.00 C -ATOM 1304 OD1 ASN 83 -2.015 -12.784 9.510 1.00 0.00 O -ATOM 1305 ND2 ASN 83 -0.102 -13.680 9.074 1.00 0.00 N -ATOM 1306 HD21 ASN 83 -0.110 -14.072 10.005 1.00 0.00 H -ATOM 1307 HD22 ASN 83 0.559 -13.887 8.339 1.00 0.00 H -ATOM 1308 C ASN 83 -2.481 -12.130 5.106 1.00 0.00 C -ATOM 1309 O ASN 83 -2.223 -12.983 4.309 1.00 0.00 O -ATOM 1310 N CYS 84 -2.646 -10.820 4.844 1.00 0.00 N -ATOM 1311 H CYS 84 -2.942 -10.268 5.637 1.00 0.00 H -ATOM 1312 CA CYS 84 -2.905 -10.154 3.562 1.00 0.00 C -ATOM 1313 HA CYS 84 -2.487 -10.778 2.772 1.00 0.00 H -ATOM 1314 CB CYS 84 -4.391 -9.969 3.381 1.00 0.00 C -ATOM 1315 HB2 CYS 84 -4.821 -9.621 4.320 1.00 0.00 H -ATOM 1316 HB3 CYS 84 -4.810 -9.251 2.675 1.00 0.00 H -ATOM 1317 SG CYS 84 -5.156 -11.554 2.926 1.00 0.00 S -ATOM 1318 HG CYS 84 -5.167 -11.889 4.220 1.00 0.00 H -ATOM 1319 C CYS 84 -2.230 -8.755 3.516 1.00 0.00 C -ATOM 1320 O CYS 84 -2.090 -8.133 4.562 1.00 0.00 O -ATOM 1321 N THR 85 -1.766 -8.305 2.348 1.00 0.00 N -ATOM 1322 H THR 85 -1.961 -8.909 1.562 1.00 0.00 H -ATOM 1323 CA THR 85 -1.292 -6.962 2.109 1.00 0.00 C -ATOM 1324 HA THR 85 -1.585 -6.301 2.924 1.00 0.00 H -ATOM 1325 CB THR 85 0.295 -6.959 2.132 1.00 0.00 C -ATOM 1326 HB THR 85 0.677 -7.633 1.365 1.00 0.00 H -ATOM 1327 CG2 THR 85 0.988 -5.637 1.870 1.00 0.00 C -ATOM 1328 HG21 THR 85 2.018 -5.827 2.176 1.00 0.00 H -ATOM 1329 HG22 THR 85 1.055 -5.505 0.790 1.00 0.00 H -ATOM 1330 HG23 THR 85 0.428 -4.846 2.367 1.00 0.00 H -ATOM 1331 OG1 THR 85 0.664 -7.538 3.324 1.00 0.00 O -ATOM 1332 HG1 THR 85 1.571 -7.840 3.227 1.00 0.00 H -ATOM 1333 C THR 85 -1.904 -6.281 0.805 1.00 0.00 C -ATOM 1334 O THR 85 -2.186 -6.965 -0.177 1.00 0.00 O -ATOM 1335 N ILE 86 -2.083 -4.921 0.824 1.00 0.00 N -ATOM 1336 H ILE 86 -2.005 -4.412 1.693 1.00 0.00 H -ATOM 1337 CA ILE 86 -2.207 -4.074 -0.375 1.00 0.00 C -ATOM 1338 HA ILE 86 -2.013 -4.651 -1.279 1.00 0.00 H -ATOM 1339 CB ILE 86 -3.688 -3.601 -0.569 1.00 0.00 C -ATOM 1340 HB ILE 86 -3.937 -2.965 0.281 1.00 0.00 H -ATOM 1341 CG2 ILE 86 -3.774 -2.917 -1.897 1.00 0.00 C -ATOM 1342 HG21 ILE 86 -4.765 -2.481 -2.019 1.00 0.00 H -ATOM 1343 HG22 ILE 86 -3.266 -1.960 -1.780 1.00 0.00 H -ATOM 1344 HG23 ILE 86 -3.506 -3.556 -2.738 1.00 0.00 H -ATOM 1345 CG1 ILE 86 -4.842 -4.712 -0.450 1.00 0.00 C -ATOM 1346 HG12 ILE 86 -4.681 -5.527 -1.156 1.00 0.00 H -ATOM 1347 HG13 ILE 86 -4.833 -5.244 0.502 1.00 0.00 H -ATOM 1348 CD1 ILE 86 -6.268 -4.036 -0.596 1.00 0.00 C -ATOM 1349 HD11 ILE 86 -6.299 -3.131 0.010 1.00 0.00 H -ATOM 1350 HD12 ILE 86 -6.450 -3.828 -1.650 1.00 0.00 H -ATOM 1351 HD13 ILE 86 -7.061 -4.741 -0.345 1.00 0.00 H -ATOM 1352 C ILE 86 -1.182 -2.966 -0.369 1.00 0.00 C -ATOM 1353 O ILE 86 -1.173 -2.117 0.510 1.00 0.00 O -ATOM 1354 N PHE 87 -0.294 -3.039 -1.374 1.00 0.00 N -ATOM 1355 H PHE 87 -0.366 -3.885 -1.920 1.00 0.00 H -ATOM 1356 CA PHE 87 0.424 -1.876 -1.870 1.00 0.00 C -ATOM 1357 HA PHE 87 0.823 -1.365 -0.993 1.00 0.00 H -ATOM 1358 CB PHE 87 1.593 -2.428 -2.682 1.00 0.00 C -ATOM 1359 HB2 PHE 87 1.229 -3.062 -3.490 1.00 0.00 H -ATOM 1360 HB3 PHE 87 2.031 -1.548 -3.152 1.00 0.00 H -ATOM 1361 CG PHE 87 2.582 -3.263 -1.818 1.00 0.00 C -ATOM 1362 CD1 PHE 87 2.744 -4.587 -1.983 1.00 0.00 C -ATOM 1363 HD1 PHE 87 2.127 -5.139 -2.676 1.00 0.00 H -ATOM 1364 CE1 PHE 87 3.657 -5.338 -1.191 1.00 0.00 C -ATOM 1365 HE1 PHE 87 3.739 -6.404 -1.341 1.00 0.00 H -ATOM 1366 CZ PHE 87 4.413 -4.750 -0.166 1.00 0.00 C -ATOM 1367 HZ PHE 87 5.050 -5.354 0.464 1.00 0.00 H -ATOM 1368 CE2 PHE 87 4.290 -3.359 -0.033 1.00 0.00 C -ATOM 1369 HE2 PHE 87 4.955 -2.938 0.707 1.00 0.00 H -ATOM 1370 CD2 PHE 87 3.266 -2.683 -0.740 1.00 0.00 C -ATOM 1371 HD2 PHE 87 3.130 -1.615 -0.655 1.00 0.00 H -ATOM 1372 C PHE 87 -0.370 -0.814 -2.677 1.00 0.00 C -ATOM 1373 O PHE 87 -1.298 -1.151 -3.453 1.00 0.00 O -ATOM 1374 N ALA 88 -0.028 0.478 -2.501 1.00 0.00 N -ATOM 1375 H ALA 88 0.652 0.786 -1.821 1.00 0.00 H -ATOM 1376 CA ALA 88 -0.139 1.450 -3.581 1.00 0.00 C -ATOM 1377 HA ALA 88 -0.676 1.061 -4.446 1.00 0.00 H -ATOM 1378 CB ALA 88 -0.909 2.667 -3.057 1.00 0.00 C -ATOM 1379 HB1 ALA 88 -1.935 2.427 -2.781 1.00 0.00 H -ATOM 1380 HB2 ALA 88 -0.504 3.090 -2.136 1.00 0.00 H -ATOM 1381 HB3 ALA 88 -0.916 3.463 -3.801 1.00 0.00 H -ATOM 1382 C ALA 88 1.337 1.813 -3.991 1.00 0.00 C -ATOM 1383 O ALA 88 2.174 2.073 -3.125 1.00 0.00 O -ATOM 1384 N TYR 89 1.540 1.755 -5.318 1.00 0.00 N -ATOM 1385 H TYR 89 0.700 1.497 -5.816 1.00 0.00 H -ATOM 1386 CA TYR 89 2.681 2.098 -6.149 1.00 0.00 C -ATOM 1387 HA TYR 89 3.382 2.598 -5.481 1.00 0.00 H -ATOM 1388 CB TYR 89 3.338 0.864 -6.621 1.00 0.00 C -ATOM 1389 HB2 TYR 89 3.537 0.120 -5.849 1.00 0.00 H -ATOM 1390 HB3 TYR 89 2.630 0.386 -7.298 1.00 0.00 H -ATOM 1391 CG TYR 89 4.681 0.992 -7.355 1.00 0.00 C -ATOM 1392 CD1 TYR 89 4.627 1.333 -8.681 1.00 0.00 C -ATOM 1393 HD1 TYR 89 3.732 1.633 -9.206 1.00 0.00 H -ATOM 1394 CE1 TYR 89 5.824 1.572 -9.371 1.00 0.00 C -ATOM 1395 HE1 TYR 89 5.976 1.905 -10.387 1.00 0.00 H -ATOM 1396 CZ TYR 89 7.053 1.461 -8.710 1.00 0.00 C -ATOM 1397 OH TYR 89 8.190 1.673 -9.446 1.00 0.00 O -ATOM 1398 HH TYR 89 8.946 1.229 -9.056 1.00 0.00 H -ATOM 1399 CE2 TYR 89 7.112 1.074 -7.344 1.00 0.00 C -ATOM 1400 HE2 TYR 89 8.047 0.888 -6.840 1.00 0.00 H -ATOM 1401 CD2 TYR 89 5.886 0.768 -6.727 1.00 0.00 C -ATOM 1402 HD2 TYR 89 5.842 0.612 -5.659 1.00 0.00 H -ATOM 1403 C TYR 89 2.460 3.136 -7.209 1.00 0.00 C -ATOM 1404 O TYR 89 1.496 3.069 -8.024 1.00 0.00 O -ATOM 1405 N GLY 90 3.326 4.089 -7.332 1.00 0.00 N -ATOM 1406 H GLY 90 4.035 4.295 -6.643 1.00 0.00 H -ATOM 1407 CA GLY 90 3.125 5.146 -8.309 1.00 0.00 C -ATOM 1408 HA2 GLY 90 3.276 4.729 -9.305 1.00 0.00 H -ATOM 1409 HA3 GLY 90 2.162 5.647 -8.220 1.00 0.00 H -ATOM 1410 C GLY 90 4.170 6.257 -8.173 1.00 0.00 C -ATOM 1411 O GLY 90 4.711 6.534 -7.104 1.00 0.00 O -ATOM 1412 N GLN 91 4.217 7.098 -9.192 1.00 0.00 N -ATOM 1413 H GLN 91 3.836 6.689 -10.033 1.00 0.00 H -ATOM 1414 CA GLN 91 4.788 8.418 -9.232 1.00 0.00 C -ATOM 1415 HA GLN 91 5.867 8.330 -9.104 1.00 0.00 H -ATOM 1416 CB GLN 91 4.452 8.850 -10.692 1.00 0.00 C -ATOM 1417 HB2 GLN 91 5.088 8.286 -11.373 1.00 0.00 H -ATOM 1418 HB3 GLN 91 3.396 8.705 -10.923 1.00 0.00 H -ATOM 1419 CG GLN 91 4.707 10.331 -10.890 1.00 0.00 C -ATOM 1420 HG2 GLN 91 3.962 10.841 -10.280 1.00 0.00 H -ATOM 1421 HG3 GLN 91 5.719 10.628 -10.615 1.00 0.00 H -ATOM 1422 CD GLN 91 4.523 10.808 -12.331 1.00 0.00 C -ATOM 1423 OE1 GLN 91 3.803 10.229 -13.116 1.00 0.00 O -ATOM 1424 NE2 GLN 91 5.117 11.871 -12.766 1.00 0.00 N -ATOM 1425 HE21 GLN 91 5.050 12.098 -13.748 1.00 0.00 H -ATOM 1426 HE22 GLN 91 5.686 12.452 -12.166 1.00 0.00 H -ATOM 1427 C GLN 91 4.219 9.351 -8.106 1.00 0.00 C -ATOM 1428 O GLN 91 3.052 9.249 -7.764 1.00 0.00 O -ATOM 1429 N THR 92 5.000 10.431 -7.835 1.00 0.00 N -ATOM 1430 H THR 92 5.996 10.431 -8.006 1.00 0.00 H -ATOM 1431 CA THR 92 4.548 11.621 -6.971 1.00 0.00 C -ATOM 1432 HA THR 92 3.951 11.232 -6.146 1.00 0.00 H -ATOM 1433 CB THR 92 5.700 12.521 -6.512 1.00 0.00 C -ATOM 1434 HB THR 92 6.175 12.982 -7.378 1.00 0.00 H -ATOM 1435 CG2 THR 92 5.308 13.610 -5.457 1.00 0.00 C -ATOM 1436 HG21 THR 92 6.180 14.121 -5.048 1.00 0.00 H -ATOM 1437 HG22 THR 92 4.829 14.377 -6.065 1.00 0.00 H -ATOM 1438 HG23 THR 92 4.550 13.337 -4.723 1.00 0.00 H -ATOM 1439 OG1 THR 92 6.540 11.696 -5.676 1.00 0.00 O -ATOM 1440 HG1 THR 92 7.344 11.400 -6.109 1.00 0.00 H -ATOM 1441 C THR 92 3.470 12.474 -7.813 1.00 0.00 C -ATOM 1442 O THR 92 3.647 12.891 -8.972 1.00 0.00 O -ATOM 1443 N GLY 93 2.321 12.585 -7.247 1.00 0.00 N -ATOM 1444 H GLY 93 2.187 12.259 -6.301 1.00 0.00 H -ATOM 1445 CA GLY 93 1.100 13.138 -7.861 1.00 0.00 C -ATOM 1446 HA2 GLY 93 0.577 13.858 -7.233 1.00 0.00 H -ATOM 1447 HA3 GLY 93 1.431 13.702 -8.733 1.00 0.00 H -ATOM 1448 C GLY 93 0.129 12.082 -8.451 1.00 0.00 C -ATOM 1449 O GLY 93 -0.738 12.492 -9.300 1.00 0.00 O -ATOM 1450 N THR 94 0.072 10.827 -7.944 1.00 0.00 N -ATOM 1451 H THR 94 0.709 10.538 -7.215 1.00 0.00 H -ATOM 1452 CA THR 94 -0.826 9.796 -8.469 1.00 0.00 C -ATOM 1453 HA THR 94 -1.331 10.242 -9.326 1.00 0.00 H -ATOM 1454 CB THR 94 -0.067 8.649 -9.032 1.00 0.00 C -ATOM 1455 HB THR 94 -0.736 7.854 -9.364 1.00 0.00 H -ATOM 1456 CG2 THR 94 0.619 9.083 -10.287 1.00 0.00 C -ATOM 1457 HG21 THR 94 0.893 8.181 -10.834 1.00 0.00 H -ATOM 1458 HG22 THR 94 -0.024 9.727 -10.886 1.00 0.00 H -ATOM 1459 HG23 THR 94 1.463 9.725 -10.038 1.00 0.00 H -ATOM 1460 OG1 THR 94 0.763 7.991 -8.079 1.00 0.00 O -ATOM 1461 HG1 THR 94 1.580 8.482 -8.189 1.00 0.00 H -ATOM 1462 C THR 94 -1.887 9.272 -7.518 1.00 0.00 C -ATOM 1463 O THR 94 -2.846 8.761 -8.111 1.00 0.00 O -ATOM 1464 N GLY 95 -1.837 9.424 -6.226 1.00 0.00 N -ATOM 1465 H GLY 95 -0.938 9.709 -5.862 1.00 0.00 H -ATOM 1466 CA GLY 95 -2.881 9.240 -5.225 1.00 0.00 C -ATOM 1467 HA2 GLY 95 -2.975 10.140 -4.616 1.00 0.00 H -ATOM 1468 HA3 GLY 95 -3.874 9.149 -5.664 1.00 0.00 H -ATOM 1469 C GLY 95 -2.769 7.933 -4.356 1.00 0.00 C -ATOM 1470 O GLY 95 -3.785 7.241 -4.115 1.00 0.00 O -ATOM 1471 N LYS 96 -1.578 7.547 -3.938 1.00 0.00 N -ATOM 1472 H LYS 96 -0.827 8.148 -4.246 1.00 0.00 H -ATOM 1473 CA LYS 96 -1.257 6.330 -3.200 1.00 0.00 C -ATOM 1474 HA LYS 96 -1.725 5.469 -3.676 1.00 0.00 H -ATOM 1475 CB LYS 96 0.287 6.214 -3.187 1.00 0.00 C -ATOM 1476 HB2 LYS 96 0.692 7.082 -2.667 1.00 0.00 H -ATOM 1477 HB3 LYS 96 0.619 5.436 -2.501 1.00 0.00 H -ATOM 1478 CG LYS 96 0.825 6.020 -4.650 1.00 0.00 C -ATOM 1479 HG2 LYS 96 0.417 5.073 -5.006 1.00 0.00 H -ATOM 1480 HG3 LYS 96 0.460 6.789 -5.332 1.00 0.00 H -ATOM 1481 CD LYS 96 2.417 6.059 -4.522 1.00 0.00 C -ATOM 1482 HD2 LYS 96 2.755 5.306 -3.810 1.00 0.00 H -ATOM 1483 HD3 LYS 96 2.865 5.862 -5.497 1.00 0.00 H -ATOM 1484 CE LYS 96 3.154 7.321 -4.061 1.00 0.00 C -ATOM 1485 HE2 LYS 96 3.049 7.529 -2.996 1.00 0.00 H -ATOM 1486 HE3 LYS 96 4.235 7.177 -4.060 1.00 0.00 H -ATOM 1487 NZ LYS 96 2.752 8.508 -4.868 1.00 0.00 N -ATOM 1488 HZ1 LYS 96 2.831 8.331 -5.858 1.00 0.00 H -ATOM 1489 HZ2 LYS 96 1.780 8.749 -4.733 1.00 0.00 H -ATOM 1490 HZ3 LYS 96 3.323 9.260 -4.508 1.00 0.00 H -ATOM 1491 C LYS 96 -1.853 6.402 -1.854 1.00 0.00 C -ATOM 1492 O LYS 96 -2.583 5.497 -1.454 1.00 0.00 O -ATOM 1493 N THR 97 -1.631 7.505 -1.047 1.00 0.00 N -ATOM 1494 H THR 97 -1.308 8.276 -1.612 1.00 0.00 H -ATOM 1495 CA THR 97 -2.287 7.721 0.265 1.00 0.00 C -ATOM 1496 HA THR 97 -2.086 6.870 0.915 1.00 0.00 H -ATOM 1497 CB THR 97 -1.688 8.912 0.993 1.00 0.00 C -ATOM 1498 HB THR 97 -1.774 9.859 0.459 1.00 0.00 H -ATOM 1499 CG2 THR 97 -2.323 9.049 2.396 1.00 0.00 C -ATOM 1500 HG21 THR 97 -1.994 8.186 2.975 1.00 0.00 H -ATOM 1501 HG22 THR 97 -1.838 9.899 2.878 1.00 0.00 H -ATOM 1502 HG23 THR 97 -3.398 9.179 2.521 1.00 0.00 H -ATOM 1503 OG1 THR 97 -0.303 8.656 1.084 1.00 0.00 O -ATOM 1504 HG1 THR 97 -0.188 7.864 1.615 1.00 0.00 H -ATOM 1505 C THR 97 -3.779 8.203 0.043 1.00 0.00 C -ATOM 1506 O THR 97 -4.616 7.837 0.829 1.00 0.00 O -ATOM 1507 N PHE 98 -4.038 8.851 -1.069 1.00 0.00 N -ATOM 1508 H PHE 98 -3.291 9.138 -1.685 1.00 0.00 H -ATOM 1509 CA PHE 98 -5.432 9.173 -1.414 1.00 0.00 C -ATOM 1510 HA PHE 98 -5.970 9.658 -0.600 1.00 0.00 H -ATOM 1511 CB PHE 98 -5.474 9.994 -2.685 1.00 0.00 C -ATOM 1512 HB2 PHE 98 -4.830 10.869 -2.596 1.00 0.00 H -ATOM 1513 HB3 PHE 98 -5.011 9.408 -3.479 1.00 0.00 H -ATOM 1514 CG PHE 98 -6.781 10.417 -3.198 1.00 0.00 C -ATOM 1515 CD1 PHE 98 -7.568 9.811 -4.154 1.00 0.00 C -ATOM 1516 HD1 PHE 98 -7.273 8.825 -4.482 1.00 0.00 H -ATOM 1517 CE1 PHE 98 -8.795 10.359 -4.505 1.00 0.00 C -ATOM 1518 HE1 PHE 98 -9.418 9.736 -5.130 1.00 0.00 H -ATOM 1519 CZ PHE 98 -9.247 11.509 -3.861 1.00 0.00 C -ATOM 1520 HZ PHE 98 -10.263 11.797 -4.088 1.00 0.00 H -ATOM 1521 CE2 PHE 98 -8.477 12.152 -2.886 1.00 0.00 C -ATOM 1522 HE2 PHE 98 -8.814 13.064 -2.415 1.00 0.00 H -ATOM 1523 CD2 PHE 98 -7.237 11.639 -2.551 1.00 0.00 C -ATOM 1524 HD2 PHE 98 -6.526 12.044 -1.845 1.00 0.00 H -ATOM 1525 C PHE 98 -6.211 7.889 -1.618 1.00 0.00 C -ATOM 1526 O PHE 98 -7.370 7.770 -1.270 1.00 0.00 O -ATOM 1527 N THR 99 -5.575 6.803 -2.098 1.00 0.00 N -ATOM 1528 H THR 99 -4.625 6.937 -2.416 1.00 0.00 H -ATOM 1529 CA THR 99 -6.162 5.519 -2.301 1.00 0.00 C -ATOM 1530 HA THR 99 -7.134 5.704 -2.758 1.00 0.00 H -ATOM 1531 CB THR 99 -5.325 4.615 -3.248 1.00 0.00 C -ATOM 1532 HB THR 99 -4.277 4.636 -2.948 1.00 0.00 H -ATOM 1533 CG2 THR 99 -5.939 3.237 -3.458 1.00 0.00 C -ATOM 1534 HG21 THR 99 -5.696 2.909 -4.470 1.00 0.00 H -ATOM 1535 HG22 THR 99 -5.450 2.537 -2.781 1.00 0.00 H -ATOM 1536 HG23 THR 99 -7.024 3.296 -3.377 1.00 0.00 H -ATOM 1537 OG1 THR 99 -5.340 5.190 -4.513 1.00 0.00 O -ATOM 1538 HG1 THR 99 -5.106 6.108 -4.355 1.00 0.00 H -ATOM 1539 C THR 99 -6.345 4.886 -0.919 1.00 0.00 C -ATOM 1540 O THR 99 -7.415 4.373 -0.616 1.00 0.00 O -ATOM 1541 N MET 100 -5.253 4.966 -0.042 1.00 0.00 N -ATOM 1542 H MET 100 -4.425 5.451 -0.358 1.00 0.00 H -ATOM 1543 CA MET 100 -5.144 4.335 1.279 1.00 0.00 C -ATOM 1544 HA MET 100 -5.586 3.339 1.242 1.00 0.00 H -ATOM 1545 CB MET 100 -3.686 4.100 1.686 1.00 0.00 C -ATOM 1546 HB2 MET 100 -3.134 4.175 0.749 1.00 0.00 H -ATOM 1547 HB3 MET 100 -3.327 4.851 2.389 1.00 0.00 H -ATOM 1548 CG MET 100 -3.462 2.711 2.347 1.00 0.00 C -ATOM 1549 HG2 MET 100 -2.416 2.674 2.647 1.00 0.00 H -ATOM 1550 HG3 MET 100 -4.074 2.488 3.221 1.00 0.00 H -ATOM 1551 SD MET 100 -3.707 1.407 1.193 1.00 0.00 S -ATOM 1552 CE MET 100 -2.340 1.637 -0.035 1.00 0.00 C -ATOM 1553 HE1 MET 100 -2.278 0.729 -0.635 1.00 0.00 H -ATOM 1554 HE2 MET 100 -2.615 2.500 -0.642 1.00 0.00 H -ATOM 1555 HE3 MET 100 -1.461 1.883 0.560 1.00 0.00 H -ATOM 1556 C MET 100 -6.023 5.000 2.359 1.00 0.00 C -ATOM 1557 O MET 100 -6.662 4.305 3.068 1.00 0.00 O -ATOM 1558 N GLU 101 -5.930 6.296 2.580 1.00 0.00 N -ATOM 1559 H GLU 101 -5.389 6.918 1.996 1.00 0.00 H -ATOM 1560 CA GLU 101 -6.776 7.036 3.450 1.00 0.00 C -ATOM 1561 HA GLU 101 -7.203 6.349 4.180 1.00 0.00 H -ATOM 1562 CB GLU 101 -5.975 8.152 4.230 1.00 0.00 C -ATOM 1563 HB2 GLU 101 -5.361 8.793 3.597 1.00 0.00 H -ATOM 1564 HB3 GLU 101 -6.698 8.780 4.751 1.00 0.00 H -ATOM 1565 CG GLU 101 -5.038 7.708 5.370 1.00 0.00 C -ATOM 1566 HG2 GLU 101 -5.513 7.147 6.174 1.00 0.00 H -ATOM 1567 HG3 GLU 101 -4.297 7.073 4.884 1.00 0.00 H -ATOM 1568 CD GLU 101 -4.324 8.940 5.997 1.00 0.00 C -ATOM 1569 OE1 GLU 101 -3.962 8.863 7.187 1.00 0.00 O -ATOM 1570 OE2 GLU 101 -4.234 10.048 5.342 1.00 0.00 O -ATOM 1571 C GLU 101 -7.893 7.803 2.723 1.00 0.00 C -ATOM 1572 O GLU 101 -9.048 7.601 3.060 1.00 0.00 O -ATOM 1573 N GLY 102 -7.580 8.535 1.634 1.00 0.00 N -ATOM 1574 H GLY 102 -6.641 8.544 1.263 1.00 0.00 H -ATOM 1575 CA GLY 102 -8.635 9.425 1.058 1.00 0.00 C -ATOM 1576 HA2 GLY 102 -8.186 9.953 0.218 1.00 0.00 H -ATOM 1577 HA3 GLY 102 -9.479 8.802 0.763 1.00 0.00 H -ATOM 1578 C GLY 102 -8.997 10.451 2.147 1.00 0.00 C -ATOM 1579 O GLY 102 -8.156 10.918 2.870 1.00 0.00 O -ATOM 1580 N GLU 103 -10.183 10.954 1.972 1.00 0.00 N -ATOM 1581 H GLU 103 -10.798 10.580 1.263 1.00 0.00 H -ATOM 1582 CA GLU 103 -10.791 11.906 2.926 1.00 0.00 C -ATOM 1583 HA GLU 103 -10.062 12.000 3.731 1.00 0.00 H -ATOM 1584 CB GLU 103 -11.158 13.294 2.289 1.00 0.00 C -ATOM 1585 HB2 GLU 103 -12.053 13.207 1.673 1.00 0.00 H -ATOM 1586 HB3 GLU 103 -11.626 14.035 2.936 1.00 0.00 H -ATOM 1587 CG GLU 103 -10.012 13.955 1.547 1.00 0.00 C -ATOM 1588 HG2 GLU 103 -9.512 13.246 0.888 1.00 0.00 H -ATOM 1589 HG3 GLU 103 -10.401 14.826 1.020 1.00 0.00 H -ATOM 1590 CD GLU 103 -8.900 14.572 2.498 1.00 0.00 C -ATOM 1591 OE1 GLU 103 -7.747 14.809 2.049 1.00 0.00 O -ATOM 1592 OE2 GLU 103 -9.217 14.731 3.731 1.00 0.00 O -ATOM 1593 C GLU 103 -12.116 11.357 3.579 1.00 0.00 C -ATOM 1594 O GLU 103 -12.967 10.745 2.886 1.00 0.00 O -ATOM 1595 N ARG 104 -12.454 11.776 4.808 1.00 0.00 N -ATOM 1596 H ARG 104 -11.749 12.267 5.340 1.00 0.00 H -ATOM 1597 CA ARG 104 -13.651 11.301 5.526 1.00 0.00 C -ATOM 1598 HA ARG 104 -13.886 10.288 5.199 1.00 0.00 H -ATOM 1599 CB ARG 104 -13.326 11.341 7.027 1.00 0.00 C -ATOM 1600 HB2 ARG 104 -12.989 12.345 7.284 1.00 0.00 H -ATOM 1601 HB3 ARG 104 -14.249 11.185 7.585 1.00 0.00 H -ATOM 1602 CG ARG 104 -12.284 10.283 7.448 1.00 0.00 C -ATOM 1603 HG2 ARG 104 -12.542 9.298 7.061 1.00 0.00 H -ATOM 1604 HG3 ARG 104 -11.308 10.546 7.037 1.00 0.00 H -ATOM 1605 CD ARG 104 -12.211 10.159 8.956 1.00 0.00 C -ATOM 1606 HD2 ARG 104 -13.014 9.540 9.357 1.00 0.00 H -ATOM 1607 HD3 ARG 104 -11.389 9.539 9.311 1.00 0.00 H -ATOM 1608 NE ARG 104 -12.050 11.432 9.677 1.00 0.00 N -ATOM 1609 HE ARG 104 -12.775 11.862 10.232 1.00 0.00 H -ATOM 1610 CZ ARG 104 -10.833 12.045 9.897 1.00 0.00 C -ATOM 1611 NH1 ARG 104 -9.710 11.443 9.695 1.00 0.00 N -ATOM 1612 HH11 ARG 104 -9.627 10.525 9.282 1.00 0.00 H -ATOM 1613 HH12 ARG 104 -8.900 11.995 9.938 1.00 0.00 H -ATOM 1614 NH2 ARG 104 -10.724 13.268 10.374 1.00 0.00 N -ATOM 1615 HH21 ARG 104 -11.520 13.834 10.634 1.00 0.00 H -ATOM 1616 HH22 ARG 104 -9.808 13.667 10.223 1.00 0.00 H -ATOM 1617 C ARG 104 -14.883 12.164 5.302 1.00 0.00 C -ATOM 1618 O ARG 104 -14.820 13.295 4.757 1.00 0.00 O -ATOM 1619 N SER 105 -16.031 11.753 5.858 1.00 0.00 N -ATOM 1620 H SER 105 -15.911 10.932 6.435 1.00 0.00 H -ATOM 1621 CA SER 105 -17.320 12.438 5.927 1.00 0.00 C -ATOM 1622 HA SER 105 -17.259 13.366 5.357 1.00 0.00 H -ATOM 1623 CB SER 105 -18.329 11.726 5.088 1.00 0.00 C -ATOM 1624 HB2 SER 105 -19.263 12.280 5.004 1.00 0.00 H -ATOM 1625 HB3 SER 105 -18.058 11.634 4.036 1.00 0.00 H -ATOM 1626 OG SER 105 -18.547 10.433 5.626 1.00 0.00 O -ATOM 1627 HG SER 105 -17.982 9.861 5.100 1.00 0.00 H -ATOM 1628 C SER 105 -17.743 12.665 7.441 1.00 0.00 C -ATOM 1629 O SER 105 -16.974 12.138 8.293 1.00 0.00 O -ATOM 1630 N PRO 106 -18.844 13.384 7.720 1.00 0.00 N -ATOM 1631 CD PRO 106 -19.573 14.299 6.801 1.00 0.00 C -ATOM 1632 HD2 PRO 106 -20.544 13.919 6.484 1.00 0.00 H -ATOM 1633 HD3 PRO 106 -18.956 14.611 5.958 1.00 0.00 H -ATOM 1634 CG PRO 106 -19.710 15.467 7.773 1.00 0.00 C -ATOM 1635 HG2 PRO 106 -20.446 16.176 7.392 1.00 0.00 H -ATOM 1636 HG3 PRO 106 -18.777 15.964 8.043 1.00 0.00 H -ATOM 1637 CB PRO 106 -20.216 14.779 9.013 1.00 0.00 C -ATOM 1638 HB2 PRO 106 -21.243 14.443 8.876 1.00 0.00 H -ATOM 1639 HB3 PRO 106 -20.188 15.428 9.889 1.00 0.00 H -ATOM 1640 CA PRO 106 -19.276 13.579 9.096 1.00 0.00 C -ATOM 1641 HA PRO 106 -18.425 13.995 9.633 1.00 0.00 H -ATOM 1642 C PRO 106 -19.813 12.251 9.776 1.00 0.00 C -ATOM 1643 O PRO 106 -20.121 11.188 9.165 1.00 0.00 O -ATOM 1644 N ASN 107 -20.150 12.465 11.060 1.00 0.00 N -ATOM 1645 H ASN 107 -19.954 13.359 11.487 1.00 0.00 H -ATOM 1646 CA ASN 107 -20.437 11.341 11.906 1.00 0.00 C -ATOM 1647 HA ASN 107 -19.596 10.658 11.778 1.00 0.00 H -ATOM 1648 CB ASN 107 -20.515 11.765 13.458 1.00 0.00 C -ATOM 1649 HB2 ASN 107 -21.099 12.686 13.455 1.00 0.00 H -ATOM 1650 HB3 ASN 107 -21.001 10.968 14.018 1.00 0.00 H -ATOM 1651 CG ASN 107 -19.285 12.031 14.150 1.00 0.00 C -ATOM 1652 OD1 ASN 107 -18.352 12.422 13.470 1.00 0.00 O -ATOM 1653 ND2 ASN 107 -19.267 12.030 15.389 1.00 0.00 N -ATOM 1654 HD21 ASN 107 -18.447 12.429 15.824 1.00 0.00 H -ATOM 1655 HD22 ASN 107 -20.114 11.887 15.920 1.00 0.00 H -ATOM 1656 C ASN 107 -21.670 10.525 11.529 1.00 0.00 C -ATOM 1657 O ASN 107 -22.814 11.006 11.501 1.00 0.00 O -ATOM 1658 N GLU 108 -21.488 9.287 11.248 1.00 0.00 N -ATOM 1659 H GLU 108 -20.544 8.932 11.188 1.00 0.00 H -ATOM 1660 CA GLU 108 -22.529 8.333 10.815 1.00 0.00 C -ATOM 1661 HA GLU 108 -22.069 7.373 10.585 1.00 0.00 H -ATOM 1662 CB GLU 108 -23.487 8.000 12.023 1.00 0.00 C -ATOM 1663 HB2 GLU 108 -24.042 8.902 12.281 1.00 0.00 H -ATOM 1664 HB3 GLU 108 -24.100 7.127 11.800 1.00 0.00 H -ATOM 1665 CG GLU 108 -22.738 7.690 13.325 1.00 0.00 C -ATOM 1666 HG2 GLU 108 -22.276 8.624 13.646 1.00 0.00 H -ATOM 1667 HG3 GLU 108 -23.493 7.425 14.065 1.00 0.00 H -ATOM 1668 CD GLU 108 -21.736 6.526 13.340 1.00 0.00 C -ATOM 1669 OE1 GLU 108 -22.182 5.372 13.168 1.00 0.00 O -ATOM 1670 OE2 GLU 108 -20.516 6.760 13.355 1.00 0.00 O -ATOM 1671 C GLU 108 -23.428 8.754 9.671 1.00 0.00 C -ATOM 1672 O GLU 108 -24.420 8.067 9.379 1.00 0.00 O -ATOM 1673 N GLU 109 -23.079 9.819 8.906 1.00 0.00 N -ATOM 1674 H GLU 109 -22.327 10.362 9.305 1.00 0.00 H -ATOM 1675 CA GLU 109 -23.886 10.331 7.766 1.00 0.00 C -ATOM 1676 HA GLU 109 -24.879 10.523 8.172 1.00 0.00 H -ATOM 1677 CB GLU 109 -23.193 11.583 7.293 1.00 0.00 C -ATOM 1678 HB2 GLU 109 -23.026 12.252 8.137 1.00 0.00 H -ATOM 1679 HB3 GLU 109 -22.181 11.334 6.974 1.00 0.00 H -ATOM 1680 CG GLU 109 -23.948 12.368 6.213 1.00 0.00 C -ATOM 1681 HG2 GLU 109 -23.347 13.066 5.629 1.00 0.00 H -ATOM 1682 HG3 GLU 109 -24.401 11.662 5.517 1.00 0.00 H -ATOM 1683 CD GLU 109 -25.069 13.152 6.846 1.00 0.00 C -ATOM 1684 OE1 GLU 109 -26.003 12.653 7.508 1.00 0.00 O -ATOM 1685 OE2 GLU 109 -25.142 14.360 6.730 1.00 0.00 O -ATOM 1686 C GLU 109 -24.167 9.366 6.617 1.00 0.00 C -ATOM 1687 O GLU 109 -25.188 9.422 5.896 1.00 0.00 O -ATOM 1688 N TYR 110 -23.297 8.378 6.373 1.00 0.00 N -ATOM 1689 H TYR 110 -22.466 8.254 6.932 1.00 0.00 H -ATOM 1690 CA TYR 110 -23.383 7.386 5.292 1.00 0.00 C -ATOM 1691 HA TYR 110 -24.405 7.313 4.919 1.00 0.00 H -ATOM 1692 CB TYR 110 -22.502 7.937 4.160 1.00 0.00 C -ATOM 1693 HB2 TYR 110 -21.463 7.795 4.456 1.00 0.00 H -ATOM 1694 HB3 TYR 110 -22.504 7.262 3.303 1.00 0.00 H -ATOM 1695 CG TYR 110 -22.699 9.307 3.644 1.00 0.00 C -ATOM 1696 CD1 TYR 110 -23.826 9.692 2.838 1.00 0.00 C -ATOM 1697 HD1 TYR 110 -24.624 8.976 2.706 1.00 0.00 H -ATOM 1698 CE1 TYR 110 -23.936 10.988 2.345 1.00 0.00 C -ATOM 1699 HE1 TYR 110 -24.718 11.181 1.626 1.00 0.00 H -ATOM 1700 CZ TYR 110 -22.934 11.965 2.669 1.00 0.00 C -ATOM 1701 OH TYR 110 -22.975 13.175 2.077 1.00 0.00 O -ATOM 1702 HH TYR 110 -22.157 13.635 2.278 1.00 0.00 H -ATOM 1703 CE2 TYR 110 -21.809 11.646 3.449 1.00 0.00 C -ATOM 1704 HE2 TYR 110 -21.162 12.491 3.634 1.00 0.00 H -ATOM 1705 CD2 TYR 110 -21.648 10.294 3.861 1.00 0.00 C -ATOM 1706 HD2 TYR 110 -20.755 10.044 4.413 1.00 0.00 H -ATOM 1707 C TYR 110 -22.973 5.937 5.856 1.00 0.00 C -ATOM 1708 O TYR 110 -22.344 5.874 6.884 1.00 0.00 O -ATOM 1709 N THR 111 -23.147 4.863 5.066 1.00 0.00 N -ATOM 1710 H THR 111 -23.654 5.021 4.207 1.00 0.00 H -ATOM 1711 CA THR 111 -22.401 3.625 5.120 1.00 0.00 C -ATOM 1712 HA THR 111 -22.146 3.428 6.162 1.00 0.00 H -ATOM 1713 CB THR 111 -23.205 2.394 4.529 1.00 0.00 C -ATOM 1714 HB THR 111 -22.640 1.503 4.801 1.00 0.00 H -ATOM 1715 CG2 THR 111 -24.519 2.152 5.314 1.00 0.00 C -ATOM 1716 HG21 THR 111 -24.186 2.169 6.352 1.00 0.00 H -ATOM 1717 HG22 THR 111 -25.241 2.953 5.151 1.00 0.00 H -ATOM 1718 HG23 THR 111 -24.961 1.191 5.053 1.00 0.00 H -ATOM 1719 OG1 THR 111 -23.511 2.486 3.144 1.00 0.00 O -ATOM 1720 HG1 THR 111 -23.589 1.582 2.830 1.00 0.00 H -ATOM 1721 C THR 111 -21.114 3.704 4.351 1.00 0.00 C -ATOM 1722 O THR 111 -20.884 4.711 3.656 1.00 0.00 O -ATOM 1723 N TRP 112 -20.339 2.617 4.378 1.00 0.00 N -ATOM 1724 H TRP 112 -20.667 1.901 5.011 1.00 0.00 H -ATOM 1725 CA TRP 112 -19.039 2.314 3.791 1.00 0.00 C -ATOM 1726 HA TRP 112 -18.409 3.143 4.109 1.00 0.00 H -ATOM 1727 CB TRP 112 -18.532 0.943 4.242 1.00 0.00 C -ATOM 1728 HB2 TRP 112 -17.523 0.901 3.832 1.00 0.00 H -ATOM 1729 HB3 TRP 112 -18.201 0.989 5.279 1.00 0.00 H -ATOM 1730 CG TRP 112 -19.319 -0.328 3.950 1.00 0.00 C -ATOM 1731 CD1 TRP 112 -20.267 -0.940 4.778 1.00 0.00 C -ATOM 1732 HD1 TRP 112 -20.643 -0.522 5.700 1.00 0.00 H -ATOM 1733 NE1 TRP 112 -20.860 -1.954 4.024 1.00 0.00 N -ATOM 1734 HE1 TRP 112 -21.563 -2.583 4.386 1.00 0.00 H -ATOM 1735 CE2 TRP 112 -20.228 -2.171 2.834 1.00 0.00 C -ATOM 1736 CZ2 TRP 112 -20.455 -3.069 1.795 1.00 0.00 C -ATOM 1737 HZ2 TRP 112 -21.197 -3.842 1.922 1.00 0.00 H -ATOM 1738 CH2 TRP 112 -19.525 -3.131 0.750 1.00 0.00 C -ATOM 1739 HH2 TRP 112 -19.467 -3.922 0.017 1.00 0.00 H -ATOM 1740 CZ3 TRP 112 -18.552 -2.084 0.635 1.00 0.00 C -ATOM 1741 HZ3 TRP 112 -17.935 -1.906 -0.234 1.00 0.00 H -ATOM 1742 CE3 TRP 112 -18.465 -1.103 1.620 1.00 0.00 C -ATOM 1743 HE3 TRP 112 -17.755 -0.291 1.656 1.00 0.00 H -ATOM 1744 CD2 TRP 112 -19.248 -1.161 2.753 1.00 0.00 C -ATOM 1745 C TRP 112 -19.166 2.163 2.249 1.00 0.00 C -ATOM 1746 O TRP 112 -18.277 2.567 1.538 1.00 0.00 O -ATOM 1747 N GLU 113 -20.329 1.821 1.729 1.00 0.00 N -ATOM 1748 H GLU 113 -21.093 1.584 2.346 1.00 0.00 H -ATOM 1749 CA GLU 113 -20.728 2.013 0.317 1.00 0.00 C -ATOM 1750 HA GLU 113 -19.907 1.687 -0.321 1.00 0.00 H -ATOM 1751 CB GLU 113 -21.975 1.329 -0.097 1.00 0.00 C -ATOM 1752 HB2 GLU 113 -22.610 1.481 0.775 1.00 0.00 H -ATOM 1753 HB3 GLU 113 -22.289 1.837 -1.009 1.00 0.00 H -ATOM 1754 CG GLU 113 -21.688 -0.148 -0.367 1.00 0.00 C -ATOM 1755 HG2 GLU 113 -21.011 -0.211 -1.220 1.00 0.00 H -ATOM 1756 HG3 GLU 113 -21.217 -0.615 0.498 1.00 0.00 H -ATOM 1757 CD GLU 113 -22.866 -0.929 -0.758 1.00 0.00 C -ATOM 1758 OE1 GLU 113 -22.953 -1.505 -1.832 1.00 0.00 O -ATOM 1759 OE2 GLU 113 -23.714 -0.975 0.123 1.00 0.00 O -ATOM 1760 C GLU 113 -20.885 3.555 -0.014 1.00 0.00 C -ATOM 1761 O GLU 113 -20.102 4.071 -0.892 1.00 0.00 O -ATOM 1762 N GLU 114 -21.787 4.264 0.649 1.00 0.00 N -ATOM 1763 H GLU 114 -22.272 3.850 1.432 1.00 0.00 H -ATOM 1764 CA GLU 114 -22.262 5.627 0.261 1.00 0.00 C -ATOM 1765 HA GLU 114 -22.354 5.722 -0.820 1.00 0.00 H -ATOM 1766 CB GLU 114 -23.617 5.922 0.744 1.00 0.00 C -ATOM 1767 HB2 GLU 114 -23.662 5.845 1.830 1.00 0.00 H -ATOM 1768 HB3 GLU 114 -23.995 6.923 0.537 1.00 0.00 H -ATOM 1769 CG GLU 114 -24.723 5.000 0.135 1.00 0.00 C -ATOM 1770 HG2 GLU 114 -24.737 4.034 0.640 1.00 0.00 H -ATOM 1771 HG3 GLU 114 -25.715 5.394 0.360 1.00 0.00 H -ATOM 1772 CD GLU 114 -24.540 4.715 -1.387 1.00 0.00 C -ATOM 1773 OE1 GLU 114 -23.666 3.911 -1.851 1.00 0.00 O -ATOM 1774 OE2 GLU 114 -25.378 5.263 -2.144 1.00 0.00 O -ATOM 1775 C GLU 114 -21.405 6.874 0.683 1.00 0.00 C -ATOM 1776 O GLU 114 -21.648 8.009 0.291 1.00 0.00 O -ATOM 1777 N ASP 115 -20.287 6.656 1.368 1.00 0.00 N -ATOM 1778 H ASP 115 -20.248 5.720 1.747 1.00 0.00 H -ATOM 1779 CA ASP 115 -19.323 7.695 1.677 1.00 0.00 C -ATOM 1780 HA ASP 115 -19.776 8.502 2.252 1.00 0.00 H -ATOM 1781 CB ASP 115 -18.269 7.078 2.645 1.00 0.00 C -ATOM 1782 HB2 ASP 115 -18.789 6.789 3.559 1.00 0.00 H -ATOM 1783 HB3 ASP 115 -17.771 6.231 2.173 1.00 0.00 H -ATOM 1784 CG ASP 115 -17.302 8.141 2.982 1.00 0.00 C -ATOM 1785 OD1 ASP 115 -16.444 8.537 2.149 1.00 0.00 O -ATOM 1786 OD2 ASP 115 -17.484 8.772 4.024 1.00 0.00 O -ATOM 1787 C ASP 115 -18.659 8.263 0.456 1.00 0.00 C -ATOM 1788 O ASP 115 -18.048 7.555 -0.318 1.00 0.00 O -ATOM 1789 N PRO 116 -18.680 9.608 0.276 1.00 0.00 N -ATOM 1790 CD PRO 116 -19.128 10.689 1.145 1.00 0.00 C -ATOM 1791 HD2 PRO 116 -18.861 10.623 2.200 1.00 0.00 H -ATOM 1792 HD3 PRO 116 -20.199 10.884 1.107 1.00 0.00 H -ATOM 1793 CG PRO 116 -18.572 11.909 0.473 1.00 0.00 C -ATOM 1794 HG2 PRO 116 -17.559 12.095 0.831 1.00 0.00 H -ATOM 1795 HG3 PRO 116 -19.217 12.713 0.830 1.00 0.00 H -ATOM 1796 CB PRO 116 -18.647 11.664 -1.070 1.00 0.00 C -ATOM 1797 HB2 PRO 116 -17.925 12.190 -1.693 1.00 0.00 H -ATOM 1798 HB3 PRO 116 -19.659 11.818 -1.444 1.00 0.00 H -ATOM 1799 CA PRO 116 -18.253 10.146 -1.096 1.00 0.00 C -ATOM 1800 HA PRO 116 -18.808 9.538 -1.811 1.00 0.00 H -ATOM 1801 C PRO 116 -16.674 10.139 -1.512 1.00 0.00 C -ATOM 1802 O PRO 116 -16.405 10.204 -2.685 1.00 0.00 O -ATOM 1803 N LEU 117 -15.763 9.916 -0.569 1.00 0.00 N -ATOM 1804 H LEU 117 -16.123 9.618 0.327 1.00 0.00 H -ATOM 1805 CA LEU 117 -14.314 10.198 -0.780 1.00 0.00 C -ATOM 1806 HA LEU 117 -14.006 9.997 -1.806 1.00 0.00 H -ATOM 1807 CB LEU 117 -14.065 11.699 -0.451 1.00 0.00 C -ATOM 1808 HB2 LEU 117 -14.800 11.901 0.328 1.00 0.00 H -ATOM 1809 HB3 LEU 117 -13.090 11.891 -0.004 1.00 0.00 H -ATOM 1810 CG LEU 117 -14.242 12.736 -1.573 1.00 0.00 C -ATOM 1811 HG LEU 117 -15.231 12.533 -1.985 1.00 0.00 H -ATOM 1812 CD1 LEU 117 -14.187 14.140 -0.987 1.00 0.00 C -ATOM 1813 HD11 LEU 117 -14.771 14.255 -0.074 1.00 0.00 H -ATOM 1814 HD12 LEU 117 -13.151 14.426 -0.806 1.00 0.00 H -ATOM 1815 HD13 LEU 117 -14.535 14.825 -1.760 1.00 0.00 H -ATOM 1816 CD2 LEU 117 -13.237 12.605 -2.804 1.00 0.00 C -ATOM 1817 HD21 LEU 117 -13.248 11.593 -3.205 1.00 0.00 H -ATOM 1818 HD22 LEU 117 -13.630 13.292 -3.553 1.00 0.00 H -ATOM 1819 HD23 LEU 117 -12.198 12.684 -2.483 1.00 0.00 H -ATOM 1820 C LEU 117 -13.364 9.388 0.055 1.00 0.00 C -ATOM 1821 O LEU 117 -12.090 9.444 -0.014 1.00 0.00 O -ATOM 1822 N ALA 118 -13.879 8.456 0.843 1.00 0.00 N -ATOM 1823 H ALA 118 -14.883 8.458 0.953 1.00 0.00 H -ATOM 1824 CA ALA 118 -12.967 7.606 1.721 1.00 0.00 C -ATOM 1825 HA ALA 118 -12.449 8.311 2.370 1.00 0.00 H -ATOM 1826 CB ALA 118 -13.869 6.702 2.674 1.00 0.00 C -ATOM 1827 HB1 ALA 118 -14.669 6.300 2.052 1.00 0.00 H -ATOM 1828 HB2 ALA 118 -13.167 5.942 3.017 1.00 0.00 H -ATOM 1829 HB3 ALA 118 -14.345 7.312 3.442 1.00 0.00 H -ATOM 1830 C ALA 118 -12.070 6.676 0.853 1.00 0.00 C -ATOM 1831 O ALA 118 -12.533 6.107 -0.156 1.00 0.00 O -ATOM 1832 N GLY 119 -10.767 6.490 1.336 1.00 0.00 N -ATOM 1833 H GLY 119 -10.483 7.002 2.159 1.00 0.00 H -ATOM 1834 CA GLY 119 -9.865 5.439 0.947 1.00 0.00 C -ATOM 1835 HA2 GLY 119 -10.007 5.296 -0.124 1.00 0.00 H -ATOM 1836 HA3 GLY 119 -8.852 5.754 1.197 1.00 0.00 H -ATOM 1837 C GLY 119 -10.014 4.073 1.612 1.00 0.00 C -ATOM 1838 O GLY 119 -10.977 3.817 2.327 1.00 0.00 O -ATOM 1839 N ILE 120 -9.092 3.113 1.356 1.00 0.00 N -ATOM 1840 H ILE 120 -8.377 3.361 0.687 1.00 0.00 H -ATOM 1841 CA ILE 120 -9.176 1.737 1.927 1.00 0.00 C -ATOM 1842 HA ILE 120 -10.153 1.354 1.632 1.00 0.00 H -ATOM 1843 CB ILE 120 -8.138 0.795 1.417 1.00 0.00 C -ATOM 1844 HB ILE 120 -7.134 1.040 1.766 1.00 0.00 H -ATOM 1845 CG2 ILE 120 -8.566 -0.606 1.897 1.00 0.00 C -ATOM 1846 HG21 ILE 120 -7.885 -1.362 1.508 1.00 0.00 H -ATOM 1847 HG22 ILE 120 -8.559 -0.587 2.987 1.00 0.00 H -ATOM 1848 HG23 ILE 120 -9.549 -0.819 1.476 1.00 0.00 H -ATOM 1849 CG1 ILE 120 -8.145 0.702 -0.120 1.00 0.00 C -ATOM 1850 HG12 ILE 120 -9.112 0.272 -0.383 1.00 0.00 H -ATOM 1851 HG13 ILE 120 -8.128 1.733 -0.477 1.00 0.00 H -ATOM 1852 CD1 ILE 120 -6.946 0.064 -0.816 1.00 0.00 C -ATOM 1853 HD11 ILE 120 -6.695 -0.940 -0.471 1.00 0.00 H -ATOM 1854 HD12 ILE 120 -7.026 -0.055 -1.897 1.00 0.00 H -ATOM 1855 HD13 ILE 120 -6.044 0.664 -0.699 1.00 0.00 H -ATOM 1856 C ILE 120 -9.298 1.769 3.451 1.00 0.00 C -ATOM 1857 O ILE 120 -10.236 1.175 4.020 1.00 0.00 O -ATOM 1858 N ILE 121 -8.403 2.465 4.179 1.00 0.00 N -ATOM 1859 H ILE 121 -7.632 2.922 3.714 1.00 0.00 H -ATOM 1860 CA ILE 121 -8.365 2.567 5.690 1.00 0.00 C -ATOM 1861 HA ILE 121 -8.213 1.588 6.145 1.00 0.00 H -ATOM 1862 CB ILE 121 -7.125 3.383 6.143 1.00 0.00 C -ATOM 1863 HB ILE 121 -7.161 4.383 5.710 1.00 0.00 H -ATOM 1864 CG2 ILE 121 -7.177 3.621 7.687 1.00 0.00 C -ATOM 1865 HG21 ILE 121 -6.305 4.205 7.980 1.00 0.00 H -ATOM 1866 HG22 ILE 121 -8.067 4.162 8.012 1.00 0.00 H -ATOM 1867 HG23 ILE 121 -7.120 2.694 8.257 1.00 0.00 H -ATOM 1868 CG1 ILE 121 -5.769 2.829 5.698 1.00 0.00 C -ATOM 1869 HG12 ILE 121 -5.603 2.046 6.438 1.00 0.00 H -ATOM 1870 HG13 ILE 121 -5.804 2.470 4.669 1.00 0.00 H -ATOM 1871 CD1 ILE 121 -4.531 3.797 5.845 1.00 0.00 C -ATOM 1872 HD11 ILE 121 -3.605 3.255 5.652 1.00 0.00 H -ATOM 1873 HD12 ILE 121 -4.730 4.520 5.054 1.00 0.00 H -ATOM 1874 HD13 ILE 121 -4.407 4.248 6.829 1.00 0.00 H -ATOM 1875 C ILE 121 -9.700 3.037 6.258 1.00 0.00 C -ATOM 1876 O ILE 121 -10.298 2.217 6.938 1.00 0.00 O -ATOM 1877 N PRO 122 -10.165 4.275 5.991 1.00 0.00 N -ATOM 1878 CD PRO 122 -9.561 5.350 5.290 1.00 0.00 C -ATOM 1879 HD2 PRO 122 -9.134 5.082 4.323 1.00 0.00 H -ATOM 1880 HD3 PRO 122 -8.798 5.640 6.012 1.00 0.00 H -ATOM 1881 CG PRO 122 -10.600 6.427 5.218 1.00 0.00 C -ATOM 1882 HG2 PRO 122 -11.333 6.346 4.416 1.00 0.00 H -ATOM 1883 HG3 PRO 122 -10.179 7.427 5.312 1.00 0.00 H -ATOM 1884 CB PRO 122 -11.398 6.226 6.545 1.00 0.00 C -ATOM 1885 HB2 PRO 122 -12.363 6.713 6.404 1.00 0.00 H -ATOM 1886 HB3 PRO 122 -10.911 6.660 7.418 1.00 0.00 H -ATOM 1887 CA PRO 122 -11.408 4.711 6.727 1.00 0.00 C -ATOM 1888 HA PRO 122 -11.346 4.553 7.803 1.00 0.00 H -ATOM 1889 C PRO 122 -12.722 3.973 6.328 1.00 0.00 C -ATOM 1890 O PRO 122 -13.633 3.760 7.151 1.00 0.00 O -ATOM 1891 N ARG 123 -12.775 3.503 5.045 1.00 0.00 N -ATOM 1892 H ARG 123 -11.973 3.646 4.447 1.00 0.00 H -ATOM 1893 CA ARG 123 -13.865 2.648 4.487 1.00 0.00 C -ATOM 1894 HA ARG 123 -14.815 3.114 4.745 1.00 0.00 H -ATOM 1895 CB ARG 123 -13.731 2.554 2.952 1.00 0.00 C -ATOM 1896 HB2 ARG 123 -13.262 3.454 2.553 1.00 0.00 H -ATOM 1897 HB3 ARG 123 -13.086 1.732 2.640 1.00 0.00 H -ATOM 1898 CG ARG 123 -15.093 2.288 2.275 1.00 0.00 C -ATOM 1899 HG2 ARG 123 -15.447 1.285 2.510 1.00 0.00 H -ATOM 1900 HG3 ARG 123 -15.901 2.936 2.614 1.00 0.00 H -ATOM 1901 CD ARG 123 -14.981 2.439 0.709 1.00 0.00 C -ATOM 1902 HD2 ARG 123 -14.151 1.817 0.373 1.00 0.00 H -ATOM 1903 HD3 ARG 123 -15.881 2.066 0.219 1.00 0.00 H -ATOM 1904 NE ARG 123 -14.813 3.827 0.212 1.00 0.00 N -ATOM 1905 HE ARG 123 -13.878 4.176 0.060 1.00 0.00 H -ATOM 1906 CZ ARG 123 -15.747 4.712 -0.147 1.00 0.00 C -ATOM 1907 NH1 ARG 123 -17.040 4.614 0.133 1.00 0.00 N -ATOM 1908 HH11 ARG 123 -17.371 3.874 0.735 1.00 0.00 H -ATOM 1909 HH12 ARG 123 -17.613 5.440 0.029 1.00 0.00 H -ATOM 1910 NH2 ARG 123 -15.312 5.828 -0.589 1.00 0.00 N -ATOM 1911 HH21 ARG 123 -14.313 5.974 -0.633 1.00 0.00 H -ATOM 1912 HH22 ARG 123 -15.947 6.469 -1.043 1.00 0.00 H -ATOM 1913 C ARG 123 -13.933 1.319 5.159 1.00 0.00 C -ATOM 1914 O ARG 123 -15.012 0.869 5.550 1.00 0.00 O -ATOM 1915 N THR 124 -12.694 0.806 5.406 1.00 0.00 N -ATOM 1916 H THR 124 -11.795 1.240 5.254 1.00 0.00 H -ATOM 1917 CA THR 124 -12.611 -0.438 6.200 1.00 0.00 C -ATOM 1918 HA THR 124 -13.276 -1.155 5.718 1.00 0.00 H -ATOM 1919 CB THR 124 -11.177 -1.010 6.354 1.00 0.00 C -ATOM 1920 HB THR 124 -10.615 -0.177 6.777 1.00 0.00 H -ATOM 1921 CG2 THR 124 -11.069 -2.309 7.120 1.00 0.00 C -ATOM 1922 HG21 THR 124 -10.014 -2.531 7.279 1.00 0.00 H -ATOM 1923 HG22 THR 124 -11.384 -2.170 8.155 1.00 0.00 H -ATOM 1924 HG23 THR 124 -11.592 -3.152 6.669 1.00 0.00 H -ATOM 1925 OG1 THR 124 -10.681 -1.320 5.071 1.00 0.00 O -ATOM 1926 HG1 THR 124 -10.662 -0.451 4.663 1.00 0.00 H -ATOM 1927 C THR 124 -13.090 -0.204 7.594 1.00 0.00 C -ATOM 1928 O THR 124 -13.963 -0.925 8.069 1.00 0.00 O -ATOM 1929 N LEU 125 -12.551 0.765 8.353 1.00 0.00 N -ATOM 1930 H LEU 125 -11.837 1.310 7.893 1.00 0.00 H -ATOM 1931 CA LEU 125 -12.962 1.065 9.742 1.00 0.00 C -ATOM 1932 HA LEU 125 -12.701 0.237 10.401 1.00 0.00 H -ATOM 1933 CB LEU 125 -12.095 2.285 10.267 1.00 0.00 C -ATOM 1934 HB2 LEU 125 -12.290 3.078 9.544 1.00 0.00 H -ATOM 1935 HB3 LEU 125 -12.420 2.585 11.264 1.00 0.00 H -ATOM 1936 CG LEU 125 -10.577 1.949 10.381 1.00 0.00 C -ATOM 1937 HG LEU 125 -10.261 1.354 9.524 1.00 0.00 H -ATOM 1938 CD1 LEU 125 -9.916 3.318 10.512 1.00 0.00 C -ATOM 1939 HD11 LEU 125 -10.420 3.978 11.219 1.00 0.00 H -ATOM 1940 HD12 LEU 125 -8.860 3.243 10.771 1.00 0.00 H -ATOM 1941 HD13 LEU 125 -10.137 3.845 9.584 1.00 0.00 H -ATOM 1942 CD2 LEU 125 -10.324 1.129 11.658 1.00 0.00 C -ATOM 1943 HD21 LEU 125 -9.246 0.973 11.696 1.00 0.00 H -ATOM 1944 HD22 LEU 125 -10.709 1.629 12.547 1.00 0.00 H -ATOM 1945 HD23 LEU 125 -10.784 0.143 11.588 1.00 0.00 H -ATOM 1946 C LEU 125 -14.543 1.257 9.872 1.00 0.00 C -ATOM 1947 O LEU 125 -15.177 0.969 10.875 1.00 0.00 O -ATOM 1948 N HIE 126 -15.164 1.914 8.834 1.00 0.00 N -ATOM 1949 H HIE 126 -14.575 2.185 8.060 1.00 0.00 H -ATOM 1950 CA HIE 126 -16.630 2.093 8.753 1.00 0.00 C -ATOM 1951 HA HIE 126 -16.908 2.562 9.697 1.00 0.00 H -ATOM 1952 CB HIE 126 -16.751 3.119 7.691 1.00 0.00 C -ATOM 1953 HB2 HIE 126 -16.001 3.870 7.937 1.00 0.00 H -ATOM 1954 HB3 HIE 126 -16.502 2.581 6.775 1.00 0.00 H -ATOM 1955 CG HIE 126 -17.986 3.964 7.482 1.00 0.00 C -ATOM 1956 ND1 HIE 126 -17.930 5.109 6.649 1.00 0.00 N -ATOM 1957 CE1 HIE 126 -19.136 5.663 6.742 1.00 0.00 C -ATOM 1958 HE1 HIE 126 -19.465 6.510 6.159 1.00 0.00 H -ATOM 1959 NE2 HIE 126 -19.887 4.961 7.628 1.00 0.00 N -ATOM 1960 HE2 HIE 126 -20.888 5.007 7.756 1.00 0.00 H -ATOM 1961 CD2 HIE 126 -19.130 3.926 8.189 1.00 0.00 C -ATOM 1962 HD2 HIE 126 -19.452 3.177 8.897 1.00 0.00 H -ATOM 1963 C HIE 126 -17.457 0.867 8.507 1.00 0.00 C -ATOM 1964 O HIE 126 -18.699 0.907 8.667 1.00 0.00 O -ATOM 1965 N GLN 127 -16.752 -0.243 8.200 1.00 0.00 N -ATOM 1966 H GLN 127 -15.748 -0.135 8.180 1.00 0.00 H -ATOM 1967 CA GLN 127 -17.325 -1.565 7.858 1.00 0.00 C -ATOM 1968 HA GLN 127 -18.407 -1.624 7.987 1.00 0.00 H -ATOM 1969 CB GLN 127 -17.099 -1.886 6.372 1.00 0.00 C -ATOM 1970 HB2 GLN 127 -17.358 -1.054 5.715 1.00 0.00 H -ATOM 1971 HB3 GLN 127 -16.020 -2.000 6.267 1.00 0.00 H -ATOM 1972 CG GLN 127 -17.880 -3.142 5.896 1.00 0.00 C -ATOM 1973 HG2 GLN 127 -17.582 -4.009 6.485 1.00 0.00 H -ATOM 1974 HG3 GLN 127 -18.925 -2.926 6.113 1.00 0.00 H -ATOM 1975 CD GLN 127 -17.540 -3.550 4.468 1.00 0.00 C -ATOM 1976 OE1 GLN 127 -16.442 -3.359 4.020 1.00 0.00 O -ATOM 1977 NE2 GLN 127 -18.328 -4.311 3.868 1.00 0.00 N -ATOM 1978 HE21 GLN 127 -18.009 -4.548 2.939 1.00 0.00 H -ATOM 1979 HE22 GLN 127 -19.226 -4.607 4.221 1.00 0.00 H -ATOM 1980 C GLN 127 -16.864 -2.717 8.839 1.00 0.00 C -ATOM 1981 O GLN 127 -17.684 -3.655 9.039 1.00 0.00 O -ATOM 1982 N ILE 128 -15.676 -2.734 9.506 1.00 0.00 N -ATOM 1983 H ILE 128 -15.022 -1.983 9.337 1.00 0.00 H -ATOM 1984 CA ILE 128 -15.065 -3.927 10.112 1.00 0.00 C -ATOM 1985 HA ILE 128 -15.165 -4.757 9.413 1.00 0.00 H -ATOM 1986 CB ILE 128 -13.523 -3.591 10.358 1.00 0.00 C -ATOM 1987 HB ILE 128 -13.057 -3.389 9.393 1.00 0.00 H -ATOM 1988 CG2 ILE 128 -13.238 -2.357 11.244 1.00 0.00 C -ATOM 1989 HG21 ILE 128 -13.963 -1.622 10.894 1.00 0.00 H -ATOM 1990 HG22 ILE 128 -13.476 -2.629 12.272 1.00 0.00 H -ATOM 1991 HG23 ILE 128 -12.225 -2.012 11.038 1.00 0.00 H -ATOM 1992 CG1 ILE 128 -12.782 -4.788 11.080 1.00 0.00 C -ATOM 1993 HG12 ILE 128 -13.019 -4.873 12.141 1.00 0.00 H -ATOM 1994 HG13 ILE 128 -13.166 -5.686 10.595 1.00 0.00 H -ATOM 1995 CD1 ILE 128 -11.289 -4.545 10.998 1.00 0.00 C -ATOM 1996 HD11 ILE 128 -10.883 -4.348 10.005 1.00 0.00 H -ATOM 1997 HD12 ILE 128 -10.921 -3.591 11.375 1.00 0.00 H -ATOM 1998 HD13 ILE 128 -10.721 -5.311 11.525 1.00 0.00 H -ATOM 1999 C ILE 128 -15.779 -4.452 11.348 1.00 0.00 C -ATOM 2000 O ILE 128 -15.943 -5.638 11.496 1.00 0.00 O -ATOM 2001 N PHE 129 -16.176 -3.556 12.225 1.00 0.00 N -ATOM 2002 H PHE 129 -16.101 -2.580 11.976 1.00 0.00 H -ATOM 2003 CA PHE 129 -16.873 -3.918 13.471 1.00 0.00 C -ATOM 2004 HA PHE 129 -16.409 -4.771 13.966 1.00 0.00 H -ATOM 2005 CB PHE 129 -16.856 -2.698 14.365 1.00 0.00 C -ATOM 2006 HB2 PHE 129 -17.519 -2.039 13.803 1.00 0.00 H -ATOM 2007 HB3 PHE 129 -17.408 -2.923 15.278 1.00 0.00 H -ATOM 2008 CG PHE 129 -15.551 -2.062 14.669 1.00 0.00 C -ATOM 2009 CD1 PHE 129 -14.701 -2.653 15.585 1.00 0.00 C -ATOM 2010 HD1 PHE 129 -15.074 -3.479 16.170 1.00 0.00 H -ATOM 2011 CE1 PHE 129 -13.442 -2.061 15.916 1.00 0.00 C -ATOM 2012 HE1 PHE 129 -12.799 -2.402 16.714 1.00 0.00 H -ATOM 2013 CZ PHE 129 -13.129 -0.873 15.238 1.00 0.00 C -ATOM 2014 HZ PHE 129 -12.237 -0.340 15.532 1.00 0.00 H -ATOM 2015 CE2 PHE 129 -13.996 -0.227 14.364 1.00 0.00 C -ATOM 2016 HE2 PHE 129 -13.623 0.550 13.710 1.00 0.00 H -ATOM 2017 CD2 PHE 129 -15.184 -0.870 14.058 1.00 0.00 C -ATOM 2018 HD2 PHE 129 -15.842 -0.503 13.284 1.00 0.00 H -ATOM 2019 C PHE 129 -18.303 -4.434 13.165 1.00 0.00 C -ATOM 2020 O PHE 129 -18.702 -5.441 13.724 1.00 0.00 O -ATOM 2021 N GLU 130 -18.979 -3.873 12.173 1.00 0.00 N -ATOM 2022 H GLU 130 -18.606 -3.037 11.744 1.00 0.00 H -ATOM 2023 CA GLU 130 -20.307 -4.306 11.724 1.00 0.00 C -ATOM 2024 HA GLU 130 -20.903 -4.410 12.631 1.00 0.00 H -ATOM 2025 CB GLU 130 -20.811 -3.272 10.682 1.00 0.00 C -ATOM 2026 HB2 GLU 130 -20.849 -2.293 11.161 1.00 0.00 H -ATOM 2027 HB3 GLU 130 -20.037 -3.067 9.943 1.00 0.00 H -ATOM 2028 CG GLU 130 -22.160 -3.519 10.107 1.00 0.00 C -ATOM 2029 HG2 GLU 130 -22.259 -3.020 9.144 1.00 0.00 H -ATOM 2030 HG3 GLU 130 -22.239 -4.577 9.858 1.00 0.00 H -ATOM 2031 CD GLU 130 -23.369 -3.109 10.998 1.00 0.00 C -ATOM 2032 OE1 GLU 130 -24.305 -2.358 10.619 1.00 0.00 O -ATOM 2033 OE2 GLU 130 -23.359 -3.539 12.185 1.00 0.00 O -ATOM 2034 C GLU 130 -20.208 -5.681 11.056 1.00 0.00 C -ATOM 2035 O GLU 130 -20.925 -6.653 11.373 1.00 0.00 O -ATOM 2036 N LYS 131 -19.260 -5.844 10.059 1.00 0.00 N -ATOM 2037 H LYS 131 -18.735 -5.032 9.766 1.00 0.00 H -ATOM 2038 CA LYS 131 -19.102 -7.079 9.290 1.00 0.00 C -ATOM 2039 HA LYS 131 -20.039 -7.411 8.844 1.00 0.00 H -ATOM 2040 CB LYS 131 -18.082 -6.680 8.169 1.00 0.00 C -ATOM 2041 HB2 LYS 131 -18.537 -5.942 7.509 1.00 0.00 H -ATOM 2042 HB3 LYS 131 -17.197 -6.195 8.581 1.00 0.00 H -ATOM 2043 CG LYS 131 -17.771 -7.796 7.171 1.00 0.00 C -ATOM 2044 HG2 LYS 131 -16.901 -7.482 6.595 1.00 0.00 H -ATOM 2045 HG3 LYS 131 -17.454 -8.732 7.634 1.00 0.00 H -ATOM 2046 CD LYS 131 -19.001 -7.955 6.265 1.00 0.00 C -ATOM 2047 HD2 LYS 131 -19.547 -8.822 6.638 1.00 0.00 H -ATOM 2048 HD3 LYS 131 -19.671 -7.104 6.392 1.00 0.00 H -ATOM 2049 CE LYS 131 -18.656 -8.050 4.735 1.00 0.00 C -ATOM 2050 HE2 LYS 131 -18.305 -7.091 4.355 1.00 0.00 H -ATOM 2051 HE3 LYS 131 -17.865 -8.798 4.708 1.00 0.00 H -ATOM 2052 NZ LYS 131 -19.733 -8.603 3.921 1.00 0.00 N -ATOM 2053 HZ1 LYS 131 -19.351 -8.668 2.989 1.00 0.00 H -ATOM 2054 HZ2 LYS 131 -20.041 -9.504 4.257 1.00 0.00 H -ATOM 2055 HZ3 LYS 131 -20.582 -8.055 3.900 1.00 0.00 H -ATOM 2056 C LYS 131 -18.590 -8.245 10.139 1.00 0.00 C -ATOM 2057 O LYS 131 -18.914 -9.379 9.884 1.00 0.00 O -ATOM 2058 N LEU 132 -17.928 -7.994 11.259 1.00 0.00 N -ATOM 2059 H LEU 132 -17.381 -7.146 11.251 1.00 0.00 H -ATOM 2060 CA LEU 132 -17.522 -9.050 12.267 1.00 0.00 C -ATOM 2061 HA LEU 132 -17.336 -10.011 11.787 1.00 0.00 H -ATOM 2062 CB LEU 132 -16.208 -8.742 12.976 1.00 0.00 C -ATOM 2063 HB2 LEU 132 -16.355 -7.771 13.447 1.00 0.00 H -ATOM 2064 HB3 LEU 132 -15.964 -9.423 13.791 1.00 0.00 H -ATOM 2065 CG LEU 132 -14.928 -8.778 12.096 1.00 0.00 C -ATOM 2066 HG LEU 132 -15.082 -8.187 11.194 1.00 0.00 H -ATOM 2067 CD1 LEU 132 -13.786 -8.139 12.793 1.00 0.00 C -ATOM 2068 HD11 LEU 132 -14.129 -7.125 13.003 1.00 0.00 H -ATOM 2069 HD12 LEU 132 -13.502 -8.639 13.719 1.00 0.00 H -ATOM 2070 HD13 LEU 132 -12.982 -8.034 12.066 1.00 0.00 H -ATOM 2071 CD2 LEU 132 -14.365 -10.146 11.670 1.00 0.00 C -ATOM 2072 HD21 LEU 132 -15.107 -10.615 11.023 1.00 0.00 H -ATOM 2073 HD22 LEU 132 -13.500 -10.051 11.015 1.00 0.00 H -ATOM 2074 HD23 LEU 132 -14.259 -10.707 12.599 1.00 0.00 H -ATOM 2075 C LEU 132 -18.634 -9.362 13.251 1.00 0.00 C -ATOM 2076 O LEU 132 -18.698 -10.547 13.673 1.00 0.00 O -ATOM 2077 N THR 133 -19.429 -8.390 13.657 1.00 0.00 N -ATOM 2078 H THR 133 -19.232 -7.463 13.305 1.00 0.00 H -ATOM 2079 CA THR 133 -20.657 -8.544 14.399 1.00 0.00 C -ATOM 2080 HA THR 133 -20.495 -9.125 15.306 1.00 0.00 H -ATOM 2081 CB THR 133 -21.321 -7.260 14.750 1.00 0.00 C -ATOM 2082 HB THR 133 -21.568 -6.699 13.848 1.00 0.00 H -ATOM 2083 CG2 THR 133 -22.591 -7.329 15.584 1.00 0.00 C -ATOM 2084 HG21 THR 133 -22.809 -6.272 15.737 1.00 0.00 H -ATOM 2085 HG22 THR 133 -23.330 -7.825 14.955 1.00 0.00 H -ATOM 2086 HG23 THR 133 -22.377 -7.851 16.517 1.00 0.00 H -ATOM 2087 OG1 THR 133 -20.380 -6.474 15.416 1.00 0.00 O -ATOM 2088 HG1 THR 133 -19.745 -6.248 14.732 1.00 0.00 H -ATOM 2089 C THR 133 -21.648 -9.375 13.501 1.00 0.00 C -ATOM 2090 O THR 133 -22.419 -10.160 14.016 1.00 0.00 O -ATOM 2091 N ASP 134 -21.788 -9.158 12.182 1.00 0.00 N -ATOM 2092 H ASP 134 -21.167 -8.525 11.697 1.00 0.00 H -ATOM 2093 CA ASP 134 -22.542 -9.962 11.186 1.00 0.00 C -ATOM 2094 HA ASP 134 -23.525 -10.116 11.631 1.00 0.00 H -ATOM 2095 CB ASP 134 -22.663 -9.134 9.900 1.00 0.00 C -ATOM 2096 HB2 ASP 134 -22.572 -8.071 10.123 1.00 0.00 H -ATOM 2097 HB3 ASP 134 -21.807 -9.368 9.267 1.00 0.00 H -ATOM 2098 CG ASP 134 -23.941 -9.243 9.058 1.00 0.00 C -ATOM 2099 OD1 ASP 134 -23.888 -8.823 7.906 1.00 0.00 O -ATOM 2100 OD2 ASP 134 -24.985 -9.749 9.518 1.00 0.00 O -ATOM 2101 C ASP 134 -22.023 -11.334 10.905 1.00 0.00 C -ATOM 2102 O ASP 134 -22.845 -12.202 10.656 1.00 0.00 O -ATOM 2103 N ASN 135 -20.677 -11.545 10.846 1.00 0.00 N -ATOM 2104 H ASN 135 -20.050 -10.770 11.008 1.00 0.00 H -ATOM 2105 CA ASN 135 -20.031 -12.880 10.811 1.00 0.00 C -ATOM 2106 HA ASN 135 -20.296 -13.323 9.851 1.00 0.00 H -ATOM 2107 CB ASN 135 -18.545 -12.536 10.773 1.00 0.00 C -ATOM 2108 HB2 ASN 135 -18.366 -11.848 9.947 1.00 0.00 H -ATOM 2109 HB3 ASN 135 -18.241 -11.960 11.647 1.00 0.00 H -ATOM 2110 CG ASN 135 -17.705 -13.802 10.414 1.00 0.00 C -ATOM 2111 OD1 ASN 135 -18.055 -14.417 9.392 1.00 0.00 O -ATOM 2112 ND2 ASN 135 -16.871 -14.135 11.376 1.00 0.00 N -ATOM 2113 HD21 ASN 135 -16.392 -15.015 11.260 1.00 0.00 H -ATOM 2114 HD22 ASN 135 -16.622 -13.578 12.183 1.00 0.00 H -ATOM 2115 C ASN 135 -20.481 -13.708 12.016 1.00 0.00 C -ATOM 2116 O ASN 135 -20.625 -14.907 11.847 1.00 0.00 O -ATOM 2117 N GLY 136 -20.873 -13.036 13.094 1.00 0.00 N -ATOM 2118 H GLY 136 -20.980 -12.032 13.046 1.00 0.00 H -ATOM 2119 CA GLY 136 -21.827 -13.641 14.049 1.00 0.00 C -ATOM 2120 HA2 GLY 136 -22.382 -12.902 14.628 1.00 0.00 H -ATOM 2121 HA3 GLY 136 -22.632 -14.092 13.468 1.00 0.00 H -ATOM 2122 C GLY 136 -21.255 -14.650 14.991 1.00 0.00 C -ATOM 2123 O GLY 136 -21.712 -15.753 15.111 1.00 0.00 O -ATOM 2124 N THR 137 -20.117 -14.259 15.514 1.00 0.00 N -ATOM 2125 H THR 137 -19.903 -13.280 15.393 1.00 0.00 H -ATOM 2126 CA THR 137 -19.213 -14.978 16.437 1.00 0.00 C -ATOM 2127 HA THR 137 -19.905 -15.411 17.160 1.00 0.00 H -ATOM 2128 CB THR 137 -18.510 -16.138 15.753 1.00 0.00 C -ATOM 2129 HB THR 137 -19.293 -16.789 15.365 1.00 0.00 H -ATOM 2130 CG2 THR 137 -17.630 -15.676 14.564 1.00 0.00 C -ATOM 2131 HG21 THR 137 -17.173 -16.524 14.055 1.00 0.00 H -ATOM 2132 HG22 THR 137 -18.255 -15.265 13.770 1.00 0.00 H -ATOM 2133 HG23 THR 137 -16.847 -14.976 14.854 1.00 0.00 H -ATOM 2134 OG1 THR 137 -17.670 -16.898 16.652 1.00 0.00 O -ATOM 2135 HG1 THR 137 -18.231 -17.483 17.166 1.00 0.00 H -ATOM 2136 C THR 137 -18.300 -14.072 17.237 1.00 0.00 C -ATOM 2137 O THR 137 -18.052 -12.917 16.802 1.00 0.00 O -ATOM 2138 N GLU 138 -17.917 -14.435 18.429 1.00 0.00 N -ATOM 2139 H GLU 138 -18.237 -15.307 18.825 1.00 0.00 H -ATOM 2140 CA GLU 138 -17.137 -13.514 19.334 1.00 0.00 C -ATOM 2141 HA GLU 138 -17.739 -12.627 19.532 1.00 0.00 H -ATOM 2142 CB GLU 138 -16.870 -14.233 20.654 1.00 0.00 C -ATOM 2143 HB2 GLU 138 -17.763 -14.157 21.275 1.00 0.00 H -ATOM 2144 HB3 GLU 138 -16.751 -15.306 20.504 1.00 0.00 H -ATOM 2145 CG GLU 138 -15.685 -13.787 21.578 1.00 0.00 C -ATOM 2146 HG2 GLU 138 -15.349 -14.524 22.308 1.00 0.00 H -ATOM 2147 HG3 GLU 138 -14.770 -13.661 21.000 1.00 0.00 H -ATOM 2148 CD GLU 138 -15.958 -12.451 22.303 1.00 0.00 C -ATOM 2149 OE1 GLU 138 -15.198 -12.006 23.200 1.00 0.00 O -ATOM 2150 OE2 GLU 138 -16.944 -11.770 22.010 1.00 0.00 O -ATOM 2151 C GLU 138 -15.756 -13.042 18.750 1.00 0.00 C -ATOM 2152 O GLU 138 -14.931 -13.840 18.341 1.00 0.00 O -ATOM 2153 N PHE 139 -15.537 -11.754 18.768 1.00 0.00 N -ATOM 2154 H PHE 139 -16.150 -11.044 19.143 1.00 0.00 H -ATOM 2155 CA PHE 139 -14.417 -11.098 18.072 1.00 0.00 C -ATOM 2156 HA PHE 139 -13.659 -11.869 17.930 1.00 0.00 H -ATOM 2157 CB PHE 139 -14.800 -10.582 16.734 1.00 0.00 C -ATOM 2158 HB2 PHE 139 -13.833 -10.331 16.300 1.00 0.00 H -ATOM 2159 HB3 PHE 139 -15.268 -11.382 16.159 1.00 0.00 H -ATOM 2160 CG PHE 139 -15.519 -9.266 16.513 1.00 0.00 C -ATOM 2161 CD1 PHE 139 -16.915 -9.264 16.597 1.00 0.00 C -ATOM 2162 HD1 PHE 139 -17.411 -10.175 16.896 1.00 0.00 H -ATOM 2163 CE1 PHE 139 -17.699 -8.119 16.538 1.00 0.00 C -ATOM 2164 HE1 PHE 139 -18.763 -8.103 16.721 1.00 0.00 H -ATOM 2165 CZ PHE 139 -17.072 -6.953 16.141 1.00 0.00 C -ATOM 2166 HZ PHE 139 -17.662 -6.049 16.116 1.00 0.00 H -ATOM 2167 CE2 PHE 139 -15.646 -6.902 16.132 1.00 0.00 C -ATOM 2168 HE2 PHE 139 -15.267 -5.899 16.006 1.00 0.00 H -ATOM 2169 CD2 PHE 139 -14.852 -8.065 16.260 1.00 0.00 C -ATOM 2170 HD2 PHE 139 -13.784 -7.930 16.350 1.00 0.00 H -ATOM 2171 C PHE 139 -13.802 -9.938 18.883 1.00 0.00 C -ATOM 2172 O PHE 139 -14.454 -9.457 19.827 1.00 0.00 O -ATOM 2173 N SER 140 -12.522 -9.627 18.582 1.00 0.00 N -ATOM 2174 H SER 140 -12.055 -10.134 17.843 1.00 0.00 H -ATOM 2175 CA SER 140 -11.900 -8.387 19.072 1.00 0.00 C -ATOM 2176 HA SER 140 -12.674 -7.686 19.388 1.00 0.00 H -ATOM 2177 CB SER 140 -11.118 -8.594 20.410 1.00 0.00 C -ATOM 2178 HB2 SER 140 -11.768 -8.759 21.271 1.00 0.00 H -ATOM 2179 HB3 SER 140 -10.362 -9.379 20.375 1.00 0.00 H -ATOM 2180 OG SER 140 -10.515 -7.341 20.790 1.00 0.00 O -ATOM 2181 HG SER 140 -10.127 -7.423 21.664 1.00 0.00 H -ATOM 2182 C SER 140 -10.938 -7.736 18.023 1.00 0.00 C -ATOM 2183 O SER 140 -10.587 -8.443 17.061 1.00 0.00 O -ATOM 2184 N VAL 141 -10.522 -6.433 17.997 1.00 0.00 N -ATOM 2185 H VAL 141 -10.823 -5.827 18.746 1.00 0.00 H -ATOM 2186 CA VAL 141 -9.790 -5.770 16.863 1.00 0.00 C -ATOM 2187 HA VAL 141 -9.300 -6.493 16.211 1.00 0.00 H -ATOM 2188 CB VAL 141 -10.747 -4.884 16.061 1.00 0.00 C -ATOM 2189 HB VAL 141 -11.136 -4.222 16.834 1.00 0.00 H -ATOM 2190 CG1 VAL 141 -9.915 -4.056 15.013 1.00 0.00 C -ATOM 2191 HG11 VAL 141 -9.338 -4.632 14.289 1.00 0.00 H -ATOM 2192 HG12 VAL 141 -10.634 -3.497 14.414 1.00 0.00 H -ATOM 2193 HG13 VAL 141 -9.216 -3.317 15.404 1.00 0.00 H -ATOM 2194 CG2 VAL 141 -11.702 -5.662 15.163 1.00 0.00 C -ATOM 2195 HG21 VAL 141 -11.926 -6.616 15.643 1.00 0.00 H -ATOM 2196 HG22 VAL 141 -12.531 -5.089 14.749 1.00 0.00 H -ATOM 2197 HG23 VAL 141 -11.134 -5.953 14.280 1.00 0.00 H -ATOM 2198 C VAL 141 -8.620 -4.976 17.442 1.00 0.00 C -ATOM 2199 O VAL 141 -8.799 -4.224 18.445 1.00 0.00 O -ATOM 2200 N LYS 142 -7.436 -5.075 16.791 1.00 0.00 N -ATOM 2201 H LYS 142 -7.406 -5.681 15.983 1.00 0.00 H -ATOM 2202 CA LYS 142 -6.170 -4.404 17.113 1.00 0.00 C -ATOM 2203 HA LYS 142 -6.250 -3.734 17.970 1.00 0.00 H -ATOM 2204 CB LYS 142 -5.157 -5.512 17.579 1.00 0.00 C -ATOM 2205 HB2 LYS 142 -5.426 -6.378 16.972 1.00 0.00 H -ATOM 2206 HB3 LYS 142 -4.104 -5.236 17.524 1.00 0.00 H -ATOM 2207 CG LYS 142 -5.410 -5.799 19.041 1.00 0.00 C -ATOM 2208 HG2 LYS 142 -5.163 -4.921 19.640 1.00 0.00 H -ATOM 2209 HG3 LYS 142 -6.431 -5.993 19.370 1.00 0.00 H -ATOM 2210 CD LYS 142 -4.616 -6.968 19.541 1.00 0.00 C -ATOM 2211 HD2 LYS 142 -4.772 -7.864 18.940 1.00 0.00 H -ATOM 2212 HD3 LYS 142 -3.574 -6.692 19.382 1.00 0.00 H -ATOM 2213 CE LYS 142 -4.892 -7.327 21.018 1.00 0.00 C -ATOM 2214 HE2 LYS 142 -4.492 -6.538 21.656 1.00 0.00 H -ATOM 2215 HE3 LYS 142 -5.935 -7.458 21.303 1.00 0.00 H -ATOM 2216 NZ LYS 142 -4.198 -8.613 21.379 1.00 0.00 N -ATOM 2217 HZ1 LYS 142 -3.218 -8.519 21.153 1.00 0.00 H -ATOM 2218 HZ2 LYS 142 -4.273 -8.681 22.384 1.00 0.00 H -ATOM 2219 HZ3 LYS 142 -4.541 -9.444 20.919 1.00 0.00 H -ATOM 2220 C LYS 142 -5.600 -3.651 15.902 1.00 0.00 C -ATOM 2221 O LYS 142 -5.851 -4.010 14.768 1.00 0.00 O -ATOM 2222 N VAL 143 -4.850 -2.565 16.131 1.00 0.00 N -ATOM 2223 H VAL 143 -4.577 -2.362 17.082 1.00 0.00 H -ATOM 2224 CA VAL 143 -4.140 -1.852 15.097 1.00 0.00 C -ATOM 2225 HA VAL 143 -4.269 -2.379 14.151 1.00 0.00 H -ATOM 2226 CB VAL 143 -4.745 -0.496 14.898 1.00 0.00 C -ATOM 2227 HB VAL 143 -5.804 -0.638 14.687 1.00 0.00 H -ATOM 2228 CG1 VAL 143 -4.548 0.518 16.041 1.00 0.00 C -ATOM 2229 HG11 VAL 143 -5.023 0.091 16.923 1.00 0.00 H -ATOM 2230 HG12 VAL 143 -3.485 0.566 16.279 1.00 0.00 H -ATOM 2231 HG13 VAL 143 -4.946 1.531 15.980 1.00 0.00 H -ATOM 2232 CG2 VAL 143 -4.204 0.242 13.613 1.00 0.00 C -ATOM 2233 HG21 VAL 143 -4.856 1.095 13.424 1.00 0.00 H -ATOM 2234 HG22 VAL 143 -3.204 0.661 13.718 1.00 0.00 H -ATOM 2235 HG23 VAL 143 -4.290 -0.397 12.734 1.00 0.00 H -ATOM 2236 C VAL 143 -2.619 -1.866 15.458 1.00 0.00 C -ATOM 2237 O VAL 143 -2.247 -1.772 16.608 1.00 0.00 O -ATOM 2238 N SER 144 -1.770 -1.899 14.406 1.00 0.00 N -ATOM 2239 H SER 144 -2.216 -2.115 13.526 1.00 0.00 H -ATOM 2240 CA SER 144 -0.376 -1.491 14.509 1.00 0.00 C -ATOM 2241 HA SER 144 -0.319 -0.953 15.455 1.00 0.00 H -ATOM 2242 CB SER 144 0.561 -2.693 14.561 1.00 0.00 C -ATOM 2243 HB2 SER 144 0.318 -3.355 15.393 1.00 0.00 H -ATOM 2244 HB3 SER 144 0.595 -3.197 13.595 1.00 0.00 H -ATOM 2245 OG SER 144 1.801 -2.156 14.856 1.00 0.00 O -ATOM 2246 HG SER 144 2.288 -2.807 15.366 1.00 0.00 H -ATOM 2247 C SER 144 -0.022 -0.513 13.419 1.00 0.00 C -ATOM 2248 O SER 144 -0.362 -0.645 12.223 1.00 0.00 O -ATOM 2249 N LEU 145 0.839 0.464 13.758 1.00 0.00 N -ATOM 2250 H LEU 145 1.271 0.398 14.668 1.00 0.00 H -ATOM 2251 CA LEU 145 1.195 1.598 12.855 1.00 0.00 C -ATOM 2252 HA LEU 145 0.916 1.449 11.811 1.00 0.00 H -ATOM 2253 CB LEU 145 0.358 2.824 13.339 1.00 0.00 C -ATOM 2254 HB2 LEU 145 0.633 3.026 14.374 1.00 0.00 H -ATOM 2255 HB3 LEU 145 0.707 3.717 12.821 1.00 0.00 H -ATOM 2256 CG LEU 145 -1.140 2.816 13.203 1.00 0.00 C -ATOM 2257 HG LEU 145 -1.449 1.858 13.621 1.00 0.00 H -ATOM 2258 CD1 LEU 145 -1.661 3.981 14.029 1.00 0.00 C -ATOM 2259 HD11 LEU 145 -1.274 3.913 15.045 1.00 0.00 H -ATOM 2260 HD12 LEU 145 -1.409 4.993 13.708 1.00 0.00 H -ATOM 2261 HD13 LEU 145 -2.720 3.772 14.185 1.00 0.00 H -ATOM 2262 CD2 LEU 145 -1.640 3.078 11.822 1.00 0.00 C -ATOM 2263 HD21 LEU 145 -2.706 2.855 11.779 1.00 0.00 H -ATOM 2264 HD22 LEU 145 -1.534 4.142 11.608 1.00 0.00 H -ATOM 2265 HD23 LEU 145 -1.112 2.456 11.099 1.00 0.00 H -ATOM 2266 C LEU 145 2.707 1.874 12.883 1.00 0.00 C -ATOM 2267 O LEU 145 3.301 2.167 13.886 1.00 0.00 O -ATOM 2268 N LEU 146 3.336 1.908 11.691 1.00 0.00 N -ATOM 2269 H LEU 146 2.800 1.763 10.846 1.00 0.00 H -ATOM 2270 CA LEU 146 4.689 2.283 11.450 1.00 0.00 C -ATOM 2271 HA LEU 146 5.038 2.748 12.371 1.00 0.00 H -ATOM 2272 CB LEU 146 5.460 0.952 11.236 1.00 0.00 C -ATOM 2273 HB2 LEU 146 5.386 0.429 12.190 1.00 0.00 H -ATOM 2274 HB3 LEU 146 5.056 0.360 10.416 1.00 0.00 H -ATOM 2275 CG LEU 146 6.930 1.209 10.972 1.00 0.00 C -ATOM 2276 HG LEU 146 6.990 1.811 10.065 1.00 0.00 H -ATOM 2277 CD1 LEU 146 7.663 2.052 12.089 1.00 0.00 C -ATOM 2278 HD11 LEU 146 7.627 1.497 13.027 1.00 0.00 H -ATOM 2279 HD12 LEU 146 8.708 2.235 11.839 1.00 0.00 H -ATOM 2280 HD13 LEU 146 7.187 3.015 12.270 1.00 0.00 H -ATOM 2281 CD2 LEU 146 7.728 -0.081 10.799 1.00 0.00 C -ATOM 2282 HD21 LEU 146 7.101 -0.846 10.341 1.00 0.00 H -ATOM 2283 HD22 LEU 146 8.651 -0.077 10.218 1.00 0.00 H -ATOM 2284 HD23 LEU 146 7.892 -0.445 11.812 1.00 0.00 H -ATOM 2285 C LEU 146 4.785 3.298 10.258 1.00 0.00 C -ATOM 2286 O LEU 146 3.930 3.218 9.360 1.00 0.00 O -ATOM 2287 N GLU 147 5.793 4.204 10.231 1.00 0.00 N -ATOM 2288 H GLU 147 6.400 4.337 11.027 1.00 0.00 H -ATOM 2289 CA GLU 147 6.251 4.924 9.056 1.00 0.00 C -ATOM 2290 HA GLU 147 5.695 4.529 8.206 1.00 0.00 H -ATOM 2291 CB GLU 147 5.839 6.383 9.318 1.00 0.00 C -ATOM 2292 HB2 GLU 147 4.760 6.409 9.473 1.00 0.00 H -ATOM 2293 HB3 GLU 147 6.200 6.889 10.214 1.00 0.00 H -ATOM 2294 CG GLU 147 6.039 7.264 8.058 1.00 0.00 C -ATOM 2295 HG2 GLU 147 6.469 8.159 8.509 1.00 0.00 H -ATOM 2296 HG3 GLU 147 6.608 6.699 7.320 1.00 0.00 H -ATOM 2297 CD GLU 147 4.705 7.666 7.474 1.00 0.00 C -ATOM 2298 OE1 GLU 147 4.451 8.859 7.291 1.00 0.00 O -ATOM 2299 OE2 GLU 147 3.888 6.712 7.217 1.00 0.00 O -ATOM 2300 C GLU 147 7.763 4.821 8.995 1.00 0.00 C -ATOM 2301 O GLU 147 8.432 4.709 9.991 1.00 0.00 O -ATOM 2302 N ILE 148 8.305 4.902 7.754 1.00 0.00 N -ATOM 2303 H ILE 148 7.714 5.032 6.945 1.00 0.00 H -ATOM 2304 CA ILE 148 9.742 4.753 7.458 1.00 0.00 C -ATOM 2305 HA ILE 148 10.384 4.800 8.337 1.00 0.00 H -ATOM 2306 CB ILE 148 9.999 3.416 6.719 1.00 0.00 C -ATOM 2307 HB ILE 148 9.262 3.323 5.921 1.00 0.00 H -ATOM 2308 CG2 ILE 148 11.383 3.491 6.137 1.00 0.00 C -ATOM 2309 HG21 ILE 148 11.426 4.074 5.218 1.00 0.00 H -ATOM 2310 HG22 ILE 148 12.105 3.817 6.885 1.00 0.00 H -ATOM 2311 HG23 ILE 148 11.691 2.487 5.843 1.00 0.00 H -ATOM 2312 CG1 ILE 148 9.720 2.257 7.731 1.00 0.00 C -ATOM 2313 HG12 ILE 148 10.021 2.515 8.747 1.00 0.00 H -ATOM 2314 HG13 ILE 148 8.653 2.036 7.703 1.00 0.00 H -ATOM 2315 CD1 ILE 148 10.505 0.942 7.463 1.00 0.00 C -ATOM 2316 HD11 ILE 148 11.553 0.946 7.760 1.00 0.00 H -ATOM 2317 HD12 ILE 148 10.125 0.149 8.107 1.00 0.00 H -ATOM 2318 HD13 ILE 148 10.478 0.561 6.442 1.00 0.00 H -ATOM 2319 C ILE 148 10.209 6.031 6.666 1.00 0.00 C -ATOM 2320 O ILE 148 9.465 6.505 5.770 1.00 0.00 O -ATOM 2321 N TYR 149 11.372 6.468 6.918 1.00 0.00 N -ATOM 2322 H TYR 149 11.860 6.106 7.724 1.00 0.00 H -ATOM 2323 CA TYR 149 12.020 7.371 5.957 1.00 0.00 C -ATOM 2324 HA TYR 149 11.712 7.043 4.964 1.00 0.00 H -ATOM 2325 CB TYR 149 11.608 8.810 6.208 1.00 0.00 C -ATOM 2326 HB2 TYR 149 10.597 8.953 5.827 1.00 0.00 H -ATOM 2327 HB3 TYR 149 11.586 8.923 7.292 1.00 0.00 H -ATOM 2328 CG TYR 149 12.458 9.923 5.572 1.00 0.00 C -ATOM 2329 CD1 TYR 149 13.482 10.481 6.336 1.00 0.00 C -ATOM 2330 HD1 TYR 149 13.672 10.107 7.332 1.00 0.00 H -ATOM 2331 CE1 TYR 149 14.351 11.371 5.735 1.00 0.00 C -ATOM 2332 HE1 TYR 149 15.193 11.770 6.281 1.00 0.00 H -ATOM 2333 CZ TYR 149 14.009 12.018 4.520 1.00 0.00 C -ATOM 2334 OH TYR 149 14.820 12.924 3.957 1.00 0.00 O -ATOM 2335 HH TYR 149 15.624 13.110 4.445 1.00 0.00 H -ATOM 2336 CE2 TYR 149 12.973 11.526 3.744 1.00 0.00 C -ATOM 2337 HE2 TYR 149 12.868 11.917 2.743 1.00 0.00 H -ATOM 2338 CD2 TYR 149 12.129 10.443 4.294 1.00 0.00 C -ATOM 2339 HD2 TYR 149 11.391 9.927 3.697 1.00 0.00 H -ATOM 2340 C TYR 149 13.569 7.166 6.106 1.00 0.00 C -ATOM 2341 O TYR 149 14.013 6.976 7.176 1.00 0.00 O -ATOM 2342 N ASN 150 14.385 7.185 5.043 1.00 0.00 N -ATOM 2343 H ASN 150 14.021 7.398 4.126 1.00 0.00 H -ATOM 2344 CA ASN 150 15.844 7.036 5.062 1.00 0.00 C -ATOM 2345 HA ASN 150 16.120 6.727 4.053 1.00 0.00 H -ATOM 2346 CB ASN 150 16.661 8.331 5.187 1.00 0.00 C -ATOM 2347 HB2 ASN 150 17.652 8.110 4.792 1.00 0.00 H -ATOM 2348 HB3 ASN 150 16.139 8.927 4.438 1.00 0.00 H -ATOM 2349 CG ASN 150 16.818 9.108 6.435 1.00 0.00 C -ATOM 2350 OD1 ASN 150 17.606 9.998 6.565 1.00 0.00 O -ATOM 2351 ND2 ASN 150 16.005 8.836 7.438 1.00 0.00 N -ATOM 2352 HD21 ASN 150 15.915 9.499 8.194 1.00 0.00 H -ATOM 2353 HD22 ASN 150 15.593 7.918 7.531 1.00 0.00 H -ATOM 2354 C ASN 150 16.556 5.859 5.862 1.00 0.00 C -ATOM 2355 O ASN 150 17.634 6.048 6.386 1.00 0.00 O -ATOM 2356 N GLU 151 15.928 4.664 5.899 1.00 0.00 N -ATOM 2357 H GLU 151 15.030 4.526 5.457 1.00 0.00 H -ATOM 2358 CA GLU 151 16.394 3.547 6.708 1.00 0.00 C -ATOM 2359 HA GLU 151 15.627 2.796 6.516 1.00 0.00 H -ATOM 2360 CB GLU 151 17.731 2.946 6.240 1.00 0.00 C -ATOM 2361 HB2 GLU 151 18.402 3.754 6.533 1.00 0.00 H -ATOM 2362 HB3 GLU 151 17.986 2.091 6.867 1.00 0.00 H -ATOM 2363 CG GLU 151 17.858 2.631 4.768 1.00 0.00 C -ATOM 2364 HG2 GLU 151 17.880 3.562 4.204 1.00 0.00 H -ATOM 2365 HG3 GLU 151 18.719 2.007 4.525 1.00 0.00 H -ATOM 2366 CD GLU 151 16.603 1.854 4.267 1.00 0.00 C -ATOM 2367 OE1 GLU 151 16.209 0.849 4.916 1.00 0.00 O -ATOM 2368 OE2 GLU 151 15.999 2.263 3.247 1.00 0.00 O -ATOM 2369 C GLU 151 16.245 3.830 8.236 1.00 0.00 C -ATOM 2370 O GLU 151 16.797 3.009 9.043 1.00 0.00 O -ATOM 2371 N GLU 152 15.482 4.872 8.684 1.00 0.00 N -ATOM 2372 H GLU 152 15.041 5.396 7.942 1.00 0.00 H -ATOM 2373 CA GLU 152 14.958 5.115 10.017 1.00 0.00 C -ATOM 2374 HA GLU 152 15.529 4.514 10.724 1.00 0.00 H -ATOM 2375 CB GLU 152 15.260 6.599 10.394 1.00 0.00 C -ATOM 2376 HB2 GLU 152 14.555 7.221 9.842 1.00 0.00 H -ATOM 2377 HB3 GLU 152 14.985 6.666 11.446 1.00 0.00 H -ATOM 2378 CG GLU 152 16.791 6.963 10.219 1.00 0.00 C -ATOM 2379 HG2 GLU 152 17.332 6.352 10.941 1.00 0.00 H -ATOM 2380 HG3 GLU 152 17.156 6.751 9.213 1.00 0.00 H -ATOM 2381 CD GLU 152 17.059 8.341 10.673 1.00 0.00 C -ATOM 2382 OE1 GLU 152 16.168 9.089 11.095 1.00 0.00 O -ATOM 2383 OE2 GLU 152 18.253 8.765 10.617 1.00 0.00 O -ATOM 2384 C GLU 152 13.501 4.731 10.119 1.00 0.00 C -ATOM 2385 O GLU 152 12.672 4.676 9.210 1.00 0.00 O -ATOM 2386 N LEU 153 13.077 4.289 11.313 1.00 0.00 N -ATOM 2387 H LEU 153 13.730 4.253 12.083 1.00 0.00 H -ATOM 2388 CA LEU 153 11.710 3.828 11.645 1.00 0.00 C -ATOM 2389 HA LEU 153 11.160 3.747 10.706 1.00 0.00 H -ATOM 2390 CB LEU 153 11.813 2.434 12.324 1.00 0.00 C -ATOM 2391 HB2 LEU 153 12.689 2.386 12.971 1.00 0.00 H -ATOM 2392 HB3 LEU 153 10.918 2.114 12.857 1.00 0.00 H -ATOM 2393 CG LEU 153 12.016 1.213 11.398 1.00 0.00 C -ATOM 2394 HG LEU 153 11.079 1.107 10.851 1.00 0.00 H -ATOM 2395 CD1 LEU 153 13.201 1.312 10.514 1.00 0.00 C -ATOM 2396 HD11 LEU 153 13.353 0.430 9.891 1.00 0.00 H -ATOM 2397 HD12 LEU 153 12.972 2.017 9.714 1.00 0.00 H -ATOM 2398 HD13 LEU 153 14.142 1.486 11.035 1.00 0.00 H -ATOM 2399 CD2 LEU 153 12.271 -0.079 12.165 1.00 0.00 C -ATOM 2400 HD21 LEU 153 13.183 0.049 12.748 1.00 0.00 H -ATOM 2401 HD22 LEU 153 11.359 -0.387 12.675 1.00 0.00 H -ATOM 2402 HD23 LEU 153 12.518 -0.930 11.530 1.00 0.00 H -ATOM 2403 C LEU 153 11.190 4.890 12.624 1.00 0.00 C -ATOM 2404 O LEU 153 11.796 5.268 13.642 1.00 0.00 O -ATOM 2405 N PHE 154 10.015 5.466 12.304 1.00 0.00 N -ATOM 2406 H PHE 154 9.681 5.196 11.391 1.00 0.00 H -ATOM 2407 CA PHE 154 9.330 6.557 12.976 1.00 0.00 C -ATOM 2408 HA PHE 154 10.124 6.958 13.605 1.00 0.00 H -ATOM 2409 CB PHE 154 8.861 7.665 11.935 1.00 0.00 C -ATOM 2410 HB2 PHE 154 8.289 7.196 11.135 1.00 0.00 H -ATOM 2411 HB3 PHE 154 8.170 8.248 12.544 1.00 0.00 H -ATOM 2412 CG PHE 154 9.982 8.501 11.349 1.00 0.00 C -ATOM 2413 CD1 PHE 154 9.885 9.898 11.450 1.00 0.00 C -ATOM 2414 HD1 PHE 154 9.077 10.282 12.054 1.00 0.00 H -ATOM 2415 CE1 PHE 154 10.794 10.707 10.750 1.00 0.00 C -ATOM 2416 HE1 PHE 154 10.665 11.768 10.905 1.00 0.00 H -ATOM 2417 CZ PHE 154 11.849 10.099 10.009 1.00 0.00 C -ATOM 2418 HZ PHE 154 12.606 10.656 9.477 1.00 0.00 H -ATOM 2419 CE2 PHE 154 11.897 8.711 9.891 1.00 0.00 C -ATOM 2420 HE2 PHE 154 12.633 8.183 9.301 1.00 0.00 H -ATOM 2421 CD2 PHE 154 11.011 7.886 10.577 1.00 0.00 C -ATOM 2422 HD2 PHE 154 10.983 6.809 10.502 1.00 0.00 H -ATOM 2423 C PHE 154 8.168 6.118 13.802 1.00 0.00 C -ATOM 2424 O PHE 154 7.298 5.436 13.302 1.00 0.00 O -ATOM 2425 N ASP 155 8.265 6.393 15.103 1.00 0.00 N -ATOM 2426 H ASP 155 8.892 7.159 15.302 1.00 0.00 H -ATOM 2427 CA ASP 155 7.337 5.987 16.183 1.00 0.00 C -ATOM 2428 HA ASP 155 7.345 4.896 16.189 1.00 0.00 H -ATOM 2429 CB ASP 155 7.922 6.497 17.508 1.00 0.00 C -ATOM 2430 HB2 ASP 155 9.006 6.378 17.516 1.00 0.00 H -ATOM 2431 HB3 ASP 155 7.697 7.562 17.562 1.00 0.00 H -ATOM 2432 CG ASP 155 7.466 5.955 18.824 1.00 0.00 C -ATOM 2433 OD1 ASP 155 7.646 6.682 19.813 1.00 0.00 O -ATOM 2434 OD2 ASP 155 7.099 4.779 18.939 1.00 0.00 O -ATOM 2435 C ASP 155 5.847 6.388 15.995 1.00 0.00 C -ATOM 2436 O ASP 155 5.259 7.135 16.863 1.00 0.00 O -ATOM 2437 N LEU 156 5.179 5.995 14.841 1.00 0.00 N -ATOM 2438 H LEU 156 5.673 5.368 14.221 1.00 0.00 H -ATOM 2439 CA LEU 156 3.813 6.367 14.571 1.00 0.00 C -ATOM 2440 HA LEU 156 3.852 7.457 14.587 1.00 0.00 H -ATOM 2441 CB LEU 156 3.429 5.931 13.158 1.00 0.00 C -ATOM 2442 HB2 LEU 156 4.271 6.117 12.491 1.00 0.00 H -ATOM 2443 HB3 LEU 156 3.246 4.858 13.147 1.00 0.00 H -ATOM 2444 CG LEU 156 2.215 6.676 12.519 1.00 0.00 C -ATOM 2445 HG LEU 156 1.431 6.759 13.272 1.00 0.00 H -ATOM 2446 CD1 LEU 156 2.689 8.174 12.239 1.00 0.00 C -ATOM 2447 HD11 LEU 156 1.755 8.699 12.036 1.00 0.00 H -ATOM 2448 HD12 LEU 156 3.092 8.641 13.137 1.00 0.00 H -ATOM 2449 HD13 LEU 156 3.316 8.358 11.367 1.00 0.00 H -ATOM 2450 CD2 LEU 156 1.543 6.071 11.189 1.00 0.00 C -ATOM 2451 HD21 LEU 156 2.308 6.174 10.420 1.00 0.00 H -ATOM 2452 HD22 LEU 156 1.250 5.049 11.433 1.00 0.00 H -ATOM 2453 HD23 LEU 156 0.678 6.683 10.934 1.00 0.00 H -ATOM 2454 C LEU 156 2.764 6.048 15.587 1.00 0.00 C -ATOM 2455 O LEU 156 1.952 6.907 15.896 1.00 0.00 O -ATOM 2456 N LEU 157 2.808 4.901 16.242 1.00 0.00 N -ATOM 2457 H LEU 157 3.593 4.293 16.058 1.00 0.00 H -ATOM 2458 CA LEU 157 1.838 4.410 17.228 1.00 0.00 C -ATOM 2459 HA LEU 157 0.867 4.506 16.740 1.00 0.00 H -ATOM 2460 CB LEU 157 2.079 2.871 17.356 1.00 0.00 C -ATOM 2461 HB2 LEU 157 2.385 2.468 16.390 1.00 0.00 H -ATOM 2462 HB3 LEU 157 2.864 2.695 18.091 1.00 0.00 H -ATOM 2463 CG LEU 157 0.800 2.113 17.875 1.00 0.00 C -ATOM 2464 HG LEU 157 0.601 2.444 18.894 1.00 0.00 H -ATOM 2465 CD1 LEU 157 -0.414 2.293 16.979 1.00 0.00 C -ATOM 2466 HD11 LEU 157 -0.186 2.131 15.925 1.00 0.00 H -ATOM 2467 HD12 LEU 157 -1.098 1.476 17.210 1.00 0.00 H -ATOM 2468 HD13 LEU 157 -1.027 3.191 17.060 1.00 0.00 H -ATOM 2469 CD2 LEU 157 1.216 0.654 17.786 1.00 0.00 C -ATOM 2470 HD21 LEU 157 2.047 0.598 18.487 1.00 0.00 H -ATOM 2471 HD22 LEU 157 0.435 -0.016 18.144 1.00 0.00 H -ATOM 2472 HD23 LEU 157 1.502 0.380 16.770 1.00 0.00 H -ATOM 2473 C LEU 157 1.924 5.193 18.591 1.00 0.00 C -ATOM 2474 O LEU 157 0.921 5.191 19.350 1.00 0.00 O -ATOM 2475 N ASN 158 2.967 5.995 18.774 1.00 0.00 N -ATOM 2476 H ASN 158 3.717 5.864 18.109 1.00 0.00 H -ATOM 2477 CA ASN 158 3.077 6.916 19.941 1.00 0.00 C -ATOM 2478 HA ASN 158 2.601 6.332 20.729 1.00 0.00 H -ATOM 2479 CB ASN 158 4.506 7.291 20.133 1.00 0.00 C -ATOM 2480 HB2 ASN 158 5.030 6.341 20.235 1.00 0.00 H -ATOM 2481 HB3 ASN 158 4.993 7.788 19.293 1.00 0.00 H -ATOM 2482 CG ASN 158 4.778 8.082 21.415 1.00 0.00 C -ATOM 2483 OD1 ASN 158 3.965 8.685 22.053 1.00 0.00 O -ATOM 2484 ND2 ASN 158 6.071 8.185 21.628 1.00 0.00 N -ATOM 2485 HD21 ASN 158 6.343 8.576 22.518 1.00 0.00 H -ATOM 2486 HD22 ASN 158 6.638 7.596 21.034 1.00 0.00 H -ATOM 2487 C ASN 158 2.255 8.212 19.791 1.00 0.00 C -ATOM 2488 O ASN 158 2.486 8.964 18.873 1.00 0.00 O -ATOM 2489 N PRO 159 1.222 8.477 20.669 1.00 0.00 N -ATOM 2490 CD PRO 159 0.968 7.631 21.833 1.00 0.00 C -ATOM 2491 HD2 PRO 159 1.844 7.528 22.474 1.00 0.00 H -ATOM 2492 HD3 PRO 159 0.711 6.648 21.439 1.00 0.00 H -ATOM 2493 CG PRO 159 -0.148 8.306 22.646 1.00 0.00 C -ATOM 2494 HG2 PRO 159 0.154 8.896 23.511 1.00 0.00 H -ATOM 2495 HG3 PRO 159 -0.769 7.476 22.979 1.00 0.00 H -ATOM 2496 CB PRO 159 -0.809 9.148 21.591 1.00 0.00 C -ATOM 2497 HB2 PRO 159 -1.350 10.018 21.965 1.00 0.00 H -ATOM 2498 HB3 PRO 159 -1.526 8.625 20.959 1.00 0.00 H -ATOM 2499 CA PRO 159 0.304 9.635 20.646 1.00 0.00 C -ATOM 2500 HA PRO 159 -0.091 9.780 19.641 1.00 0.00 H -ATOM 2501 C PRO 159 0.948 11.005 21.102 1.00 0.00 C -ATOM 2502 O PRO 159 0.319 12.064 21.181 1.00 0.00 O -ATOM 2503 N SER 160 2.316 10.976 21.172 1.00 0.00 N -ATOM 2504 H SER 160 2.761 10.070 21.134 1.00 0.00 H -ATOM 2505 CA SER 160 3.127 12.145 21.351 1.00 0.00 C -ATOM 2506 HA SER 160 2.694 12.786 22.119 1.00 0.00 H -ATOM 2507 CB SER 160 4.486 11.852 21.813 1.00 0.00 C -ATOM 2508 HB2 SER 160 4.475 11.357 22.785 1.00 0.00 H -ATOM 2509 HB3 SER 160 4.867 11.068 21.160 1.00 0.00 H -ATOM 2510 OG SER 160 5.350 12.998 21.852 1.00 0.00 O -ATOM 2511 HG SER 160 6.210 12.760 22.204 1.00 0.00 H -ATOM 2512 C SER 160 3.185 12.786 19.907 1.00 0.00 C -ATOM 2513 O SER 160 3.526 12.158 18.873 1.00 0.00 O -ATOM 2514 N SER 161 3.020 14.085 19.823 1.00 0.00 N -ATOM 2515 H SER 161 2.956 14.666 20.647 1.00 0.00 H -ATOM 2516 CA SER 161 3.312 14.920 18.663 1.00 0.00 C -ATOM 2517 HA SER 161 2.785 14.437 17.840 1.00 0.00 H -ATOM 2518 CB SER 161 2.965 16.370 19.005 1.00 0.00 C -ATOM 2519 HB2 SER 161 3.750 16.668 19.700 1.00 0.00 H -ATOM 2520 HB3 SER 161 3.112 16.886 18.056 1.00 0.00 H -ATOM 2521 OG SER 161 1.659 16.487 19.575 1.00 0.00 O -ATOM 2522 HG SER 161 1.588 17.374 19.935 1.00 0.00 H -ATOM 2523 C SER 161 4.774 14.940 18.268 1.00 0.00 C -ATOM 2524 O SER 161 5.022 15.400 17.138 1.00 0.00 O -ATOM 2525 N ASP 162 5.617 14.651 19.278 1.00 0.00 N -ATOM 2526 H ASP 162 5.267 14.381 20.187 1.00 0.00 H -ATOM 2527 CA ASP 162 7.051 14.765 19.200 1.00 0.00 C -ATOM 2528 HA ASP 162 7.281 15.804 18.972 1.00 0.00 H -ATOM 2529 CB ASP 162 7.698 14.324 20.523 1.00 0.00 C -ATOM 2530 HB2 ASP 162 7.250 14.861 21.357 1.00 0.00 H -ATOM 2531 HB3 ASP 162 7.493 13.267 20.687 1.00 0.00 H -ATOM 2532 CG ASP 162 9.286 14.444 20.581 1.00 0.00 C -ATOM 2533 OD1 ASP 162 9.950 14.440 19.511 1.00 0.00 O -ATOM 2534 OD2 ASP 162 9.733 14.611 21.773 1.00 0.00 O -ATOM 2535 C ASP 162 7.697 13.975 17.971 1.00 0.00 C -ATOM 2536 O ASP 162 7.679 12.773 17.968 1.00 0.00 O -ATOM 2537 N VAL 163 8.150 14.682 16.932 1.00 0.00 N -ATOM 2538 H VAL 163 8.166 15.692 16.964 1.00 0.00 H -ATOM 2539 CA VAL 163 8.706 14.055 15.745 1.00 0.00 C -ATOM 2540 HA VAL 163 7.933 13.329 15.491 1.00 0.00 H -ATOM 2541 CB VAL 163 8.824 15.044 14.574 1.00 0.00 C -ATOM 2542 HB VAL 163 7.897 15.604 14.450 1.00 0.00 H -ATOM 2543 CG1 VAL 163 9.816 16.175 14.841 1.00 0.00 C -ATOM 2544 HG11 VAL 163 10.777 15.791 15.181 1.00 0.00 H -ATOM 2545 HG12 VAL 163 10.129 16.833 14.029 1.00 0.00 H -ATOM 2546 HG13 VAL 163 9.489 16.733 15.718 1.00 0.00 H -ATOM 2547 CG2 VAL 163 9.137 14.382 13.224 1.00 0.00 C -ATOM 2548 HG21 VAL 163 8.527 13.495 13.055 1.00 0.00 H -ATOM 2549 HG22 VAL 163 9.026 15.188 12.498 1.00 0.00 H -ATOM 2550 HG23 VAL 163 10.166 14.044 13.107 1.00 0.00 H -ATOM 2551 C VAL 163 10.057 13.262 15.890 1.00 0.00 C -ATOM 2552 O VAL 163 10.316 12.392 15.109 1.00 0.00 O -ATOM 2553 N SER 164 10.856 13.588 16.917 1.00 0.00 N -ATOM 2554 H SER 164 10.544 14.311 17.551 1.00 0.00 H -ATOM 2555 CA SER 164 12.264 13.154 17.065 1.00 0.00 C -ATOM 2556 HA SER 164 12.722 13.329 16.092 1.00 0.00 H -ATOM 2557 CB SER 164 12.951 14.101 18.040 1.00 0.00 C -ATOM 2558 HB2 SER 164 14.034 13.986 18.043 1.00 0.00 H -ATOM 2559 HB3 SER 164 12.805 15.121 17.685 1.00 0.00 H -ATOM 2560 OG SER 164 12.525 13.934 19.415 1.00 0.00 O -ATOM 2561 HG SER 164 11.588 14.136 19.465 1.00 0.00 H -ATOM 2562 C SER 164 12.479 11.711 17.495 1.00 0.00 C -ATOM 2563 O SER 164 13.534 11.187 17.216 1.00 0.00 O -ATOM 2564 N GLU 165 11.436 11.089 18.118 1.00 0.00 N -ATOM 2565 H GLU 165 10.618 11.670 18.232 1.00 0.00 H -ATOM 2566 CA GLU 165 11.360 9.633 18.391 1.00 0.00 C -ATOM 2567 HA GLU 165 12.087 9.482 19.189 1.00 0.00 H -ATOM 2568 CB GLU 165 9.978 9.111 18.905 1.00 0.00 C -ATOM 2569 HB2 GLU 165 9.254 9.138 18.092 1.00 0.00 H -ATOM 2570 HB3 GLU 165 10.148 8.053 19.104 1.00 0.00 H -ATOM 2571 CG GLU 165 9.491 9.830 20.187 1.00 0.00 C -ATOM 2572 HG2 GLU 165 9.343 10.900 20.044 1.00 0.00 H -ATOM 2573 HG3 GLU 165 8.572 9.359 20.540 1.00 0.00 H -ATOM 2574 CD GLU 165 10.396 9.637 21.403 1.00 0.00 C -ATOM 2575 OE1 GLU 165 11.112 8.581 21.505 1.00 0.00 O -ATOM 2576 OE2 GLU 165 10.657 10.630 22.130 1.00 0.00 O -ATOM 2577 C GLU 165 11.931 8.781 17.240 1.00 0.00 C -ATOM 2578 O GLU 165 11.645 9.083 16.092 1.00 0.00 O -ATOM 2579 N ARG 166 12.568 7.630 17.511 1.00 0.00 N -ATOM 2580 H ARG 166 13.018 7.601 18.415 1.00 0.00 H -ATOM 2581 CA ARG 166 12.938 6.583 16.523 1.00 0.00 C -ATOM 2582 HA ARG 166 12.177 6.755 15.761 1.00 0.00 H -ATOM 2583 CB ARG 166 14.332 6.756 15.962 1.00 0.00 C -ATOM 2584 HB2 ARG 166 15.073 6.973 16.731 1.00 0.00 H -ATOM 2585 HB3 ARG 166 14.572 5.851 15.403 1.00 0.00 H -ATOM 2586 CG ARG 166 14.424 7.917 15.046 1.00 0.00 C -ATOM 2587 HG2 ARG 166 14.193 8.836 15.584 1.00 0.00 H -ATOM 2588 HG3 ARG 166 15.483 8.058 14.829 1.00 0.00 H -ATOM 2589 CD ARG 166 13.665 7.853 13.714 1.00 0.00 C -ATOM 2590 HD2 ARG 166 13.796 6.876 13.247 1.00 0.00 H -ATOM 2591 HD3 ARG 166 12.605 7.926 13.958 1.00 0.00 H -ATOM 2592 NE ARG 166 13.878 9.044 12.791 1.00 0.00 N -ATOM 2593 HE ARG 166 14.476 8.888 11.992 1.00 0.00 H -ATOM 2594 CZ ARG 166 13.369 10.242 12.935 1.00 0.00 C -ATOM 2595 NH1 ARG 166 12.488 10.495 13.825 1.00 0.00 N -ATOM 2596 HH11 ARG 166 12.155 9.813 14.492 1.00 0.00 H -ATOM 2597 HH12 ARG 166 12.173 11.452 13.910 1.00 0.00 H -ATOM 2598 NH2 ARG 166 13.763 11.248 12.216 1.00 0.00 N -ATOM 2599 HH21 ARG 166 14.321 11.090 11.389 1.00 0.00 H -ATOM 2600 HH22 ARG 166 13.585 12.209 12.470 1.00 0.00 H -ATOM 2601 C ARG 166 12.774 5.224 17.104 1.00 0.00 C -ATOM 2602 O ARG 166 13.071 5.090 18.290 1.00 0.00 O -ATOM 2603 N LEU 167 12.489 4.188 16.273 1.00 0.00 N -ATOM 2604 H LEU 167 12.224 4.358 15.314 1.00 0.00 H -ATOM 2605 CA LEU 167 12.459 2.748 16.681 1.00 0.00 C -ATOM 2606 HA LEU 167 12.478 2.687 17.769 1.00 0.00 H -ATOM 2607 CB LEU 167 11.181 1.987 16.259 1.00 0.00 C -ATOM 2608 HB2 LEU 167 11.095 2.034 15.174 1.00 0.00 H -ATOM 2609 HB3 LEU 167 11.157 0.944 16.574 1.00 0.00 H -ATOM 2610 CG LEU 167 9.936 2.710 16.915 1.00 0.00 C -ATOM 2611 HG LEU 167 9.989 3.747 16.584 1.00 0.00 H -ATOM 2612 CD1 LEU 167 8.725 2.058 16.207 1.00 0.00 C -ATOM 2613 HD11 LEU 167 7.886 2.726 16.400 1.00 0.00 H -ATOM 2614 HD12 LEU 167 8.827 1.981 15.126 1.00 0.00 H -ATOM 2615 HD13 LEU 167 8.623 1.042 16.588 1.00 0.00 H -ATOM 2616 CD2 LEU 167 9.780 2.671 18.389 1.00 0.00 C -ATOM 2617 HD21 LEU 167 9.727 1.659 18.790 1.00 0.00 H -ATOM 2618 HD22 LEU 167 10.514 3.324 18.860 1.00 0.00 H -ATOM 2619 HD23 LEU 167 8.753 3.011 18.518 1.00 0.00 H -ATOM 2620 C LEU 167 13.743 2.023 16.112 1.00 0.00 C -ATOM 2621 O LEU 167 14.234 2.485 15.073 1.00 0.00 O -ATOM 2622 N GLN 168 14.070 0.896 16.773 1.00 0.00 N -ATOM 2623 H GLN 168 13.570 0.666 17.619 1.00 0.00 H -ATOM 2624 CA GLN 168 15.146 0.014 16.438 1.00 0.00 C -ATOM 2625 HA GLN 168 15.608 0.478 15.566 1.00 0.00 H -ATOM 2626 CB GLN 168 16.160 -0.062 17.560 1.00 0.00 C -ATOM 2627 HB2 GLN 168 15.738 -0.393 18.508 1.00 0.00 H -ATOM 2628 HB3 GLN 168 16.876 -0.842 17.304 1.00 0.00 H -ATOM 2629 CG GLN 168 16.947 1.229 17.909 1.00 0.00 C -ATOM 2630 HG2 GLN 168 16.257 1.766 18.561 1.00 0.00 H -ATOM 2631 HG3 GLN 168 17.875 1.045 18.450 1.00 0.00 H -ATOM 2632 CD GLN 168 17.329 2.044 16.702 1.00 0.00 C -ATOM 2633 OE1 GLN 168 17.767 1.466 15.693 1.00 0.00 O -ATOM 2634 NE2 GLN 168 17.212 3.324 16.766 1.00 0.00 N -ATOM 2635 HE21 GLN 168 17.500 3.913 15.998 1.00 0.00 H -ATOM 2636 HE22 GLN 168 16.982 3.785 17.634 1.00 0.00 H -ATOM 2637 C GLN 168 14.737 -1.406 15.951 1.00 0.00 C -ATOM 2638 O GLN 168 13.642 -1.981 16.349 1.00 0.00 O -ATOM 2639 N MET 169 15.621 -2.059 15.208 1.00 0.00 N -ATOM 2640 H MET 169 16.502 -1.654 14.926 1.00 0.00 H -ATOM 2641 CA MET 169 15.222 -3.329 14.574 1.00 0.00 C -ATOM 2642 HA MET 169 14.193 -3.647 14.749 1.00 0.00 H -ATOM 2643 CB MET 169 15.253 -3.089 13.030 1.00 0.00 C -ATOM 2644 HB2 MET 169 14.797 -2.109 12.892 1.00 0.00 H -ATOM 2645 HB3 MET 169 16.309 -2.990 12.778 1.00 0.00 H -ATOM 2646 CG MET 169 14.483 -4.085 12.114 1.00 0.00 C -ATOM 2647 HG2 MET 169 14.698 -5.110 12.420 1.00 0.00 H -ATOM 2648 HG3 MET 169 13.451 -3.945 12.437 1.00 0.00 H -ATOM 2649 SD MET 169 14.687 -3.845 10.374 1.00 0.00 S -ATOM 2650 CE MET 169 16.477 -4.074 10.212 1.00 0.00 C -ATOM 2651 HE1 MET 169 17.029 -3.410 10.879 1.00 0.00 H -ATOM 2652 HE2 MET 169 16.828 -5.097 10.340 1.00 0.00 H -ATOM 2653 HE3 MET 169 16.752 -3.833 9.185 1.00 0.00 H -ATOM 2654 C MET 169 16.220 -4.463 14.819 1.00 0.00 C -ATOM 2655 O MET 169 17.410 -4.255 14.744 1.00 0.00 O -ATOM 2656 N PHE 170 15.781 -5.726 14.814 1.00 0.00 N -ATOM 2657 H PHE 170 14.776 -5.784 14.748 1.00 0.00 H -ATOM 2658 CA PHE 170 16.494 -6.915 15.206 1.00 0.00 C -ATOM 2659 HA PHE 170 17.523 -6.787 14.868 1.00 0.00 H -ATOM 2660 CB PHE 170 16.367 -6.900 16.712 1.00 0.00 C -ATOM 2661 HB2 PHE 170 15.324 -6.781 17.008 1.00 0.00 H -ATOM 2662 HB3 PHE 170 16.735 -7.817 17.172 1.00 0.00 H -ATOM 2663 CG PHE 170 17.142 -5.769 17.356 1.00 0.00 C -ATOM 2664 CD1 PHE 170 16.419 -4.592 17.890 1.00 0.00 C -ATOM 2665 HD1 PHE 170 15.342 -4.578 17.820 1.00 0.00 H -ATOM 2666 CE1 PHE 170 17.137 -3.687 18.670 1.00 0.00 C -ATOM 2667 HE1 PHE 170 16.582 -2.871 19.109 1.00 0.00 H -ATOM 2668 CZ PHE 170 18.564 -3.792 18.827 1.00 0.00 C -ATOM 2669 HZ PHE 170 19.130 -3.082 19.411 1.00 0.00 H -ATOM 2670 CE2 PHE 170 19.238 -4.858 18.220 1.00 0.00 C -ATOM 2671 HE2 PHE 170 20.302 -4.991 18.351 1.00 0.00 H -ATOM 2672 CD2 PHE 170 18.584 -5.831 17.469 1.00 0.00 C -ATOM 2673 HD2 PHE 170 19.140 -6.648 17.038 1.00 0.00 H -ATOM 2674 C PHE 170 15.925 -8.182 14.531 1.00 0.00 C -ATOM 2675 O PHE 170 14.916 -8.152 13.820 1.00 0.00 O -ATOM 2676 N ASP 171 16.617 -9.293 14.559 1.00 0.00 N -ATOM 2677 H ASP 171 17.542 -9.288 14.963 1.00 0.00 H -ATOM 2678 CA ASP 171 16.258 -10.585 14.020 1.00 0.00 C -ATOM 2679 HA ASP 171 15.912 -10.515 12.989 1.00 0.00 H -ATOM 2680 CB ASP 171 17.527 -11.581 14.059 1.00 0.00 C -ATOM 2681 HB2 ASP 171 17.862 -11.649 15.094 1.00 0.00 H -ATOM 2682 HB3 ASP 171 17.245 -12.493 13.532 1.00 0.00 H -ATOM 2683 CG ASP 171 18.677 -11.122 13.206 1.00 0.00 C -ATOM 2684 OD1 ASP 171 18.576 -10.180 12.382 1.00 0.00 O -ATOM 2685 OD2 ASP 171 19.812 -11.703 13.224 1.00 0.00 O -ATOM 2686 C ASP 171 15.093 -11.200 14.833 1.00 0.00 C -ATOM 2687 O ASP 171 14.629 -10.730 15.874 1.00 0.00 O -ATOM 2688 N ASP 172 14.595 -12.313 14.249 1.00 0.00 N -ATOM 2689 H ASP 172 14.919 -12.552 13.323 1.00 0.00 H -ATOM 2690 CA ASP 172 13.531 -13.172 14.776 1.00 0.00 C -ATOM 2691 HA ASP 172 13.354 -12.768 15.773 1.00 0.00 H -ATOM 2692 CB ASP 172 12.205 -13.026 14.069 1.00 0.00 C -ATOM 2693 HB2 ASP 172 12.036 -11.982 13.809 1.00 0.00 H -ATOM 2694 HB3 ASP 172 12.288 -13.314 13.021 1.00 0.00 H -ATOM 2695 CG ASP 172 11.031 -13.772 14.707 1.00 0.00 C -ATOM 2696 OD1 ASP 172 9.961 -13.834 14.026 1.00 0.00 O -ATOM 2697 OD2 ASP 172 11.115 -14.402 15.826 1.00 0.00 O -ATOM 2698 C ASP 172 13.917 -14.622 14.826 1.00 0.00 C -ATOM 2699 O ASP 172 13.625 -15.367 13.869 1.00 0.00 O -ATOM 2700 N PRO 173 14.495 -15.197 15.944 1.00 0.00 N -ATOM 2701 CD PRO 173 14.785 -14.350 17.042 1.00 0.00 C -ATOM 2702 HD2 PRO 173 13.867 -14.357 17.631 1.00 0.00 H -ATOM 2703 HD3 PRO 173 15.007 -13.316 16.782 1.00 0.00 H -ATOM 2704 CG PRO 173 16.046 -14.958 17.617 1.00 0.00 C -ATOM 2705 HG2 PRO 173 16.186 -14.642 18.651 1.00 0.00 H -ATOM 2706 HG3 PRO 173 16.869 -14.740 16.937 1.00 0.00 H -ATOM 2707 CB PRO 173 15.715 -16.412 17.563 1.00 0.00 C -ATOM 2708 HB2 PRO 173 15.004 -16.709 18.335 1.00 0.00 H -ATOM 2709 HB3 PRO 173 16.551 -17.102 17.676 1.00 0.00 H -ATOM 2710 CA PRO 173 15.108 -16.551 16.119 1.00 0.00 C -ATOM 2711 HA PRO 173 15.900 -16.693 15.384 1.00 0.00 H -ATOM 2712 C PRO 173 14.117 -17.703 16.039 1.00 0.00 C -ATOM 2713 O PRO 173 14.495 -18.905 16.150 1.00 0.00 O -ATOM 2714 N ARG 174 12.817 -17.428 15.819 1.00 0.00 N -ATOM 2715 H ARG 174 12.503 -16.471 15.895 1.00 0.00 H -ATOM 2716 CA ARG 174 11.843 -18.397 15.315 1.00 0.00 C -ATOM 2717 HA ARG 174 11.876 -19.280 15.953 1.00 0.00 H -ATOM 2718 CB ARG 174 10.485 -17.795 15.420 1.00 0.00 C -ATOM 2719 HB2 ARG 174 10.481 -16.868 14.847 1.00 0.00 H -ATOM 2720 HB3 ARG 174 9.689 -18.488 15.150 1.00 0.00 H -ATOM 2721 CG ARG 174 10.228 -17.443 16.862 1.00 0.00 C -ATOM 2722 HG2 ARG 174 10.270 -18.311 17.521 1.00 0.00 H -ATOM 2723 HG3 ARG 174 10.936 -16.713 17.254 1.00 0.00 H -ATOM 2724 CD ARG 174 8.785 -16.881 16.988 1.00 0.00 C -ATOM 2725 HD2 ARG 174 7.970 -17.535 16.675 1.00 0.00 H -ATOM 2726 HD3 ARG 174 8.663 -16.743 18.063 1.00 0.00 H -ATOM 2727 NE ARG 174 8.704 -15.580 16.328 1.00 0.00 N -ATOM 2728 HE ARG 174 9.525 -15.285 15.819 1.00 0.00 H -ATOM 2729 CZ ARG 174 7.749 -14.651 16.519 1.00 0.00 C -ATOM 2730 NH1 ARG 174 6.730 -14.779 17.343 1.00 0.00 N -ATOM 2731 HH11 ARG 174 6.644 -15.575 17.958 1.00 0.00 H -ATOM 2732 HH12 ARG 174 6.037 -14.059 17.487 1.00 0.00 H -ATOM 2733 NH2 ARG 174 7.775 -13.561 15.876 1.00 0.00 N -ATOM 2734 HH21 ARG 174 8.490 -13.424 15.176 1.00 0.00 H -ATOM 2735 HH22 ARG 174 7.054 -12.869 16.020 1.00 0.00 H -ATOM 2736 C ARG 174 12.080 -18.859 13.858 1.00 0.00 C -ATOM 2737 O ARG 174 11.856 -20.023 13.618 1.00 0.00 O -ATOM 2738 N ASN 175 12.717 -18.101 13.040 1.00 0.00 N -ATOM 2739 H ASN 175 12.789 -17.098 13.130 1.00 0.00 H -ATOM 2740 CA ASN 175 13.328 -18.621 11.779 1.00 0.00 C -ATOM 2741 HA ASN 175 13.609 -19.664 11.929 1.00 0.00 H -ATOM 2742 CB ASN 175 12.255 -18.609 10.726 1.00 0.00 C -ATOM 2743 HB2 ASN 175 12.738 -19.189 9.940 1.00 0.00 H -ATOM 2744 HB3 ASN 175 11.386 -19.138 11.117 1.00 0.00 H -ATOM 2745 CG ASN 175 11.858 -17.213 10.332 1.00 0.00 C -ATOM 2746 OD1 ASN 175 12.169 -16.209 10.979 1.00 0.00 O -ATOM 2747 ND2 ASN 175 11.136 -17.053 9.265 1.00 0.00 N -ATOM 2748 HD21 ASN 175 10.730 -16.153 9.047 1.00 0.00 H -ATOM 2749 HD22 ASN 175 10.926 -17.847 8.678 1.00 0.00 H -ATOM 2750 C ASN 175 14.563 -17.869 11.326 1.00 0.00 C -ATOM 2751 O ASN 175 15.073 -18.171 10.256 1.00 0.00 O -ATOM 2752 N LYS 176 15.210 -17.083 12.190 1.00 0.00 N -ATOM 2753 H LYS 176 14.640 -17.035 13.023 1.00 0.00 H -ATOM 2754 CA LYS 176 16.408 -16.154 12.016 1.00 0.00 C -ATOM 2755 HA LYS 176 16.487 -15.600 12.952 1.00 0.00 H -ATOM 2756 CB LYS 176 17.689 -16.990 11.751 1.00 0.00 C -ATOM 2757 HB2 LYS 176 17.609 -17.835 12.435 1.00 0.00 H -ATOM 2758 HB3 LYS 176 17.750 -17.298 10.706 1.00 0.00 H -ATOM 2759 CG LYS 176 19.030 -16.166 11.869 1.00 0.00 C -ATOM 2760 HG2 LYS 176 19.811 -16.925 11.911 1.00 0.00 H -ATOM 2761 HG3 LYS 176 19.203 -15.531 11.000 1.00 0.00 H -ATOM 2762 CD LYS 176 19.090 -15.334 13.095 1.00 0.00 C -ATOM 2763 HD2 LYS 176 18.654 -14.339 13.007 1.00 0.00 H -ATOM 2764 HD3 LYS 176 18.466 -15.755 13.883 1.00 0.00 H -ATOM 2765 CE LYS 176 20.525 -15.156 13.632 1.00 0.00 C -ATOM 2766 HE2 LYS 176 20.423 -14.828 14.666 1.00 0.00 H -ATOM 2767 HE3 LYS 176 21.033 -16.119 13.680 1.00 0.00 H -ATOM 2768 NZ LYS 176 21.293 -14.075 12.966 1.00 0.00 N -ATOM 2769 HZ1 LYS 176 22.265 -13.952 13.211 1.00 0.00 H -ATOM 2770 HZ2 LYS 176 21.250 -14.321 11.987 1.00 0.00 H -ATOM 2771 HZ3 LYS 176 20.869 -13.162 13.050 1.00 0.00 H -ATOM 2772 C LYS 176 16.233 -15.136 10.854 1.00 0.00 C -ATOM 2773 O LYS 176 16.449 -13.926 11.097 1.00 0.00 O -ATOM 2774 N ARG 177 15.640 -15.540 9.755 1.00 0.00 N -ATOM 2775 H ARG 177 15.450 -16.532 9.709 1.00 0.00 H -ATOM 2776 CA ARG 177 15.299 -14.804 8.554 1.00 0.00 C -ATOM 2777 HA ARG 177 16.202 -14.361 8.135 1.00 0.00 H -ATOM 2778 CB ARG 177 14.680 -15.850 7.554 1.00 0.00 C -ATOM 2779 HB2 ARG 177 13.961 -16.488 8.069 1.00 0.00 H -ATOM 2780 HB3 ARG 177 14.123 -15.327 6.776 1.00 0.00 H -ATOM 2781 CG ARG 177 15.748 -16.770 6.972 1.00 0.00 C -ATOM 2782 HG2 ARG 177 16.379 -16.198 6.292 1.00 0.00 H -ATOM 2783 HG3 ARG 177 16.433 -17.084 7.760 1.00 0.00 H -ATOM 2784 CD ARG 177 15.149 -17.995 6.255 1.00 0.00 C -ATOM 2785 HD2 ARG 177 15.926 -18.617 5.811 1.00 0.00 H -ATOM 2786 HD3 ARG 177 14.620 -18.646 6.952 1.00 0.00 H -ATOM 2787 NE ARG 177 14.155 -17.582 5.231 1.00 0.00 N -ATOM 2788 HE ARG 177 14.572 -16.936 4.576 1.00 0.00 H -ATOM 2789 CZ ARG 177 12.836 -17.662 5.208 1.00 0.00 C -ATOM 2790 NH1 ARG 177 12.087 -18.373 5.933 1.00 0.00 N -ATOM 2791 HH11 ARG 177 12.473 -19.093 6.527 1.00 0.00 H -ATOM 2792 HH12 ARG 177 11.100 -18.163 5.898 1.00 0.00 H -ATOM 2793 NH2 ARG 177 12.132 -16.869 4.449 1.00 0.00 N -ATOM 2794 HH21 ARG 177 12.580 -16.142 3.907 1.00 0.00 H -ATOM 2795 HH22 ARG 177 11.124 -16.917 4.452 1.00 0.00 H -ATOM 2796 C ARG 177 14.230 -13.729 8.834 1.00 0.00 C -ATOM 2797 O ARG 177 14.228 -12.646 8.212 1.00 0.00 O -ATOM 2798 N GLY 178 13.410 -13.960 9.830 1.00 0.00 N -ATOM 2799 H GLY 178 13.261 -14.929 10.074 1.00 0.00 H -ATOM 2800 CA GLY 178 12.392 -13.005 10.312 1.00 0.00 C -ATOM 2801 HA2 GLY 178 11.763 -12.516 9.567 1.00 0.00 H -ATOM 2802 HA3 GLY 178 11.791 -13.501 11.075 1.00 0.00 H -ATOM 2803 C GLY 178 13.072 -11.773 10.994 1.00 0.00 C -ATOM 2804 O GLY 178 14.283 -11.709 11.147 1.00 0.00 O -ATOM 2805 N VAL 179 12.212 -10.865 11.323 1.00 0.00 N -ATOM 2806 H VAL 179 11.242 -11.140 11.369 1.00 0.00 H -ATOM 2807 CA VAL 179 12.427 -9.525 11.785 1.00 0.00 C -ATOM 2808 HA VAL 179 13.395 -9.526 12.286 1.00 0.00 H -ATOM 2809 CB VAL 179 12.544 -8.549 10.495 1.00 0.00 C -ATOM 2810 HB VAL 179 11.685 -8.578 9.825 1.00 0.00 H -ATOM 2811 CG1 VAL 179 12.847 -7.086 10.881 1.00 0.00 C -ATOM 2812 HG11 VAL 179 13.702 -7.056 11.557 1.00 0.00 H -ATOM 2813 HG12 VAL 179 12.908 -6.475 9.981 1.00 0.00 H -ATOM 2814 HG13 VAL 179 11.948 -6.710 11.369 1.00 0.00 H -ATOM 2815 CG2 VAL 179 13.680 -9.074 9.668 1.00 0.00 C -ATOM 2816 HG21 VAL 179 14.225 -8.327 9.091 1.00 0.00 H -ATOM 2817 HG22 VAL 179 14.533 -9.483 10.209 1.00 0.00 H -ATOM 2818 HG23 VAL 179 13.308 -9.871 9.023 1.00 0.00 H -ATOM 2819 C VAL 179 11.470 -8.949 12.801 1.00 0.00 C -ATOM 2820 O VAL 179 10.289 -9.137 12.645 1.00 0.00 O -ATOM 2821 N ILE 180 11.986 -8.318 13.854 1.00 0.00 N -ATOM 2822 H ILE 180 12.988 -8.186 13.865 1.00 0.00 H -ATOM 2823 CA ILE 180 11.125 -7.602 14.821 1.00 0.00 C -ATOM 2824 HA ILE 180 10.069 -7.777 14.617 1.00 0.00 H -ATOM 2825 CB ILE 180 11.356 -8.259 16.211 1.00 0.00 C -ATOM 2826 HB ILE 180 12.378 -8.006 16.493 1.00 0.00 H -ATOM 2827 CG2 ILE 180 10.449 -7.573 17.245 1.00 0.00 C -ATOM 2828 HG21 ILE 180 10.740 -7.909 18.240 1.00 0.00 H -ATOM 2829 HG22 ILE 180 10.467 -6.484 17.288 1.00 0.00 H -ATOM 2830 HG23 ILE 180 9.432 -7.910 17.047 1.00 0.00 H -ATOM 2831 CG1 ILE 180 11.382 -9.811 16.290 1.00 0.00 C -ATOM 2832 HG12 ILE 180 12.113 -10.235 15.601 1.00 0.00 H -ATOM 2833 HG13 ILE 180 11.634 -10.122 17.304 1.00 0.00 H -ATOM 2834 CD1 ILE 180 10.042 -10.458 15.804 1.00 0.00 C -ATOM 2835 HD11 ILE 180 9.168 -10.152 16.380 1.00 0.00 H -ATOM 2836 HD12 ILE 180 9.878 -10.216 14.754 1.00 0.00 H -ATOM 2837 HD13 ILE 180 10.124 -11.539 15.686 1.00 0.00 H -ATOM 2838 C ILE 180 11.438 -6.093 14.838 1.00 0.00 C -ATOM 2839 O ILE 180 12.595 -5.688 14.654 1.00 0.00 O -ATOM 2840 N ILE 181 10.364 -5.306 15.081 1.00 0.00 N -ATOM 2841 H ILE 181 9.458 -5.733 14.953 1.00 0.00 H -ATOM 2842 CA ILE 181 10.525 -3.870 15.444 1.00 0.00 C -ATOM 2843 HA ILE 181 11.526 -3.544 15.160 1.00 0.00 H -ATOM 2844 CB ILE 181 9.550 -3.003 14.606 1.00 0.00 C -ATOM 2845 HB ILE 181 8.518 -3.280 14.823 1.00 0.00 H -ATOM 2846 CG2 ILE 181 9.773 -1.532 14.875 1.00 0.00 C -ATOM 2847 HG21 ILE 181 9.511 -1.189 15.877 1.00 0.00 H -ATOM 2848 HG22 ILE 181 10.829 -1.262 14.826 1.00 0.00 H -ATOM 2849 HG23 ILE 181 9.193 -0.930 14.175 1.00 0.00 H -ATOM 2850 CG1 ILE 181 9.830 -3.268 13.152 1.00 0.00 C -ATOM 2851 HG12 ILE 181 9.938 -2.314 12.636 1.00 0.00 H -ATOM 2852 HG13 ILE 181 10.792 -3.758 13.005 1.00 0.00 H -ATOM 2853 CD1 ILE 181 8.764 -4.118 12.440 1.00 0.00 C -ATOM 2854 HD11 ILE 181 7.806 -3.617 12.584 1.00 0.00 H -ATOM 2855 HD12 ILE 181 8.981 -4.160 11.373 1.00 0.00 H -ATOM 2856 HD13 ILE 181 8.671 -5.109 12.884 1.00 0.00 H -ATOM 2857 C ILE 181 10.416 -3.723 16.972 1.00 0.00 C -ATOM 2858 O ILE 181 9.355 -3.932 17.552 1.00 0.00 O -ATOM 2859 N LYS 182 11.548 -3.451 17.655 1.00 0.00 N -ATOM 2860 H LYS 182 12.397 -3.350 17.117 1.00 0.00 H -ATOM 2861 CA LYS 182 11.652 -3.300 19.105 1.00 0.00 C -ATOM 2862 HA LYS 182 11.224 -4.180 19.584 1.00 0.00 H -ATOM 2863 CB LYS 182 13.146 -3.353 19.518 1.00 0.00 C -ATOM 2864 HB2 LYS 182 13.614 -4.264 19.145 1.00 0.00 H -ATOM 2865 HB3 LYS 182 13.713 -2.447 19.301 1.00 0.00 H -ATOM 2866 CG LYS 182 13.282 -3.540 21.063 1.00 0.00 C -ATOM 2867 HG2 LYS 182 12.776 -2.758 21.629 1.00 0.00 H -ATOM 2868 HG3 LYS 182 12.836 -4.456 21.450 1.00 0.00 H -ATOM 2869 CD LYS 182 14.782 -3.549 21.429 1.00 0.00 C -ATOM 2870 HD2 LYS 182 15.399 -4.064 20.693 1.00 0.00 H -ATOM 2871 HD3 LYS 182 15.088 -2.503 21.478 1.00 0.00 H -ATOM 2872 CE LYS 182 14.920 -4.204 22.834 1.00 0.00 C -ATOM 2873 HE2 LYS 182 14.301 -3.638 23.530 1.00 0.00 H -ATOM 2874 HE3 LYS 182 14.692 -5.270 22.813 1.00 0.00 H -ATOM 2875 NZ LYS 182 16.391 -4.158 23.089 1.00 0.00 N -ATOM 2876 HZ1 LYS 182 16.676 -4.446 24.015 1.00 0.00 H -ATOM 2877 HZ2 LYS 182 16.869 -4.781 22.453 1.00 0.00 H -ATOM 2878 HZ3 LYS 182 16.763 -3.227 22.962 1.00 0.00 H -ATOM 2879 C LYS 182 10.854 -2.089 19.624 1.00 0.00 C -ATOM 2880 O LYS 182 11.153 -0.900 19.525 1.00 0.00 O -ATOM 2881 N GLY 183 9.821 -2.472 20.338 1.00 0.00 N -ATOM 2882 H GLY 183 9.748 -3.461 20.532 1.00 0.00 H -ATOM 2883 CA GLY 183 8.985 -1.518 21.070 1.00 0.00 C -ATOM 2884 HA2 GLY 183 8.590 -2.039 21.942 1.00 0.00 H -ATOM 2885 HA3 GLY 183 9.596 -0.670 21.380 1.00 0.00 H -ATOM 2886 C GLY 183 7.846 -1.059 20.250 1.00 0.00 C -ATOM 2887 O GLY 183 7.226 0.001 20.547 1.00 0.00 O -ATOM 2888 N LEU 184 7.546 -1.634 19.056 1.00 0.00 N -ATOM 2889 H LEU 184 8.179 -2.308 18.649 1.00 0.00 H -ATOM 2890 CA LEU 184 6.228 -1.431 18.411 1.00 0.00 C -ATOM 2891 HA LEU 184 5.902 -0.391 18.385 1.00 0.00 H -ATOM 2892 CB LEU 184 6.512 -1.834 16.909 1.00 0.00 C -ATOM 2893 HB2 LEU 184 7.218 -1.110 16.502 1.00 0.00 H -ATOM 2894 HB3 LEU 184 6.903 -2.851 16.865 1.00 0.00 H -ATOM 2895 CG LEU 184 5.333 -1.636 15.946 1.00 0.00 C -ATOM 2896 HG LEU 184 4.562 -2.236 16.429 1.00 0.00 H -ATOM 2897 CD1 LEU 184 4.949 -0.229 15.836 1.00 0.00 C -ATOM 2898 HD11 LEU 184 4.077 -0.184 15.185 1.00 0.00 H -ATOM 2899 HD12 LEU 184 4.637 0.137 16.814 1.00 0.00 H -ATOM 2900 HD13 LEU 184 5.695 0.393 15.337 1.00 0.00 H -ATOM 2901 CD2 LEU 184 5.591 -2.132 14.520 1.00 0.00 C -ATOM 2902 HD21 LEU 184 6.192 -1.404 13.974 1.00 0.00 H -ATOM 2903 HD22 LEU 184 6.269 -2.985 14.551 1.00 0.00 H -ATOM 2904 HD23 LEU 184 4.627 -2.360 14.066 1.00 0.00 H -ATOM 2905 C LEU 184 5.187 -2.419 19.019 1.00 0.00 C -ATOM 2906 O LEU 184 5.495 -3.606 19.158 1.00 0.00 O -ATOM 2907 N GLU 185 4.036 -1.951 19.420 1.00 0.00 N -ATOM 2908 H GLU 185 3.813 -0.978 19.262 1.00 0.00 H -ATOM 2909 CA GLU 185 3.101 -2.772 20.297 1.00 0.00 C -ATOM 2910 HA GLU 185 3.231 -3.846 20.166 1.00 0.00 H -ATOM 2911 CB GLU 185 3.462 -2.516 21.753 1.00 0.00 C -ATOM 2912 HB2 GLU 185 4.528 -2.715 21.860 1.00 0.00 H -ATOM 2913 HB3 GLU 185 3.370 -1.448 21.952 1.00 0.00 H -ATOM 2914 CG GLU 185 2.658 -3.345 22.783 1.00 0.00 C -ATOM 2915 HG2 GLU 185 2.954 -2.849 23.708 1.00 0.00 H -ATOM 2916 HG3 GLU 185 1.607 -3.152 22.573 1.00 0.00 H -ATOM 2917 CD GLU 185 2.948 -4.822 22.805 1.00 0.00 C -ATOM 2918 OE1 GLU 185 2.114 -5.627 23.222 1.00 0.00 O -ATOM 2919 OE2 GLU 185 4.065 -5.253 22.598 1.00 0.00 O -ATOM 2920 C GLU 185 1.669 -2.374 19.979 1.00 0.00 C -ATOM 2921 O GLU 185 1.348 -1.191 20.129 1.00 0.00 O -ATOM 2922 N GLU 186 0.816 -3.335 19.585 1.00 0.00 N -ATOM 2923 H GLU 186 1.051 -4.298 19.779 1.00 0.00 H -ATOM 2924 CA GLU 186 -0.476 -3.026 19.068 1.00 0.00 C -ATOM 2925 HA GLU 186 -0.338 -2.408 18.181 1.00 0.00 H -ATOM 2926 CB GLU 186 -1.160 -4.312 18.469 1.00 0.00 C -ATOM 2927 HB2 GLU 186 -1.728 -4.759 19.285 1.00 0.00 H -ATOM 2928 HB3 GLU 186 -1.841 -3.913 17.716 1.00 0.00 H -ATOM 2929 CG GLU 186 -0.190 -5.327 17.826 1.00 0.00 C -ATOM 2930 HG2 GLU 186 -0.692 -5.883 17.035 1.00 0.00 H -ATOM 2931 HG3 GLU 186 0.627 -4.762 17.375 1.00 0.00 H -ATOM 2932 CD GLU 186 0.354 -6.379 18.848 1.00 0.00 C -ATOM 2933 OE1 GLU 186 -0.381 -7.382 19.132 1.00 0.00 O -ATOM 2934 OE2 GLU 186 1.467 -6.200 19.402 1.00 0.00 O -ATOM 2935 C GLU 186 -1.440 -2.371 20.118 1.00 0.00 C -ATOM 2936 O GLU 186 -1.500 -2.668 21.248 1.00 0.00 O -ATOM 2937 N ILE 187 -2.281 -1.460 19.578 1.00 0.00 N -ATOM 2938 H ILE 187 -2.133 -1.229 18.605 1.00 0.00 H -ATOM 2939 CA ILE 187 -3.455 -0.898 20.344 1.00 0.00 C -ATOM 2940 HA ILE 187 -3.146 -0.972 21.386 1.00 0.00 H -ATOM 2941 CB ILE 187 -3.793 0.574 19.908 1.00 0.00 C -ATOM 2942 HB ILE 187 -3.997 0.546 18.838 1.00 0.00 H -ATOM 2943 CG2 ILE 187 -5.054 1.130 20.550 1.00 0.00 C -ATOM 2944 HG21 ILE 187 -5.869 0.683 19.980 1.00 0.00 H -ATOM 2945 HG22 ILE 187 -5.061 0.842 21.601 1.00 0.00 H -ATOM 2946 HG23 ILE 187 -5.141 2.195 20.335 1.00 0.00 H -ATOM 2947 CG1 ILE 187 -2.595 1.588 20.052 1.00 0.00 C -ATOM 2948 HG12 ILE 187 -1.749 0.981 19.731 1.00 0.00 H -ATOM 2949 HG13 ILE 187 -2.743 2.411 19.352 1.00 0.00 H -ATOM 2950 CD1 ILE 187 -2.332 2.064 21.451 1.00 0.00 C -ATOM 2951 HD11 ILE 187 -3.245 2.564 21.773 1.00 0.00 H -ATOM 2952 HD12 ILE 187 -2.120 1.286 22.185 1.00 0.00 H -ATOM 2953 HD13 ILE 187 -1.498 2.758 21.338 1.00 0.00 H -ATOM 2954 C ILE 187 -4.675 -1.699 20.208 1.00 0.00 C -ATOM 2955 O ILE 187 -5.057 -1.909 19.069 1.00 0.00 O -ATOM 2956 N THR 188 -5.325 -2.116 21.298 1.00 0.00 N -ATOM 2957 H THR 188 -4.936 -1.833 22.185 1.00 0.00 H -ATOM 2958 CA THR 188 -6.619 -2.770 21.228 1.00 0.00 C -ATOM 2959 HA THR 188 -6.770 -3.386 20.342 1.00 0.00 H -ATOM 2960 CB THR 188 -6.910 -3.576 22.585 1.00 0.00 C -ATOM 2961 HB THR 188 -6.761 -2.947 23.462 1.00 0.00 H -ATOM 2962 CG2 THR 188 -8.329 -4.160 22.670 1.00 0.00 C -ATOM 2963 HG21 THR 188 -8.472 -4.937 21.921 1.00 0.00 H -ATOM 2964 HG22 THR 188 -8.569 -4.635 23.622 1.00 0.00 H -ATOM 2965 HG23 THR 188 -9.031 -3.343 22.500 1.00 0.00 H -ATOM 2966 OG1 THR 188 -5.977 -4.647 22.503 1.00 0.00 O -ATOM 2967 HG1 THR 188 -5.103 -4.304 22.302 1.00 0.00 H -ATOM 2968 C THR 188 -7.674 -1.650 21.100 1.00 0.00 C -ATOM 2969 O THR 188 -7.680 -0.659 21.853 1.00 0.00 O -ATOM 2970 N VAL 189 -8.717 -1.843 20.224 1.00 0.00 N -ATOM 2971 H VAL 189 -8.573 -2.681 19.680 1.00 0.00 H -ATOM 2972 CA VAL 189 -9.686 -0.719 19.914 1.00 0.00 C -ATOM 2973 HA VAL 189 -9.849 -0.104 20.799 1.00 0.00 H -ATOM 2974 CB VAL 189 -9.031 0.192 18.878 1.00 0.00 C -ATOM 2975 HB VAL 189 -8.048 0.481 19.251 1.00 0.00 H -ATOM 2976 CG1 VAL 189 -8.759 -0.370 17.471 1.00 0.00 C -ATOM 2977 HG11 VAL 189 -8.024 0.285 17.004 1.00 0.00 H -ATOM 2978 HG12 VAL 189 -8.411 -1.391 17.631 1.00 0.00 H -ATOM 2979 HG13 VAL 189 -9.603 -0.470 16.789 1.00 0.00 H -ATOM 2980 CG2 VAL 189 -9.939 1.475 18.686 1.00 0.00 C -ATOM 2981 HG21 VAL 189 -10.901 1.277 18.213 1.00 0.00 H -ATOM 2982 HG22 VAL 189 -9.958 1.840 19.712 1.00 0.00 H -ATOM 2983 HG23 VAL 189 -9.442 2.275 18.135 1.00 0.00 H -ATOM 2984 C VAL 189 -11.042 -1.284 19.441 1.00 0.00 C -ATOM 2985 O VAL 189 -11.039 -2.261 18.729 1.00 0.00 O -ATOM 2986 N HIE 190 -12.147 -0.706 19.859 1.00 0.00 N -ATOM 2987 H HIE 190 -12.094 0.062 20.514 1.00 0.00 H -ATOM 2988 CA HIE 190 -13.531 -1.252 19.730 1.00 0.00 C -ATOM 2989 HA HIE 190 -13.533 -2.277 19.358 1.00 0.00 H -ATOM 2990 CB HIE 190 -14.131 -1.203 21.144 1.00 0.00 C -ATOM 2991 HB2 HIE 190 -15.215 -1.148 21.043 1.00 0.00 H -ATOM 2992 HB3 HIE 190 -13.988 -2.121 21.714 1.00 0.00 H -ATOM 2993 CG HIE 190 -13.880 0.044 22.011 1.00 0.00 C -ATOM 2994 ND1 HIE 190 -13.968 1.403 21.544 1.00 0.00 N -ATOM 2995 CE1 HIE 190 -13.834 2.141 22.669 1.00 0.00 C -ATOM 2996 HE1 HIE 190 -13.856 3.219 22.720 1.00 0.00 H -ATOM 2997 NE2 HIE 190 -13.660 1.391 23.765 1.00 0.00 N -ATOM 2998 HE2 HIE 190 -13.514 1.700 24.716 1.00 0.00 H -ATOM 2999 CD2 HIE 190 -13.770 0.065 23.344 1.00 0.00 C -ATOM 3000 HD2 HIE 190 -13.594 -0.804 23.960 1.00 0.00 H -ATOM 3001 C HIE 190 -14.391 -0.439 18.777 1.00 0.00 C -ATOM 3002 O HIE 190 -15.532 -0.844 18.582 1.00 0.00 O -ATOM 3003 N ASN 191 -13.984 0.724 18.342 1.00 0.00 N -ATOM 3004 H ASN 191 -13.190 1.102 18.839 1.00 0.00 H -ATOM 3005 CA ASN 191 -14.821 1.641 17.522 1.00 0.00 C -ATOM 3006 HA ASN 191 -15.623 1.112 17.005 1.00 0.00 H -ATOM 3007 CB ASN 191 -15.401 2.577 18.658 1.00 0.00 C -ATOM 3008 HB2 ASN 191 -16.051 2.023 19.336 1.00 0.00 H -ATOM 3009 HB3 ASN 191 -14.599 3.135 19.142 1.00 0.00 H -ATOM 3010 CG ASN 191 -16.396 3.543 18.065 1.00 0.00 C -ATOM 3011 OD1 ASN 191 -16.055 4.728 17.949 1.00 0.00 O -ATOM 3012 ND2 ASN 191 -17.538 3.149 17.634 1.00 0.00 N -ATOM 3013 HD21 ASN 191 -18.186 3.862 17.335 1.00 0.00 H -ATOM 3014 HD22 ASN 191 -17.817 2.180 17.673 1.00 0.00 H -ATOM 3015 C ASN 191 -13.976 2.454 16.487 1.00 0.00 C -ATOM 3016 O ASN 191 -12.821 2.643 16.782 1.00 0.00 O -ATOM 3017 N LYS 192 -14.547 2.811 15.304 1.00 0.00 N -ATOM 3018 H LYS 192 -15.512 2.577 15.118 1.00 0.00 H -ATOM 3019 CA LYS 192 -13.782 3.496 14.245 1.00 0.00 C -ATOM 3020 HA LYS 192 -12.888 2.906 14.044 1.00 0.00 H -ATOM 3021 CB LYS 192 -14.703 3.525 13.006 1.00 0.00 C -ATOM 3022 HB2 LYS 192 -14.156 3.863 12.126 1.00 0.00 H -ATOM 3023 HB3 LYS 192 -14.942 2.486 12.776 1.00 0.00 H -ATOM 3024 CG LYS 192 -16.033 4.337 13.131 1.00 0.00 C -ATOM 3025 HG2 LYS 192 -16.597 4.062 14.021 1.00 0.00 H -ATOM 3026 HG3 LYS 192 -15.808 5.403 13.153 1.00 0.00 H -ATOM 3027 CD LYS 192 -16.915 4.060 11.940 1.00 0.00 C -ATOM 3028 HD2 LYS 192 -16.269 4.425 11.142 1.00 0.00 H -ATOM 3029 HD3 LYS 192 -17.172 3.018 11.755 1.00 0.00 H -ATOM 3030 CE LYS 192 -18.233 4.945 11.831 1.00 0.00 C -ATOM 3031 HE2 LYS 192 -18.753 4.669 10.914 1.00 0.00 H -ATOM 3032 HE3 LYS 192 -18.836 4.608 12.673 1.00 0.00 H -ATOM 3033 NZ LYS 192 -17.935 6.414 11.948 1.00 0.00 N -ATOM 3034 HZ1 LYS 192 -17.478 6.715 11.099 1.00 0.00 H -ATOM 3035 HZ2 LYS 192 -18.827 6.884 12.020 1.00 0.00 H -ATOM 3036 HZ3 LYS 192 -17.445 6.650 12.799 1.00 0.00 H -ATOM 3037 C LYS 192 -13.461 4.924 14.689 1.00 0.00 C -ATOM 3038 O LYS 192 -12.358 5.340 14.310 1.00 0.00 O -ATOM 3039 N ASP 193 -14.287 5.621 15.393 1.00 0.00 N -ATOM 3040 H ASP 193 -15.247 5.338 15.527 1.00 0.00 H -ATOM 3041 CA ASP 193 -14.069 7.043 15.647 1.00 0.00 C -ATOM 3042 HA ASP 193 -13.797 7.416 14.660 1.00 0.00 H -ATOM 3043 CB ASP 193 -15.269 7.766 16.239 1.00 0.00 C -ATOM 3044 HB2 ASP 193 -15.284 7.520 17.301 1.00 0.00 H -ATOM 3045 HB3 ASP 193 -15.132 8.840 16.113 1.00 0.00 H -ATOM 3046 CG ASP 193 -16.657 7.352 15.635 1.00 0.00 C -ATOM 3047 OD1 ASP 193 -16.831 7.089 14.418 1.00 0.00 O -ATOM 3048 OD2 ASP 193 -17.678 7.359 16.411 1.00 0.00 O -ATOM 3049 C ASP 193 -12.778 7.260 16.492 1.00 0.00 C -ATOM 3050 O ASP 193 -12.262 8.378 16.566 1.00 0.00 O -ATOM 3051 N GLU 194 -12.398 6.241 17.242 1.00 0.00 N -ATOM 3052 H GLU 194 -12.891 5.360 17.264 1.00 0.00 H -ATOM 3053 CA GLU 194 -11.265 6.178 18.158 1.00 0.00 C -ATOM 3054 HA GLU 194 -11.087 7.139 18.641 1.00 0.00 H -ATOM 3055 CB GLU 194 -11.486 5.134 19.208 1.00 0.00 C -ATOM 3056 HB2 GLU 194 -11.688 4.154 18.775 1.00 0.00 H -ATOM 3057 HB3 GLU 194 -10.505 5.048 19.676 1.00 0.00 H -ATOM 3058 CG GLU 194 -12.503 5.452 20.336 1.00 0.00 C -ATOM 3059 HG2 GLU 194 -13.288 6.005 19.822 1.00 0.00 H -ATOM 3060 HG3 GLU 194 -12.971 4.588 20.809 1.00 0.00 H -ATOM 3061 CD GLU 194 -12.022 6.407 21.450 1.00 0.00 C -ATOM 3062 OE1 GLU 194 -11.124 7.302 21.340 1.00 0.00 O -ATOM 3063 OE2 GLU 194 -12.651 6.236 22.508 1.00 0.00 O -ATOM 3064 C GLU 194 -9.941 5.977 17.418 1.00 0.00 C -ATOM 3065 O GLU 194 -8.975 6.593 17.812 1.00 0.00 O -ATOM 3066 N VAL 195 -9.907 5.184 16.350 1.00 0.00 N -ATOM 3067 H VAL 195 -10.729 4.672 16.061 1.00 0.00 H -ATOM 3068 CA VAL 195 -8.791 5.063 15.430 1.00 0.00 C -ATOM 3069 HA VAL 195 -7.901 5.064 16.059 1.00 0.00 H -ATOM 3070 CB VAL 195 -8.778 3.754 14.532 1.00 0.00 C -ATOM 3071 HB VAL 195 -9.748 3.777 14.035 1.00 0.00 H -ATOM 3072 CG1 VAL 195 -7.488 3.546 13.632 1.00 0.00 C -ATOM 3073 HG11 VAL 195 -6.641 3.736 14.293 1.00 0.00 H -ATOM 3074 HG12 VAL 195 -7.333 2.544 13.233 1.00 0.00 H -ATOM 3075 HG13 VAL 195 -7.251 4.337 12.921 1.00 0.00 H -ATOM 3076 CG2 VAL 195 -8.845 2.563 15.460 1.00 0.00 C -ATOM 3077 HG21 VAL 195 -9.790 2.459 15.993 1.00 0.00 H -ATOM 3078 HG22 VAL 195 -8.703 1.651 14.879 1.00 0.00 H -ATOM 3079 HG23 VAL 195 -8.103 2.507 16.257 1.00 0.00 H -ATOM 3080 C VAL 195 -8.635 6.355 14.587 1.00 0.00 C -ATOM 3081 O VAL 195 -7.506 6.718 14.181 1.00 0.00 O -ATOM 3082 N TYR 196 -9.721 7.033 14.265 1.00 0.00 N -ATOM 3083 H TYR 196 -10.550 6.596 14.640 1.00 0.00 H -ATOM 3084 CA TYR 196 -9.736 8.360 13.679 1.00 0.00 C -ATOM 3085 HA TYR 196 -9.134 8.364 12.771 1.00 0.00 H -ATOM 3086 CB TYR 196 -11.200 8.726 13.410 1.00 0.00 C -ATOM 3087 HB2 TYR 196 -11.820 8.589 14.296 1.00 0.00 H -ATOM 3088 HB3 TYR 196 -11.292 9.811 13.403 1.00 0.00 H -ATOM 3089 CG TYR 196 -11.893 7.990 12.234 1.00 0.00 C -ATOM 3090 CD1 TYR 196 -11.239 7.094 11.344 1.00 0.00 C -ATOM 3091 HD1 TYR 196 -10.172 6.965 11.444 1.00 0.00 H -ATOM 3092 CE1 TYR 196 -11.948 6.434 10.364 1.00 0.00 C -ATOM 3093 HE1 TYR 196 -11.425 5.845 9.625 1.00 0.00 H -ATOM 3094 CZ TYR 196 -13.320 6.556 10.302 1.00 0.00 C -ATOM 3095 OH TYR 196 -14.078 5.855 9.364 1.00 0.00 O -ATOM 3096 HH TYR 196 -14.918 6.319 9.395 1.00 0.00 H -ATOM 3097 CE2 TYR 196 -14.008 7.377 11.225 1.00 0.00 C -ATOM 3098 HE2 TYR 196 -15.082 7.413 11.339 1.00 0.00 H -ATOM 3099 CD2 TYR 196 -13.261 8.139 12.167 1.00 0.00 C -ATOM 3100 HD2 TYR 196 -13.890 8.826 12.716 1.00 0.00 H -ATOM 3101 C TYR 196 -8.995 9.404 14.549 1.00 0.00 C -ATOM 3102 O TYR 196 -8.178 10.054 13.909 1.00 0.00 O -ATOM 3103 N GLN 197 -9.319 9.651 15.831 1.00 0.00 N -ATOM 3104 H GLN 197 -10.140 9.217 16.230 1.00 0.00 H -ATOM 3105 CA GLN 197 -8.532 10.481 16.740 1.00 0.00 C -ATOM 3106 HA GLN 197 -8.479 11.514 16.394 1.00 0.00 H -ATOM 3107 CB GLN 197 -9.142 10.282 18.179 1.00 0.00 C -ATOM 3108 HB2 GLN 197 -9.004 9.250 18.503 1.00 0.00 H -ATOM 3109 HB3 GLN 197 -8.540 10.920 18.826 1.00 0.00 H -ATOM 3110 CG GLN 197 -10.560 10.708 18.461 1.00 0.00 C -ATOM 3111 HG2 GLN 197 -10.767 11.675 18.003 1.00 0.00 H -ATOM 3112 HG3 GLN 197 -11.147 9.935 17.964 1.00 0.00 H -ATOM 3113 CD GLN 197 -10.950 10.767 19.947 1.00 0.00 C -ATOM 3114 OE1 GLN 197 -10.145 10.872 20.873 1.00 0.00 O -ATOM 3115 NE2 GLN 197 -12.231 10.764 20.201 1.00 0.00 N -ATOM 3116 HE21 GLN 197 -12.578 10.563 21.127 1.00 0.00 H -ATOM 3117 HE22 GLN 197 -12.923 10.804 19.466 1.00 0.00 H -ATOM 3118 C GLN 197 -7.101 9.984 16.801 1.00 0.00 C -ATOM 3119 O GLN 197 -6.198 10.811 17.140 1.00 0.00 O -ATOM 3120 N ILE 198 -6.781 8.747 16.427 1.00 0.00 N -ATOM 3121 H ILE 198 -7.529 8.086 16.274 1.00 0.00 H -ATOM 3122 CA ILE 198 -5.368 8.379 16.345 1.00 0.00 C -ATOM 3123 HA ILE 198 -4.812 8.750 17.205 1.00 0.00 H -ATOM 3124 CB ILE 198 -5.182 6.891 16.699 1.00 0.00 C -ATOM 3125 HB ILE 198 -5.904 6.291 16.145 1.00 0.00 H -ATOM 3126 CG2 ILE 198 -3.824 6.337 16.135 1.00 0.00 C -ATOM 3127 HG21 ILE 198 -2.991 6.735 16.715 1.00 0.00 H -ATOM 3128 HG22 ILE 198 -3.920 5.278 16.372 1.00 0.00 H -ATOM 3129 HG23 ILE 198 -3.720 6.502 15.062 1.00 0.00 H -ATOM 3130 CG1 ILE 198 -5.541 6.727 18.234 1.00 0.00 C -ATOM 3131 HG12 ILE 198 -4.753 7.277 18.747 1.00 0.00 H -ATOM 3132 HG13 ILE 198 -6.484 7.251 18.395 1.00 0.00 H -ATOM 3133 CD1 ILE 198 -5.577 5.240 18.730 1.00 0.00 C -ATOM 3134 HD11 ILE 198 -4.560 4.878 18.583 1.00 0.00 H -ATOM 3135 HD12 ILE 198 -5.848 5.273 19.785 1.00 0.00 H -ATOM 3136 HD13 ILE 198 -6.266 4.613 18.164 1.00 0.00 H -ATOM 3137 C ILE 198 -4.690 8.895 15.064 1.00 0.00 C -ATOM 3138 O ILE 198 -3.694 9.521 15.167 1.00 0.00 O -ATOM 3139 N LEU 199 -5.322 8.678 13.942 1.00 0.00 N -ATOM 3140 H LEU 199 -6.155 8.108 13.929 1.00 0.00 H -ATOM 3141 CA LEU 199 -4.794 9.096 12.587 1.00 0.00 C -ATOM 3142 HA LEU 199 -3.752 8.781 12.525 1.00 0.00 H -ATOM 3143 CB LEU 199 -5.669 8.509 11.482 1.00 0.00 C -ATOM 3144 HB2 LEU 199 -6.687 8.681 11.833 1.00 0.00 H -ATOM 3145 HB3 LEU 199 -5.650 9.118 10.578 1.00 0.00 H -ATOM 3146 CG LEU 199 -5.509 6.994 11.119 1.00 0.00 C -ATOM 3147 HG LEU 199 -5.509 6.393 12.029 1.00 0.00 H -ATOM 3148 CD1 LEU 199 -6.634 6.491 10.238 1.00 0.00 C -ATOM 3149 HD11 LEU 199 -6.437 5.445 10.002 1.00 0.00 H -ATOM 3150 HD12 LEU 199 -7.547 6.651 10.811 1.00 0.00 H -ATOM 3151 HD13 LEU 199 -6.759 7.003 9.284 1.00 0.00 H -ATOM 3152 CD2 LEU 199 -4.213 6.837 10.346 1.00 0.00 C -ATOM 3153 HD21 LEU 199 -3.367 7.257 10.889 1.00 0.00 H -ATOM 3154 HD22 LEU 199 -4.002 5.771 10.417 1.00 0.00 H -ATOM 3155 HD23 LEU 199 -4.397 7.100 9.304 1.00 0.00 H -ATOM 3156 C LEU 199 -4.647 10.613 12.475 1.00 0.00 C -ATOM 3157 O LEU 199 -3.833 11.063 11.691 1.00 0.00 O -ATOM 3158 N GLU 200 -5.425 11.398 13.219 1.00 0.00 N -ATOM 3159 H GLU 200 -6.249 10.986 13.631 1.00 0.00 H -ATOM 3160 CA GLU 200 -5.386 12.890 13.280 1.00 0.00 C -ATOM 3161 HA GLU 200 -5.305 13.276 12.264 1.00 0.00 H -ATOM 3162 CB GLU 200 -6.655 13.368 13.860 1.00 0.00 C -ATOM 3163 HB2 GLU 200 -6.767 12.778 14.769 1.00 0.00 H -ATOM 3164 HB3 GLU 200 -6.564 14.360 14.302 1.00 0.00 H -ATOM 3165 CG GLU 200 -7.912 13.251 12.942 1.00 0.00 C -ATOM 3166 HG2 GLU 200 -8.073 12.181 12.806 1.00 0.00 H -ATOM 3167 HG3 GLU 200 -8.784 13.713 13.405 1.00 0.00 H -ATOM 3168 CD GLU 200 -7.676 13.936 11.597 1.00 0.00 C -ATOM 3169 OE1 GLU 200 -7.997 13.298 10.578 1.00 0.00 O -ATOM 3170 OE2 GLU 200 -7.227 15.103 11.536 1.00 0.00 O -ATOM 3171 C GLU 200 -4.090 13.415 13.933 1.00 0.00 C -ATOM 3172 O GLU 200 -3.324 14.138 13.317 1.00 0.00 O -ATOM 3173 N LYS 201 -3.702 12.791 15.049 1.00 0.00 N -ATOM 3174 H LYS 201 -4.333 12.053 15.327 1.00 0.00 H -ATOM 3175 CA LYS 201 -2.345 12.945 15.631 1.00 0.00 C -ATOM 3176 HA LYS 201 -2.099 13.980 15.871 1.00 0.00 H -ATOM 3177 CB LYS 201 -2.322 12.129 16.942 1.00 0.00 C -ATOM 3178 HB2 LYS 201 -3.267 12.202 17.481 1.00 0.00 H -ATOM 3179 HB3 LYS 201 -2.247 11.073 16.683 1.00 0.00 H -ATOM 3180 CG LYS 201 -1.091 12.366 17.848 1.00 0.00 C -ATOM 3181 HG2 LYS 201 -1.324 11.812 18.757 1.00 0.00 H -ATOM 3182 HG3 LYS 201 -0.197 11.813 17.560 1.00 0.00 H -ATOM 3183 CD LYS 201 -0.643 13.769 18.234 1.00 0.00 C -ATOM 3184 HD2 LYS 201 0.194 13.643 18.920 1.00 0.00 H -ATOM 3185 HD3 LYS 201 -0.274 14.370 17.403 1.00 0.00 H -ATOM 3186 CE LYS 201 -1.732 14.666 18.854 1.00 0.00 C -ATOM 3187 HE2 LYS 201 -2.389 15.011 18.056 1.00 0.00 H -ATOM 3188 HE3 LYS 201 -2.402 14.101 19.502 1.00 0.00 H -ATOM 3189 NZ LYS 201 -1.093 15.846 19.520 1.00 0.00 N -ATOM 3190 HZ1 LYS 201 -0.571 16.433 18.885 1.00 0.00 H -ATOM 3191 HZ2 LYS 201 -1.778 16.365 20.051 1.00 0.00 H -ATOM 3192 HZ3 LYS 201 -0.415 15.597 20.226 1.00 0.00 H -ATOM 3193 C LYS 201 -1.234 12.456 14.633 1.00 0.00 C -ATOM 3194 O LYS 201 -0.231 13.124 14.508 1.00 0.00 O -ATOM 3195 N GLY 202 -1.408 11.311 14.024 1.00 0.00 N -ATOM 3196 H GLY 202 -2.235 10.750 14.173 1.00 0.00 H -ATOM 3197 CA GLY 202 -0.437 10.784 13.033 1.00 0.00 C -ATOM 3198 HA2 GLY 202 0.504 10.599 13.552 1.00 0.00 H -ATOM 3199 HA3 GLY 202 -0.797 9.812 12.697 1.00 0.00 H -ATOM 3200 C GLY 202 -0.144 11.727 11.891 1.00 0.00 C -ATOM 3201 O GLY 202 0.986 11.923 11.502 1.00 0.00 O -ATOM 3202 N ALA 203 -1.151 12.365 11.356 1.00 0.00 N -ATOM 3203 H ALA 203 -2.094 12.051 11.537 1.00 0.00 H -ATOM 3204 CA ALA 203 -1.065 13.521 10.365 1.00 0.00 C -ATOM 3205 HA ALA 203 -0.476 13.301 9.475 1.00 0.00 H -ATOM 3206 CB ALA 203 -2.436 14.010 9.958 1.00 0.00 C -ATOM 3207 HB1 ALA 203 -2.999 14.490 10.759 1.00 0.00 H -ATOM 3208 HB2 ALA 203 -2.321 14.745 9.161 1.00 0.00 H -ATOM 3209 HB3 ALA 203 -3.033 13.171 9.599 1.00 0.00 H -ATOM 3210 C ALA 203 -0.255 14.753 10.874 1.00 0.00 C -ATOM 3211 O ALA 203 0.356 15.525 10.087 1.00 0.00 O -ATOM 3212 N ALA 204 -0.389 15.036 12.234 1.00 0.00 N -ATOM 3213 H ALA 204 -0.971 14.493 12.856 1.00 0.00 H -ATOM 3214 CA ALA 204 0.313 16.128 12.857 1.00 0.00 C -ATOM 3215 HA ALA 204 0.185 16.931 12.131 1.00 0.00 H -ATOM 3216 CB ALA 204 -0.280 16.405 14.225 1.00 0.00 C -ATOM 3217 HB1 ALA 204 0.252 17.225 14.707 1.00 0.00 H -ATOM 3218 HB2 ALA 204 -1.349 16.607 14.174 1.00 0.00 H -ATOM 3219 HB3 ALA 204 -0.086 15.546 14.869 1.00 0.00 H -ATOM 3220 C ALA 204 1.812 15.805 12.947 1.00 0.00 C -ATOM 3221 O ALA 204 2.606 16.521 12.365 1.00 0.00 O -ATOM 3222 N LYS 205 2.291 14.680 13.470 1.00 0.00 N -ATOM 3223 H LYS 205 1.610 14.018 13.815 1.00 0.00 H -ATOM 3224 CA LYS 205 3.659 14.177 13.429 1.00 0.00 C -ATOM 3225 HA LYS 205 4.278 14.968 13.852 1.00 0.00 H -ATOM 3226 CB LYS 205 3.944 12.958 14.261 1.00 0.00 C -ATOM 3227 HB2 LYS 205 3.382 13.162 15.173 1.00 0.00 H -ATOM 3228 HB3 LYS 205 3.398 12.130 13.812 1.00 0.00 H -ATOM 3229 CG LYS 205 5.321 12.589 14.643 1.00 0.00 C -ATOM 3230 HG2 LYS 205 5.603 11.923 13.828 1.00 0.00 H -ATOM 3231 HG3 LYS 205 5.921 13.492 14.748 1.00 0.00 H -ATOM 3232 CD LYS 205 5.581 11.860 15.975 1.00 0.00 C -ATOM 3233 HD2 LYS 205 6.530 11.326 15.996 1.00 0.00 H -ATOM 3234 HD3 LYS 205 5.499 12.538 16.825 1.00 0.00 H -ATOM 3235 CE LYS 205 4.473 10.710 16.062 1.00 0.00 C -ATOM 3236 HE2 LYS 205 3.573 11.309 16.195 1.00 0.00 H -ATOM 3237 HE3 LYS 205 4.465 10.119 15.146 1.00 0.00 H -ATOM 3238 NZ LYS 205 4.584 9.971 17.287 1.00 0.00 N -ATOM 3239 HZ1 LYS 205 3.844 9.289 17.371 1.00 0.00 H -ATOM 3240 HZ2 LYS 205 5.489 9.545 17.425 1.00 0.00 H -ATOM 3241 HZ3 LYS 205 4.399 10.559 18.088 1.00 0.00 H -ATOM 3242 C LYS 205 4.078 14.087 11.928 1.00 0.00 C -ATOM 3243 O LYS 205 5.156 14.642 11.569 1.00 0.00 O -ATOM 3244 N ARG 206 3.311 13.401 11.035 1.00 0.00 N -ATOM 3245 H ARG 206 2.396 13.046 11.273 1.00 0.00 H -ATOM 3246 CA ARG 206 3.596 13.437 9.610 1.00 0.00 C -ATOM 3247 HA ARG 206 4.525 12.903 9.409 1.00 0.00 H -ATOM 3248 CB ARG 206 2.511 12.897 8.706 1.00 0.00 C -ATOM 3249 HB2 ARG 206 1.502 13.216 8.966 1.00 0.00 H -ATOM 3250 HB3 ARG 206 2.649 13.113 7.646 1.00 0.00 H -ATOM 3251 CG ARG 206 2.661 11.376 8.690 1.00 0.00 C -ATOM 3252 HG2 ARG 206 3.506 11.033 8.095 1.00 0.00 H -ATOM 3253 HG3 ARG 206 2.915 10.953 9.662 1.00 0.00 H -ATOM 3254 CD ARG 206 1.404 10.582 8.318 1.00 0.00 C -ATOM 3255 HD2 ARG 206 0.698 10.670 9.145 1.00 0.00 H -ATOM 3256 HD3 ARG 206 1.005 11.022 7.404 1.00 0.00 H -ATOM 3257 NE ARG 206 1.672 9.204 7.984 1.00 0.00 N -ATOM 3258 HE ARG 206 2.634 8.954 7.801 1.00 0.00 H -ATOM 3259 CZ ARG 206 0.801 8.211 7.912 1.00 0.00 C -ATOM 3260 NH1 ARG 206 -0.469 8.389 8.108 1.00 0.00 N -ATOM 3261 HH11 ARG 206 -0.885 9.305 8.013 1.00 0.00 H -ATOM 3262 HH12 ARG 206 -1.071 7.578 8.117 1.00 0.00 H -ATOM 3263 NH2 ARG 206 1.175 7.029 7.887 1.00 0.00 N -ATOM 3264 HH21 ARG 206 2.140 6.814 7.680 1.00 0.00 H -ATOM 3265 HH22 ARG 206 0.535 6.248 7.923 1.00 0.00 H -ATOM 3266 C ARG 206 3.972 14.849 9.128 1.00 0.00 C -ATOM 3267 O ARG 206 4.994 15.013 8.496 1.00 0.00 O -ATOM 3268 N THR 207 3.135 15.893 9.321 1.00 0.00 N -ATOM 3269 H THR 207 2.324 15.759 9.906 1.00 0.00 H -ATOM 3270 CA THR 207 3.350 17.229 8.694 1.00 0.00 C -ATOM 3271 HA THR 207 3.540 17.116 7.627 1.00 0.00 H -ATOM 3272 CB THR 207 2.145 18.121 8.903 1.00 0.00 C -ATOM 3273 HB THR 207 1.973 18.288 9.967 1.00 0.00 H -ATOM 3274 CG2 THR 207 2.311 19.347 8.051 1.00 0.00 C -ATOM 3275 HG21 THR 207 2.844 20.167 8.533 1.00 0.00 H -ATOM 3276 HG22 THR 207 2.857 19.177 7.122 1.00 0.00 H -ATOM 3277 HG23 THR 207 1.325 19.736 7.800 1.00 0.00 H -ATOM 3278 OG1 THR 207 0.938 17.465 8.355 1.00 0.00 O -ATOM 3279 HG1 THR 207 0.774 16.854 9.077 1.00 0.00 H -ATOM 3280 C THR 207 4.582 17.975 9.267 1.00 0.00 C -ATOM 3281 O THR 207 5.205 18.759 8.558 1.00 0.00 O -ATOM 3282 N THR 208 5.037 17.668 10.557 1.00 0.00 N -ATOM 3283 H THR 208 4.522 17.159 11.262 1.00 0.00 H -ATOM 3284 CA THR 208 6.264 18.210 11.106 1.00 0.00 C -ATOM 3285 HA THR 208 6.384 19.286 10.979 1.00 0.00 H -ATOM 3286 CB THR 208 6.219 18.065 12.588 1.00 0.00 C -ATOM 3287 HB THR 208 6.290 17.000 12.808 1.00 0.00 H -ATOM 3288 CG2 THR 208 7.413 18.792 13.243 1.00 0.00 C -ATOM 3289 HG21 THR 208 8.230 18.120 12.979 1.00 0.00 H -ATOM 3290 HG22 THR 208 7.626 19.762 12.795 1.00 0.00 H -ATOM 3291 HG23 THR 208 7.310 18.889 14.324 1.00 0.00 H -ATOM 3292 OG1 THR 208 5.026 18.639 13.179 1.00 0.00 O -ATOM 3293 HG1 THR 208 4.843 18.216 14.022 1.00 0.00 H -ATOM 3294 C THR 208 7.532 17.564 10.525 1.00 0.00 C -ATOM 3295 O THR 208 8.589 18.158 10.287 1.00 0.00 O -ATOM 3296 N ALA 209 7.438 16.304 10.294 1.00 0.00 N -ATOM 3297 H ALA 209 6.593 15.778 10.461 1.00 0.00 H -ATOM 3298 CA ALA 209 8.422 15.512 9.520 1.00 0.00 C -ATOM 3299 HA ALA 209 9.373 15.726 10.008 1.00 0.00 H -ATOM 3300 CB ALA 209 7.945 14.106 9.631 1.00 0.00 C -ATOM 3301 HB1 ALA 209 8.723 13.480 9.193 1.00 0.00 H -ATOM 3302 HB2 ALA 209 7.702 13.737 10.627 1.00 0.00 H -ATOM 3303 HB3 ALA 209 7.057 13.972 9.013 1.00 0.00 H -ATOM 3304 C ALA 209 8.504 16.030 8.052 1.00 0.00 C -ATOM 3305 O ALA 209 9.595 16.260 7.532 1.00 0.00 O -ATOM 3306 N ALA 210 7.367 16.324 7.359 1.00 0.00 N -ATOM 3307 H ALA 210 6.546 15.950 7.814 1.00 0.00 H -ATOM 3308 CA ALA 210 7.336 16.919 6.029 1.00 0.00 C -ATOM 3309 HA ALA 210 8.121 16.419 5.464 1.00 0.00 H -ATOM 3310 CB ALA 210 5.878 16.767 5.539 1.00 0.00 C -ATOM 3311 HB1 ALA 210 5.541 15.737 5.429 1.00 0.00 H -ATOM 3312 HB2 ALA 210 5.202 17.382 6.133 1.00 0.00 H -ATOM 3313 HB3 ALA 210 5.788 17.108 4.508 1.00 0.00 H -ATOM 3314 C ALA 210 7.871 18.423 6.032 1.00 0.00 C -ATOM 3315 O ALA 210 8.644 18.873 5.172 1.00 0.00 O -ATOM 3316 N THR 211 7.640 19.230 7.082 1.00 0.00 N -ATOM 3317 H THR 211 6.976 18.822 7.724 1.00 0.00 H -ATOM 3318 CA THR 211 8.044 20.573 7.367 1.00 0.00 C -ATOM 3319 HA THR 211 7.850 21.025 6.394 1.00 0.00 H -ATOM 3320 CB THR 211 7.248 21.243 8.462 1.00 0.00 C -ATOM 3321 HB THR 211 7.451 20.706 9.389 1.00 0.00 H -ATOM 3322 CG2 THR 211 7.796 22.621 8.770 1.00 0.00 C -ATOM 3323 HG21 THR 211 7.672 23.390 8.007 1.00 0.00 H -ATOM 3324 HG22 THR 211 7.244 22.952 9.649 1.00 0.00 H -ATOM 3325 HG23 THR 211 8.832 22.474 9.079 1.00 0.00 H -ATOM 3326 OG1 THR 211 5.907 21.446 8.114 1.00 0.00 O -ATOM 3327 HG1 THR 211 5.371 20.651 8.156 1.00 0.00 H -ATOM 3328 C THR 211 9.592 20.639 7.522 1.00 0.00 C -ATOM 3329 O THR 211 10.220 21.524 6.849 1.00 0.00 O -ATOM 3330 N LEU 212 10.173 19.676 8.282 1.00 0.00 N -ATOM 3331 H LEU 212 9.630 19.030 8.836 1.00 0.00 H -ATOM 3332 CA LEU 212 11.616 19.743 8.554 1.00 0.00 C -ATOM 3333 HA LEU 212 11.906 20.793 8.533 1.00 0.00 H -ATOM 3334 CB LEU 212 11.984 19.122 9.948 1.00 0.00 C -ATOM 3335 HB2 LEU 212 11.389 18.220 10.085 1.00 0.00 H -ATOM 3336 HB3 LEU 212 13.040 18.849 9.982 1.00 0.00 H -ATOM 3337 CG LEU 212 11.714 20.096 11.102 1.00 0.00 C -ATOM 3338 HG LEU 212 10.757 20.592 10.949 1.00 0.00 H -ATOM 3339 CD1 LEU 212 11.571 19.440 12.471 1.00 0.00 C -ATOM 3340 HD11 LEU 212 10.558 19.063 12.611 1.00 0.00 H -ATOM 3341 HD12 LEU 212 12.273 18.647 12.724 1.00 0.00 H -ATOM 3342 HD13 LEU 212 11.748 20.175 13.257 1.00 0.00 H -ATOM 3343 CD2 LEU 212 12.725 21.222 11.070 1.00 0.00 C -ATOM 3344 HD21 LEU 212 13.655 20.716 10.812 1.00 0.00 H -ATOM 3345 HD22 LEU 212 12.473 21.942 10.292 1.00 0.00 H -ATOM 3346 HD23 LEU 212 12.806 21.728 12.033 1.00 0.00 H -ATOM 3347 C LEU 212 12.403 19.141 7.411 1.00 0.00 C -ATOM 3348 O LEU 212 13.577 19.455 7.374 1.00 0.00 O -ATOM 3349 N MET 213 11.881 18.189 6.631 1.00 0.00 N -ATOM 3350 H MET 213 10.997 17.834 6.967 1.00 0.00 H -ATOM 3351 CA MET 213 12.547 17.335 5.632 1.00 0.00 C -ATOM 3352 HA MET 213 13.536 17.781 5.530 1.00 0.00 H -ATOM 3353 CB MET 213 12.668 15.858 6.074 1.00 0.00 C -ATOM 3354 HB2 MET 213 11.680 15.537 6.401 1.00 0.00 H -ATOM 3355 HB3 MET 213 12.986 15.250 5.226 1.00 0.00 H -ATOM 3356 CG MET 213 13.729 15.626 7.205 1.00 0.00 C -ATOM 3357 HG2 MET 213 14.676 15.964 6.785 1.00 0.00 H -ATOM 3358 HG3 MET 213 13.517 16.272 8.057 1.00 0.00 H -ATOM 3359 SD MET 213 13.850 13.932 7.839 1.00 0.00 S -ATOM 3360 CE MET 213 12.131 13.510 7.985 1.00 0.00 C -ATOM 3361 HE1 MET 213 11.990 12.480 8.312 1.00 0.00 H -ATOM 3362 HE2 MET 213 11.700 14.214 8.697 1.00 0.00 H -ATOM 3363 HE3 MET 213 11.750 13.494 6.963 1.00 0.00 H -ATOM 3364 C MET 213 11.835 17.442 4.266 1.00 0.00 C -ATOM 3365 O MET 213 10.701 16.921 4.105 1.00 0.00 O -ATOM 3366 N ASN 214 12.466 18.011 3.263 1.00 0.00 N -ATOM 3367 H ASN 214 13.424 18.276 3.448 1.00 0.00 H -ATOM 3368 CA ASN 214 11.825 18.346 1.956 1.00 0.00 C -ATOM 3369 HA ASN 214 10.834 18.661 2.286 1.00 0.00 H -ATOM 3370 CB ASN 214 12.542 19.504 1.349 1.00 0.00 C -ATOM 3371 HB2 ASN 214 12.455 20.327 2.058 1.00 0.00 H -ATOM 3372 HB3 ASN 214 13.609 19.318 1.227 1.00 0.00 H -ATOM 3373 CG ASN 214 11.898 19.860 0.021 1.00 0.00 C -ATOM 3374 OD1 ASN 214 12.003 19.130 -0.967 1.00 0.00 O -ATOM 3375 ND2 ASN 214 11.228 20.973 -0.085 1.00 0.00 N -ATOM 3376 HD21 ASN 214 10.631 21.151 -0.879 1.00 0.00 H -ATOM 3377 HD22 ASN 214 11.469 21.704 0.571 1.00 0.00 H -ATOM 3378 C ASN 214 11.601 17.106 1.043 1.00 0.00 C -ATOM 3379 O ASN 214 10.626 17.059 0.241 1.00 0.00 O -ATOM 3380 N ALA 215 12.367 16.044 1.296 1.00 0.00 N -ATOM 3381 H ALA 215 13.136 16.079 1.950 1.00 0.00 H -ATOM 3382 CA ALA 215 12.194 14.801 0.612 1.00 0.00 C -ATOM 3383 HA ALA 215 12.024 15.071 -0.431 1.00 0.00 H -ATOM 3384 CB ALA 215 13.508 14.005 0.758 1.00 0.00 C -ATOM 3385 HB1 ALA 215 13.753 13.959 1.819 1.00 0.00 H -ATOM 3386 HB2 ALA 215 13.370 12.950 0.521 1.00 0.00 H -ATOM 3387 HB3 ALA 215 14.223 14.518 0.116 1.00 0.00 H -ATOM 3388 C ALA 215 11.012 13.936 1.186 1.00 0.00 C -ATOM 3389 O ALA 215 10.462 13.119 0.517 1.00 0.00 O -ATOM 3390 N TYR 216 10.731 14.068 2.505 1.00 0.00 N -ATOM 3391 H TYR 216 11.207 14.756 3.070 1.00 0.00 H -ATOM 3392 CA TYR 216 9.857 13.153 3.235 1.00 0.00 C -ATOM 3393 HA TYR 216 10.370 12.191 3.236 1.00 0.00 H -ATOM 3394 CB TYR 216 9.773 13.678 4.706 1.00 0.00 C -ATOM 3395 HB2 TYR 216 10.817 13.662 5.022 1.00 0.00 H -ATOM 3396 HB3 TYR 216 9.497 14.731 4.656 1.00 0.00 H -ATOM 3397 CG TYR 216 8.797 12.899 5.641 1.00 0.00 C -ATOM 3398 CD1 TYR 216 7.495 13.281 5.605 1.00 0.00 C -ATOM 3399 HD1 TYR 216 7.223 14.046 4.891 1.00 0.00 H -ATOM 3400 CE1 TYR 216 6.536 12.647 6.383 1.00 0.00 C -ATOM 3401 HE1 TYR 216 5.495 12.928 6.441 1.00 0.00 H -ATOM 3402 CZ TYR 216 6.924 11.477 7.099 1.00 0.00 C -ATOM 3403 OH TYR 216 5.998 10.893 7.956 1.00 0.00 O -ATOM 3404 HH TYR 216 5.505 10.201 7.508 1.00 0.00 H -ATOM 3405 CE2 TYR 216 8.245 11.028 7.061 1.00 0.00 C -ATOM 3406 HE2 TYR 216 8.481 10.105 7.570 1.00 0.00 H -ATOM 3407 CD2 TYR 216 9.220 11.713 6.305 1.00 0.00 C -ATOM 3408 HD2 TYR 216 10.211 11.292 6.221 1.00 0.00 H -ATOM 3409 C TYR 216 8.520 12.942 2.533 1.00 0.00 C -ATOM 3410 O TYR 216 8.109 11.758 2.471 1.00 0.00 O -ATOM 3411 N SER 217 7.816 13.975 2.077 1.00 0.00 N -ATOM 3412 H SER 217 8.173 14.894 2.300 1.00 0.00 H -ATOM 3413 CA SER 217 6.411 13.750 1.646 1.00 0.00 C -ATOM 3414 HA SER 217 5.933 13.012 2.290 1.00 0.00 H -ATOM 3415 CB SER 217 5.651 15.016 1.708 1.00 0.00 C -ATOM 3416 HB2 SER 217 4.597 14.866 1.476 1.00 0.00 H -ATOM 3417 HB3 SER 217 5.644 15.322 2.754 1.00 0.00 H -ATOM 3418 OG SER 217 6.250 16.110 1.039 1.00 0.00 O -ATOM 3419 HG SER 217 6.754 16.508 1.753 1.00 0.00 H -ATOM 3420 C SER 217 6.404 13.012 0.291 1.00 0.00 C -ATOM 3421 O SER 217 5.264 12.682 -0.096 1.00 0.00 O -ATOM 3422 N SER 218 7.517 12.768 -0.429 1.00 0.00 N -ATOM 3423 H SER 218 8.353 13.193 -0.055 1.00 0.00 H -ATOM 3424 CA SER 218 7.500 11.872 -1.558 1.00 0.00 C -ATOM 3425 HA SER 218 6.504 11.506 -1.804 1.00 0.00 H -ATOM 3426 CB SER 218 7.923 12.748 -2.759 1.00 0.00 C -ATOM 3427 HB2 SER 218 7.897 12.051 -3.597 1.00 0.00 H -ATOM 3428 HB3 SER 218 7.195 13.555 -2.839 1.00 0.00 H -ATOM 3429 OG SER 218 9.192 13.389 -2.479 1.00 0.00 O -ATOM 3430 HG SER 218 8.961 14.121 -1.902 1.00 0.00 H -ATOM 3431 C SER 218 8.519 10.687 -1.422 1.00 0.00 C -ATOM 3432 O SER 218 8.522 9.870 -2.348 1.00 0.00 O -ATOM 3433 N ARG 219 9.109 10.467 -0.251 1.00 0.00 N -ATOM 3434 H ARG 219 8.886 11.071 0.528 1.00 0.00 H -ATOM 3435 CA ARG 219 10.088 9.359 0.070 1.00 0.00 C -ATOM 3436 HA ARG 219 10.105 8.519 -0.626 1.00 0.00 H -ATOM 3437 CB ARG 219 11.477 9.991 -0.098 1.00 0.00 C -ATOM 3438 HB2 ARG 219 11.588 10.930 0.445 1.00 0.00 H -ATOM 3439 HB3 ARG 219 12.143 9.278 0.388 1.00 0.00 H -ATOM 3440 CG ARG 219 11.986 10.255 -1.557 1.00 0.00 C -ATOM 3441 HG2 ARG 219 11.290 10.921 -2.068 1.00 0.00 H -ATOM 3442 HG3 ARG 219 12.938 10.785 -1.519 1.00 0.00 H -ATOM 3443 CD ARG 219 12.145 9.021 -2.388 1.00 0.00 C -ATOM 3444 HD2 ARG 219 12.990 8.559 -1.878 1.00 0.00 H -ATOM 3445 HD3 ARG 219 11.270 8.380 -2.283 1.00 0.00 H -ATOM 3446 NE ARG 219 12.539 9.247 -3.783 1.00 0.00 N -ATOM 3447 HE ARG 219 13.482 9.042 -4.075 1.00 0.00 H -ATOM 3448 CZ ARG 219 11.760 9.892 -4.647 1.00 0.00 C -ATOM 3449 NH1 ARG 219 10.491 10.103 -4.385 1.00 0.00 N -ATOM 3450 HH11 ARG 219 10.015 9.766 -3.561 1.00 0.00 H -ATOM 3451 HH12 ARG 219 9.875 10.423 -5.118 1.00 0.00 H -ATOM 3452 NH2 ARG 219 12.188 10.223 -5.829 1.00 0.00 N -ATOM 3453 HH21 ARG 219 13.141 10.068 -6.126 1.00 0.00 H -ATOM 3454 HH22 ARG 219 11.461 10.639 -6.394 1.00 0.00 H -ATOM 3455 C ARG 219 9.977 8.669 1.441 1.00 0.00 C -ATOM 3456 O ARG 219 10.843 7.908 1.753 1.00 0.00 O -ATOM 3457 N SER 220 8.911 8.932 2.120 1.00 0.00 N -ATOM 3458 H SER 220 8.260 9.646 1.825 1.00 0.00 H -ATOM 3459 CA SER 220 8.571 8.140 3.299 1.00 0.00 C -ATOM 3460 HA SER 220 9.402 7.637 3.793 1.00 0.00 H -ATOM 3461 CB SER 220 7.941 9.093 4.402 1.00 0.00 C -ATOM 3462 HB2 SER 220 7.496 8.490 5.192 1.00 0.00 H -ATOM 3463 HB3 SER 220 8.748 9.683 4.836 1.00 0.00 H -ATOM 3464 OG SER 220 6.918 9.928 3.885 1.00 0.00 O -ATOM 3465 HG SER 220 7.338 10.539 3.275 1.00 0.00 H -ATOM 3466 C SER 220 7.526 7.115 2.927 1.00 0.00 C -ATOM 3467 O SER 220 6.739 7.332 2.045 1.00 0.00 O -ATOM 3468 N HIE 221 7.410 6.026 3.707 1.00 0.00 N -ATOM 3469 H HIE 221 7.936 6.043 4.569 1.00 0.00 H -ATOM 3470 CA HIE 221 6.552 4.870 3.443 1.00 0.00 C -ATOM 3471 HA HIE 221 5.928 5.137 2.591 1.00 0.00 H -ATOM 3472 CB HIE 221 7.455 3.638 3.128 1.00 0.00 C -ATOM 3473 HB2 HIE 221 8.084 3.488 4.005 1.00 0.00 H -ATOM 3474 HB3 HIE 221 6.790 2.784 3.002 1.00 0.00 H -ATOM 3475 CG HIE 221 8.328 3.837 1.917 1.00 0.00 C -ATOM 3476 ND1 HIE 221 8.162 3.223 0.622 1.00 0.00 N -ATOM 3477 CE1 HIE 221 9.287 3.415 -0.053 1.00 0.00 C -ATOM 3478 HE1 HIE 221 9.399 3.156 -1.095 1.00 0.00 H -ATOM 3479 NE2 HIE 221 10.121 4.181 0.688 1.00 0.00 N -ATOM 3480 HE2 HIE 221 10.992 4.577 0.364 1.00 0.00 H -ATOM 3481 CD2 HIE 221 9.523 4.508 1.899 1.00 0.00 C -ATOM 3482 HD2 HIE 221 9.871 5.193 2.658 1.00 0.00 H -ATOM 3483 C HIE 221 5.729 4.685 4.705 1.00 0.00 C -ATOM 3484 O HIE 221 6.235 4.734 5.803 1.00 0.00 O -ATOM 3485 N SER 222 4.494 4.561 4.579 1.00 0.00 N -ATOM 3486 H SER 222 4.195 4.381 3.631 1.00 0.00 H -ATOM 3487 CA SER 222 3.441 4.211 5.656 1.00 0.00 C -ATOM 3488 HA SER 222 3.801 4.439 6.658 1.00 0.00 H -ATOM 3489 CB SER 222 2.195 4.937 5.208 1.00 0.00 C -ATOM 3490 HB2 SER 222 1.857 4.467 4.283 1.00 0.00 H -ATOM 3491 HB3 SER 222 1.513 4.642 6.005 1.00 0.00 H -ATOM 3492 OG SER 222 2.414 6.338 5.166 1.00 0.00 O -ATOM 3493 HG SER 222 3.019 6.506 5.891 1.00 0.00 H -ATOM 3494 C SER 222 3.163 2.703 5.592 1.00 0.00 C -ATOM 3495 O SER 222 2.839 2.191 4.523 1.00 0.00 O -ATOM 3496 N VAL 223 3.303 2.106 6.741 1.00 0.00 N -ATOM 3497 H VAL 223 3.525 2.686 7.537 1.00 0.00 H -ATOM 3498 CA VAL 223 2.957 0.662 6.980 1.00 0.00 C -ATOM 3499 HA VAL 223 2.515 0.231 6.081 1.00 0.00 H -ATOM 3500 CB VAL 223 4.268 -0.063 7.280 1.00 0.00 C -ATOM 3501 HB VAL 223 4.794 0.365 8.133 1.00 0.00 H -ATOM 3502 CG1 VAL 223 4.058 -1.557 7.624 1.00 0.00 C -ATOM 3503 HG11 VAL 223 3.672 -2.105 6.765 1.00 0.00 H -ATOM 3504 HG12 VAL 223 5.002 -2.076 7.786 1.00 0.00 H -ATOM 3505 HG13 VAL 223 3.410 -1.578 8.501 1.00 0.00 H -ATOM 3506 CG2 VAL 223 5.271 -0.109 6.175 1.00 0.00 C -ATOM 3507 HG21 VAL 223 5.537 0.920 5.935 1.00 0.00 H -ATOM 3508 HG22 VAL 223 6.209 -0.557 6.502 1.00 0.00 H -ATOM 3509 HG23 VAL 223 4.900 -0.575 5.262 1.00 0.00 H -ATOM 3510 C VAL 223 1.879 0.689 8.104 1.00 0.00 C -ATOM 3511 O VAL 223 2.180 0.665 9.313 1.00 0.00 O -ATOM 3512 N PHE 224 0.592 0.734 7.643 1.00 0.00 N -ATOM 3513 H PHE 224 0.512 0.787 6.638 1.00 0.00 H -ATOM 3514 CA PHE 224 -0.564 0.364 8.502 1.00 0.00 C -ATOM 3515 HA PHE 224 -0.427 0.747 9.513 1.00 0.00 H -ATOM 3516 CB PHE 224 -1.795 1.071 7.956 1.00 0.00 C -ATOM 3517 HB2 PHE 224 -1.494 2.112 7.852 1.00 0.00 H -ATOM 3518 HB3 PHE 224 -1.995 0.662 6.965 1.00 0.00 H -ATOM 3519 CG PHE 224 -3.143 0.940 8.702 1.00 0.00 C -ATOM 3520 CD1 PHE 224 -3.940 -0.198 8.686 1.00 0.00 C -ATOM 3521 HD1 PHE 224 -3.712 -0.971 7.968 1.00 0.00 H -ATOM 3522 CE1 PHE 224 -5.156 -0.175 9.336 1.00 0.00 C -ATOM 3523 HE1 PHE 224 -5.706 -1.104 9.316 1.00 0.00 H -ATOM 3524 CZ PHE 224 -5.610 0.943 10.001 1.00 0.00 C -ATOM 3525 HZ PHE 224 -6.500 1.022 10.608 1.00 0.00 H -ATOM 3526 CE2 PHE 224 -4.894 2.120 9.919 1.00 0.00 C -ATOM 3527 HE2 PHE 224 -5.286 2.953 10.484 1.00 0.00 H -ATOM 3528 CD2 PHE 224 -3.631 2.088 9.312 1.00 0.00 C -ATOM 3529 HD2 PHE 224 -3.022 2.971 9.436 1.00 0.00 H -ATOM 3530 C PHE 224 -0.855 -1.174 8.514 1.00 0.00 C -ATOM 3531 O PHE 224 -0.657 -1.887 7.563 1.00 0.00 O -ATOM 3532 N SER 225 -1.319 -1.550 9.689 1.00 0.00 N -ATOM 3533 H SER 225 -1.256 -0.969 10.514 1.00 0.00 H -ATOM 3534 CA SER 225 -1.872 -2.919 9.879 1.00 0.00 C -ATOM 3535 HA SER 225 -2.373 -3.188 8.949 1.00 0.00 H -ATOM 3536 CB SER 225 -0.795 -3.893 10.187 1.00 0.00 C -ATOM 3537 HB2 SER 225 -0.007 -3.655 9.473 1.00 0.00 H -ATOM 3538 HB3 SER 225 -0.486 -3.826 11.231 1.00 0.00 H -ATOM 3539 OG SER 225 -1.273 -5.187 9.936 1.00 0.00 O -ATOM 3540 HG SER 225 -0.950 -5.430 9.065 1.00 0.00 H -ATOM 3541 C SER 225 -3.065 -3.033 10.872 1.00 0.00 C -ATOM 3542 O SER 225 -2.986 -2.542 11.994 1.00 0.00 O -ATOM 3543 N VAL 226 -4.158 -3.724 10.484 1.00 0.00 N -ATOM 3544 H VAL 226 -4.147 -3.930 9.495 1.00 0.00 H -ATOM 3545 CA VAL 226 -5.228 -4.226 11.370 1.00 0.00 C -ATOM 3546 HA VAL 226 -4.987 -3.994 12.408 1.00 0.00 H -ATOM 3547 CB VAL 226 -6.597 -3.660 10.859 1.00 0.00 C -ATOM 3548 HB VAL 226 -6.557 -2.590 10.659 1.00 0.00 H -ATOM 3549 CG1 VAL 226 -7.058 -4.228 9.513 1.00 0.00 C -ATOM 3550 HG11 VAL 226 -7.119 -5.316 9.503 1.00 0.00 H -ATOM 3551 HG12 VAL 226 -7.968 -3.717 9.198 1.00 0.00 H -ATOM 3552 HG13 VAL 226 -6.273 -4.012 8.789 1.00 0.00 H -ATOM 3553 CG2 VAL 226 -7.731 -3.866 11.895 1.00 0.00 C -ATOM 3554 HG21 VAL 226 -7.903 -4.940 11.842 1.00 0.00 H -ATOM 3555 HG22 VAL 226 -7.319 -3.442 12.811 1.00 0.00 H -ATOM 3556 HG23 VAL 226 -8.679 -3.411 11.612 1.00 0.00 H -ATOM 3557 C VAL 226 -5.310 -5.720 11.388 1.00 0.00 C -ATOM 3558 O VAL 226 -5.156 -6.424 10.401 1.00 0.00 O -ATOM 3559 N THR 227 -5.398 -6.270 12.589 1.00 0.00 N -ATOM 3560 H THR 227 -5.595 -5.572 13.291 1.00 0.00 H -ATOM 3561 CA THR 227 -5.359 -7.629 13.014 1.00 0.00 C -ATOM 3562 HA THR 227 -5.396 -8.257 12.124 1.00 0.00 H -ATOM 3563 CB THR 227 -4.006 -8.063 13.651 1.00 0.00 C -ATOM 3564 HB THR 227 -3.282 -7.790 12.883 1.00 0.00 H -ATOM 3565 CG2 THR 227 -3.568 -7.346 14.893 1.00 0.00 C -ATOM 3566 HG21 THR 227 -2.528 -7.584 15.114 1.00 0.00 H -ATOM 3567 HG22 THR 227 -3.690 -6.264 14.902 1.00 0.00 H -ATOM 3568 HG23 THR 227 -4.117 -7.714 15.761 1.00 0.00 H -ATOM 3569 OG1 THR 227 -4.049 -9.441 13.986 1.00 0.00 O -ATOM 3570 HG1 THR 227 -3.164 -9.614 14.316 1.00 0.00 H -ATOM 3571 C THR 227 -6.598 -7.919 13.866 1.00 0.00 C -ATOM 3572 O THR 227 -6.936 -7.113 14.685 1.00 0.00 O -ATOM 3573 N ILE 228 -7.296 -9.030 13.690 1.00 0.00 N -ATOM 3574 H ILE 228 -6.830 -9.694 13.086 1.00 0.00 H -ATOM 3575 CA ILE 228 -8.685 -9.347 14.167 1.00 0.00 C -ATOM 3576 HA ILE 228 -9.161 -8.549 14.736 1.00 0.00 H -ATOM 3577 CB ILE 228 -9.596 -9.524 12.946 1.00 0.00 C -ATOM 3578 HB ILE 228 -9.361 -10.489 12.497 1.00 0.00 H -ATOM 3579 CG2 ILE 228 -10.982 -9.737 13.513 1.00 0.00 C -ATOM 3580 HG21 ILE 228 -11.482 -8.779 13.658 1.00 0.00 H -ATOM 3581 HG22 ILE 228 -11.478 -10.288 12.714 1.00 0.00 H -ATOM 3582 HG23 ILE 228 -10.991 -10.335 14.424 1.00 0.00 H -ATOM 3583 CG1 ILE 228 -9.395 -8.545 11.763 1.00 0.00 C -ATOM 3584 HG12 ILE 228 -9.662 -7.546 12.111 1.00 0.00 H -ATOM 3585 HG13 ILE 228 -8.355 -8.649 11.457 1.00 0.00 H -ATOM 3586 CD1 ILE 228 -10.247 -8.900 10.574 1.00 0.00 C -ATOM 3587 HD11 ILE 228 -11.313 -8.894 10.799 1.00 0.00 H -ATOM 3588 HD12 ILE 228 -9.984 -8.255 9.736 1.00 0.00 H -ATOM 3589 HD13 ILE 228 -10.041 -9.930 10.283 1.00 0.00 H -ATOM 3590 C ILE 228 -8.502 -10.589 15.024 1.00 0.00 C -ATOM 3591 O ILE 228 -8.057 -11.571 14.433 1.00 0.00 O -ATOM 3592 N HIE 229 -8.841 -10.595 16.317 1.00 0.00 N -ATOM 3593 H HIE 229 -9.220 -9.698 16.583 1.00 0.00 H -ATOM 3594 CA HIE 229 -9.022 -11.839 17.151 1.00 0.00 C -ATOM 3595 HA HIE 229 -8.335 -12.630 16.849 1.00 0.00 H -ATOM 3596 CB HIE 229 -8.510 -11.456 18.609 1.00 0.00 C -ATOM 3597 HB2 HIE 229 -7.607 -10.855 18.503 1.00 0.00 H -ATOM 3598 HB3 HIE 229 -9.068 -10.732 19.203 1.00 0.00 H -ATOM 3599 CG HIE 229 -8.423 -12.587 19.598 1.00 0.00 C -ATOM 3600 ND1 HIE 229 -9.469 -13.514 19.876 1.00 0.00 N -ATOM 3601 CE1 HIE 229 -8.938 -14.257 20.901 1.00 0.00 C -ATOM 3602 HE1 HIE 229 -9.453 -15.077 21.378 1.00 0.00 H -ATOM 3603 NE2 HIE 229 -7.703 -13.811 21.247 1.00 0.00 N -ATOM 3604 HE2 HIE 229 -7.078 -14.152 21.963 1.00 0.00 H -ATOM 3605 CD2 HIE 229 -7.397 -12.777 20.466 1.00 0.00 C -ATOM 3606 HD2 HIE 229 -6.492 -12.189 20.468 1.00 0.00 H -ATOM 3607 C HIE 229 -10.416 -12.543 17.058 1.00 0.00 C -ATOM 3608 O HIE 229 -11.410 -11.902 17.149 1.00 0.00 O -ATOM 3609 N MET 230 -10.437 -13.887 16.928 1.00 0.00 N -ATOM 3610 H MET 230 -9.577 -14.393 17.083 1.00 0.00 H -ATOM 3611 CA MET 230 -11.588 -14.787 16.760 1.00 0.00 C -ATOM 3612 HA MET 230 -12.429 -14.337 17.287 1.00 0.00 H -ATOM 3613 CB MET 230 -11.932 -14.816 15.261 1.00 0.00 C -ATOM 3614 HB2 MET 230 -11.050 -15.102 14.688 1.00 0.00 H -ATOM 3615 HB3 MET 230 -12.636 -15.630 15.091 1.00 0.00 H -ATOM 3616 CG MET 230 -12.579 -13.562 14.703 1.00 0.00 C -ATOM 3617 HG2 MET 230 -13.213 -13.152 15.489 1.00 0.00 H -ATOM 3618 HG3 MET 230 -11.812 -12.799 14.578 1.00 0.00 H -ATOM 3619 SD MET 230 -13.447 -13.740 13.082 1.00 0.00 S -ATOM 3620 CE MET 230 -11.929 -13.789 12.023 1.00 0.00 C -ATOM 3621 HE1 MET 230 -11.255 -12.939 12.137 1.00 0.00 H -ATOM 3622 HE2 MET 230 -11.394 -14.690 12.323 1.00 0.00 H -ATOM 3623 HE3 MET 230 -12.227 -13.977 10.991 1.00 0.00 H -ATOM 3624 C MET 230 -11.269 -16.190 17.299 1.00 0.00 C -ATOM 3625 O MET 230 -10.172 -16.624 17.658 1.00 0.00 O -ATOM 3626 N LYS 231 -12.357 -17.021 17.289 1.00 0.00 N -ATOM 3627 H LYS 231 -13.234 -16.577 17.060 1.00 0.00 H -ATOM 3628 CA LYS 231 -12.318 -18.462 17.647 1.00 0.00 C -ATOM 3629 HA LYS 231 -11.513 -18.666 18.354 1.00 0.00 H -ATOM 3630 CB LYS 231 -13.657 -18.929 18.277 1.00 0.00 C -ATOM 3631 HB2 LYS 231 -14.536 -18.710 17.671 1.00 0.00 H -ATOM 3632 HB3 LYS 231 -13.551 -20.002 18.440 1.00 0.00 H -ATOM 3633 CG LYS 231 -13.917 -18.239 19.637 1.00 0.00 C -ATOM 3634 HG2 LYS 231 -12.981 -18.238 20.195 1.00 0.00 H -ATOM 3635 HG3 LYS 231 -14.092 -17.168 19.539 1.00 0.00 H -ATOM 3636 CD LYS 231 -15.074 -18.970 20.371 1.00 0.00 C -ATOM 3637 HD2 LYS 231 -16.015 -18.685 19.901 1.00 0.00 H -ATOM 3638 HD3 LYS 231 -15.026 -20.059 20.403 1.00 0.00 H -ATOM 3639 CE LYS 231 -15.043 -18.330 21.729 1.00 0.00 C -ATOM 3640 HE2 LYS 231 -14.056 -18.542 22.139 1.00 0.00 H -ATOM 3641 HE3 LYS 231 -15.144 -17.255 21.582 1.00 0.00 H -ATOM 3642 NZ LYS 231 -16.124 -18.873 22.465 1.00 0.00 N -ATOM 3643 HZ1 LYS 231 -16.248 -19.855 22.262 1.00 0.00 H -ATOM 3644 HZ2 LYS 231 -16.064 -18.900 23.473 1.00 0.00 H -ATOM 3645 HZ3 LYS 231 -16.973 -18.336 22.358 1.00 0.00 H -ATOM 3646 C LYS 231 -12.096 -19.329 16.393 1.00 0.00 C -ATOM 3647 O LYS 231 -12.802 -19.123 15.403 1.00 0.00 O -ATOM 3648 N GLU 232 -11.085 -20.224 16.404 1.00 0.00 N -ATOM 3649 H GLU 232 -10.605 -20.365 17.281 1.00 0.00 H -ATOM 3650 CA GLU 232 -10.858 -21.183 15.267 1.00 0.00 C -ATOM 3651 HA GLU 232 -10.954 -20.607 14.346 1.00 0.00 H -ATOM 3652 CB GLU 232 -9.466 -21.755 15.569 1.00 0.00 C -ATOM 3653 HB2 GLU 232 -8.768 -20.926 15.681 1.00 0.00 H -ATOM 3654 HB3 GLU 232 -9.372 -22.328 16.493 1.00 0.00 H -ATOM 3655 CG GLU 232 -8.731 -22.636 14.513 1.00 0.00 C -ATOM 3656 HG2 GLU 232 -7.693 -22.856 14.759 1.00 0.00 H -ATOM 3657 HG3 GLU 232 -9.187 -23.626 14.523 1.00 0.00 H -ATOM 3658 CD GLU 232 -8.715 -22.096 13.065 1.00 0.00 C -ATOM 3659 OE1 GLU 232 -7.582 -21.793 12.561 1.00 0.00 O -ATOM 3660 OE2 GLU 232 -9.735 -22.131 12.404 1.00 0.00 O -ATOM 3661 C GLU 232 -11.846 -22.348 15.342 1.00 0.00 C -ATOM 3662 O GLU 232 -12.597 -22.410 16.291 1.00 0.00 O -ATOM 3663 N THR 233 -11.827 -23.292 14.347 1.00 0.00 N -ATOM 3664 H THR 233 -11.168 -22.996 13.641 1.00 0.00 H -ATOM 3665 CA THR 233 -12.746 -24.456 14.293 1.00 0.00 C -ATOM 3666 HA THR 233 -13.767 -24.090 14.397 1.00 0.00 H -ATOM 3667 CB THR 233 -12.796 -25.101 12.872 1.00 0.00 C -ATOM 3668 HB THR 233 -13.022 -24.328 12.138 1.00 0.00 H -ATOM 3669 CG2 THR 233 -11.414 -25.649 12.475 1.00 0.00 C -ATOM 3670 HG21 THR 233 -10.685 -24.838 12.475 1.00 0.00 H -ATOM 3671 HG22 THR 233 -11.157 -26.434 13.185 1.00 0.00 H -ATOM 3672 HG23 THR 233 -11.404 -26.105 11.484 1.00 0.00 H -ATOM 3673 OG1 THR 233 -13.788 -26.131 12.809 1.00 0.00 O -ATOM 3674 HG1 THR 233 -13.759 -26.440 11.901 1.00 0.00 H -ATOM 3675 C THR 233 -12.533 -25.513 15.350 1.00 0.00 C -ATOM 3676 O THR 233 -11.352 -25.894 15.576 1.00 0.00 O -ATOM 3677 N THR 234 -13.613 -25.848 16.049 1.00 0.00 N -ATOM 3678 H THR 234 -14.513 -25.637 15.641 1.00 0.00 H -ATOM 3679 CA THR 234 -13.539 -26.718 17.257 1.00 0.00 C -ATOM 3680 HA THR 234 -12.768 -26.284 17.894 1.00 0.00 H -ATOM 3681 CB THR 234 -14.906 -26.664 17.991 1.00 0.00 C -ATOM 3682 HB THR 234 -15.705 -26.990 17.325 1.00 0.00 H -ATOM 3683 CG2 THR 234 -14.966 -27.654 19.185 1.00 0.00 C -ATOM 3684 HG21 THR 234 -15.877 -27.458 19.747 1.00 0.00 H -ATOM 3685 HG22 THR 234 -14.963 -28.683 18.828 1.00 0.00 H -ATOM 3686 HG23 THR 234 -14.232 -27.317 19.919 1.00 0.00 H -ATOM 3687 OG1 THR 234 -15.104 -25.410 18.607 1.00 0.00 O -ATOM 3688 HG1 THR 234 -15.532 -24.888 17.923 1.00 0.00 H -ATOM 3689 C THR 234 -13.191 -28.158 16.828 1.00 0.00 C -ATOM 3690 O THR 234 -12.653 -28.955 17.650 1.00 0.00 O -ATOM 3691 N ILE 235 -13.494 -28.528 15.593 1.00 0.00 N -ATOM 3692 H ILE 235 -13.868 -27.805 14.994 1.00 0.00 H -ATOM 3693 CA ILE 235 -13.068 -29.767 15.002 1.00 0.00 C -ATOM 3694 HA ILE 235 -13.493 -30.568 15.608 1.00 0.00 H -ATOM 3695 CB ILE 235 -13.644 -29.864 13.532 1.00 0.00 C -ATOM 3696 HB ILE 235 -13.164 -29.027 13.026 1.00 0.00 H -ATOM 3697 CG2 ILE 235 -13.083 -31.081 12.813 1.00 0.00 C -ATOM 3698 HG21 ILE 235 -13.381 -31.174 11.769 1.00 0.00 H -ATOM 3699 HG22 ILE 235 -11.995 -31.069 12.758 1.00 0.00 H -ATOM 3700 HG23 ILE 235 -13.248 -32.015 13.353 1.00 0.00 H -ATOM 3701 CG1 ILE 235 -15.181 -29.798 13.443 1.00 0.00 C -ATOM 3702 HG12 ILE 235 -15.607 -30.726 13.824 1.00 0.00 H -ATOM 3703 HG13 ILE 235 -15.469 -28.912 14.009 1.00 0.00 H -ATOM 3704 CD1 ILE 235 -15.809 -29.511 12.071 1.00 0.00 C -ATOM 3705 HD11 ILE 235 -15.303 -28.679 11.581 1.00 0.00 H -ATOM 3706 HD12 ILE 235 -15.824 -30.378 11.409 1.00 0.00 H -ATOM 3707 HD13 ILE 235 -16.861 -29.252 12.192 1.00 0.00 H -ATOM 3708 C ILE 235 -11.514 -29.865 14.908 1.00 0.00 C -ATOM 3709 O ILE 235 -11.088 -30.941 15.203 1.00 0.00 O -ATOM 3710 N ASP 236 -10.655 -28.850 14.695 1.00 0.00 N -ATOM 3711 H ASP 236 -10.990 -27.900 14.623 1.00 0.00 H -ATOM 3712 CA ASP 236 -9.213 -28.969 14.800 1.00 0.00 C -ATOM 3713 HA ASP 236 -8.808 -29.905 14.415 1.00 0.00 H -ATOM 3714 CB ASP 236 -8.642 -27.819 13.942 1.00 0.00 C -ATOM 3715 HB2 ASP 236 -9.052 -26.939 14.438 1.00 0.00 H -ATOM 3716 HB3 ASP 236 -7.564 -27.827 14.107 1.00 0.00 H -ATOM 3717 CG ASP 236 -8.897 -27.853 12.471 1.00 0.00 C -ATOM 3718 OD1 ASP 236 -9.487 -28.851 11.995 1.00 0.00 O -ATOM 3719 OD2 ASP 236 -8.602 -26.836 11.808 1.00 0.00 O -ATOM 3720 C ASP 236 -8.608 -28.965 16.198 1.00 0.00 C -ATOM 3721 O ASP 236 -7.450 -29.325 16.407 1.00 0.00 O -ATOM 3722 N GLY 237 -9.409 -28.462 17.115 1.00 0.00 N -ATOM 3723 H GLY 237 -10.237 -27.960 16.826 1.00 0.00 H -ATOM 3724 CA GLY 237 -9.336 -28.655 18.539 1.00 0.00 C -ATOM 3725 HA2 GLY 237 -9.825 -29.571 18.872 1.00 0.00 H -ATOM 3726 HA3 GLY 237 -8.299 -28.593 18.867 1.00 0.00 H -ATOM 3727 C GLY 237 -9.935 -27.441 19.302 1.00 0.00 C -ATOM 3728 O GLY 237 -10.258 -26.370 18.729 1.00 0.00 O -ATOM 3729 N GLU 238 -10.348 -27.714 20.518 1.00 0.00 N -ATOM 3730 H GLU 238 -10.163 -28.617 20.929 1.00 0.00 H -ATOM 3731 CA GLU 238 -11.355 -26.899 21.225 1.00 0.00 C -ATOM 3732 HA GLU 238 -11.925 -26.443 20.415 1.00 0.00 H -ATOM 3733 CB GLU 238 -12.250 -27.721 22.101 1.00 0.00 C -ATOM 3734 HB2 GLU 238 -11.751 -27.784 23.068 1.00 0.00 H -ATOM 3735 HB3 GLU 238 -13.186 -27.172 22.207 1.00 0.00 H -ATOM 3736 CG GLU 238 -12.605 -29.149 21.572 1.00 0.00 C -ATOM 3737 HG2 GLU 238 -13.571 -29.449 21.976 1.00 0.00 H -ATOM 3738 HG3 GLU 238 -12.706 -29.247 20.491 1.00 0.00 H -ATOM 3739 CD GLU 238 -11.528 -30.165 22.009 1.00 0.00 C -ATOM 3740 OE1 GLU 238 -10.338 -29.823 22.391 1.00 0.00 O -ATOM 3741 OE2 GLU 238 -11.810 -31.380 21.977 1.00 0.00 O -ATOM 3742 C GLU 238 -10.749 -25.724 22.058 1.00 0.00 C -ATOM 3743 O GLU 238 -9.631 -25.713 22.566 1.00 0.00 O -ATOM 3744 N GLU 239 -11.530 -24.653 22.113 1.00 0.00 N -ATOM 3745 H GLU 239 -12.435 -24.800 21.691 1.00 0.00 H -ATOM 3746 CA GLU 239 -11.196 -23.304 22.663 1.00 0.00 C -ATOM 3747 HA GLU 239 -12.063 -22.649 22.587 1.00 0.00 H -ATOM 3748 CB GLU 239 -10.865 -23.376 24.154 1.00 0.00 C -ATOM 3749 HB2 GLU 239 -9.861 -23.751 24.351 1.00 0.00 H -ATOM 3750 HB3 GLU 239 -10.953 -22.328 24.441 1.00 0.00 H -ATOM 3751 CG GLU 239 -11.882 -24.254 24.973 1.00 0.00 C -ATOM 3752 HG2 GLU 239 -11.997 -25.299 24.688 1.00 0.00 H -ATOM 3753 HG3 GLU 239 -11.618 -24.269 26.031 1.00 0.00 H -ATOM 3754 CD GLU 239 -13.300 -23.647 24.922 1.00 0.00 C -ATOM 3755 OE1 GLU 239 -14.244 -24.292 24.499 1.00 0.00 O -ATOM 3756 OE2 GLU 239 -13.439 -22.426 25.195 1.00 0.00 O -ATOM 3757 C GLU 239 -10.089 -22.598 21.857 1.00 0.00 C -ATOM 3758 O GLU 239 -9.691 -21.535 22.322 1.00 0.00 O -ATOM 3759 N LEU 240 -9.502 -23.103 20.774 1.00 0.00 N -ATOM 3760 H LEU 240 -9.899 -24.012 20.588 1.00 0.00 H -ATOM 3761 CA LEU 240 -8.458 -22.486 19.960 1.00 0.00 C -ATOM 3762 HA LEU 240 -7.635 -22.304 20.650 1.00 0.00 H -ATOM 3763 CB LEU 240 -8.098 -23.459 18.895 1.00 0.00 C -ATOM 3764 HB2 LEU 240 -9.013 -23.814 18.420 1.00 0.00 H -ATOM 3765 HB3 LEU 240 -7.521 -22.993 18.097 1.00 0.00 H -ATOM 3766 CG LEU 240 -7.290 -24.652 19.561 1.00 0.00 C -ATOM 3767 HG LEU 240 -7.983 -25.129 20.253 1.00 0.00 H -ATOM 3768 CD1 LEU 240 -7.025 -25.562 18.429 1.00 0.00 C -ATOM 3769 HD11 LEU 240 -6.383 -26.400 18.702 1.00 0.00 H -ATOM 3770 HD12 LEU 240 -7.972 -25.902 18.008 1.00 0.00 H -ATOM 3771 HD13 LEU 240 -6.369 -25.092 17.697 1.00 0.00 H -ATOM 3772 CD2 LEU 240 -5.966 -24.269 20.116 1.00 0.00 C -ATOM 3773 HD21 LEU 240 -6.052 -23.506 20.889 1.00 0.00 H -ATOM 3774 HD22 LEU 240 -5.524 -25.120 20.633 1.00 0.00 H -ATOM 3775 HD23 LEU 240 -5.290 -23.982 19.311 1.00 0.00 H -ATOM 3776 C LEU 240 -8.934 -21.201 19.334 1.00 0.00 C -ATOM 3777 O LEU 240 -10.131 -20.959 19.131 1.00 0.00 O -ATOM 3778 N VAL 241 -7.876 -20.423 19.003 1.00 0.00 N -ATOM 3779 H VAL 241 -6.995 -20.838 19.272 1.00 0.00 H -ATOM 3780 CA VAL 241 -7.947 -19.035 18.597 1.00 0.00 C -ATOM 3781 HA VAL 241 -8.995 -18.739 18.647 1.00 0.00 H -ATOM 3782 CB VAL 241 -7.165 -18.193 19.533 1.00 0.00 C -ATOM 3783 HB VAL 241 -6.263 -18.756 19.775 1.00 0.00 H -ATOM 3784 CG1 VAL 241 -6.820 -16.854 18.936 1.00 0.00 C -ATOM 3785 HG11 VAL 241 -7.654 -16.421 18.384 1.00 0.00 H -ATOM 3786 HG12 VAL 241 -6.451 -16.080 19.608 1.00 0.00 H -ATOM 3787 HG13 VAL 241 -6.031 -17.045 18.208 1.00 0.00 H -ATOM 3788 CG2 VAL 241 -7.951 -17.953 20.857 1.00 0.00 C -ATOM 3789 HG21 VAL 241 -7.360 -17.202 21.380 1.00 0.00 H -ATOM 3790 HG22 VAL 241 -8.945 -17.546 20.674 1.00 0.00 H -ATOM 3791 HG23 VAL 241 -8.044 -18.860 21.455 1.00 0.00 H -ATOM 3792 C VAL 241 -7.540 -18.830 17.090 1.00 0.00 C -ATOM 3793 O VAL 241 -6.556 -19.344 16.540 1.00 0.00 O -ATOM 3794 N LYS 242 -8.269 -17.979 16.294 1.00 0.00 N -ATOM 3795 H LYS 242 -9.046 -17.481 16.704 1.00 0.00 H -ATOM 3796 CA LYS 242 -7.962 -17.473 14.927 1.00 0.00 C -ATOM 3797 HA LYS 242 -7.069 -18.056 14.703 1.00 0.00 H -ATOM 3798 CB LYS 242 -9.054 -17.838 13.975 1.00 0.00 C -ATOM 3799 HB2 LYS 242 -9.820 -18.445 14.459 1.00 0.00 H -ATOM 3800 HB3 LYS 242 -9.573 -16.903 13.762 1.00 0.00 H -ATOM 3801 CG LYS 242 -8.612 -18.525 12.676 1.00 0.00 C -ATOM 3802 HG2 LYS 242 -8.075 -17.737 12.148 1.00 0.00 H -ATOM 3803 HG3 LYS 242 -7.941 -19.356 12.901 1.00 0.00 H -ATOM 3804 CD LYS 242 -9.785 -18.997 11.865 1.00 0.00 C -ATOM 3805 HD2 LYS 242 -10.375 -19.691 12.464 1.00 0.00 H -ATOM 3806 HD3 LYS 242 -10.383 -18.143 11.546 1.00 0.00 H -ATOM 3807 CE LYS 242 -9.226 -19.754 10.606 1.00 0.00 C -ATOM 3808 HE2 LYS 242 -9.055 -19.108 9.745 1.00 0.00 H -ATOM 3809 HE3 LYS 242 -8.344 -20.292 10.953 1.00 0.00 H -ATOM 3810 NZ LYS 242 -10.239 -20.698 10.124 1.00 0.00 N -ATOM 3811 HZ1 LYS 242 -9.848 -21.288 9.405 1.00 0.00 H -ATOM 3812 HZ2 LYS 242 -10.453 -21.370 10.846 1.00 0.00 H -ATOM 3813 HZ3 LYS 242 -11.095 -20.346 9.717 1.00 0.00 H -ATOM 3814 C LYS 242 -7.523 -16.006 14.844 1.00 0.00 C -ATOM 3815 O LYS 242 -8.088 -15.117 15.479 1.00 0.00 O -ATOM 3816 N ILE 243 -6.574 -15.717 13.920 1.00 0.00 N -ATOM 3817 H ILE 243 -6.180 -16.500 13.417 1.00 0.00 H -ATOM 3818 CA ILE 243 -6.162 -14.342 13.519 1.00 0.00 C -ATOM 3819 HA ILE 243 -6.933 -13.680 13.915 1.00 0.00 H -ATOM 3820 CB ILE 243 -4.854 -13.966 14.210 1.00 0.00 C -ATOM 3821 HB ILE 243 -4.110 -14.572 13.691 1.00 0.00 H -ATOM 3822 CG2 ILE 243 -4.391 -12.544 13.994 1.00 0.00 C -ATOM 3823 HG21 ILE 243 -4.908 -11.789 14.585 1.00 0.00 H -ATOM 3824 HG22 ILE 243 -3.342 -12.326 14.190 1.00 0.00 H -ATOM 3825 HG23 ILE 243 -4.578 -12.259 12.958 1.00 0.00 H -ATOM 3826 CG1 ILE 243 -4.668 -14.496 15.619 1.00 0.00 C -ATOM 3827 HG12 ILE 243 -5.514 -14.090 16.175 1.00 0.00 H -ATOM 3828 HG13 ILE 243 -4.767 -15.580 15.672 1.00 0.00 H -ATOM 3829 CD1 ILE 243 -3.309 -14.162 16.299 1.00 0.00 C -ATOM 3830 HD11 ILE 243 -3.154 -13.090 16.426 1.00 0.00 H -ATOM 3831 HD12 ILE 243 -3.310 -14.564 17.313 1.00 0.00 H -ATOM 3832 HD13 ILE 243 -2.499 -14.692 15.799 1.00 0.00 H -ATOM 3833 C ILE 243 -6.086 -14.120 12.007 1.00 0.00 C -ATOM 3834 O ILE 243 -5.609 -14.956 11.232 1.00 0.00 O -ATOM 3835 N GLY 244 -6.713 -13.054 11.500 1.00 0.00 N -ATOM 3836 H GLY 244 -7.080 -12.425 12.201 1.00 0.00 H -ATOM 3837 CA GLY 244 -6.352 -12.523 10.199 1.00 0.00 C -ATOM 3838 HA2 GLY 244 -5.600 -13.115 9.678 1.00 0.00 H -ATOM 3839 HA3 GLY 244 -7.178 -12.566 9.489 1.00 0.00 H -ATOM 3840 C GLY 244 -5.814 -11.050 10.236 1.00 0.00 C -ATOM 3841 O GLY 244 -6.140 -10.264 11.090 1.00 0.00 O -ATOM 3842 N LYS 245 -4.995 -10.709 9.262 1.00 0.00 N -ATOM 3843 H LYS 245 -4.710 -11.465 8.655 1.00 0.00 H -ATOM 3844 CA LYS 245 -4.354 -9.433 9.122 1.00 0.00 C -ATOM 3845 HA LYS 245 -4.787 -8.711 9.815 1.00 0.00 H -ATOM 3846 CB LYS 245 -2.835 -9.493 9.450 1.00 0.00 C -ATOM 3847 HB2 LYS 245 -2.257 -10.059 8.719 1.00 0.00 H -ATOM 3848 HB3 LYS 245 -2.346 -8.526 9.327 1.00 0.00 H -ATOM 3849 CG LYS 245 -2.527 -9.882 10.939 1.00 0.00 C -ATOM 3850 HG2 LYS 245 -3.123 -9.233 11.580 1.00 0.00 H -ATOM 3851 HG3 LYS 245 -2.839 -10.875 11.262 1.00 0.00 H -ATOM 3852 CD LYS 245 -1.095 -9.643 11.463 1.00 0.00 C -ATOM 3853 HD2 LYS 245 -0.734 -8.637 11.249 1.00 0.00 H -ATOM 3854 HD3 LYS 245 -1.011 -9.712 12.547 1.00 0.00 H -ATOM 3855 CE LYS 245 -0.057 -10.585 11.002 1.00 0.00 C -ATOM 3856 HE2 LYS 245 -0.320 -11.522 11.492 1.00 0.00 H -ATOM 3857 HE3 LYS 245 -0.015 -10.715 9.920 1.00 0.00 H -ATOM 3858 NZ LYS 245 1.303 -10.262 11.510 1.00 0.00 N -ATOM 3859 HZ1 LYS 245 1.991 -10.939 11.215 1.00 0.00 H -ATOM 3860 HZ2 LYS 245 1.640 -9.356 11.219 1.00 0.00 H -ATOM 3861 HZ3 LYS 245 1.282 -10.411 12.509 1.00 0.00 H -ATOM 3862 C LYS 245 -4.608 -8.881 7.680 1.00 0.00 C -ATOM 3863 O LYS 245 -4.369 -9.594 6.734 1.00 0.00 O -ATOM 3864 N LEU 246 -4.786 -7.544 7.694 1.00 0.00 N -ATOM 3865 H LEU 246 -4.832 -7.076 8.588 1.00 0.00 H -ATOM 3866 CA LEU 246 -4.631 -6.710 6.482 1.00 0.00 C -ATOM 3867 HA LEU 246 -4.295 -7.454 5.759 1.00 0.00 H -ATOM 3868 CB LEU 246 -5.982 -6.138 6.210 1.00 0.00 C -ATOM 3869 HB2 LEU 246 -6.558 -7.058 6.118 1.00 0.00 H -ATOM 3870 HB3 LEU 246 -6.400 -5.672 7.102 1.00 0.00 H -ATOM 3871 CG LEU 246 -6.261 -5.272 4.937 1.00 0.00 C -ATOM 3872 HG LEU 246 -5.878 -4.256 5.035 1.00 0.00 H -ATOM 3873 CD1 LEU 246 -5.660 -5.814 3.746 1.00 0.00 C -ATOM 3874 HD11 LEU 246 -5.704 -5.052 2.968 1.00 0.00 H -ATOM 3875 HD12 LEU 246 -4.576 -5.908 3.795 1.00 0.00 H -ATOM 3876 HD13 LEU 246 -6.045 -6.776 3.410 1.00 0.00 H -ATOM 3877 CD2 LEU 246 -7.816 -5.200 4.691 1.00 0.00 C -ATOM 3878 HD21 LEU 246 -8.365 -6.047 5.103 1.00 0.00 H -ATOM 3879 HD22 LEU 246 -8.293 -4.456 5.330 1.00 0.00 H -ATOM 3880 HD23 LEU 246 -7.994 -5.031 3.629 1.00 0.00 H -ATOM 3881 C LEU 246 -3.628 -5.602 6.748 1.00 0.00 C -ATOM 3882 O LEU 246 -3.753 -4.778 7.613 1.00 0.00 O -ATOM 3883 N ASN 247 -2.484 -5.655 6.039 1.00 0.00 N -ATOM 3884 H ASN 247 -2.355 -6.493 5.491 1.00 0.00 H -ATOM 3885 CA ASN 247 -1.549 -4.556 5.854 1.00 0.00 C -ATOM 3886 HA ASN 247 -1.505 -4.018 6.802 1.00 0.00 H -ATOM 3887 CB ASN 247 -0.218 -5.256 5.622 1.00 0.00 C -ATOM 3888 HB2 ASN 247 -0.305 -5.814 4.690 1.00 0.00 H -ATOM 3889 HB3 ASN 247 0.549 -4.487 5.533 1.00 0.00 H -ATOM 3890 CG ASN 247 0.210 -6.332 6.658 1.00 0.00 C -ATOM 3891 OD1 ASN 247 0.098 -6.149 7.878 1.00 0.00 O -ATOM 3892 ND2 ASN 247 0.608 -7.450 6.195 1.00 0.00 N -ATOM 3893 HD21 ASN 247 1.030 -8.159 6.777 1.00 0.00 H -ATOM 3894 HD22 ASN 247 0.539 -7.649 5.207 1.00 0.00 H -ATOM 3895 C ASN 247 -1.885 -3.623 4.588 1.00 0.00 C -ATOM 3896 O ASN 247 -1.947 -4.013 3.422 1.00 0.00 O -ATOM 3897 N LEU 248 -2.171 -2.369 4.884 1.00 0.00 N -ATOM 3898 H LEU 248 -1.919 -2.157 5.839 1.00 0.00 H -ATOM 3899 CA LEU 248 -2.458 -1.235 3.953 1.00 0.00 C -ATOM 3900 HA LEU 248 -2.630 -1.672 2.969 1.00 0.00 H -ATOM 3901 CB LEU 248 -3.782 -0.565 4.456 1.00 0.00 C -ATOM 3902 HB2 LEU 248 -3.641 -0.246 5.488 1.00 0.00 H -ATOM 3903 HB3 LEU 248 -3.989 0.310 3.838 1.00 0.00 H -ATOM 3904 CG LEU 248 -4.974 -1.531 4.285 1.00 0.00 C -ATOM 3905 HG LEU 248 -4.872 -2.371 4.973 1.00 0.00 H -ATOM 3906 CD1 LEU 248 -6.182 -0.720 4.762 1.00 0.00 C -ATOM 3907 HD11 LEU 248 -5.978 -0.224 5.711 1.00 0.00 H -ATOM 3908 HD12 LEU 248 -6.365 0.076 4.040 1.00 0.00 H -ATOM 3909 HD13 LEU 248 -7.094 -1.268 4.997 1.00 0.00 H -ATOM 3910 CD2 LEU 248 -5.259 -1.969 2.808 1.00 0.00 C -ATOM 3911 HD21 LEU 248 -6.172 -2.561 2.761 1.00 0.00 H -ATOM 3912 HD22 LEU 248 -5.423 -1.101 2.169 1.00 0.00 H -ATOM 3913 HD23 LEU 248 -4.493 -2.608 2.371 1.00 0.00 H -ATOM 3914 C LEU 248 -1.247 -0.313 3.844 1.00 0.00 C -ATOM 3915 O LEU 248 -0.830 0.341 4.814 1.00 0.00 O -ATOM 3916 N VAL 249 -0.571 -0.412 2.740 1.00 0.00 N -ATOM 3917 H VAL 249 -0.967 -0.947 1.981 1.00 0.00 H -ATOM 3918 CA VAL 249 0.845 0.015 2.584 1.00 0.00 C -ATOM 3919 HA VAL 249 1.054 0.596 3.482 1.00 0.00 H -ATOM 3920 CB VAL 249 1.819 -1.196 2.631 1.00 0.00 C -ATOM 3921 HB VAL 249 1.741 -1.780 1.714 1.00 0.00 H -ATOM 3922 CG1 VAL 249 3.317 -0.755 2.673 1.00 0.00 C -ATOM 3923 HG11 VAL 249 3.883 -1.672 2.505 1.00 0.00 H -ATOM 3924 HG12 VAL 249 3.545 -0.036 1.887 1.00 0.00 H -ATOM 3925 HG13 VAL 249 3.454 -0.324 3.664 1.00 0.00 H -ATOM 3926 CG2 VAL 249 1.561 -2.056 3.860 1.00 0.00 C -ATOM 3927 HG21 VAL 249 2.466 -2.621 4.091 1.00 0.00 H -ATOM 3928 HG22 VAL 249 1.286 -1.437 4.714 1.00 0.00 H -ATOM 3929 HG23 VAL 249 0.796 -2.784 3.593 1.00 0.00 H -ATOM 3930 C VAL 249 0.945 0.890 1.380 1.00 0.00 C -ATOM 3931 O VAL 249 1.093 0.408 0.285 1.00 0.00 O -ATOM 3932 N ASP 250 0.958 2.239 1.500 1.00 0.00 N -ATOM 3933 H ASP 250 0.826 2.760 2.354 1.00 0.00 H -ATOM 3934 CA ASP 250 1.125 3.245 0.491 1.00 0.00 C -ATOM 3935 HA ASP 250 0.930 2.810 -0.488 1.00 0.00 H -ATOM 3936 CB ASP 250 0.177 4.545 0.672 1.00 0.00 C -ATOM 3937 HB2 ASP 250 0.677 5.376 0.174 1.00 0.00 H -ATOM 3938 HB3 ASP 250 -0.828 4.354 0.296 1.00 0.00 H -ATOM 3939 CG ASP 250 -0.057 4.933 2.104 1.00 0.00 C -ATOM 3940 OD1 ASP 250 -0.307 6.150 2.262 1.00 0.00 O -ATOM 3941 OD2 ASP 250 -0.105 4.113 3.028 1.00 0.00 O -ATOM 3942 C ASP 250 2.617 3.712 0.483 1.00 0.00 C -ATOM 3943 O ASP 250 3.088 4.593 1.213 1.00 0.00 O -ATOM 3944 N LEU 251 3.359 3.103 -0.446 1.00 0.00 N -ATOM 3945 H LEU 251 2.806 2.638 -1.151 1.00 0.00 H -ATOM 3946 CA LEU 251 4.753 3.250 -0.769 1.00 0.00 C -ATOM 3947 HA LEU 251 5.341 3.046 0.127 1.00 0.00 H -ATOM 3948 CB LEU 251 5.166 2.225 -1.843 1.00 0.00 C -ATOM 3949 HB2 LEU 251 4.732 2.345 -2.836 1.00 0.00 H -ATOM 3950 HB3 LEU 251 6.209 2.412 -2.102 1.00 0.00 H -ATOM 3951 CG LEU 251 4.984 0.747 -1.451 1.00 0.00 C -ATOM 3952 HG LEU 251 3.945 0.551 -1.188 1.00 0.00 H -ATOM 3953 CD1 LEU 251 5.436 -0.137 -2.566 1.00 0.00 C -ATOM 3954 HD11 LEU 251 6.336 0.300 -3.000 1.00 0.00 H -ATOM 3955 HD12 LEU 251 5.625 -1.173 -2.283 1.00 0.00 H -ATOM 3956 HD13 LEU 251 4.582 -0.208 -3.239 1.00 0.00 H -ATOM 3957 CD2 LEU 251 5.958 0.312 -0.341 1.00 0.00 C -ATOM 3958 HD21 LEU 251 5.801 0.992 0.496 1.00 0.00 H -ATOM 3959 HD22 LEU 251 5.790 -0.726 -0.054 1.00 0.00 H -ATOM 3960 HD23 LEU 251 6.996 0.334 -0.671 1.00 0.00 H -ATOM 3961 C LEU 251 5.128 4.686 -1.272 1.00 0.00 C -ATOM 3962 O LEU 251 4.239 5.476 -1.612 1.00 0.00 O -ATOM 3963 N ALA 252 6.411 5.077 -1.268 1.00 0.00 N -ATOM 3964 H ALA 252 7.119 4.458 -0.897 1.00 0.00 H -ATOM 3965 CA ALA 252 6.889 6.439 -1.648 1.00 0.00 C -ATOM 3966 HA ALA 252 6.374 7.247 -1.127 1.00 0.00 H -ATOM 3967 CB ALA 252 8.314 6.515 -1.069 1.00 0.00 C -ATOM 3968 HB1 ALA 252 8.589 7.555 -1.247 1.00 0.00 H -ATOM 3969 HB2 ALA 252 8.319 6.326 0.005 1.00 0.00 H -ATOM 3970 HB3 ALA 252 9.023 5.950 -1.673 1.00 0.00 H -ATOM 3971 C ALA 252 6.879 6.561 -3.204 1.00 0.00 C -ATOM 3972 O ALA 252 6.719 5.563 -3.873 1.00 0.00 O -ATOM 3973 N GLY 253 7.055 7.772 -3.769 1.00 0.00 N -ATOM 3974 H GLY 253 7.335 8.572 -3.219 1.00 0.00 H -ATOM 3975 CA GLY 253 6.958 8.091 -5.215 1.00 0.00 C -ATOM 3976 HA2 GLY 253 5.936 7.969 -5.575 1.00 0.00 H -ATOM 3977 HA3 GLY 253 7.192 9.145 -5.363 1.00 0.00 H -ATOM 3978 C GLY 253 7.965 7.365 -6.128 1.00 0.00 C -ATOM 3979 O GLY 253 9.189 7.379 -5.807 1.00 0.00 O -ATOM 3980 N SER 254 7.532 6.796 -7.257 1.00 0.00 N -ATOM 3981 H SER 254 6.569 6.825 -7.561 1.00 0.00 H -ATOM 3982 CA SER 254 8.341 5.999 -8.096 1.00 0.00 C -ATOM 3983 HA SER 254 9.097 5.489 -7.500 1.00 0.00 H -ATOM 3984 CB SER 254 7.502 4.954 -8.855 1.00 0.00 C -ATOM 3985 HB2 SER 254 8.148 4.302 -9.443 1.00 0.00 H -ATOM 3986 HB3 SER 254 6.866 4.359 -8.200 1.00 0.00 H -ATOM 3987 OG SER 254 6.745 5.722 -9.804 1.00 0.00 O -ATOM 3988 HG SER 254 6.900 5.374 -10.685 1.00 0.00 H -ATOM 3989 C SER 254 9.201 6.837 -9.142 1.00 0.00 C -ATOM 3990 O SER 254 10.033 6.270 -9.872 1.00 0.00 O -ATOM 3991 N GLU 255 9.021 8.146 -9.276 1.00 0.00 N -ATOM 3992 H GLU 255 8.302 8.516 -8.671 1.00 0.00 H -ATOM 3993 CA GLU 255 9.689 8.972 -10.322 1.00 0.00 C -ATOM 3994 HA GLU 255 9.370 8.499 -11.250 1.00 0.00 H -ATOM 3995 CB GLU 255 9.075 10.453 -10.239 1.00 0.00 C -ATOM 3996 HB2 GLU 255 9.285 10.945 -11.188 1.00 0.00 H -ATOM 3997 HB3 GLU 255 7.985 10.451 -10.274 1.00 0.00 H -ATOM 3998 CG GLU 255 9.463 11.432 -9.158 1.00 0.00 C -ATOM 3999 HG2 GLU 255 10.533 11.637 -9.152 1.00 0.00 H -ATOM 4000 HG3 GLU 255 8.812 12.297 -9.291 1.00 0.00 H -ATOM 4001 CD GLU 255 9.018 10.988 -7.775 1.00 0.00 C -ATOM 4002 OE1 GLU 255 9.847 11.193 -6.843 1.00 0.00 O -ATOM 4003 OE2 GLU 255 7.940 10.328 -7.603 1.00 0.00 O -ATOM 4004 C GLU 255 11.227 9.104 -10.315 1.00 0.00 C -ATOM 4005 O GLU 255 11.828 8.861 -9.234 1.00 0.00 O -ATOM 4006 N ASN 256 11.757 9.640 -11.444 1.00 0.00 N -ATOM 4007 H ASN 256 11.141 9.653 -12.244 1.00 0.00 H -ATOM 4008 CA ASN 256 13.139 9.971 -11.706 1.00 0.00 C -ATOM 4009 HA ASN 256 13.620 9.011 -11.900 1.00 0.00 H -ATOM 4010 CB ASN 256 13.196 10.841 -12.947 1.00 0.00 C -ATOM 4011 HB2 ASN 256 14.189 11.173 -13.251 1.00 0.00 H -ATOM 4012 HB3 ASN 256 12.916 10.104 -13.701 1.00 0.00 H -ATOM 4013 CG ASN 256 12.282 11.998 -12.967 1.00 0.00 C -ATOM 4014 OD1 ASN 256 12.653 13.065 -12.534 1.00 0.00 O -ATOM 4015 ND2 ASN 256 10.999 11.893 -13.311 1.00 0.00 N -ATOM 4016 HD21 ASN 256 10.481 12.756 -13.228 1.00 0.00 H -ATOM 4017 HD22 ASN 256 10.643 10.992 -13.596 1.00 0.00 H -ATOM 4018 C ASN 256 13.966 10.591 -10.551 1.00 0.00 C -ATOM 4019 O ASN 256 15.187 10.363 -10.540 1.00 0.00 O -ATOM 4020 N ILE 257 13.428 11.455 -9.642 1.00 0.00 N -ATOM 4021 H ILE 257 12.435 11.629 -9.704 1.00 0.00 H -ATOM 4022 CA ILE 257 14.216 12.252 -8.728 1.00 0.00 C -ATOM 4023 HA ILE 257 14.811 13.003 -9.247 1.00 0.00 H -ATOM 4024 CB ILE 257 13.237 13.085 -7.891 1.00 0.00 C -ATOM 4025 HB ILE 257 12.476 12.468 -7.414 1.00 0.00 H -ATOM 4026 CG2 ILE 257 13.930 13.932 -6.884 1.00 0.00 C -ATOM 4027 HG21 ILE 257 13.132 14.360 -6.279 1.00 0.00 H -ATOM 4028 HG22 ILE 257 14.422 13.308 -6.138 1.00 0.00 H -ATOM 4029 HG23 ILE 257 14.635 14.658 -7.291 1.00 0.00 H -ATOM 4030 CG1 ILE 257 12.509 14.096 -8.903 1.00 0.00 C -ATOM 4031 HG12 ILE 257 13.276 14.778 -9.271 1.00 0.00 H -ATOM 4032 HG13 ILE 257 12.100 13.523 -9.735 1.00 0.00 H -ATOM 4033 CD1 ILE 257 11.329 14.927 -8.221 1.00 0.00 C -ATOM 4034 HD11 ILE 257 11.851 15.760 -7.748 1.00 0.00 H -ATOM 4035 HD12 ILE 257 10.645 15.299 -8.983 1.00 0.00 H -ATOM 4036 HD13 ILE 257 10.839 14.255 -7.517 1.00 0.00 H -ATOM 4037 C ILE 257 15.150 11.360 -7.817 1.00 0.00 C -ATOM 4038 O ILE 257 14.665 10.507 -7.038 1.00 0.00 O -ATOM 4039 N GLY 258 16.436 11.593 -7.877 1.00 0.00 N -ATOM 4040 H GLY 258 16.665 12.409 -8.427 1.00 0.00 H -ATOM 4041 CA GLY 258 17.440 10.707 -7.226 1.00 0.00 C -ATOM 4042 HA2 GLY 258 18.444 11.131 -7.239 1.00 0.00 H -ATOM 4043 HA3 GLY 258 17.279 10.594 -6.154 1.00 0.00 H -ATOM 4044 C GLY 258 17.505 9.222 -7.596 1.00 0.00 C -ATOM 4045 O GLY 258 17.989 8.423 -6.819 1.00 0.00 O -ATOM 4046 N ARG 259 16.924 8.839 -8.739 1.00 0.00 N -ATOM 4047 H ARG 259 16.459 9.570 -9.257 1.00 0.00 H -ATOM 4048 CA ARG 259 16.970 7.463 -9.275 1.00 0.00 C -ATOM 4049 HA ARG 259 17.087 6.804 -8.415 1.00 0.00 H -ATOM 4050 CB ARG 259 15.583 7.222 -9.994 1.00 0.00 C -ATOM 4051 HB2 ARG 259 14.737 7.729 -9.530 1.00 0.00 H -ATOM 4052 HB3 ARG 259 15.682 7.598 -11.013 1.00 0.00 H -ATOM 4053 CG ARG 259 15.147 5.732 -10.039 1.00 0.00 C -ATOM 4054 HG2 ARG 259 15.849 5.072 -10.549 1.00 0.00 H -ATOM 4055 HG3 ARG 259 15.010 5.314 -9.042 1.00 0.00 H -ATOM 4056 CD ARG 259 13.684 5.681 -10.636 1.00 0.00 C -ATOM 4057 HD2 ARG 259 13.411 4.631 -10.537 1.00 0.00 H -ATOM 4058 HD3 ARG 259 13.028 6.197 -9.936 1.00 0.00 H -ATOM 4059 NE ARG 259 13.704 6.148 -12.037 1.00 0.00 N -ATOM 4060 HE ARG 259 14.620 6.403 -12.379 1.00 0.00 H -ATOM 4061 CZ ARG 259 12.647 6.409 -12.817 1.00 0.00 C -ATOM 4062 NH1 ARG 259 11.403 6.469 -12.406 1.00 0.00 N -ATOM 4063 HH11 ARG 259 11.225 6.344 -11.421 1.00 0.00 H -ATOM 4064 HH12 ARG 259 10.661 6.798 -13.008 1.00 0.00 H -ATOM 4065 NH2 ARG 259 12.937 6.663 -14.034 1.00 0.00 N -ATOM 4066 HH21 ARG 259 13.854 6.626 -14.456 1.00 0.00 H -ATOM 4067 HH22 ARG 259 12.194 6.812 -14.703 1.00 0.00 H -ATOM 4068 C ARG 259 18.199 7.173 -10.034 1.00 0.00 C -ATOM 4069 O ARG 259 18.449 6.076 -10.508 1.00 0.00 O -ATOM 4070 N SER 260 19.086 8.176 -10.265 1.00 0.00 N -ATOM 4071 H SER 260 18.808 9.073 -9.893 1.00 0.00 H -ATOM 4072 CA SER 260 20.357 8.057 -11.052 1.00 0.00 C -ATOM 4073 HA SER 260 20.101 7.498 -11.953 1.00 0.00 H -ATOM 4074 CB SER 260 20.796 9.471 -11.385 1.00 0.00 C -ATOM 4075 HB2 SER 260 19.991 10.004 -11.892 1.00 0.00 H -ATOM 4076 HB3 SER 260 21.045 10.016 -10.474 1.00 0.00 H -ATOM 4077 OG SER 260 21.811 9.351 -12.392 1.00 0.00 O -ATOM 4078 HG SER 260 21.600 10.045 -13.022 1.00 0.00 H -ATOM 4079 C SER 260 21.465 7.305 -10.300 1.00 0.00 C -ATOM 4080 O SER 260 21.543 7.330 -9.063 1.00 0.00 O -ATOM 4081 N GLY 261 22.301 6.526 -11.017 1.00 0.00 N -ATOM 4082 H GLY 261 22.194 6.553 -12.021 1.00 0.00 H -ATOM 4083 CA GLY 261 23.317 5.666 -10.434 1.00 0.00 C -ATOM 4084 HA2 GLY 261 22.864 4.954 -9.745 1.00 0.00 H -ATOM 4085 HA3 GLY 261 23.808 5.138 -11.251 1.00 0.00 H -ATOM 4086 C GLY 261 24.556 6.307 -9.784 1.00 0.00 C -ATOM 4087 O GLY 261 25.620 5.679 -9.541 1.00 0.00 O -ATOM 4088 N ALA 262 24.427 7.593 -9.488 1.00 0.00 N -ATOM 4089 H ALA 262 23.552 8.065 -9.665 1.00 0.00 H -ATOM 4090 CA ALA 262 25.355 8.551 -8.917 1.00 0.00 C -ATOM 4091 HA ALA 262 26.281 8.108 -8.549 1.00 0.00 H -ATOM 4092 CB ALA 262 25.737 9.529 -10.055 1.00 0.00 C -ATOM 4093 HB1 ALA 262 26.171 9.096 -10.957 1.00 0.00 H -ATOM 4094 HB2 ALA 262 24.853 10.078 -10.378 1.00 0.00 H -ATOM 4095 HB3 ALA 262 26.519 10.192 -9.683 1.00 0.00 H -ATOM 4096 C ALA 262 24.618 9.309 -7.796 1.00 0.00 C -ATOM 4097 O ALA 262 25.263 10.241 -7.304 1.00 0.00 O -ATOM 4098 N VAL 263 23.369 9.017 -7.356 1.00 0.00 N -ATOM 4099 H VAL 263 22.985 8.180 -7.771 1.00 0.00 H -ATOM 4100 CA VAL 263 22.694 9.672 -6.222 1.00 0.00 C -ATOM 4101 HA VAL 263 22.781 10.731 -6.466 1.00 0.00 H -ATOM 4102 CB VAL 263 21.260 9.102 -6.086 1.00 0.00 C -ATOM 4103 HB VAL 263 20.750 9.101 -7.049 1.00 0.00 H -ATOM 4104 CG1 VAL 263 21.012 7.759 -5.453 1.00 0.00 C -ATOM 4105 HG11 VAL 263 21.597 7.778 -4.533 1.00 0.00 H -ATOM 4106 HG12 VAL 263 19.959 7.634 -5.202 1.00 0.00 H -ATOM 4107 HG13 VAL 263 21.399 7.017 -6.152 1.00 0.00 H -ATOM 4108 CG2 VAL 263 20.458 10.032 -5.142 1.00 0.00 C -ATOM 4109 HG21 VAL 263 20.767 10.059 -4.097 1.00 0.00 H -ATOM 4110 HG22 VAL 263 20.522 11.059 -5.501 1.00 0.00 H -ATOM 4111 HG23 VAL 263 19.430 9.692 -5.262 1.00 0.00 H -ATOM 4112 C VAL 263 23.425 9.561 -4.870 1.00 0.00 C -ATOM 4113 O VAL 263 23.403 10.450 -4.005 1.00 0.00 O -ATOM 4114 N ASP 264 24.013 8.391 -4.668 1.00 0.00 N -ATOM 4115 H ASP 264 24.092 7.714 -5.413 1.00 0.00 H -ATOM 4116 CA ASP 264 24.790 8.158 -3.375 1.00 0.00 C -ATOM 4117 HA ASP 264 24.152 8.423 -2.532 1.00 0.00 H -ATOM 4118 CB ASP 264 25.163 6.704 -3.224 1.00 0.00 C -ATOM 4119 HB2 ASP 264 25.922 6.502 -2.468 1.00 0.00 H -ATOM 4120 HB3 ASP 264 24.325 6.180 -2.765 1.00 0.00 H -ATOM 4121 CG ASP 264 25.584 5.877 -4.475 1.00 0.00 C -ATOM 4122 OD1 ASP 264 25.623 6.438 -5.623 1.00 0.00 O -ATOM 4123 OD2 ASP 264 25.844 4.660 -4.478 1.00 0.00 O -ATOM 4124 C ASP 264 26.020 9.114 -3.378 1.00 0.00 C -ATOM 4125 O ASP 264 26.445 9.582 -2.293 1.00 0.00 O -ATOM 4126 N LYS 265 26.627 9.420 -4.500 1.00 0.00 N -ATOM 4127 H LYS 265 26.184 9.031 -5.320 1.00 0.00 H -ATOM 4128 CA LYS 265 27.865 10.155 -4.738 1.00 0.00 C -ATOM 4129 HA LYS 265 28.515 10.003 -3.876 1.00 0.00 H -ATOM 4130 CB LYS 265 28.484 9.568 -6.009 1.00 0.00 C -ATOM 4131 HB2 LYS 265 27.902 9.911 -6.864 1.00 0.00 H -ATOM 4132 HB3 LYS 265 29.510 9.905 -6.151 1.00 0.00 H -ATOM 4133 CG LYS 265 28.473 8.049 -6.108 1.00 0.00 C -ATOM 4134 HG2 LYS 265 28.878 7.590 -5.206 1.00 0.00 H -ATOM 4135 HG3 LYS 265 27.438 7.761 -6.292 1.00 0.00 H -ATOM 4136 CD LYS 265 29.339 7.573 -7.274 1.00 0.00 C -ATOM 4137 HD2 LYS 265 29.030 8.022 -8.219 1.00 0.00 H -ATOM 4138 HD3 LYS 265 30.398 7.769 -7.109 1.00 0.00 H -ATOM 4139 CE LYS 265 29.159 6.095 -7.347 1.00 0.00 C -ATOM 4140 HE2 LYS 265 29.762 5.647 -8.136 1.00 0.00 H -ATOM 4141 HE3 LYS 265 29.567 5.599 -6.467 1.00 0.00 H -ATOM 4142 NZ LYS 265 27.712 5.612 -7.551 1.00 0.00 N -ATOM 4143 HZ1 LYS 265 27.122 5.821 -6.758 1.00 0.00 H -ATOM 4144 HZ2 LYS 265 27.274 5.968 -8.388 1.00 0.00 H -ATOM 4145 HZ3 LYS 265 27.723 4.604 -7.608 1.00 0.00 H -ATOM 4146 C LYS 265 27.679 11.684 -4.895 1.00 0.00 C -ATOM 4147 O LYS 265 28.633 12.500 -4.829 1.00 0.00 O -ATOM 4148 N ARG 266 26.403 12.145 -4.778 1.00 0.00 N -ATOM 4149 H ARG 266 25.647 11.528 -5.039 1.00 0.00 H -ATOM 4150 CA ARG 266 26.070 13.555 -4.441 1.00 0.00 C -ATOM 4151 HA ARG 266 26.803 14.200 -4.926 1.00 0.00 H -ATOM 4152 CB ARG 266 24.745 13.886 -5.114 1.00 0.00 C -ATOM 4153 HB2 ARG 266 24.834 13.433 -6.101 1.00 0.00 H -ATOM 4154 HB3 ARG 266 23.955 13.358 -4.580 1.00 0.00 H -ATOM 4155 CG ARG 266 24.384 15.294 -5.371 1.00 0.00 C -ATOM 4156 HG2 ARG 266 24.956 15.841 -6.122 1.00 0.00 H -ATOM 4157 HG3 ARG 266 23.451 15.169 -5.922 1.00 0.00 H -ATOM 4158 CD ARG 266 24.196 16.298 -4.261 1.00 0.00 C -ATOM 4159 HD2 ARG 266 25.073 16.355 -3.617 1.00 0.00 H -ATOM 4160 HD3 ARG 266 24.036 17.284 -4.697 1.00 0.00 H -ATOM 4161 NE ARG 266 23.003 15.906 -3.562 1.00 0.00 N -ATOM 4162 HE ARG 266 22.387 15.267 -4.046 1.00 0.00 H -ATOM 4163 CZ ARG 266 22.535 16.285 -2.390 1.00 0.00 C -ATOM 4164 NH1 ARG 266 23.209 16.924 -1.504 1.00 0.00 N -ATOM 4165 HH11 ARG 266 24.101 17.328 -1.751 1.00 0.00 H -ATOM 4166 HH12 ARG 266 22.589 17.156 -0.740 1.00 0.00 H -ATOM 4167 NH2 ARG 266 21.292 16.011 -2.151 1.00 0.00 N -ATOM 4168 HH21 ARG 266 20.821 15.416 -2.817 1.00 0.00 H -ATOM 4169 HH22 ARG 266 20.724 16.261 -1.355 1.00 0.00 H -ATOM 4170 C ARG 266 26.144 13.684 -2.885 1.00 0.00 C -ATOM 4171 O ARG 266 26.903 14.515 -2.376 1.00 0.00 O -ATOM 4172 N ALA 267 25.351 12.868 -2.119 1.00 0.00 N -ATOM 4173 H ALA 267 24.643 12.291 -2.550 1.00 0.00 H -ATOM 4174 CA ALA 267 25.499 12.717 -0.759 1.00 0.00 C -ATOM 4175 HA ALA 267 26.552 12.750 -0.483 1.00 0.00 H -ATOM 4176 CB ALA 267 24.535 13.770 -0.105 1.00 0.00 C -ATOM 4177 HB1 ALA 267 23.498 13.436 -0.131 1.00 0.00 H -ATOM 4178 HB2 ALA 267 24.766 13.669 0.956 1.00 0.00 H -ATOM 4179 HB3 ALA 267 24.748 14.787 -0.432 1.00 0.00 H -ATOM 4180 C ALA 267 25.015 11.244 -0.387 1.00 0.00 C -ATOM 4181 O ALA 267 24.052 10.721 -0.974 1.00 0.00 O -ATOM 4182 N ARG 268 25.714 10.559 0.562 1.00 0.00 N -ATOM 4183 H ARG 268 26.565 10.969 0.920 1.00 0.00 H -ATOM 4184 CA ARG 268 25.206 9.262 1.041 1.00 0.00 C -ATOM 4185 HA ARG 268 25.094 8.711 0.106 1.00 0.00 H -ATOM 4186 CB ARG 268 26.196 8.579 1.989 1.00 0.00 C -ATOM 4187 HB2 ARG 268 27.222 8.624 1.624 1.00 0.00 H -ATOM 4188 HB3 ARG 268 26.315 9.082 2.948 1.00 0.00 H -ATOM 4189 CG ARG 268 25.790 7.114 2.378 1.00 0.00 C -ATOM 4190 HG2 ARG 268 26.534 6.645 3.022 1.00 0.00 H -ATOM 4191 HG3 ARG 268 24.860 7.131 2.946 1.00 0.00 H -ATOM 4192 CD ARG 268 25.669 6.079 1.180 1.00 0.00 C -ATOM 4193 HD2 ARG 268 25.853 6.559 0.218 1.00 0.00 H -ATOM 4194 HD3 ARG 268 26.515 5.401 1.279 1.00 0.00 H -ATOM 4195 NE ARG 268 24.421 5.297 1.400 1.00 0.00 N -ATOM 4196 HE ARG 268 23.839 5.616 2.162 1.00 0.00 H -ATOM 4197 CZ ARG 268 23.928 4.363 0.562 1.00 0.00 C -ATOM 4198 NH1 ARG 268 24.474 3.987 -0.496 1.00 0.00 N -ATOM 4199 HH11 ARG 268 25.450 4.178 -0.662 1.00 0.00 H -ATOM 4200 HH12 ARG 268 23.985 3.287 -1.035 1.00 0.00 H -ATOM 4201 NH2 ARG 268 22.792 3.791 0.938 1.00 0.00 N -ATOM 4202 HH21 ARG 268 22.540 3.838 1.915 1.00 0.00 H -ATOM 4203 HH22 ARG 268 22.341 3.166 0.286 1.00 0.00 H -ATOM 4204 C ARG 268 23.760 9.306 1.606 1.00 0.00 C -ATOM 4205 O ARG 268 23.044 8.348 1.288 1.00 0.00 O -ATOM 4206 N GLU 269 23.335 10.373 2.379 1.00 0.00 N -ATOM 4207 H GLU 269 24.067 10.994 2.692 1.00 0.00 H -ATOM 4208 CA GLU 269 21.969 10.541 2.812 1.00 0.00 C -ATOM 4209 HA GLU 269 21.630 9.873 3.604 1.00 0.00 H -ATOM 4210 CB GLU 269 21.812 11.936 3.450 1.00 0.00 C -ATOM 4211 HB2 GLU 269 22.382 11.854 4.375 1.00 0.00 H -ATOM 4212 HB3 GLU 269 22.294 12.630 2.761 1.00 0.00 H -ATOM 4213 CG GLU 269 20.352 12.348 3.825 1.00 0.00 C -ATOM 4214 HG2 GLU 269 19.793 12.302 2.891 1.00 0.00 H -ATOM 4215 HG3 GLU 269 19.867 11.596 4.446 1.00 0.00 H -ATOM 4216 CD GLU 269 20.176 13.721 4.394 1.00 0.00 C -ATOM 4217 OE1 GLU 269 21.053 14.598 4.180 1.00 0.00 O -ATOM 4218 OE2 GLU 269 19.297 13.978 5.246 1.00 0.00 O -ATOM 4219 C GLU 269 20.999 10.463 1.574 1.00 0.00 C -ATOM 4220 O GLU 269 20.041 9.783 1.697 1.00 0.00 O -ATOM 4221 N ALA 270 21.304 11.113 0.413 1.00 0.00 N -ATOM 4222 H ALA 270 22.230 11.517 0.394 1.00 0.00 H -ATOM 4223 CA ALA 270 20.530 11.005 -0.849 1.00 0.00 C -ATOM 4224 HA ALA 270 19.531 11.310 -0.537 1.00 0.00 H -ATOM 4225 CB ALA 270 21.032 12.070 -1.879 1.00 0.00 C -ATOM 4226 HB1 ALA 270 20.925 13.126 -1.626 1.00 0.00 H -ATOM 4227 HB2 ALA 270 22.056 11.971 -2.237 1.00 0.00 H -ATOM 4228 HB3 ALA 270 20.463 11.997 -2.806 1.00 0.00 H -ATOM 4229 C ALA 270 20.502 9.560 -1.481 1.00 0.00 C -ATOM 4230 O ALA 270 19.455 9.143 -1.908 1.00 0.00 O -ATOM 4231 N GLY 271 21.591 8.769 -1.336 1.00 0.00 N -ATOM 4232 H GLY 271 22.381 9.350 -1.096 1.00 0.00 H -ATOM 4233 CA GLY 271 21.560 7.276 -1.386 1.00 0.00 C -ATOM 4234 HA2 GLY 271 21.320 6.953 -2.399 1.00 0.00 H -ATOM 4235 HA3 GLY 271 22.592 6.966 -1.223 1.00 0.00 H -ATOM 4236 C GLY 271 20.608 6.596 -0.402 1.00 0.00 C -ATOM 4237 O GLY 271 19.722 5.841 -0.849 1.00 0.00 O -ATOM 4238 N ASN 272 20.657 6.910 0.924 1.00 0.00 N -ATOM 4239 H ASN 272 21.254 7.692 1.148 1.00 0.00 H -ATOM 4240 CA ASN 272 19.819 6.310 1.949 1.00 0.00 C -ATOM 4241 HA ASN 272 19.921 5.232 1.833 1.00 0.00 H -ATOM 4242 CB ASN 272 20.496 6.621 3.387 1.00 0.00 C -ATOM 4243 HB2 ASN 272 20.454 7.679 3.648 1.00 0.00 H -ATOM 4244 HB3 ASN 272 19.827 6.274 4.174 1.00 0.00 H -ATOM 4245 CG ASN 272 21.829 6.066 3.728 1.00 0.00 C -ATOM 4246 OD1 ASN 272 22.222 4.986 3.275 1.00 0.00 O -ATOM 4247 ND2 ASN 272 22.489 6.681 4.622 1.00 0.00 N -ATOM 4248 HD21 ASN 272 23.330 6.229 4.949 1.00 0.00 H -ATOM 4249 HD22 ASN 272 22.024 7.404 5.153 1.00 0.00 H -ATOM 4250 C ASN 272 18.304 6.637 1.786 1.00 0.00 C -ATOM 4251 O ASN 272 17.453 5.839 2.184 1.00 0.00 O -ATOM 4252 N ILE 273 17.938 7.831 1.227 1.00 0.00 N -ATOM 4253 H ILE 273 18.715 8.465 1.104 1.00 0.00 H -ATOM 4254 CA ILE 273 16.535 8.297 0.925 1.00 0.00 C -ATOM 4255 HA ILE 273 15.954 8.167 1.837 1.00 0.00 H -ATOM 4256 CB ILE 273 16.544 9.796 0.699 1.00 0.00 C -ATOM 4257 HB ILE 273 17.411 10.048 0.090 1.00 0.00 H -ATOM 4258 CG2 ILE 273 15.320 10.375 -0.096 1.00 0.00 C -ATOM 4259 HG21 ILE 273 15.108 9.835 -1.019 1.00 0.00 H -ATOM 4260 HG22 ILE 273 14.437 10.225 0.524 1.00 0.00 H -ATOM 4261 HG23 ILE 273 15.373 11.433 -0.349 1.00 0.00 H -ATOM 4262 CG1 ILE 273 16.613 10.580 2.023 1.00 0.00 C -ATOM 4263 HG12 ILE 273 15.674 10.618 2.575 1.00 0.00 H -ATOM 4264 HG13 ILE 273 17.399 10.099 2.607 1.00 0.00 H -ATOM 4265 CD1 ILE 273 17.178 11.991 1.869 1.00 0.00 C -ATOM 4266 HD11 ILE 273 17.297 12.478 2.835 1.00 0.00 H -ATOM 4267 HD12 ILE 273 18.151 11.993 1.377 1.00 0.00 H -ATOM 4268 HD13 ILE 273 16.501 12.583 1.253 1.00 0.00 H -ATOM 4269 C ILE 273 15.820 7.423 -0.160 1.00 0.00 C -ATOM 4270 O ILE 273 14.651 7.087 -0.012 1.00 0.00 O -ATOM 4271 N ASN 274 16.581 6.994 -1.120 1.00 0.00 N -ATOM 4272 H ASN 274 17.549 7.278 -1.115 1.00 0.00 H -ATOM 4273 CA ASN 274 16.262 6.249 -2.344 1.00 0.00 C -ATOM 4274 HA ASN 274 15.190 6.314 -2.529 1.00 0.00 H -ATOM 4275 CB ASN 274 17.003 6.897 -3.483 1.00 0.00 C -ATOM 4276 HB2 ASN 274 18.056 7.042 -3.240 1.00 0.00 H -ATOM 4277 HB3 ASN 274 16.741 6.254 -4.323 1.00 0.00 H -ATOM 4278 CG ASN 274 16.436 8.308 -3.773 1.00 0.00 C -ATOM 4279 OD1 ASN 274 15.324 8.529 -4.084 1.00 0.00 O -ATOM 4280 ND2 ASN 274 17.331 9.302 -3.732 1.00 0.00 N -ATOM 4281 HD21 ASN 274 17.035 10.264 -3.818 1.00 0.00 H -ATOM 4282 HD22 ASN 274 18.209 9.042 -3.304 1.00 0.00 H -ATOM 4283 C ASN 274 16.548 4.719 -2.156 1.00 0.00 C -ATOM 4284 O ASN 274 16.269 3.851 -3.020 1.00 0.00 O -ATOM 4285 N GLN 275 17.249 4.316 -1.039 1.00 0.00 N -ATOM 4286 H GLN 275 17.534 5.069 -0.430 1.00 0.00 H -ATOM 4287 CA GLN 275 17.746 2.980 -0.763 1.00 0.00 C -ATOM 4288 HA GLN 275 18.553 2.826 -1.480 1.00 0.00 H -ATOM 4289 CB GLN 275 18.366 2.983 0.640 1.00 0.00 C -ATOM 4290 HB2 GLN 275 19.075 3.807 0.554 1.00 0.00 H -ATOM 4291 HB3 GLN 275 17.668 3.333 1.401 1.00 0.00 H -ATOM 4292 CG GLN 275 19.054 1.633 0.992 1.00 0.00 C -ATOM 4293 HG2 GLN 275 19.464 1.739 1.996 1.00 0.00 H -ATOM 4294 HG3 GLN 275 18.345 0.805 0.982 1.00 0.00 H -ATOM 4295 CD GLN 275 20.117 1.127 0.081 1.00 0.00 C -ATOM 4296 OE1 GLN 275 20.858 1.944 -0.463 1.00 0.00 O -ATOM 4297 NE2 GLN 275 20.275 -0.151 -0.072 1.00 0.00 N -ATOM 4298 HE21 GLN 275 20.877 -0.499 -0.805 1.00 0.00 H -ATOM 4299 HE22 GLN 275 19.546 -0.782 0.229 1.00 0.00 H -ATOM 4300 C GLN 275 16.671 1.951 -0.814 1.00 0.00 C -ATOM 4301 O GLN 275 16.940 0.853 -1.354 1.00 0.00 O -ATOM 4302 N SER 276 15.417 2.254 -0.366 1.00 0.00 N -ATOM 4303 H SER 276 15.334 3.200 -0.023 1.00 0.00 H -ATOM 4304 CA SER 276 14.214 1.332 -0.338 1.00 0.00 C -ATOM 4305 HA SER 276 14.595 0.347 -0.066 1.00 0.00 H -ATOM 4306 CB SER 276 13.140 1.729 0.677 1.00 0.00 C -ATOM 4307 HB2 SER 276 12.226 1.253 0.322 1.00 0.00 H -ATOM 4308 HB3 SER 276 13.482 1.463 1.677 1.00 0.00 H -ATOM 4309 OG SER 276 12.952 3.147 0.446 1.00 0.00 O -ATOM 4310 HG SER 276 13.695 3.620 0.829 1.00 0.00 H -ATOM 4311 C SER 276 13.536 1.060 -1.699 1.00 0.00 C -ATOM 4312 O SER 276 13.182 -0.080 -1.913 1.00 0.00 O -ATOM 4313 N LEU 277 13.562 2.041 -2.627 1.00 0.00 N -ATOM 4314 H LEU 277 13.930 2.964 -2.437 1.00 0.00 H -ATOM 4315 CA LEU 277 12.937 2.005 -3.977 1.00 0.00 C -ATOM 4316 HA LEU 277 11.947 1.551 -3.958 1.00 0.00 H -ATOM 4317 CB LEU 277 12.757 3.470 -4.538 1.00 0.00 C -ATOM 4318 HB2 LEU 277 13.746 3.922 -4.448 1.00 0.00 H -ATOM 4319 HB3 LEU 277 12.408 3.544 -5.569 1.00 0.00 H -ATOM 4320 CG LEU 277 11.724 4.283 -3.827 1.00 0.00 C -ATOM 4321 HG LEU 277 11.535 3.905 -2.822 1.00 0.00 H -ATOM 4322 CD1 LEU 277 12.198 5.698 -3.771 1.00 0.00 C -ATOM 4323 HD11 LEU 277 12.894 5.742 -2.933 1.00 0.00 H -ATOM 4324 HD12 LEU 277 12.748 5.909 -4.688 1.00 0.00 H -ATOM 4325 HD13 LEU 277 11.340 6.346 -3.592 1.00 0.00 H -ATOM 4326 CD2 LEU 277 10.296 4.221 -4.498 1.00 0.00 C -ATOM 4327 HD21 LEU 277 10.309 4.845 -5.393 1.00 0.00 H -ATOM 4328 HD22 LEU 277 9.906 3.225 -4.704 1.00 0.00 H -ATOM 4329 HD23 LEU 277 9.654 4.745 -3.790 1.00 0.00 H -ATOM 4330 C LEU 277 13.923 1.230 -4.855 1.00 0.00 C -ATOM 4331 O LEU 277 13.404 0.381 -5.616 1.00 0.00 O -ATOM 4332 N LEU 278 15.218 1.409 -4.729 1.00 0.00 N -ATOM 4333 H LEU 278 15.443 2.107 -4.034 1.00 0.00 H -ATOM 4334 CA LEU 278 16.269 0.699 -5.516 1.00 0.00 C -ATOM 4335 HA LEU 278 15.924 0.596 -6.546 1.00 0.00 H -ATOM 4336 CB LEU 278 17.558 1.469 -5.389 1.00 0.00 C -ATOM 4337 HB2 LEU 278 17.404 2.545 -5.480 1.00 0.00 H -ATOM 4338 HB3 LEU 278 17.905 1.303 -4.370 1.00 0.00 H -ATOM 4339 CG LEU 278 18.732 1.046 -6.243 1.00 0.00 C -ATOM 4340 HG LEU 278 18.871 -0.033 -6.320 1.00 0.00 H -ATOM 4341 CD1 LEU 278 18.624 1.532 -7.676 1.00 0.00 C -ATOM 4342 HD11 LEU 278 18.334 2.582 -7.697 1.00 0.00 H -ATOM 4343 HD12 LEU 278 19.619 1.365 -8.089 1.00 0.00 H -ATOM 4344 HD13 LEU 278 17.867 0.973 -8.226 1.00 0.00 H -ATOM 4345 CD2 LEU 278 20.074 1.673 -5.774 1.00 0.00 C -ATOM 4346 HD21 LEU 278 20.296 1.292 -4.777 1.00 0.00 H -ATOM 4347 HD22 LEU 278 20.924 1.491 -6.430 1.00 0.00 H -ATOM 4348 HD23 LEU 278 19.832 2.736 -5.810 1.00 0.00 H -ATOM 4349 C LEU 278 16.387 -0.762 -5.115 1.00 0.00 C -ATOM 4350 O LEU 278 16.389 -1.565 -6.003 1.00 0.00 O -ATOM 4351 N THR 279 16.214 -1.077 -3.812 1.00 0.00 N -ATOM 4352 H THR 279 16.259 -0.334 -3.129 1.00 0.00 H -ATOM 4353 CA THR 279 16.049 -2.456 -3.338 1.00 0.00 C -ATOM 4354 HA THR 279 16.867 -3.034 -3.769 1.00 0.00 H -ATOM 4355 CB THR 279 16.155 -2.538 -1.850 1.00 0.00 C -ATOM 4356 HB THR 279 15.384 -2.024 -1.276 1.00 0.00 H -ATOM 4357 CG2 THR 279 15.958 -4.058 -1.417 1.00 0.00 C -ATOM 4358 HG21 THR 279 16.473 -4.194 -0.466 1.00 0.00 H -ATOM 4359 HG22 THR 279 14.904 -4.331 -1.380 1.00 0.00 H -ATOM 4360 HG23 THR 279 16.464 -4.793 -2.044 1.00 0.00 H -ATOM 4361 OG1 THR 279 17.434 -2.017 -1.431 1.00 0.00 O -ATOM 4362 HG1 THR 279 17.337 -1.073 -1.289 1.00 0.00 H -ATOM 4363 C THR 279 14.717 -3.081 -3.720 1.00 0.00 C -ATOM 4364 O THR 279 14.659 -4.226 -4.103 1.00 0.00 O -ATOM 4365 N LEU 280 13.623 -2.245 -3.703 1.00 0.00 N -ATOM 4366 H LEU 280 13.652 -1.291 -3.372 1.00 0.00 H -ATOM 4367 CA LEU 280 12.322 -2.701 -4.280 1.00 0.00 C -ATOM 4368 HA LEU 280 12.053 -3.655 -3.828 1.00 0.00 H -ATOM 4369 CB LEU 280 11.192 -1.669 -3.990 1.00 0.00 C -ATOM 4370 HB2 LEU 280 11.655 -0.701 -4.183 1.00 0.00 H -ATOM 4371 HB3 LEU 280 10.360 -1.701 -4.694 1.00 0.00 H -ATOM 4372 CG LEU 280 10.704 -1.805 -2.500 1.00 0.00 C -ATOM 4373 HG LEU 280 11.496 -1.991 -1.776 1.00 0.00 H -ATOM 4374 CD1 LEU 280 9.882 -0.504 -2.333 1.00 0.00 C -ATOM 4375 HD11 LEU 280 9.139 -0.363 -3.117 1.00 0.00 H -ATOM 4376 HD12 LEU 280 9.386 -0.580 -1.365 1.00 0.00 H -ATOM 4377 HD13 LEU 280 10.613 0.302 -2.281 1.00 0.00 H -ATOM 4378 CD2 LEU 280 9.769 -3.019 -2.414 1.00 0.00 C -ATOM 4379 HD21 LEU 280 8.861 -2.901 -3.004 1.00 0.00 H -ATOM 4380 HD22 LEU 280 10.268 -3.943 -2.709 1.00 0.00 H -ATOM 4381 HD23 LEU 280 9.458 -3.160 -1.378 1.00 0.00 H -ATOM 4382 C LEU 280 12.470 -3.107 -5.781 1.00 0.00 C -ATOM 4383 O LEU 280 11.838 -4.123 -6.107 1.00 0.00 O -ATOM 4384 N GLY 281 13.261 -2.379 -6.579 1.00 0.00 N -ATOM 4385 H GLY 281 13.511 -1.439 -6.304 1.00 0.00 H -ATOM 4386 CA GLY 281 13.669 -2.797 -7.935 1.00 0.00 C -ATOM 4387 HA2 GLY 281 12.770 -2.882 -8.547 1.00 0.00 H -ATOM 4388 HA3 GLY 281 14.247 -2.007 -8.413 1.00 0.00 H -ATOM 4389 C GLY 281 14.352 -4.164 -7.941 1.00 0.00 C -ATOM 4390 O GLY 281 13.937 -5.138 -8.496 1.00 0.00 O -ATOM 4391 N ARG 282 15.493 -4.268 -7.172 1.00 0.00 N -ATOM 4392 H ARG 282 15.709 -3.445 -6.628 1.00 0.00 H -ATOM 4393 CA ARG 282 16.365 -5.565 -7.093 1.00 0.00 C -ATOM 4394 HA ARG 282 16.688 -5.906 -8.077 1.00 0.00 H -ATOM 4395 CB ARG 282 17.629 -5.250 -6.312 1.00 0.00 C -ATOM 4396 HB2 ARG 282 17.261 -4.978 -5.323 1.00 0.00 H -ATOM 4397 HB3 ARG 282 18.086 -6.240 -6.328 1.00 0.00 H -ATOM 4398 CG ARG 282 18.490 -4.161 -6.894 1.00 0.00 C -ATOM 4399 HG2 ARG 282 18.915 -4.553 -7.818 1.00 0.00 H -ATOM 4400 HG3 ARG 282 17.843 -3.310 -7.104 1.00 0.00 H -ATOM 4401 CD ARG 282 19.670 -3.688 -6.048 1.00 0.00 C -ATOM 4402 HD2 ARG 282 20.018 -2.754 -6.488 1.00 0.00 H -ATOM 4403 HD3 ARG 282 19.309 -3.627 -5.021 1.00 0.00 H -ATOM 4404 NE ARG 282 20.764 -4.703 -6.106 1.00 0.00 N -ATOM 4405 HE ARG 282 20.719 -5.416 -6.820 1.00 0.00 H -ATOM 4406 CZ ARG 282 21.808 -4.643 -5.405 1.00 0.00 C -ATOM 4407 NH1 ARG 282 22.088 -3.639 -4.680 1.00 0.00 N -ATOM 4408 HH11 ARG 282 21.551 -2.793 -4.803 1.00 0.00 H -ATOM 4409 HH12 ARG 282 22.846 -3.665 -4.013 1.00 0.00 H -ATOM 4410 NH2 ARG 282 22.424 -5.730 -5.176 1.00 0.00 N -ATOM 4411 HH21 ARG 282 22.372 -6.463 -5.869 1.00 0.00 H -ATOM 4412 HH22 ARG 282 23.209 -5.718 -4.539 1.00 0.00 H -ATOM 4413 C ARG 282 15.545 -6.726 -6.532 1.00 0.00 C -ATOM 4414 O ARG 282 15.735 -7.868 -7.074 1.00 0.00 O -ATOM 4415 N VAL 283 14.666 -6.595 -5.483 1.00 0.00 N -ATOM 4416 H VAL 283 14.592 -5.675 -5.072 1.00 0.00 H -ATOM 4417 CA VAL 283 13.793 -7.683 -4.939 1.00 0.00 C -ATOM 4418 HA VAL 283 14.381 -8.550 -4.636 1.00 0.00 H -ATOM 4419 CB VAL 283 13.146 -7.201 -3.603 1.00 0.00 C -ATOM 4420 HB VAL 283 12.767 -6.199 -3.803 1.00 0.00 H -ATOM 4421 CG1 VAL 283 11.931 -8.053 -3.047 1.00 0.00 C -ATOM 4422 HG11 VAL 283 12.250 -9.057 -2.766 1.00 0.00 H -ATOM 4423 HG12 VAL 283 11.403 -7.588 -2.215 1.00 0.00 H -ATOM 4424 HG13 VAL 283 11.192 -8.088 -3.848 1.00 0.00 H -ATOM 4425 CG2 VAL 283 14.120 -7.111 -2.432 1.00 0.00 C -ATOM 4426 HG21 VAL 283 14.507 -8.116 -2.266 1.00 0.00 H -ATOM 4427 HG22 VAL 283 14.902 -6.413 -2.732 1.00 0.00 H -ATOM 4428 HG23 VAL 283 13.726 -6.773 -1.474 1.00 0.00 H -ATOM 4429 C VAL 283 12.728 -8.120 -5.993 1.00 0.00 C -ATOM 4430 O VAL 283 12.559 -9.319 -6.159 1.00 0.00 O -ATOM 4431 N ILE 284 12.056 -7.185 -6.678 1.00 0.00 N -ATOM 4432 H ILE 284 12.299 -6.218 -6.516 1.00 0.00 H -ATOM 4433 CA ILE 284 11.041 -7.482 -7.713 1.00 0.00 C -ATOM 4434 HA ILE 284 10.402 -8.284 -7.342 1.00 0.00 H -ATOM 4435 CB ILE 284 10.144 -6.309 -8.100 1.00 0.00 C -ATOM 4436 HB ILE 284 10.715 -5.430 -7.797 1.00 0.00 H -ATOM 4437 CG2 ILE 284 9.760 -6.337 -9.621 1.00 0.00 C -ATOM 4438 HG21 ILE 284 8.990 -5.638 -9.952 1.00 0.00 H -ATOM 4439 HG22 ILE 284 10.575 -6.331 -10.344 1.00 0.00 H -ATOM 4440 HG23 ILE 284 9.401 -7.357 -9.756 1.00 0.00 H -ATOM 4441 CG1 ILE 284 8.795 -6.343 -7.254 1.00 0.00 C -ATOM 4442 HG12 ILE 284 8.266 -5.438 -7.552 1.00 0.00 H -ATOM 4443 HG13 ILE 284 8.202 -7.226 -7.497 1.00 0.00 H -ATOM 4444 CD1 ILE 284 9.052 -6.382 -5.721 1.00 0.00 C -ATOM 4445 HD11 ILE 284 9.711 -5.571 -5.415 1.00 0.00 H -ATOM 4446 HD12 ILE 284 8.154 -6.142 -5.151 1.00 0.00 H -ATOM 4447 HD13 ILE 284 9.544 -7.306 -5.417 1.00 0.00 H -ATOM 4448 C ILE 284 11.745 -8.136 -8.981 1.00 0.00 C -ATOM 4449 O ILE 284 11.153 -9.102 -9.456 1.00 0.00 O -ATOM 4450 N THR 285 13.000 -7.698 -9.317 1.00 0.00 N -ATOM 4451 H THR 285 13.380 -6.968 -8.732 1.00 0.00 H -ATOM 4452 CA THR 285 13.864 -8.469 -10.234 1.00 0.00 C -ATOM 4453 HA THR 285 13.278 -8.595 -11.144 1.00 0.00 H -ATOM 4454 CB THR 285 15.073 -7.541 -10.559 1.00 0.00 C -ATOM 4455 HB THR 285 15.685 -7.325 -9.684 1.00 0.00 H -ATOM 4456 CG2 THR 285 15.732 -7.994 -11.811 1.00 0.00 C -ATOM 4457 HG21 THR 285 16.526 -7.291 -12.063 1.00 0.00 H -ATOM 4458 HG22 THR 285 16.319 -8.866 -11.518 1.00 0.00 H -ATOM 4459 HG23 THR 285 14.991 -8.112 -12.601 1.00 0.00 H -ATOM 4460 OG1 THR 285 14.525 -6.259 -10.921 1.00 0.00 O -ATOM 4461 HG1 THR 285 14.303 -5.780 -10.120 1.00 0.00 H -ATOM 4462 C THR 285 14.281 -9.849 -9.861 1.00 0.00 C -ATOM 4463 O THR 285 14.054 -10.746 -10.587 1.00 0.00 O -ATOM 4464 N ALA 286 14.914 -10.032 -8.737 1.00 0.00 N -ATOM 4465 H ALA 286 14.998 -9.222 -8.141 1.00 0.00 H -ATOM 4466 CA ALA 286 15.251 -11.419 -8.236 1.00 0.00 C -ATOM 4467 HA ALA 286 15.973 -11.878 -8.912 1.00 0.00 H -ATOM 4468 CB ALA 286 16.040 -11.291 -6.949 1.00 0.00 C -ATOM 4469 HB1 ALA 286 15.437 -10.799 -6.185 1.00 0.00 H -ATOM 4470 HB2 ALA 286 16.325 -12.290 -6.620 1.00 0.00 H -ATOM 4471 HB3 ALA 286 16.871 -10.623 -7.169 1.00 0.00 H -ATOM 4472 C ALA 286 13.951 -12.237 -8.072 1.00 0.00 C -ATOM 4473 O ALA 286 13.981 -13.415 -8.325 1.00 0.00 O -ATOM 4474 N LEU 287 12.770 -11.724 -7.615 1.00 0.00 N -ATOM 4475 H LEU 287 12.699 -10.722 -7.516 1.00 0.00 H -ATOM 4476 CA LEU 287 11.540 -12.477 -7.546 1.00 0.00 C -ATOM 4477 HA LEU 287 11.677 -13.479 -7.140 1.00 0.00 H -ATOM 4478 CB LEU 287 10.416 -11.679 -6.824 1.00 0.00 C -ATOM 4479 HB2 LEU 287 10.461 -10.630 -7.116 1.00 0.00 H -ATOM 4480 HB3 LEU 287 9.475 -12.164 -7.086 1.00 0.00 H -ATOM 4481 CG LEU 287 10.484 -11.756 -5.301 1.00 0.00 C -ATOM 4482 HG LEU 287 11.522 -11.643 -4.989 1.00 0.00 H -ATOM 4483 CD1 LEU 287 9.658 -10.598 -4.700 1.00 0.00 C -ATOM 4484 HD11 LEU 287 9.820 -9.650 -5.213 1.00 0.00 H -ATOM 4485 HD12 LEU 287 8.610 -10.885 -4.797 1.00 0.00 H -ATOM 4486 HD13 LEU 287 9.863 -10.525 -3.632 1.00 0.00 H -ATOM 4487 CD2 LEU 287 10.057 -13.045 -4.724 1.00 0.00 C -ATOM 4488 HD21 LEU 287 10.188 -13.044 -3.641 1.00 0.00 H -ATOM 4489 HD22 LEU 287 9.035 -13.329 -4.967 1.00 0.00 H -ATOM 4490 HD23 LEU 287 10.665 -13.864 -5.108 1.00 0.00 H -ATOM 4491 C LEU 287 11.009 -12.882 -8.886 1.00 0.00 C -ATOM 4492 O LEU 287 10.209 -13.814 -8.925 1.00 0.00 O -ATOM 4493 N VAL 288 11.339 -12.241 -10.067 1.00 0.00 N -ATOM 4494 H VAL 288 11.882 -11.394 -9.979 1.00 0.00 H -ATOM 4495 CA VAL 288 10.995 -12.776 -11.424 1.00 0.00 C -ATOM 4496 HA VAL 288 10.202 -13.523 -11.404 1.00 0.00 H -ATOM 4497 CB VAL 288 10.474 -11.563 -12.330 1.00 0.00 C -ATOM 4498 HB VAL 288 10.255 -12.009 -13.300 1.00 0.00 H -ATOM 4499 CG1 VAL 288 9.166 -10.963 -11.726 1.00 0.00 C -ATOM 4500 HG11 VAL 288 8.285 -11.605 -11.771 1.00 0.00 H -ATOM 4501 HG12 VAL 288 9.270 -10.790 -10.655 1.00 0.00 H -ATOM 4502 HG13 VAL 288 8.947 -10.010 -12.208 1.00 0.00 H -ATOM 4503 CG2 VAL 288 11.493 -10.515 -12.438 1.00 0.00 C -ATOM 4504 HG21 VAL 288 12.381 -10.916 -12.926 1.00 0.00 H -ATOM 4505 HG22 VAL 288 11.143 -9.842 -13.221 1.00 0.00 H -ATOM 4506 HG23 VAL 288 11.772 -9.989 -11.525 1.00 0.00 H -ATOM 4507 C VAL 288 12.183 -13.473 -12.110 1.00 0.00 C -ATOM 4508 O VAL 288 11.916 -14.136 -13.100 1.00 0.00 O -ATOM 4509 N GLU 289 13.419 -13.278 -11.645 1.00 0.00 N -ATOM 4510 H GLU 289 13.602 -12.479 -11.057 1.00 0.00 H -ATOM 4511 CA GLU 289 14.527 -14.180 -11.985 1.00 0.00 C -ATOM 4512 HA GLU 289 14.651 -14.320 -13.058 1.00 0.00 H -ATOM 4513 CB GLU 289 15.765 -13.432 -11.599 1.00 0.00 C -ATOM 4514 HB2 GLU 289 15.695 -12.436 -12.038 1.00 0.00 H -ATOM 4515 HB3 GLU 289 15.800 -13.230 -10.528 1.00 0.00 H -ATOM 4516 CG GLU 289 17.213 -14.067 -11.915 1.00 0.00 C -ATOM 4517 HG2 GLU 289 17.992 -13.380 -11.586 1.00 0.00 H -ATOM 4518 HG3 GLU 289 17.458 -14.923 -11.285 1.00 0.00 H -ATOM 4519 CD GLU 289 17.374 -14.516 -13.415 1.00 0.00 C -ATOM 4520 OE1 GLU 289 16.910 -13.816 -14.305 1.00 0.00 O -ATOM 4521 OE2 GLU 289 17.967 -15.577 -13.687 1.00 0.00 O -ATOM 4522 C GLU 289 14.442 -15.600 -11.330 1.00 0.00 C -ATOM 4523 O GLU 289 15.043 -16.575 -11.722 1.00 0.00 O -ATOM 4524 N ARG 290 13.473 -15.690 -10.409 1.00 0.00 N -ATOM 4525 H ARG 290 13.030 -14.813 -10.176 1.00 0.00 H -ATOM 4526 CA ARG 290 12.948 -16.795 -9.683 1.00 0.00 C -ATOM 4527 HA ARG 290 12.195 -16.392 -9.007 1.00 0.00 H -ATOM 4528 CB ARG 290 12.222 -17.827 -10.561 1.00 0.00 C -ATOM 4529 HB2 ARG 290 12.974 -18.163 -11.275 1.00 0.00 H -ATOM 4530 HB3 ARG 290 11.857 -18.675 -9.983 1.00 0.00 H -ATOM 4531 CG ARG 290 10.980 -17.181 -11.251 1.00 0.00 C -ATOM 4532 HG2 ARG 290 10.182 -16.990 -10.533 1.00 0.00 H -ATOM 4533 HG3 ARG 290 11.366 -16.335 -11.820 1.00 0.00 H -ATOM 4534 CD ARG 290 10.428 -18.116 -12.335 1.00 0.00 C -ATOM 4535 HD2 ARG 290 10.136 -19.061 -11.880 1.00 0.00 H -ATOM 4536 HD3 ARG 290 9.584 -17.681 -12.869 1.00 0.00 H -ATOM 4537 NE ARG 290 11.395 -18.502 -13.423 1.00 0.00 N -ATOM 4538 HE ARG 290 12.314 -18.083 -13.374 1.00 0.00 H -ATOM 4539 CZ ARG 290 11.313 -19.462 -14.312 1.00 0.00 C -ATOM 4540 NH1 ARG 290 10.186 -20.082 -14.559 1.00 0.00 N -ATOM 4541 HH11 ARG 290 9.328 -19.705 -14.182 1.00 0.00 H -ATOM 4542 HH12 ARG 290 10.182 -20.956 -15.065 1.00 0.00 H -ATOM 4543 NH2 ARG 290 12.411 -19.749 -15.015 1.00 0.00 N -ATOM 4544 HH21 ARG 290 13.304 -19.372 -14.728 1.00 0.00 H -ATOM 4545 HH22 ARG 290 12.429 -20.466 -15.726 1.00 0.00 H -ATOM 4546 C ARG 290 13.869 -17.400 -8.639 1.00 0.00 C -ATOM 4547 O ARG 290 13.419 -18.214 -7.912 1.00 0.00 O -ATOM 4548 N THR 291 15.174 -16.932 -8.689 1.00 0.00 N -ATOM 4549 H THR 291 15.422 -16.202 -9.340 1.00 0.00 H -ATOM 4550 CA THR 291 16.153 -17.197 -7.704 1.00 0.00 C -ATOM 4551 HA THR 291 16.373 -18.264 -7.698 1.00 0.00 H -ATOM 4552 CB THR 291 17.534 -16.539 -8.099 1.00 0.00 C -ATOM 4553 HB THR 291 17.887 -16.931 -9.054 1.00 0.00 H -ATOM 4554 CG2 THR 291 17.539 -15.075 -8.090 1.00 0.00 C -ATOM 4555 HG21 THR 291 16.641 -14.663 -8.547 1.00 0.00 H -ATOM 4556 HG22 THR 291 17.647 -14.645 -7.094 1.00 0.00 H -ATOM 4557 HG23 THR 291 18.284 -14.547 -8.686 1.00 0.00 H -ATOM 4558 OG1 THR 291 18.497 -16.934 -7.134 1.00 0.00 O -ATOM 4559 HG1 THR 291 19.264 -16.373 -7.264 1.00 0.00 H -ATOM 4560 C THR 291 15.747 -16.963 -6.271 1.00 0.00 C -ATOM 4561 O THR 291 15.206 -15.869 -5.946 1.00 0.00 O -ATOM 4562 N PRO 292 15.960 -17.927 -5.302 1.00 0.00 N -ATOM 4563 CD PRO 292 16.581 -19.202 -5.492 1.00 0.00 C -ATOM 4564 HD2 PRO 292 17.619 -19.188 -5.821 1.00 0.00 H -ATOM 4565 HD3 PRO 292 15.944 -19.727 -6.204 1.00 0.00 H -ATOM 4566 CG PRO 292 16.688 -19.832 -4.090 1.00 0.00 C -ATOM 4567 HG2 PRO 292 17.685 -19.834 -3.648 1.00 0.00 H -ATOM 4568 HG3 PRO 292 16.437 -20.893 -4.055 1.00 0.00 H -ATOM 4569 CB PRO 292 15.716 -19.042 -3.237 1.00 0.00 C -ATOM 4570 HB2 PRO 292 16.025 -19.013 -2.192 1.00 0.00 H -ATOM 4571 HB3 PRO 292 14.733 -19.512 -3.217 1.00 0.00 H -ATOM 4572 CA PRO 292 15.589 -17.640 -3.897 1.00 0.00 C -ATOM 4573 HA PRO 292 14.570 -17.263 -3.817 1.00 0.00 H -ATOM 4574 C PRO 292 16.491 -16.637 -3.152 1.00 0.00 C -ATOM 4575 O PRO 292 16.145 -16.085 -2.106 1.00 0.00 O -ATOM 4576 N HIE 293 17.697 -16.348 -3.689 1.00 0.00 N -ATOM 4577 H HIE 293 17.804 -16.779 -4.597 1.00 0.00 H -ATOM 4578 CA HIE 293 18.682 -15.304 -3.133 1.00 0.00 C -ATOM 4579 HA HIE 293 18.606 -15.262 -2.046 1.00 0.00 H -ATOM 4580 CB HIE 293 20.176 -15.519 -3.569 1.00 0.00 C -ATOM 4581 HB2 HIE 293 20.246 -15.404 -4.651 1.00 0.00 H -ATOM 4582 HB3 HIE 293 20.769 -14.700 -3.161 1.00 0.00 H -ATOM 4583 CG HIE 293 20.598 -16.921 -3.238 1.00 0.00 C -ATOM 4584 ND1 HIE 293 20.647 -17.372 -1.887 1.00 0.00 N -ATOM 4585 CE1 HIE 293 20.932 -18.686 -2.024 1.00 0.00 C -ATOM 4586 HE1 HIE 293 21.014 -19.350 -1.176 1.00 0.00 H -ATOM 4587 NE2 HIE 293 21.165 -19.027 -3.309 1.00 0.00 N -ATOM 4588 HE2 HIE 293 21.476 -19.940 -3.609 1.00 0.00 H -ATOM 4589 CD2 HIE 293 20.992 -17.905 -4.069 1.00 0.00 C -ATOM 4590 HD2 HIE 293 21.153 -17.807 -5.132 1.00 0.00 H -ATOM 4591 C HIE 293 18.238 -13.852 -3.509 1.00 0.00 C -ATOM 4592 O HIE 293 18.939 -12.952 -3.945 1.00 0.00 O -ATOM 4593 N VAL 294 16.912 -13.616 -3.285 1.00 0.00 N -ATOM 4594 H VAL 294 16.412 -14.447 -3.004 1.00 0.00 H -ATOM 4595 CA VAL 294 16.179 -12.358 -3.372 1.00 0.00 C -ATOM 4596 HA VAL 294 16.300 -11.895 -4.352 1.00 0.00 H -ATOM 4597 CB VAL 294 14.642 -12.528 -3.080 1.00 0.00 C -ATOM 4598 HB VAL 294 14.609 -12.740 -2.012 1.00 0.00 H -ATOM 4599 CG1 VAL 294 13.819 -11.255 -3.322 1.00 0.00 C -ATOM 4600 HG11 VAL 294 12.769 -11.370 -3.054 1.00 0.00 H -ATOM 4601 HG12 VAL 294 14.250 -10.455 -2.718 1.00 0.00 H -ATOM 4602 HG13 VAL 294 13.750 -11.057 -4.392 1.00 0.00 H -ATOM 4603 CG2 VAL 294 14.037 -13.675 -3.924 1.00 0.00 C -ATOM 4604 HG21 VAL 294 14.079 -13.405 -4.979 1.00 0.00 H -ATOM 4605 HG22 VAL 294 14.361 -14.691 -3.700 1.00 0.00 H -ATOM 4606 HG23 VAL 294 12.965 -13.748 -3.734 1.00 0.00 H -ATOM 4607 C VAL 294 16.715 -11.357 -2.301 1.00 0.00 C -ATOM 4608 O VAL 294 16.556 -11.589 -1.143 1.00 0.00 O -ATOM 4609 N PRO 295 17.351 -10.235 -2.685 1.00 0.00 N -ATOM 4610 CD PRO 295 17.378 -9.758 -4.079 1.00 0.00 C -ATOM 4611 HD2 PRO 295 16.338 -9.778 -4.405 1.00 0.00 H -ATOM 4612 HD3 PRO 295 17.981 -10.495 -4.609 1.00 0.00 H -ATOM 4613 CG PRO 295 17.905 -8.311 -4.022 1.00 0.00 C -ATOM 4614 HG2 PRO 295 17.158 -7.517 -4.024 1.00 0.00 H -ATOM 4615 HG3 PRO 295 18.529 -8.065 -4.880 1.00 0.00 H -ATOM 4616 CB PRO 295 18.723 -8.343 -2.820 1.00 0.00 C -ATOM 4617 HB2 PRO 295 19.069 -7.358 -2.507 1.00 0.00 H -ATOM 4618 HB3 PRO 295 19.668 -8.796 -3.122 1.00 0.00 H -ATOM 4619 CA PRO 295 17.974 -9.272 -1.825 1.00 0.00 C -ATOM 4620 HA PRO 295 18.773 -9.647 -1.185 1.00 0.00 H -ATOM 4621 C PRO 295 17.057 -8.428 -0.888 1.00 0.00 C -ATOM 4622 O PRO 295 17.159 -7.206 -0.831 1.00 0.00 O -ATOM 4623 N TYR 296 16.198 -9.059 -0.031 1.00 0.00 N -ATOM 4624 H TYR 296 16.201 -10.069 -0.055 1.00 0.00 H -ATOM 4625 CA TYR 296 15.313 -8.433 0.963 1.00 0.00 C -ATOM 4626 HA TYR 296 14.522 -7.807 0.550 1.00 0.00 H -ATOM 4627 CB TYR 296 14.552 -9.565 1.816 1.00 0.00 C -ATOM 4628 HB2 TYR 296 15.233 -10.110 2.469 1.00 0.00 H -ATOM 4629 HB3 TYR 296 13.920 -9.041 2.534 1.00 0.00 H -ATOM 4630 CG TYR 296 13.594 -10.453 1.025 1.00 0.00 C -ATOM 4631 CD1 TYR 296 12.343 -10.010 0.558 1.00 0.00 C -ATOM 4632 HD1 TYR 296 12.001 -9.004 0.754 1.00 0.00 H -ATOM 4633 CE1 TYR 296 11.628 -10.842 -0.317 1.00 0.00 C -ATOM 4634 HE1 TYR 296 10.766 -10.471 -0.851 1.00 0.00 H -ATOM 4635 CZ TYR 296 12.048 -12.143 -0.470 1.00 0.00 C -ATOM 4636 OH TYR 296 11.280 -12.955 -1.191 1.00 0.00 O -ATOM 4637 HH TYR 296 10.354 -12.707 -1.241 1.00 0.00 H -ATOM 4638 CE2 TYR 296 13.189 -12.659 0.170 1.00 0.00 C -ATOM 4639 HE2 TYR 296 13.547 -13.642 -0.098 1.00 0.00 H -ATOM 4640 CD2 TYR 296 13.967 -11.801 0.925 1.00 0.00 C -ATOM 4641 HD2 TYR 296 14.876 -12.129 1.408 1.00 0.00 H -ATOM 4642 C TYR 296 16.113 -7.573 1.923 1.00 0.00 C -ATOM 4643 O TYR 296 15.671 -6.477 2.325 1.00 0.00 O -ATOM 4644 N ARG 297 17.340 -8.021 2.232 1.00 0.00 N -ATOM 4645 H ARG 297 17.585 -8.842 1.696 1.00 0.00 H -ATOM 4646 CA ARG 297 18.249 -7.439 3.188 1.00 0.00 C -ATOM 4647 HA ARG 297 17.823 -7.549 4.185 1.00 0.00 H -ATOM 4648 CB ARG 297 19.644 -8.171 3.227 1.00 0.00 C -ATOM 4649 HB2 ARG 297 20.303 -7.889 4.048 1.00 0.00 H -ATOM 4650 HB3 ARG 297 19.423 -9.236 3.296 1.00 0.00 H -ATOM 4651 CG ARG 297 20.525 -7.979 1.937 1.00 0.00 C -ATOM 4652 HG2 ARG 297 19.925 -8.182 1.048 1.00 0.00 H -ATOM 4653 HG3 ARG 297 20.826 -6.942 1.792 1.00 0.00 H -ATOM 4654 CD ARG 297 21.830 -8.799 1.776 1.00 0.00 C -ATOM 4655 HD2 ARG 297 22.444 -8.572 2.648 1.00 0.00 H -ATOM 4656 HD3 ARG 297 21.504 -9.837 1.826 1.00 0.00 H -ATOM 4657 NE ARG 297 22.470 -8.523 0.521 1.00 0.00 N -ATOM 4658 HE ARG 297 22.735 -7.556 0.397 1.00 0.00 H -ATOM 4659 CZ ARG 297 22.377 -9.125 -0.651 1.00 0.00 C -ATOM 4660 NH1 ARG 297 21.730 -10.257 -0.919 1.00 0.00 N -ATOM 4661 HH11 ARG 297 21.340 -10.747 -0.127 1.00 0.00 H -ATOM 4662 HH12 ARG 297 21.892 -10.739 -1.791 1.00 0.00 H -ATOM 4663 NH2 ARG 297 23.045 -8.553 -1.614 1.00 0.00 N -ATOM 4664 HH21 ARG 297 23.124 -7.562 -1.436 1.00 0.00 H -ATOM 4665 HH22 ARG 297 22.887 -8.913 -2.544 1.00 0.00 H -ATOM 4666 C ARG 297 18.556 -5.936 3.029 1.00 0.00 C -ATOM 4667 O ARG 297 18.806 -5.213 3.970 1.00 0.00 O -ATOM 4668 N GLU 298 18.494 -5.540 1.702 1.00 0.00 N -ATOM 4669 H GLU 298 18.338 -6.301 1.057 1.00 0.00 H -ATOM 4670 CA GLU 298 19.145 -4.220 1.422 1.00 0.00 C -ATOM 4671 HA GLU 298 19.966 -4.141 2.135 1.00 0.00 H -ATOM 4672 CB GLU 298 19.649 -4.061 0.007 1.00 0.00 C -ATOM 4673 HB2 GLU 298 18.721 -3.947 -0.553 1.00 0.00 H -ATOM 4674 HB3 GLU 298 20.155 -3.096 -0.003 1.00 0.00 H -ATOM 4675 CG GLU 298 20.606 -5.200 -0.643 1.00 0.00 C -ATOM 4676 HG2 GLU 298 20.202 -6.186 -0.420 1.00 0.00 H -ATOM 4677 HG3 GLU 298 20.569 -5.063 -1.723 1.00 0.00 H -ATOM 4678 CD GLU 298 22.109 -5.105 -0.197 1.00 0.00 C -ATOM 4679 OE1 GLU 298 22.397 -4.307 0.777 1.00 0.00 O -ATOM 4680 OE2 GLU 298 22.969 -5.845 -0.806 1.00 0.00 O -ATOM 4681 C GLU 298 18.318 -2.987 1.800 1.00 0.00 C -ATOM 4682 O GLU 298 18.785 -1.842 1.648 1.00 0.00 O -ATOM 4683 N SER 299 17.104 -3.191 2.376 1.00 0.00 N -ATOM 4684 H SER 299 16.649 -4.092 2.348 1.00 0.00 H -ATOM 4685 CA SER 299 16.379 -2.126 3.043 1.00 0.00 C -ATOM 4686 HA SER 299 17.025 -1.432 3.582 1.00 0.00 H -ATOM 4687 CB SER 299 15.618 -1.384 1.975 1.00 0.00 C -ATOM 4688 HB2 SER 299 16.282 -0.792 1.345 1.00 0.00 H -ATOM 4689 HB3 SER 299 15.218 -2.175 1.341 1.00 0.00 H -ATOM 4690 OG SER 299 14.609 -0.617 2.586 1.00 0.00 O -ATOM 4691 HG SER 299 15.078 0.105 3.009 1.00 0.00 H -ATOM 4692 C SER 299 15.474 -2.696 4.146 1.00 0.00 C -ATOM 4693 O SER 299 15.037 -3.813 4.180 1.00 0.00 O -ATOM 4694 N LYS 300 15.274 -1.894 5.174 1.00 0.00 N -ATOM 4695 H LYS 300 15.611 -0.945 5.099 1.00 0.00 H -ATOM 4696 CA LYS 300 14.490 -2.331 6.336 1.00 0.00 C -ATOM 4697 HA LYS 300 14.944 -3.240 6.732 1.00 0.00 H -ATOM 4698 CB LYS 300 14.562 -1.320 7.519 1.00 0.00 C -ATOM 4699 HB2 LYS 300 14.241 -0.299 7.317 1.00 0.00 H -ATOM 4700 HB3 LYS 300 14.122 -1.669 8.453 1.00 0.00 H -ATOM 4701 CG LYS 300 16.049 -1.115 7.820 1.00 0.00 C -ATOM 4702 HG2 LYS 300 16.595 -2.051 7.932 1.00 0.00 H -ATOM 4703 HG3 LYS 300 16.461 -0.416 7.090 1.00 0.00 H -ATOM 4704 CD LYS 300 16.352 -0.311 9.111 1.00 0.00 C -ATOM 4705 HD2 LYS 300 15.892 0.658 8.915 1.00 0.00 H -ATOM 4706 HD3 LYS 300 15.850 -0.823 9.932 1.00 0.00 H -ATOM 4707 CE LYS 300 17.885 -0.137 9.378 1.00 0.00 C -ATOM 4708 HE2 LYS 300 18.187 -1.098 9.795 1.00 0.00 H -ATOM 4709 HE3 LYS 300 18.382 0.086 8.434 1.00 0.00 H -ATOM 4710 NZ LYS 300 18.249 1.021 10.261 1.00 0.00 N -ATOM 4711 HZ1 LYS 300 18.087 0.790 11.230 1.00 0.00 H -ATOM 4712 HZ2 LYS 300 19.193 1.349 10.121 1.00 0.00 H -ATOM 4713 HZ3 LYS 300 17.569 1.712 9.977 1.00 0.00 H -ATOM 4714 C LYS 300 13.038 -2.565 5.985 1.00 0.00 C -ATOM 4715 O LYS 300 12.466 -3.546 6.454 1.00 0.00 O -ATOM 4716 N LEU 301 12.455 -1.750 5.080 1.00 0.00 N -ATOM 4717 H LEU 301 12.967 -0.881 5.022 1.00 0.00 H -ATOM 4718 CA LEU 301 11.063 -1.865 4.527 1.00 0.00 C -ATOM 4719 HA LEU 301 10.430 -1.966 5.409 1.00 0.00 H -ATOM 4720 CB LEU 301 10.748 -0.696 3.640 1.00 0.00 C -ATOM 4721 HB2 LEU 301 10.693 0.179 4.287 1.00 0.00 H -ATOM 4722 HB3 LEU 301 11.523 -0.658 2.874 1.00 0.00 H -ATOM 4723 CG LEU 301 9.397 -0.927 2.902 1.00 0.00 C -ATOM 4724 HG LEU 301 9.532 -1.917 2.466 1.00 0.00 H -ATOM 4725 CD1 LEU 301 8.225 -0.855 3.866 1.00 0.00 C -ATOM 4726 HD11 LEU 301 8.184 0.143 4.304 1.00 0.00 H -ATOM 4727 HD12 LEU 301 7.329 -1.014 3.265 1.00 0.00 H -ATOM 4728 HD13 LEU 301 8.361 -1.611 4.637 1.00 0.00 H -ATOM 4729 CD2 LEU 301 9.296 0.023 1.688 1.00 0.00 C -ATOM 4730 HD21 LEU 301 8.248 0.032 1.389 1.00 0.00 H -ATOM 4731 HD22 LEU 301 9.408 1.083 1.915 1.00 0.00 H -ATOM 4732 HD23 LEU 301 9.789 -0.325 0.780 1.00 0.00 H -ATOM 4733 C LEU 301 10.917 -3.244 3.880 1.00 0.00 C -ATOM 4734 O LEU 301 10.137 -4.073 4.323 1.00 0.00 O -ATOM 4735 N THR 302 11.804 -3.564 2.897 1.00 0.00 N -ATOM 4736 H THR 302 12.585 -2.958 2.686 1.00 0.00 H -ATOM 4737 CA THR 302 11.843 -4.905 2.274 1.00 0.00 C -ATOM 4738 HA THR 302 10.818 -5.099 1.958 1.00 0.00 H -ATOM 4739 CB THR 302 12.772 -4.968 1.013 1.00 0.00 C -ATOM 4740 HB THR 302 12.700 -5.973 0.597 1.00 0.00 H -ATOM 4741 CG2 THR 302 12.185 -3.949 0.117 1.00 0.00 C -ATOM 4742 HG21 THR 302 12.288 -2.930 0.488 1.00 0.00 H -ATOM 4743 HG22 THR 302 12.734 -4.107 -0.812 1.00 0.00 H -ATOM 4744 HG23 THR 302 11.140 -4.234 -0.005 1.00 0.00 H -ATOM 4745 OG1 THR 302 14.080 -4.586 1.142 1.00 0.00 O -ATOM 4746 HG1 THR 302 14.551 -5.107 1.797 1.00 0.00 H -ATOM 4747 C THR 302 12.119 -5.979 3.260 1.00 0.00 C -ATOM 4748 O THR 302 11.515 -7.023 3.156 1.00 0.00 O -ATOM 4749 N ARG 303 12.955 -5.739 4.275 1.00 0.00 N -ATOM 4750 H ARG 303 13.396 -4.836 4.369 1.00 0.00 H -ATOM 4751 CA ARG 303 13.106 -6.726 5.362 1.00 0.00 C -ATOM 4752 HA ARG 303 13.276 -7.697 4.898 1.00 0.00 H -ATOM 4753 CB ARG 303 14.234 -6.387 6.294 1.00 0.00 C -ATOM 4754 HB2 ARG 303 14.150 -5.313 6.462 1.00 0.00 H -ATOM 4755 HB3 ARG 303 14.230 -6.880 7.267 1.00 0.00 H -ATOM 4756 CG ARG 303 15.630 -6.665 5.670 1.00 0.00 C -ATOM 4757 HG2 ARG 303 15.597 -7.718 5.392 1.00 0.00 H -ATOM 4758 HG3 ARG 303 15.864 -5.939 4.891 1.00 0.00 H -ATOM 4759 CD ARG 303 16.757 -6.473 6.668 1.00 0.00 C -ATOM 4760 HD2 ARG 303 17.622 -6.298 6.027 1.00 0.00 H -ATOM 4761 HD3 ARG 303 16.530 -5.543 7.190 1.00 0.00 H -ATOM 4762 NE ARG 303 16.955 -7.577 7.554 1.00 0.00 N -ATOM 4763 HE ARG 303 16.301 -8.346 7.553 1.00 0.00 H -ATOM 4764 CZ ARG 303 17.973 -7.795 8.347 1.00 0.00 C -ATOM 4765 NH1 ARG 303 18.823 -6.830 8.541 1.00 0.00 N -ATOM 4766 HH11 ARG 303 18.620 -5.935 8.119 1.00 0.00 H -ATOM 4767 HH12 ARG 303 19.746 -7.042 8.893 1.00 0.00 H -ATOM 4768 NH2 ARG 303 18.116 -8.859 9.030 1.00 0.00 N -ATOM 4769 HH21 ARG 303 17.604 -9.714 8.868 1.00 0.00 H -ATOM 4770 HH22 ARG 303 18.970 -8.889 9.569 1.00 0.00 H -ATOM 4771 C ARG 303 11.830 -7.009 6.070 1.00 0.00 C -ATOM 4772 O ARG 303 11.465 -8.171 6.318 1.00 0.00 O -ATOM 4773 N ILE 304 11.153 -5.966 6.461 1.00 0.00 N -ATOM 4774 H ILE 304 11.594 -5.062 6.368 1.00 0.00 H -ATOM 4775 CA ILE 304 9.929 -5.964 7.332 1.00 0.00 C -ATOM 4776 HA ILE 304 10.084 -6.667 8.150 1.00 0.00 H -ATOM 4777 CB ILE 304 9.828 -4.555 7.936 1.00 0.00 C -ATOM 4778 HB ILE 304 10.068 -3.826 7.162 1.00 0.00 H -ATOM 4779 CG2 ILE 304 8.413 -4.153 8.430 1.00 0.00 C -ATOM 4780 HG21 ILE 304 8.354 -3.194 8.946 1.00 0.00 H -ATOM 4781 HG22 ILE 304 7.888 -3.993 7.487 1.00 0.00 H -ATOM 4782 HG23 ILE 304 7.954 -4.890 9.088 1.00 0.00 H -ATOM 4783 CG1 ILE 304 10.878 -4.436 9.029 1.00 0.00 C -ATOM 4784 HG12 ILE 304 10.542 -5.040 9.872 1.00 0.00 H -ATOM 4785 HG13 ILE 304 11.854 -4.832 8.751 1.00 0.00 H -ATOM 4786 CD1 ILE 304 11.002 -2.922 9.470 1.00 0.00 C -ATOM 4787 HD11 ILE 304 11.282 -2.342 8.590 1.00 0.00 H -ATOM 4788 HD12 ILE 304 10.046 -2.560 9.847 1.00 0.00 H -ATOM 4789 HD13 ILE 304 11.798 -2.790 10.204 1.00 0.00 H -ATOM 4790 C ILE 304 8.710 -6.498 6.605 1.00 0.00 C -ATOM 4791 O ILE 304 7.868 -7.102 7.220 1.00 0.00 O -ATOM 4792 N LEU 305 8.794 -6.397 5.219 1.00 0.00 N -ATOM 4793 H LEU 305 9.635 -5.969 4.857 1.00 0.00 H -ATOM 4794 CA LEU 305 7.769 -6.846 4.282 1.00 0.00 C -ATOM 4795 HA LEU 305 6.932 -7.182 4.895 1.00 0.00 H -ATOM 4796 CB LEU 305 7.088 -5.751 3.408 1.00 0.00 C -ATOM 4797 HB2 LEU 305 7.862 -5.486 2.687 1.00 0.00 H -ATOM 4798 HB3 LEU 305 6.268 -6.171 2.825 1.00 0.00 H -ATOM 4799 CG LEU 305 6.585 -4.497 4.041 1.00 0.00 C -ATOM 4800 HG LEU 305 7.382 -3.918 4.506 1.00 0.00 H -ATOM 4801 CD1 LEU 305 5.955 -3.638 2.950 1.00 0.00 C -ATOM 4802 HD11 LEU 305 5.112 -4.219 2.575 1.00 0.00 H -ATOM 4803 HD12 LEU 305 5.779 -2.647 3.368 1.00 0.00 H -ATOM 4804 HD13 LEU 305 6.699 -3.528 2.161 1.00 0.00 H -ATOM 4805 CD2 LEU 305 5.408 -4.814 5.033 1.00 0.00 C -ATOM 4806 HD21 LEU 305 5.109 -3.904 5.555 1.00 0.00 H -ATOM 4807 HD22 LEU 305 4.613 -5.364 4.530 1.00 0.00 H -ATOM 4808 HD23 LEU 305 5.768 -5.546 5.756 1.00 0.00 H -ATOM 4809 C LEU 305 8.086 -8.124 3.524 1.00 0.00 C -ATOM 4810 O LEU 305 7.448 -8.369 2.537 1.00 0.00 O -ATOM 4811 N GLN 306 9.027 -8.997 3.998 1.00 0.00 N -ATOM 4812 H GLN 306 9.603 -8.645 4.750 1.00 0.00 H -ATOM 4813 CA GLN 306 9.413 -10.174 3.264 1.00 0.00 C -ATOM 4814 HA GLN 306 9.748 -9.892 2.266 1.00 0.00 H -ATOM 4815 CB GLN 306 10.543 -10.868 3.924 1.00 0.00 C -ATOM 4816 HB2 GLN 306 10.943 -11.685 3.323 1.00 0.00 H -ATOM 4817 HB3 GLN 306 11.420 -10.223 3.981 1.00 0.00 H -ATOM 4818 CG GLN 306 10.301 -11.396 5.296 1.00 0.00 C -ATOM 4819 HG2 GLN 306 9.968 -10.556 5.904 1.00 0.00 H -ATOM 4820 HG3 GLN 306 9.598 -12.226 5.377 1.00 0.00 H -ATOM 4821 CD GLN 306 11.444 -11.949 5.973 1.00 0.00 C -ATOM 4822 OE1 GLN 306 11.659 -13.195 6.110 1.00 0.00 O -ATOM 4823 NE2 GLN 306 12.259 -11.194 6.524 1.00 0.00 N -ATOM 4824 HE21 GLN 306 12.936 -11.674 7.099 1.00 0.00 H -ATOM 4825 HE22 GLN 306 12.184 -10.187 6.539 1.00 0.00 H -ATOM 4826 C GLN 306 8.299 -11.132 3.076 1.00 0.00 C -ATOM 4827 O GLN 306 8.325 -11.945 2.132 1.00 0.00 O -ATOM 4828 N ASP 307 7.349 -11.170 4.008 1.00 0.00 N -ATOM 4829 H ASP 307 7.375 -10.615 4.851 1.00 0.00 H -ATOM 4830 CA ASP 307 6.277 -12.144 3.856 1.00 0.00 C -ATOM 4831 HA ASP 307 6.720 -13.057 3.460 1.00 0.00 H -ATOM 4832 CB ASP 307 5.652 -12.530 5.209 1.00 0.00 C -ATOM 4833 HB2 ASP 307 6.462 -12.639 5.930 1.00 0.00 H -ATOM 4834 HB3 ASP 307 4.914 -11.756 5.423 1.00 0.00 H -ATOM 4835 CG ASP 307 4.922 -13.919 5.125 1.00 0.00 C -ATOM 4836 OD1 ASP 307 5.550 -14.866 4.580 1.00 0.00 O -ATOM 4837 OD2 ASP 307 3.802 -14.117 5.587 1.00 0.00 O -ATOM 4838 C ASP 307 5.176 -11.711 2.796 1.00 0.00 C -ATOM 4839 O ASP 307 4.487 -12.620 2.339 1.00 0.00 O -ATOM 4840 N SER 308 5.031 -10.442 2.521 1.00 0.00 N -ATOM 4841 H SER 308 5.508 -9.750 3.083 1.00 0.00 H -ATOM 4842 CA SER 308 4.340 -9.922 1.394 1.00 0.00 C -ATOM 4843 HA SER 308 3.402 -10.446 1.209 1.00 0.00 H -ATOM 4844 CB SER 308 4.049 -8.468 1.646 1.00 0.00 C -ATOM 4845 HB2 SER 308 4.978 -7.901 1.697 1.00 0.00 H -ATOM 4846 HB3 SER 308 3.412 -8.056 0.864 1.00 0.00 H -ATOM 4847 OG SER 308 3.281 -8.340 2.781 1.00 0.00 O -ATOM 4848 HG SER 308 3.874 -8.709 3.441 1.00 0.00 H -ATOM 4849 C SER 308 5.048 -10.084 0.051 1.00 0.00 C -ATOM 4850 O SER 308 4.507 -10.685 -0.915 1.00 0.00 O -ATOM 4851 N LEU 309 6.363 -9.782 0.021 1.00 0.00 N -ATOM 4852 H LEU 309 6.785 -9.389 0.849 1.00 0.00 H -ATOM 4853 CA LEU 309 7.197 -9.802 -1.164 1.00 0.00 C -ATOM 4854 HA LEU 309 6.535 -9.489 -1.972 1.00 0.00 H -ATOM 4855 CB LEU 309 8.323 -8.815 -1.044 1.00 0.00 C -ATOM 4856 HB2 LEU 309 8.982 -9.197 -0.264 1.00 0.00 H -ATOM 4857 HB3 LEU 309 8.873 -8.962 -1.973 1.00 0.00 H -ATOM 4858 CG LEU 309 7.975 -7.323 -0.779 1.00 0.00 C -ATOM 4859 HG LEU 309 7.018 -7.224 -0.266 1.00 0.00 H -ATOM 4860 CD1 LEU 309 9.095 -6.669 0.041 1.00 0.00 C -ATOM 4861 HD11 LEU 309 9.289 -7.215 0.963 1.00 0.00 H -ATOM 4862 HD12 LEU 309 10.008 -6.820 -0.535 1.00 0.00 H -ATOM 4863 HD13 LEU 309 8.849 -5.612 0.148 1.00 0.00 H -ATOM 4864 CD2 LEU 309 7.873 -6.548 -2.051 1.00 0.00 C -ATOM 4865 HD21 LEU 309 8.848 -6.628 -2.531 1.00 0.00 H -ATOM 4866 HD22 LEU 309 7.057 -6.906 -2.679 1.00 0.00 H -ATOM 4867 HD23 LEU 309 7.756 -5.495 -1.794 1.00 0.00 H -ATOM 4868 C LEU 309 7.582 -11.292 -1.587 1.00 0.00 C -ATOM 4869 O LEU 309 8.674 -11.643 -1.313 1.00 0.00 O -ATOM 4870 N GLY 310 6.618 -12.092 -2.052 1.00 0.00 N -ATOM 4871 H GLY 310 5.723 -11.676 -2.265 1.00 0.00 H -ATOM 4872 CA GLY 310 6.762 -13.571 -2.444 1.00 0.00 C -ATOM 4873 HA2 GLY 310 5.984 -13.648 -3.204 1.00 0.00 H -ATOM 4874 HA3 GLY 310 7.751 -13.675 -2.890 1.00 0.00 H -ATOM 4875 C GLY 310 6.498 -14.638 -1.352 1.00 0.00 C -ATOM 4876 O GLY 310 6.307 -15.788 -1.710 1.00 0.00 O -ATOM 4877 N GLY 311 6.414 -14.250 -0.122 1.00 0.00 N -ATOM 4878 H GLY 311 6.351 -13.249 -0.000 1.00 0.00 H -ATOM 4879 CA GLY 311 6.036 -15.029 0.999 1.00 0.00 C -ATOM 4880 HA2 GLY 311 6.605 -15.938 1.193 1.00 0.00 H -ATOM 4881 HA3 GLY 311 6.284 -14.529 1.935 1.00 0.00 H -ATOM 4882 C GLY 311 4.490 -15.402 1.072 1.00 0.00 C -ATOM 4883 O GLY 311 3.735 -15.409 0.115 1.00 0.00 O -ATOM 4884 N ARG 312 4.026 -15.875 2.253 1.00 0.00 N -ATOM 4885 H ARG 312 4.517 -15.602 3.093 1.00 0.00 H -ATOM 4886 CA ARG 312 2.715 -16.378 2.500 1.00 0.00 C -ATOM 4887 HA ARG 312 2.518 -17.092 1.700 1.00 0.00 H -ATOM 4888 CB ARG 312 2.704 -17.289 3.755 1.00 0.00 C -ATOM 4889 HB2 ARG 312 3.525 -18.007 3.742 1.00 0.00 H -ATOM 4890 HB3 ARG 312 3.015 -16.719 4.630 1.00 0.00 H -ATOM 4891 CG ARG 312 1.434 -18.049 4.004 1.00 0.00 C -ATOM 4892 HG2 ARG 312 0.629 -17.357 4.255 1.00 0.00 H -ATOM 4893 HG3 ARG 312 1.102 -18.600 3.124 1.00 0.00 H -ATOM 4894 CD ARG 312 1.578 -19.182 5.003 1.00 0.00 C -ATOM 4895 HD2 ARG 312 2.339 -19.933 4.790 1.00 0.00 H -ATOM 4896 HD3 ARG 312 1.800 -18.673 5.941 1.00 0.00 H -ATOM 4897 NE ARG 312 0.337 -20.006 5.146 1.00 0.00 N -ATOM 4898 HE ARG 312 0.143 -20.578 4.336 1.00 0.00 H -ATOM 4899 CZ ARG 312 -0.388 -20.258 6.191 1.00 0.00 C -ATOM 4900 NH1 ARG 312 -0.321 -19.566 7.279 1.00 0.00 N -ATOM 4901 HH11 ARG 312 0.379 -18.856 7.440 1.00 0.00 H -ATOM 4902 HH12 ARG 312 -0.861 -19.668 8.125 1.00 0.00 H -ATOM 4903 NH2 ARG 312 -1.292 -21.162 6.114 1.00 0.00 N -ATOM 4904 HH21 ARG 312 -1.462 -21.664 5.254 1.00 0.00 H -ATOM 4905 HH22 ARG 312 -1.815 -21.481 6.917 1.00 0.00 H -ATOM 4906 C ARG 312 1.646 -15.288 2.563 1.00 0.00 C -ATOM 4907 O ARG 312 0.516 -15.561 2.199 1.00 0.00 O -ATOM 4908 N THR 313 2.081 -13.997 2.849 1.00 0.00 N -ATOM 4909 H THR 313 3.052 -13.768 3.005 1.00 0.00 H -ATOM 4910 CA THR 313 1.097 -12.899 3.047 1.00 0.00 C -ATOM 4911 HA THR 313 0.302 -13.325 3.659 1.00 0.00 H -ATOM 4912 CB THR 313 1.623 -11.768 3.994 1.00 0.00 C -ATOM 4913 HB THR 313 2.566 -11.452 3.548 1.00 0.00 H -ATOM 4914 CG2 THR 313 0.830 -10.556 4.245 1.00 0.00 C -ATOM 4915 HG21 THR 313 0.060 -10.759 4.990 1.00 0.00 H -ATOM 4916 HG22 THR 313 1.411 -9.723 4.639 1.00 0.00 H -ATOM 4917 HG23 THR 313 0.355 -10.197 3.332 1.00 0.00 H -ATOM 4918 OG1 THR 313 2.053 -12.233 5.233 1.00 0.00 O -ATOM 4919 HG1 THR 313 2.667 -12.965 5.143 1.00 0.00 H -ATOM 4920 C THR 313 0.479 -12.438 1.727 1.00 0.00 C -ATOM 4921 O THR 313 1.109 -11.753 0.896 1.00 0.00 O -ATOM 4922 N ARG 314 -0.824 -12.743 1.559 1.00 0.00 N -ATOM 4923 H ARG 314 -1.379 -13.143 2.303 1.00 0.00 H -ATOM 4924 CA ARG 314 -1.515 -12.665 0.188 1.00 0.00 C -ATOM 4925 HA ARG 314 -0.975 -13.236 -0.568 1.00 0.00 H -ATOM 4926 CB ARG 314 -2.916 -13.304 0.338 1.00 0.00 C -ATOM 4927 HB2 ARG 314 -3.575 -12.704 0.965 1.00 0.00 H -ATOM 4928 HB3 ARG 314 -3.289 -13.372 -0.684 1.00 0.00 H -ATOM 4929 CG ARG 314 -2.803 -14.644 0.982 1.00 0.00 C -ATOM 4930 HG2 ARG 314 -2.012 -15.220 0.504 1.00 0.00 H -ATOM 4931 HG3 ARG 314 -2.487 -14.595 2.024 1.00 0.00 H -ATOM 4932 CD ARG 314 -4.207 -15.266 0.964 1.00 0.00 C -ATOM 4933 HD2 ARG 314 -4.809 -14.673 1.654 1.00 0.00 H -ATOM 4934 HD3 ARG 314 -4.640 -15.083 -0.018 1.00 0.00 H -ATOM 4935 NE ARG 314 -4.101 -16.712 1.214 1.00 0.00 N -ATOM 4936 HE ARG 314 -3.225 -17.030 1.603 1.00 0.00 H -ATOM 4937 CZ ARG 314 -4.872 -17.663 0.751 1.00 0.00 C -ATOM 4938 NH1 ARG 314 -6.091 -17.417 0.262 1.00 0.00 N -ATOM 4939 HH11 ARG 314 -6.339 -16.438 0.220 1.00 0.00 H -ATOM 4940 HH12 ARG 314 -6.712 -18.126 -0.098 1.00 0.00 H -ATOM 4941 NH2 ARG 314 -4.540 -18.955 0.960 1.00 0.00 N -ATOM 4942 HH21 ARG 314 -3.662 -19.213 1.388 1.00 0.00 H -ATOM 4943 HH22 ARG 314 -5.061 -19.614 0.399 1.00 0.00 H -ATOM 4944 C ARG 314 -1.519 -11.159 -0.226 1.00 0.00 C -ATOM 4945 O ARG 314 -2.065 -10.301 0.439 1.00 0.00 O -ATOM 4946 N THR 315 -0.747 -10.820 -1.267 1.00 0.00 N -ATOM 4947 H THR 315 -0.297 -11.606 -1.716 1.00 0.00 H -ATOM 4948 CA THR 315 -0.391 -9.433 -1.697 1.00 0.00 C -ATOM 4949 HA THR 315 -0.769 -8.732 -0.953 1.00 0.00 H -ATOM 4950 CB THR 315 1.202 -9.377 -1.758 1.00 0.00 C -ATOM 4951 HB THR 315 1.606 -10.281 -2.212 1.00 0.00 H -ATOM 4952 CG2 THR 315 1.698 -8.191 -2.661 1.00 0.00 C -ATOM 4953 HG21 THR 315 1.567 -8.264 -3.741 1.00 0.00 H -ATOM 4954 HG22 THR 315 1.150 -7.283 -2.405 1.00 0.00 H -ATOM 4955 HG23 THR 315 2.778 -8.059 -2.601 1.00 0.00 H -ATOM 4956 OG1 THR 315 1.789 -9.368 -0.463 1.00 0.00 O -ATOM 4957 HG1 THR 315 1.308 -9.979 0.101 1.00 0.00 H -ATOM 4958 C THR 315 -1.024 -9.043 -3.019 1.00 0.00 C -ATOM 4959 O THR 315 -1.067 -9.732 -4.008 1.00 0.00 O -ATOM 4960 N SER 316 -1.531 -7.750 -3.036 1.00 0.00 N -ATOM 4961 H SER 316 -1.546 -7.278 -2.143 1.00 0.00 H -ATOM 4962 CA SER 316 -2.010 -7.046 -4.231 1.00 0.00 C -ATOM 4963 HA SER 316 -1.768 -7.633 -5.116 1.00 0.00 H -ATOM 4964 CB SER 316 -3.466 -6.940 -4.191 1.00 0.00 C -ATOM 4965 HB2 SER 316 -3.954 -7.913 -4.153 1.00 0.00 H -ATOM 4966 HB3 SER 316 -3.657 -6.347 -3.296 1.00 0.00 H -ATOM 4967 OG SER 316 -3.871 -6.302 -5.401 1.00 0.00 O -ATOM 4968 HG SER 316 -4.830 -6.281 -5.434 1.00 0.00 H -ATOM 4969 C SER 316 -1.264 -5.657 -4.427 1.00 0.00 C -ATOM 4970 O SER 316 -0.805 -5.135 -3.403 1.00 0.00 O -ATOM 4971 N ILE 317 -1.098 -5.141 -5.634 1.00 0.00 N -ATOM 4972 H ILE 317 -1.464 -5.742 -6.358 1.00 0.00 H -ATOM 4973 CA ILE 317 -0.507 -3.842 -5.932 1.00 0.00 C -ATOM 4974 HA ILE 317 -0.374 -3.282 -5.008 1.00 0.00 H -ATOM 4975 CB ILE 317 0.844 -3.880 -6.749 1.00 0.00 C -ATOM 4976 HB ILE 317 0.739 -4.459 -7.667 1.00 0.00 H -ATOM 4977 CG2 ILE 317 1.409 -2.413 -7.092 1.00 0.00 C -ATOM 4978 HG21 ILE 317 0.703 -1.870 -7.723 1.00 0.00 H -ATOM 4979 HG22 ILE 317 1.516 -1.793 -6.203 1.00 0.00 H -ATOM 4980 HG23 ILE 317 2.353 -2.583 -7.610 1.00 0.00 H -ATOM 4981 CG1 ILE 317 1.984 -4.630 -6.036 1.00 0.00 C -ATOM 4982 HG12 ILE 317 2.543 -3.932 -5.415 1.00 0.00 H -ATOM 4983 HG13 ILE 317 1.567 -5.373 -5.354 1.00 0.00 H -ATOM 4984 CD1 ILE 317 2.940 -5.489 -6.929 1.00 0.00 C -ATOM 4985 HD11 ILE 317 3.863 -5.755 -6.413 1.00 0.00 H -ATOM 4986 HD12 ILE 317 2.502 -6.373 -7.395 1.00 0.00 H -ATOM 4987 HD13 ILE 317 3.286 -4.827 -7.721 1.00 0.00 H -ATOM 4988 C ILE 317 -1.507 -3.058 -6.725 1.00 0.00 C -ATOM 4989 O ILE 317 -1.860 -3.408 -7.879 1.00 0.00 O -ATOM 4990 N ILE 318 -1.869 -1.905 -6.136 1.00 0.00 N -ATOM 4991 H ILE 318 -1.661 -1.768 -5.157 1.00 0.00 H -ATOM 4992 CA ILE 318 -2.557 -0.860 -6.854 1.00 0.00 C -ATOM 4993 HA ILE 318 -3.265 -1.318 -7.545 1.00 0.00 H -ATOM 4994 CB ILE 318 -3.486 -0.026 -5.908 1.00 0.00 C -ATOM 4995 HB ILE 318 -2.885 0.294 -5.056 1.00 0.00 H -ATOM 4996 CG2 ILE 318 -4.178 1.096 -6.607 1.00 0.00 C -ATOM 4997 HG21 ILE 318 -3.467 1.617 -7.249 1.00 0.00 H -ATOM 4998 HG22 ILE 318 -4.846 0.713 -7.380 1.00 0.00 H -ATOM 4999 HG23 ILE 318 -4.786 1.740 -5.974 1.00 0.00 H -ATOM 5000 CG1 ILE 318 -4.506 -1.030 -5.305 1.00 0.00 C -ATOM 5001 HG12 ILE 318 -5.221 -1.278 -6.089 1.00 0.00 H -ATOM 5002 HG13 ILE 318 -4.062 -1.961 -4.949 1.00 0.00 H -ATOM 5003 CD1 ILE 318 -5.380 -0.484 -4.177 1.00 0.00 C -ATOM 5004 HD11 ILE 318 -4.716 -0.007 -3.455 1.00 0.00 H -ATOM 5005 HD12 ILE 318 -6.044 0.286 -4.569 1.00 0.00 H -ATOM 5006 HD13 ILE 318 -5.877 -1.339 -3.718 1.00 0.00 H -ATOM 5007 C ILE 318 -1.483 0.059 -7.514 1.00 0.00 C -ATOM 5008 O ILE 318 -0.773 0.760 -6.810 1.00 0.00 O -ATOM 5009 N ALA 319 -1.342 0.011 -8.788 1.00 0.00 N -ATOM 5010 H ALA 319 -1.755 -0.810 -9.206 1.00 0.00 H -ATOM 5011 CA ALA 319 -0.439 0.851 -9.541 1.00 0.00 C -ATOM 5012 HA ALA 319 0.463 0.992 -8.945 1.00 0.00 H -ATOM 5013 CB ALA 319 0.041 -0.014 -10.715 1.00 0.00 C -ATOM 5014 HB1 ALA 319 0.714 -0.780 -10.331 1.00 0.00 H -ATOM 5015 HB2 ALA 319 -0.780 -0.416 -11.309 1.00 0.00 H -ATOM 5016 HB3 ALA 319 0.593 0.624 -11.404 1.00 0.00 H -ATOM 5017 C ALA 319 -1.263 2.178 -9.857 1.00 0.00 C -ATOM 5018 O ALA 319 -2.088 2.211 -10.774 1.00 0.00 O -ATOM 5019 N THR 320 -0.958 3.273 -9.150 1.00 0.00 N -ATOM 5020 H THR 320 -0.130 3.299 -8.573 1.00 0.00 H -ATOM 5021 CA THR 320 -1.582 4.588 -9.427 1.00 0.00 C -ATOM 5022 HA THR 320 -2.550 4.288 -9.829 1.00 0.00 H -ATOM 5023 CB THR 320 -1.916 5.462 -8.146 1.00 0.00 C -ATOM 5024 HB THR 320 -2.280 6.441 -8.459 1.00 0.00 H -ATOM 5025 CG2 THR 320 -3.136 4.915 -7.351 1.00 0.00 C -ATOM 5026 HG21 THR 320 -2.987 3.887 -7.020 1.00 0.00 H -ATOM 5027 HG22 THR 320 -3.207 5.482 -6.424 1.00 0.00 H -ATOM 5028 HG23 THR 320 -4.034 4.837 -7.963 1.00 0.00 H -ATOM 5029 OG1 THR 320 -0.817 5.629 -7.291 1.00 0.00 O -ATOM 5030 HG1 THR 320 -0.274 6.279 -7.743 1.00 0.00 H -ATOM 5031 C THR 320 -0.805 5.374 -10.473 1.00 0.00 C -ATOM 5032 O THR 320 0.389 5.568 -10.342 1.00 0.00 O -ATOM 5033 N ILE 321 -1.491 5.854 -11.507 1.00 0.00 N -ATOM 5034 H ILE 321 -2.461 5.621 -11.662 1.00 0.00 H -ATOM 5035 CA ILE 321 -0.850 6.467 -12.707 1.00 0.00 C -ATOM 5036 HA ILE 321 0.181 6.734 -12.474 1.00 0.00 H -ATOM 5037 CB ILE 321 -0.826 5.480 -13.913 1.00 0.00 C -ATOM 5038 HB ILE 321 -0.424 5.985 -14.792 1.00 0.00 H -ATOM 5039 CG2 ILE 321 0.148 4.445 -13.484 1.00 0.00 C -ATOM 5040 HG21 ILE 321 1.094 4.937 -13.257 1.00 0.00 H -ATOM 5041 HG22 ILE 321 -0.225 3.816 -12.675 1.00 0.00 H -ATOM 5042 HG23 ILE 321 0.287 3.714 -14.281 1.00 0.00 H -ATOM 5043 CG1 ILE 321 -2.208 4.970 -14.370 1.00 0.00 C -ATOM 5044 HG12 ILE 321 -2.389 4.101 -13.738 1.00 0.00 H -ATOM 5045 HG13 ILE 321 -3.003 5.700 -14.218 1.00 0.00 H -ATOM 5046 CD1 ILE 321 -2.176 4.580 -15.862 1.00 0.00 C -ATOM 5047 HD11 ILE 321 -2.959 3.872 -16.131 1.00 0.00 H -ATOM 5048 HD12 ILE 321 -2.223 5.426 -16.548 1.00 0.00 H -ATOM 5049 HD13 ILE 321 -1.228 4.095 -16.090 1.00 0.00 H -ATOM 5050 C ILE 321 -1.618 7.759 -13.143 1.00 0.00 C -ATOM 5051 O ILE 321 -2.815 7.812 -12.894 1.00 0.00 O -ATOM 5052 N SER 322 -0.896 8.749 -13.735 1.00 0.00 N -ATOM 5053 H SER 322 0.108 8.673 -13.813 1.00 0.00 H -ATOM 5054 CA SER 322 -1.462 9.845 -14.606 1.00 0.00 C -ATOM 5055 HA SER 322 -2.221 10.394 -14.051 1.00 0.00 H -ATOM 5056 CB SER 322 -0.295 10.776 -14.947 1.00 0.00 C -ATOM 5057 HB2 SER 322 -0.004 11.379 -14.087 1.00 0.00 H -ATOM 5058 HB3 SER 322 0.497 10.083 -15.232 1.00 0.00 H -ATOM 5059 OG SER 322 -0.504 11.656 -16.032 1.00 0.00 O -ATOM 5060 HG SER 322 -0.487 12.526 -15.627 1.00 0.00 H -ATOM 5061 C SER 322 -2.143 9.437 -15.982 1.00 0.00 C -ATOM 5062 O SER 322 -1.652 8.493 -16.630 1.00 0.00 O -ATOM 5063 N PRO 323 -3.141 10.130 -16.538 1.00 0.00 N -ATOM 5064 CD PRO 323 -3.875 11.178 -15.822 1.00 0.00 C -ATOM 5065 HD2 PRO 323 -3.171 11.957 -15.533 1.00 0.00 H -ATOM 5066 HD3 PRO 323 -4.412 10.751 -14.974 1.00 0.00 H -ATOM 5067 CG PRO 323 -4.861 11.765 -16.748 1.00 0.00 C -ATOM 5068 HG2 PRO 323 -4.539 12.643 -17.309 1.00 0.00 H -ATOM 5069 HG3 PRO 323 -5.762 12.049 -16.203 1.00 0.00 H -ATOM 5070 CB PRO 323 -5.121 10.630 -17.768 1.00 0.00 C -ATOM 5071 HB2 PRO 323 -5.670 10.918 -18.665 1.00 0.00 H -ATOM 5072 HB3 PRO 323 -5.715 9.848 -17.297 1.00 0.00 H -ATOM 5073 CA PRO 323 -3.794 9.959 -17.910 1.00 0.00 C -ATOM 5074 HA PRO 323 -3.991 8.920 -18.176 1.00 0.00 H -ATOM 5075 C PRO 323 -3.046 10.559 -19.134 1.00 0.00 C -ATOM 5076 O PRO 323 -3.395 10.289 -20.228 1.00 0.00 O -ATOM 5077 N ALA 324 -2.119 11.541 -18.814 1.00 0.00 N -ATOM 5078 H ALA 324 -1.935 11.610 -17.823 1.00 0.00 H -ATOM 5079 CA ALA 324 -1.753 12.770 -19.609 1.00 0.00 C -ATOM 5080 HA ALA 324 -2.422 12.795 -20.468 1.00 0.00 H -ATOM 5081 CB ALA 324 -1.947 14.089 -18.900 1.00 0.00 C -ATOM 5082 HB1 ALA 324 -1.172 14.329 -18.172 1.00 0.00 H -ATOM 5083 HB2 ALA 324 -1.975 14.850 -19.681 1.00 0.00 H -ATOM 5084 HB3 ALA 324 -2.928 14.134 -18.428 1.00 0.00 H -ATOM 5085 C ALA 324 -0.349 12.626 -20.204 1.00 0.00 C -ATOM 5086 O ALA 324 0.613 12.123 -19.536 1.00 0.00 O -ATOM 5087 N SER 325 -0.132 13.275 -21.326 1.00 0.00 N -ATOM 5088 H SER 325 -0.959 13.682 -21.741 1.00 0.00 H -ATOM 5089 CA SER 325 1.132 13.283 -22.071 1.00 0.00 C -ATOM 5090 HA SER 325 1.424 12.261 -22.314 1.00 0.00 H -ATOM 5091 CB SER 325 0.744 14.072 -23.338 1.00 0.00 C -ATOM 5092 HB2 SER 325 1.535 14.010 -24.085 1.00 0.00 H -ATOM 5093 HB3 SER 325 -0.083 13.541 -23.810 1.00 0.00 H -ATOM 5094 OG SER 325 0.371 15.389 -23.078 1.00 0.00 O -ATOM 5095 HG SER 325 1.086 16.003 -23.263 1.00 0.00 H -ATOM 5096 C SER 325 2.345 13.890 -21.417 1.00 0.00 C -ATOM 5097 O SER 325 3.441 13.611 -21.785 1.00 0.00 O -ATOM 5098 N LEU 326 2.095 14.661 -20.352 1.00 0.00 N -ATOM 5099 H LEU 326 1.101 14.832 -20.290 1.00 0.00 H -ATOM 5100 CA LEU 326 3.131 15.146 -19.492 1.00 0.00 C -ATOM 5101 HA LEU 326 3.812 15.679 -20.155 1.00 0.00 H -ATOM 5102 CB LEU 326 2.612 16.089 -18.389 1.00 0.00 C -ATOM 5103 HB2 LEU 326 2.175 16.863 -19.020 1.00 0.00 H -ATOM 5104 HB3 LEU 326 1.981 15.468 -17.753 1.00 0.00 H -ATOM 5105 CG LEU 326 3.702 16.811 -17.521 1.00 0.00 C -ATOM 5106 HG LEU 326 4.368 16.198 -16.913 1.00 0.00 H -ATOM 5107 CD1 LEU 326 4.628 17.741 -18.288 1.00 0.00 C -ATOM 5108 HD11 LEU 326 5.091 17.190 -19.108 1.00 0.00 H -ATOM 5109 HD12 LEU 326 4.125 18.571 -18.785 1.00 0.00 H -ATOM 5110 HD13 LEU 326 5.406 18.171 -17.658 1.00 0.00 H -ATOM 5111 CD2 LEU 326 2.960 17.638 -16.508 1.00 0.00 C -ATOM 5112 HD21 LEU 326 2.278 16.998 -15.948 1.00 0.00 H -ATOM 5113 HD22 LEU 326 3.652 18.150 -15.838 1.00 0.00 H -ATOM 5114 HD23 LEU 326 2.355 18.436 -16.938 1.00 0.00 H -ATOM 5115 C LEU 326 3.940 14.055 -18.846 1.00 0.00 C -ATOM 5116 O LEU 326 5.141 14.114 -18.732 1.00 0.00 O -ATOM 5117 N ASN 327 3.322 12.928 -18.477 1.00 0.00 N -ATOM 5118 H ASN 327 2.350 12.834 -18.732 1.00 0.00 H -ATOM 5119 CA ASN 327 3.851 11.923 -17.568 1.00 0.00 C -ATOM 5120 HA ASN 327 4.867 12.110 -17.220 1.00 0.00 H -ATOM 5121 CB ASN 327 2.939 12.020 -16.298 1.00 0.00 C -ATOM 5122 HB2 ASN 327 1.928 11.860 -16.672 1.00 0.00 H -ATOM 5123 HB3 ASN 327 3.026 11.166 -15.627 1.00 0.00 H -ATOM 5124 CG ASN 327 3.239 13.282 -15.407 1.00 0.00 C -ATOM 5125 OD1 ASN 327 4.401 13.538 -15.071 1.00 0.00 O -ATOM 5126 ND2 ASN 327 2.290 14.034 -15.026 1.00 0.00 N -ATOM 5127 HD21 ASN 327 2.497 14.625 -14.233 1.00 0.00 H -ATOM 5128 HD22 ASN 327 1.320 13.906 -15.278 1.00 0.00 H -ATOM 5129 C ASN 327 3.906 10.461 -18.169 1.00 0.00 C -ATOM 5130 O ASN 327 4.062 9.509 -17.427 1.00 0.00 O -ATOM 5131 N LEU 328 3.847 10.367 -19.518 1.00 0.00 N -ATOM 5132 H LEU 328 3.896 11.292 -19.922 1.00 0.00 H -ATOM 5133 CA LEU 328 3.898 9.089 -20.364 1.00 0.00 C -ATOM 5134 HA LEU 328 2.935 8.615 -20.175 1.00 0.00 H -ATOM 5135 CB LEU 328 3.940 9.553 -21.799 1.00 0.00 C -ATOM 5136 HB2 LEU 328 3.087 10.126 -22.165 1.00 0.00 H -ATOM 5137 HB3 LEU 328 4.836 10.168 -21.887 1.00 0.00 H -ATOM 5138 CG LEU 328 4.109 8.312 -22.743 1.00 0.00 C -ATOM 5139 HG LEU 328 5.019 7.780 -22.465 1.00 0.00 H -ATOM 5140 CD1 LEU 328 2.964 7.296 -22.752 1.00 0.00 C -ATOM 5141 HD11 LEU 328 2.682 7.075 -21.723 1.00 0.00 H -ATOM 5142 HD12 LEU 328 2.050 7.730 -23.155 1.00 0.00 H -ATOM 5143 HD13 LEU 328 3.134 6.403 -23.351 1.00 0.00 H -ATOM 5144 CD2 LEU 328 4.259 8.717 -24.208 1.00 0.00 C -ATOM 5145 HD21 LEU 328 3.364 9.211 -24.583 1.00 0.00 H -ATOM 5146 HD22 LEU 328 5.163 9.271 -24.462 1.00 0.00 H -ATOM 5147 HD23 LEU 328 4.356 7.811 -24.808 1.00 0.00 H -ATOM 5148 C LEU 328 5.102 8.230 -19.834 1.00 0.00 C -ATOM 5149 O LEU 328 4.906 7.044 -19.657 1.00 0.00 O -ATOM 5150 N GLU 329 6.252 8.872 -19.579 1.00 0.00 N -ATOM 5151 H GLU 329 6.320 9.856 -19.796 1.00 0.00 H -ATOM 5152 CA GLU 329 7.556 8.158 -19.303 1.00 0.00 C -ATOM 5153 HA GLU 329 7.731 7.348 -20.013 1.00 0.00 H -ATOM 5154 CB GLU 329 8.678 9.193 -19.567 1.00 0.00 C -ATOM 5155 HB2 GLU 329 8.661 9.320 -20.649 1.00 0.00 H -ATOM 5156 HB3 GLU 329 8.637 10.107 -18.974 1.00 0.00 H -ATOM 5157 CG GLU 329 10.103 8.722 -19.190 1.00 0.00 C -ATOM 5158 HG2 GLU 329 10.678 9.544 -18.763 1.00 0.00 H -ATOM 5159 HG3 GLU 329 10.050 7.924 -18.451 1.00 0.00 H -ATOM 5160 CD GLU 329 10.829 8.194 -20.480 1.00 0.00 C -ATOM 5161 OE1 GLU 329 12.039 8.482 -20.663 1.00 0.00 O -ATOM 5162 OE2 GLU 329 10.275 7.345 -21.275 1.00 0.00 O -ATOM 5163 C GLU 329 7.599 7.541 -17.926 1.00 0.00 C -ATOM 5164 O GLU 329 8.184 6.474 -17.726 1.00 0.00 O -ATOM 5165 N GLU 330 6.920 8.190 -16.919 1.00 0.00 N -ATOM 5166 H GLU 330 6.379 8.992 -17.207 1.00 0.00 H -ATOM 5167 CA GLU 330 6.686 7.594 -15.588 1.00 0.00 C -ATOM 5168 HA GLU 330 7.558 6.980 -15.364 1.00 0.00 H -ATOM 5169 CB GLU 330 6.697 8.616 -14.476 1.00 0.00 C -ATOM 5170 HB2 GLU 330 5.861 9.304 -14.588 1.00 0.00 H -ATOM 5171 HB3 GLU 330 6.520 8.081 -13.542 1.00 0.00 H -ATOM 5172 CG GLU 330 7.976 9.436 -14.411 1.00 0.00 C -ATOM 5173 HG2 GLU 330 8.214 9.912 -15.362 1.00 0.00 H -ATOM 5174 HG3 GLU 330 7.865 10.272 -13.721 1.00 0.00 H -ATOM 5175 CD GLU 330 9.263 8.707 -13.993 1.00 0.00 C -ATOM 5176 OE1 GLU 330 10.341 9.323 -13.879 1.00 0.00 O -ATOM 5177 OE2 GLU 330 9.206 7.510 -13.715 1.00 0.00 O -ATOM 5178 C GLU 330 5.607 6.549 -15.551 1.00 0.00 C -ATOM 5179 O GLU 330 5.762 5.428 -15.026 1.00 0.00 O -ATOM 5180 N THR 331 4.491 6.937 -16.159 1.00 0.00 N -ATOM 5181 H THR 331 4.384 7.894 -16.465 1.00 0.00 H -ATOM 5182 CA THR 331 3.272 6.078 -16.430 1.00 0.00 C -ATOM 5183 HA THR 331 2.850 5.763 -15.474 1.00 0.00 H -ATOM 5184 CB THR 331 2.233 6.909 -17.169 1.00 0.00 C -ATOM 5185 HB THR 331 2.665 7.486 -17.987 1.00 0.00 H -ATOM 5186 CG2 THR 331 1.015 6.022 -17.476 1.00 0.00 C -ATOM 5187 HG21 THR 331 0.103 6.596 -17.640 1.00 0.00 H -ATOM 5188 HG22 THR 331 1.227 5.442 -18.373 1.00 0.00 H -ATOM 5189 HG23 THR 331 0.900 5.287 -16.679 1.00 0.00 H -ATOM 5190 OG1 THR 331 1.722 7.792 -16.275 1.00 0.00 O -ATOM 5191 HG1 THR 331 1.176 8.370 -16.812 1.00 0.00 H -ATOM 5192 C THR 331 3.769 4.800 -17.037 1.00 0.00 C -ATOM 5193 O THR 331 3.448 3.783 -16.532 1.00 0.00 O -ATOM 5194 N LEU 332 4.671 4.847 -18.032 1.00 0.00 N -ATOM 5195 H LEU 332 4.894 5.753 -18.421 1.00 0.00 H -ATOM 5196 CA LEU 332 5.155 3.600 -18.734 1.00 0.00 C -ATOM 5197 HA LEU 332 4.276 2.976 -18.901 1.00 0.00 H -ATOM 5198 CB LEU 332 5.874 3.945 -20.058 1.00 0.00 C -ATOM 5199 HB2 LEU 332 6.476 4.824 -19.828 1.00 0.00 H -ATOM 5200 HB3 LEU 332 6.601 3.205 -20.394 1.00 0.00 H -ATOM 5201 CG LEU 332 4.959 4.347 -21.261 1.00 0.00 C -ATOM 5202 HG LEU 332 4.197 5.070 -20.969 1.00 0.00 H -ATOM 5203 CD1 LEU 332 5.914 4.871 -22.406 1.00 0.00 C -ATOM 5204 HD11 LEU 332 6.709 5.454 -21.942 1.00 0.00 H -ATOM 5205 HD12 LEU 332 6.303 3.977 -22.893 1.00 0.00 H -ATOM 5206 HD13 LEU 332 5.453 5.512 -23.157 1.00 0.00 H -ATOM 5207 CD2 LEU 332 4.123 3.197 -21.733 1.00 0.00 C -ATOM 5208 HD21 LEU 332 3.685 3.563 -22.662 1.00 0.00 H -ATOM 5209 HD22 LEU 332 4.740 2.334 -21.979 1.00 0.00 H -ATOM 5210 HD23 LEU 332 3.321 2.964 -21.032 1.00 0.00 H -ATOM 5211 C LEU 332 6.078 2.876 -17.752 1.00 0.00 C -ATOM 5212 O LEU 332 6.310 1.646 -17.929 1.00 0.00 O -ATOM 5213 N SER 333 6.726 3.549 -16.825 1.00 0.00 N -ATOM 5214 H SER 333 6.534 4.535 -16.720 1.00 0.00 H -ATOM 5215 CA SER 333 7.662 2.845 -15.965 1.00 0.00 C -ATOM 5216 HA SER 333 8.262 2.088 -16.470 1.00 0.00 H -ATOM 5217 CB SER 333 8.647 3.888 -15.395 1.00 0.00 C -ATOM 5218 HB2 SER 333 8.892 4.490 -16.271 1.00 0.00 H -ATOM 5219 HB3 SER 333 8.146 4.487 -14.635 1.00 0.00 H -ATOM 5220 OG SER 333 9.732 3.130 -14.885 1.00 0.00 O -ATOM 5221 HG SER 333 9.465 2.910 -13.990 1.00 0.00 H -ATOM 5222 C SER 333 6.971 2.107 -14.891 1.00 0.00 C -ATOM 5223 O SER 333 7.304 0.966 -14.532 1.00 0.00 O -ATOM 5224 N THR 334 5.951 2.707 -14.251 1.00 0.00 N -ATOM 5225 H THR 334 5.712 3.604 -14.647 1.00 0.00 H -ATOM 5226 CA THR 334 5.013 2.077 -13.331 1.00 0.00 C -ATOM 5227 HA THR 334 5.540 1.588 -12.513 1.00 0.00 H -ATOM 5228 CB THR 334 4.034 3.085 -12.834 1.00 0.00 C -ATOM 5229 HB THR 334 3.656 3.673 -13.669 1.00 0.00 H -ATOM 5230 CG2 THR 334 2.796 2.556 -12.149 1.00 0.00 C -ATOM 5231 HG21 THR 334 2.109 2.168 -12.902 1.00 0.00 H -ATOM 5232 HG22 THR 334 3.142 1.752 -11.499 1.00 0.00 H -ATOM 5233 HG23 THR 334 2.280 3.406 -11.700 1.00 0.00 H -ATOM 5234 OG1 THR 334 4.733 3.880 -11.892 1.00 0.00 O -ATOM 5235 HG1 THR 334 4.253 4.712 -11.860 1.00 0.00 H -ATOM 5236 C THR 334 4.234 0.929 -14.046 1.00 0.00 C -ATOM 5237 O THR 334 4.314 -0.161 -13.527 1.00 0.00 O -ATOM 5238 N LEU 335 3.712 1.187 -15.230 1.00 0.00 N -ATOM 5239 H LEU 335 4.025 2.053 -15.643 1.00 0.00 H -ATOM 5240 CA LEU 335 3.223 0.069 -16.052 1.00 0.00 C -ATOM 5241 HA LEU 335 2.396 -0.349 -15.478 1.00 0.00 H -ATOM 5242 CB LEU 335 2.650 0.490 -17.399 1.00 0.00 C -ATOM 5243 HB2 LEU 335 3.395 1.065 -17.950 1.00 0.00 H -ATOM 5244 HB3 LEU 335 2.548 -0.386 -18.040 1.00 0.00 H -ATOM 5245 CG LEU 335 1.315 1.254 -17.373 1.00 0.00 C -ATOM 5246 HG LEU 335 1.394 1.998 -16.580 1.00 0.00 H -ATOM 5247 CD1 LEU 335 0.957 1.915 -18.750 1.00 0.00 C -ATOM 5248 HD11 LEU 335 1.756 2.629 -18.949 1.00 0.00 H -ATOM 5249 HD12 LEU 335 0.872 1.136 -19.507 1.00 0.00 H -ATOM 5250 HD13 LEU 335 0.006 2.446 -18.749 1.00 0.00 H -ATOM 5251 CD2 LEU 335 0.225 0.386 -17.071 1.00 0.00 C -ATOM 5252 HD21 LEU 335 0.208 -0.466 -17.751 1.00 0.00 H -ATOM 5253 HD22 LEU 335 0.397 -0.001 -16.067 1.00 0.00 H -ATOM 5254 HD23 LEU 335 -0.747 0.875 -17.012 1.00 0.00 H -ATOM 5255 C LEU 335 4.207 -1.045 -16.274 1.00 0.00 C -ATOM 5256 O LEU 335 3.767 -2.178 -16.258 1.00 0.00 O -ATOM 5257 N GLU 336 5.513 -0.791 -16.476 1.00 0.00 N -ATOM 5258 H GLU 336 5.826 0.166 -16.544 1.00 0.00 H -ATOM 5259 CA GLU 336 6.572 -1.828 -16.656 1.00 0.00 C -ATOM 5260 HA GLU 336 6.067 -2.655 -17.158 1.00 0.00 H -ATOM 5261 CB GLU 336 7.809 -1.341 -17.496 1.00 0.00 C -ATOM 5262 HB2 GLU 336 8.245 -0.398 -17.168 1.00 0.00 H -ATOM 5263 HB3 GLU 336 8.601 -2.085 -17.410 1.00 0.00 H -ATOM 5264 CG GLU 336 7.406 -1.159 -18.989 1.00 0.00 C -ATOM 5265 HG2 GLU 336 6.499 -0.555 -18.986 1.00 0.00 H -ATOM 5266 HG3 GLU 336 8.222 -0.637 -19.491 1.00 0.00 H -ATOM 5267 CD GLU 336 7.160 -2.481 -19.755 1.00 0.00 C -ATOM 5268 OE1 GLU 336 7.406 -3.544 -19.159 1.00 0.00 O -ATOM 5269 OE2 GLU 336 6.902 -2.452 -20.975 1.00 0.00 O -ATOM 5270 C GLU 336 6.948 -2.490 -15.304 1.00 0.00 C -ATOM 5271 O GLU 336 7.382 -3.668 -15.340 1.00 0.00 O -ATOM 5272 N TYR 337 6.716 -1.835 -14.125 1.00 0.00 N -ATOM 5273 H TYR 337 6.437 -0.864 -14.147 1.00 0.00 H -ATOM 5274 CA TYR 337 7.096 -2.427 -12.878 1.00 0.00 C -ATOM 5275 HA TYR 337 7.991 -3.015 -13.085 1.00 0.00 H -ATOM 5276 CB TYR 337 7.462 -1.335 -11.902 1.00 0.00 C -ATOM 5277 HB2 TYR 337 8.203 -0.684 -12.367 1.00 0.00 H -ATOM 5278 HB3 TYR 337 6.560 -0.746 -11.740 1.00 0.00 H -ATOM 5279 CG TYR 337 7.954 -1.879 -10.601 1.00 0.00 C -ATOM 5280 CD1 TYR 337 7.024 -2.069 -9.603 1.00 0.00 C -ATOM 5281 HD1 TYR 337 5.978 -1.818 -9.708 1.00 0.00 H -ATOM 5282 CE1 TYR 337 7.359 -2.639 -8.337 1.00 0.00 C -ATOM 5283 HE1 TYR 337 6.635 -2.755 -7.544 1.00 0.00 H -ATOM 5284 CZ TYR 337 8.677 -2.901 -8.094 1.00 0.00 C -ATOM 5285 OH TYR 337 8.938 -3.182 -6.793 1.00 0.00 O -ATOM 5286 HH TYR 337 9.861 -3.377 -6.612 1.00 0.00 H -ATOM 5287 CE2 TYR 337 9.687 -2.691 -9.135 1.00 0.00 C -ATOM 5288 HE2 TYR 337 10.719 -2.884 -8.883 1.00 0.00 H -ATOM 5289 CD2 TYR 337 9.266 -2.228 -10.406 1.00 0.00 C -ATOM 5290 HD2 TYR 337 10.065 -2.133 -11.124 1.00 0.00 H -ATOM 5291 C TYR 337 5.976 -3.306 -12.392 1.00 0.00 C -ATOM 5292 O TYR 337 6.253 -4.467 -12.079 1.00 0.00 O -ATOM 5293 N ALA 338 4.736 -2.875 -12.487 1.00 0.00 N -ATOM 5294 H ALA 338 4.592 -1.993 -12.958 1.00 0.00 H -ATOM 5295 CA ALA 338 3.523 -3.616 -12.293 1.00 0.00 C -ATOM 5296 HA ALA 338 3.476 -3.988 -11.270 1.00 0.00 H -ATOM 5297 CB ALA 338 2.418 -2.470 -12.422 1.00 0.00 C -ATOM 5298 HB1 ALA 338 2.405 -2.188 -13.475 1.00 0.00 H -ATOM 5299 HB2 ALA 338 1.417 -2.795 -12.139 1.00 0.00 H -ATOM 5300 HB3 ALA 338 2.674 -1.527 -11.937 1.00 0.00 H -ATOM 5301 C ALA 338 3.343 -4.764 -13.317 1.00 0.00 C -ATOM 5302 O ALA 338 3.029 -5.917 -12.957 1.00 0.00 O -ATOM 5303 N HIE 339 3.765 -4.595 -14.615 1.00 0.00 N -ATOM 5304 H HIE 339 3.964 -3.660 -14.942 1.00 0.00 H -ATOM 5305 CA HIE 339 3.868 -5.769 -15.616 1.00 0.00 C -ATOM 5306 HA HIE 339 2.991 -6.414 -15.606 1.00 0.00 H -ATOM 5307 CB HIE 339 4.017 -5.183 -17.014 1.00 0.00 C -ATOM 5308 HB2 HIE 339 3.244 -4.455 -17.266 1.00 0.00 H -ATOM 5309 HB3 HIE 339 4.918 -4.575 -16.937 1.00 0.00 H -ATOM 5310 CG HIE 339 4.081 -6.161 -18.164 1.00 0.00 C -ATOM 5311 ND1 HIE 339 3.048 -7.013 -18.458 1.00 0.00 N -ATOM 5312 CE1 HIE 339 3.410 -7.636 -19.574 1.00 0.00 C -ATOM 5313 HE1 HIE 339 2.731 -8.275 -20.119 1.00 0.00 H -ATOM 5314 NE2 HIE 339 4.575 -7.193 -19.967 1.00 0.00 N -ATOM 5315 HE2 HIE 339 4.831 -7.517 -20.888 1.00 0.00 H -ATOM 5316 CD2 HIE 339 5.059 -6.244 -19.131 1.00 0.00 C -ATOM 5317 HD2 HIE 339 5.948 -5.655 -19.304 1.00 0.00 H -ATOM 5318 C HIE 339 5.051 -6.753 -15.362 1.00 0.00 C -ATOM 5319 O HIE 339 5.027 -7.913 -15.818 1.00 0.00 O -ATOM 5320 N ARG 340 6.024 -6.416 -14.543 1.00 0.00 N -ATOM 5321 H ARG 340 6.186 -5.440 -14.338 1.00 0.00 H -ATOM 5322 CA ARG 340 7.029 -7.415 -14.108 1.00 0.00 C -ATOM 5323 HA ARG 340 7.220 -8.074 -14.954 1.00 0.00 H -ATOM 5324 CB ARG 340 8.359 -6.745 -13.800 1.00 0.00 C -ATOM 5325 HB2 ARG 340 8.340 -5.766 -14.278 1.00 0.00 H -ATOM 5326 HB3 ARG 340 8.384 -6.498 -12.739 1.00 0.00 H -ATOM 5327 CG ARG 340 9.679 -7.608 -14.116 1.00 0.00 C -ATOM 5328 HG2 ARG 340 9.686 -8.240 -13.229 1.00 0.00 H -ATOM 5329 HG3 ARG 340 9.607 -8.089 -15.091 1.00 0.00 H -ATOM 5330 CD ARG 340 10.924 -6.780 -14.154 1.00 0.00 C -ATOM 5331 HD2 ARG 340 10.972 -6.428 -13.124 1.00 0.00 H -ATOM 5332 HD3 ARG 340 11.782 -7.431 -14.319 1.00 0.00 H -ATOM 5333 NE ARG 340 10.794 -5.589 -15.052 1.00 0.00 N -ATOM 5334 HE ARG 340 10.683 -4.733 -14.527 1.00 0.00 H -ATOM 5335 CZ ARG 340 10.734 -5.541 -16.340 1.00 0.00 C -ATOM 5336 NH1 ARG 340 10.877 -6.511 -17.149 1.00 0.00 N -ATOM 5337 HH11 ARG 340 10.954 -7.443 -16.764 1.00 0.00 H -ATOM 5338 HH12 ARG 340 10.819 -6.322 -18.139 1.00 0.00 H -ATOM 5339 NH2 ARG 340 10.662 -4.342 -16.917 1.00 0.00 N -ATOM 5340 HH21 ARG 340 10.728 -3.498 -16.366 1.00 0.00 H -ATOM 5341 HH22 ARG 340 10.375 -4.319 -17.885 1.00 0.00 H -ATOM 5342 C ARG 340 6.403 -8.163 -12.947 1.00 0.00 C -ATOM 5343 O ARG 340 6.277 -9.402 -12.943 1.00 0.00 O -ATOM 5344 N ALA 341 5.994 -7.405 -11.889 1.00 0.00 N -ATOM 5345 H ALA 341 6.009 -6.406 -12.035 1.00 0.00 H -ATOM 5346 CA ALA 341 5.743 -7.970 -10.615 1.00 0.00 C -ATOM 5347 HA ALA 341 6.596 -8.500 -10.191 1.00 0.00 H -ATOM 5348 CB ALA 341 5.535 -6.823 -9.691 1.00 0.00 C -ATOM 5349 HB1 ALA 341 4.722 -6.150 -9.966 1.00 0.00 H -ATOM 5350 HB2 ALA 341 5.317 -7.280 -8.726 1.00 0.00 H -ATOM 5351 HB3 ALA 341 6.446 -6.228 -9.627 1.00 0.00 H -ATOM 5352 C ALA 341 4.540 -8.996 -10.421 1.00 0.00 C -ATOM 5353 O ALA 341 4.484 -9.812 -9.454 1.00 0.00 O -ATOM 5354 N LYS 342 3.653 -9.016 -11.405 1.00 0.00 N -ATOM 5355 H LYS 342 3.843 -8.394 -12.178 1.00 0.00 H -ATOM 5356 CA LYS 342 2.389 -9.916 -11.375 1.00 0.00 C -ATOM 5357 HA LYS 342 1.909 -9.858 -10.399 1.00 0.00 H -ATOM 5358 CB LYS 342 1.608 -9.384 -12.550 1.00 0.00 C -ATOM 5359 HB2 LYS 342 0.577 -9.734 -12.495 1.00 0.00 H -ATOM 5360 HB3 LYS 342 1.526 -8.312 -12.377 1.00 0.00 H -ATOM 5361 CG LYS 342 2.251 -9.425 -13.961 1.00 0.00 C -ATOM 5362 HG2 LYS 342 3.118 -8.765 -13.953 1.00 0.00 H -ATOM 5363 HG3 LYS 342 2.567 -10.461 -14.083 1.00 0.00 H -ATOM 5364 CD LYS 342 1.270 -9.000 -15.082 1.00 0.00 C -ATOM 5365 HD2 LYS 342 0.977 -7.966 -14.897 1.00 0.00 H -ATOM 5366 HD3 LYS 342 1.799 -9.136 -16.025 1.00 0.00 H -ATOM 5367 CE LYS 342 0.103 -9.957 -15.220 1.00 0.00 C -ATOM 5368 HE2 LYS 342 0.457 -10.987 -15.262 1.00 0.00 H -ATOM 5369 HE3 LYS 342 -0.522 -9.840 -14.334 1.00 0.00 H -ATOM 5370 NZ LYS 342 -0.707 -9.793 -16.464 1.00 0.00 N -ATOM 5371 HZ1 LYS 342 -0.083 -9.662 -17.247 1.00 0.00 H -ATOM 5372 HZ2 LYS 342 -1.256 -10.573 -16.798 1.00 0.00 H -ATOM 5373 HZ3 LYS 342 -1.339 -9.009 -16.538 1.00 0.00 H -ATOM 5374 C LYS 342 2.743 -11.379 -11.688 1.00 0.00 C -ATOM 5375 O LYS 342 1.876 -12.231 -11.550 1.00 0.00 O -ATOM 5376 N ASN 343 3.965 -11.725 -12.136 1.00 0.00 N -ATOM 5377 H ASN 343 4.663 -11.006 -12.263 1.00 0.00 H -ATOM 5378 CA ASN 343 4.381 -13.082 -12.492 1.00 0.00 C -ATOM 5379 HA ASN 343 3.608 -13.550 -13.102 1.00 0.00 H -ATOM 5380 CB ASN 343 5.549 -12.930 -13.419 1.00 0.00 C -ATOM 5381 HB2 ASN 343 6.359 -12.306 -13.043 1.00 0.00 H -ATOM 5382 HB3 ASN 343 6.039 -13.881 -13.627 1.00 0.00 H -ATOM 5383 CG ASN 343 5.069 -12.376 -14.708 1.00 0.00 C -ATOM 5384 OD1 ASN 343 4.829 -13.140 -15.601 1.00 0.00 O -ATOM 5385 ND2 ASN 343 5.189 -11.072 -14.924 1.00 0.00 N -ATOM 5386 HD21 ASN 343 5.100 -10.699 -15.858 1.00 0.00 H -ATOM 5387 HD22 ASN 343 5.637 -10.442 -14.273 1.00 0.00 H -ATOM 5388 C ASN 343 4.774 -13.894 -11.254 1.00 0.00 C -ATOM 5389 O ASN 343 4.344 -15.050 -11.099 1.00 0.00 O -ATOM 5390 N ILE 344 5.159 -13.218 -10.197 1.00 0.00 N -ATOM 5391 H ILE 344 5.365 -12.238 -10.321 1.00 0.00 H -ATOM 5392 CA ILE 344 5.436 -13.703 -8.878 1.00 0.00 C -ATOM 5393 HA ILE 344 6.160 -14.517 -8.892 1.00 0.00 H -ATOM 5394 CB ILE 344 5.997 -12.480 -8.095 1.00 0.00 C -ATOM 5395 HB ILE 344 5.224 -11.742 -7.883 1.00 0.00 H -ATOM 5396 CG2 ILE 344 6.612 -12.821 -6.761 1.00 0.00 C -ATOM 5397 HG21 ILE 344 5.956 -13.431 -6.139 1.00 0.00 H -ATOM 5398 HG22 ILE 344 7.574 -13.330 -6.824 1.00 0.00 H -ATOM 5399 HG23 ILE 344 6.929 -11.918 -6.240 1.00 0.00 H -ATOM 5400 CG1 ILE 344 7.029 -11.626 -8.916 1.00 0.00 C -ATOM 5401 HG12 ILE 344 7.955 -12.183 -9.053 1.00 0.00 H -ATOM 5402 HG13 ILE 344 6.724 -11.348 -9.925 1.00 0.00 H -ATOM 5403 CD1 ILE 344 7.369 -10.234 -8.233 1.00 0.00 C -ATOM 5404 HD11 ILE 344 8.121 -9.794 -8.886 1.00 0.00 H -ATOM 5405 HD12 ILE 344 6.586 -9.478 -8.253 1.00 0.00 H -ATOM 5406 HD13 ILE 344 7.847 -10.279 -7.254 1.00 0.00 H -ATOM 5407 C ILE 344 4.164 -14.245 -8.198 1.00 0.00 C -ATOM 5408 O ILE 344 3.023 -13.864 -8.507 1.00 0.00 O -ATOM 5409 N LEU 345 4.351 -15.148 -7.239 1.00 0.00 N -ATOM 5410 H LEU 345 5.317 -15.394 -7.078 1.00 0.00 H -ATOM 5411 CA LEU 345 3.365 -15.943 -6.475 1.00 0.00 C -ATOM 5412 HA LEU 345 2.334 -15.784 -6.789 1.00 0.00 H -ATOM 5413 CB LEU 345 3.573 -17.420 -6.813 1.00 0.00 C -ATOM 5414 HB2 LEU 345 4.493 -17.820 -6.388 1.00 0.00 H -ATOM 5415 HB3 LEU 345 2.711 -17.941 -6.397 1.00 0.00 H -ATOM 5416 CG LEU 345 3.643 -17.995 -8.205 1.00 0.00 C -ATOM 5417 HG LEU 345 4.534 -17.566 -8.662 1.00 0.00 H -ATOM 5418 CD1 LEU 345 3.694 -19.545 -8.069 1.00 0.00 C -ATOM 5419 HD11 LEU 345 2.796 -19.941 -7.595 1.00 0.00 H -ATOM 5420 HD12 LEU 345 3.746 -20.053 -9.031 1.00 0.00 H -ATOM 5421 HD13 LEU 345 4.558 -19.720 -7.428 1.00 0.00 H -ATOM 5422 CD2 LEU 345 2.522 -17.659 -9.029 1.00 0.00 C -ATOM 5423 HD21 LEU 345 2.737 -18.054 -10.021 1.00 0.00 H -ATOM 5424 HD22 LEU 345 1.655 -18.099 -8.537 1.00 0.00 H -ATOM 5425 HD23 LEU 345 2.399 -16.576 -9.041 1.00 0.00 H -ATOM 5426 C LEU 345 3.443 -15.664 -4.934 1.00 0.00 C -ATOM 5427 O LEU 345 4.548 -15.262 -4.467 1.00 0.00 O -ATOM 5428 N ASN 346 2.361 -15.826 -4.147 1.00 0.00 N -ATOM 5429 H ASN 346 1.473 -16.106 -4.538 1.00 0.00 H -ATOM 5430 CA ASN 346 2.443 -16.061 -2.669 1.00 0.00 C -ATOM 5431 HA ASN 346 3.432 -15.784 -2.305 1.00 0.00 H -ATOM 5432 CB ASN 346 1.355 -15.168 -1.925 1.00 0.00 C -ATOM 5433 HB2 ASN 346 0.338 -15.417 -2.229 1.00 0.00 H -ATOM 5434 HB3 ASN 346 1.425 -15.430 -0.870 1.00 0.00 H -ATOM 5435 CG ASN 346 1.620 -13.649 -2.031 1.00 0.00 C -ATOM 5436 OD1 ASN 346 0.818 -12.911 -2.507 1.00 0.00 O -ATOM 5437 ND2 ASN 346 2.778 -13.268 -1.618 1.00 0.00 N -ATOM 5438 HD21 ASN 346 2.939 -12.270 -1.634 1.00 0.00 H -ATOM 5439 HD22 ASN 346 3.334 -13.909 -1.071 1.00 0.00 H -ATOM 5440 C ASN 346 2.210 -17.502 -2.328 1.00 0.00 C -ATOM 5441 O ASN 346 1.600 -18.298 -3.110 1.00 0.00 O -ATOM 5442 N LYS 347 2.793 -17.907 -1.215 1.00 0.00 N -ATOM 5443 H LYS 347 3.240 -17.149 -0.721 1.00 0.00 H -ATOM 5444 CA LYS 347 2.974 -19.268 -0.829 1.00 0.00 C -ATOM 5445 HA LYS 347 3.355 -19.886 -1.641 1.00 0.00 H -ATOM 5446 CB LYS 347 4.044 -19.338 0.282 1.00 0.00 C -ATOM 5447 HB2 LYS 347 3.772 -18.704 1.126 1.00 0.00 H -ATOM 5448 HB3 LYS 347 4.085 -20.348 0.689 1.00 0.00 H -ATOM 5449 CG LYS 347 5.457 -18.839 -0.119 1.00 0.00 C -ATOM 5450 HG2 LYS 347 5.299 -17.816 -0.459 1.00 0.00 H -ATOM 5451 HG3 LYS 347 6.155 -18.787 0.716 1.00 0.00 H -ATOM 5452 CD LYS 347 6.041 -19.688 -1.304 1.00 0.00 C -ATOM 5453 HD2 LYS 347 6.347 -20.660 -0.919 1.00 0.00 H -ATOM 5454 HD3 LYS 347 5.261 -19.836 -2.052 1.00 0.00 H -ATOM 5455 CE LYS 347 7.189 -18.810 -1.784 1.00 0.00 C -ATOM 5456 HE2 LYS 347 6.689 -17.970 -2.265 1.00 0.00 H -ATOM 5457 HE3 LYS 347 7.807 -18.529 -0.931 1.00 0.00 H -ATOM 5458 NZ LYS 347 8.017 -19.439 -2.844 1.00 0.00 N -ATOM 5459 HZ1 LYS 347 8.779 -18.860 -3.168 1.00 0.00 H -ATOM 5460 HZ2 LYS 347 8.379 -20.308 -2.479 1.00 0.00 H -ATOM 5461 HZ3 LYS 347 7.519 -19.652 -3.697 1.00 0.00 H -ATOM 5462 C LYS 347 1.692 -20.017 -0.398 1.00 0.00 C -ATOM 5463 O LYS 347 1.498 -21.138 -0.936 1.00 0.00 O -ATOM 5464 OXT LYS 347 0.914 -19.570 0.487 1.00 0.00 O -TER 5465 LYS 347 -HETATM 5466 O1B ADP 348 0.377 9.742 -4.458 1.00 0.00 O -HETATM 5467 PB ADP 348 0.937 11.056 -3.977 1.00 0.00 P -HETATM 5468 O2B ADP 348 2.257 11.378 -4.575 1.00 0.00 O -HETATM 5469 O3B ADP 348 0.736 11.188 -2.506 1.00 0.00 O -HETATM 5470 O3A ADP 348 -0.027 12.006 -4.632 1.00 0.00 O -HETATM 5471 PA ADP 348 -0.903 13.057 -3.962 1.00 0.00 P -HETATM 5472 O1A ADP 348 -0.103 14.158 -3.308 1.00 0.00 O -HETATM 5473 O2A ADP 348 -2.118 12.407 -3.377 1.00 0.00 O -HETATM 5474 O5* ADP 348 -1.423 13.782 -5.347 1.00 0.00 O -HETATM 5475 C5* ADP 348 -2.283 13.132 -6.246 1.00 0.00 C -HETATM 5476 H50 ADP 348 -2.441 12.066 -6.085 1.00 0.00 H -HETATM 5477 H51 ADP 348 -1.861 13.309 -7.236 1.00 0.00 H -HETATM 5478 C4* ADP 348 -3.661 13.839 -6.173 1.00 0.00 C -HETATM 5479 H40 ADP 348 -3.603 14.927 -6.216 1.00 0.00 H -HETATM 5480 O4* ADP 348 -4.347 13.410 -7.346 1.00 0.00 O -HETATM 5481 C1* ADP 348 -5.718 13.351 -6.987 1.00 0.00 C -HETATM 5482 H10 ADP 348 -6.190 14.156 -7.549 1.00 0.00 H -HETATM 5483 N9 ADP 348 -6.254 11.966 -7.187 1.00 0.00 N -HETATM 5484 C8 ADP 348 -5.673 10.764 -7.184 1.00 0.00 C -HETATM 5485 H80 ADP 348 -4.612 10.701 -6.993 1.00 0.00 H -HETATM 5486 N7 ADP 348 -6.416 9.708 -7.436 1.00 0.00 N -HETATM 5487 C5 ADP 348 -7.635 10.306 -7.712 1.00 0.00 C -HETATM 5488 C6 ADP 348 -8.877 9.825 -8.099 1.00 0.00 C -HETATM 5489 N6 ADP 348 -9.173 8.560 -8.263 1.00 0.00 N -HETATM 5490 H60 ADP 348 -8.397 7.918 -8.201 1.00 0.00 H -HETATM 5491 H61 ADP 348 -10.081 8.347 -8.651 1.00 0.00 H -HETATM 5492 N1 ADP 348 -9.932 10.593 -8.259 1.00 0.00 N -HETATM 5493 C2 ADP 348 -9.712 11.935 -8.066 1.00 0.00 C -HETATM 5494 H2 ADP 348 -10.549 12.583 -8.284 1.00 0.00 H -HETATM 5495 N3 ADP 348 -8.564 12.591 -7.875 1.00 0.00 N -HETATM 5496 C4 ADP 348 -7.540 11.704 -7.605 1.00 0.00 C -HETATM 5497 C3* ADP 348 -4.481 13.433 -4.972 1.00 0.00 C -HETATM 5498 H30 ADP 348 -4.466 12.353 -4.822 1.00 0.00 H -HETATM 5499 O3* ADP 348 -4.040 14.126 -3.793 1.00 0.00 O -HETATM 5500 H3* ADP 348 -3.336 13.589 -3.422 1.00 0.00 H -HETATM 5501 C2* ADP 348 -5.811 13.800 -5.523 1.00 0.00 C -HETATM 5502 H20 ADP 348 -6.586 13.229 -5.014 1.00 0.00 H -HETATM 5503 O2* ADP 348 -6.157 15.157 -5.591 1.00 0.00 O -HETATM 5504 H2* ADP 348 -6.272 15.483 -4.696 1.00 0.00 H -HETATM 5505 MG MG 349 1.531 11.566 -0.796 1.00 0.00 Mg -HETATM 5506 O WAT 438 1.633 9.634 -0.519 1.00 0.00 O -HETATM 5507 H1 WAT 438 0.962 9.350 0.102 1.00 0.00 H -HETATM 5508 H2 WAT 438 2.371 9.047 -0.359 1.00 0.00 H -HETATM 5509 O WAT 439 -0.280 11.730 0.044 1.00 0.00 O -HETATM 5510 H1 WAT 439 -0.291 11.885 0.989 1.00 0.00 H -HETATM 5511 H2 WAT 439 -1.137 12.033 -0.258 1.00 0.00 H -HETATM 5512 O WAT 440 1.530 13.533 -1.175 1.00 0.00 O -HETATM 5513 H1 WAT 440 2.186 14.207 -0.999 1.00 0.00 H -HETATM 5514 H2 WAT 440 0.845 13.987 -1.665 1.00 0.00 H -HETATM 5515 O WAT 441 2.336 12.051 0.938 1.00 0.00 O -HETATM 5516 H1 WAT 441 3.188 11.764 1.264 1.00 0.00 H -HETATM 5517 H2 WAT 441 2.179 12.885 1.381 1.00 0.00 H -CONECT 5481 5480 5482 5483 5501 -CONECT 5493 5492 5494 5495 -CONECT 5501 5481 5497 5502 5503 -CONECT 5497 5478 5498 5499 5501 -CONECT 5496 5483 5487 5495 -CONECT 5478 5475 5479 5480 5497 -CONECT 5487 5486 5488 5496 -CONECT 5475 5474 5476 5477 5478 -CONECT 5488 5487 5489 5492 -CONECT 5484 5483 5485 5486 -CONECT 5482 5481 -CONECT 5494 5493 -CONECT 5504 5503 -CONECT 5502 5501 -CONECT 5500 5499 -CONECT 5498 5497 -CONECT 5479 5478 -CONECT 5476 5475 -CONECT 5477 5475 -CONECT 5490 5489 -CONECT 5491 5489 -CONECT 5485 5484 -CONECT 5492 5488 5493 -CONECT 5495 5493 5496 -CONECT 5489 5488 5490 5491 -CONECT 5486 5484 5487 -CONECT 5483 5481 5484 5496 -CONECT 5472 5471 -CONECT 5466 5467 -CONECT 5503 5501 5504 -CONECT 5473 5471 -CONECT 5468 5467 -CONECT 5499 5497 5500 -CONECT 5470 5467 5471 -CONECT 5469 5467 -CONECT 5480 5478 5481 -CONECT 5474 5471 5475 -CONECT 5471 5470 5472 5473 5474 -CONECT 5467 5466 5468 5469 5470 -CONECT 5507 5506 -CONECT 5508 5506 -CONECT 5506 5507 5508 -CONECT 5510 5509 -CONECT 5511 5509 -CONECT 5509 5510 5511 -CONECT 5513 5512 -CONECT 5514 5512 -CONECT 5512 5513 5514 -CONECT 5516 5515 -CONECT 5517 5515 -CONECT 5515 5516 5517 -END diff --git a/receptor/eg5_adp_mg_03000.pdb b/receptor/eg5_adp_mg_03000.pdb deleted file mode 100644 index 16b98ea..0000000 --- a/receptor/eg5_adp_mg_03000.pdb +++ /dev/null @@ -1,5595 +0,0 @@ -HELIX 1 1 LEU 15 ARG 18 1 4 -HELIX 2 2 GLN 63 MET 80 1 18 -HELIX 3 3 LYS 96 MET 100 1 5 -HELIX 4 4 ILE 120 ASP 134 1 15 -HELIX 5 5 LYS 192 LEU 212 1 21 -HELIX 6 6 TYR 216 ARG 219 1 4 -HELIX 7 7 ASN 256 ARG 259 1 4 -HELIX 8 8 ALA 262 ARG 266 1 5 -HELIX 9 9 ARG 268 VAL 288 1 21 -HELIX 10 10 TYR 296 GLU 298 1 3 -HELIX 11 11 LYS 300 ILE 304 1 5 -HELIX 12 12 SER 325 ASN 343 1 19 -SHEET 1 1 1 GLN 5 CYS 10 0 -SHEET 2 2 1 VAL 26 ASP 29 0 -SHEET 3 3 1 GLU 34 VAL 37 0 -SHEET 4 4 1 LYS 49 THR 52 0 -SHEET 5 5 1 CYS 84 TYR 89 0 -SHEET 6 6 1 PHE 139 TYR 149 0 -SHEET 7 7 1 GLU 152 PHE 154 0 -SHEET 8 8 1 MET 169 ASP 171 0 -SHEET 9 9 1 VAL 179 ILE 181 0 -SHEET 10 10 1 ILE 187 VAL 189 0 -SHEET 11 11 1 HIE 221 LYS 231 0 -SHEET 12 12 1 VAL 241 ASP 250 0 -SHEET 13 13 1 ARG 314 ILE 321 0 -CRYST1 88.569 88.569 88.569 109.47 109.47 109.47 1 -ATOM 1 N GLY 1 2.246 -21.417 -3.917 1.00 0.00 N -ATOM 2 H1 GLY 1 2.113 -22.116 -4.634 1.00 0.00 H -ATOM 3 H2 GLY 1 2.717 -21.768 -3.096 1.00 0.00 H -ATOM 4 H3 GLY 1 2.752 -20.660 -4.356 1.00 0.00 H -ATOM 5 CA GLY 1 0.950 -20.870 -3.443 1.00 0.00 C -ATOM 6 HA2 GLY 1 0.296 -21.723 -3.261 1.00 0.00 H -ATOM 7 HA3 GLY 1 1.012 -20.445 -2.442 1.00 0.00 H -ATOM 8 C GLY 1 0.341 -19.924 -4.465 1.00 0.00 C -ATOM 9 O GLY 1 0.511 -20.119 -5.673 1.00 0.00 O -ATOM 10 N LYS 2 -0.409 -18.958 -3.953 1.00 0.00 N -ATOM 11 H LYS 2 -0.412 -18.823 -2.952 1.00 0.00 H -ATOM 12 CA LYS 2 -1.354 -18.067 -4.696 1.00 0.00 C -ATOM 13 HA LYS 2 -1.778 -18.678 -5.493 1.00 0.00 H -ATOM 14 CB LYS 2 -2.440 -17.509 -3.690 1.00 0.00 C -ATOM 15 HB2 LYS 2 -3.001 -18.361 -3.305 1.00 0.00 H -ATOM 16 HB3 LYS 2 -1.993 -16.877 -2.923 1.00 0.00 H -ATOM 17 CG LYS 2 -3.480 -16.621 -4.304 1.00 0.00 C -ATOM 18 HG2 LYS 2 -3.069 -15.613 -4.238 1.00 0.00 H -ATOM 19 HG3 LYS 2 -3.780 -16.926 -5.306 1.00 0.00 H -ATOM 20 CD LYS 2 -4.841 -16.699 -3.541 1.00 0.00 C -ATOM 21 HD2 LYS 2 -5.303 -17.675 -3.689 1.00 0.00 H -ATOM 22 HD3 LYS 2 -4.766 -16.611 -2.457 1.00 0.00 H -ATOM 23 CE LYS 2 -5.906 -15.603 -4.063 1.00 0.00 C -ATOM 24 HE2 LYS 2 -5.301 -14.728 -4.298 1.00 0.00 H -ATOM 25 HE3 LYS 2 -6.379 -15.913 -4.995 1.00 0.00 H -ATOM 26 NZ LYS 2 -6.993 -15.322 -3.119 1.00 0.00 N -ATOM 27 HZ1 LYS 2 -6.752 -15.379 -2.141 1.00 0.00 H -ATOM 28 HZ2 LYS 2 -7.334 -14.402 -3.360 1.00 0.00 H -ATOM 29 HZ3 LYS 2 -7.730 -15.998 -3.261 1.00 0.00 H -ATOM 30 C LYS 2 -0.518 -16.965 -5.334 1.00 0.00 C -ATOM 31 O LYS 2 0.155 -16.128 -4.767 1.00 0.00 O -ATOM 32 N ASN 3 -0.879 -16.668 -6.579 1.00 0.00 N -ATOM 33 H ASN 3 -1.643 -17.197 -6.973 1.00 0.00 H -ATOM 34 CA ASN 3 -0.274 -15.579 -7.301 1.00 0.00 C -ATOM 35 HA ASN 3 0.813 -15.637 -7.247 1.00 0.00 H -ATOM 36 CB ASN 3 -0.725 -15.822 -8.753 1.00 0.00 C -ATOM 37 HB2 ASN 3 -0.603 -16.883 -8.973 1.00 0.00 H -ATOM 38 HB3 ASN 3 -1.781 -15.553 -8.795 1.00 0.00 H -ATOM 39 CG ASN 3 0.051 -14.947 -9.760 1.00 0.00 C -ATOM 40 OD1 ASN 3 -0.357 -14.678 -10.823 1.00 0.00 O -ATOM 41 ND2 ASN 3 1.088 -14.331 -9.343 1.00 0.00 N -ATOM 42 HD21 ASN 3 1.485 -13.701 -10.026 1.00 0.00 H -ATOM 43 HD22 ASN 3 1.615 -14.659 -8.546 1.00 0.00 H -ATOM 44 C ASN 3 -0.741 -14.193 -6.736 1.00 0.00 C -ATOM 45 O ASN 3 -1.924 -14.050 -6.446 1.00 0.00 O -ATOM 46 N ILE 4 0.123 -13.189 -6.707 1.00 0.00 N -ATOM 47 H ILE 4 1.093 -13.397 -6.894 1.00 0.00 H -ATOM 48 CA ILE 4 -0.173 -11.771 -6.429 1.00 0.00 C -ATOM 49 HA ILE 4 -0.645 -11.773 -5.447 1.00 0.00 H -ATOM 50 CB ILE 4 1.153 -11.051 -6.405 1.00 0.00 C -ATOM 51 HB ILE 4 1.733 -11.489 -7.218 1.00 0.00 H -ATOM 52 CG2 ILE 4 1.060 -9.484 -6.674 1.00 0.00 C -ATOM 53 HG21 ILE 4 0.741 -9.021 -5.740 1.00 0.00 H -ATOM 54 HG22 ILE 4 1.984 -8.970 -6.934 1.00 0.00 H -ATOM 55 HG23 ILE 4 0.389 -9.246 -7.499 1.00 0.00 H -ATOM 56 CG1 ILE 4 1.924 -11.444 -5.119 1.00 0.00 C -ATOM 57 HG12 ILE 4 1.365 -11.254 -4.204 1.00 0.00 H -ATOM 58 HG13 ILE 4 2.183 -12.502 -5.162 1.00 0.00 H -ATOM 59 CD1 ILE 4 3.290 -10.719 -4.830 1.00 0.00 C -ATOM 60 HD11 ILE 4 3.069 -9.653 -4.777 1.00 0.00 H -ATOM 61 HD12 ILE 4 3.889 -10.989 -3.960 1.00 0.00 H -ATOM 62 HD13 ILE 4 3.934 -10.892 -5.692 1.00 0.00 H -ATOM 63 C ILE 4 -1.196 -11.219 -7.381 1.00 0.00 C -ATOM 64 O ILE 4 -1.059 -11.402 -8.594 1.00 0.00 O -ATOM 65 N GLN 5 -2.218 -10.595 -6.848 1.00 0.00 N -ATOM 66 H GLN 5 -2.331 -10.561 -5.844 1.00 0.00 H -ATOM 67 CA GLN 5 -3.185 -9.782 -7.567 1.00 0.00 C -ATOM 68 HA GLN 5 -3.507 -10.346 -8.442 1.00 0.00 H -ATOM 69 CB GLN 5 -4.382 -9.534 -6.628 1.00 0.00 C -ATOM 70 HB2 GLN 5 -4.791 -10.504 -6.346 1.00 0.00 H -ATOM 71 HB3 GLN 5 -4.200 -8.931 -5.738 1.00 0.00 H -ATOM 72 CG GLN 5 -5.485 -8.826 -7.416 1.00 0.00 C -ATOM 73 HG2 GLN 5 -5.071 -7.918 -7.856 1.00 0.00 H -ATOM 74 HG3 GLN 5 -5.710 -9.545 -8.204 1.00 0.00 H -ATOM 75 CD GLN 5 -6.707 -8.367 -6.575 1.00 0.00 C -ATOM 76 OE1 GLN 5 -6.747 -8.123 -5.361 1.00 0.00 O -ATOM 77 NE2 GLN 5 -7.823 -8.328 -7.253 1.00 0.00 N -ATOM 78 HE21 GLN 5 -8.585 -7.877 -6.766 1.00 0.00 H -ATOM 79 HE22 GLN 5 -7.880 -8.557 -8.235 1.00 0.00 H -ATOM 80 C GLN 5 -2.583 -8.422 -8.060 1.00 0.00 C -ATOM 81 O GLN 5 -2.183 -7.624 -7.211 1.00 0.00 O -ATOM 82 N VAL 6 -2.580 -8.046 -9.346 1.00 0.00 N -ATOM 83 H VAL 6 -3.056 -8.630 -10.018 1.00 0.00 H -ATOM 84 CA VAL 6 -2.154 -6.709 -9.767 1.00 0.00 C -ATOM 85 HA VAL 6 -1.711 -6.185 -8.919 1.00 0.00 H -ATOM 86 CB VAL 6 -0.815 -6.884 -10.689 1.00 0.00 C -ATOM 87 HB VAL 6 -1.125 -7.176 -11.693 1.00 0.00 H -ATOM 88 CG1 VAL 6 -0.191 -5.539 -10.913 1.00 0.00 C -ATOM 89 HG11 VAL 6 0.627 -5.653 -11.625 1.00 0.00 H -ATOM 90 HG12 VAL 6 -1.002 -4.870 -11.201 1.00 0.00 H -ATOM 91 HG13 VAL 6 0.219 -5.169 -9.973 1.00 0.00 H -ATOM 92 CG2 VAL 6 0.304 -7.746 -10.034 1.00 0.00 C -ATOM 93 HG21 VAL 6 0.078 -8.810 -9.988 1.00 0.00 H -ATOM 94 HG22 VAL 6 1.250 -7.591 -10.553 1.00 0.00 H -ATOM 95 HG23 VAL 6 0.480 -7.441 -9.002 1.00 0.00 H -ATOM 96 C VAL 6 -3.173 -5.957 -10.572 1.00 0.00 C -ATOM 97 O VAL 6 -3.619 -6.498 -11.566 1.00 0.00 O -ATOM 98 N VAL 7 -3.700 -4.837 -10.108 1.00 0.00 N -ATOM 99 H VAL 7 -3.316 -4.467 -9.250 1.00 0.00 H -ATOM 100 CA VAL 7 -4.760 -3.945 -10.652 1.00 0.00 C -ATOM 101 HA VAL 7 -5.118 -4.420 -11.565 1.00 0.00 H -ATOM 102 CB VAL 7 -6.022 -3.845 -9.761 1.00 0.00 C -ATOM 103 HB VAL 7 -6.783 -3.191 -10.187 1.00 0.00 H -ATOM 104 CG1 VAL 7 -6.501 -5.315 -9.589 1.00 0.00 C -ATOM 105 HG11 VAL 7 -6.867 -5.643 -10.561 1.00 0.00 H -ATOM 106 HG12 VAL 7 -5.742 -6.002 -9.214 1.00 0.00 H -ATOM 107 HG13 VAL 7 -7.335 -5.381 -8.890 1.00 0.00 H -ATOM 108 CG2 VAL 7 -5.801 -3.442 -8.332 1.00 0.00 C -ATOM 109 HG21 VAL 7 -5.592 -2.372 -8.301 1.00 0.00 H -ATOM 110 HG22 VAL 7 -6.556 -3.627 -7.568 1.00 0.00 H -ATOM 111 HG23 VAL 7 -4.924 -3.947 -7.925 1.00 0.00 H -ATOM 112 C VAL 7 -4.040 -2.571 -10.949 1.00 0.00 C -ATOM 113 O VAL 7 -3.078 -2.232 -10.333 1.00 0.00 O -ATOM 114 N VAL 8 -4.812 -1.818 -11.790 1.00 0.00 N -ATOM 115 H VAL 8 -5.547 -2.269 -12.316 1.00 0.00 H -ATOM 116 CA VAL 8 -4.434 -0.457 -12.241 1.00 0.00 C -ATOM 117 HA VAL 8 -3.585 -0.182 -11.614 1.00 0.00 H -ATOM 118 CB VAL 8 -4.094 -0.438 -13.789 1.00 0.00 C -ATOM 119 HB VAL 8 -5.007 -0.784 -14.274 1.00 0.00 H -ATOM 120 CG1 VAL 8 -3.637 0.961 -14.353 1.00 0.00 C -ATOM 121 HG11 VAL 8 -4.379 1.754 -14.262 1.00 0.00 H -ATOM 122 HG12 VAL 8 -2.754 1.228 -13.771 1.00 0.00 H -ATOM 123 HG13 VAL 8 -3.400 0.892 -15.415 1.00 0.00 H -ATOM 124 CG2 VAL 8 -2.885 -1.354 -14.010 1.00 0.00 C -ATOM 125 HG21 VAL 8 -2.628 -1.342 -15.069 1.00 0.00 H -ATOM 126 HG22 VAL 8 -2.002 -1.076 -13.434 1.00 0.00 H -ATOM 127 HG23 VAL 8 -3.163 -2.379 -13.767 1.00 0.00 H -ATOM 128 C VAL 8 -5.543 0.562 -11.939 1.00 0.00 C -ATOM 129 O VAL 8 -6.709 0.260 -12.156 1.00 0.00 O -ATOM 130 N ARG 9 -5.128 1.846 -11.634 1.00 0.00 N -ATOM 131 H ARG 9 -4.161 2.123 -11.731 1.00 0.00 H -ATOM 132 CA ARG 9 -6.035 2.978 -11.480 1.00 0.00 C -ATOM 133 HA ARG 9 -6.942 2.677 -12.003 1.00 0.00 H -ATOM 134 CB ARG 9 -6.290 3.350 -10.001 1.00 0.00 C -ATOM 135 HB2 ARG 9 -6.368 2.468 -9.365 1.00 0.00 H -ATOM 136 HB3 ARG 9 -5.494 3.920 -9.522 1.00 0.00 H -ATOM 137 CG ARG 9 -7.582 4.203 -9.770 1.00 0.00 C -ATOM 138 HG2 ARG 9 -7.524 5.164 -10.280 1.00 0.00 H -ATOM 139 HG3 ARG 9 -8.434 3.670 -10.191 1.00 0.00 H -ATOM 140 CD ARG 9 -7.957 4.419 -8.254 1.00 0.00 C -ATOM 141 HD2 ARG 9 -8.327 3.432 -7.974 1.00 0.00 H -ATOM 142 HD3 ARG 9 -7.042 4.710 -7.737 1.00 0.00 H -ATOM 143 NE ARG 9 -9.143 5.271 -8.124 1.00 0.00 N -ATOM 144 HE ARG 9 -9.637 5.434 -8.990 1.00 0.00 H -ATOM 145 CZ ARG 9 -9.528 5.950 -7.148 1.00 0.00 C -ATOM 146 NH1 ARG 9 -8.970 5.808 -5.963 1.00 0.00 N -ATOM 147 HH11 ARG 9 -8.112 5.280 -5.898 1.00 0.00 H -ATOM 148 HH12 ARG 9 -9.356 6.347 -5.200 1.00 0.00 H -ATOM 149 NH2 ARG 9 -10.666 6.628 -7.253 1.00 0.00 N -ATOM 150 HH21 ARG 9 -11.230 6.486 -8.079 1.00 0.00 H -ATOM 151 HH22 ARG 9 -11.002 7.265 -6.546 1.00 0.00 H -ATOM 152 C ARG 9 -5.504 4.222 -12.177 1.00 0.00 C -ATOM 153 O ARG 9 -4.405 4.623 -11.853 1.00 0.00 O -ATOM 154 N CYS 10 -6.192 4.844 -13.106 1.00 0.00 N -ATOM 155 H CYS 10 -7.167 4.579 -13.140 1.00 0.00 H -ATOM 156 CA CYS 10 -5.808 6.194 -13.597 1.00 0.00 C -ATOM 157 HA CYS 10 -4.734 6.384 -13.591 1.00 0.00 H -ATOM 158 CB CYS 10 -6.090 6.229 -15.110 1.00 0.00 C -ATOM 159 HB2 CYS 10 -5.536 5.498 -15.698 1.00 0.00 H -ATOM 160 HB3 CYS 10 -7.106 5.901 -15.330 1.00 0.00 H -ATOM 161 SG CYS 10 -5.858 7.892 -15.879 1.00 0.00 S -ATOM 162 HG CYS 10 -7.112 8.249 -15.593 1.00 0.00 H -ATOM 163 C CYS 10 -6.470 7.329 -12.815 1.00 0.00 C -ATOM 164 O CYS 10 -7.652 7.302 -12.513 1.00 0.00 O -ATOM 165 N ARG 11 -5.705 8.395 -12.618 1.00 0.00 N -ATOM 166 H ARG 11 -4.740 8.466 -12.910 1.00 0.00 H -ATOM 167 CA ARG 11 -6.345 9.608 -12.138 1.00 0.00 C -ATOM 168 HA ARG 11 -7.138 9.331 -11.444 1.00 0.00 H -ATOM 169 CB ARG 11 -5.518 10.410 -11.131 1.00 0.00 C -ATOM 170 HB2 ARG 11 -6.012 11.258 -10.656 1.00 0.00 H -ATOM 171 HB3 ARG 11 -5.219 9.673 -10.386 1.00 0.00 H -ATOM 172 CG ARG 11 -4.134 10.958 -11.578 1.00 0.00 C -ATOM 173 HG2 ARG 11 -3.419 10.148 -11.724 1.00 0.00 H -ATOM 174 HG3 ARG 11 -4.315 11.569 -12.463 1.00 0.00 H -ATOM 175 CD ARG 11 -3.599 11.944 -10.544 1.00 0.00 C -ATOM 176 HD2 ARG 11 -4.315 12.759 -10.422 1.00 0.00 H -ATOM 177 HD3 ARG 11 -3.310 11.437 -9.625 1.00 0.00 H -ATOM 178 NE ARG 11 -2.427 12.597 -11.035 1.00 0.00 N -ATOM 179 HE ARG 11 -1.551 12.118 -10.891 1.00 0.00 H -ATOM 180 CZ ARG 11 -2.289 13.560 -11.943 1.00 0.00 C -ATOM 181 NH1 ARG 11 -3.286 14.146 -12.438 1.00 0.00 N -ATOM 182 HH11 ARG 11 -4.217 13.934 -12.112 1.00 0.00 H -ATOM 183 HH12 ARG 11 -3.109 15.075 -12.794 1.00 0.00 H -ATOM 184 NH2 ARG 11 -1.146 14.055 -12.260 1.00 0.00 N -ATOM 185 HH21 ARG 11 -0.373 13.658 -11.746 1.00 0.00 H -ATOM 186 HH22 ARG 11 -1.086 14.942 -12.739 1.00 0.00 H -ATOM 187 C ARG 11 -6.828 10.615 -13.118 1.00 0.00 C -ATOM 188 O ARG 11 -6.239 10.818 -14.189 1.00 0.00 O -ATOM 189 N PRO 12 -7.913 11.459 -12.736 1.00 0.00 N -ATOM 190 CD PRO 12 -8.973 11.100 -11.747 1.00 0.00 C -ATOM 191 HD2 PRO 12 -8.540 11.371 -10.784 1.00 0.00 H -ATOM 192 HD3 PRO 12 -9.254 10.049 -11.818 1.00 0.00 H -ATOM 193 CG PRO 12 -10.116 12.044 -11.990 1.00 0.00 C -ATOM 194 HG2 PRO 12 -10.636 12.436 -11.115 1.00 0.00 H -ATOM 195 HG3 PRO 12 -10.888 11.701 -12.677 1.00 0.00 H -ATOM 196 CB PRO 12 -9.366 13.159 -12.690 1.00 0.00 C -ATOM 197 HB2 PRO 12 -9.138 13.925 -11.950 1.00 0.00 H -ATOM 198 HB3 PRO 12 -10.081 13.551 -13.413 1.00 0.00 H -ATOM 199 CA PRO 12 -8.147 12.667 -13.451 1.00 0.00 C -ATOM 200 HA PRO 12 -8.314 12.442 -14.505 1.00 0.00 H -ATOM 201 C PRO 12 -7.050 13.671 -13.423 1.00 0.00 C -ATOM 202 O PRO 12 -6.109 13.482 -12.634 1.00 0.00 O -ATOM 203 N PHE 13 -6.978 14.582 -14.431 1.00 0.00 N -ATOM 204 H PHE 13 -7.790 14.786 -14.996 1.00 0.00 H -ATOM 205 CA PHE 13 -5.953 15.622 -14.340 1.00 0.00 C -ATOM 206 HA PHE 13 -4.949 15.211 -14.230 1.00 0.00 H -ATOM 207 CB PHE 13 -5.994 16.461 -15.658 1.00 0.00 C -ATOM 208 HB2 PHE 13 -6.996 16.884 -15.736 1.00 0.00 H -ATOM 209 HB3 PHE 13 -5.359 17.336 -15.519 1.00 0.00 H -ATOM 210 CG PHE 13 -5.546 15.711 -16.911 1.00 0.00 C -ATOM 211 CD1 PHE 13 -6.487 14.871 -17.507 1.00 0.00 C -ATOM 212 HD1 PHE 13 -7.442 14.723 -17.025 1.00 0.00 H -ATOM 213 CE1 PHE 13 -6.257 14.332 -18.767 1.00 0.00 C -ATOM 214 HE1 PHE 13 -7.128 13.901 -19.237 1.00 0.00 H -ATOM 215 CZ PHE 13 -5.071 14.631 -19.482 1.00 0.00 C -ATOM 216 HZ PHE 13 -4.993 14.323 -20.515 1.00 0.00 H -ATOM 217 CE2 PHE 13 -4.146 15.490 -18.921 1.00 0.00 C -ATOM 218 HE2 PHE 13 -3.363 15.798 -19.599 1.00 0.00 H -ATOM 219 CD2 PHE 13 -4.365 16.005 -17.635 1.00 0.00 C -ATOM 220 HD2 PHE 13 -3.634 16.691 -17.230 1.00 0.00 H -ATOM 221 C PHE 13 -6.138 16.509 -13.151 1.00 0.00 C -ATOM 222 O PHE 13 -7.245 16.705 -12.741 1.00 0.00 O -ATOM 223 N ASN 14 -5.067 17.001 -12.507 1.00 0.00 N -ATOM 224 H ASN 14 -4.159 16.845 -12.921 1.00 0.00 H -ATOM 225 CA ASN 14 -5.188 17.938 -11.357 1.00 0.00 C -ATOM 226 HA ASN 14 -5.994 17.779 -10.641 1.00 0.00 H -ATOM 227 CB ASN 14 -3.770 17.946 -10.703 1.00 0.00 C -ATOM 228 HB2 ASN 14 -2.916 17.834 -11.371 1.00 0.00 H -ATOM 229 HB3 ASN 14 -3.600 18.830 -10.087 1.00 0.00 H -ATOM 230 CG ASN 14 -3.750 16.745 -9.741 1.00 0.00 C -ATOM 231 OD1 ASN 14 -4.637 16.432 -8.975 1.00 0.00 O -ATOM 232 ND2 ASN 14 -2.599 16.113 -9.719 1.00 0.00 N -ATOM 233 HD21 ASN 14 -2.508 15.429 -8.981 1.00 0.00 H -ATOM 234 HD22 ASN 14 -1.861 16.423 -10.333 1.00 0.00 H -ATOM 235 C ASN 14 -5.614 19.343 -11.880 1.00 0.00 C -ATOM 236 O ASN 14 -5.555 19.778 -13.034 1.00 0.00 O -ATOM 237 N LEU 15 -5.954 20.209 -10.927 1.00 0.00 N -ATOM 238 H LEU 15 -5.898 19.944 -9.954 1.00 0.00 H -ATOM 239 CA LEU 15 -6.340 21.608 -11.119 1.00 0.00 C -ATOM 240 HA LEU 15 -7.281 21.602 -11.669 1.00 0.00 H -ATOM 241 CB LEU 15 -6.663 22.343 -9.799 1.00 0.00 C -ATOM 242 HB2 LEU 15 -7.476 21.769 -9.352 1.00 0.00 H -ATOM 243 HB3 LEU 15 -5.804 22.221 -9.138 1.00 0.00 H -ATOM 244 CG LEU 15 -7.011 23.870 -9.855 1.00 0.00 C -ATOM 245 HG LEU 15 -6.112 24.368 -10.217 1.00 0.00 H -ATOM 246 CD1 LEU 15 -8.227 24.126 -10.783 1.00 0.00 C -ATOM 247 HD11 LEU 15 -7.918 23.987 -11.820 1.00 0.00 H -ATOM 248 HD12 LEU 15 -9.102 23.522 -10.546 1.00 0.00 H -ATOM 249 HD13 LEU 15 -8.451 25.184 -10.641 1.00 0.00 H -ATOM 250 CD2 LEU 15 -7.448 24.423 -8.450 1.00 0.00 C -ATOM 251 HD21 LEU 15 -8.390 23.968 -8.142 1.00 0.00 H -ATOM 252 HD22 LEU 15 -6.714 24.095 -7.715 1.00 0.00 H -ATOM 253 HD23 LEU 15 -7.678 25.488 -8.411 1.00 0.00 H -ATOM 254 C LEU 15 -5.245 22.341 -11.951 1.00 0.00 C -ATOM 255 O LEU 15 -5.563 22.992 -12.939 1.00 0.00 O -ATOM 256 N ALA 16 -4.031 22.269 -11.511 1.00 0.00 N -ATOM 257 H ALA 16 -3.928 22.075 -10.524 1.00 0.00 H -ATOM 258 CA ALA 16 -2.828 22.849 -12.122 1.00 0.00 C -ATOM 259 HA ALA 16 -3.059 23.914 -12.151 1.00 0.00 H -ATOM 260 CB ALA 16 -1.717 22.556 -11.104 1.00 0.00 C -ATOM 261 HB1 ALA 16 -2.094 22.874 -10.132 1.00 0.00 H -ATOM 262 HB2 ALA 16 -1.499 21.489 -11.158 1.00 0.00 H -ATOM 263 HB3 ALA 16 -0.826 23.122 -11.376 1.00 0.00 H -ATOM 264 C ALA 16 -2.526 22.251 -13.474 1.00 0.00 C -ATOM 265 O ALA 16 -1.829 22.914 -14.204 1.00 0.00 O -ATOM 266 N GLU 17 -3.097 21.140 -13.940 1.00 0.00 N -ATOM 267 H GLU 17 -3.870 20.737 -13.430 1.00 0.00 H -ATOM 268 CA GLU 17 -2.876 20.512 -15.242 1.00 0.00 C -ATOM 269 HA GLU 17 -2.003 20.929 -15.745 1.00 0.00 H -ATOM 270 CB GLU 17 -2.773 18.986 -15.127 1.00 0.00 C -ATOM 271 HB2 GLU 17 -3.715 18.611 -14.730 1.00 0.00 H -ATOM 272 HB3 GLU 17 -2.712 18.636 -16.158 1.00 0.00 H -ATOM 273 CG GLU 17 -1.680 18.425 -14.217 1.00 0.00 C -ATOM 274 HG2 GLU 17 -0.723 18.704 -14.659 1.00 0.00 H -ATOM 275 HG3 GLU 17 -1.605 18.866 -13.224 1.00 0.00 H -ATOM 276 CD GLU 17 -1.621 16.943 -14.068 1.00 0.00 C -ATOM 277 OE1 GLU 17 -0.532 16.329 -14.236 1.00 0.00 O -ATOM 278 OE2 GLU 17 -2.646 16.350 -13.721 1.00 0.00 O -ATOM 279 C GLU 17 -4.056 20.785 -16.130 1.00 0.00 C -ATOM 280 O GLU 17 -3.857 21.061 -17.303 1.00 0.00 O -ATOM 281 N ARG 18 -5.257 21.011 -15.541 1.00 0.00 N -ATOM 282 H ARG 18 -5.393 20.657 -14.605 1.00 0.00 H -ATOM 283 CA ARG 18 -6.396 21.373 -16.377 1.00 0.00 C -ATOM 284 HA ARG 18 -6.355 20.813 -17.311 1.00 0.00 H -ATOM 285 CB ARG 18 -7.768 21.162 -15.680 1.00 0.00 C -ATOM 286 HB2 ARG 18 -7.643 21.739 -14.762 1.00 0.00 H -ATOM 287 HB3 ARG 18 -8.659 21.496 -16.211 1.00 0.00 H -ATOM 288 CG ARG 18 -7.843 19.707 -15.446 1.00 0.00 C -ATOM 289 HG2 ARG 18 -7.810 19.218 -16.419 1.00 0.00 H -ATOM 290 HG3 ARG 18 -7.013 19.375 -14.821 1.00 0.00 H -ATOM 291 CD ARG 18 -9.276 19.255 -14.910 1.00 0.00 C -ATOM 292 HD2 ARG 18 -9.987 19.382 -15.726 1.00 0.00 H -ATOM 293 HD3 ARG 18 -9.279 18.216 -14.582 1.00 0.00 H -ATOM 294 NE ARG 18 -9.756 20.082 -13.810 1.00 0.00 N -ATOM 295 HE ARG 18 -10.364 20.860 -14.023 1.00 0.00 H -ATOM 296 CZ ARG 18 -9.576 19.809 -12.505 1.00 0.00 C -ATOM 297 NH1 ARG 18 -8.836 18.807 -12.068 1.00 0.00 N -ATOM 298 HH11 ARG 18 -8.436 18.130 -12.702 1.00 0.00 H -ATOM 299 HH12 ARG 18 -8.774 18.625 -11.077 1.00 0.00 H -ATOM 300 NH2 ARG 18 -10.110 20.506 -11.562 1.00 0.00 N -ATOM 301 HH21 ARG 18 -10.768 21.258 -11.711 1.00 0.00 H -ATOM 302 HH22 ARG 18 -9.731 20.249 -10.662 1.00 0.00 H -ATOM 303 C ARG 18 -6.323 22.807 -16.720 1.00 0.00 C -ATOM 304 O ARG 18 -6.660 23.106 -17.865 1.00 0.00 O -ATOM 305 N LYS 19 -5.837 23.677 -15.797 1.00 0.00 N -ATOM 306 H LYS 19 -5.739 23.277 -14.875 1.00 0.00 H -ATOM 307 CA LYS 19 -5.430 25.118 -16.206 1.00 0.00 C -ATOM 308 HA LYS 19 -6.253 25.637 -16.696 1.00 0.00 H -ATOM 309 CB LYS 19 -5.032 25.963 -14.971 1.00 0.00 C -ATOM 310 HB2 LYS 19 -4.404 25.360 -14.314 1.00 0.00 H -ATOM 311 HB3 LYS 19 -4.510 26.821 -15.395 1.00 0.00 H -ATOM 312 CG LYS 19 -6.292 26.404 -14.176 1.00 0.00 C -ATOM 313 HG2 LYS 19 -6.990 26.897 -14.852 1.00 0.00 H -ATOM 314 HG3 LYS 19 -6.846 25.531 -13.831 1.00 0.00 H -ATOM 315 CD LYS 19 -5.916 27.312 -12.967 1.00 0.00 C -ATOM 316 HD2 LYS 19 -5.340 26.668 -12.302 1.00 0.00 H -ATOM 317 HD3 LYS 19 -5.299 28.181 -13.191 1.00 0.00 H -ATOM 318 CE LYS 19 -7.239 27.709 -12.239 1.00 0.00 C -ATOM 319 HE2 LYS 19 -7.857 28.342 -12.876 1.00 0.00 H -ATOM 320 HE3 LYS 19 -7.747 26.780 -11.982 1.00 0.00 H -ATOM 321 NZ LYS 19 -6.898 28.375 -10.973 1.00 0.00 N -ATOM 322 HZ1 LYS 19 -6.602 29.327 -11.137 1.00 0.00 H -ATOM 323 HZ2 LYS 19 -7.748 28.425 -10.431 1.00 0.00 H -ATOM 324 HZ3 LYS 19 -6.258 27.777 -10.471 1.00 0.00 H -ATOM 325 C LYS 19 -4.345 25.232 -17.244 1.00 0.00 C -ATOM 326 O LYS 19 -4.417 26.085 -18.123 1.00 0.00 O -ATOM 327 N ALA 20 -3.347 24.343 -17.314 1.00 0.00 N -ATOM 328 H ALA 20 -3.379 23.650 -16.579 1.00 0.00 H -ATOM 329 CA ALA 20 -2.343 24.247 -18.387 1.00 0.00 C -ATOM 330 HA ALA 20 -2.208 25.248 -18.798 1.00 0.00 H -ATOM 331 CB ALA 20 -0.986 23.843 -17.799 1.00 0.00 C -ATOM 332 HB1 ALA 20 -1.147 22.766 -17.844 1.00 0.00 H -ATOM 333 HB2 ALA 20 -0.164 24.041 -18.486 1.00 0.00 H -ATOM 334 HB3 ALA 20 -0.900 24.217 -16.779 1.00 0.00 H -ATOM 335 C ALA 20 -2.725 23.408 -19.581 1.00 0.00 C -ATOM 336 O ALA 20 -1.856 22.998 -20.331 1.00 0.00 O -ATOM 337 N SER 21 -3.954 23.101 -19.651 1.00 0.00 N -ATOM 338 H SER 21 -4.588 23.262 -18.881 1.00 0.00 H -ATOM 339 CA SER 21 -4.551 22.486 -20.832 1.00 0.00 C -ATOM 340 HA SER 21 -5.525 22.053 -20.610 1.00 0.00 H -ATOM 341 CB SER 21 -4.681 23.480 -22.061 1.00 0.00 C -ATOM 342 HB2 SER 21 -3.675 23.827 -22.300 1.00 0.00 H -ATOM 343 HB3 SER 21 -5.185 22.945 -22.866 1.00 0.00 H -ATOM 344 OG SER 21 -5.513 24.542 -21.652 1.00 0.00 O -ATOM 345 HG SER 21 -6.270 24.175 -21.191 1.00 0.00 H -ATOM 346 C SER 21 -3.741 21.277 -21.449 1.00 0.00 C -ATOM 347 O SER 21 -3.346 21.245 -22.653 1.00 0.00 O -ATOM 348 N ALA 22 -3.318 20.357 -20.553 1.00 0.00 N -ATOM 349 H ALA 22 -3.694 20.298 -19.618 1.00 0.00 H -ATOM 350 CA ALA 22 -2.495 19.243 -20.946 1.00 0.00 C -ATOM 351 HA ALA 22 -1.764 19.505 -21.711 1.00 0.00 H -ATOM 352 CB ALA 22 -1.705 18.696 -19.788 1.00 0.00 C -ATOM 353 HB1 ALA 22 -2.419 18.139 -19.181 1.00 0.00 H -ATOM 354 HB2 ALA 22 -0.956 18.015 -20.191 1.00 0.00 H -ATOM 355 HB3 ALA 22 -1.282 19.489 -19.170 1.00 0.00 H -ATOM 356 C ALA 22 -3.312 18.078 -21.569 1.00 0.00 C -ATOM 357 O ALA 22 -4.427 17.788 -21.188 1.00 0.00 O -ATOM 358 N HIE 23 -2.754 17.275 -22.487 1.00 0.00 N -ATOM 359 H HIE 23 -1.767 17.443 -22.624 1.00 0.00 H -ATOM 360 CA HIE 23 -3.379 16.187 -23.207 1.00 0.00 C -ATOM 361 HA HIE 23 -4.448 16.278 -23.020 1.00 0.00 H -ATOM 362 CB HIE 23 -3.079 16.270 -24.761 1.00 0.00 C -ATOM 363 HB2 HIE 23 -1.999 16.391 -24.849 1.00 0.00 H -ATOM 364 HB3 HIE 23 -3.519 15.406 -25.260 1.00 0.00 H -ATOM 365 CG HIE 23 -3.613 17.589 -25.210 1.00 0.00 C -ATOM 366 ND1 HIE 23 -4.655 17.793 -26.095 1.00 0.00 N -ATOM 367 CE1 HIE 23 -4.573 19.145 -26.401 1.00 0.00 C -ATOM 368 HE1 HIE 23 -5.100 19.642 -27.201 1.00 0.00 H -ATOM 369 NE2 HIE 23 -3.622 19.651 -25.649 1.00 0.00 N -ATOM 370 HE2 HIE 23 -3.316 20.608 -25.746 1.00 0.00 H -ATOM 371 CD2 HIE 23 -3.029 18.739 -24.948 1.00 0.00 C -ATOM 372 HD2 HIE 23 -2.157 18.942 -24.344 1.00 0.00 H -ATOM 373 C HIE 23 -2.813 14.851 -22.784 1.00 0.00 C -ATOM 374 O HIE 23 -1.626 14.673 -22.456 1.00 0.00 O -ATOM 375 N SER 24 -3.653 13.841 -22.721 1.00 0.00 N -ATOM 376 H SER 24 -4.613 14.071 -22.936 1.00 0.00 H -ATOM 377 CA SER 24 -3.336 12.493 -22.223 1.00 0.00 C -ATOM 378 HA SER 24 -2.708 12.638 -21.345 1.00 0.00 H -ATOM 379 CB SER 24 -4.681 11.825 -21.841 1.00 0.00 C -ATOM 380 HB2 SER 24 -5.083 12.221 -20.909 1.00 0.00 H -ATOM 381 HB3 SER 24 -5.392 12.044 -22.638 1.00 0.00 H -ATOM 382 OG SER 24 -4.447 10.440 -21.589 1.00 0.00 O -ATOM 383 HG SER 24 -5.167 10.340 -20.962 1.00 0.00 H -ATOM 384 C SER 24 -2.569 11.681 -23.275 1.00 0.00 C -ATOM 385 O SER 24 -2.718 11.906 -24.518 1.00 0.00 O -ATOM 386 N ILE 25 -1.822 10.724 -22.860 1.00 0.00 N -ATOM 387 H ILE 25 -1.873 10.575 -21.862 1.00 0.00 H -ATOM 388 CA ILE 25 -1.075 9.777 -23.727 1.00 0.00 C -ATOM 389 HA ILE 25 -1.366 9.856 -24.774 1.00 0.00 H -ATOM 390 CB ILE 25 0.422 9.947 -23.745 1.00 0.00 C -ATOM 391 HB ILE 25 0.846 9.276 -24.492 1.00 0.00 H -ATOM 392 CG2 ILE 25 0.706 11.265 -24.455 1.00 0.00 C -ATOM 393 HG21 ILE 25 0.183 11.367 -25.406 1.00 0.00 H -ATOM 394 HG22 ILE 25 0.371 12.067 -23.797 1.00 0.00 H -ATOM 395 HG23 ILE 25 1.775 11.264 -24.671 1.00 0.00 H -ATOM 396 CG1 ILE 25 1.105 9.946 -22.374 1.00 0.00 C -ATOM 397 HG12 ILE 25 2.176 9.993 -22.567 1.00 0.00 H -ATOM 398 HG13 ILE 25 0.835 10.761 -21.704 1.00 0.00 H -ATOM 399 CD1 ILE 25 0.856 8.722 -21.514 1.00 0.00 C -ATOM 400 HD11 ILE 25 -0.082 8.880 -20.982 1.00 0.00 H -ATOM 401 HD12 ILE 25 0.864 7.860 -22.180 1.00 0.00 H -ATOM 402 HD13 ILE 25 1.613 8.670 -20.730 1.00 0.00 H -ATOM 403 C ILE 25 -1.488 8.325 -23.253 1.00 0.00 C -ATOM 404 O ILE 25 -0.917 7.395 -23.793 1.00 0.00 O -ATOM 405 N VAL 26 -2.438 8.149 -22.328 1.00 0.00 N -ATOM 406 H VAL 26 -3.012 8.919 -22.017 1.00 0.00 H -ATOM 407 CA VAL 26 -2.890 6.822 -21.776 1.00 0.00 C -ATOM 408 HA VAL 26 -2.511 6.059 -22.456 1.00 0.00 H -ATOM 409 CB VAL 26 -2.105 6.543 -20.464 1.00 0.00 C -ATOM 410 HB VAL 26 -1.047 6.737 -20.642 1.00 0.00 H -ATOM 411 CG1 VAL 26 -2.431 7.564 -19.350 1.00 0.00 C -ATOM 412 HG11 VAL 26 -3.436 7.328 -19.002 1.00 0.00 H -ATOM 413 HG12 VAL 26 -1.710 7.545 -18.532 1.00 0.00 H -ATOM 414 HG13 VAL 26 -2.428 8.593 -19.708 1.00 0.00 H -ATOM 415 CG2 VAL 26 -2.280 4.997 -19.987 1.00 0.00 C -ATOM 416 HG21 VAL 26 -3.270 4.852 -19.554 1.00 0.00 H -ATOM 417 HG22 VAL 26 -2.175 4.262 -20.785 1.00 0.00 H -ATOM 418 HG23 VAL 26 -1.519 4.883 -19.214 1.00 0.00 H -ATOM 419 C VAL 26 -4.405 6.719 -21.701 1.00 0.00 C -ATOM 420 O VAL 26 -5.079 7.665 -21.288 1.00 0.00 O -ATOM 421 N GLU 27 -4.986 5.605 -22.104 1.00 0.00 N -ATOM 422 H GLU 27 -4.256 4.981 -22.418 1.00 0.00 H -ATOM 423 CA GLU 27 -6.412 5.353 -22.300 1.00 0.00 C -ATOM 424 HA GLU 27 -6.997 6.169 -21.877 1.00 0.00 H -ATOM 425 CB GLU 27 -6.796 5.465 -23.784 1.00 0.00 C -ATOM 426 HB2 GLU 27 -6.394 6.401 -24.172 1.00 0.00 H -ATOM 427 HB3 GLU 27 -6.269 4.687 -24.336 1.00 0.00 H -ATOM 428 CG GLU 27 -8.329 5.325 -24.025 1.00 0.00 C -ATOM 429 HG2 GLU 27 -8.528 5.578 -25.066 1.00 0.00 H -ATOM 430 HG3 GLU 27 -8.631 4.280 -23.954 1.00 0.00 H -ATOM 431 CD GLU 27 -9.287 6.297 -23.289 1.00 0.00 C -ATOM 432 OE1 GLU 27 -10.124 6.888 -24.039 1.00 0.00 O -ATOM 433 OE2 GLU 27 -9.250 6.391 -22.057 1.00 0.00 O -ATOM 434 C GLU 27 -6.862 4.115 -21.519 1.00 0.00 C -ATOM 435 O GLU 27 -6.066 3.144 -21.479 1.00 0.00 O -ATOM 436 N CYS 28 -7.997 4.147 -20.767 1.00 0.00 N -ATOM 437 H CYS 28 -8.533 4.998 -20.852 1.00 0.00 H -ATOM 438 CA CYS 28 -8.348 3.080 -19.800 1.00 0.00 C -ATOM 439 HA CYS 28 -7.513 2.380 -19.784 1.00 0.00 H -ATOM 440 CB CYS 28 -8.524 3.505 -18.350 1.00 0.00 C -ATOM 441 HB2 CYS 28 -9.378 4.171 -18.222 1.00 0.00 H -ATOM 442 HB3 CYS 28 -8.627 2.694 -17.630 1.00 0.00 H -ATOM 443 SG CYS 28 -6.981 4.322 -17.812 1.00 0.00 S -ATOM 444 HG CYS 28 -7.153 5.437 -18.528 1.00 0.00 H -ATOM 445 C CYS 28 -9.695 2.328 -20.304 1.00 0.00 C -ATOM 446 O CYS 28 -10.555 2.956 -20.892 1.00 0.00 O -ATOM 447 N ASP 29 -9.788 1.061 -20.052 1.00 0.00 N -ATOM 448 H ASP 29 -9.027 0.598 -19.580 1.00 0.00 H -ATOM 449 CA ASP 29 -10.899 0.199 -20.488 1.00 0.00 C -ATOM 450 HA ASP 29 -11.737 0.888 -20.596 1.00 0.00 H -ATOM 451 CB ASP 29 -10.640 -0.337 -21.892 1.00 0.00 C -ATOM 452 HB2 ASP 29 -10.293 0.433 -22.581 1.00 0.00 H -ATOM 453 HB3 ASP 29 -9.914 -1.133 -21.731 1.00 0.00 H -ATOM 454 CG ASP 29 -11.881 -0.959 -22.589 1.00 0.00 C -ATOM 455 OD1 ASP 29 -11.923 -1.017 -23.860 1.00 0.00 O -ATOM 456 OD2 ASP 29 -12.806 -1.486 -21.987 1.00 0.00 O -ATOM 457 C ASP 29 -11.421 -0.907 -19.560 1.00 0.00 C -ATOM 458 O ASP 29 -10.858 -2.049 -19.618 1.00 0.00 O -ATOM 459 N PRO 30 -12.277 -0.669 -18.587 1.00 0.00 N -ATOM 460 CD PRO 30 -12.888 0.576 -18.316 1.00 0.00 C -ATOM 461 HD2 PRO 30 -13.044 1.060 -19.280 1.00 0.00 H -ATOM 462 HD3 PRO 30 -12.235 1.081 -17.604 1.00 0.00 H -ATOM 463 CG PRO 30 -14.183 0.239 -17.647 1.00 0.00 C -ATOM 464 HG2 PRO 30 -14.949 -0.073 -18.357 1.00 0.00 H -ATOM 465 HG3 PRO 30 -14.456 0.972 -16.889 1.00 0.00 H -ATOM 466 CB PRO 30 -13.851 -0.977 -16.771 1.00 0.00 C -ATOM 467 HB2 PRO 30 -14.656 -1.665 -16.517 1.00 0.00 H -ATOM 468 HB3 PRO 30 -13.351 -0.686 -15.848 1.00 0.00 H -ATOM 469 CA PRO 30 -12.794 -1.648 -17.644 1.00 0.00 C -ATOM 470 HA PRO 30 -12.052 -2.083 -16.975 1.00 0.00 H -ATOM 471 C PRO 30 -13.467 -2.875 -18.260 1.00 0.00 C -ATOM 472 O PRO 30 -13.179 -3.980 -17.784 1.00 0.00 O -ATOM 473 N VAL 31 -14.188 -2.815 -19.428 1.00 0.00 N -ATOM 474 H VAL 31 -14.361 -1.904 -19.828 1.00 0.00 H -ATOM 475 CA VAL 31 -14.802 -3.951 -20.080 1.00 0.00 C -ATOM 476 HA VAL 31 -15.371 -4.521 -19.345 1.00 0.00 H -ATOM 477 CB VAL 31 -15.860 -3.500 -21.116 1.00 0.00 C -ATOM 478 HB VAL 31 -15.467 -2.823 -21.875 1.00 0.00 H -ATOM 479 CG1 VAL 31 -16.586 -4.690 -21.715 1.00 0.00 C -ATOM 480 HG11 VAL 31 -17.044 -5.275 -20.916 1.00 0.00 H -ATOM 481 HG12 VAL 31 -17.414 -4.294 -22.302 1.00 0.00 H -ATOM 482 HG13 VAL 31 -15.945 -5.293 -22.358 1.00 0.00 H -ATOM 483 CG2 VAL 31 -16.960 -2.746 -20.332 1.00 0.00 C -ATOM 484 HG21 VAL 31 -16.517 -1.865 -19.868 1.00 0.00 H -ATOM 485 HG22 VAL 31 -17.737 -2.477 -21.047 1.00 0.00 H -ATOM 486 HG23 VAL 31 -17.393 -3.443 -19.614 1.00 0.00 H -ATOM 487 C VAL 31 -13.767 -4.871 -20.681 1.00 0.00 C -ATOM 488 O VAL 31 -13.776 -6.076 -20.416 1.00 0.00 O -ATOM 489 N ARG 32 -12.716 -4.417 -21.359 1.00 0.00 N -ATOM 490 H ARG 32 -12.687 -3.436 -21.595 1.00 0.00 H -ATOM 491 CA ARG 32 -11.538 -5.168 -21.844 1.00 0.00 C -ATOM 492 HA ARG 32 -11.804 -6.154 -22.224 1.00 0.00 H -ATOM 493 CB ARG 32 -10.948 -4.575 -23.089 1.00 0.00 C -ATOM 494 HB2 ARG 32 -10.756 -3.504 -23.017 1.00 0.00 H -ATOM 495 HB3 ARG 32 -9.960 -4.985 -23.300 1.00 0.00 H -ATOM 496 CG ARG 32 -11.866 -4.974 -24.387 1.00 0.00 C -ATOM 497 HG2 ARG 32 -11.890 -6.054 -24.537 1.00 0.00 H -ATOM 498 HG3 ARG 32 -12.874 -4.613 -24.181 1.00 0.00 H -ATOM 499 CD ARG 32 -11.518 -4.330 -25.709 1.00 0.00 C -ATOM 500 HD2 ARG 32 -12.183 -4.709 -26.486 1.00 0.00 H -ATOM 501 HD3 ARG 32 -11.635 -3.246 -25.708 1.00 0.00 H -ATOM 502 NE ARG 32 -10.131 -4.500 -26.111 1.00 0.00 N -ATOM 503 HE ARG 32 -9.436 -3.914 -25.674 1.00 0.00 H -ATOM 504 CZ ARG 32 -9.655 -5.521 -26.864 1.00 0.00 C -ATOM 505 NH1 ARG 32 -10.378 -6.311 -27.629 1.00 0.00 N -ATOM 506 HH11 ARG 32 -11.316 -5.996 -27.827 1.00 0.00 H -ATOM 507 HH12 ARG 32 -9.863 -6.824 -28.330 1.00 0.00 H -ATOM 508 NH2 ARG 32 -8.359 -5.743 -26.938 1.00 0.00 N -ATOM 509 HH21 ARG 32 -7.695 -5.280 -26.333 1.00 0.00 H -ATOM 510 HH22 ARG 32 -7.990 -6.442 -27.566 1.00 0.00 H -ATOM 511 C ARG 32 -10.436 -5.505 -20.811 1.00 0.00 C -ATOM 512 O ARG 32 -9.559 -6.316 -21.116 1.00 0.00 O -ATOM 513 N LYS 33 -10.546 -4.901 -19.620 1.00 0.00 N -ATOM 514 H LYS 33 -11.270 -4.198 -19.563 1.00 0.00 H -ATOM 515 CA LYS 33 -9.503 -4.846 -18.593 1.00 0.00 C -ATOM 516 HA LYS 33 -9.738 -4.014 -17.930 1.00 0.00 H -ATOM 517 CB LYS 33 -9.454 -6.055 -17.632 1.00 0.00 C -ATOM 518 HB2 LYS 33 -9.288 -6.901 -18.298 1.00 0.00 H -ATOM 519 HB3 LYS 33 -8.568 -5.866 -17.025 1.00 0.00 H -ATOM 520 CG LYS 33 -10.602 -6.399 -16.768 1.00 0.00 C -ATOM 521 HG2 LYS 33 -10.662 -5.696 -15.938 1.00 0.00 H -ATOM 522 HG3 LYS 33 -11.463 -6.296 -17.429 1.00 0.00 H -ATOM 523 CD LYS 33 -10.678 -7.831 -16.219 1.00 0.00 C -ATOM 524 HD2 LYS 33 -11.174 -8.445 -16.970 1.00 0.00 H -ATOM 525 HD3 LYS 33 -9.670 -8.195 -16.023 1.00 0.00 H -ATOM 526 CE LYS 33 -11.616 -7.729 -14.985 1.00 0.00 C -ATOM 527 HE2 LYS 33 -11.390 -8.530 -14.280 1.00 0.00 H -ATOM 528 HE3 LYS 33 -11.552 -6.754 -14.501 1.00 0.00 H -ATOM 529 NZ LYS 33 -13.058 -7.903 -15.347 1.00 0.00 N -ATOM 530 HZ1 LYS 33 -13.559 -7.622 -14.517 1.00 0.00 H -ATOM 531 HZ2 LYS 33 -13.363 -7.320 -16.114 1.00 0.00 H -ATOM 532 HZ3 LYS 33 -13.276 -8.858 -15.595 1.00 0.00 H -ATOM 533 C LYS 33 -8.152 -4.551 -19.260 1.00 0.00 C -ATOM 534 O LYS 33 -7.217 -5.309 -19.229 1.00 0.00 O -ATOM 535 N GLU 34 -8.141 -3.392 -19.960 1.00 0.00 N -ATOM 536 H GLU 34 -8.887 -2.722 -19.836 1.00 0.00 H -ATOM 537 CA GLU 34 -7.079 -2.995 -20.846 1.00 0.00 C -ATOM 538 HA GLU 34 -6.226 -3.673 -20.828 1.00 0.00 H -ATOM 539 CB GLU 34 -7.660 -3.088 -22.221 1.00 0.00 C -ATOM 540 HB2 GLU 34 -8.070 -4.098 -22.251 1.00 0.00 H -ATOM 541 HB3 GLU 34 -8.466 -2.382 -22.421 1.00 0.00 H -ATOM 542 CG GLU 34 -6.636 -2.993 -23.362 1.00 0.00 C -ATOM 543 HG2 GLU 34 -6.157 -2.016 -23.406 1.00 0.00 H -ATOM 544 HG3 GLU 34 -5.965 -3.818 -23.121 1.00 0.00 H -ATOM 545 CD GLU 34 -7.329 -3.302 -24.718 1.00 0.00 C -ATOM 546 OE1 GLU 34 -8.307 -2.659 -25.059 1.00 0.00 O -ATOM 547 OE2 GLU 34 -6.801 -4.139 -25.398 1.00 0.00 O -ATOM 548 C GLU 34 -6.563 -1.554 -20.723 1.00 0.00 C -ATOM 549 O GLU 34 -7.331 -0.621 -20.423 1.00 0.00 O -ATOM 550 N VAL 35 -5.266 -1.382 -20.733 1.00 0.00 N -ATOM 551 H VAL 35 -4.646 -2.118 -21.041 1.00 0.00 H -ATOM 552 CA VAL 35 -4.708 -0.001 -20.647 1.00 0.00 C -ATOM 553 HA VAL 35 -5.498 0.639 -21.041 1.00 0.00 H -ATOM 554 CB VAL 35 -4.386 0.428 -19.153 1.00 0.00 C -ATOM 555 HB VAL 35 -5.270 0.327 -18.525 1.00 0.00 H -ATOM 556 CG1 VAL 35 -3.260 -0.500 -18.683 1.00 0.00 C -ATOM 557 HG11 VAL 35 -2.330 -0.092 -19.078 1.00 0.00 H -ATOM 558 HG12 VAL 35 -3.233 -0.555 -17.594 1.00 0.00 H -ATOM 559 HG13 VAL 35 -3.330 -1.463 -19.188 1.00 0.00 H -ATOM 560 CG2 VAL 35 -3.989 1.829 -18.880 1.00 0.00 C -ATOM 561 HG21 VAL 35 -4.763 2.479 -19.287 1.00 0.00 H -ATOM 562 HG22 VAL 35 -4.044 2.114 -17.829 1.00 0.00 H -ATOM 563 HG23 VAL 35 -3.047 2.076 -19.368 1.00 0.00 H -ATOM 564 C VAL 35 -3.535 0.309 -21.634 1.00 0.00 C -ATOM 565 O VAL 35 -2.571 -0.486 -21.656 1.00 0.00 O -ATOM 566 N SER 36 -3.720 1.323 -22.493 1.00 0.00 N -ATOM 567 H SER 36 -4.564 1.868 -22.408 1.00 0.00 H -ATOM 568 CA SER 36 -2.773 1.527 -23.652 1.00 0.00 C -ATOM 569 HA SER 36 -2.032 0.727 -23.647 1.00 0.00 H -ATOM 570 CB SER 36 -3.513 1.395 -24.993 1.00 0.00 C -ATOM 571 HB2 SER 36 -4.235 0.586 -24.890 1.00 0.00 H -ATOM 572 HB3 SER 36 -4.073 2.314 -25.164 1.00 0.00 H -ATOM 573 OG SER 36 -2.599 1.330 -26.017 1.00 0.00 O -ATOM 574 HG SER 36 -2.376 0.404 -26.141 1.00 0.00 H -ATOM 575 C SER 36 -2.065 2.882 -23.690 1.00 0.00 C -ATOM 576 O SER 36 -2.632 3.876 -23.247 1.00 0.00 O -ATOM 577 N VAL 37 -0.782 2.799 -24.129 1.00 0.00 N -ATOM 578 H VAL 37 -0.444 1.914 -24.479 1.00 0.00 H -ATOM 579 CA VAL 37 0.114 4.002 -24.233 1.00 0.00 C -ATOM 580 HA VAL 37 -0.403 4.929 -23.987 1.00 0.00 H -ATOM 581 CB VAL 37 1.232 4.011 -23.161 1.00 0.00 C -ATOM 582 HB VAL 37 1.685 3.022 -23.242 1.00 0.00 H -ATOM 583 CG1 VAL 37 2.437 4.942 -23.335 1.00 0.00 C -ATOM 584 HG11 VAL 37 2.937 5.077 -22.377 1.00 0.00 H -ATOM 585 HG12 VAL 37 3.138 4.715 -24.138 1.00 0.00 H -ATOM 586 HG13 VAL 37 2.045 5.930 -23.577 1.00 0.00 H -ATOM 587 CG2 VAL 37 0.616 3.980 -21.719 1.00 0.00 C -ATOM 588 HG21 VAL 37 1.391 3.823 -20.969 1.00 0.00 H -ATOM 589 HG22 VAL 37 0.136 4.955 -21.641 1.00 0.00 H -ATOM 590 HG23 VAL 37 -0.103 3.161 -21.688 1.00 0.00 H -ATOM 591 C VAL 37 0.687 4.248 -25.637 1.00 0.00 C -ATOM 592 O VAL 37 1.355 3.390 -26.211 1.00 0.00 O -ATOM 593 N ARG 38 0.391 5.423 -26.191 1.00 0.00 N -ATOM 594 H ARG 38 -0.281 5.950 -25.650 1.00 0.00 H -ATOM 595 CA ARG 38 0.742 5.911 -27.535 1.00 0.00 C -ATOM 596 HA ARG 38 0.590 5.145 -28.295 1.00 0.00 H -ATOM 597 CB ARG 38 -0.307 7.021 -27.863 1.00 0.00 C -ATOM 598 HB2 ARG 38 -1.231 6.562 -27.510 1.00 0.00 H -ATOM 599 HB3 ARG 38 -0.161 7.898 -27.232 1.00 0.00 H -ATOM 600 CG ARG 38 -0.259 7.395 -29.353 1.00 0.00 C -ATOM 601 HG2 ARG 38 0.670 7.919 -29.583 1.00 0.00 H -ATOM 602 HG3 ARG 38 -0.471 6.514 -29.958 1.00 0.00 H -ATOM 603 CD ARG 38 -1.359 8.364 -29.610 1.00 0.00 C -ATOM 604 HD2 ARG 38 -1.444 8.477 -30.691 1.00 0.00 H -ATOM 605 HD3 ARG 38 -2.307 7.958 -29.255 1.00 0.00 H -ATOM 606 NE ARG 38 -1.142 9.688 -29.152 1.00 0.00 N -ATOM 607 HE ARG 38 -1.692 9.926 -28.339 1.00 0.00 H -ATOM 608 CZ ARG 38 -0.348 10.653 -29.597 1.00 0.00 C -ATOM 609 NH1 ARG 38 0.341 10.568 -30.693 1.00 0.00 N -ATOM 610 HH11 ARG 38 0.469 9.676 -31.149 1.00 0.00 H -ATOM 611 HH12 ARG 38 0.785 11.381 -31.098 1.00 0.00 H -ATOM 612 NH2 ARG 38 -0.325 11.867 -29.113 1.00 0.00 N -ATOM 613 HH21 ARG 38 -0.802 12.107 -28.256 1.00 0.00 H -ATOM 614 HH22 ARG 38 0.254 12.602 -29.496 1.00 0.00 H -ATOM 615 C ARG 38 2.196 6.415 -27.610 1.00 0.00 C -ATOM 616 O ARG 38 2.508 7.577 -27.443 1.00 0.00 O -ATOM 617 N THR 39 3.052 5.358 -27.669 1.00 0.00 N -ATOM 618 H THR 39 2.617 4.447 -27.684 1.00 0.00 H -ATOM 619 CA THR 39 4.561 5.540 -27.643 1.00 0.00 C -ATOM 620 HA THR 39 4.883 6.021 -26.719 1.00 0.00 H -ATOM 621 CB THR 39 5.270 4.195 -27.769 1.00 0.00 C -ATOM 622 HB THR 39 6.353 4.302 -27.836 1.00 0.00 H -ATOM 623 CG2 THR 39 5.036 3.211 -26.684 1.00 0.00 C -ATOM 624 HG21 THR 39 5.866 2.504 -26.689 1.00 0.00 H -ATOM 625 HG22 THR 39 4.985 3.598 -25.665 1.00 0.00 H -ATOM 626 HG23 THR 39 4.143 2.618 -26.882 1.00 0.00 H -ATOM 627 OG1 THR 39 5.039 3.516 -28.969 1.00 0.00 O -ATOM 628 HG1 THR 39 5.741 2.867 -29.066 1.00 0.00 H -ATOM 629 C THR 39 5.127 6.431 -28.797 1.00 0.00 C -ATOM 630 O THR 39 6.276 6.863 -28.623 1.00 0.00 O -ATOM 631 N GLY 40 4.377 6.773 -29.871 1.00 0.00 N -ATOM 632 H GLY 40 3.439 6.400 -29.911 1.00 0.00 H -ATOM 633 CA GLY 40 4.844 7.720 -30.911 1.00 0.00 C -ATOM 634 HA2 GLY 40 5.907 7.518 -31.037 1.00 0.00 H -ATOM 635 HA3 GLY 40 4.280 7.554 -31.828 1.00 0.00 H -ATOM 636 C GLY 40 4.800 9.192 -30.497 1.00 0.00 C -ATOM 637 O GLY 40 4.141 9.598 -29.579 1.00 0.00 O -ATOM 638 N GLY 41 5.294 10.070 -31.357 1.00 0.00 N -ATOM 639 H GLY 41 5.764 9.689 -32.165 1.00 0.00 H -ATOM 640 CA GLY 41 5.370 11.557 -31.170 1.00 0.00 C -ATOM 641 HA2 GLY 41 4.435 11.991 -30.815 1.00 0.00 H -ATOM 642 HA3 GLY 41 6.076 11.717 -30.355 1.00 0.00 H -ATOM 643 C GLY 41 5.953 12.309 -32.381 1.00 0.00 C -ATOM 644 O GLY 41 5.222 12.585 -33.375 1.00 0.00 O -ATOM 645 N LEU 42 7.228 12.731 -32.200 1.00 0.00 N -ATOM 646 H LEU 42 7.650 12.603 -31.292 1.00 0.00 H -ATOM 647 CA LEU 42 7.926 13.429 -33.314 1.00 0.00 C -ATOM 648 HA LEU 42 7.517 14.400 -33.593 1.00 0.00 H -ATOM 649 CB LEU 42 9.271 13.748 -32.810 1.00 0.00 C -ATOM 650 HB2 LEU 42 9.676 12.789 -32.486 1.00 0.00 H -ATOM 651 HB3 LEU 42 9.923 13.996 -33.648 1.00 0.00 H -ATOM 652 CG LEU 42 9.376 14.805 -31.734 1.00 0.00 C -ATOM 653 HG LEU 42 8.626 14.690 -30.952 1.00 0.00 H -ATOM 654 CD1 LEU 42 10.738 14.770 -30.987 1.00 0.00 C -ATOM 655 HD11 LEU 42 11.108 13.776 -30.737 1.00 0.00 H -ATOM 656 HD12 LEU 42 11.517 15.262 -31.569 1.00 0.00 H -ATOM 657 HD13 LEU 42 10.712 15.452 -30.137 1.00 0.00 H -ATOM 658 CD2 LEU 42 9.344 16.150 -32.363 1.00 0.00 C -ATOM 659 HD21 LEU 42 8.402 16.205 -32.910 1.00 0.00 H -ATOM 660 HD22 LEU 42 9.525 16.955 -31.652 1.00 0.00 H -ATOM 661 HD23 LEU 42 10.151 16.147 -33.097 1.00 0.00 H -ATOM 662 C LEU 42 8.045 12.550 -34.596 1.00 0.00 C -ATOM 663 O LEU 42 8.161 13.052 -35.720 1.00 0.00 O -ATOM 664 N ALA 43 7.854 11.260 -34.504 1.00 0.00 N -ATOM 665 H ALA 43 7.894 10.779 -33.616 1.00 0.00 H -ATOM 666 CA ALA 43 7.579 10.464 -35.656 1.00 0.00 C -ATOM 667 HA ALA 43 7.026 11.068 -36.374 1.00 0.00 H -ATOM 668 CB ALA 43 8.878 9.786 -36.223 1.00 0.00 C -ATOM 669 HB1 ALA 43 8.644 9.184 -37.101 1.00 0.00 H -ATOM 670 HB2 ALA 43 9.689 10.480 -36.445 1.00 0.00 H -ATOM 671 HB3 ALA 43 9.219 9.118 -35.432 1.00 0.00 H -ATOM 672 C ALA 43 6.495 9.395 -35.265 1.00 0.00 C -ATOM 673 O ALA 43 6.268 9.106 -34.107 1.00 0.00 O -ATOM 674 N ASP 44 5.878 8.877 -36.343 1.00 0.00 N -ATOM 675 H ASP 44 6.194 9.191 -37.250 1.00 0.00 H -ATOM 676 CA ASP 44 5.004 7.647 -36.333 1.00 0.00 C -ATOM 677 HA ASP 44 4.309 7.549 -37.166 1.00 0.00 H -ATOM 678 CB ASP 44 5.915 6.407 -36.445 1.00 0.00 C -ATOM 679 HB2 ASP 44 6.715 6.385 -35.705 1.00 0.00 H -ATOM 680 HB3 ASP 44 5.368 5.483 -36.255 1.00 0.00 H -ATOM 681 CG ASP 44 6.524 6.270 -37.774 1.00 0.00 C -ATOM 682 OD1 ASP 44 6.420 7.149 -38.580 1.00 0.00 O -ATOM 683 OD2 ASP 44 7.242 5.347 -38.124 1.00 0.00 O -ATOM 684 C ASP 44 4.001 7.567 -35.119 1.00 0.00 C -ATOM 685 O ASP 44 4.034 6.745 -34.238 1.00 0.00 O -ATOM 686 N LYS 45 3.089 8.536 -35.080 1.00 0.00 N -ATOM 687 H LYS 45 3.251 9.221 -35.806 1.00 0.00 H -ATOM 688 CA LYS 45 2.173 8.877 -33.938 1.00 0.00 C -ATOM 689 HA LYS 45 2.809 8.916 -33.054 1.00 0.00 H -ATOM 690 CB LYS 45 1.558 10.253 -34.161 1.00 0.00 C -ATOM 691 HB2 LYS 45 0.668 10.138 -34.780 1.00 0.00 H -ATOM 692 HB3 LYS 45 1.037 10.625 -33.279 1.00 0.00 H -ATOM 693 CG LYS 45 2.428 11.336 -34.656 1.00 0.00 C -ATOM 694 HG2 LYS 45 3.028 11.560 -33.774 1.00 0.00 H -ATOM 695 HG3 LYS 45 3.124 10.869 -35.353 1.00 0.00 H -ATOM 696 CD LYS 45 1.704 12.558 -35.258 1.00 0.00 C -ATOM 697 HD2 LYS 45 1.105 12.202 -36.096 1.00 0.00 H -ATOM 698 HD3 LYS 45 0.990 12.973 -34.548 1.00 0.00 H -ATOM 699 CE LYS 45 2.700 13.685 -35.631 1.00 0.00 C -ATOM 700 HE2 LYS 45 3.456 13.358 -36.344 1.00 0.00 H -ATOM 701 HE3 LYS 45 2.151 14.451 -36.181 1.00 0.00 H -ATOM 702 NZ LYS 45 3.407 14.169 -34.380 1.00 0.00 N -ATOM 703 HZ1 LYS 45 4.217 14.747 -34.552 1.00 0.00 H -ATOM 704 HZ2 LYS 45 2.888 14.699 -33.694 1.00 0.00 H -ATOM 705 HZ3 LYS 45 3.736 13.416 -33.793 1.00 0.00 H -ATOM 706 C LYS 45 1.143 7.869 -33.483 1.00 0.00 C -ATOM 707 O LYS 45 0.766 7.858 -32.286 1.00 0.00 O -ATOM 708 N SER 46 0.798 7.001 -34.378 1.00 0.00 N -ATOM 709 H SER 46 1.196 7.153 -35.293 1.00 0.00 H -ATOM 710 CA SER 46 0.027 5.683 -34.243 1.00 0.00 C -ATOM 711 HA SER 46 -0.933 6.107 -33.949 1.00 0.00 H -ATOM 712 CB SER 46 -0.245 5.034 -35.667 1.00 0.00 C -ATOM 713 HB2 SER 46 0.734 4.762 -36.062 1.00 0.00 H -ATOM 714 HB3 SER 46 -0.909 4.177 -35.555 1.00 0.00 H -ATOM 715 OG SER 46 -0.867 5.933 -36.526 1.00 0.00 O -ATOM 716 HG SER 46 -1.702 5.518 -36.756 1.00 0.00 H -ATOM 717 C SER 46 0.656 4.629 -33.391 1.00 0.00 C -ATOM 718 O SER 46 0.010 3.682 -33.009 1.00 0.00 O -ATOM 719 N SER 47 2.007 4.735 -33.208 1.00 0.00 N -ATOM 720 H SER 47 2.548 5.536 -33.499 1.00 0.00 H -ATOM 721 CA SER 47 2.700 3.687 -32.420 1.00 0.00 C -ATOM 722 HA SER 47 2.506 2.735 -32.912 1.00 0.00 H -ATOM 723 CB SER 47 4.174 3.934 -32.456 1.00 0.00 C -ATOM 724 HB2 SER 47 4.327 4.797 -31.808 1.00 0.00 H -ATOM 725 HB3 SER 47 4.643 3.042 -32.040 1.00 0.00 H -ATOM 726 OG SER 47 4.724 4.247 -33.729 1.00 0.00 O -ATOM 727 HG SER 47 4.611 5.200 -33.748 1.00 0.00 H -ATOM 728 C SER 47 2.191 3.710 -30.990 1.00 0.00 C -ATOM 729 O SER 47 1.988 4.781 -30.374 1.00 0.00 O -ATOM 730 N ARG 48 1.967 2.493 -30.546 1.00 0.00 N -ATOM 731 H ARG 48 2.191 1.692 -31.121 1.00 0.00 H -ATOM 732 CA ARG 48 1.637 2.288 -29.143 1.00 0.00 C -ATOM 733 HA ARG 48 2.060 3.067 -28.511 1.00 0.00 H -ATOM 734 CB ARG 48 0.082 2.338 -29.064 1.00 0.00 C -ATOM 735 HB2 ARG 48 -0.144 2.121 -28.020 1.00 0.00 H -ATOM 736 HB3 ARG 48 -0.239 3.373 -29.180 1.00 0.00 H -ATOM 737 CG ARG 48 -0.706 1.406 -29.953 1.00 0.00 C -ATOM 738 HG2 ARG 48 -0.453 1.616 -30.991 1.00 0.00 H -ATOM 739 HG3 ARG 48 -0.380 0.372 -29.830 1.00 0.00 H -ATOM 740 CD ARG 48 -2.195 1.475 -29.633 1.00 0.00 C -ATOM 741 HD2 ARG 48 -2.695 0.747 -30.272 1.00 0.00 H -ATOM 742 HD3 ARG 48 -2.496 1.220 -28.617 1.00 0.00 H -ATOM 743 NE ARG 48 -2.715 2.829 -29.955 1.00 0.00 N -ATOM 744 HE ARG 48 -2.876 2.912 -30.948 1.00 0.00 H -ATOM 745 CZ ARG 48 -2.773 3.847 -29.054 1.00 0.00 C -ATOM 746 NH1 ARG 48 -2.456 3.694 -27.781 1.00 0.00 N -ATOM 747 HH11 ARG 48 -2.416 2.827 -27.266 1.00 0.00 H -ATOM 748 HH12 ARG 48 -2.760 4.476 -27.216 1.00 0.00 H -ATOM 749 NH2 ARG 48 -3.348 5.007 -29.313 1.00 0.00 N -ATOM 750 HH21 ARG 48 -3.607 5.313 -30.240 1.00 0.00 H -ATOM 751 HH22 ARG 48 -3.530 5.604 -28.520 1.00 0.00 H -ATOM 752 C ARG 48 2.120 0.958 -28.606 1.00 0.00 C -ATOM 753 O ARG 48 2.491 0.083 -29.375 1.00 0.00 O -ATOM 754 N LYS 49 2.085 0.818 -27.244 1.00 0.00 N -ATOM 755 H LYS 49 1.895 1.691 -26.772 1.00 0.00 H -ATOM 756 CA LYS 49 2.186 -0.308 -26.341 1.00 0.00 C -ATOM 757 HA LYS 49 2.206 -1.164 -27.015 1.00 0.00 H -ATOM 758 CB LYS 49 3.466 -0.144 -25.517 1.00 0.00 C -ATOM 759 HB2 LYS 49 3.425 0.756 -24.904 1.00 0.00 H -ATOM 760 HB3 LYS 49 3.450 -0.928 -24.761 1.00 0.00 H -ATOM 761 CG LYS 49 4.804 -0.317 -26.263 1.00 0.00 C -ATOM 762 HG2 LYS 49 4.891 -1.354 -26.585 1.00 0.00 H -ATOM 763 HG3 LYS 49 4.916 0.415 -27.064 1.00 0.00 H -ATOM 764 CD LYS 49 6.029 -0.156 -25.455 1.00 0.00 C -ATOM 765 HD2 LYS 49 6.943 -0.089 -26.045 1.00 0.00 H -ATOM 766 HD3 LYS 49 5.942 0.759 -24.869 1.00 0.00 H -ATOM 767 CE LYS 49 6.318 -1.343 -24.428 1.00 0.00 C -ATOM 768 HE2 LYS 49 6.042 -0.964 -23.444 1.00 0.00 H -ATOM 769 HE3 LYS 49 5.809 -2.266 -24.707 1.00 0.00 H -ATOM 770 NZ LYS 49 7.747 -1.658 -24.365 1.00 0.00 N -ATOM 771 HZ1 LYS 49 7.919 -2.170 -25.219 1.00 0.00 H -ATOM 772 HZ2 LYS 49 8.265 -0.795 -24.441 1.00 0.00 H -ATOM 773 HZ3 LYS 49 8.079 -2.088 -23.513 1.00 0.00 H -ATOM 774 C LYS 49 0.953 -0.510 -25.521 1.00 0.00 C -ATOM 775 O LYS 49 0.403 0.442 -25.110 1.00 0.00 O -ATOM 776 N THR 50 0.496 -1.741 -25.157 1.00 0.00 N -ATOM 777 H THR 50 0.872 -2.573 -25.588 1.00 0.00 H -ATOM 778 CA THR 50 -0.764 -1.946 -24.428 1.00 0.00 C -ATOM 779 HA THR 50 -1.003 -1.093 -23.793 1.00 0.00 H -ATOM 780 CB THR 50 -1.955 -2.301 -25.338 1.00 0.00 C -ATOM 781 HB THR 50 -1.750 -3.279 -25.775 1.00 0.00 H -ATOM 782 CG2 THR 50 -3.285 -2.322 -24.661 1.00 0.00 C -ATOM 783 HG21 THR 50 -3.516 -1.503 -23.981 1.00 0.00 H -ATOM 784 HG22 THR 50 -4.127 -2.370 -25.354 1.00 0.00 H -ATOM 785 HG23 THR 50 -3.367 -3.222 -24.051 1.00 0.00 H -ATOM 786 OG1 THR 50 -1.954 -1.316 -26.364 1.00 0.00 O -ATOM 787 HG1 THR 50 -1.524 -1.758 -27.100 1.00 0.00 H -ATOM 788 C THR 50 -0.500 -3.085 -23.375 1.00 0.00 C -ATOM 789 O THR 50 0.203 -4.076 -23.616 1.00 0.00 O -ATOM 790 N TYR 51 -1.234 -3.004 -22.288 1.00 0.00 N -ATOM 791 H TYR 51 -1.735 -2.137 -22.157 1.00 0.00 H -ATOM 792 CA TYR 51 -1.118 -3.960 -21.133 1.00 0.00 C -ATOM 793 HA TYR 51 -0.627 -4.896 -21.401 1.00 0.00 H -ATOM 794 CB TYR 51 -0.319 -3.417 -19.975 1.00 0.00 C -ATOM 795 HB2 TYR 51 -0.762 -2.456 -19.713 1.00 0.00 H -ATOM 796 HB3 TYR 51 -0.456 -4.083 -19.123 1.00 0.00 H -ATOM 797 CG TYR 51 1.198 -3.167 -20.096 1.00 0.00 C -ATOM 798 CD1 TYR 51 2.055 -4.207 -19.667 1.00 0.00 C -ATOM 799 HD1 TYR 51 1.570 -5.071 -19.238 1.00 0.00 H -ATOM 800 CE1 TYR 51 3.465 -4.052 -19.606 1.00 0.00 C -ATOM 801 HE1 TYR 51 4.095 -4.778 -19.113 1.00 0.00 H -ATOM 802 CZ TYR 51 4.056 -2.800 -20.036 1.00 0.00 C -ATOM 803 OH TYR 51 5.343 -2.604 -20.034 1.00 0.00 O -ATOM 804 HH TYR 51 5.840 -3.410 -19.880 1.00 0.00 H -ATOM 805 CE2 TYR 51 3.174 -1.810 -20.600 1.00 0.00 C -ATOM 806 HE2 TYR 51 3.646 -0.962 -21.072 1.00 0.00 H -ATOM 807 CD2 TYR 51 1.753 -1.990 -20.611 1.00 0.00 C -ATOM 808 HD2 TYR 51 1.171 -1.152 -20.965 1.00 0.00 H -ATOM 809 C TYR 51 -2.613 -4.373 -20.749 1.00 0.00 C -ATOM 810 O TYR 51 -3.514 -3.536 -20.816 1.00 0.00 O -ATOM 811 N THR 52 -2.873 -5.589 -20.280 1.00 0.00 N -ATOM 812 H THR 52 -2.166 -6.298 -20.413 1.00 0.00 H -ATOM 813 CA THR 52 -3.953 -6.135 -19.441 1.00 0.00 C -ATOM 814 HA THR 52 -4.731 -5.376 -19.361 1.00 0.00 H -ATOM 815 CB THR 52 -4.741 -7.348 -20.124 1.00 0.00 C -ATOM 816 HB THR 52 -5.061 -7.022 -21.114 1.00 0.00 H -ATOM 817 CG2 THR 52 -3.791 -8.586 -20.279 1.00 0.00 C -ATOM 818 HG21 THR 52 -3.388 -8.828 -19.296 1.00 0.00 H -ATOM 819 HG22 THR 52 -4.353 -9.447 -20.640 1.00 0.00 H -ATOM 820 HG23 THR 52 -3.071 -8.332 -21.056 1.00 0.00 H -ATOM 821 OG1 THR 52 -5.844 -7.682 -19.345 1.00 0.00 O -ATOM 822 HG1 THR 52 -6.397 -6.897 -19.341 1.00 0.00 H -ATOM 823 C THR 52 -3.536 -6.362 -17.940 1.00 0.00 C -ATOM 824 O THR 52 -2.369 -6.813 -17.656 1.00 0.00 O -ATOM 825 N PHE 53 -4.408 -5.978 -16.996 1.00 0.00 N -ATOM 826 H PHE 53 -5.212 -5.445 -17.293 1.00 0.00 H -ATOM 827 CA PHE 53 -4.253 -6.278 -15.592 1.00 0.00 C -ATOM 828 HA PHE 53 -3.453 -7.007 -15.463 1.00 0.00 H -ATOM 829 CB PHE 53 -3.723 -5.101 -14.866 1.00 0.00 C -ATOM 830 HB2 PHE 53 -4.444 -4.323 -15.113 1.00 0.00 H -ATOM 831 HB3 PHE 53 -3.754 -5.199 -13.780 1.00 0.00 H -ATOM 832 CG PHE 53 -2.336 -4.587 -15.358 1.00 0.00 C -ATOM 833 CD1 PHE 53 -1.162 -5.121 -14.811 1.00 0.00 C -ATOM 834 HD1 PHE 53 -1.218 -5.954 -14.127 1.00 0.00 H -ATOM 835 CE1 PHE 53 0.086 -4.678 -15.221 1.00 0.00 C -ATOM 836 HE1 PHE 53 1.034 -5.003 -14.816 1.00 0.00 H -ATOM 837 CZ PHE 53 0.142 -3.621 -16.159 1.00 0.00 C -ATOM 838 HZ PHE 53 1.135 -3.296 -16.430 1.00 0.00 H -ATOM 839 CE2 PHE 53 -0.967 -3.078 -16.716 1.00 0.00 C -ATOM 840 HE2 PHE 53 -0.844 -2.293 -17.448 1.00 0.00 H -ATOM 841 CD2 PHE 53 -2.232 -3.523 -16.308 1.00 0.00 C -ATOM 842 HD2 PHE 53 -3.111 -3.074 -16.747 1.00 0.00 H -ATOM 843 C PHE 53 -5.562 -6.805 -14.975 1.00 0.00 C -ATOM 844 O PHE 53 -6.591 -6.816 -15.632 1.00 0.00 O -ATOM 845 N ASP 54 -5.580 -7.176 -13.705 1.00 0.00 N -ATOM 846 H ASP 54 -4.726 -7.232 -13.167 1.00 0.00 H -ATOM 847 CA ASP 54 -6.643 -8.018 -13.125 1.00 0.00 C -ATOM 848 HA ASP 54 -6.883 -8.870 -13.760 1.00 0.00 H -ATOM 849 CB ASP 54 -6.243 -8.592 -11.776 1.00 0.00 C -ATOM 850 HB2 ASP 54 -6.014 -7.773 -11.095 1.00 0.00 H -ATOM 851 HB3 ASP 54 -7.139 -9.020 -11.325 1.00 0.00 H -ATOM 852 CG ASP 54 -5.099 -9.602 -11.859 1.00 0.00 C -ATOM 853 OD1 ASP 54 -4.736 -10.063 -12.986 1.00 0.00 O -ATOM 854 OD2 ASP 54 -4.579 -9.997 -10.763 1.00 0.00 O -ATOM 855 C ASP 54 -7.905 -7.278 -13.043 1.00 0.00 C -ATOM 856 O ASP 54 -8.968 -7.872 -13.316 1.00 0.00 O -ATOM 857 N MET 55 -7.877 -5.978 -12.777 1.00 0.00 N -ATOM 858 H MET 55 -6.924 -5.738 -12.544 1.00 0.00 H -ATOM 859 CA MET 55 -8.829 -4.922 -13.087 1.00 0.00 C -ATOM 860 HA MET 55 -9.534 -5.238 -13.856 1.00 0.00 H -ATOM 861 CB MET 55 -9.720 -4.498 -11.889 1.00 0.00 C -ATOM 862 HB2 MET 55 -10.188 -5.385 -11.462 1.00 0.00 H -ATOM 863 HB3 MET 55 -9.031 -4.179 -11.106 1.00 0.00 H -ATOM 864 CG MET 55 -10.769 -3.428 -12.137 1.00 0.00 C -ATOM 865 HG2 MET 55 -11.306 -3.295 -11.197 1.00 0.00 H -ATOM 866 HG3 MET 55 -10.351 -2.456 -12.399 1.00 0.00 H -ATOM 867 SD MET 55 -11.952 -3.916 -13.468 1.00 0.00 S -ATOM 868 CE MET 55 -12.869 -2.466 -13.418 1.00 0.00 C -ATOM 869 HE1 MET 55 -13.462 -2.421 -14.331 1.00 0.00 H -ATOM 870 HE2 MET 55 -13.470 -2.443 -12.508 1.00 0.00 H -ATOM 871 HE3 MET 55 -12.185 -1.620 -13.363 1.00 0.00 H -ATOM 872 C MET 55 -8.166 -3.665 -13.620 1.00 0.00 C -ATOM 873 O MET 55 -7.008 -3.429 -13.285 1.00 0.00 O -ATOM 874 N VAL 56 -8.798 -2.878 -14.495 1.00 0.00 N -ATOM 875 H VAL 56 -9.697 -3.251 -14.762 1.00 0.00 H -ATOM 876 CA VAL 56 -8.268 -1.582 -14.982 1.00 0.00 C -ATOM 877 HA VAL 56 -7.405 -1.291 -14.383 1.00 0.00 H -ATOM 878 CB VAL 56 -7.908 -1.481 -16.424 1.00 0.00 C -ATOM 879 HB VAL 56 -8.718 -1.911 -17.013 1.00 0.00 H -ATOM 880 CG1 VAL 56 -7.608 -0.049 -16.840 1.00 0.00 C -ATOM 881 HG11 VAL 56 -8.371 0.711 -16.671 1.00 0.00 H -ATOM 882 HG12 VAL 56 -6.727 0.397 -16.380 1.00 0.00 H -ATOM 883 HG13 VAL 56 -7.544 -0.038 -17.927 1.00 0.00 H -ATOM 884 CG2 VAL 56 -6.609 -2.232 -16.642 1.00 0.00 C -ATOM 885 HG21 VAL 56 -5.712 -1.803 -16.195 1.00 0.00 H -ATOM 886 HG22 VAL 56 -6.706 -3.273 -16.330 1.00 0.00 H -ATOM 887 HG23 VAL 56 -6.455 -2.312 -17.718 1.00 0.00 H -ATOM 888 C VAL 56 -9.360 -0.574 -14.568 1.00 0.00 C -ATOM 889 O VAL 56 -10.392 -0.515 -15.248 1.00 0.00 O -ATOM 890 N PHE 57 -9.123 0.232 -13.568 1.00 0.00 N -ATOM 891 H PHE 57 -8.232 0.114 -13.108 1.00 0.00 H -ATOM 892 CA PHE 57 -9.862 1.392 -13.138 1.00 0.00 C -ATOM 893 HA PHE 57 -10.907 1.167 -13.348 1.00 0.00 H -ATOM 894 CB PHE 57 -9.696 1.577 -11.636 1.00 0.00 C -ATOM 895 HB2 PHE 57 -8.675 1.917 -11.469 1.00 0.00 H -ATOM 896 HB3 PHE 57 -10.326 2.413 -11.329 1.00 0.00 H -ATOM 897 CG PHE 57 -9.991 0.328 -10.770 1.00 0.00 C -ATOM 898 CD1 PHE 57 -11.297 -0.137 -10.586 1.00 0.00 C -ATOM 899 HD1 PHE 57 -12.109 0.194 -11.216 1.00 0.00 H -ATOM 900 CE1 PHE 57 -11.647 -1.081 -9.644 1.00 0.00 C -ATOM 901 HE1 PHE 57 -12.675 -1.315 -9.402 1.00 0.00 H -ATOM 902 CZ PHE 57 -10.573 -1.526 -8.817 1.00 0.00 C -ATOM 903 HZ PHE 57 -10.810 -2.243 -8.047 1.00 0.00 H -ATOM 904 CE2 PHE 57 -9.230 -1.143 -9.070 1.00 0.00 C -ATOM 905 HE2 PHE 57 -8.434 -1.557 -8.471 1.00 0.00 H -ATOM 906 CD2 PHE 57 -8.930 -0.217 -10.082 1.00 0.00 C -ATOM 907 HD2 PHE 57 -7.892 0.059 -10.196 1.00 0.00 H -ATOM 908 C PHE 57 -9.509 2.626 -13.918 1.00 0.00 C -ATOM 909 O PHE 57 -8.513 3.261 -13.680 1.00 0.00 O -ATOM 910 N GLY 58 -10.385 3.052 -14.782 1.00 0.00 N -ATOM 911 H GLY 58 -11.270 2.567 -14.832 1.00 0.00 H -ATOM 912 CA GLY 58 -10.310 4.349 -15.474 1.00 0.00 C -ATOM 913 HA2 GLY 58 -9.383 4.378 -16.045 1.00 0.00 H -ATOM 914 HA3 GLY 58 -11.176 4.231 -16.127 1.00 0.00 H -ATOM 915 C GLY 58 -10.566 5.541 -14.538 1.00 0.00 C -ATOM 916 O GLY 58 -10.865 5.294 -13.422 1.00 0.00 O -ATOM 917 N ALA 59 -10.458 6.819 -15.036 1.00 0.00 N -ATOM 918 H ALA 59 -10.210 6.940 -16.007 1.00 0.00 H -ATOM 919 CA ALA 59 -10.505 7.990 -14.163 1.00 0.00 C -ATOM 920 HA ALA 59 -9.855 7.887 -13.294 1.00 0.00 H -ATOM 921 CB ALA 59 -9.951 9.178 -14.956 1.00 0.00 C -ATOM 922 HB1 ALA 59 -10.353 9.264 -15.966 1.00 0.00 H -ATOM 923 HB2 ALA 59 -9.939 10.068 -14.327 1.00 0.00 H -ATOM 924 HB3 ALA 59 -8.891 8.987 -15.112 1.00 0.00 H -ATOM 925 C ALA 59 -11.966 8.219 -13.559 1.00 0.00 C -ATOM 926 O ALA 59 -12.067 8.939 -12.533 1.00 0.00 O -ATOM 927 N SER 60 -12.997 7.627 -14.131 1.00 0.00 N -ATOM 928 H SER 60 -12.804 6.995 -14.895 1.00 0.00 H -ATOM 929 CA SER 60 -14.390 7.702 -13.634 1.00 0.00 C -ATOM 930 HA SER 60 -14.545 8.755 -13.398 1.00 0.00 H -ATOM 931 CB SER 60 -15.307 7.102 -14.741 1.00 0.00 C -ATOM 932 HB2 SER 60 -15.229 6.016 -14.801 1.00 0.00 H -ATOM 933 HB3 SER 60 -16.304 7.418 -14.433 1.00 0.00 H -ATOM 934 OG SER 60 -15.163 7.778 -15.948 1.00 0.00 O -ATOM 935 HG SER 60 -15.625 8.618 -15.898 1.00 0.00 H -ATOM 936 C SER 60 -14.609 6.974 -12.334 1.00 0.00 C -ATOM 937 O SER 60 -15.567 7.288 -11.614 1.00 0.00 O -ATOM 938 N THR 61 -13.839 5.918 -12.022 1.00 0.00 N -ATOM 939 H THR 61 -13.294 5.564 -12.797 1.00 0.00 H -ATOM 940 CA THR 61 -13.938 5.058 -10.859 1.00 0.00 C -ATOM 941 HA THR 61 -14.801 4.403 -10.983 1.00 0.00 H -ATOM 942 CB THR 61 -12.777 4.045 -10.848 1.00 0.00 C -ATOM 943 HB THR 61 -11.827 4.562 -10.715 1.00 0.00 H -ATOM 944 CG2 THR 61 -12.885 3.103 -9.713 1.00 0.00 C -ATOM 945 HG21 THR 61 -13.869 2.637 -9.772 1.00 0.00 H -ATOM 946 HG22 THR 61 -12.180 2.286 -9.869 1.00 0.00 H -ATOM 947 HG23 THR 61 -12.807 3.581 -8.736 1.00 0.00 H -ATOM 948 OG1 THR 61 -12.867 3.168 -12.006 1.00 0.00 O -ATOM 949 HG1 THR 61 -12.947 3.719 -12.789 1.00 0.00 H -ATOM 950 C THR 61 -13.956 5.806 -9.531 1.00 0.00 C -ATOM 951 O THR 61 -12.898 6.117 -8.978 1.00 0.00 O -ATOM 952 N LYS 62 -15.153 5.909 -8.945 1.00 0.00 N -ATOM 953 H LYS 62 -15.921 5.421 -9.382 1.00 0.00 H -ATOM 954 CA LYS 62 -15.275 6.486 -7.560 1.00 0.00 C -ATOM 955 HA LYS 62 -14.773 7.452 -7.505 1.00 0.00 H -ATOM 956 CB LYS 62 -16.756 6.843 -7.230 1.00 0.00 C -ATOM 957 HB2 LYS 62 -16.939 6.836 -6.155 1.00 0.00 H -ATOM 958 HB3 LYS 62 -17.069 7.821 -7.593 1.00 0.00 H -ATOM 959 CG LYS 62 -17.774 5.855 -7.834 1.00 0.00 C -ATOM 960 HG2 LYS 62 -17.821 6.238 -8.854 1.00 0.00 H -ATOM 961 HG3 LYS 62 -17.453 4.831 -7.648 1.00 0.00 H -ATOM 962 CD LYS 62 -19.188 6.030 -7.242 1.00 0.00 C -ATOM 963 HD2 LYS 62 -19.170 6.013 -6.153 1.00 0.00 H -ATOM 964 HD3 LYS 62 -19.489 7.046 -7.501 1.00 0.00 H -ATOM 965 CE LYS 62 -20.277 5.149 -7.875 1.00 0.00 C -ATOM 966 HE2 LYS 62 -20.172 5.251 -8.955 1.00 0.00 H -ATOM 967 HE3 LYS 62 -20.204 4.107 -7.563 1.00 0.00 H -ATOM 968 NZ LYS 62 -21.664 5.610 -7.533 1.00 0.00 N -ATOM 969 HZ1 LYS 62 -22.389 5.172 -8.086 1.00 0.00 H -ATOM 970 HZ2 LYS 62 -21.813 5.449 -6.547 1.00 0.00 H -ATOM 971 HZ3 LYS 62 -21.759 6.590 -7.760 1.00 0.00 H -ATOM 972 C LYS 62 -14.598 5.507 -6.516 1.00 0.00 C -ATOM 973 O LYS 62 -14.573 4.267 -6.712 1.00 0.00 O -ATOM 974 N GLN 63 -14.102 6.030 -5.314 1.00 0.00 N -ATOM 975 H GLN 63 -14.311 6.992 -5.087 1.00 0.00 H -ATOM 976 CA GLN 63 -13.343 5.301 -4.246 1.00 0.00 C -ATOM 977 HA GLN 63 -12.395 4.929 -4.633 1.00 0.00 H -ATOM 978 CB GLN 63 -13.224 6.261 -2.997 1.00 0.00 C -ATOM 979 HB2 GLN 63 -14.243 6.551 -2.735 1.00 0.00 H -ATOM 980 HB3 GLN 63 -12.917 5.699 -2.116 1.00 0.00 H -ATOM 981 CG GLN 63 -12.372 7.527 -3.083 1.00 0.00 C -ATOM 982 HG2 GLN 63 -12.579 7.929 -4.074 1.00 0.00 H -ATOM 983 HG3 GLN 63 -12.786 8.243 -2.374 1.00 0.00 H -ATOM 984 CD GLN 63 -10.874 7.252 -3.006 1.00 0.00 C -ATOM 985 OE1 GLN 63 -10.280 6.608 -3.829 1.00 0.00 O -ATOM 986 NE2 GLN 63 -10.195 7.699 -1.976 1.00 0.00 N -ATOM 987 HE21 GLN 63 -9.192 7.677 -2.091 1.00 0.00 H -ATOM 988 HE22 GLN 63 -10.534 8.387 -1.319 1.00 0.00 H -ATOM 989 C GLN 63 -14.046 4.106 -3.724 1.00 0.00 C -ATOM 990 O GLN 63 -13.411 3.132 -3.360 1.00 0.00 O -ATOM 991 N ILE 64 -15.372 4.074 -3.845 1.00 0.00 N -ATOM 992 H ILE 64 -15.817 4.825 -4.353 1.00 0.00 H -ATOM 993 CA ILE 64 -16.159 2.957 -3.422 1.00 0.00 C -ATOM 994 HA ILE 64 -15.775 2.688 -2.438 1.00 0.00 H -ATOM 995 CB ILE 64 -17.686 3.235 -3.163 1.00 0.00 C -ATOM 996 HB ILE 64 -17.690 4.004 -2.389 1.00 0.00 H -ATOM 997 CG2 ILE 64 -18.207 3.674 -4.574 1.00 0.00 C -ATOM 998 HG21 ILE 64 -17.663 4.513 -5.009 1.00 0.00 H -ATOM 999 HG22 ILE 64 -18.238 2.781 -5.198 1.00 0.00 H -ATOM 1000 HG23 ILE 64 -19.189 4.094 -4.359 1.00 0.00 H -ATOM 1001 CG1 ILE 64 -18.571 2.045 -2.740 1.00 0.00 C -ATOM 1002 HG12 ILE 64 -19.506 2.544 -2.490 1.00 0.00 H -ATOM 1003 HG13 ILE 64 -18.751 1.332 -3.546 1.00 0.00 H -ATOM 1004 CD1 ILE 64 -18.098 1.306 -1.501 1.00 0.00 C -ATOM 1005 HD11 ILE 64 -18.839 0.734 -0.943 1.00 0.00 H -ATOM 1006 HD12 ILE 64 -17.223 0.688 -1.702 1.00 0.00 H -ATOM 1007 HD13 ILE 64 -17.734 2.031 -0.774 1.00 0.00 H -ATOM 1008 C ILE 64 -15.968 1.658 -4.293 1.00 0.00 C -ATOM 1009 O ILE 64 -15.832 0.593 -3.699 1.00 0.00 O -ATOM 1010 N ASP 65 -15.751 1.792 -5.597 1.00 0.00 N -ATOM 1011 H ASP 65 -15.840 2.697 -6.036 1.00 0.00 H -ATOM 1012 CA ASP 65 -15.669 0.633 -6.547 1.00 0.00 C -ATOM 1013 HA ASP 65 -16.426 -0.082 -6.223 1.00 0.00 H -ATOM 1014 CB ASP 65 -16.052 1.100 -7.981 1.00 0.00 C -ATOM 1015 HB2 ASP 65 -15.561 2.046 -8.210 1.00 0.00 H -ATOM 1016 HB3 ASP 65 -15.675 0.405 -8.733 1.00 0.00 H -ATOM 1017 CG ASP 65 -17.547 1.274 -8.240 1.00 0.00 C -ATOM 1018 OD1 ASP 65 -17.924 1.750 -9.316 1.00 0.00 O -ATOM 1019 OD2 ASP 65 -18.382 0.794 -7.381 1.00 0.00 O -ATOM 1020 C ASP 65 -14.286 -0.051 -6.459 1.00 0.00 C -ATOM 1021 O ASP 65 -14.172 -1.301 -6.584 1.00 0.00 O -ATOM 1022 N VAL 66 -13.314 0.712 -5.941 1.00 0.00 N -ATOM 1023 H VAL 66 -13.478 1.664 -5.646 1.00 0.00 H -ATOM 1024 CA VAL 66 -12.006 0.172 -5.493 1.00 0.00 C -ATOM 1025 HA VAL 66 -11.730 -0.485 -6.318 1.00 0.00 H -ATOM 1026 CB VAL 66 -10.857 1.178 -5.244 1.00 0.00 C -ATOM 1027 HB VAL 66 -10.810 1.522 -4.211 1.00 0.00 H -ATOM 1028 CG1 VAL 66 -9.473 0.447 -5.451 1.00 0.00 C -ATOM 1029 HG11 VAL 66 -9.141 -0.015 -4.522 1.00 0.00 H -ATOM 1030 HG12 VAL 66 -9.574 -0.299 -6.239 1.00 0.00 H -ATOM 1031 HG13 VAL 66 -8.638 1.108 -5.685 1.00 0.00 H -ATOM 1032 CG2 VAL 66 -10.862 2.419 -6.191 1.00 0.00 C -ATOM 1033 HG21 VAL 66 -10.030 3.039 -5.856 1.00 0.00 H -ATOM 1034 HG22 VAL 66 -10.762 2.127 -7.236 1.00 0.00 H -ATOM 1035 HG23 VAL 66 -11.820 2.935 -6.247 1.00 0.00 H -ATOM 1036 C VAL 66 -12.157 -0.721 -4.299 1.00 0.00 C -ATOM 1037 O VAL 66 -11.536 -1.761 -4.249 1.00 0.00 O -ATOM 1038 N TYR 67 -12.993 -0.306 -3.367 1.00 0.00 N -ATOM 1039 H TYR 67 -13.514 0.536 -3.564 1.00 0.00 H -ATOM 1040 CA TYR 67 -13.259 -1.077 -2.134 1.00 0.00 C -ATOM 1041 HA TYR 67 -12.364 -1.533 -1.711 1.00 0.00 H -ATOM 1042 CB TYR 67 -13.838 -0.118 -1.029 1.00 0.00 C -ATOM 1043 HB2 TYR 67 -13.081 0.661 -0.935 1.00 0.00 H -ATOM 1044 HB3 TYR 67 -14.846 0.199 -1.298 1.00 0.00 H -ATOM 1045 CG TYR 67 -13.980 -0.770 0.340 1.00 0.00 C -ATOM 1046 CD1 TYR 67 -15.230 -1.208 0.820 1.00 0.00 C -ATOM 1047 HD1 TYR 67 -16.088 -1.063 0.180 1.00 0.00 H -ATOM 1048 CE1 TYR 67 -15.264 -1.963 2.040 1.00 0.00 C -ATOM 1049 HE1 TYR 67 -16.175 -2.363 2.459 1.00 0.00 H -ATOM 1050 CZ TYR 67 -14.061 -2.216 2.720 1.00 0.00 C -ATOM 1051 OH TYR 67 -14.075 -2.947 3.825 1.00 0.00 O -ATOM 1052 HH TYR 67 -14.943 -3.329 3.972 1.00 0.00 H -ATOM 1053 CE2 TYR 67 -12.872 -1.547 2.343 1.00 0.00 C -ATOM 1054 HE2 TYR 67 -11.977 -1.684 2.933 1.00 0.00 H -ATOM 1055 CD2 TYR 67 -12.845 -0.829 1.148 1.00 0.00 C -ATOM 1056 HD2 TYR 67 -11.930 -0.297 0.932 1.00 0.00 H -ATOM 1057 C TYR 67 -14.060 -2.319 -2.430 1.00 0.00 C -ATOM 1058 O TYR 67 -13.591 -3.427 -2.262 1.00 0.00 O -ATOM 1059 N ARG 68 -15.217 -2.158 -3.139 1.00 0.00 N -ATOM 1060 H ARG 68 -15.384 -1.213 -3.451 1.00 0.00 H -ATOM 1061 CA ARG 68 -16.124 -3.262 -3.570 1.00 0.00 C -ATOM 1062 HA ARG 68 -16.589 -3.698 -2.686 1.00 0.00 H -ATOM 1063 CB ARG 68 -17.259 -2.725 -4.503 1.00 0.00 C -ATOM 1064 HB2 ARG 68 -16.832 -2.093 -5.282 1.00 0.00 H -ATOM 1065 HB3 ARG 68 -17.696 -3.628 -4.929 1.00 0.00 H -ATOM 1066 CG ARG 68 -18.280 -1.988 -3.663 1.00 0.00 C -ATOM 1067 HG2 ARG 68 -18.642 -2.709 -2.929 1.00 0.00 H -ATOM 1068 HG3 ARG 68 -17.897 -1.161 -3.063 1.00 0.00 H -ATOM 1069 CD ARG 68 -19.445 -1.388 -4.488 1.00 0.00 C -ATOM 1070 HD2 ARG 68 -18.959 -0.860 -5.309 1.00 0.00 H -ATOM 1071 HD3 ARG 68 -19.964 -2.280 -4.837 1.00 0.00 H -ATOM 1072 NE ARG 68 -20.320 -0.487 -3.742 1.00 0.00 N -ATOM 1073 HE ARG 68 -20.268 0.450 -4.117 1.00 0.00 H -ATOM 1074 CZ ARG 68 -21.200 -0.834 -2.826 1.00 0.00 C -ATOM 1075 NH1 ARG 68 -21.432 -2.028 -2.369 1.00 0.00 N -ATOM 1076 HH11 ARG 68 -20.869 -2.829 -2.619 1.00 0.00 H -ATOM 1077 HH12 ARG 68 -22.260 -2.209 -1.821 1.00 0.00 H -ATOM 1078 NH2 ARG 68 -21.962 0.048 -2.358 1.00 0.00 N -ATOM 1079 HH21 ARG 68 -21.875 1.001 -2.682 1.00 0.00 H -ATOM 1080 HH22 ARG 68 -22.680 -0.272 -1.724 1.00 0.00 H -ATOM 1081 C ARG 68 -15.388 -4.354 -4.282 1.00 0.00 C -ATOM 1082 O ARG 68 -15.657 -5.558 -4.058 1.00 0.00 O -ATOM 1083 N SER 69 -14.515 -3.952 -5.203 1.00 0.00 N -ATOM 1084 H SER 69 -14.354 -2.957 -5.278 1.00 0.00 H -ATOM 1085 CA SER 69 -13.651 -4.830 -6.010 1.00 0.00 C -ATOM 1086 HA SER 69 -14.206 -5.713 -6.326 1.00 0.00 H -ATOM 1087 CB SER 69 -12.985 -4.103 -7.195 1.00 0.00 C -ATOM 1088 HB2 SER 69 -13.820 -3.697 -7.768 1.00 0.00 H -ATOM 1089 HB3 SER 69 -12.394 -3.252 -6.857 1.00 0.00 H -ATOM 1090 OG SER 69 -12.070 -4.940 -7.928 1.00 0.00 O -ATOM 1091 HG SER 69 -12.586 -5.145 -8.711 1.00 0.00 H -ATOM 1092 C SER 69 -12.519 -5.450 -5.177 1.00 0.00 C -ATOM 1093 O SER 69 -12.514 -6.658 -4.869 1.00 0.00 O -ATOM 1094 N VAL 70 -11.532 -4.622 -4.779 1.00 0.00 N -ATOM 1095 H VAL 70 -11.603 -3.629 -4.946 1.00 0.00 H -ATOM 1096 CA VAL 70 -10.267 -5.041 -4.153 1.00 0.00 C -ATOM 1097 HA VAL 70 -9.773 -5.735 -4.835 1.00 0.00 H -ATOM 1098 CB VAL 70 -9.175 -3.899 -4.178 1.00 0.00 C -ATOM 1099 HB VAL 70 -9.557 -3.141 -3.492 1.00 0.00 H -ATOM 1100 CG1 VAL 70 -7.815 -4.428 -3.708 1.00 0.00 C -ATOM 1101 HG11 VAL 70 -7.539 -5.326 -4.262 1.00 0.00 H -ATOM 1102 HG12 VAL 70 -7.016 -3.701 -3.841 1.00 0.00 H -ATOM 1103 HG13 VAL 70 -7.765 -4.654 -2.643 1.00 0.00 H -ATOM 1104 CG2 VAL 70 -8.994 -3.260 -5.552 1.00 0.00 C -ATOM 1105 HG21 VAL 70 -8.128 -2.608 -5.436 1.00 0.00 H -ATOM 1106 HG22 VAL 70 -8.697 -4.047 -6.245 1.00 0.00 H -ATOM 1107 HG23 VAL 70 -9.843 -2.666 -5.890 1.00 0.00 H -ATOM 1108 C VAL 70 -10.368 -5.576 -2.742 1.00 0.00 C -ATOM 1109 O VAL 70 -9.826 -6.671 -2.525 1.00 0.00 O -ATOM 1110 N VAL 71 -10.936 -4.847 -1.771 1.00 0.00 N -ATOM 1111 H VAL 71 -11.276 -3.938 -2.053 1.00 0.00 H -ATOM 1112 CA VAL 71 -10.697 -5.010 -0.318 1.00 0.00 C -ATOM 1113 HA VAL 71 -9.738 -5.496 -0.141 1.00 0.00 H -ATOM 1114 CB VAL 71 -10.720 -3.668 0.401 1.00 0.00 C -ATOM 1115 HB VAL 71 -11.742 -3.304 0.506 1.00 0.00 H -ATOM 1116 CG1 VAL 71 -10.068 -3.809 1.810 1.00 0.00 C -ATOM 1117 HG11 VAL 71 -9.021 -4.109 1.749 1.00 0.00 H -ATOM 1118 HG12 VAL 71 -10.082 -2.805 2.236 1.00 0.00 H -ATOM 1119 HG13 VAL 71 -10.673 -4.448 2.452 1.00 0.00 H -ATOM 1120 CG2 VAL 71 -9.913 -2.616 -0.412 1.00 0.00 C -ATOM 1121 HG21 VAL 71 -10.245 -2.339 -1.413 1.00 0.00 H -ATOM 1122 HG22 VAL 71 -10.202 -1.692 0.089 1.00 0.00 H -ATOM 1123 HG23 VAL 71 -8.834 -2.756 -0.366 1.00 0.00 H -ATOM 1124 C VAL 71 -11.657 -5.989 0.357 1.00 0.00 C -ATOM 1125 O VAL 71 -11.309 -6.914 1.107 1.00 0.00 O -ATOM 1126 N CYS 72 -12.937 -5.931 -0.047 1.00 0.00 N -ATOM 1127 H CYS 72 -13.169 -5.244 -0.750 1.00 0.00 H -ATOM 1128 CA CYS 72 -13.975 -6.786 0.509 1.00 0.00 C -ATOM 1129 HA CYS 72 -14.036 -6.535 1.568 1.00 0.00 H -ATOM 1130 CB CYS 72 -15.395 -6.355 -0.086 1.00 0.00 C -ATOM 1131 HB2 CYS 72 -15.264 -6.428 -1.165 1.00 0.00 H -ATOM 1132 HB3 CYS 72 -16.113 -7.024 0.391 1.00 0.00 H -ATOM 1133 SG CYS 72 -15.683 -4.618 0.116 1.00 0.00 S -ATOM 1134 HG CYS 72 -16.175 -4.545 1.357 1.00 0.00 H -ATOM 1135 C CYS 72 -13.746 -8.309 0.429 1.00 0.00 C -ATOM 1136 O CYS 72 -14.077 -8.945 1.431 1.00 0.00 O -ATOM 1137 N PRO 73 -13.222 -8.913 -0.686 1.00 0.00 N -ATOM 1138 CD PRO 73 -13.024 -8.281 -2.007 1.00 0.00 C -ATOM 1139 HD2 PRO 73 -12.113 -7.681 -2.011 1.00 0.00 H -ATOM 1140 HD3 PRO 73 -13.862 -7.648 -2.298 1.00 0.00 H -ATOM 1141 CG PRO 73 -12.736 -9.406 -3.004 1.00 0.00 C -ATOM 1142 HG2 PRO 73 -11.687 -9.385 -3.297 1.00 0.00 H -ATOM 1143 HG3 PRO 73 -13.327 -9.280 -3.911 1.00 0.00 H -ATOM 1144 CB PRO 73 -13.078 -10.728 -2.290 1.00 0.00 C -ATOM 1145 HB2 PRO 73 -12.419 -11.559 -2.538 1.00 0.00 H -ATOM 1146 HB3 PRO 73 -14.098 -10.947 -2.604 1.00 0.00 H -ATOM 1147 CA PRO 73 -13.075 -10.340 -0.803 1.00 0.00 C -ATOM 1148 HA PRO 73 -13.879 -10.882 -0.304 1.00 0.00 H -ATOM 1149 C PRO 73 -11.751 -10.842 -0.168 1.00 0.00 C -ATOM 1150 O PRO 73 -11.506 -11.999 0.157 1.00 0.00 O -ATOM 1151 N ILE 74 -10.787 -9.927 0.011 1.00 0.00 N -ATOM 1152 H ILE 74 -10.856 -8.989 -0.355 1.00 0.00 H -ATOM 1153 CA ILE 74 -9.618 -10.162 0.881 1.00 0.00 C -ATOM 1154 HA ILE 74 -9.323 -11.202 0.744 1.00 0.00 H -ATOM 1155 CB ILE 74 -8.440 -9.210 0.529 1.00 0.00 C -ATOM 1156 HB ILE 74 -8.877 -8.229 0.716 1.00 0.00 H -ATOM 1157 CG2 ILE 74 -7.141 -9.357 1.364 1.00 0.00 C -ATOM 1158 HG21 ILE 74 -7.449 -9.425 2.407 1.00 0.00 H -ATOM 1159 HG22 ILE 74 -6.642 -10.293 1.112 1.00 0.00 H -ATOM 1160 HG23 ILE 74 -6.439 -8.539 1.202 1.00 0.00 H -ATOM 1161 CG1 ILE 74 -8.117 -9.222 -0.980 1.00 0.00 C -ATOM 1162 HG12 ILE 74 -7.501 -10.096 -1.190 1.00 0.00 H -ATOM 1163 HG13 ILE 74 -9.046 -9.241 -1.550 1.00 0.00 H -ATOM 1164 CD1 ILE 74 -7.341 -7.964 -1.426 1.00 0.00 C -ATOM 1165 HD11 ILE 74 -7.840 -7.080 -1.032 1.00 0.00 H -ATOM 1166 HD12 ILE 74 -6.302 -8.026 -1.103 1.00 0.00 H -ATOM 1167 HD13 ILE 74 -7.244 -7.822 -2.502 1.00 0.00 H -ATOM 1168 C ILE 74 -9.944 -10.056 2.347 1.00 0.00 C -ATOM 1169 O ILE 74 -9.590 -10.851 3.150 1.00 0.00 O -ATOM 1170 N LEU 75 -10.724 -9.087 2.804 1.00 0.00 N -ATOM 1171 H LEU 75 -11.056 -8.423 2.120 1.00 0.00 H -ATOM 1172 CA LEU 75 -11.319 -8.976 4.169 1.00 0.00 C -ATOM 1173 HA LEU 75 -10.486 -8.882 4.865 1.00 0.00 H -ATOM 1174 CB LEU 75 -12.172 -7.713 4.282 1.00 0.00 C -ATOM 1175 HB2 LEU 75 -11.571 -6.909 3.856 1.00 0.00 H -ATOM 1176 HB3 LEU 75 -13.004 -7.685 3.579 1.00 0.00 H -ATOM 1177 CG LEU 75 -12.680 -7.292 5.602 1.00 0.00 C -ATOM 1178 HG LEU 75 -13.535 -7.908 5.885 1.00 0.00 H -ATOM 1179 CD1 LEU 75 -11.526 -7.034 6.634 1.00 0.00 C -ATOM 1180 HD11 LEU 75 -11.015 -7.995 6.674 1.00 0.00 H -ATOM 1181 HD12 LEU 75 -10.888 -6.278 6.175 1.00 0.00 H -ATOM 1182 HD13 LEU 75 -11.890 -6.824 7.639 1.00 0.00 H -ATOM 1183 CD2 LEU 75 -13.307 -5.900 5.426 1.00 0.00 C -ATOM 1184 HD21 LEU 75 -14.056 -5.863 4.634 1.00 0.00 H -ATOM 1185 HD22 LEU 75 -13.683 -5.510 6.371 1.00 0.00 H -ATOM 1186 HD23 LEU 75 -12.536 -5.209 5.082 1.00 0.00 H -ATOM 1187 C LEU 75 -12.046 -10.221 4.576 1.00 0.00 C -ATOM 1188 O LEU 75 -11.957 -10.625 5.771 1.00 0.00 O -ATOM 1189 N ASP 76 -12.655 -10.932 3.619 1.00 0.00 N -ATOM 1190 H ASP 76 -12.787 -10.519 2.707 1.00 0.00 H -ATOM 1191 CA ASP 76 -13.202 -12.261 3.854 1.00 0.00 C -ATOM 1192 HA ASP 76 -13.738 -12.081 4.786 1.00 0.00 H -ATOM 1193 CB ASP 76 -14.276 -12.673 2.807 1.00 0.00 C -ATOM 1194 HB2 ASP 76 -14.999 -11.859 2.731 1.00 0.00 H -ATOM 1195 HB3 ASP 76 -13.806 -12.793 1.831 1.00 0.00 H -ATOM 1196 CG ASP 76 -15.071 -13.920 3.315 1.00 0.00 C -ATOM 1197 OD1 ASP 76 -15.651 -13.869 4.411 1.00 0.00 O -ATOM 1198 OD2 ASP 76 -15.126 -14.995 2.663 1.00 0.00 O -ATOM 1199 C ASP 76 -12.249 -13.484 3.916 1.00 0.00 C -ATOM 1200 O ASP 76 -12.383 -14.352 4.739 1.00 0.00 O -ATOM 1201 N GLU 77 -11.190 -13.456 3.155 1.00 0.00 N -ATOM 1202 H GLU 77 -11.097 -12.599 2.630 1.00 0.00 H -ATOM 1203 CA GLU 77 -10.149 -14.487 3.120 1.00 0.00 C -ATOM 1204 HA GLU 77 -10.662 -15.448 3.166 1.00 0.00 H -ATOM 1205 CB GLU 77 -9.451 -14.296 1.734 1.00 0.00 C -ATOM 1206 HB2 GLU 77 -10.251 -14.301 0.994 1.00 0.00 H -ATOM 1207 HB3 GLU 77 -9.000 -13.304 1.774 1.00 0.00 H -ATOM 1208 CG GLU 77 -8.357 -15.331 1.298 1.00 0.00 C -ATOM 1209 HG2 GLU 77 -7.463 -15.143 1.895 1.00 0.00 H -ATOM 1210 HG3 GLU 77 -8.772 -16.315 1.514 1.00 0.00 H -ATOM 1211 CD GLU 77 -7.937 -15.125 -0.128 1.00 0.00 C -ATOM 1212 OE1 GLU 77 -8.825 -15.018 -0.995 1.00 0.00 O -ATOM 1213 OE2 GLU 77 -6.697 -15.072 -0.465 1.00 0.00 O -ATOM 1214 C GLU 77 -9.239 -14.373 4.354 1.00 0.00 C -ATOM 1215 O GLU 77 -8.864 -15.383 4.908 1.00 0.00 O -ATOM 1216 N VAL 78 -8.887 -13.153 4.874 1.00 0.00 N -ATOM 1217 H VAL 78 -9.225 -12.334 4.390 1.00 0.00 H -ATOM 1218 CA VAL 78 -8.211 -12.798 6.148 1.00 0.00 C -ATOM 1219 HA VAL 78 -7.238 -13.284 6.209 1.00 0.00 H -ATOM 1220 CB VAL 78 -7.961 -11.283 6.184 1.00 0.00 C -ATOM 1221 HB VAL 78 -8.923 -10.806 5.994 1.00 0.00 H -ATOM 1222 CG1 VAL 78 -7.575 -10.664 7.527 1.00 0.00 C -ATOM 1223 HG11 VAL 78 -8.442 -10.464 8.156 1.00 0.00 H -ATOM 1224 HG12 VAL 78 -6.980 -11.373 8.103 1.00 0.00 H -ATOM 1225 HG13 VAL 78 -6.936 -9.789 7.406 1.00 0.00 H -ATOM 1226 CG2 VAL 78 -6.881 -10.947 5.063 1.00 0.00 C -ATOM 1227 HG21 VAL 78 -5.913 -11.340 5.376 1.00 0.00 H -ATOM 1228 HG22 VAL 78 -7.181 -11.454 4.145 1.00 0.00 H -ATOM 1229 HG23 VAL 78 -6.845 -9.907 4.740 1.00 0.00 H -ATOM 1230 C VAL 78 -9.061 -13.242 7.377 1.00 0.00 C -ATOM 1231 O VAL 78 -8.485 -13.805 8.341 1.00 0.00 O -ATOM 1232 N ILE 79 -10.361 -13.137 7.424 1.00 0.00 N -ATOM 1233 H ILE 79 -10.850 -12.743 6.634 1.00 0.00 H -ATOM 1234 CA ILE 79 -11.181 -13.677 8.519 1.00 0.00 C -ATOM 1235 HA ILE 79 -10.731 -13.465 9.489 1.00 0.00 H -ATOM 1236 CB ILE 79 -12.515 -12.977 8.457 1.00 0.00 C -ATOM 1237 HB ILE 79 -12.720 -13.031 7.387 1.00 0.00 H -ATOM 1238 CG2 ILE 79 -13.759 -13.696 9.217 1.00 0.00 C -ATOM 1239 HG21 ILE 79 -14.048 -14.662 8.801 1.00 0.00 H -ATOM 1240 HG22 ILE 79 -13.539 -13.834 10.276 1.00 0.00 H -ATOM 1241 HG23 ILE 79 -14.684 -13.121 9.176 1.00 0.00 H -ATOM 1242 CG1 ILE 79 -12.318 -11.471 8.702 1.00 0.00 C -ATOM 1243 HG12 ILE 79 -11.988 -11.308 9.728 1.00 0.00 H -ATOM 1244 HG13 ILE 79 -11.576 -11.035 8.033 1.00 0.00 H -ATOM 1245 CD1 ILE 79 -13.642 -10.709 8.453 1.00 0.00 C -ATOM 1246 HD11 ILE 79 -14.223 -11.131 7.633 1.00 0.00 H -ATOM 1247 HD12 ILE 79 -14.301 -10.808 9.315 1.00 0.00 H -ATOM 1248 HD13 ILE 79 -13.451 -9.640 8.360 1.00 0.00 H -ATOM 1249 C ILE 79 -11.295 -15.184 8.513 1.00 0.00 C -ATOM 1250 O ILE 79 -11.377 -15.820 9.542 1.00 0.00 O -ATOM 1251 N MET 80 -11.234 -15.788 7.317 1.00 0.00 N -ATOM 1252 H MET 80 -10.896 -15.117 6.642 1.00 0.00 H -ATOM 1253 CA MET 80 -11.042 -17.243 7.083 1.00 0.00 C -ATOM 1254 HA MET 80 -11.817 -17.717 7.684 1.00 0.00 H -ATOM 1255 CB MET 80 -11.327 -17.489 5.663 1.00 0.00 C -ATOM 1256 HB2 MET 80 -12.123 -16.821 5.330 1.00 0.00 H -ATOM 1257 HB3 MET 80 -10.451 -17.098 5.146 1.00 0.00 H -ATOM 1258 CG MET 80 -11.799 -18.813 5.235 1.00 0.00 C -ATOM 1259 HG2 MET 80 -12.557 -19.195 5.918 1.00 0.00 H -ATOM 1260 HG3 MET 80 -12.170 -18.684 4.217 1.00 0.00 H -ATOM 1261 SD MET 80 -10.532 -20.078 5.141 1.00 0.00 S -ATOM 1262 CE MET 80 -11.551 -21.285 4.313 1.00 0.00 C -ATOM 1263 HE1 MET 80 -11.543 -21.140 3.232 1.00 0.00 H -ATOM 1264 HE2 MET 80 -10.990 -22.197 4.516 1.00 0.00 H -ATOM 1265 HE3 MET 80 -12.573 -21.297 4.690 1.00 0.00 H -ATOM 1266 C MET 80 -9.695 -17.734 7.571 1.00 0.00 C -ATOM 1267 O MET 80 -9.626 -18.874 8.087 1.00 0.00 O -ATOM 1268 N GLY 81 -8.658 -16.876 7.551 1.00 0.00 N -ATOM 1269 H GLY 81 -8.868 -16.015 7.066 1.00 0.00 H -ATOM 1270 CA GLY 81 -7.406 -17.028 8.282 1.00 0.00 C -ATOM 1271 HA2 GLY 81 -7.397 -16.330 9.120 1.00 0.00 H -ATOM 1272 HA3 GLY 81 -7.336 -18.094 8.500 1.00 0.00 H -ATOM 1273 C GLY 81 -6.126 -16.808 7.474 1.00 0.00 C -ATOM 1274 O GLY 81 -5.084 -16.768 8.142 1.00 0.00 O -ATOM 1275 N TYR 82 -6.156 -16.490 6.195 1.00 0.00 N -ATOM 1276 H TYR 82 -7.061 -16.598 5.760 1.00 0.00 H -ATOM 1277 CA TYR 82 -5.011 -16.176 5.365 1.00 0.00 C -ATOM 1278 HA TYR 82 -4.207 -16.866 5.621 1.00 0.00 H -ATOM 1279 CB TYR 82 -5.314 -16.357 3.857 1.00 0.00 C -ATOM 1280 HB2 TYR 82 -6.163 -15.766 3.515 1.00 0.00 H -ATOM 1281 HB3 TYR 82 -4.453 -16.057 3.260 1.00 0.00 H -ATOM 1282 CG TYR 82 -5.678 -17.777 3.585 1.00 0.00 C -ATOM 1283 CD1 TYR 82 -4.718 -18.764 3.242 1.00 0.00 C -ATOM 1284 HD1 TYR 82 -3.678 -18.481 3.306 1.00 0.00 H -ATOM 1285 CE1 TYR 82 -5.024 -20.057 2.921 1.00 0.00 C -ATOM 1286 HE1 TYR 82 -4.232 -20.758 2.702 1.00 0.00 H -ATOM 1287 CZ TYR 82 -6.358 -20.438 2.714 1.00 0.00 C -ATOM 1288 OH TYR 82 -6.619 -21.687 2.285 1.00 0.00 O -ATOM 1289 HH TYR 82 -5.869 -22.282 2.357 1.00 0.00 H -ATOM 1290 CE2 TYR 82 -7.423 -19.570 3.063 1.00 0.00 C -ATOM 1291 HE2 TYR 82 -8.444 -19.922 3.052 1.00 0.00 H -ATOM 1292 CD2 TYR 82 -7.052 -18.198 3.487 1.00 0.00 C -ATOM 1293 HD2 TYR 82 -7.813 -17.455 3.674 1.00 0.00 H -ATOM 1294 C TYR 82 -4.453 -14.730 5.506 1.00 0.00 C -ATOM 1295 O TYR 82 -5.186 -13.791 5.235 1.00 0.00 O -ATOM 1296 N ASN 83 -3.152 -14.658 5.909 1.00 0.00 N -ATOM 1297 H ASN 83 -2.658 -15.526 6.058 1.00 0.00 H -ATOM 1298 CA ASN 83 -2.570 -13.335 6.098 1.00 0.00 C -ATOM 1299 HA ASN 83 -3.313 -12.777 6.669 1.00 0.00 H -ATOM 1300 CB ASN 83 -1.356 -13.403 7.003 1.00 0.00 C -ATOM 1301 HB2 ASN 83 -0.561 -13.926 6.472 1.00 0.00 H -ATOM 1302 HB3 ASN 83 -0.976 -12.384 7.080 1.00 0.00 H -ATOM 1303 CG ASN 83 -1.711 -14.067 8.344 1.00 0.00 C -ATOM 1304 OD1 ASN 83 -2.787 -13.793 8.975 1.00 0.00 O -ATOM 1305 ND2 ASN 83 -0.842 -14.827 8.965 1.00 0.00 N -ATOM 1306 HD21 ASN 83 -1.145 -15.264 9.823 1.00 0.00 H -ATOM 1307 HD22 ASN 83 0.088 -15.026 8.625 1.00 0.00 H -ATOM 1308 C ASN 83 -2.245 -12.529 4.831 1.00 0.00 C -ATOM 1309 O ASN 83 -1.675 -13.167 3.910 1.00 0.00 O -ATOM 1310 N CYS 84 -2.430 -11.259 4.834 1.00 0.00 N -ATOM 1311 H CYS 84 -2.872 -10.863 5.652 1.00 0.00 H -ATOM 1312 CA CYS 84 -2.282 -10.474 3.666 1.00 0.00 C -ATOM 1313 HA CYS 84 -1.649 -11.045 2.987 1.00 0.00 H -ATOM 1314 CB CYS 84 -3.683 -10.340 3.108 1.00 0.00 C -ATOM 1315 HB2 CYS 84 -4.253 -9.869 3.909 1.00 0.00 H -ATOM 1316 HB3 CYS 84 -3.661 -9.742 2.197 1.00 0.00 H -ATOM 1317 SG CYS 84 -4.438 -11.968 2.751 1.00 0.00 S -ATOM 1318 HG CYS 84 -4.207 -12.583 3.914 1.00 0.00 H -ATOM 1319 C CYS 84 -1.578 -9.105 3.713 1.00 0.00 C -ATOM 1320 O CYS 84 -1.572 -8.437 4.763 1.00 0.00 O -ATOM 1321 N THR 85 -1.362 -8.506 2.550 1.00 0.00 N -ATOM 1322 H THR 85 -1.382 -9.001 1.669 1.00 0.00 H -ATOM 1323 CA THR 85 -0.880 -7.147 2.301 1.00 0.00 C -ATOM 1324 HA THR 85 -1.031 -6.558 3.206 1.00 0.00 H -ATOM 1325 CB THR 85 0.621 -7.101 2.183 1.00 0.00 C -ATOM 1326 HB THR 85 0.921 -7.861 1.462 1.00 0.00 H -ATOM 1327 CG2 THR 85 1.341 -5.808 1.880 1.00 0.00 C -ATOM 1328 HG21 THR 85 1.130 -5.133 2.709 1.00 0.00 H -ATOM 1329 HG22 THR 85 2.415 -5.956 1.766 1.00 0.00 H -ATOM 1330 HG23 THR 85 1.014 -5.413 0.917 1.00 0.00 H -ATOM 1331 OG1 THR 85 1.201 -7.496 3.398 1.00 0.00 O -ATOM 1332 HG1 THR 85 1.858 -8.078 3.011 1.00 0.00 H -ATOM 1333 C THR 85 -1.540 -6.459 1.110 1.00 0.00 C -ATOM 1334 O THR 85 -1.861 -7.105 0.113 1.00 0.00 O -ATOM 1335 N ILE 86 -1.723 -5.135 1.107 1.00 0.00 N -ATOM 1336 H ILE 86 -1.534 -4.626 1.959 1.00 0.00 H -ATOM 1337 CA ILE 86 -2.251 -4.351 -0.057 1.00 0.00 C -ATOM 1338 HA ILE 86 -2.092 -4.980 -0.933 1.00 0.00 H -ATOM 1339 CB ILE 86 -3.753 -4.028 0.184 1.00 0.00 C -ATOM 1340 HB ILE 86 -3.875 -3.263 0.951 1.00 0.00 H -ATOM 1341 CG2 ILE 86 -4.376 -3.328 -1.038 1.00 0.00 C -ATOM 1342 HG21 ILE 86 -4.724 -4.070 -1.756 1.00 0.00 H -ATOM 1343 HG22 ILE 86 -5.140 -2.632 -0.695 1.00 0.00 H -ATOM 1344 HG23 ILE 86 -3.664 -2.700 -1.575 1.00 0.00 H -ATOM 1345 CG1 ILE 86 -4.626 -5.244 0.523 1.00 0.00 C -ATOM 1346 HG12 ILE 86 -4.630 -5.906 -0.343 1.00 0.00 H -ATOM 1347 HG13 ILE 86 -4.275 -5.716 1.441 1.00 0.00 H -ATOM 1348 CD1 ILE 86 -6.056 -5.018 0.809 1.00 0.00 C -ATOM 1349 HD11 ILE 86 -6.141 -4.371 1.682 1.00 0.00 H -ATOM 1350 HD12 ILE 86 -6.523 -4.523 -0.044 1.00 0.00 H -ATOM 1351 HD13 ILE 86 -6.691 -5.892 0.955 1.00 0.00 H -ATOM 1352 C ILE 86 -1.457 -3.078 -0.223 1.00 0.00 C -ATOM 1353 O ILE 86 -1.285 -2.421 0.841 1.00 0.00 O -ATOM 1354 N PHE 87 -0.846 -2.753 -1.374 1.00 0.00 N -ATOM 1355 H PHE 87 -1.039 -3.346 -2.168 1.00 0.00 H -ATOM 1356 CA PHE 87 0.084 -1.613 -1.465 1.00 0.00 C -ATOM 1357 HA PHE 87 -0.146 -0.897 -0.676 1.00 0.00 H -ATOM 1358 CB PHE 87 1.558 -2.002 -1.113 1.00 0.00 C -ATOM 1359 HB2 PHE 87 1.973 -1.031 -0.844 1.00 0.00 H -ATOM 1360 HB3 PHE 87 1.663 -2.682 -0.268 1.00 0.00 H -ATOM 1361 CG PHE 87 2.369 -2.587 -2.277 1.00 0.00 C -ATOM 1362 CD1 PHE 87 2.597 -3.967 -2.281 1.00 0.00 C -ATOM 1363 HD1 PHE 87 2.182 -4.573 -1.490 1.00 0.00 H -ATOM 1364 CE1 PHE 87 3.507 -4.574 -3.166 1.00 0.00 C -ATOM 1365 HE1 PHE 87 3.702 -5.636 -3.182 1.00 0.00 H -ATOM 1366 CZ PHE 87 4.059 -3.722 -4.134 1.00 0.00 C -ATOM 1367 HZ PHE 87 4.711 -4.234 -4.827 1.00 0.00 H -ATOM 1368 CE2 PHE 87 3.911 -2.311 -4.183 1.00 0.00 C -ATOM 1369 HE2 PHE 87 4.446 -1.796 -4.969 1.00 0.00 H -ATOM 1370 CD2 PHE 87 3.132 -1.760 -3.166 1.00 0.00 C -ATOM 1371 HD2 PHE 87 2.976 -0.695 -3.084 1.00 0.00 H -ATOM 1372 C PHE 87 -0.106 -0.842 -2.754 1.00 0.00 C -ATOM 1373 O PHE 87 -0.561 -1.444 -3.758 1.00 0.00 O -ATOM 1374 N ALA 88 0.146 0.483 -2.662 1.00 0.00 N -ATOM 1375 H ALA 88 0.676 0.848 -1.884 1.00 0.00 H -ATOM 1376 CA ALA 88 -0.032 1.285 -3.784 1.00 0.00 C -ATOM 1377 HA ALA 88 -0.540 0.783 -4.608 1.00 0.00 H -ATOM 1378 CB ALA 88 -1.017 2.441 -3.410 1.00 0.00 C -ATOM 1379 HB1 ALA 88 -1.915 2.034 -2.943 1.00 0.00 H -ATOM 1380 HB2 ALA 88 -0.603 3.014 -2.581 1.00 0.00 H -ATOM 1381 HB3 ALA 88 -1.168 2.968 -4.352 1.00 0.00 H -ATOM 1382 C ALA 88 1.321 1.785 -4.291 1.00 0.00 C -ATOM 1383 O ALA 88 2.130 2.262 -3.519 1.00 0.00 O -ATOM 1384 N TYR 89 1.512 1.734 -5.606 1.00 0.00 N -ATOM 1385 H TYR 89 0.708 1.338 -6.073 1.00 0.00 H -ATOM 1386 CA TYR 89 2.790 1.856 -6.308 1.00 0.00 C -ATOM 1387 HA TYR 89 3.479 2.300 -5.588 1.00 0.00 H -ATOM 1388 CB TYR 89 3.308 0.474 -6.655 1.00 0.00 C -ATOM 1389 HB2 TYR 89 3.428 -0.063 -5.714 1.00 0.00 H -ATOM 1390 HB3 TYR 89 2.552 -0.141 -7.144 1.00 0.00 H -ATOM 1391 CG TYR 89 4.619 0.415 -7.432 1.00 0.00 C -ATOM 1392 CD1 TYR 89 4.550 0.263 -8.786 1.00 0.00 C -ATOM 1393 HD1 TYR 89 3.593 0.121 -9.266 1.00 0.00 H -ATOM 1394 CE1 TYR 89 5.738 0.198 -9.572 1.00 0.00 C -ATOM 1395 HE1 TYR 89 5.588 0.056 -10.632 1.00 0.00 H -ATOM 1396 CZ TYR 89 6.994 0.378 -8.975 1.00 0.00 C -ATOM 1397 OH TYR 89 8.125 0.255 -9.740 1.00 0.00 O -ATOM 1398 HH TYR 89 8.923 -0.111 -9.351 1.00 0.00 H -ATOM 1399 CE2 TYR 89 7.037 0.530 -7.626 1.00 0.00 C -ATOM 1400 HE2 TYR 89 8.037 0.572 -7.220 1.00 0.00 H -ATOM 1401 CD2 TYR 89 5.883 0.550 -6.807 1.00 0.00 C -ATOM 1402 HD2 TYR 89 5.987 0.591 -5.733 1.00 0.00 H -ATOM 1403 C TYR 89 2.682 2.858 -7.478 1.00 0.00 C -ATOM 1404 O TYR 89 1.780 2.713 -8.282 1.00 0.00 O -ATOM 1405 N GLY 90 3.562 3.894 -7.601 1.00 0.00 N -ATOM 1406 H GLY 90 4.233 3.950 -6.848 1.00 0.00 H -ATOM 1407 CA GLY 90 3.638 4.802 -8.740 1.00 0.00 C -ATOM 1408 HA2 GLY 90 4.166 4.285 -9.541 1.00 0.00 H -ATOM 1409 HA3 GLY 90 2.653 5.075 -9.117 1.00 0.00 H -ATOM 1410 C GLY 90 4.420 6.122 -8.514 1.00 0.00 C -ATOM 1411 O GLY 90 4.779 6.420 -7.326 1.00 0.00 O -ATOM 1412 N GLN 91 4.814 6.727 -9.636 1.00 0.00 N -ATOM 1413 H GLN 91 4.580 6.242 -10.491 1.00 0.00 H -ATOM 1414 CA GLN 91 5.594 8.018 -9.565 1.00 0.00 C -ATOM 1415 HA GLN 91 6.521 7.729 -9.068 1.00 0.00 H -ATOM 1416 CB GLN 91 5.820 8.648 -11.005 1.00 0.00 C -ATOM 1417 HB2 GLN 91 6.238 9.649 -10.900 1.00 0.00 H -ATOM 1418 HB3 GLN 91 6.612 8.074 -11.488 1.00 0.00 H -ATOM 1419 CG GLN 91 4.616 8.723 -11.912 1.00 0.00 C -ATOM 1420 HG2 GLN 91 4.161 7.742 -12.057 1.00 0.00 H -ATOM 1421 HG3 GLN 91 3.908 9.384 -11.411 1.00 0.00 H -ATOM 1422 CD GLN 91 4.834 9.329 -13.297 1.00 0.00 C -ATOM 1423 OE1 GLN 91 4.666 8.709 -14.330 1.00 0.00 O -ATOM 1424 NE2 GLN 91 5.067 10.627 -13.436 1.00 0.00 N -ATOM 1425 HE21 GLN 91 4.857 10.972 -14.362 1.00 0.00 H -ATOM 1426 HE22 GLN 91 5.275 11.284 -12.698 1.00 0.00 H -ATOM 1427 C GLN 91 4.900 9.135 -8.725 1.00 0.00 C -ATOM 1428 O GLN 91 3.677 9.046 -8.349 1.00 0.00 O -ATOM 1429 N THR 92 5.608 10.211 -8.348 1.00 0.00 N -ATOM 1430 H THR 92 6.528 10.229 -8.765 1.00 0.00 H -ATOM 1431 CA THR 92 5.112 11.402 -7.603 1.00 0.00 C -ATOM 1432 HA THR 92 4.800 11.051 -6.619 1.00 0.00 H -ATOM 1433 CB THR 92 6.125 12.479 -7.493 1.00 0.00 C -ATOM 1434 HB THR 92 6.538 12.644 -8.488 1.00 0.00 H -ATOM 1435 CG2 THR 92 5.701 13.742 -6.945 1.00 0.00 C -ATOM 1436 HG21 THR 92 5.153 14.363 -7.654 1.00 0.00 H -ATOM 1437 HG22 THR 92 5.165 13.586 -6.009 1.00 0.00 H -ATOM 1438 HG23 THR 92 6.591 14.286 -6.628 1.00 0.00 H -ATOM 1439 OG1 THR 92 7.319 12.005 -6.786 1.00 0.00 O -ATOM 1440 HG1 THR 92 7.651 11.253 -7.283 1.00 0.00 H -ATOM 1441 C THR 92 3.799 12.004 -8.248 1.00 0.00 C -ATOM 1442 O THR 92 3.854 12.604 -9.310 1.00 0.00 O -ATOM 1443 N GLY 93 2.677 11.847 -7.528 1.00 0.00 N -ATOM 1444 H GLY 93 2.624 11.300 -6.681 1.00 0.00 H -ATOM 1445 CA GLY 93 1.427 12.557 -7.870 1.00 0.00 C -ATOM 1446 HA2 GLY 93 0.976 12.992 -6.979 1.00 0.00 H -ATOM 1447 HA3 GLY 93 1.633 13.436 -8.481 1.00 0.00 H -ATOM 1448 C GLY 93 0.398 11.692 -8.600 1.00 0.00 C -ATOM 1449 O GLY 93 -0.256 12.350 -9.402 1.00 0.00 O -ATOM 1450 N THR 94 0.461 10.379 -8.479 1.00 0.00 N -ATOM 1451 H THR 94 1.227 10.010 -7.934 1.00 0.00 H -ATOM 1452 CA THR 94 -0.387 9.414 -9.181 1.00 0.00 C -ATOM 1453 HA THR 94 -0.815 9.849 -10.084 1.00 0.00 H -ATOM 1454 CB THR 94 0.351 8.150 -9.605 1.00 0.00 C -ATOM 1455 HB THR 94 -0.338 7.473 -10.110 1.00 0.00 H -ATOM 1456 CG2 THR 94 1.540 8.378 -10.488 1.00 0.00 C -ATOM 1457 HG21 THR 94 2.258 9.101 -10.100 1.00 0.00 H -ATOM 1458 HG22 THR 94 2.042 7.418 -10.612 1.00 0.00 H -ATOM 1459 HG23 THR 94 1.214 8.784 -11.445 1.00 0.00 H -ATOM 1460 OG1 THR 94 0.792 7.513 -8.396 1.00 0.00 O -ATOM 1461 HG1 THR 94 0.404 6.637 -8.338 1.00 0.00 H -ATOM 1462 C THR 94 -1.710 9.000 -8.526 1.00 0.00 C -ATOM 1463 O THR 94 -2.535 8.526 -9.280 1.00 0.00 O -ATOM 1464 N GLY 95 -1.932 9.074 -7.239 1.00 0.00 N -ATOM 1465 H GLY 95 -1.106 9.326 -6.716 1.00 0.00 H -ATOM 1466 CA GLY 95 -3.144 8.515 -6.579 1.00 0.00 C -ATOM 1467 HA2 GLY 95 -3.631 9.291 -5.989 1.00 0.00 H -ATOM 1468 HA3 GLY 95 -3.834 8.247 -7.379 1.00 0.00 H -ATOM 1469 C GLY 95 -2.854 7.363 -5.619 1.00 0.00 C -ATOM 1470 O GLY 95 -3.796 6.572 -5.286 1.00 0.00 O -ATOM 1471 N LYS 96 -1.624 7.089 -5.247 1.00 0.00 N -ATOM 1472 H LYS 96 -0.926 7.814 -5.321 1.00 0.00 H -ATOM 1473 CA LYS 96 -1.187 6.090 -4.218 1.00 0.00 C -ATOM 1474 HA LYS 96 -1.530 5.115 -4.565 1.00 0.00 H -ATOM 1475 CB LYS 96 0.326 6.112 -4.080 1.00 0.00 C -ATOM 1476 HB2 LYS 96 0.621 7.121 -3.790 1.00 0.00 H -ATOM 1477 HB3 LYS 96 0.479 5.369 -3.297 1.00 0.00 H -ATOM 1478 CG LYS 96 1.183 5.598 -5.251 1.00 0.00 C -ATOM 1479 HG2 LYS 96 0.891 4.592 -5.553 1.00 0.00 H -ATOM 1480 HG3 LYS 96 0.970 6.134 -6.176 1.00 0.00 H -ATOM 1481 CD LYS 96 2.703 5.628 -4.949 1.00 0.00 C -ATOM 1482 HD2 LYS 96 2.818 5.044 -4.035 1.00 0.00 H -ATOM 1483 HD3 LYS 96 3.247 5.139 -5.757 1.00 0.00 H -ATOM 1484 CE LYS 96 3.371 7.004 -4.848 1.00 0.00 C -ATOM 1485 HE2 LYS 96 3.383 7.348 -3.814 1.00 0.00 H -ATOM 1486 HE3 LYS 96 4.439 6.913 -5.049 1.00 0.00 H -ATOM 1487 NZ LYS 96 2.781 7.969 -5.826 1.00 0.00 N -ATOM 1488 HZ1 LYS 96 2.861 8.939 -5.559 1.00 0.00 H -ATOM 1489 HZ2 LYS 96 3.073 7.755 -6.770 1.00 0.00 H -ATOM 1490 HZ3 LYS 96 1.780 8.006 -5.703 1.00 0.00 H -ATOM 1491 C LYS 96 -1.800 6.365 -2.845 1.00 0.00 C -ATOM 1492 O LYS 96 -2.550 5.530 -2.387 1.00 0.00 O -ATOM 1493 N THR 97 -1.469 7.542 -2.238 1.00 0.00 N -ATOM 1494 H THR 97 -0.949 8.250 -2.737 1.00 0.00 H -ATOM 1495 CA THR 97 -2.067 7.980 -0.968 1.00 0.00 C -ATOM 1496 HA THR 97 -1.847 7.215 -0.222 1.00 0.00 H -ATOM 1497 CB THR 97 -1.506 9.292 -0.408 1.00 0.00 C -ATOM 1498 HB THR 97 -1.838 10.094 -1.068 1.00 0.00 H -ATOM 1499 CG2 THR 97 -1.994 9.546 1.005 1.00 0.00 C -ATOM 1500 HG21 THR 97 -1.968 8.630 1.594 1.00 0.00 H -ATOM 1501 HG22 THR 97 -1.346 10.196 1.593 1.00 0.00 H -ATOM 1502 HG23 THR 97 -2.964 10.038 1.080 1.00 0.00 H -ATOM 1503 OG1 THR 97 -0.051 9.269 -0.393 1.00 0.00 O -ATOM 1504 HG1 THR 97 0.079 8.520 0.196 1.00 0.00 H -ATOM 1505 C THR 97 -3.604 8.130 -1.068 1.00 0.00 C -ATOM 1506 O THR 97 -4.338 7.812 -0.179 1.00 0.00 O -ATOM 1507 N PHE 98 -4.084 8.595 -2.218 1.00 0.00 N -ATOM 1508 H PHE 98 -3.382 8.929 -2.864 1.00 0.00 H -ATOM 1509 CA PHE 98 -5.511 8.867 -2.426 1.00 0.00 C -ATOM 1510 HA PHE 98 -5.864 9.464 -1.585 1.00 0.00 H -ATOM 1511 CB PHE 98 -5.711 9.762 -3.631 1.00 0.00 C -ATOM 1512 HB2 PHE 98 -5.111 10.642 -3.400 1.00 0.00 H -ATOM 1513 HB3 PHE 98 -5.302 9.344 -4.551 1.00 0.00 H -ATOM 1514 CG PHE 98 -7.137 10.052 -3.946 1.00 0.00 C -ATOM 1515 CD1 PHE 98 -7.868 9.280 -4.849 1.00 0.00 C -ATOM 1516 HD1 PHE 98 -7.412 8.392 -5.259 1.00 0.00 H -ATOM 1517 CE1 PHE 98 -9.198 9.537 -5.147 1.00 0.00 C -ATOM 1518 HE1 PHE 98 -9.674 8.985 -5.945 1.00 0.00 H -ATOM 1519 CZ PHE 98 -9.874 10.646 -4.609 1.00 0.00 C -ATOM 1520 HZ PHE 98 -10.873 10.849 -4.967 1.00 0.00 H -ATOM 1521 CE2 PHE 98 -9.154 11.434 -3.695 1.00 0.00 C -ATOM 1522 HE2 PHE 98 -9.651 12.221 -3.148 1.00 0.00 H -ATOM 1523 CD2 PHE 98 -7.813 11.144 -3.332 1.00 0.00 C -ATOM 1524 HD2 PHE 98 -7.361 11.845 -2.645 1.00 0.00 H -ATOM 1525 C PHE 98 -6.425 7.612 -2.492 1.00 0.00 C -ATOM 1526 O PHE 98 -7.411 7.500 -1.744 1.00 0.00 O -ATOM 1527 N THR 99 -5.967 6.538 -3.157 1.00 0.00 N -ATOM 1528 H THR 99 -5.019 6.581 -3.504 1.00 0.00 H -ATOM 1529 CA THR 99 -6.826 5.304 -3.230 1.00 0.00 C -ATOM 1530 HA THR 99 -7.840 5.637 -3.453 1.00 0.00 H -ATOM 1531 CB THR 99 -6.267 4.336 -4.287 1.00 0.00 C -ATOM 1532 HB THR 99 -5.287 3.982 -3.965 1.00 0.00 H -ATOM 1533 CG2 THR 99 -7.071 3.068 -4.586 1.00 0.00 C -ATOM 1534 HG21 THR 99 -8.123 3.354 -4.610 1.00 0.00 H -ATOM 1535 HG22 THR 99 -6.769 2.618 -5.533 1.00 0.00 H -ATOM 1536 HG23 THR 99 -6.933 2.380 -3.751 1.00 0.00 H -ATOM 1537 OG1 THR 99 -6.086 5.034 -5.418 1.00 0.00 O -ATOM 1538 HG1 THR 99 -5.359 5.626 -5.215 1.00 0.00 H -ATOM 1539 C THR 99 -6.815 4.492 -1.924 1.00 0.00 C -ATOM 1540 O THR 99 -7.729 3.749 -1.574 1.00 0.00 O -ATOM 1541 N MET 100 -5.686 4.624 -1.269 1.00 0.00 N -ATOM 1542 H MET 100 -5.012 5.276 -1.644 1.00 0.00 H -ATOM 1543 CA MET 100 -5.313 3.900 -0.049 1.00 0.00 C -ATOM 1544 HA MET 100 -5.677 2.874 -0.074 1.00 0.00 H -ATOM 1545 CB MET 100 -3.739 3.842 0.094 1.00 0.00 C -ATOM 1546 HB2 MET 100 -3.337 3.323 -0.777 1.00 0.00 H -ATOM 1547 HB3 MET 100 -3.422 4.884 0.132 1.00 0.00 H -ATOM 1548 CG MET 100 -3.370 3.000 1.352 1.00 0.00 C -ATOM 1549 HG2 MET 100 -2.358 2.595 1.328 1.00 0.00 H -ATOM 1550 HG3 MET 100 -3.380 3.603 2.260 1.00 0.00 H -ATOM 1551 SD MET 100 -4.284 1.338 1.576 1.00 0.00 S -ATOM 1552 CE MET 100 -3.667 0.276 0.177 1.00 0.00 C -ATOM 1553 HE1 MET 100 -4.044 -0.745 0.244 1.00 0.00 H -ATOM 1554 HE2 MET 100 -4.090 0.765 -0.701 1.00 0.00 H -ATOM 1555 HE3 MET 100 -2.581 0.231 0.256 1.00 0.00 H -ATOM 1556 C MET 100 -5.899 4.603 1.208 1.00 0.00 C -ATOM 1557 O MET 100 -6.489 3.961 2.148 1.00 0.00 O -ATOM 1558 N GLU 101 -5.654 5.889 1.353 1.00 0.00 N -ATOM 1559 H GLU 101 -5.048 6.399 0.727 1.00 0.00 H -ATOM 1560 CA GLU 101 -6.076 6.722 2.530 1.00 0.00 C -ATOM 1561 HA GLU 101 -6.602 6.141 3.287 1.00 0.00 H -ATOM 1562 CB GLU 101 -4.837 7.465 3.135 1.00 0.00 C -ATOM 1563 HB2 GLU 101 -4.099 6.664 3.195 1.00 0.00 H -ATOM 1564 HB3 GLU 101 -4.446 8.211 2.444 1.00 0.00 H -ATOM 1565 CG GLU 101 -5.132 8.084 4.541 1.00 0.00 C -ATOM 1566 HG2 GLU 101 -6.116 7.804 4.916 1.00 0.00 H -ATOM 1567 HG3 GLU 101 -4.322 7.731 5.180 1.00 0.00 H -ATOM 1568 CD GLU 101 -4.967 9.566 4.550 1.00 0.00 C -ATOM 1569 OE1 GLU 101 -5.854 10.342 5.036 1.00 0.00 O -ATOM 1570 OE2 GLU 101 -3.835 10.080 4.289 1.00 0.00 O -ATOM 1571 C GLU 101 -7.155 7.783 2.225 1.00 0.00 C -ATOM 1572 O GLU 101 -8.193 7.912 2.922 1.00 0.00 O -ATOM 1573 N GLY 102 -7.015 8.508 1.114 1.00 0.00 N -ATOM 1574 H GLY 102 -6.217 8.336 0.519 1.00 0.00 H -ATOM 1575 CA GLY 102 -8.049 9.378 0.630 1.00 0.00 C -ATOM 1576 HA2 GLY 102 -7.489 9.797 -0.207 1.00 0.00 H -ATOM 1577 HA3 GLY 102 -8.959 8.841 0.363 1.00 0.00 H -ATOM 1578 C GLY 102 -8.327 10.520 1.664 1.00 0.00 C -ATOM 1579 O GLY 102 -7.356 10.925 2.310 1.00 0.00 O -ATOM 1580 N GLU 103 -9.584 10.888 1.844 1.00 0.00 N -ATOM 1581 H GLU 103 -10.259 10.453 1.230 1.00 0.00 H -ATOM 1582 CA GLU 103 -10.006 11.791 2.858 1.00 0.00 C -ATOM 1583 HA GLU 103 -9.203 11.845 3.595 1.00 0.00 H -ATOM 1584 CB GLU 103 -10.112 13.287 2.331 1.00 0.00 C -ATOM 1585 HB2 GLU 103 -11.089 13.363 1.854 1.00 0.00 H -ATOM 1586 HB3 GLU 103 -10.207 13.944 3.195 1.00 0.00 H -ATOM 1587 CG GLU 103 -9.020 13.830 1.412 1.00 0.00 C -ATOM 1588 HG2 GLU 103 -8.726 13.149 0.614 1.00 0.00 H -ATOM 1589 HG3 GLU 103 -9.486 14.681 0.916 1.00 0.00 H -ATOM 1590 CD GLU 103 -7.696 14.217 2.072 1.00 0.00 C -ATOM 1591 OE1 GLU 103 -7.803 14.978 3.048 1.00 0.00 O -ATOM 1592 OE2 GLU 103 -6.602 13.793 1.621 1.00 0.00 O -ATOM 1593 C GLU 103 -11.233 11.310 3.579 1.00 0.00 C -ATOM 1594 O GLU 103 -12.117 10.645 3.069 1.00 0.00 O -ATOM 1595 N ARG 104 -11.264 11.608 4.948 1.00 0.00 N -ATOM 1596 H ARG 104 -10.475 12.073 5.373 1.00 0.00 H -ATOM 1597 CA ARG 104 -12.455 11.211 5.823 1.00 0.00 C -ATOM 1598 HA ARG 104 -12.825 10.269 5.418 1.00 0.00 H -ATOM 1599 CB ARG 104 -12.259 11.048 7.363 1.00 0.00 C -ATOM 1600 HB2 ARG 104 -12.067 12.025 7.807 1.00 0.00 H -ATOM 1601 HB3 ARG 104 -13.178 10.616 7.760 1.00 0.00 H -ATOM 1602 CG ARG 104 -11.210 10.004 7.711 1.00 0.00 C -ATOM 1603 HG2 ARG 104 -11.290 9.083 7.133 1.00 0.00 H -ATOM 1604 HG3 ARG 104 -10.278 10.532 7.514 1.00 0.00 H -ATOM 1605 CD ARG 104 -11.194 9.611 9.266 1.00 0.00 C -ATOM 1606 HD2 ARG 104 -12.188 9.234 9.508 1.00 0.00 H -ATOM 1607 HD3 ARG 104 -10.423 8.874 9.490 1.00 0.00 H -ATOM 1608 NE ARG 104 -10.929 10.760 10.099 1.00 0.00 N -ATOM 1609 HE ARG 104 -11.711 11.216 10.545 1.00 0.00 H -ATOM 1610 CZ ARG 104 -9.832 11.365 10.433 1.00 0.00 C -ATOM 1611 NH1 ARG 104 -8.663 10.989 9.963 1.00 0.00 N -ATOM 1612 HH11 ARG 104 -8.571 10.143 9.417 1.00 0.00 H -ATOM 1613 HH12 ARG 104 -7.935 11.689 9.988 1.00 0.00 H -ATOM 1614 NH2 ARG 104 -9.800 12.407 11.234 1.00 0.00 N -ATOM 1615 HH21 ARG 104 -10.644 12.874 11.532 1.00 0.00 H -ATOM 1616 HH22 ARG 104 -8.856 12.765 11.283 1.00 0.00 H -ATOM 1617 C ARG 104 -13.653 12.173 5.705 1.00 0.00 C -ATOM 1618 O ARG 104 -13.394 13.336 5.690 1.00 0.00 O -ATOM 1619 N SER 105 -14.875 11.609 5.580 1.00 0.00 N -ATOM 1620 H SER 105 -14.971 10.607 5.655 1.00 0.00 H -ATOM 1621 CA SER 105 -16.099 12.453 5.624 1.00 0.00 C -ATOM 1622 HA SER 105 -15.930 13.358 5.040 1.00 0.00 H -ATOM 1623 CB SER 105 -17.141 11.589 4.898 1.00 0.00 C -ATOM 1624 HB2 SER 105 -17.947 12.225 4.531 1.00 0.00 H -ATOM 1625 HB3 SER 105 -16.621 11.310 3.982 1.00 0.00 H -ATOM 1626 OG SER 105 -17.633 10.464 5.578 1.00 0.00 O -ATOM 1627 HG SER 105 -17.103 9.709 5.312 1.00 0.00 H -ATOM 1628 C SER 105 -16.425 12.810 7.062 1.00 0.00 C -ATOM 1629 O SER 105 -15.890 12.159 7.931 1.00 0.00 O -ATOM 1630 N PRO 106 -17.313 13.773 7.259 1.00 0.00 N -ATOM 1631 CD PRO 106 -17.759 14.724 6.244 1.00 0.00 C -ATOM 1632 HD2 PRO 106 -18.512 14.240 5.623 1.00 0.00 H -ATOM 1633 HD3 PRO 106 -17.036 15.177 5.566 1.00 0.00 H -ATOM 1634 CG PRO 106 -18.487 15.837 6.975 1.00 0.00 C -ATOM 1635 HG2 PRO 106 -19.337 16.226 6.413 1.00 0.00 H -ATOM 1636 HG3 PRO 106 -17.844 16.655 7.298 1.00 0.00 H -ATOM 1637 CB PRO 106 -19.021 15.124 8.213 1.00 0.00 C -ATOM 1638 HB2 PRO 106 -19.921 14.544 8.010 1.00 0.00 H -ATOM 1639 HB3 PRO 106 -19.166 15.827 9.035 1.00 0.00 H -ATOM 1640 CA PRO 106 -17.889 14.123 8.566 1.00 0.00 C -ATOM 1641 HA PRO 106 -17.055 14.580 9.100 1.00 0.00 H -ATOM 1642 C PRO 106 -18.433 12.956 9.256 1.00 0.00 C -ATOM 1643 O PRO 106 -19.277 12.235 8.761 1.00 0.00 O -ATOM 1644 N ASN 107 -17.879 12.628 10.489 1.00 0.00 N -ATOM 1645 H ASN 107 -17.064 13.167 10.745 1.00 0.00 H -ATOM 1646 CA ASN 107 -18.191 11.464 11.291 1.00 0.00 C -ATOM 1647 HA ASN 107 -17.808 10.600 10.749 1.00 0.00 H -ATOM 1648 CB ASN 107 -17.534 11.661 12.660 1.00 0.00 C -ATOM 1649 HB2 ASN 107 -17.885 12.576 13.140 1.00 0.00 H -ATOM 1650 HB3 ASN 107 -17.784 10.793 13.269 1.00 0.00 H -ATOM 1651 CG ASN 107 -15.980 11.552 12.504 1.00 0.00 C -ATOM 1652 OD1 ASN 107 -15.240 12.552 12.215 1.00 0.00 O -ATOM 1653 ND2 ASN 107 -15.516 10.375 12.864 1.00 0.00 N -ATOM 1654 HD21 ASN 107 -14.511 10.271 12.887 1.00 0.00 H -ATOM 1655 HD22 ASN 107 -16.143 9.601 13.026 1.00 0.00 H -ATOM 1656 C ASN 107 -19.690 11.174 11.426 1.00 0.00 C -ATOM 1657 O ASN 107 -20.531 12.015 11.649 1.00 0.00 O -ATOM 1658 N GLU 108 -19.982 9.917 11.200 1.00 0.00 N -ATOM 1659 H GLU 108 -19.209 9.295 11.007 1.00 0.00 H -ATOM 1660 CA GLU 108 -21.294 9.277 11.187 1.00 0.00 C -ATOM 1661 HA GLU 108 -21.029 8.255 10.918 1.00 0.00 H -ATOM 1662 CB GLU 108 -21.864 9.238 12.603 1.00 0.00 C -ATOM 1663 HB2 GLU 108 -22.178 10.226 12.939 1.00 0.00 H -ATOM 1664 HB3 GLU 108 -22.848 8.777 12.514 1.00 0.00 H -ATOM 1665 CG GLU 108 -21.047 8.553 13.801 1.00 0.00 C -ATOM 1666 HG2 GLU 108 -20.253 9.246 14.081 1.00 0.00 H -ATOM 1667 HG3 GLU 108 -21.710 8.455 14.660 1.00 0.00 H -ATOM 1668 CD GLU 108 -20.259 7.307 13.486 1.00 0.00 C -ATOM 1669 OE1 GLU 108 -20.754 6.558 12.585 1.00 0.00 O -ATOM 1670 OE2 GLU 108 -19.308 6.921 14.177 1.00 0.00 O -ATOM 1671 C GLU 108 -22.268 9.754 10.080 1.00 0.00 C -ATOM 1672 O GLU 108 -23.320 9.195 9.843 1.00 0.00 O -ATOM 1673 N GLU 109 -21.922 10.856 9.371 1.00 0.00 N -ATOM 1674 H GLU 109 -21.003 11.260 9.485 1.00 0.00 H -ATOM 1675 CA GLU 109 -22.827 11.338 8.201 1.00 0.00 C -ATOM 1676 HA GLU 109 -23.857 11.388 8.558 1.00 0.00 H -ATOM 1677 CB GLU 109 -22.401 12.763 7.755 1.00 0.00 C -ATOM 1678 HB2 GLU 109 -21.355 12.739 7.448 1.00 0.00 H -ATOM 1679 HB3 GLU 109 -22.954 13.082 6.871 1.00 0.00 H -ATOM 1680 CG GLU 109 -22.553 13.894 8.805 1.00 0.00 C -ATOM 1681 HG2 GLU 109 -21.817 13.704 9.585 1.00 0.00 H -ATOM 1682 HG3 GLU 109 -22.175 14.776 8.290 1.00 0.00 H -ATOM 1683 CD GLU 109 -23.984 14.177 9.325 1.00 0.00 C -ATOM 1684 OE1 GLU 109 -24.276 14.031 10.528 1.00 0.00 O -ATOM 1685 OE2 GLU 109 -24.843 14.612 8.509 1.00 0.00 O -ATOM 1686 C GLU 109 -23.076 10.370 7.053 1.00 0.00 C -ATOM 1687 O GLU 109 -24.095 10.499 6.379 1.00 0.00 O -ATOM 1688 N TYR 110 -22.210 9.358 6.842 1.00 0.00 N -ATOM 1689 H TYR 110 -21.345 9.455 7.354 1.00 0.00 H -ATOM 1690 CA TYR 110 -22.238 8.490 5.624 1.00 0.00 C -ATOM 1691 HA TYR 110 -23.267 8.497 5.265 1.00 0.00 H -ATOM 1692 CB TYR 110 -21.342 9.011 4.451 1.00 0.00 C -ATOM 1693 HB2 TYR 110 -20.315 8.732 4.687 1.00 0.00 H -ATOM 1694 HB3 TYR 110 -21.554 8.384 3.585 1.00 0.00 H -ATOM 1695 CG TYR 110 -21.358 10.475 4.132 1.00 0.00 C -ATOM 1696 CD1 TYR 110 -22.003 10.841 2.931 1.00 0.00 C -ATOM 1697 HD1 TYR 110 -22.429 10.018 2.377 1.00 0.00 H -ATOM 1698 CE1 TYR 110 -22.090 12.193 2.577 1.00 0.00 C -ATOM 1699 HE1 TYR 110 -22.598 12.467 1.664 1.00 0.00 H -ATOM 1700 CZ TYR 110 -21.466 13.171 3.352 1.00 0.00 C -ATOM 1701 OH TYR 110 -21.416 14.416 2.895 1.00 0.00 O -ATOM 1702 HH TYR 110 -22.209 14.620 2.393 1.00 0.00 H -ATOM 1703 CE2 TYR 110 -20.742 12.792 4.523 1.00 0.00 C -ATOM 1704 HE2 TYR 110 -20.243 13.588 5.055 1.00 0.00 H -ATOM 1705 CD2 TYR 110 -20.719 11.430 4.955 1.00 0.00 C -ATOM 1706 HD2 TYR 110 -20.266 11.191 5.906 1.00 0.00 H -ATOM 1707 C TYR 110 -21.860 7.034 5.993 1.00 0.00 C -ATOM 1708 O TYR 110 -20.973 6.911 6.886 1.00 0.00 O -ATOM 1709 N THR 111 -22.560 6.018 5.389 1.00 0.00 N -ATOM 1710 H THR 111 -23.326 6.271 4.781 1.00 0.00 H -ATOM 1711 CA THR 111 -22.180 4.600 5.507 1.00 0.00 C -ATOM 1712 HA THR 111 -21.897 4.426 6.545 1.00 0.00 H -ATOM 1713 CB THR 111 -23.258 3.669 5.030 1.00 0.00 C -ATOM 1714 HB THR 111 -22.980 2.650 5.299 1.00 0.00 H -ATOM 1715 CG2 THR 111 -24.605 3.930 5.635 1.00 0.00 C -ATOM 1716 HG21 THR 111 -24.430 3.857 6.709 1.00 0.00 H -ATOM 1717 HG22 THR 111 -24.912 4.910 5.268 1.00 0.00 H -ATOM 1718 HG23 THR 111 -25.289 3.152 5.296 1.00 0.00 H -ATOM 1719 OG1 THR 111 -23.451 3.836 3.638 1.00 0.00 O -ATOM 1720 HG1 THR 111 -24.035 3.179 3.252 1.00 0.00 H -ATOM 1721 C THR 111 -20.948 4.252 4.626 1.00 0.00 C -ATOM 1722 O THR 111 -20.556 4.996 3.738 1.00 0.00 O -ATOM 1723 N TRP 112 -20.394 3.062 4.708 1.00 0.00 N -ATOM 1724 H TRP 112 -20.809 2.448 5.394 1.00 0.00 H -ATOM 1725 CA TRP 112 -19.213 2.627 3.965 1.00 0.00 C -ATOM 1726 HA TRP 112 -18.409 3.361 4.027 1.00 0.00 H -ATOM 1727 CB TRP 112 -18.580 1.294 4.494 1.00 0.00 C -ATOM 1728 HB2 TRP 112 -17.736 1.247 3.807 1.00 0.00 H -ATOM 1729 HB3 TRP 112 -18.221 1.284 5.523 1.00 0.00 H -ATOM 1730 CG TRP 112 -19.458 0.086 4.229 1.00 0.00 C -ATOM 1731 CD1 TRP 112 -20.539 -0.282 4.941 1.00 0.00 C -ATOM 1732 HD1 TRP 112 -20.869 0.224 5.837 1.00 0.00 H -ATOM 1733 NE1 TRP 112 -21.019 -1.497 4.476 1.00 0.00 N -ATOM 1734 HE1 TRP 112 -21.779 -1.984 4.929 1.00 0.00 H -ATOM 1735 CE2 TRP 112 -20.357 -1.872 3.353 1.00 0.00 C -ATOM 1736 CZ2 TRP 112 -20.520 -2.987 2.497 1.00 0.00 C -ATOM 1737 HZ2 TRP 112 -21.362 -3.632 2.698 1.00 0.00 H -ATOM 1738 CH2 TRP 112 -19.688 -3.136 1.341 1.00 0.00 C -ATOM 1739 HH2 TRP 112 -19.849 -4.027 0.753 1.00 0.00 H -ATOM 1740 CZ3 TRP 112 -18.668 -2.199 1.164 1.00 0.00 C -ATOM 1741 HZ3 TRP 112 -17.998 -2.480 0.365 1.00 0.00 H -ATOM 1742 CE3 TRP 112 -18.558 -1.123 2.043 1.00 0.00 C -ATOM 1743 HE3 TRP 112 -17.814 -0.363 1.855 1.00 0.00 H -ATOM 1744 CD2 TRP 112 -19.346 -0.902 3.179 1.00 0.00 C -ATOM 1745 C TRP 112 -19.474 2.580 2.474 1.00 0.00 C -ATOM 1746 O TRP 112 -18.553 2.709 1.655 1.00 0.00 O -ATOM 1747 N GLU 113 -20.763 2.463 2.076 1.00 0.00 N -ATOM 1748 H GLU 113 -21.444 2.109 2.731 1.00 0.00 H -ATOM 1749 CA GLU 113 -21.264 2.518 0.742 1.00 0.00 C -ATOM 1750 HA GLU 113 -20.581 2.016 0.057 1.00 0.00 H -ATOM 1751 CB GLU 113 -22.597 1.697 0.703 1.00 0.00 C -ATOM 1752 HB2 GLU 113 -23.371 2.239 1.247 1.00 0.00 H -ATOM 1753 HB3 GLU 113 -22.905 1.702 -0.343 1.00 0.00 H -ATOM 1754 CG GLU 113 -22.325 0.176 1.021 1.00 0.00 C -ATOM 1755 HG2 GLU 113 -21.567 -0.223 0.346 1.00 0.00 H -ATOM 1756 HG3 GLU 113 -22.017 0.007 2.053 1.00 0.00 H -ATOM 1757 CD GLU 113 -23.549 -0.615 0.678 1.00 0.00 C -ATOM 1758 OE1 GLU 113 -23.797 -0.930 -0.555 1.00 0.00 O -ATOM 1759 OE2 GLU 113 -24.376 -0.843 1.630 1.00 0.00 O -ATOM 1760 C GLU 113 -21.603 3.933 0.142 1.00 0.00 C -ATOM 1761 O GLU 113 -21.495 4.159 -1.118 1.00 0.00 O -ATOM 1762 N GLU 114 -22.056 4.873 1.002 1.00 0.00 N -ATOM 1763 H GLU 114 -22.071 4.639 1.984 1.00 0.00 H -ATOM 1764 CA GLU 114 -22.322 6.317 0.668 1.00 0.00 C -ATOM 1765 HA GLU 114 -22.665 6.499 -0.351 1.00 0.00 H -ATOM 1766 CB GLU 114 -23.489 6.799 1.553 1.00 0.00 C -ATOM 1767 HB2 GLU 114 -23.279 6.693 2.618 1.00 0.00 H -ATOM 1768 HB3 GLU 114 -23.679 7.837 1.275 1.00 0.00 H -ATOM 1769 CG GLU 114 -24.744 5.986 1.268 1.00 0.00 C -ATOM 1770 HG2 GLU 114 -24.527 4.936 1.461 1.00 0.00 H -ATOM 1771 HG3 GLU 114 -25.539 6.163 1.994 1.00 0.00 H -ATOM 1772 CD GLU 114 -25.334 6.186 -0.122 1.00 0.00 C -ATOM 1773 OE1 GLU 114 -26.154 5.357 -0.515 1.00 0.00 O -ATOM 1774 OE2 GLU 114 -25.132 7.237 -0.749 1.00 0.00 O -ATOM 1775 C GLU 114 -21.108 7.266 0.904 1.00 0.00 C -ATOM 1776 O GLU 114 -21.082 8.335 0.272 1.00 0.00 O -ATOM 1777 N ASP 115 -20.057 6.865 1.641 1.00 0.00 N -ATOM 1778 H ASP 115 -20.101 6.040 2.222 1.00 0.00 H -ATOM 1779 CA ASP 115 -18.928 7.777 2.010 1.00 0.00 C -ATOM 1780 HA ASP 115 -19.386 8.646 2.484 1.00 0.00 H -ATOM 1781 CB ASP 115 -17.993 7.202 3.110 1.00 0.00 C -ATOM 1782 HB2 ASP 115 -18.453 6.909 4.053 1.00 0.00 H -ATOM 1783 HB3 ASP 115 -17.568 6.293 2.685 1.00 0.00 H -ATOM 1784 CG ASP 115 -16.801 8.081 3.464 1.00 0.00 C -ATOM 1785 OD1 ASP 115 -16.594 8.228 4.702 1.00 0.00 O -ATOM 1786 OD2 ASP 115 -16.035 8.640 2.606 1.00 0.00 O -ATOM 1787 C ASP 115 -18.227 8.174 0.697 1.00 0.00 C -ATOM 1788 O ASP 115 -17.867 7.291 -0.113 1.00 0.00 O -ATOM 1789 N PRO 116 -18.020 9.403 0.294 1.00 0.00 N -ATOM 1790 CD PRO 116 -18.663 10.594 0.933 1.00 0.00 C -ATOM 1791 HD2 PRO 116 -17.926 11.150 1.513 1.00 0.00 H -ATOM 1792 HD3 PRO 116 -19.503 10.413 1.606 1.00 0.00 H -ATOM 1793 CG PRO 116 -19.144 11.367 -0.216 1.00 0.00 C -ATOM 1794 HG2 PRO 116 -19.263 12.419 0.040 1.00 0.00 H -ATOM 1795 HG3 PRO 116 -20.038 10.922 -0.652 1.00 0.00 H -ATOM 1796 CB PRO 116 -17.985 11.198 -1.242 1.00 0.00 C -ATOM 1797 HB2 PRO 116 -17.219 11.907 -0.925 1.00 0.00 H -ATOM 1798 HB3 PRO 116 -18.200 11.507 -2.265 1.00 0.00 H -ATOM 1799 CA PRO 116 -17.597 9.719 -1.042 1.00 0.00 C -ATOM 1800 HA PRO 116 -18.226 9.104 -1.684 1.00 0.00 H -ATOM 1801 C PRO 116 -16.116 9.561 -1.411 1.00 0.00 C -ATOM 1802 O PRO 116 -15.772 9.154 -2.503 1.00 0.00 O -ATOM 1803 N LEU 117 -15.225 9.716 -0.382 1.00 0.00 N -ATOM 1804 H LEU 117 -15.596 9.955 0.526 1.00 0.00 H -ATOM 1805 CA LEU 117 -13.752 10.041 -0.567 1.00 0.00 C -ATOM 1806 HA LEU 117 -13.553 9.838 -1.620 1.00 0.00 H -ATOM 1807 CB LEU 117 -13.444 11.554 -0.351 1.00 0.00 C -ATOM 1808 HB2 LEU 117 -14.407 12.064 -0.372 1.00 0.00 H -ATOM 1809 HB3 LEU 117 -12.926 11.734 0.592 1.00 0.00 H -ATOM 1810 CG LEU 117 -12.694 12.078 -1.591 1.00 0.00 C -ATOM 1811 HG LEU 117 -11.793 11.465 -1.596 1.00 0.00 H -ATOM 1812 CD1 LEU 117 -13.320 11.945 -2.993 1.00 0.00 C -ATOM 1813 HD11 LEU 117 -13.185 10.939 -3.390 1.00 0.00 H -ATOM 1814 HD12 LEU 117 -14.373 12.220 -2.936 1.00 0.00 H -ATOM 1815 HD13 LEU 117 -12.677 12.563 -3.619 1.00 0.00 H -ATOM 1816 CD2 LEU 117 -12.296 13.487 -1.307 1.00 0.00 C -ATOM 1817 HD21 LEU 117 -11.535 13.478 -0.527 1.00 0.00 H -ATOM 1818 HD22 LEU 117 -11.794 13.917 -2.174 1.00 0.00 H -ATOM 1819 HD23 LEU 117 -13.181 14.099 -1.125 1.00 0.00 H -ATOM 1820 C LEU 117 -12.817 9.175 0.258 1.00 0.00 C -ATOM 1821 O LEU 117 -11.580 9.349 0.132 1.00 0.00 O -ATOM 1822 N ALA 118 -13.372 8.348 1.155 1.00 0.00 N -ATOM 1823 H ALA 118 -14.365 8.426 1.321 1.00 0.00 H -ATOM 1824 CA ALA 118 -12.571 7.424 1.967 1.00 0.00 C -ATOM 1825 HA ALA 118 -11.852 8.072 2.468 1.00 0.00 H -ATOM 1826 CB ALA 118 -13.492 6.836 3.056 1.00 0.00 C -ATOM 1827 HB1 ALA 118 -12.948 6.107 3.655 1.00 0.00 H -ATOM 1828 HB2 ALA 118 -13.843 7.626 3.722 1.00 0.00 H -ATOM 1829 HB3 ALA 118 -14.344 6.366 2.564 1.00 0.00 H -ATOM 1830 C ALA 118 -11.787 6.400 1.171 1.00 0.00 C -ATOM 1831 O ALA 118 -12.431 5.616 0.440 1.00 0.00 O -ATOM 1832 N GLY 119 -10.455 6.325 1.196 1.00 0.00 N -ATOM 1833 H GLY 119 -9.959 7.021 1.734 1.00 0.00 H -ATOM 1834 CA GLY 119 -9.749 5.179 0.529 1.00 0.00 C -ATOM 1835 HA2 GLY 119 -10.131 5.004 -0.477 1.00 0.00 H -ATOM 1836 HA3 GLY 119 -8.668 5.288 0.434 1.00 0.00 H -ATOM 1837 C GLY 119 -9.894 3.832 1.315 1.00 0.00 C -ATOM 1838 O GLY 119 -10.612 3.800 2.345 1.00 0.00 O -ATOM 1839 N ILE 120 -9.157 2.816 0.897 1.00 0.00 N -ATOM 1840 H ILE 120 -8.541 2.881 0.099 1.00 0.00 H -ATOM 1841 CA ILE 120 -9.086 1.511 1.485 1.00 0.00 C -ATOM 1842 HA ILE 120 -10.019 1.009 1.228 1.00 0.00 H -ATOM 1843 CB ILE 120 -8.010 0.673 0.805 1.00 0.00 C -ATOM 1844 HB ILE 120 -7.087 1.254 0.825 1.00 0.00 H -ATOM 1845 CG2 ILE 120 -7.699 -0.628 1.584 1.00 0.00 C -ATOM 1846 HG21 ILE 120 -8.688 -1.043 1.783 1.00 0.00 H -ATOM 1847 HG22 ILE 120 -7.153 -1.416 1.065 1.00 0.00 H -ATOM 1848 HG23 ILE 120 -7.270 -0.371 2.553 1.00 0.00 H -ATOM 1849 CG1 ILE 120 -8.301 0.398 -0.758 1.00 0.00 C -ATOM 1850 HG12 ILE 120 -9.152 -0.279 -0.821 1.00 0.00 H -ATOM 1851 HG13 ILE 120 -8.611 1.255 -1.356 1.00 0.00 H -ATOM 1852 CD1 ILE 120 -7.274 -0.352 -1.519 1.00 0.00 C -ATOM 1853 HD11 ILE 120 -6.392 0.276 -1.654 1.00 0.00 H -ATOM 1854 HD12 ILE 120 -7.063 -1.325 -1.078 1.00 0.00 H -ATOM 1855 HD13 ILE 120 -7.768 -0.544 -2.471 1.00 0.00 H -ATOM 1856 C ILE 120 -9.004 1.475 3.018 1.00 0.00 C -ATOM 1857 O ILE 120 -9.818 0.791 3.653 1.00 0.00 O -ATOM 1858 N ILE 121 -8.062 2.255 3.660 1.00 0.00 N -ATOM 1859 H ILE 121 -7.411 2.812 3.126 1.00 0.00 H -ATOM 1860 CA ILE 121 -7.862 2.215 5.145 1.00 0.00 C -ATOM 1861 HA ILE 121 -7.936 1.176 5.464 1.00 0.00 H -ATOM 1862 CB ILE 121 -6.577 2.871 5.677 1.00 0.00 C -ATOM 1863 HB ILE 121 -6.544 3.905 5.332 1.00 0.00 H -ATOM 1864 CG2 ILE 121 -6.581 2.956 7.218 1.00 0.00 C -ATOM 1865 HG21 ILE 121 -7.332 3.656 7.584 1.00 0.00 H -ATOM 1866 HG22 ILE 121 -6.597 1.960 7.661 1.00 0.00 H -ATOM 1867 HG23 ILE 121 -5.708 3.475 7.615 1.00 0.00 H -ATOM 1868 CG1 ILE 121 -5.308 2.127 5.207 1.00 0.00 C -ATOM 1869 HG12 ILE 121 -5.368 1.203 5.782 1.00 0.00 H -ATOM 1870 HG13 ILE 121 -5.437 1.876 4.155 1.00 0.00 H -ATOM 1871 CD1 ILE 121 -4.009 2.788 5.402 1.00 0.00 C -ATOM 1872 HD11 ILE 121 -3.910 2.934 6.477 1.00 0.00 H -ATOM 1873 HD12 ILE 121 -3.137 2.164 5.206 1.00 0.00 H -ATOM 1874 HD13 ILE 121 -3.908 3.685 4.790 1.00 0.00 H -ATOM 1875 C ILE 121 -9.054 2.654 5.907 1.00 0.00 C -ATOM 1876 O ILE 121 -9.534 1.874 6.747 1.00 0.00 O -ATOM 1877 N PRO 122 -9.503 3.921 5.817 1.00 0.00 N -ATOM 1878 CD PRO 122 -8.991 5.053 5.049 1.00 0.00 C -ATOM 1879 HD2 PRO 122 -8.407 4.674 4.210 1.00 0.00 H -ATOM 1880 HD3 PRO 122 -8.156 5.496 5.592 1.00 0.00 H -ATOM 1881 CG PRO 122 -10.123 5.978 4.845 1.00 0.00 C -ATOM 1882 HG2 PRO 122 -10.803 5.712 4.035 1.00 0.00 H -ATOM 1883 HG3 PRO 122 -9.763 6.986 4.638 1.00 0.00 H -ATOM 1884 CB PRO 122 -10.945 5.830 6.127 1.00 0.00 C -ATOM 1885 HB2 PRO 122 -11.999 6.074 5.999 1.00 0.00 H -ATOM 1886 HB3 PRO 122 -10.380 6.492 6.783 1.00 0.00 H -ATOM 1887 CA PRO 122 -10.732 4.357 6.478 1.00 0.00 C -ATOM 1888 HA PRO 122 -10.521 4.289 7.545 1.00 0.00 H -ATOM 1889 C PRO 122 -11.928 3.498 6.187 1.00 0.00 C -ATOM 1890 O PRO 122 -12.689 3.228 7.144 1.00 0.00 O -ATOM 1891 N ARG 123 -12.130 3.080 4.971 1.00 0.00 N -ATOM 1892 H ARG 123 -11.494 3.363 4.238 1.00 0.00 H -ATOM 1893 CA ARG 123 -13.316 2.275 4.508 1.00 0.00 C -ATOM 1894 HA ARG 123 -14.189 2.736 4.972 1.00 0.00 H -ATOM 1895 CB ARG 123 -13.492 2.297 2.973 1.00 0.00 C -ATOM 1896 HB2 ARG 123 -13.045 3.233 2.636 1.00 0.00 H -ATOM 1897 HB3 ARG 123 -12.959 1.472 2.502 1.00 0.00 H -ATOM 1898 CG ARG 123 -14.954 2.263 2.565 1.00 0.00 C -ATOM 1899 HG2 ARG 123 -15.450 1.328 2.821 1.00 0.00 H -ATOM 1900 HG3 ARG 123 -15.664 2.969 2.996 1.00 0.00 H -ATOM 1901 CD ARG 123 -15.118 2.370 1.036 1.00 0.00 C -ATOM 1902 HD2 ARG 123 -14.471 1.691 0.481 1.00 0.00 H -ATOM 1903 HD3 ARG 123 -16.119 2.027 0.770 1.00 0.00 H -ATOM 1904 NE ARG 123 -14.837 3.759 0.547 1.00 0.00 N -ATOM 1905 HE ARG 123 -13.862 4.021 0.589 1.00 0.00 H -ATOM 1906 CZ ARG 123 -15.699 4.713 0.335 1.00 0.00 C -ATOM 1907 NH1 ARG 123 -16.968 4.596 0.458 1.00 0.00 N -ATOM 1908 HH11 ARG 123 -17.383 3.756 0.835 1.00 0.00 H -ATOM 1909 HH12 ARG 123 -17.541 5.407 0.271 1.00 0.00 H -ATOM 1910 NH2 ARG 123 -15.270 5.899 -0.009 1.00 0.00 N -ATOM 1911 HH21 ARG 123 -14.289 6.025 -0.213 1.00 0.00 H -ATOM 1912 HH22 ARG 123 -15.951 6.625 -0.180 1.00 0.00 H -ATOM 1913 C ARG 123 -13.268 0.850 5.118 1.00 0.00 C -ATOM 1914 O ARG 123 -14.279 0.391 5.573 1.00 0.00 O -ATOM 1915 N THR 124 -12.075 0.224 5.261 1.00 0.00 N -ATOM 1916 H THR 124 -11.312 0.720 4.823 1.00 0.00 H -ATOM 1917 CA THR 124 -11.940 -1.057 6.016 1.00 0.00 C -ATOM 1918 HA THR 124 -12.618 -1.802 5.598 1.00 0.00 H -ATOM 1919 CB THR 124 -10.522 -1.505 5.987 1.00 0.00 C -ATOM 1920 HB THR 124 -9.890 -0.640 6.186 1.00 0.00 H -ATOM 1921 CG2 THR 124 -10.075 -2.617 6.898 1.00 0.00 C -ATOM 1922 HG21 THR 124 -10.748 -3.466 6.780 1.00 0.00 H -ATOM 1923 HG22 THR 124 -9.016 -2.872 6.834 1.00 0.00 H -ATOM 1924 HG23 THR 124 -10.126 -2.297 7.939 1.00 0.00 H -ATOM 1925 OG1 THR 124 -10.187 -1.934 4.714 1.00 0.00 O -ATOM 1926 HG1 THR 124 -10.046 -1.134 4.201 1.00 0.00 H -ATOM 1927 C THR 124 -12.380 -0.877 7.445 1.00 0.00 C -ATOM 1928 O THR 124 -13.066 -1.706 8.001 1.00 0.00 O -ATOM 1929 N LEU 125 -11.997 0.200 8.061 1.00 0.00 N -ATOM 1930 H LEU 125 -11.441 0.845 7.519 1.00 0.00 H -ATOM 1931 CA LEU 125 -12.346 0.607 9.391 1.00 0.00 C -ATOM 1932 HA LEU 125 -12.177 -0.278 10.005 1.00 0.00 H -ATOM 1933 CB LEU 125 -11.347 1.660 9.868 1.00 0.00 C -ATOM 1934 HB2 LEU 125 -11.319 2.392 9.062 1.00 0.00 H -ATOM 1935 HB3 LEU 125 -11.676 2.039 10.836 1.00 0.00 H -ATOM 1936 CG LEU 125 -9.918 1.162 10.027 1.00 0.00 C -ATOM 1937 HG LEU 125 -9.613 0.461 9.251 1.00 0.00 H -ATOM 1938 CD1 LEU 125 -9.049 2.399 10.065 1.00 0.00 C -ATOM 1939 HD11 LEU 125 -8.000 2.118 9.978 1.00 0.00 H -ATOM 1940 HD12 LEU 125 -9.274 2.845 9.097 1.00 0.00 H -ATOM 1941 HD13 LEU 125 -9.330 3.158 10.795 1.00 0.00 H -ATOM 1942 CD2 LEU 125 -9.718 0.537 11.380 1.00 0.00 C -ATOM 1943 HD21 LEU 125 -10.236 -0.421 11.414 1.00 0.00 H -ATOM 1944 HD22 LEU 125 -8.681 0.215 11.486 1.00 0.00 H -ATOM 1945 HD23 LEU 125 -10.129 1.011 12.270 1.00 0.00 H -ATOM 1946 C LEU 125 -13.812 0.960 9.590 1.00 0.00 C -ATOM 1947 O LEU 125 -14.477 0.866 10.631 1.00 0.00 O -ATOM 1948 N HIE 126 -14.365 1.529 8.536 1.00 0.00 N -ATOM 1949 H HIE 126 -13.709 1.776 7.809 1.00 0.00 H -ATOM 1950 CA HIE 126 -15.755 1.807 8.428 1.00 0.00 C -ATOM 1951 HA HIE 126 -16.035 2.357 9.326 1.00 0.00 H -ATOM 1952 CB HIE 126 -15.970 2.593 7.133 1.00 0.00 C -ATOM 1953 HB2 HIE 126 -15.048 3.091 6.832 1.00 0.00 H -ATOM 1954 HB3 HIE 126 -16.172 1.958 6.271 1.00 0.00 H -ATOM 1955 CG HIE 126 -17.004 3.696 7.150 1.00 0.00 C -ATOM 1956 ND1 HIE 126 -17.010 4.653 6.147 1.00 0.00 N -ATOM 1957 CE1 HIE 126 -18.111 5.396 6.402 1.00 0.00 C -ATOM 1958 HE1 HIE 126 -18.228 6.412 6.057 1.00 0.00 H -ATOM 1959 NE2 HIE 126 -18.728 4.916 7.491 1.00 0.00 N -ATOM 1960 HE2 HIE 126 -19.396 5.496 7.977 1.00 0.00 H -ATOM 1961 CD2 HIE 126 -17.998 3.893 8.088 1.00 0.00 C -ATOM 1962 HD2 HIE 126 -18.224 3.317 8.973 1.00 0.00 H -ATOM 1963 C HIE 126 -16.602 0.576 8.420 1.00 0.00 C -ATOM 1964 O HIE 126 -17.723 0.561 8.928 1.00 0.00 O -ATOM 1965 N GLN 127 -16.134 -0.453 7.864 1.00 0.00 N -ATOM 1966 H GLN 127 -15.184 -0.368 7.532 1.00 0.00 H -ATOM 1967 CA GLN 127 -16.886 -1.696 7.810 1.00 0.00 C -ATOM 1968 HA GLN 127 -17.961 -1.593 7.961 1.00 0.00 H -ATOM 1969 CB GLN 127 -16.744 -2.197 6.319 1.00 0.00 C -ATOM 1970 HB2 GLN 127 -17.027 -1.435 5.591 1.00 0.00 H -ATOM 1971 HB3 GLN 127 -15.747 -2.532 6.033 1.00 0.00 H -ATOM 1972 CG GLN 127 -17.652 -3.408 6.099 1.00 0.00 C -ATOM 1973 HG2 GLN 127 -17.584 -4.197 6.849 1.00 0.00 H -ATOM 1974 HG3 GLN 127 -18.699 -3.130 6.216 1.00 0.00 H -ATOM 1975 CD GLN 127 -17.545 -4.107 4.756 1.00 0.00 C -ATOM 1976 OE1 GLN 127 -16.537 -4.116 4.070 1.00 0.00 O -ATOM 1977 NE2 GLN 127 -18.543 -4.848 4.374 1.00 0.00 N -ATOM 1978 HE21 GLN 127 -18.506 -5.301 3.471 1.00 0.00 H -ATOM 1979 HE22 GLN 127 -19.440 -4.752 4.829 1.00 0.00 H -ATOM 1980 C GLN 127 -16.457 -2.775 8.832 1.00 0.00 C -ATOM 1981 O GLN 127 -17.276 -3.645 9.206 1.00 0.00 O -ATOM 1982 N ILE 128 -15.212 -2.909 9.270 1.00 0.00 N -ATOM 1983 H ILE 128 -14.557 -2.207 8.955 1.00 0.00 H -ATOM 1984 CA ILE 128 -14.631 -4.110 9.911 1.00 0.00 C -ATOM 1985 HA ILE 128 -14.673 -4.865 9.126 1.00 0.00 H -ATOM 1986 CB ILE 128 -13.142 -3.940 10.230 1.00 0.00 C -ATOM 1987 HB ILE 128 -12.657 -3.575 9.324 1.00 0.00 H -ATOM 1988 CG2 ILE 128 -12.928 -2.881 11.388 1.00 0.00 C -ATOM 1989 HG21 ILE 128 -11.874 -2.622 11.485 1.00 0.00 H -ATOM 1990 HG22 ILE 128 -13.510 -1.973 11.231 1.00 0.00 H -ATOM 1991 HG23 ILE 128 -13.294 -3.300 12.327 1.00 0.00 H -ATOM 1992 CG1 ILE 128 -12.535 -5.263 10.605 1.00 0.00 C -ATOM 1993 HG12 ILE 128 -12.896 -5.611 11.573 1.00 0.00 H -ATOM 1994 HG13 ILE 128 -12.890 -5.928 9.818 1.00 0.00 H -ATOM 1995 CD1 ILE 128 -11.012 -5.436 10.655 1.00 0.00 C -ATOM 1996 HD11 ILE 128 -10.588 -4.772 11.407 1.00 0.00 H -ATOM 1997 HD12 ILE 128 -10.752 -6.477 10.849 1.00 0.00 H -ATOM 1998 HD13 ILE 128 -10.710 -5.207 9.633 1.00 0.00 H -ATOM 1999 C ILE 128 -15.357 -4.645 11.094 1.00 0.00 C -ATOM 2000 O ILE 128 -15.520 -5.845 11.271 1.00 0.00 O -ATOM 2001 N PHE 129 -15.890 -3.759 12.004 1.00 0.00 N -ATOM 2002 H PHE 129 -16.032 -2.806 11.705 1.00 0.00 H -ATOM 2003 CA PHE 129 -16.606 -4.311 13.154 1.00 0.00 C -ATOM 2004 HA PHE 129 -15.995 -5.069 13.644 1.00 0.00 H -ATOM 2005 CB PHE 129 -16.820 -3.220 14.189 1.00 0.00 C -ATOM 2006 HB2 PHE 129 -17.254 -2.339 13.716 1.00 0.00 H -ATOM 2007 HB3 PHE 129 -17.474 -3.676 14.934 1.00 0.00 H -ATOM 2008 CG PHE 129 -15.547 -2.674 14.949 1.00 0.00 C -ATOM 2009 CD1 PHE 129 -15.329 -3.097 16.271 1.00 0.00 C -ATOM 2010 HD1 PHE 129 -16.098 -3.746 16.664 1.00 0.00 H -ATOM 2011 CE1 PHE 129 -14.345 -2.532 17.126 1.00 0.00 C -ATOM 2012 HE1 PHE 129 -14.385 -2.819 18.166 1.00 0.00 H -ATOM 2013 CZ PHE 129 -13.372 -1.692 16.560 1.00 0.00 C -ATOM 2014 HZ PHE 129 -12.625 -1.121 17.091 1.00 0.00 H -ATOM 2015 CE2 PHE 129 -13.504 -1.405 15.216 1.00 0.00 C -ATOM 2016 HE2 PHE 129 -12.825 -0.778 14.659 1.00 0.00 H -ATOM 2017 CD2 PHE 129 -14.655 -1.733 14.458 1.00 0.00 C -ATOM 2018 HD2 PHE 129 -14.696 -1.328 13.458 1.00 0.00 H -ATOM 2019 C PHE 129 -17.965 -4.859 12.771 1.00 0.00 C -ATOM 2020 O PHE 129 -18.457 -5.729 13.457 1.00 0.00 O -ATOM 2021 N GLU 130 -18.683 -4.240 11.786 1.00 0.00 N -ATOM 2022 H GLU 130 -18.217 -3.475 11.320 1.00 0.00 H -ATOM 2023 CA GLU 130 -20.004 -4.696 11.341 1.00 0.00 C -ATOM 2024 HA GLU 130 -20.648 -4.887 12.199 1.00 0.00 H -ATOM 2025 CB GLU 130 -20.707 -3.525 10.537 1.00 0.00 C -ATOM 2026 HB2 GLU 130 -20.297 -3.455 9.530 1.00 0.00 H -ATOM 2027 HB3 GLU 130 -21.763 -3.782 10.434 1.00 0.00 H -ATOM 2028 CG GLU 130 -20.570 -2.152 11.242 1.00 0.00 C -ATOM 2029 HG2 GLU 130 -19.518 -1.926 11.414 1.00 0.00 H -ATOM 2030 HG3 GLU 130 -20.840 -1.290 10.634 1.00 0.00 H -ATOM 2031 CD GLU 130 -21.365 -2.003 12.566 1.00 0.00 C -ATOM 2032 OE1 GLU 130 -20.830 -2.178 13.678 1.00 0.00 O -ATOM 2033 OE2 GLU 130 -22.603 -1.694 12.643 1.00 0.00 O -ATOM 2034 C GLU 130 -19.961 -5.981 10.473 1.00 0.00 C -ATOM 2035 O GLU 130 -20.798 -6.806 10.494 1.00 0.00 O -ATOM 2036 N LYS 131 -18.786 -6.148 9.820 1.00 0.00 N -ATOM 2037 H LYS 131 -18.225 -5.309 9.805 1.00 0.00 H -ATOM 2038 CA LYS 131 -18.393 -7.391 9.078 1.00 0.00 C -ATOM 2039 HA LYS 131 -19.216 -7.731 8.450 1.00 0.00 H -ATOM 2040 CB LYS 131 -17.103 -7.088 8.255 1.00 0.00 C -ATOM 2041 HB2 LYS 131 -17.363 -6.278 7.573 1.00 0.00 H -ATOM 2042 HB3 LYS 131 -16.355 -6.573 8.859 1.00 0.00 H -ATOM 2043 CG LYS 131 -16.403 -8.216 7.455 1.00 0.00 C -ATOM 2044 HG2 LYS 131 -15.717 -7.768 6.736 1.00 0.00 H -ATOM 2045 HG3 LYS 131 -15.787 -8.819 8.122 1.00 0.00 H -ATOM 2046 CD LYS 131 -17.328 -9.205 6.788 1.00 0.00 C -ATOM 2047 HD2 LYS 131 -16.772 -9.954 6.225 1.00 0.00 H -ATOM 2048 HD3 LYS 131 -17.832 -9.854 7.503 1.00 0.00 H -ATOM 2049 CE LYS 131 -18.394 -8.617 5.819 1.00 0.00 C -ATOM 2050 HE2 LYS 131 -18.993 -7.821 6.261 1.00 0.00 H -ATOM 2051 HE3 LYS 131 -17.857 -8.197 4.969 1.00 0.00 H -ATOM 2052 NZ LYS 131 -19.316 -9.677 5.364 1.00 0.00 N -ATOM 2053 HZ1 LYS 131 -18.826 -10.479 4.993 1.00 0.00 H -ATOM 2054 HZ2 LYS 131 -19.906 -10.094 6.069 1.00 0.00 H -ATOM 2055 HZ3 LYS 131 -19.988 -9.319 4.701 1.00 0.00 H -ATOM 2056 C LYS 131 -18.193 -8.572 10.090 1.00 0.00 C -ATOM 2057 O LYS 131 -18.894 -9.563 10.039 1.00 0.00 O -ATOM 2058 N LEU 132 -17.401 -8.337 11.133 1.00 0.00 N -ATOM 2059 H LEU 132 -16.953 -7.432 11.170 1.00 0.00 H -ATOM 2060 CA LEU 132 -17.235 -9.324 12.211 1.00 0.00 C -ATOM 2061 HA LEU 132 -17.126 -10.339 11.829 1.00 0.00 H -ATOM 2062 CB LEU 132 -15.997 -8.853 13.087 1.00 0.00 C -ATOM 2063 HB2 LEU 132 -16.115 -7.778 13.228 1.00 0.00 H -ATOM 2064 HB3 LEU 132 -16.049 -9.481 13.976 1.00 0.00 H -ATOM 2065 CG LEU 132 -14.711 -9.255 12.393 1.00 0.00 C -ATOM 2066 HG LEU 132 -14.796 -9.086 11.319 1.00 0.00 H -ATOM 2067 CD1 LEU 132 -13.547 -8.404 12.923 1.00 0.00 C -ATOM 2068 HD11 LEU 132 -12.664 -8.602 12.313 1.00 0.00 H -ATOM 2069 HD12 LEU 132 -13.780 -7.340 12.878 1.00 0.00 H -ATOM 2070 HD13 LEU 132 -13.379 -8.673 13.965 1.00 0.00 H -ATOM 2071 CD2 LEU 132 -14.376 -10.791 12.565 1.00 0.00 C -ATOM 2072 HD21 LEU 132 -13.612 -11.090 11.847 1.00 0.00 H -ATOM 2073 HD22 LEU 132 -14.069 -10.960 13.597 1.00 0.00 H -ATOM 2074 HD23 LEU 132 -15.267 -11.416 12.493 1.00 0.00 H -ATOM 2075 C LEU 132 -18.494 -9.476 13.017 1.00 0.00 C -ATOM 2076 O LEU 132 -18.572 -10.507 13.717 1.00 0.00 O -ATOM 2077 N THR 133 -19.420 -8.470 13.039 1.00 0.00 N -ATOM 2078 H THR 133 -19.215 -7.628 12.521 1.00 0.00 H -ATOM 2079 CA THR 133 -20.741 -8.599 13.674 1.00 0.00 C -ATOM 2080 HA THR 133 -20.689 -9.039 14.671 1.00 0.00 H -ATOM 2081 CB THR 133 -21.512 -7.321 13.768 1.00 0.00 C -ATOM 2082 HB THR 133 -21.483 -6.842 12.789 1.00 0.00 H -ATOM 2083 CG2 THR 133 -22.904 -7.555 14.359 1.00 0.00 C -ATOM 2084 HG21 THR 133 -23.406 -6.624 14.619 1.00 0.00 H -ATOM 2085 HG22 THR 133 -23.493 -8.031 13.576 1.00 0.00 H -ATOM 2086 HG23 THR 133 -22.677 -8.136 15.253 1.00 0.00 H -ATOM 2087 OG1 THR 133 -20.838 -6.426 14.625 1.00 0.00 O -ATOM 2088 HG1 THR 133 -19.952 -6.329 14.268 1.00 0.00 H -ATOM 2089 C THR 133 -21.527 -9.654 12.913 1.00 0.00 C -ATOM 2090 O THR 133 -22.010 -10.599 13.473 1.00 0.00 O -ATOM 2091 N ASP 134 -21.759 -9.502 11.595 1.00 0.00 N -ATOM 2092 H ASP 134 -21.180 -8.803 11.150 1.00 0.00 H -ATOM 2093 CA ASP 134 -22.342 -10.490 10.624 1.00 0.00 C -ATOM 2094 HA ASP 134 -23.395 -10.637 10.869 1.00 0.00 H -ATOM 2095 CB ASP 134 -22.301 -9.975 9.181 1.00 0.00 C -ATOM 2096 HB2 ASP 134 -21.267 -9.669 9.020 1.00 0.00 H -ATOM 2097 HB3 ASP 134 -22.436 -10.916 8.648 1.00 0.00 H -ATOM 2098 CG ASP 134 -23.437 -9.069 8.826 1.00 0.00 C -ATOM 2099 OD1 ASP 134 -24.266 -8.717 9.639 1.00 0.00 O -ATOM 2100 OD2 ASP 134 -23.409 -8.626 7.624 1.00 0.00 O -ATOM 2101 C ASP 134 -21.631 -11.862 10.708 1.00 0.00 C -ATOM 2102 O ASP 134 -22.262 -12.929 10.448 1.00 0.00 O -ATOM 2103 N ASN 135 -20.349 -11.866 11.078 1.00 0.00 N -ATOM 2104 H ASN 135 -19.949 -10.965 11.294 1.00 0.00 H -ATOM 2105 CA ASN 135 -19.592 -13.104 11.090 1.00 0.00 C -ATOM 2106 HA ASN 135 -19.946 -13.748 10.285 1.00 0.00 H -ATOM 2107 CB ASN 135 -18.118 -12.697 11.059 1.00 0.00 C -ATOM 2108 HB2 ASN 135 -17.825 -11.921 10.352 1.00 0.00 H -ATOM 2109 HB3 ASN 135 -17.803 -12.284 12.018 1.00 0.00 H -ATOM 2110 CG ASN 135 -17.116 -13.795 10.755 1.00 0.00 C -ATOM 2111 OD1 ASN 135 -17.125 -14.396 9.737 1.00 0.00 O -ATOM 2112 ND2 ASN 135 -16.232 -14.174 11.641 1.00 0.00 N -ATOM 2113 HD21 ASN 135 -15.589 -14.889 11.335 1.00 0.00 H -ATOM 2114 HD22 ASN 135 -16.215 -13.822 12.587 1.00 0.00 H -ATOM 2115 C ASN 135 -19.975 -13.927 12.353 1.00 0.00 C -ATOM 2116 O ASN 135 -19.717 -15.121 12.370 1.00 0.00 O -ATOM 2117 N GLY 136 -20.658 -13.336 13.294 1.00 0.00 N -ATOM 2118 H GLY 136 -20.854 -12.369 13.080 1.00 0.00 H -ATOM 2119 CA GLY 136 -21.520 -14.055 14.283 1.00 0.00 C -ATOM 2120 HA2 GLY 136 -21.974 -13.263 14.880 1.00 0.00 H -ATOM 2121 HA3 GLY 136 -22.402 -14.452 13.778 1.00 0.00 H -ATOM 2122 C GLY 136 -20.782 -15.020 15.249 1.00 0.00 C -ATOM 2123 O GLY 136 -21.393 -15.930 15.804 1.00 0.00 O -ATOM 2124 N THR 137 -19.490 -14.734 15.458 1.00 0.00 N -ATOM 2125 H THR 137 -19.172 -13.954 14.901 1.00 0.00 H -ATOM 2126 CA THR 137 -18.619 -15.311 16.505 1.00 0.00 C -ATOM 2127 HA THR 137 -19.312 -15.761 17.216 1.00 0.00 H -ATOM 2128 CB THR 137 -17.794 -16.395 15.908 1.00 0.00 C -ATOM 2129 HB THR 137 -18.425 -17.219 15.574 1.00 0.00 H -ATOM 2130 CG2 THR 137 -16.792 -15.918 14.722 1.00 0.00 C -ATOM 2131 HG21 THR 137 -16.396 -16.804 14.224 1.00 0.00 H -ATOM 2132 HG22 THR 137 -17.258 -15.416 13.875 1.00 0.00 H -ATOM 2133 HG23 THR 137 -15.897 -15.421 15.095 1.00 0.00 H -ATOM 2134 OG1 THR 137 -17.009 -16.733 16.989 1.00 0.00 O -ATOM 2135 HG1 THR 137 -16.345 -17.344 16.663 1.00 0.00 H -ATOM 2136 C THR 137 -17.816 -14.236 17.143 1.00 0.00 C -ATOM 2137 O THR 137 -17.482 -13.224 16.552 1.00 0.00 O -ATOM 2138 N GLU 138 -17.688 -14.178 18.469 1.00 0.00 N -ATOM 2139 H GLU 138 -18.029 -14.957 19.015 1.00 0.00 H -ATOM 2140 CA GLU 138 -17.034 -13.123 19.326 1.00 0.00 C -ATOM 2141 HA GLU 138 -17.618 -12.210 19.218 1.00 0.00 H -ATOM 2142 CB GLU 138 -17.162 -13.398 20.847 1.00 0.00 C -ATOM 2143 HB2 GLU 138 -18.220 -13.494 21.087 1.00 0.00 H -ATOM 2144 HB3 GLU 138 -16.868 -14.408 21.135 1.00 0.00 H -ATOM 2145 CG GLU 138 -16.557 -12.375 21.783 1.00 0.00 C -ATOM 2146 HG2 GLU 138 -16.442 -12.763 22.795 1.00 0.00 H -ATOM 2147 HG3 GLU 138 -15.556 -12.060 21.487 1.00 0.00 H -ATOM 2148 CD GLU 138 -17.454 -11.133 21.762 1.00 0.00 C -ATOM 2149 OE1 GLU 138 -18.183 -11.005 22.785 1.00 0.00 O -ATOM 2150 OE2 GLU 138 -17.501 -10.407 20.769 1.00 0.00 O -ATOM 2151 C GLU 138 -15.671 -12.723 18.905 1.00 0.00 C -ATOM 2152 O GLU 138 -14.883 -13.569 18.493 1.00 0.00 O -ATOM 2153 N PHE 139 -15.421 -11.427 18.928 1.00 0.00 N -ATOM 2154 H PHE 139 -16.045 -10.820 19.440 1.00 0.00 H -ATOM 2155 CA PHE 139 -14.208 -10.855 18.234 1.00 0.00 C -ATOM 2156 HA PHE 139 -13.462 -11.650 18.223 1.00 0.00 H -ATOM 2157 CB PHE 139 -14.583 -10.496 16.798 1.00 0.00 C -ATOM 2158 HB2 PHE 139 -13.612 -10.320 16.336 1.00 0.00 H -ATOM 2159 HB3 PHE 139 -15.041 -11.369 16.334 1.00 0.00 H -ATOM 2160 CG PHE 139 -15.410 -9.259 16.547 1.00 0.00 C -ATOM 2161 CD1 PHE 139 -16.842 -9.416 16.524 1.00 0.00 C -ATOM 2162 HD1 PHE 139 -17.300 -10.391 16.610 1.00 0.00 H -ATOM 2163 CE1 PHE 139 -17.688 -8.262 16.477 1.00 0.00 C -ATOM 2164 HE1 PHE 139 -18.762 -8.367 16.515 1.00 0.00 H -ATOM 2165 CZ PHE 139 -17.066 -7.027 16.287 1.00 0.00 C -ATOM 2166 HZ PHE 139 -17.661 -6.128 16.208 1.00 0.00 H -ATOM 2167 CE2 PHE 139 -15.702 -6.853 16.011 1.00 0.00 C -ATOM 2168 HE2 PHE 139 -15.187 -5.944 15.737 1.00 0.00 H -ATOM 2169 CD2 PHE 139 -14.845 -7.977 16.308 1.00 0.00 C -ATOM 2170 HD2 PHE 139 -13.791 -7.895 16.087 1.00 0.00 H -ATOM 2171 C PHE 139 -13.539 -9.744 19.083 1.00 0.00 C -ATOM 2172 O PHE 139 -14.205 -9.136 19.919 1.00 0.00 O -ATOM 2173 N SER 140 -12.306 -9.430 18.754 1.00 0.00 N -ATOM 2174 H SER 140 -11.924 -10.076 18.077 1.00 0.00 H -ATOM 2175 CA SER 140 -11.460 -8.353 19.229 1.00 0.00 C -ATOM 2176 HA SER 140 -12.136 -7.533 19.471 1.00 0.00 H -ATOM 2177 CB SER 140 -10.696 -8.769 20.558 1.00 0.00 C -ATOM 2178 HB2 SER 140 -11.465 -8.988 21.298 1.00 0.00 H -ATOM 2179 HB3 SER 140 -10.014 -9.611 20.437 1.00 0.00 H -ATOM 2180 OG SER 140 -9.948 -7.634 21.106 1.00 0.00 O -ATOM 2181 HG SER 140 -10.563 -6.918 21.285 1.00 0.00 H -ATOM 2182 C SER 140 -10.392 -8.005 18.192 1.00 0.00 C -ATOM 2183 O SER 140 -9.875 -8.913 17.536 1.00 0.00 O -ATOM 2184 N VAL 141 -10.313 -6.695 17.898 1.00 0.00 N -ATOM 2185 H VAL 141 -11.044 -6.193 18.383 1.00 0.00 H -ATOM 2186 CA VAL 141 -9.489 -6.095 16.881 1.00 0.00 C -ATOM 2187 HA VAL 141 -9.028 -6.780 16.169 1.00 0.00 H -ATOM 2188 CB VAL 141 -10.297 -5.081 15.976 1.00 0.00 C -ATOM 2189 HB VAL 141 -10.899 -4.395 16.572 1.00 0.00 H -ATOM 2190 CG1 VAL 141 -9.553 -4.282 14.904 1.00 0.00 C -ATOM 2191 HG11 VAL 141 -8.788 -3.647 15.348 1.00 0.00 H -ATOM 2192 HG12 VAL 141 -9.238 -4.945 14.098 1.00 0.00 H -ATOM 2193 HG13 VAL 141 -10.297 -3.594 14.502 1.00 0.00 H -ATOM 2194 CG2 VAL 141 -11.438 -5.858 15.284 1.00 0.00 C -ATOM 2195 HG21 VAL 141 -12.138 -5.238 14.724 1.00 0.00 H -ATOM 2196 HG22 VAL 141 -11.131 -6.646 14.597 1.00 0.00 H -ATOM 2197 HG23 VAL 141 -12.128 -6.352 15.968 1.00 0.00 H -ATOM 2198 C VAL 141 -8.315 -5.366 17.536 1.00 0.00 C -ATOM 2199 O VAL 141 -8.514 -4.603 18.497 1.00 0.00 O -ATOM 2200 N LYS 142 -7.110 -5.477 16.930 1.00 0.00 N -ATOM 2201 H LYS 142 -7.089 -6.049 16.098 1.00 0.00 H -ATOM 2202 CA LYS 142 -5.828 -4.893 17.445 1.00 0.00 C -ATOM 2203 HA LYS 142 -6.091 -4.185 18.231 1.00 0.00 H -ATOM 2204 CB LYS 142 -4.919 -6.070 17.933 1.00 0.00 C -ATOM 2205 HB2 LYS 142 -5.062 -6.872 17.210 1.00 0.00 H -ATOM 2206 HB3 LYS 142 -3.874 -5.766 17.980 1.00 0.00 H -ATOM 2207 CG LYS 142 -5.141 -6.611 19.366 1.00 0.00 C -ATOM 2208 HG2 LYS 142 -4.136 -6.776 19.754 1.00 0.00 H -ATOM 2209 HG3 LYS 142 -5.636 -5.880 20.007 1.00 0.00 H -ATOM 2210 CD LYS 142 -6.045 -7.808 19.510 1.00 0.00 C -ATOM 2211 HD2 LYS 142 -7.011 -7.528 19.085 1.00 0.00 H -ATOM 2212 HD3 LYS 142 -5.515 -8.656 19.080 1.00 0.00 H -ATOM 2213 CE LYS 142 -6.178 -8.109 20.999 1.00 0.00 C -ATOM 2214 HE2 LYS 142 -5.192 -8.397 21.363 1.00 0.00 H -ATOM 2215 HE3 LYS 142 -6.503 -7.161 21.426 1.00 0.00 H -ATOM 2216 NZ LYS 142 -7.317 -8.974 21.311 1.00 0.00 N -ATOM 2217 HZ1 LYS 142 -7.327 -9.686 20.596 1.00 0.00 H -ATOM 2218 HZ2 LYS 142 -7.250 -9.465 22.191 1.00 0.00 H -ATOM 2219 HZ3 LYS 142 -8.188 -8.464 21.351 1.00 0.00 H -ATOM 2220 C LYS 142 -5.070 -4.201 16.332 1.00 0.00 C -ATOM 2221 O LYS 142 -5.279 -4.593 15.181 1.00 0.00 O -ATOM 2222 N VAL 143 -4.234 -3.175 16.525 1.00 0.00 N -ATOM 2223 H VAL 143 -4.059 -2.863 17.469 1.00 0.00 H -ATOM 2224 CA VAL 143 -3.638 -2.396 15.409 1.00 0.00 C -ATOM 2225 HA VAL 143 -3.387 -3.154 14.667 1.00 0.00 H -ATOM 2226 CB VAL 143 -4.611 -1.295 14.906 1.00 0.00 C -ATOM 2227 HB VAL 143 -4.189 -0.946 13.964 1.00 0.00 H -ATOM 2228 CG1 VAL 143 -6.106 -1.712 14.636 1.00 0.00 C -ATOM 2229 HG11 VAL 143 -6.563 -0.887 14.088 1.00 0.00 H -ATOM 2230 HG12 VAL 143 -6.140 -2.655 14.091 1.00 0.00 H -ATOM 2231 HG13 VAL 143 -6.771 -1.793 15.497 1.00 0.00 H -ATOM 2232 CG2 VAL 143 -4.612 -0.065 15.877 1.00 0.00 C -ATOM 2233 HG21 VAL 143 -5.445 0.617 15.702 1.00 0.00 H -ATOM 2234 HG22 VAL 143 -4.807 -0.421 16.889 1.00 0.00 H -ATOM 2235 HG23 VAL 143 -3.678 0.496 15.916 1.00 0.00 H -ATOM 2236 C VAL 143 -2.223 -1.863 15.659 1.00 0.00 C -ATOM 2237 O VAL 143 -1.695 -1.756 16.760 1.00 0.00 O -ATOM 2238 N SER 144 -1.551 -1.499 14.587 1.00 0.00 N -ATOM 2239 H SER 144 -1.955 -1.718 13.687 1.00 0.00 H -ATOM 2240 CA SER 144 -0.313 -0.828 14.598 1.00 0.00 C -ATOM 2241 HA SER 144 -0.234 -0.191 15.480 1.00 0.00 H -ATOM 2242 CB SER 144 0.864 -1.798 14.606 1.00 0.00 C -ATOM 2243 HB2 SER 144 0.516 -2.631 15.217 1.00 0.00 H -ATOM 2244 HB3 SER 144 0.967 -2.282 13.634 1.00 0.00 H -ATOM 2245 OG SER 144 2.090 -1.221 14.953 1.00 0.00 O -ATOM 2246 HG SER 144 1.837 -0.734 15.741 1.00 0.00 H -ATOM 2247 C SER 144 -0.129 0.213 13.455 1.00 0.00 C -ATOM 2248 O SER 144 -0.693 0.112 12.377 1.00 0.00 O -ATOM 2249 N LEU 145 0.699 1.233 13.765 1.00 0.00 N -ATOM 2250 H LEU 145 0.922 1.377 14.740 1.00 0.00 H -ATOM 2251 CA LEU 145 0.966 2.308 12.867 1.00 0.00 C -ATOM 2252 HA LEU 145 0.519 2.052 11.906 1.00 0.00 H -ATOM 2253 CB LEU 145 0.235 3.595 13.209 1.00 0.00 C -ATOM 2254 HB2 LEU 145 -0.823 3.412 13.395 1.00 0.00 H -ATOM 2255 HB3 LEU 145 0.528 3.813 14.236 1.00 0.00 H -ATOM 2256 CG LEU 145 0.463 4.787 12.317 1.00 0.00 C -ATOM 2257 HG LEU 145 1.530 4.851 12.100 1.00 0.00 H -ATOM 2258 CD1 LEU 145 -0.337 4.421 11.058 1.00 0.00 C -ATOM 2259 HD11 LEU 145 -1.341 4.046 11.262 1.00 0.00 H -ATOM 2260 HD12 LEU 145 -0.495 5.322 10.465 1.00 0.00 H -ATOM 2261 HD13 LEU 145 0.071 3.704 10.345 1.00 0.00 H -ATOM 2262 CD2 LEU 145 -0.058 6.100 13.001 1.00 0.00 C -ATOM 2263 HD21 LEU 145 -0.962 5.923 13.583 1.00 0.00 H -ATOM 2264 HD22 LEU 145 0.700 6.487 13.682 1.00 0.00 H -ATOM 2265 HD23 LEU 145 -0.271 6.855 12.245 1.00 0.00 H -ATOM 2266 C LEU 145 2.529 2.618 12.699 1.00 0.00 C -ATOM 2267 O LEU 145 3.091 3.141 13.654 1.00 0.00 O -ATOM 2268 N LEU 146 3.146 2.367 11.515 1.00 0.00 N -ATOM 2269 H LEU 146 2.600 2.061 10.722 1.00 0.00 H -ATOM 2270 CA LEU 146 4.623 2.425 11.353 1.00 0.00 C -ATOM 2271 HA LEU 146 4.985 2.881 12.275 1.00 0.00 H -ATOM 2272 CB LEU 146 5.272 1.010 11.096 1.00 0.00 C -ATOM 2273 HB2 LEU 146 4.767 0.713 10.177 1.00 0.00 H -ATOM 2274 HB3 LEU 146 6.344 1.112 10.929 1.00 0.00 H -ATOM 2275 CG LEU 146 5.007 0.020 12.274 1.00 0.00 C -ATOM 2276 HG LEU 146 3.942 -0.029 12.500 1.00 0.00 H -ATOM 2277 CD1 LEU 146 5.448 -1.389 11.897 1.00 0.00 C -ATOM 2278 HD11 LEU 146 4.846 -1.845 11.112 1.00 0.00 H -ATOM 2279 HD12 LEU 146 6.445 -1.409 11.459 1.00 0.00 H -ATOM 2280 HD13 LEU 146 5.398 -1.978 12.813 1.00 0.00 H -ATOM 2281 CD2 LEU 146 5.852 0.406 13.566 1.00 0.00 C -ATOM 2282 HD21 LEU 146 6.875 0.683 13.311 1.00 0.00 H -ATOM 2283 HD22 LEU 146 5.421 1.231 14.134 1.00 0.00 H -ATOM 2284 HD23 LEU 146 6.019 -0.417 14.260 1.00 0.00 H -ATOM 2285 C LEU 146 5.021 3.306 10.201 1.00 0.00 C -ATOM 2286 O LEU 146 4.231 3.417 9.206 1.00 0.00 O -ATOM 2287 N GLU 147 6.130 4.008 10.221 1.00 0.00 N -ATOM 2288 H GLU 147 6.737 3.773 10.992 1.00 0.00 H -ATOM 2289 CA GLU 147 6.613 4.978 9.194 1.00 0.00 C -ATOM 2290 HA GLU 147 5.991 5.018 8.299 1.00 0.00 H -ATOM 2291 CB GLU 147 6.222 6.301 9.752 1.00 0.00 C -ATOM 2292 HB2 GLU 147 5.205 6.410 10.129 1.00 0.00 H -ATOM 2293 HB3 GLU 147 6.728 6.417 10.712 1.00 0.00 H -ATOM 2294 CG GLU 147 6.525 7.533 8.821 1.00 0.00 C -ATOM 2295 HG2 GLU 147 6.944 8.322 9.447 1.00 0.00 H -ATOM 2296 HG3 GLU 147 7.288 7.188 8.123 1.00 0.00 H -ATOM 2297 CD GLU 147 5.321 8.076 7.990 1.00 0.00 C -ATOM 2298 OE1 GLU 147 5.519 8.997 7.146 1.00 0.00 O -ATOM 2299 OE2 GLU 147 4.167 7.514 8.050 1.00 0.00 O -ATOM 2300 C GLU 147 8.064 4.749 8.888 1.00 0.00 C -ATOM 2301 O GLU 147 8.866 4.620 9.799 1.00 0.00 O -ATOM 2302 N ILE 148 8.385 4.604 7.589 1.00 0.00 N -ATOM 2303 H ILE 148 7.661 4.813 6.918 1.00 0.00 H -ATOM 2304 CA ILE 148 9.714 4.287 7.125 1.00 0.00 C -ATOM 2305 HA ILE 148 10.412 4.297 7.962 1.00 0.00 H -ATOM 2306 CB ILE 148 9.826 2.954 6.427 1.00 0.00 C -ATOM 2307 HB ILE 148 9.249 3.142 5.521 1.00 0.00 H -ATOM 2308 CG2 ILE 148 11.261 2.549 6.054 1.00 0.00 C -ATOM 2309 HG21 ILE 148 11.812 2.620 6.991 1.00 0.00 H -ATOM 2310 HG22 ILE 148 11.359 1.543 5.646 1.00 0.00 H -ATOM 2311 HG23 ILE 148 11.687 3.338 5.434 1.00 0.00 H -ATOM 2312 CG1 ILE 148 9.109 1.750 7.207 1.00 0.00 C -ATOM 2313 HG12 ILE 148 9.355 0.794 6.746 1.00 0.00 H -ATOM 2314 HG13 ILE 148 9.362 1.641 8.262 1.00 0.00 H -ATOM 2315 CD1 ILE 148 7.549 1.749 7.034 1.00 0.00 C -ATOM 2316 HD11 ILE 148 7.390 1.707 5.957 1.00 0.00 H -ATOM 2317 HD12 ILE 148 7.232 0.758 7.360 1.00 0.00 H -ATOM 2318 HD13 ILE 148 7.131 2.655 7.472 1.00 0.00 H -ATOM 2319 C ILE 148 10.141 5.509 6.226 1.00 0.00 C -ATOM 2320 O ILE 148 9.383 5.943 5.344 1.00 0.00 O -ATOM 2321 N TYR 149 11.372 6.033 6.396 1.00 0.00 N -ATOM 2322 H TYR 149 12.022 5.558 7.006 1.00 0.00 H -ATOM 2323 CA TYR 149 11.893 7.098 5.607 1.00 0.00 C -ATOM 2324 HA TYR 149 11.538 6.943 4.589 1.00 0.00 H -ATOM 2325 CB TYR 149 11.310 8.450 5.993 1.00 0.00 C -ATOM 2326 HB2 TYR 149 10.248 8.513 5.753 1.00 0.00 H -ATOM 2327 HB3 TYR 149 11.331 8.525 7.079 1.00 0.00 H -ATOM 2328 CG TYR 149 12.037 9.642 5.403 1.00 0.00 C -ATOM 2329 CD1 TYR 149 12.794 10.487 6.174 1.00 0.00 C -ATOM 2330 HD1 TYR 149 12.822 10.372 7.247 1.00 0.00 H -ATOM 2331 CE1 TYR 149 13.575 11.489 5.634 1.00 0.00 C -ATOM 2332 HE1 TYR 149 14.180 12.071 6.314 1.00 0.00 H -ATOM 2333 CZ TYR 149 13.682 11.659 4.273 1.00 0.00 C -ATOM 2334 OH TYR 149 14.489 12.643 3.747 1.00 0.00 O -ATOM 2335 HH TYR 149 14.968 13.110 4.436 1.00 0.00 H -ATOM 2336 CE2 TYR 149 12.992 10.730 3.415 1.00 0.00 C -ATOM 2337 HE2 TYR 149 12.973 10.916 2.351 1.00 0.00 H -ATOM 2338 CD2 TYR 149 12.143 9.712 3.994 1.00 0.00 C -ATOM 2339 HD2 TYR 149 11.517 9.113 3.349 1.00 0.00 H -ATOM 2340 C TYR 149 13.437 7.134 5.591 1.00 0.00 C -ATOM 2341 O TYR 149 14.008 7.147 6.690 1.00 0.00 O -ATOM 2342 N ASN 150 14.034 7.093 4.421 1.00 0.00 N -ATOM 2343 H ASN 150 13.541 7.204 3.547 1.00 0.00 H -ATOM 2344 CA ASN 150 15.469 7.233 4.257 1.00 0.00 C -ATOM 2345 HA ASN 150 15.569 6.914 3.219 1.00 0.00 H -ATOM 2346 CB ASN 150 16.108 8.727 4.304 1.00 0.00 C -ATOM 2347 HB2 ASN 150 17.061 8.750 3.776 1.00 0.00 H -ATOM 2348 HB3 ASN 150 15.446 9.484 3.885 1.00 0.00 H -ATOM 2349 CG ASN 150 16.538 9.325 5.618 1.00 0.00 C -ATOM 2350 OD1 ASN 150 17.364 10.187 5.642 1.00 0.00 O -ATOM 2351 ND2 ASN 150 16.110 8.875 6.795 1.00 0.00 N -ATOM 2352 HD21 ASN 150 16.531 9.251 7.633 1.00 0.00 H -ATOM 2353 HD22 ASN 150 15.425 8.142 6.901 1.00 0.00 H -ATOM 2354 C ASN 150 16.318 6.152 4.941 1.00 0.00 C -ATOM 2355 O ASN 150 17.351 6.427 5.579 1.00 0.00 O -ATOM 2356 N GLU 151 15.795 4.912 4.994 1.00 0.00 N -ATOM 2357 H GLU 151 14.931 4.712 4.511 1.00 0.00 H -ATOM 2358 CA GLU 151 16.295 3.786 5.860 1.00 0.00 C -ATOM 2359 HA GLU 151 15.719 2.869 5.747 1.00 0.00 H -ATOM 2360 CB GLU 151 17.683 3.320 5.362 1.00 0.00 C -ATOM 2361 HB2 GLU 151 18.436 4.106 5.416 1.00 0.00 H -ATOM 2362 HB3 GLU 151 18.063 2.540 6.023 1.00 0.00 H -ATOM 2363 CG GLU 151 17.735 2.852 3.882 1.00 0.00 C -ATOM 2364 HG2 GLU 151 17.639 3.782 3.322 1.00 0.00 H -ATOM 2365 HG3 GLU 151 18.682 2.328 3.743 1.00 0.00 H -ATOM 2366 CD GLU 151 16.663 1.889 3.454 1.00 0.00 C -ATOM 2367 OE1 GLU 151 16.317 1.048 4.302 1.00 0.00 O -ATOM 2368 OE2 GLU 151 16.026 2.048 2.392 1.00 0.00 O -ATOM 2369 C GLU 151 16.314 3.987 7.438 1.00 0.00 C -ATOM 2370 O GLU 151 17.075 3.346 8.168 1.00 0.00 O -ATOM 2371 N GLU 152 15.395 4.853 7.937 1.00 0.00 N -ATOM 2372 H GLU 152 14.834 5.386 7.287 1.00 0.00 H -ATOM 2373 CA GLU 152 15.052 5.063 9.359 1.00 0.00 C -ATOM 2374 HA GLU 152 15.706 4.391 9.915 1.00 0.00 H -ATOM 2375 CB GLU 152 15.523 6.469 9.681 1.00 0.00 C -ATOM 2376 HB2 GLU 152 14.939 7.221 9.150 1.00 0.00 H -ATOM 2377 HB3 GLU 152 15.233 6.642 10.717 1.00 0.00 H -ATOM 2378 CG GLU 152 16.980 6.985 9.560 1.00 0.00 C -ATOM 2379 HG2 GLU 152 17.765 6.480 10.124 1.00 0.00 H -ATOM 2380 HG3 GLU 152 17.046 6.996 8.472 1.00 0.00 H -ATOM 2381 CD GLU 152 17.077 8.429 10.084 1.00 0.00 C -ATOM 2382 OE1 GLU 152 16.802 8.695 11.273 1.00 0.00 O -ATOM 2383 OE2 GLU 152 17.456 9.368 9.292 1.00 0.00 O -ATOM 2384 C GLU 152 13.579 4.861 9.770 1.00 0.00 C -ATOM 2385 O GLU 152 12.839 4.894 8.803 1.00 0.00 O -ATOM 2386 N LEU 153 13.167 4.605 11.011 1.00 0.00 N -ATOM 2387 H LEU 153 13.798 4.798 11.777 1.00 0.00 H -ATOM 2388 CA LEU 153 11.840 4.215 11.404 1.00 0.00 C -ATOM 2389 HA LEU 153 11.212 4.125 10.517 1.00 0.00 H -ATOM 2390 CB LEU 153 11.708 2.819 12.154 1.00 0.00 C -ATOM 2391 HB2 LEU 153 12.299 2.950 13.060 1.00 0.00 H -ATOM 2392 HB3 LEU 153 10.646 2.669 12.346 1.00 0.00 H -ATOM 2393 CG LEU 153 12.339 1.636 11.375 1.00 0.00 C -ATOM 2394 HG LEU 153 13.394 1.855 11.212 1.00 0.00 H -ATOM 2395 CD1 LEU 153 12.120 0.276 12.100 1.00 0.00 C -ATOM 2396 HD11 LEU 153 12.270 -0.502 11.353 1.00 0.00 H -ATOM 2397 HD12 LEU 153 12.805 0.183 12.943 1.00 0.00 H -ATOM 2398 HD13 LEU 153 11.086 0.238 12.445 1.00 0.00 H -ATOM 2399 CD2 LEU 153 11.601 1.390 10.041 1.00 0.00 C -ATOM 2400 HD21 LEU 153 11.579 2.358 9.540 1.00 0.00 H -ATOM 2401 HD22 LEU 153 12.040 0.726 9.295 1.00 0.00 H -ATOM 2402 HD23 LEU 153 10.586 1.062 10.263 1.00 0.00 H -ATOM 2403 C LEU 153 11.398 5.341 12.370 1.00 0.00 C -ATOM 2404 O LEU 153 11.824 5.631 13.453 1.00 0.00 O -ATOM 2405 N PHE 154 10.322 6.013 11.896 1.00 0.00 N -ATOM 2406 H PHE 154 9.853 5.678 11.066 1.00 0.00 H -ATOM 2407 CA PHE 154 9.681 7.102 12.590 1.00 0.00 C -ATOM 2408 HA PHE 154 10.358 7.621 13.268 1.00 0.00 H -ATOM 2409 CB PHE 154 9.126 8.080 11.513 1.00 0.00 C -ATOM 2410 HB2 PHE 154 8.581 7.577 10.714 1.00 0.00 H -ATOM 2411 HB3 PHE 154 8.415 8.678 12.081 1.00 0.00 H -ATOM 2412 CG PHE 154 10.257 8.951 11.003 1.00 0.00 C -ATOM 2413 CD1 PHE 154 10.112 10.326 11.170 1.00 0.00 C -ATOM 2414 HD1 PHE 154 9.232 10.736 11.643 1.00 0.00 H -ATOM 2415 CE1 PHE 154 11.089 11.221 10.704 1.00 0.00 C -ATOM 2416 HE1 PHE 154 10.970 12.275 10.909 1.00 0.00 H -ATOM 2417 CZ PHE 154 12.250 10.756 10.030 1.00 0.00 C -ATOM 2418 HZ PHE 154 13.049 11.419 9.733 1.00 0.00 H -ATOM 2419 CE2 PHE 154 12.357 9.337 9.783 1.00 0.00 C -ATOM 2420 HE2 PHE 154 13.196 9.098 9.147 1.00 0.00 H -ATOM 2421 CD2 PHE 154 11.379 8.441 10.201 1.00 0.00 C -ATOM 2422 HD2 PHE 154 11.473 7.419 9.863 1.00 0.00 H -ATOM 2423 C PHE 154 8.582 6.592 13.508 1.00 0.00 C -ATOM 2424 O PHE 154 7.875 5.691 13.195 1.00 0.00 O -ATOM 2425 N ASP 155 8.442 7.262 14.693 1.00 0.00 N -ATOM 2426 H ASP 155 8.983 8.114 14.752 1.00 0.00 H -ATOM 2427 CA ASP 155 7.650 6.926 15.825 1.00 0.00 C -ATOM 2428 HA ASP 155 7.237 5.926 15.697 1.00 0.00 H -ATOM 2429 CB ASP 155 8.522 6.845 17.049 1.00 0.00 C -ATOM 2430 HB2 ASP 155 9.261 6.090 16.779 1.00 0.00 H -ATOM 2431 HB3 ASP 155 9.004 7.793 17.285 1.00 0.00 H -ATOM 2432 CG ASP 155 7.741 6.413 18.300 1.00 0.00 C -ATOM 2433 OD1 ASP 155 8.273 6.526 19.401 1.00 0.00 O -ATOM 2434 OD2 ASP 155 6.606 5.819 18.215 1.00 0.00 O -ATOM 2435 C ASP 155 6.531 7.971 16.008 1.00 0.00 C -ATOM 2436 O ASP 155 6.675 8.834 16.833 1.00 0.00 O -ATOM 2437 N LEU 156 5.515 7.942 15.132 1.00 0.00 N -ATOM 2438 H LEU 156 5.567 7.282 14.369 1.00 0.00 H -ATOM 2439 CA LEU 156 4.598 9.014 15.050 1.00 0.00 C -ATOM 2440 HA LEU 156 5.212 9.900 14.885 1.00 0.00 H -ATOM 2441 CB LEU 156 3.689 8.941 13.776 1.00 0.00 C -ATOM 2442 HB2 LEU 156 2.997 8.141 14.037 1.00 0.00 H -ATOM 2443 HB3 LEU 156 3.221 9.924 13.723 1.00 0.00 H -ATOM 2444 CG LEU 156 4.336 8.678 12.364 1.00 0.00 C -ATOM 2445 HG LEU 156 4.922 7.766 12.253 1.00 0.00 H -ATOM 2446 CD1 LEU 156 3.367 8.731 11.262 1.00 0.00 C -ATOM 2447 HD11 LEU 156 2.774 9.635 11.404 1.00 0.00 H -ATOM 2448 HD12 LEU 156 3.879 8.836 10.304 1.00 0.00 H -ATOM 2449 HD13 LEU 156 2.728 7.849 11.248 1.00 0.00 H -ATOM 2450 CD2 LEU 156 5.306 9.822 12.080 1.00 0.00 C -ATOM 2451 HD21 LEU 156 4.791 10.770 12.238 1.00 0.00 H -ATOM 2452 HD22 LEU 156 6.120 9.870 12.802 1.00 0.00 H -ATOM 2453 HD23 LEU 156 5.600 9.780 11.031 1.00 0.00 H -ATOM 2454 C LEU 156 3.660 9.249 16.222 1.00 0.00 C -ATOM 2455 O LEU 156 3.295 10.437 16.479 1.00 0.00 O -ATOM 2456 N LEU 157 3.367 8.245 17.008 1.00 0.00 N -ATOM 2457 H LEU 157 3.851 7.361 16.934 1.00 0.00 H -ATOM 2458 CA LEU 157 2.601 8.316 18.298 1.00 0.00 C -ATOM 2459 HA LEU 157 1.915 9.161 18.359 1.00 0.00 H -ATOM 2460 CB LEU 157 1.821 6.984 18.430 1.00 0.00 C -ATOM 2461 HB2 LEU 157 2.494 6.153 18.643 1.00 0.00 H -ATOM 2462 HB3 LEU 157 1.173 7.057 19.302 1.00 0.00 H -ATOM 2463 CG LEU 157 0.893 6.498 17.262 1.00 0.00 C -ATOM 2464 HG LEU 157 1.441 6.533 16.321 1.00 0.00 H -ATOM 2465 CD1 LEU 157 0.420 5.066 17.547 1.00 0.00 C -ATOM 2466 HD11 LEU 157 1.268 4.405 17.723 1.00 0.00 H -ATOM 2467 HD12 LEU 157 -0.361 5.046 18.308 1.00 0.00 H -ATOM 2468 HD13 LEU 157 -0.173 4.768 16.683 1.00 0.00 H -ATOM 2469 CD2 LEU 157 -0.255 7.496 17.001 1.00 0.00 C -ATOM 2470 HD21 LEU 157 -0.881 7.665 17.878 1.00 0.00 H -ATOM 2471 HD22 LEU 157 0.013 8.400 16.455 1.00 0.00 H -ATOM 2472 HD23 LEU 157 -0.903 6.962 16.307 1.00 0.00 H -ATOM 2473 C LEU 157 3.361 8.576 19.573 1.00 0.00 C -ATOM 2474 O LEU 157 2.838 8.321 20.661 1.00 0.00 O -ATOM 2475 N ASN 158 4.546 9.088 19.497 1.00 0.00 N -ATOM 2476 H ASN 158 4.969 9.119 18.580 1.00 0.00 H -ATOM 2477 CA ASN 158 5.371 9.539 20.678 1.00 0.00 C -ATOM 2478 HA ASN 158 5.479 8.711 21.379 1.00 0.00 H -ATOM 2479 CB ASN 158 6.775 9.898 20.196 1.00 0.00 C -ATOM 2480 HB2 ASN 158 7.234 9.149 19.551 1.00 0.00 H -ATOM 2481 HB3 ASN 158 6.677 10.793 19.581 1.00 0.00 H -ATOM 2482 CG ASN 158 7.732 10.146 21.314 1.00 0.00 C -ATOM 2483 OD1 ASN 158 7.393 10.954 22.171 1.00 0.00 O -ATOM 2484 ND2 ASN 158 8.857 9.537 21.273 1.00 0.00 N -ATOM 2485 HD21 ASN 158 9.473 9.538 22.074 1.00 0.00 H -ATOM 2486 HD22 ASN 158 9.179 8.871 20.585 1.00 0.00 H -ATOM 2487 C ASN 158 4.587 10.698 21.393 1.00 0.00 C -ATOM 2488 O ASN 158 4.004 11.488 20.631 1.00 0.00 O -ATOM 2489 N PRO 159 4.616 10.919 22.726 1.00 0.00 N -ATOM 2490 CD PRO 159 4.849 9.865 23.689 1.00 0.00 C -ATOM 2491 HD2 PRO 159 5.886 9.806 24.024 1.00 0.00 H -ATOM 2492 HD3 PRO 159 4.480 8.904 23.332 1.00 0.00 H -ATOM 2493 CG PRO 159 4.069 10.331 24.932 1.00 0.00 C -ATOM 2494 HG2 PRO 159 4.545 10.037 25.867 1.00 0.00 H -ATOM 2495 HG3 PRO 159 3.069 9.899 24.907 1.00 0.00 H -ATOM 2496 CB PRO 159 3.936 11.828 24.858 1.00 0.00 C -ATOM 2497 HB2 PRO 159 4.759 12.235 25.445 1.00 0.00 H -ATOM 2498 HB3 PRO 159 2.985 12.126 25.301 1.00 0.00 H -ATOM 2499 CA PRO 159 4.077 12.141 23.324 1.00 0.00 C -ATOM 2500 HA PRO 159 3.040 12.227 23.002 1.00 0.00 H -ATOM 2501 C PRO 159 4.919 13.415 22.933 1.00 0.00 C -ATOM 2502 O PRO 159 4.338 14.421 22.755 1.00 0.00 O -ATOM 2503 N SER 160 6.226 13.298 22.664 1.00 0.00 N -ATOM 2504 H SER 160 6.614 12.367 22.704 1.00 0.00 H -ATOM 2505 CA SER 160 7.110 14.425 22.288 1.00 0.00 C -ATOM 2506 HA SER 160 6.926 15.091 23.131 1.00 0.00 H -ATOM 2507 CB SER 160 8.542 13.869 22.231 1.00 0.00 C -ATOM 2508 HB2 SER 160 8.853 13.485 23.202 1.00 0.00 H -ATOM 2509 HB3 SER 160 8.760 13.081 21.510 1.00 0.00 H -ATOM 2510 OG SER 160 9.427 14.973 22.027 1.00 0.00 O -ATOM 2511 HG SER 160 10.327 14.670 22.166 1.00 0.00 H -ATOM 2512 C SER 160 6.646 15.168 21.015 1.00 0.00 C -ATOM 2513 O SER 160 6.138 14.487 20.097 1.00 0.00 O -ATOM 2514 N SER 161 6.825 16.521 21.010 1.00 0.00 N -ATOM 2515 H SER 161 7.147 16.978 21.852 1.00 0.00 H -ATOM 2516 CA SER 161 6.665 17.338 19.773 1.00 0.00 C -ATOM 2517 HA SER 161 5.775 16.978 19.259 1.00 0.00 H -ATOM 2518 CB SER 161 6.475 18.802 20.114 1.00 0.00 C -ATOM 2519 HB2 SER 161 7.387 19.099 20.630 1.00 0.00 H -ATOM 2520 HB3 SER 161 6.303 19.346 19.185 1.00 0.00 H -ATOM 2521 OG SER 161 5.389 18.767 21.032 1.00 0.00 O -ATOM 2522 HG SER 161 4.739 19.313 20.586 1.00 0.00 H -ATOM 2523 C SER 161 7.823 17.232 18.788 1.00 0.00 C -ATOM 2524 O SER 161 7.712 17.662 17.648 1.00 0.00 O -ATOM 2525 N ASP 162 8.996 16.658 19.233 1.00 0.00 N -ATOM 2526 H ASP 162 9.075 16.358 20.193 1.00 0.00 H -ATOM 2527 CA ASP 162 10.209 16.355 18.482 1.00 0.00 C -ATOM 2528 HA ASP 162 10.304 17.315 17.972 1.00 0.00 H -ATOM 2529 CB ASP 162 11.335 16.114 19.479 1.00 0.00 C -ATOM 2530 HB2 ASP 162 11.305 16.930 20.201 1.00 0.00 H -ATOM 2531 HB3 ASP 162 11.136 15.214 20.062 1.00 0.00 H -ATOM 2532 CG ASP 162 12.732 16.068 18.865 1.00 0.00 C -ATOM 2533 OD1 ASP 162 13.734 16.015 19.619 1.00 0.00 O -ATOM 2534 OD2 ASP 162 12.881 16.241 17.637 1.00 0.00 O -ATOM 2535 C ASP 162 10.033 15.252 17.389 1.00 0.00 C -ATOM 2536 O ASP 162 9.398 14.237 17.555 1.00 0.00 O -ATOM 2537 N VAL 163 10.559 15.520 16.211 1.00 0.00 N -ATOM 2538 H VAL 163 10.809 16.494 16.107 1.00 0.00 H -ATOM 2539 CA VAL 163 10.650 14.701 15.052 1.00 0.00 C -ATOM 2540 HA VAL 163 9.722 14.138 14.959 1.00 0.00 H -ATOM 2541 CB VAL 163 10.606 15.625 13.809 1.00 0.00 C -ATOM 2542 HB VAL 163 11.510 16.233 13.798 1.00 0.00 H -ATOM 2543 CG1 VAL 163 10.540 14.786 12.508 1.00 0.00 C -ATOM 2544 HG11 VAL 163 10.437 15.498 11.690 1.00 0.00 H -ATOM 2545 HG12 VAL 163 11.451 14.232 12.283 1.00 0.00 H -ATOM 2546 HG13 VAL 163 9.663 14.144 12.426 1.00 0.00 H -ATOM 2547 CG2 VAL 163 9.288 16.475 13.826 1.00 0.00 C -ATOM 2548 HG21 VAL 163 8.947 16.803 12.843 1.00 0.00 H -ATOM 2549 HG22 VAL 163 8.465 15.885 14.231 1.00 0.00 H -ATOM 2550 HG23 VAL 163 9.405 17.405 14.381 1.00 0.00 H -ATOM 2551 C VAL 163 11.773 13.689 15.041 1.00 0.00 C -ATOM 2552 O VAL 163 11.817 12.752 14.247 1.00 0.00 O -ATOM 2553 N SER 164 12.773 13.933 15.888 1.00 0.00 N -ATOM 2554 H SER 164 12.666 14.790 16.413 1.00 0.00 H -ATOM 2555 CA SER 164 13.986 13.128 16.123 1.00 0.00 C -ATOM 2556 HA SER 164 14.429 12.943 15.145 1.00 0.00 H -ATOM 2557 CB SER 164 14.966 13.939 16.959 1.00 0.00 C -ATOM 2558 HB2 SER 164 14.780 13.798 18.023 1.00 0.00 H -ATOM 2559 HB3 SER 164 15.948 13.495 16.791 1.00 0.00 H -ATOM 2560 OG SER 164 15.128 15.305 16.604 1.00 0.00 O -ATOM 2561 HG SER 164 14.395 15.772 17.011 1.00 0.00 H -ATOM 2562 C SER 164 13.749 11.729 16.735 1.00 0.00 C -ATOM 2563 O SER 164 14.674 10.948 16.847 1.00 0.00 O -ATOM 2564 N GLU 165 12.533 11.401 17.111 1.00 0.00 N -ATOM 2565 H GLU 165 11.775 12.053 16.968 1.00 0.00 H -ATOM 2566 CA GLU 165 12.177 10.102 17.663 1.00 0.00 C -ATOM 2567 HA GLU 165 12.963 9.783 18.347 1.00 0.00 H -ATOM 2568 CB GLU 165 10.835 10.324 18.419 1.00 0.00 C -ATOM 2569 HB2 GLU 165 10.044 10.550 17.705 1.00 0.00 H -ATOM 2570 HB3 GLU 165 10.471 9.420 18.907 1.00 0.00 H -ATOM 2571 CG GLU 165 10.802 11.496 19.415 1.00 0.00 C -ATOM 2572 HG2 GLU 165 11.101 12.393 18.873 1.00 0.00 H -ATOM 2573 HG3 GLU 165 9.790 11.731 19.743 1.00 0.00 H -ATOM 2574 CD GLU 165 11.741 11.205 20.561 1.00 0.00 C -ATOM 2575 OE1 GLU 165 12.089 12.220 21.226 1.00 0.00 O -ATOM 2576 OE2 GLU 165 12.203 10.050 20.729 1.00 0.00 O -ATOM 2577 C GLU 165 12.013 9.009 16.633 1.00 0.00 C -ATOM 2578 O GLU 165 11.570 9.191 15.520 1.00 0.00 O -ATOM 2579 N ARG 166 12.410 7.827 17.033 1.00 0.00 N -ATOM 2580 H ARG 166 12.541 7.668 18.022 1.00 0.00 H -ATOM 2581 CA ARG 166 12.591 6.540 16.327 1.00 0.00 C -ATOM 2582 HA ARG 166 11.895 6.626 15.494 1.00 0.00 H -ATOM 2583 CB ARG 166 13.993 6.237 15.843 1.00 0.00 C -ATOM 2584 HB2 ARG 166 14.641 5.973 16.678 1.00 0.00 H -ATOM 2585 HB3 ARG 166 13.868 5.387 15.171 1.00 0.00 H -ATOM 2586 CG ARG 166 14.648 7.364 15.036 1.00 0.00 C -ATOM 2587 HG2 ARG 166 14.744 8.253 15.658 1.00 0.00 H -ATOM 2588 HG3 ARG 166 15.634 6.980 14.772 1.00 0.00 H -ATOM 2589 CD ARG 166 14.033 7.686 13.639 1.00 0.00 C -ATOM 2590 HD2 ARG 166 14.224 6.772 13.078 1.00 0.00 H -ATOM 2591 HD3 ARG 166 12.996 7.947 13.850 1.00 0.00 H -ATOM 2592 NE ARG 166 14.725 8.696 12.878 1.00 0.00 N -ATOM 2593 HE ARG 166 15.565 8.336 12.446 1.00 0.00 H -ATOM 2594 CZ ARG 166 14.356 9.969 12.758 1.00 0.00 C -ATOM 2595 NH1 ARG 166 13.244 10.410 13.265 1.00 0.00 N -ATOM 2596 HH11 ARG 166 12.592 9.742 13.653 1.00 0.00 H -ATOM 2597 HH12 ARG 166 12.983 11.385 13.279 1.00 0.00 H -ATOM 2598 NH2 ARG 166 15.238 10.729 12.213 1.00 0.00 N -ATOM 2599 HH21 ARG 166 16.108 10.306 11.921 1.00 0.00 H -ATOM 2600 HH22 ARG 166 14.980 11.696 12.076 1.00 0.00 H -ATOM 2601 C ARG 166 12.030 5.257 16.976 1.00 0.00 C -ATOM 2602 O ARG 166 11.670 5.075 18.151 1.00 0.00 O -ATOM 2603 N LEU 167 11.801 4.285 16.135 1.00 0.00 N -ATOM 2604 H LEU 167 12.011 4.489 15.169 1.00 0.00 H -ATOM 2605 CA LEU 167 11.567 2.842 16.468 1.00 0.00 C -ATOM 2606 HA LEU 167 11.435 2.652 17.534 1.00 0.00 H -ATOM 2607 CB LEU 167 10.211 2.398 15.812 1.00 0.00 C -ATOM 2608 HB2 LEU 167 10.196 2.768 14.786 1.00 0.00 H -ATOM 2609 HB3 LEU 167 10.314 1.318 15.711 1.00 0.00 H -ATOM 2610 CG LEU 167 9.067 2.874 16.693 1.00 0.00 C -ATOM 2611 HG LEU 167 9.277 3.844 17.146 1.00 0.00 H -ATOM 2612 CD1 LEU 167 7.787 2.934 15.840 1.00 0.00 C -ATOM 2613 HD11 LEU 167 6.966 3.362 16.414 1.00 0.00 H -ATOM 2614 HD12 LEU 167 7.880 3.559 14.952 1.00 0.00 H -ATOM 2615 HD13 LEU 167 7.552 1.956 15.420 1.00 0.00 H -ATOM 2616 CD2 LEU 167 8.674 1.950 17.914 1.00 0.00 C -ATOM 2617 HD21 LEU 167 8.416 0.924 17.654 1.00 0.00 H -ATOM 2618 HD22 LEU 167 9.460 2.011 18.668 1.00 0.00 H -ATOM 2619 HD23 LEU 167 7.749 2.298 18.373 1.00 0.00 H -ATOM 2620 C LEU 167 12.834 2.091 16.008 1.00 0.00 C -ATOM 2621 O LEU 167 13.561 2.570 15.093 1.00 0.00 O -ATOM 2622 N GLN 168 13.155 0.892 16.561 1.00 0.00 N -ATOM 2623 H GLN 168 12.586 0.516 17.305 1.00 0.00 H -ATOM 2624 CA GLN 168 14.151 -0.017 15.947 1.00 0.00 C -ATOM 2625 HA GLN 168 14.449 0.485 15.026 1.00 0.00 H -ATOM 2626 CB GLN 168 15.395 -0.033 16.847 1.00 0.00 C -ATOM 2627 HB2 GLN 168 15.126 -0.460 17.815 1.00 0.00 H -ATOM 2628 HB3 GLN 168 16.073 -0.703 16.318 1.00 0.00 H -ATOM 2629 CG GLN 168 16.071 1.334 17.022 1.00 0.00 C -ATOM 2630 HG2 GLN 168 15.263 1.985 17.352 1.00 0.00 H -ATOM 2631 HG3 GLN 168 16.858 1.251 17.772 1.00 0.00 H -ATOM 2632 CD GLN 168 16.730 1.877 15.658 1.00 0.00 C -ATOM 2633 OE1 GLN 168 17.136 1.134 14.790 1.00 0.00 O -ATOM 2634 NE2 GLN 168 16.896 3.190 15.522 1.00 0.00 N -ATOM 2635 HE21 GLN 168 17.393 3.528 14.710 1.00 0.00 H -ATOM 2636 HE22 GLN 168 16.733 3.866 16.254 1.00 0.00 H -ATOM 2637 C GLN 168 13.704 -1.440 15.671 1.00 0.00 C -ATOM 2638 O GLN 168 12.730 -1.861 16.258 1.00 0.00 O -ATOM 2639 N MET 169 14.315 -2.161 14.765 1.00 0.00 N -ATOM 2640 H MET 169 15.143 -1.824 14.296 1.00 0.00 H -ATOM 2641 CA MET 169 13.815 -3.480 14.225 1.00 0.00 C -ATOM 2642 HA MET 169 12.887 -3.854 14.660 1.00 0.00 H -ATOM 2643 CB MET 169 13.473 -3.313 12.719 1.00 0.00 C -ATOM 2644 HB2 MET 169 12.836 -4.118 12.351 1.00 0.00 H -ATOM 2645 HB3 MET 169 12.954 -2.372 12.540 1.00 0.00 H -ATOM 2646 CG MET 169 14.657 -3.358 11.740 1.00 0.00 C -ATOM 2647 HG2 MET 169 15.193 -2.408 11.724 1.00 0.00 H -ATOM 2648 HG3 MET 169 15.442 -4.036 12.072 1.00 0.00 H -ATOM 2649 SD MET 169 14.039 -3.856 10.041 1.00 0.00 S -ATOM 2650 CE MET 169 12.941 -2.432 9.925 1.00 0.00 C -ATOM 2651 HE1 MET 169 13.555 -1.550 10.114 1.00 0.00 H -ATOM 2652 HE2 MET 169 12.533 -2.389 8.915 1.00 0.00 H -ATOM 2653 HE3 MET 169 12.084 -2.440 10.597 1.00 0.00 H -ATOM 2654 C MET 169 14.772 -4.568 14.484 1.00 0.00 C -ATOM 2655 O MET 169 15.985 -4.491 14.872 1.00 0.00 O -ATOM 2656 N PHE 170 14.270 -5.779 14.362 1.00 0.00 N -ATOM 2657 H PHE 170 13.264 -5.861 14.373 1.00 0.00 H -ATOM 2658 CA PHE 170 14.933 -7.092 14.236 1.00 0.00 C -ATOM 2659 HA PHE 170 15.858 -6.968 13.672 1.00 0.00 H -ATOM 2660 CB PHE 170 15.361 -7.647 15.618 1.00 0.00 C -ATOM 2661 HB2 PHE 170 16.151 -8.383 15.471 1.00 0.00 H -ATOM 2662 HB3 PHE 170 15.893 -6.854 16.142 1.00 0.00 H -ATOM 2663 CG PHE 170 14.238 -8.303 16.418 1.00 0.00 C -ATOM 2664 CD1 PHE 170 14.255 -9.692 16.625 1.00 0.00 C -ATOM 2665 HD1 PHE 170 15.034 -10.335 16.245 1.00 0.00 H -ATOM 2666 CE1 PHE 170 13.451 -10.262 17.565 1.00 0.00 C -ATOM 2667 HE1 PHE 170 13.569 -11.327 17.700 1.00 0.00 H -ATOM 2668 CZ PHE 170 12.607 -9.540 18.367 1.00 0.00 C -ATOM 2669 HZ PHE 170 12.035 -9.928 19.196 1.00 0.00 H -ATOM 2670 CE2 PHE 170 12.496 -8.174 18.074 1.00 0.00 C -ATOM 2671 HE2 PHE 170 11.812 -7.534 18.612 1.00 0.00 H -ATOM 2672 CD2 PHE 170 13.356 -7.512 17.212 1.00 0.00 C -ATOM 2673 HD2 PHE 170 13.395 -6.454 17.000 1.00 0.00 H -ATOM 2674 C PHE 170 14.068 -8.143 13.535 1.00 0.00 C -ATOM 2675 O PHE 170 12.908 -7.935 13.246 1.00 0.00 O -ATOM 2676 N ASP 171 14.723 -9.125 12.913 1.00 0.00 N -ATOM 2677 H ASP 171 15.707 -9.305 13.054 1.00 0.00 H -ATOM 2678 CA ASP 171 14.107 -10.057 12.026 1.00 0.00 C -ATOM 2679 HA ASP 171 13.327 -9.463 11.548 1.00 0.00 H -ATOM 2680 CB ASP 171 15.099 -10.471 10.872 1.00 0.00 C -ATOM 2681 HB2 ASP 171 15.783 -11.166 11.360 1.00 0.00 H -ATOM 2682 HB3 ASP 171 14.594 -10.952 10.035 1.00 0.00 H -ATOM 2683 CG ASP 171 15.915 -9.282 10.387 1.00 0.00 C -ATOM 2684 OD1 ASP 171 15.472 -8.319 9.729 1.00 0.00 O -ATOM 2685 OD2 ASP 171 17.119 -9.346 10.645 1.00 0.00 O -ATOM 2686 C ASP 171 13.495 -11.218 12.853 1.00 0.00 C -ATOM 2687 O ASP 171 14.083 -11.588 13.884 1.00 0.00 O -ATOM 2688 N ASP 172 12.307 -11.739 12.513 1.00 0.00 N -ATOM 2689 H ASP 172 11.812 -11.485 11.669 1.00 0.00 H -ATOM 2690 CA ASP 172 11.530 -12.596 13.391 1.00 0.00 C -ATOM 2691 HA ASP 172 11.459 -12.175 14.394 1.00 0.00 H -ATOM 2692 CB ASP 172 10.139 -12.687 12.803 1.00 0.00 C -ATOM 2693 HB2 ASP 172 9.754 -11.680 12.643 1.00 0.00 H -ATOM 2694 HB3 ASP 172 10.085 -13.207 11.846 1.00 0.00 H -ATOM 2695 CG ASP 172 9.066 -13.480 13.668 1.00 0.00 C -ATOM 2696 OD1 ASP 172 9.497 -14.213 14.592 1.00 0.00 O -ATOM 2697 OD2 ASP 172 7.850 -13.533 13.341 1.00 0.00 O -ATOM 2698 C ASP 172 12.180 -14.043 13.520 1.00 0.00 C -ATOM 2699 O ASP 172 12.101 -14.793 12.530 1.00 0.00 O -ATOM 2700 N PRO 173 12.510 -14.576 14.744 1.00 0.00 N -ATOM 2701 CD PRO 173 12.439 -13.840 15.982 1.00 0.00 C -ATOM 2702 HD2 PRO 173 11.402 -14.019 16.269 1.00 0.00 H -ATOM 2703 HD3 PRO 173 12.731 -12.793 15.894 1.00 0.00 H -ATOM 2704 CG PRO 173 13.423 -14.530 16.940 1.00 0.00 C -ATOM 2705 HG2 PRO 173 13.126 -14.548 17.988 1.00 0.00 H -ATOM 2706 HG3 PRO 173 14.405 -14.089 16.764 1.00 0.00 H -ATOM 2707 CB PRO 173 13.504 -15.980 16.456 1.00 0.00 C -ATOM 2708 HB2 PRO 173 12.661 -16.560 16.834 1.00 0.00 H -ATOM 2709 HB3 PRO 173 14.462 -16.481 16.595 1.00 0.00 H -ATOM 2710 CA PRO 173 13.374 -15.814 14.977 1.00 0.00 C -ATOM 2711 HA PRO 173 14.360 -15.662 14.537 1.00 0.00 H -ATOM 2712 C PRO 173 12.738 -17.046 14.286 1.00 0.00 C -ATOM 2713 O PRO 173 13.431 -18.084 14.134 1.00 0.00 O -ATOM 2714 N ARG 174 11.439 -16.951 13.969 1.00 0.00 N -ATOM 2715 H ARG 174 10.982 -16.064 14.121 1.00 0.00 H -ATOM 2716 CA ARG 174 10.570 -18.058 13.492 1.00 0.00 C -ATOM 2717 HA ARG 174 10.723 -18.969 14.070 1.00 0.00 H -ATOM 2718 CB ARG 174 9.090 -17.506 13.475 1.00 0.00 C -ATOM 2719 HB2 ARG 174 9.171 -16.446 13.229 1.00 0.00 H -ATOM 2720 HB3 ARG 174 8.545 -18.107 12.748 1.00 0.00 H -ATOM 2721 CG ARG 174 8.630 -17.587 14.950 1.00 0.00 C -ATOM 2722 HG2 ARG 174 8.920 -18.528 15.418 1.00 0.00 H -ATOM 2723 HG3 ARG 174 9.093 -16.773 15.508 1.00 0.00 H -ATOM 2724 CD ARG 174 7.107 -17.335 14.933 1.00 0.00 C -ATOM 2725 HD2 ARG 174 6.669 -17.998 14.187 1.00 0.00 H -ATOM 2726 HD3 ARG 174 6.710 -17.471 15.939 1.00 0.00 H -ATOM 2727 NE ARG 174 6.839 -15.960 14.640 1.00 0.00 N -ATOM 2728 HE ARG 174 7.587 -15.384 14.281 1.00 0.00 H -ATOM 2729 CZ ARG 174 5.691 -15.456 14.921 1.00 0.00 C -ATOM 2730 NH1 ARG 174 4.601 -16.126 15.203 1.00 0.00 N -ATOM 2731 HH11 ARG 174 4.646 -17.120 15.029 1.00 0.00 H -ATOM 2732 HH12 ARG 174 3.771 -15.577 15.375 1.00 0.00 H -ATOM 2733 NH2 ARG 174 5.645 -14.171 14.764 1.00 0.00 N -ATOM 2734 HH21 ARG 174 6.472 -13.666 14.479 1.00 0.00 H -ATOM 2735 HH22 ARG 174 4.735 -13.732 14.783 1.00 0.00 H -ATOM 2736 C ARG 174 10.973 -18.491 12.061 1.00 0.00 C -ATOM 2737 O ARG 174 10.857 -19.675 11.802 1.00 0.00 O -ATOM 2738 N ASN 175 11.495 -17.521 11.314 1.00 0.00 N -ATOM 2739 H ASN 175 11.496 -16.600 11.730 1.00 0.00 H -ATOM 2740 CA ASN 175 11.970 -17.814 10.014 1.00 0.00 C -ATOM 2741 HA ASN 175 12.578 -18.716 9.959 1.00 0.00 H -ATOM 2742 CB ASN 175 10.587 -17.832 9.295 1.00 0.00 C -ATOM 2743 HB2 ASN 175 10.661 -17.934 8.213 1.00 0.00 H -ATOM 2744 HB3 ASN 175 9.963 -18.670 9.604 1.00 0.00 H -ATOM 2745 CG ASN 175 9.707 -16.658 9.615 1.00 0.00 C -ATOM 2746 OD1 ASN 175 10.204 -15.601 9.622 1.00 0.00 O -ATOM 2747 ND2 ASN 175 8.405 -16.810 9.903 1.00 0.00 N -ATOM 2748 HD21 ASN 175 7.981 -15.971 10.274 1.00 0.00 H -ATOM 2749 HD22 ASN 175 8.122 -17.777 9.963 1.00 0.00 H -ATOM 2750 C ASN 175 12.936 -16.675 9.499 1.00 0.00 C -ATOM 2751 O ASN 175 13.425 -16.852 8.376 1.00 0.00 O -ATOM 2752 N LYS 176 13.219 -15.564 10.163 1.00 0.00 N -ATOM 2753 H LYS 176 12.694 -15.459 11.020 1.00 0.00 H -ATOM 2754 CA LYS 176 13.915 -14.325 9.624 1.00 0.00 C -ATOM 2755 HA LYS 176 13.692 -13.531 10.337 1.00 0.00 H -ATOM 2756 CB LYS 176 15.494 -14.523 9.659 1.00 0.00 C -ATOM 2757 HB2 LYS 176 15.863 -15.320 9.012 1.00 0.00 H -ATOM 2758 HB3 LYS 176 15.948 -13.610 9.275 1.00 0.00 H -ATOM 2759 CG LYS 176 15.885 -14.878 11.098 1.00 0.00 C -ATOM 2760 HG2 LYS 176 15.409 -14.208 11.814 1.00 0.00 H -ATOM 2761 HG3 LYS 176 15.578 -15.898 11.330 1.00 0.00 H -ATOM 2762 CD LYS 176 17.423 -14.777 11.174 1.00 0.00 C -ATOM 2763 HD2 LYS 176 17.822 -15.464 10.426 1.00 0.00 H -ATOM 2764 HD3 LYS 176 17.677 -13.739 10.956 1.00 0.00 H -ATOM 2765 CE LYS 176 18.016 -15.248 12.507 1.00 0.00 C -ATOM 2766 HE2 LYS 176 17.537 -16.188 12.784 1.00 0.00 H -ATOM 2767 HE3 LYS 176 19.068 -15.525 12.433 1.00 0.00 H -ATOM 2768 NZ LYS 176 17.878 -14.287 13.689 1.00 0.00 N -ATOM 2769 HZ1 LYS 176 18.100 -14.741 14.564 1.00 0.00 H -ATOM 2770 HZ2 LYS 176 18.578 -13.565 13.584 1.00 0.00 H -ATOM 2771 HZ3 LYS 176 16.981 -13.824 13.732 1.00 0.00 H -ATOM 2772 C LYS 176 13.338 -13.816 8.258 1.00 0.00 C -ATOM 2773 O LYS 176 13.954 -12.960 7.597 1.00 0.00 O -ATOM 2774 N ARG 177 12.071 -14.155 7.942 1.00 0.00 N -ATOM 2775 H ARG 177 11.573 -14.624 8.684 1.00 0.00 H -ATOM 2776 CA ARG 177 11.210 -13.667 6.841 1.00 0.00 C -ATOM 2777 HA ARG 177 11.879 -13.215 6.108 1.00 0.00 H -ATOM 2778 CB ARG 177 10.433 -14.862 6.223 1.00 0.00 C -ATOM 2779 HB2 ARG 177 11.041 -15.755 6.076 1.00 0.00 H -ATOM 2780 HB3 ARG 177 9.623 -15.067 6.923 1.00 0.00 H -ATOM 2781 CG ARG 177 9.820 -14.539 4.836 1.00 0.00 C -ATOM 2782 HG2 ARG 177 9.077 -13.747 4.933 1.00 0.00 H -ATOM 2783 HG3 ARG 177 10.593 -14.191 4.152 1.00 0.00 H -ATOM 2784 CD ARG 177 8.992 -15.712 4.240 1.00 0.00 C -ATOM 2785 HD2 ARG 177 8.385 -15.385 3.395 1.00 0.00 H -ATOM 2786 HD3 ARG 177 9.741 -16.472 4.013 1.00 0.00 H -ATOM 2787 NE ARG 177 8.051 -16.293 5.230 1.00 0.00 N -ATOM 2788 HE ARG 177 7.236 -15.718 5.389 1.00 0.00 H -ATOM 2789 CZ ARG 177 8.232 -17.324 5.984 1.00 0.00 C -ATOM 2790 NH1 ARG 177 9.261 -18.160 5.844 1.00 0.00 N -ATOM 2791 HH11 ARG 177 9.793 -18.010 4.998 1.00 0.00 H -ATOM 2792 HH12 ARG 177 9.202 -19.082 6.251 1.00 0.00 H -ATOM 2793 NH2 ARG 177 7.397 -17.562 6.968 1.00 0.00 N -ATOM 2794 HH21 ARG 177 6.607 -16.954 7.125 1.00 0.00 H -ATOM 2795 HH22 ARG 177 7.472 -18.416 7.503 1.00 0.00 H -ATOM 2796 C ARG 177 10.294 -12.533 7.307 1.00 0.00 C -ATOM 2797 O ARG 177 10.380 -11.412 6.701 1.00 0.00 O -ATOM 2798 N GLY 178 9.583 -12.747 8.409 1.00 0.00 N -ATOM 2799 H GLY 178 9.672 -13.691 8.754 1.00 0.00 H -ATOM 2800 CA GLY 178 8.963 -11.703 9.200 1.00 0.00 C -ATOM 2801 HA2 GLY 178 8.347 -11.093 8.538 1.00 0.00 H -ATOM 2802 HA3 GLY 178 8.470 -12.085 10.094 1.00 0.00 H -ATOM 2803 C GLY 178 10.076 -10.776 9.747 1.00 0.00 C -ATOM 2804 O GLY 178 11.320 -11.033 9.821 1.00 0.00 O -ATOM 2805 N VAL 179 9.564 -9.702 10.376 1.00 0.00 N -ATOM 2806 H VAL 179 8.572 -9.532 10.295 1.00 0.00 H -ATOM 2807 CA VAL 179 10.273 -8.654 11.092 1.00 0.00 C -ATOM 2808 HA VAL 179 11.177 -9.028 11.572 1.00 0.00 H -ATOM 2809 CB VAL 179 10.744 -7.513 10.081 1.00 0.00 C -ATOM 2810 HB VAL 179 11.188 -8.005 9.216 1.00 0.00 H -ATOM 2811 CG1 VAL 179 9.552 -6.849 9.477 1.00 0.00 C -ATOM 2812 HG11 VAL 179 8.876 -7.536 8.969 1.00 0.00 H -ATOM 2813 HG12 VAL 179 8.990 -6.347 10.266 1.00 0.00 H -ATOM 2814 HG13 VAL 179 9.840 -6.081 8.759 1.00 0.00 H -ATOM 2815 CG2 VAL 179 11.802 -6.511 10.541 1.00 0.00 C -ATOM 2816 HG21 VAL 179 11.844 -5.716 9.797 1.00 0.00 H -ATOM 2817 HG22 VAL 179 11.548 -6.141 11.534 1.00 0.00 H -ATOM 2818 HG23 VAL 179 12.823 -6.860 10.698 1.00 0.00 H -ATOM 2819 C VAL 179 9.521 -8.186 12.305 1.00 0.00 C -ATOM 2820 O VAL 179 8.301 -8.324 12.423 1.00 0.00 O -ATOM 2821 N ILE 180 10.194 -7.649 13.331 1.00 0.00 N -ATOM 2822 H ILE 180 11.201 -7.584 13.277 1.00 0.00 H -ATOM 2823 CA ILE 180 9.740 -7.300 14.718 1.00 0.00 C -ATOM 2824 HA ILE 180 8.656 -7.193 14.763 1.00 0.00 H -ATOM 2825 CB ILE 180 10.100 -8.335 15.746 1.00 0.00 C -ATOM 2826 HB ILE 180 11.168 -8.488 15.902 1.00 0.00 H -ATOM 2827 CG2 ILE 180 9.330 -8.022 17.022 1.00 0.00 C -ATOM 2828 HG21 ILE 180 8.260 -8.071 16.816 1.00 0.00 H -ATOM 2829 HG22 ILE 180 9.529 -8.701 17.850 1.00 0.00 H -ATOM 2830 HG23 ILE 180 9.557 -6.996 17.310 1.00 0.00 H -ATOM 2831 CG1 ILE 180 9.584 -9.678 15.225 1.00 0.00 C -ATOM 2832 HG12 ILE 180 8.606 -9.645 14.745 1.00 0.00 H -ATOM 2833 HG13 ILE 180 10.209 -9.990 14.388 1.00 0.00 H -ATOM 2834 CD1 ILE 180 9.638 -10.790 16.247 1.00 0.00 C -ATOM 2835 HD11 ILE 180 10.620 -10.685 16.711 1.00 0.00 H -ATOM 2836 HD12 ILE 180 8.904 -10.644 17.039 1.00 0.00 H -ATOM 2837 HD13 ILE 180 9.572 -11.789 15.816 1.00 0.00 H -ATOM 2838 C ILE 180 10.297 -5.924 15.053 1.00 0.00 C -ATOM 2839 O ILE 180 11.516 -5.741 15.072 1.00 0.00 O -ATOM 2840 N ILE 181 9.385 -4.974 15.331 1.00 0.00 N -ATOM 2841 H ILE 181 8.400 -5.179 15.418 1.00 0.00 H -ATOM 2842 CA ILE 181 9.879 -3.737 15.915 1.00 0.00 C -ATOM 2843 HA ILE 181 10.928 -3.663 15.627 1.00 0.00 H -ATOM 2844 CB ILE 181 9.028 -2.613 15.292 1.00 0.00 C -ATOM 2845 HB ILE 181 7.994 -2.956 15.259 1.00 0.00 H -ATOM 2846 CG2 ILE 181 9.050 -1.305 16.130 1.00 0.00 C -ATOM 2847 HG21 ILE 181 8.442 -0.520 15.681 1.00 0.00 H -ATOM 2848 HG22 ILE 181 8.549 -1.432 17.089 1.00 0.00 H -ATOM 2849 HG23 ILE 181 10.042 -0.936 16.389 1.00 0.00 H -ATOM 2850 CG1 ILE 181 9.420 -2.058 13.886 1.00 0.00 C -ATOM 2851 HG12 ILE 181 8.847 -1.162 13.647 1.00 0.00 H -ATOM 2852 HG13 ILE 181 10.492 -1.865 13.881 1.00 0.00 H -ATOM 2853 CD1 ILE 181 9.059 -3.077 12.861 1.00 0.00 C -ATOM 2854 HD11 ILE 181 9.186 -2.653 11.865 1.00 0.00 H -ATOM 2855 HD12 ILE 181 9.666 -3.978 12.943 1.00 0.00 H -ATOM 2856 HD13 ILE 181 7.995 -3.301 12.949 1.00 0.00 H -ATOM 2857 C ILE 181 9.982 -3.916 17.414 1.00 0.00 C -ATOM 2858 O ILE 181 9.096 -4.445 18.020 1.00 0.00 O -ATOM 2859 N LYS 182 11.044 -3.352 18.010 1.00 0.00 N -ATOM 2860 H LYS 182 11.533 -2.691 17.423 1.00 0.00 H -ATOM 2861 CA LYS 182 11.563 -3.799 19.267 1.00 0.00 C -ATOM 2862 HA LYS 182 11.402 -4.877 19.257 1.00 0.00 H -ATOM 2863 CB LYS 182 13.051 -3.477 19.514 1.00 0.00 C -ATOM 2864 HB2 LYS 182 13.280 -2.579 18.941 1.00 0.00 H -ATOM 2865 HB3 LYS 182 13.310 -3.406 20.571 1.00 0.00 H -ATOM 2866 CG LYS 182 14.047 -4.482 18.971 1.00 0.00 C -ATOM 2867 HG2 LYS 182 13.716 -5.481 19.253 1.00 0.00 H -ATOM 2868 HG3 LYS 182 14.003 -4.366 17.887 1.00 0.00 H -ATOM 2869 CD LYS 182 15.548 -4.301 19.379 1.00 0.00 C -ATOM 2870 HD2 LYS 182 15.768 -3.233 19.371 1.00 0.00 H -ATOM 2871 HD3 LYS 182 15.735 -4.737 20.362 1.00 0.00 H -ATOM 2872 CE LYS 182 16.443 -5.171 18.447 1.00 0.00 C -ATOM 2873 HE2 LYS 182 16.126 -6.190 18.670 1.00 0.00 H -ATOM 2874 HE3 LYS 182 16.136 -4.888 17.441 1.00 0.00 H -ATOM 2875 NZ LYS 182 17.844 -4.993 18.707 1.00 0.00 N -ATOM 2876 HZ1 LYS 182 18.451 -5.553 18.126 1.00 0.00 H -ATOM 2877 HZ2 LYS 182 18.185 -4.072 18.469 1.00 0.00 H -ATOM 2878 HZ3 LYS 182 18.070 -5.192 19.671 1.00 0.00 H -ATOM 2879 C LYS 182 10.723 -3.330 20.429 1.00 0.00 C -ATOM 2880 O LYS 182 10.379 -2.110 20.381 1.00 0.00 O -ATOM 2881 N GLY 183 10.389 -4.268 21.285 1.00 0.00 N -ATOM 2882 H GLY 183 10.732 -5.199 21.098 1.00 0.00 H -ATOM 2883 CA GLY 183 9.372 -4.253 22.317 1.00 0.00 C -ATOM 2884 HA2 GLY 183 9.182 -5.285 22.615 1.00 0.00 H -ATOM 2885 HA3 GLY 183 9.708 -3.699 23.193 1.00 0.00 H -ATOM 2886 C GLY 183 7.985 -3.616 21.938 1.00 0.00 C -ATOM 2887 O GLY 183 7.261 -3.290 22.892 1.00 0.00 O -ATOM 2888 N LEU 184 7.608 -3.444 20.654 1.00 0.00 N -ATOM 2889 H LEU 184 8.241 -3.599 19.882 1.00 0.00 H -ATOM 2890 CA LEU 184 6.313 -2.814 20.301 1.00 0.00 C -ATOM 2891 HA LEU 184 6.107 -2.037 21.038 1.00 0.00 H -ATOM 2892 CB LEU 184 6.421 -2.042 18.945 1.00 0.00 C -ATOM 2893 HB2 LEU 184 7.262 -1.349 18.965 1.00 0.00 H -ATOM 2894 HB3 LEU 184 6.718 -2.676 18.110 1.00 0.00 H -ATOM 2895 CG LEU 184 5.172 -1.280 18.581 1.00 0.00 C -ATOM 2896 HG LEU 184 4.313 -1.877 18.886 1.00 0.00 H -ATOM 2897 CD1 LEU 184 5.016 -0.006 19.390 1.00 0.00 C -ATOM 2898 HD11 LEU 184 4.116 0.507 19.052 1.00 0.00 H -ATOM 2899 HD12 LEU 184 4.671 -0.309 20.378 1.00 0.00 H -ATOM 2900 HD13 LEU 184 5.917 0.601 19.475 1.00 0.00 H -ATOM 2901 CD2 LEU 184 4.967 -0.989 17.162 1.00 0.00 C -ATOM 2902 HD21 LEU 184 4.997 -1.913 16.584 1.00 0.00 H -ATOM 2903 HD22 LEU 184 4.025 -0.483 16.953 1.00 0.00 H -ATOM 2904 HD23 LEU 184 5.768 -0.410 16.703 1.00 0.00 H -ATOM 2905 C LEU 184 5.186 -3.799 20.169 1.00 0.00 C -ATOM 2906 O LEU 184 5.218 -4.686 19.339 1.00 0.00 O -ATOM 2907 N GLU 185 4.119 -3.621 20.948 1.00 0.00 N -ATOM 2908 H GLU 185 4.187 -2.909 21.661 1.00 0.00 H -ATOM 2909 CA GLU 185 2.924 -4.494 20.952 1.00 0.00 C -ATOM 2910 HA GLU 185 3.002 -5.397 20.346 1.00 0.00 H -ATOM 2911 CB GLU 185 2.719 -4.826 22.413 1.00 0.00 C -ATOM 2912 HB2 GLU 185 3.596 -5.422 22.661 1.00 0.00 H -ATOM 2913 HB3 GLU 185 2.772 -3.883 22.956 1.00 0.00 H -ATOM 2914 CG GLU 185 1.390 -5.669 22.675 1.00 0.00 C -ATOM 2915 HG2 GLU 185 1.172 -5.752 23.740 1.00 0.00 H -ATOM 2916 HG3 GLU 185 0.483 -5.225 22.266 1.00 0.00 H -ATOM 2917 CD GLU 185 1.449 -7.097 22.112 1.00 0.00 C -ATOM 2918 OE1 GLU 185 2.382 -7.531 21.369 1.00 0.00 O -ATOM 2919 OE2 GLU 185 0.466 -7.869 22.387 1.00 0.00 O -ATOM 2920 C GLU 185 1.661 -3.813 20.416 1.00 0.00 C -ATOM 2921 O GLU 185 1.361 -2.589 20.592 1.00 0.00 O -ATOM 2922 N GLU 186 0.852 -4.542 19.614 1.00 0.00 N -ATOM 2923 H GLU 186 1.064 -5.499 19.373 1.00 0.00 H -ATOM 2924 CA GLU 186 -0.436 -3.949 19.076 1.00 0.00 C -ATOM 2925 HA GLU 186 -0.198 -2.965 18.673 1.00 0.00 H -ATOM 2926 CB GLU 186 -0.918 -4.757 17.862 1.00 0.00 C -ATOM 2927 HB2 GLU 186 -1.296 -5.723 18.200 1.00 0.00 H -ATOM 2928 HB3 GLU 186 -1.812 -4.259 17.487 1.00 0.00 H -ATOM 2929 CG GLU 186 0.145 -4.827 16.772 1.00 0.00 C -ATOM 2930 HG2 GLU 186 -0.430 -4.739 15.850 1.00 0.00 H -ATOM 2931 HG3 GLU 186 0.864 -4.026 16.947 1.00 0.00 H -ATOM 2932 CD GLU 186 0.844 -6.192 16.802 1.00 0.00 C -ATOM 2933 OE1 GLU 186 1.614 -6.516 17.774 1.00 0.00 O -ATOM 2934 OE2 GLU 186 0.626 -7.059 15.910 1.00 0.00 O -ATOM 2935 C GLU 186 -1.525 -3.611 20.096 1.00 0.00 C -ATOM 2936 O GLU 186 -2.061 -4.429 20.900 1.00 0.00 O -ATOM 2937 N ILE 187 -2.020 -2.360 19.987 1.00 0.00 N -ATOM 2938 H ILE 187 -1.940 -1.820 19.137 1.00 0.00 H -ATOM 2939 CA ILE 187 -3.147 -1.778 20.826 1.00 0.00 C -ATOM 2940 HA ILE 187 -2.897 -2.042 21.853 1.00 0.00 H -ATOM 2941 CB ILE 187 -2.959 -0.236 20.873 1.00 0.00 C -ATOM 2942 HB ILE 187 -2.040 -0.063 21.433 1.00 0.00 H -ATOM 2943 CG2 ILE 187 -2.952 0.358 19.477 1.00 0.00 C -ATOM 2944 HG21 ILE 187 -1.986 0.157 19.013 1.00 0.00 H -ATOM 2945 HG22 ILE 187 -3.719 -0.014 18.797 1.00 0.00 H -ATOM 2946 HG23 ILE 187 -2.903 1.443 19.575 1.00 0.00 H -ATOM 2947 CG1 ILE 187 -4.117 0.429 21.639 1.00 0.00 C -ATOM 2948 HG12 ILE 187 -5.041 0.312 21.073 1.00 0.00 H -ATOM 2949 HG13 ILE 187 -4.323 -0.194 22.509 1.00 0.00 H -ATOM 2950 CD1 ILE 187 -3.888 1.906 21.986 1.00 0.00 C -ATOM 2951 HD11 ILE 187 -4.304 2.078 22.977 1.00 0.00 H -ATOM 2952 HD12 ILE 187 -2.835 2.181 22.046 1.00 0.00 H -ATOM 2953 HD13 ILE 187 -4.319 2.605 21.269 1.00 0.00 H -ATOM 2954 C ILE 187 -4.521 -2.262 20.312 1.00 0.00 C -ATOM 2955 O ILE 187 -4.608 -2.346 19.075 1.00 0.00 O -ATOM 2956 N THR 188 -5.368 -2.637 21.284 1.00 0.00 N -ATOM 2957 H THR 188 -5.018 -2.547 22.226 1.00 0.00 H -ATOM 2958 CA THR 188 -6.670 -3.323 21.207 1.00 0.00 C -ATOM 2959 HA THR 188 -6.740 -3.735 20.201 1.00 0.00 H -ATOM 2960 CB THR 188 -6.965 -4.365 22.388 1.00 0.00 C -ATOM 2961 HB THR 188 -6.998 -3.821 23.332 1.00 0.00 H -ATOM 2962 CG2 THR 188 -8.287 -5.152 22.271 1.00 0.00 C -ATOM 2963 HG21 THR 188 -9.014 -4.415 22.615 1.00 0.00 H -ATOM 2964 HG22 THR 188 -8.504 -5.503 21.263 1.00 0.00 H -ATOM 2965 HG23 THR 188 -8.284 -6.006 22.948 1.00 0.00 H -ATOM 2966 OG1 THR 188 -5.925 -5.368 22.444 1.00 0.00 O -ATOM 2967 HG1 THR 188 -5.057 -4.961 22.487 1.00 0.00 H -ATOM 2968 C THR 188 -7.743 -2.240 21.352 1.00 0.00 C -ATOM 2969 O THR 188 -7.649 -1.334 22.178 1.00 0.00 O -ATOM 2970 N VAL 189 -8.769 -2.345 20.498 1.00 0.00 N -ATOM 2971 H VAL 189 -8.759 -3.144 19.879 1.00 0.00 H -ATOM 2972 CA VAL 189 -9.823 -1.304 20.267 1.00 0.00 C -ATOM 2973 HA VAL 189 -9.740 -0.628 21.119 1.00 0.00 H -ATOM 2974 CB VAL 189 -9.548 -0.384 19.039 1.00 0.00 C -ATOM 2975 HB VAL 189 -10.389 0.299 18.918 1.00 0.00 H -ATOM 2976 CG1 VAL 189 -8.314 0.448 19.294 1.00 0.00 C -ATOM 2977 HG11 VAL 189 -8.438 1.114 20.148 1.00 0.00 H -ATOM 2978 HG12 VAL 189 -7.541 -0.298 19.479 1.00 0.00 H -ATOM 2979 HG13 VAL 189 -8.144 1.046 18.400 1.00 0.00 H -ATOM 2980 CG2 VAL 189 -9.606 -1.120 17.745 1.00 0.00 C -ATOM 2981 HG21 VAL 189 -9.435 -0.404 16.941 1.00 0.00 H -ATOM 2982 HG22 VAL 189 -8.720 -1.751 17.814 1.00 0.00 H -ATOM 2983 HG23 VAL 189 -10.554 -1.626 17.569 1.00 0.00 H -ATOM 2984 C VAL 189 -11.232 -1.955 20.217 1.00 0.00 C -ATOM 2985 O VAL 189 -11.400 -3.131 19.945 1.00 0.00 O -ATOM 2986 N HIE 190 -12.146 -1.080 20.574 1.00 0.00 N -ATOM 2987 H HIE 190 -11.895 -0.158 20.899 1.00 0.00 H -ATOM 2988 CA HIE 190 -13.520 -1.527 20.765 1.00 0.00 C -ATOM 2989 HA HIE 190 -13.645 -2.578 20.508 1.00 0.00 H -ATOM 2990 CB HIE 190 -13.893 -1.449 22.333 1.00 0.00 C -ATOM 2991 HB2 HIE 190 -13.899 -0.385 22.571 1.00 0.00 H -ATOM 2992 HB3 HIE 190 -14.893 -1.867 22.449 1.00 0.00 H -ATOM 2993 CG HIE 190 -12.976 -2.142 23.249 1.00 0.00 C -ATOM 2994 ND1 HIE 190 -13.188 -3.304 24.009 1.00 0.00 N -ATOM 2995 CE1 HIE 190 -12.068 -3.578 24.701 1.00 0.00 C -ATOM 2996 HE1 HIE 190 -11.810 -4.530 25.139 1.00 0.00 H -ATOM 2997 NE2 HIE 190 -11.202 -2.588 24.577 1.00 0.00 N -ATOM 2998 HE2 HIE 190 -10.255 -2.537 24.927 1.00 0.00 H -ATOM 2999 CD2 HIE 190 -11.754 -1.683 23.652 1.00 0.00 C -ATOM 3000 HD2 HIE 190 -11.375 -0.696 23.432 1.00 0.00 H -ATOM 3001 C HIE 190 -14.406 -0.682 19.836 1.00 0.00 C -ATOM 3002 O HIE 190 -15.526 -1.009 19.453 1.00 0.00 O -ATOM 3003 N ASN 191 -13.906 0.459 19.407 1.00 0.00 N -ATOM 3004 H ASN 191 -12.989 0.746 19.717 1.00 0.00 H -ATOM 3005 CA ASN 191 -14.621 1.330 18.431 1.00 0.00 C -ATOM 3006 HA ASN 191 -15.350 0.731 17.885 1.00 0.00 H -ATOM 3007 CB ASN 191 -15.170 2.528 19.168 1.00 0.00 C -ATOM 3008 HB2 ASN 191 -15.719 2.161 20.035 1.00 0.00 H -ATOM 3009 HB3 ASN 191 -14.330 3.130 19.513 1.00 0.00 H -ATOM 3010 CG ASN 191 -16.190 3.315 18.346 1.00 0.00 C -ATOM 3011 OD1 ASN 191 -16.100 3.646 17.159 1.00 0.00 O -ATOM 3012 ND2 ASN 191 -17.297 3.529 19.015 1.00 0.00 N -ATOM 3013 HD21 ASN 191 -18.042 4.003 18.524 1.00 0.00 H -ATOM 3014 HD22 ASN 191 -17.269 3.430 20.019 1.00 0.00 H -ATOM 3015 C ASN 191 -13.629 1.793 17.299 1.00 0.00 C -ATOM 3016 O ASN 191 -12.516 2.254 17.598 1.00 0.00 O -ATOM 3017 N LYS 192 -14.065 1.782 16.007 1.00 0.00 N -ATOM 3018 H LYS 192 -14.983 1.429 15.778 1.00 0.00 H -ATOM 3019 CA LYS 192 -13.176 2.359 14.946 1.00 0.00 C -ATOM 3020 HA LYS 192 -12.331 1.676 14.870 1.00 0.00 H -ATOM 3021 CB LYS 192 -13.954 2.366 13.555 1.00 0.00 C -ATOM 3022 HB2 LYS 192 -13.309 2.505 12.688 1.00 0.00 H -ATOM 3023 HB3 LYS 192 -14.477 1.410 13.524 1.00 0.00 H -ATOM 3024 CG LYS 192 -14.978 3.480 13.490 1.00 0.00 C -ATOM 3025 HG2 LYS 192 -15.616 3.586 14.367 1.00 0.00 H -ATOM 3026 HG3 LYS 192 -14.477 4.406 13.207 1.00 0.00 H -ATOM 3027 CD LYS 192 -16.027 3.279 12.382 1.00 0.00 C -ATOM 3028 HD2 LYS 192 -15.514 3.035 11.452 1.00 0.00 H -ATOM 3029 HD3 LYS 192 -16.619 2.400 12.634 1.00 0.00 H -ATOM 3030 CE LYS 192 -16.897 4.534 12.301 1.00 0.00 C -ATOM 3031 HE2 LYS 192 -16.287 5.413 12.094 1.00 0.00 H -ATOM 3032 HE3 LYS 192 -17.586 4.333 11.478 1.00 0.00 H -ATOM 3033 NZ LYS 192 -17.665 4.837 13.551 1.00 0.00 N -ATOM 3034 HZ1 LYS 192 -17.053 5.064 14.322 1.00 0.00 H -ATOM 3035 HZ2 LYS 192 -18.250 5.652 13.437 1.00 0.00 H -ATOM 3036 HZ3 LYS 192 -18.288 4.098 13.847 1.00 0.00 H -ATOM 3037 C LYS 192 -12.641 3.785 15.274 1.00 0.00 C -ATOM 3038 O LYS 192 -11.556 4.262 14.836 1.00 0.00 O -ATOM 3039 N ASP 193 -13.329 4.614 16.032 1.00 0.00 N -ATOM 3040 H ASP 193 -14.244 4.394 16.397 1.00 0.00 H -ATOM 3041 CA ASP 193 -12.982 6.035 16.311 1.00 0.00 C -ATOM 3042 HA ASP 193 -12.822 6.618 15.404 1.00 0.00 H -ATOM 3043 CB ASP 193 -14.185 6.535 17.037 1.00 0.00 C -ATOM 3044 HB2 ASP 193 -14.426 5.929 17.910 1.00 0.00 H -ATOM 3045 HB3 ASP 193 -13.998 7.512 17.482 1.00 0.00 H -ATOM 3046 CG ASP 193 -15.545 6.637 16.310 1.00 0.00 C -ATOM 3047 OD1 ASP 193 -16.583 7.037 16.951 1.00 0.00 O -ATOM 3048 OD2 ASP 193 -15.680 6.170 15.139 1.00 0.00 O -ATOM 3049 C ASP 193 -11.710 6.160 17.220 1.00 0.00 C -ATOM 3050 O ASP 193 -11.058 7.208 17.228 1.00 0.00 O -ATOM 3051 N GLU 194 -11.423 5.134 18.048 1.00 0.00 N -ATOM 3052 H GLU 194 -11.971 4.310 17.845 1.00 0.00 H -ATOM 3053 CA GLU 194 -10.117 4.975 18.650 1.00 0.00 C -ATOM 3054 HA GLU 194 -9.888 5.790 19.336 1.00 0.00 H -ATOM 3055 CB GLU 194 -10.036 3.730 19.544 1.00 0.00 C -ATOM 3056 HB2 GLU 194 -10.422 2.862 19.011 1.00 0.00 H -ATOM 3057 HB3 GLU 194 -8.997 3.523 19.802 1.00 0.00 H -ATOM 3058 CG GLU 194 -10.735 3.904 20.874 1.00 0.00 C -ATOM 3059 HG2 GLU 194 -10.299 4.734 21.430 1.00 0.00 H -ATOM 3060 HG3 GLU 194 -11.731 4.300 20.673 1.00 0.00 H -ATOM 3061 CD GLU 194 -10.911 2.589 21.681 1.00 0.00 C -ATOM 3062 OE1 GLU 194 -11.704 1.676 21.251 1.00 0.00 O -ATOM 3063 OE2 GLU 194 -10.277 2.507 22.732 1.00 0.00 O -ATOM 3064 C GLU 194 -8.957 4.965 17.574 1.00 0.00 C -ATOM 3065 O GLU 194 -7.878 5.567 17.738 1.00 0.00 O -ATOM 3066 N VAL 195 -9.159 4.162 16.484 1.00 0.00 N -ATOM 3067 H VAL 195 -10.030 3.656 16.562 1.00 0.00 H -ATOM 3068 CA VAL 195 -8.150 4.047 15.398 1.00 0.00 C -ATOM 3069 HA VAL 195 -7.216 3.888 15.936 1.00 0.00 H -ATOM 3070 CB VAL 195 -8.381 2.940 14.491 1.00 0.00 C -ATOM 3071 HB VAL 195 -9.216 3.195 13.838 1.00 0.00 H -ATOM 3072 CG1 VAL 195 -7.107 2.614 13.721 1.00 0.00 C -ATOM 3073 HG11 VAL 195 -6.725 3.515 13.241 1.00 0.00 H -ATOM 3074 HG12 VAL 195 -6.235 2.326 14.309 1.00 0.00 H -ATOM 3075 HG13 VAL 195 -7.343 1.946 12.892 1.00 0.00 H -ATOM 3076 CG2 VAL 195 -8.767 1.721 15.369 1.00 0.00 C -ATOM 3077 HG21 VAL 195 -9.753 1.886 15.803 1.00 0.00 H -ATOM 3078 HG22 VAL 195 -8.920 0.859 14.721 1.00 0.00 H -ATOM 3079 HG23 VAL 195 -8.107 1.522 16.213 1.00 0.00 H -ATOM 3080 C VAL 195 -8.143 5.337 14.619 1.00 0.00 C -ATOM 3081 O VAL 195 -7.063 5.858 14.360 1.00 0.00 O -ATOM 3082 N TYR 196 -9.262 5.976 14.342 1.00 0.00 N -ATOM 3083 H TYR 196 -10.119 5.466 14.500 1.00 0.00 H -ATOM 3084 CA TYR 196 -9.331 7.278 13.626 1.00 0.00 C -ATOM 3085 HA TYR 196 -9.044 7.208 12.577 1.00 0.00 H -ATOM 3086 CB TYR 196 -10.748 7.705 13.686 1.00 0.00 C -ATOM 3087 HB2 TYR 196 -11.109 7.504 14.694 1.00 0.00 H -ATOM 3088 HB3 TYR 196 -10.882 8.782 13.584 1.00 0.00 H -ATOM 3089 CG TYR 196 -11.746 7.186 12.640 1.00 0.00 C -ATOM 3090 CD1 TYR 196 -11.401 6.158 11.758 1.00 0.00 C -ATOM 3091 HD1 TYR 196 -10.424 5.697 11.754 1.00 0.00 H -ATOM 3092 CE1 TYR 196 -12.287 5.624 10.793 1.00 0.00 C -ATOM 3093 HE1 TYR 196 -12.103 4.911 10.002 1.00 0.00 H -ATOM 3094 CZ TYR 196 -13.573 6.240 10.719 1.00 0.00 C -ATOM 3095 OH TYR 196 -14.375 5.905 9.596 1.00 0.00 O -ATOM 3096 HH TYR 196 -14.962 6.612 9.318 1.00 0.00 H -ATOM 3097 CE2 TYR 196 -13.947 7.246 11.637 1.00 0.00 C -ATOM 3098 HE2 TYR 196 -14.937 7.677 11.683 1.00 0.00 H -ATOM 3099 CD2 TYR 196 -13.081 7.712 12.590 1.00 0.00 C -ATOM 3100 HD2 TYR 196 -13.431 8.509 13.231 1.00 0.00 H -ATOM 3101 C TYR 196 -8.469 8.424 14.279 1.00 0.00 C -ATOM 3102 O TYR 196 -7.722 9.133 13.610 1.00 0.00 O -ATOM 3103 N GLN 197 -8.631 8.491 15.616 1.00 0.00 N -ATOM 3104 H GLN 197 -9.307 7.896 16.072 1.00 0.00 H -ATOM 3105 CA GLN 197 -7.865 9.410 16.442 1.00 0.00 C -ATOM 3106 HA GLN 197 -7.859 10.414 16.017 1.00 0.00 H -ATOM 3107 CB GLN 197 -8.450 9.311 17.867 1.00 0.00 C -ATOM 3108 HB2 GLN 197 -9.432 9.768 17.741 1.00 0.00 H -ATOM 3109 HB3 GLN 197 -8.479 8.281 18.221 1.00 0.00 H -ATOM 3110 CG GLN 197 -7.678 10.315 18.778 1.00 0.00 C -ATOM 3111 HG2 GLN 197 -7.286 11.171 18.229 1.00 0.00 H -ATOM 3112 HG3 GLN 197 -8.382 10.640 19.544 1.00 0.00 H -ATOM 3113 CD GLN 197 -6.472 9.748 19.572 1.00 0.00 C -ATOM 3114 OE1 GLN 197 -5.931 8.633 19.437 1.00 0.00 O -ATOM 3115 NE2 GLN 197 -5.973 10.532 20.582 1.00 0.00 N -ATOM 3116 HE21 GLN 197 -5.186 10.102 21.047 1.00 0.00 H -ATOM 3117 HE22 GLN 197 -6.277 11.488 20.696 1.00 0.00 H -ATOM 3118 C GLN 197 -6.370 8.896 16.446 1.00 0.00 C -ATOM 3119 O GLN 197 -5.457 9.651 16.248 1.00 0.00 O -ATOM 3120 N ILE 198 -6.088 7.573 16.659 1.00 0.00 N -ATOM 3121 H ILE 198 -6.895 6.965 16.662 1.00 0.00 H -ATOM 3122 CA ILE 198 -4.711 7.019 16.513 1.00 0.00 C -ATOM 3123 HA ILE 198 -4.182 7.407 17.383 1.00 0.00 H -ATOM 3124 CB ILE 198 -4.615 5.495 16.824 1.00 0.00 C -ATOM 3125 HB ILE 198 -5.565 5.085 16.481 1.00 0.00 H -ATOM 3126 CG2 ILE 198 -3.360 4.839 16.180 1.00 0.00 C -ATOM 3127 HG21 ILE 198 -2.424 5.268 16.536 1.00 0.00 H -ATOM 3128 HG22 ILE 198 -3.234 3.810 16.518 1.00 0.00 H -ATOM 3129 HG23 ILE 198 -3.396 4.976 15.099 1.00 0.00 H -ATOM 3130 CG1 ILE 198 -4.674 5.130 18.314 1.00 0.00 C -ATOM 3131 HG12 ILE 198 -3.639 5.086 18.653 1.00 0.00 H -ATOM 3132 HG13 ILE 198 -5.260 5.878 18.848 1.00 0.00 H -ATOM 3133 CD1 ILE 198 -5.266 3.719 18.665 1.00 0.00 C -ATOM 3134 HD11 ILE 198 -5.464 3.619 19.732 1.00 0.00 H -ATOM 3135 HD12 ILE 198 -6.135 3.432 18.073 1.00 0.00 H -ATOM 3136 HD13 ILE 198 -4.477 2.988 18.482 1.00 0.00 H -ATOM 3137 C ILE 198 -4.034 7.505 15.154 1.00 0.00 C -ATOM 3138 O ILE 198 -2.910 7.994 15.109 1.00 0.00 O -ATOM 3139 N LEU 199 -4.758 7.375 14.005 1.00 0.00 N -ATOM 3140 H LEU 199 -5.624 6.872 14.133 1.00 0.00 H -ATOM 3141 CA LEU 199 -4.342 7.787 12.610 1.00 0.00 C -ATOM 3142 HA LEU 199 -3.426 7.266 12.332 1.00 0.00 H -ATOM 3143 CB LEU 199 -5.393 7.341 11.517 1.00 0.00 C -ATOM 3144 HB2 LEU 199 -6.396 7.377 11.945 1.00 0.00 H -ATOM 3145 HB3 LEU 199 -5.307 8.029 10.676 1.00 0.00 H -ATOM 3146 CG LEU 199 -5.292 5.917 11.067 1.00 0.00 C -ATOM 3147 HG LEU 199 -5.314 5.210 11.895 1.00 0.00 H -ATOM 3148 CD1 LEU 199 -6.546 5.526 10.375 1.00 0.00 C -ATOM 3149 HD11 LEU 199 -6.516 4.461 10.146 1.00 0.00 H -ATOM 3150 HD12 LEU 199 -7.378 5.678 11.062 1.00 0.00 H -ATOM 3151 HD13 LEU 199 -6.745 6.055 9.443 1.00 0.00 H -ATOM 3152 CD2 LEU 199 -4.110 5.734 10.163 1.00 0.00 C -ATOM 3153 HD21 LEU 199 -4.216 6.300 9.238 1.00 0.00 H -ATOM 3154 HD22 LEU 199 -3.167 6.005 10.639 1.00 0.00 H -ATOM 3155 HD23 LEU 199 -3.983 4.680 9.918 1.00 0.00 H -ATOM 3156 C LEU 199 -4.148 9.351 12.550 1.00 0.00 C -ATOM 3157 O LEU 199 -3.085 9.820 12.188 1.00 0.00 O -ATOM 3158 N GLU 200 -5.114 10.179 12.998 1.00 0.00 N -ATOM 3159 H GLU 200 -5.948 9.728 13.347 1.00 0.00 H -ATOM 3160 CA GLU 200 -5.043 11.615 13.095 1.00 0.00 C -ATOM 3161 HA GLU 200 -4.892 11.957 12.072 1.00 0.00 H -ATOM 3162 CB GLU 200 -6.415 12.177 13.498 1.00 0.00 C -ATOM 3163 HB2 GLU 200 -7.208 11.746 12.886 1.00 0.00 H -ATOM 3164 HB3 GLU 200 -6.422 11.986 14.571 1.00 0.00 H -ATOM 3165 CG GLU 200 -6.652 13.684 13.348 1.00 0.00 C -ATOM 3166 HG2 GLU 200 -7.588 13.880 13.871 1.00 0.00 H -ATOM 3167 HG3 GLU 200 -5.935 14.231 13.959 1.00 0.00 H -ATOM 3168 CD GLU 200 -6.597 14.197 11.906 1.00 0.00 C -ATOM 3169 OE1 GLU 200 -7.149 13.495 11.043 1.00 0.00 O -ATOM 3170 OE2 GLU 200 -6.131 15.310 11.644 1.00 0.00 O -ATOM 3171 C GLU 200 -4.032 12.208 14.057 1.00 0.00 C -ATOM 3172 O GLU 200 -3.413 13.256 13.758 1.00 0.00 O -ATOM 3173 N LYS 201 -3.601 11.561 15.114 1.00 0.00 N -ATOM 3174 H LYS 201 -4.004 10.692 15.437 1.00 0.00 H -ATOM 3175 CA LYS 201 -2.515 11.981 15.920 1.00 0.00 C -ATOM 3176 HA LYS 201 -2.585 13.038 16.178 1.00 0.00 H -ATOM 3177 CB LYS 201 -2.632 11.186 17.247 1.00 0.00 C -ATOM 3178 HB2 LYS 201 -2.648 10.142 16.933 1.00 0.00 H -ATOM 3179 HB3 LYS 201 -1.685 11.449 17.718 1.00 0.00 H -ATOM 3180 CG LYS 201 -3.739 11.573 18.280 1.00 0.00 C -ATOM 3181 HG2 LYS 201 -4.668 11.680 17.720 1.00 0.00 H -ATOM 3182 HG3 LYS 201 -3.863 10.840 19.077 1.00 0.00 H -ATOM 3183 CD LYS 201 -3.469 12.916 18.938 1.00 0.00 C -ATOM 3184 HD2 LYS 201 -2.523 13.001 19.472 1.00 0.00 H -ATOM 3185 HD3 LYS 201 -3.424 13.618 18.107 1.00 0.00 H -ATOM 3186 CE LYS 201 -4.569 13.419 19.881 1.00 0.00 C -ATOM 3187 HE2 LYS 201 -5.478 13.204 19.319 1.00 0.00 H -ATOM 3188 HE3 LYS 201 -4.658 12.859 20.812 1.00 0.00 H -ATOM 3189 NZ LYS 201 -4.496 14.812 20.262 1.00 0.00 N -ATOM 3190 HZ1 LYS 201 -4.299 15.443 19.499 1.00 0.00 H -ATOM 3191 HZ2 LYS 201 -5.398 15.110 20.604 1.00 0.00 H -ATOM 3192 HZ3 LYS 201 -3.890 14.951 21.059 1.00 0.00 H -ATOM 3193 C LYS 201 -1.206 11.678 15.237 1.00 0.00 C -ATOM 3194 O LYS 201 -0.268 12.468 15.276 1.00 0.00 O -ATOM 3195 N GLY 202 -1.177 10.614 14.543 1.00 0.00 N -ATOM 3196 H GLY 202 -2.012 10.050 14.479 1.00 0.00 H -ATOM 3197 CA GLY 202 0.010 10.126 13.867 1.00 0.00 C -ATOM 3198 HA2 GLY 202 0.873 10.185 14.530 1.00 0.00 H -ATOM 3199 HA3 GLY 202 -0.105 9.060 13.669 1.00 0.00 H -ATOM 3200 C GLY 202 0.271 10.946 12.539 1.00 0.00 C -ATOM 3201 O GLY 202 1.384 11.482 12.393 1.00 0.00 O -ATOM 3202 N ALA 203 -0.796 11.344 11.769 1.00 0.00 N -ATOM 3203 H ALA 203 -1.705 10.903 11.792 1.00 0.00 H -ATOM 3204 CA ALA 203 -0.793 12.392 10.685 1.00 0.00 C -ATOM 3205 HA ALA 203 0.003 12.028 10.035 1.00 0.00 H -ATOM 3206 CB ALA 203 -2.136 12.531 9.898 1.00 0.00 C -ATOM 3207 HB1 ALA 203 -2.879 12.879 10.615 1.00 0.00 H -ATOM 3208 HB2 ALA 203 -2.003 13.279 9.116 1.00 0.00 H -ATOM 3209 HB3 ALA 203 -2.325 11.556 9.448 1.00 0.00 H -ATOM 3210 C ALA 203 -0.426 13.786 11.105 1.00 0.00 C -ATOM 3211 O ALA 203 0.038 14.529 10.225 1.00 0.00 O -ATOM 3212 N ALA 204 -0.554 14.074 12.382 1.00 0.00 N -ATOM 3213 H ALA 204 -1.002 13.392 12.977 1.00 0.00 H -ATOM 3214 CA ALA 204 -0.042 15.356 12.863 1.00 0.00 C -ATOM 3215 HA ALA 204 -0.414 16.143 12.206 1.00 0.00 H -ATOM 3216 CB ALA 204 -0.521 15.791 14.194 1.00 0.00 C -ATOM 3217 HB1 ALA 204 -1.603 15.921 14.171 1.00 0.00 H -ATOM 3218 HB2 ALA 204 -0.214 15.106 14.984 1.00 0.00 H -ATOM 3219 HB3 ALA 204 -0.064 16.755 14.420 1.00 0.00 H -ATOM 3220 C ALA 204 1.471 15.410 12.807 1.00 0.00 C -ATOM 3221 O ALA 204 2.028 16.302 12.117 1.00 0.00 O -ATOM 3222 N LYS 205 2.136 14.489 13.507 1.00 0.00 N -ATOM 3223 H LYS 205 1.580 13.953 14.158 1.00 0.00 H -ATOM 3224 CA LYS 205 3.600 14.237 13.457 1.00 0.00 C -ATOM 3225 HA LYS 205 4.062 15.158 13.815 1.00 0.00 H -ATOM 3226 CB LYS 205 3.990 13.139 14.425 1.00 0.00 C -ATOM 3227 HB2 LYS 205 3.618 13.224 15.445 1.00 0.00 H -ATOM 3228 HB3 LYS 205 3.391 12.270 14.152 1.00 0.00 H -ATOM 3229 CG LYS 205 5.483 12.721 14.570 1.00 0.00 C -ATOM 3230 HG2 LYS 205 5.499 11.936 15.326 1.00 0.00 H -ATOM 3231 HG3 LYS 205 5.700 12.382 13.557 1.00 0.00 H -ATOM 3232 CD LYS 205 6.375 13.945 14.876 1.00 0.00 C -ATOM 3233 HD2 LYS 205 7.451 13.804 14.772 1.00 0.00 H -ATOM 3234 HD3 LYS 205 6.173 14.700 14.116 1.00 0.00 H -ATOM 3235 CE LYS 205 6.108 14.612 16.235 1.00 0.00 C -ATOM 3236 HE2 LYS 205 6.634 15.563 16.151 1.00 0.00 H -ATOM 3237 HE3 LYS 205 5.088 14.959 16.397 1.00 0.00 H -ATOM 3238 NZ LYS 205 6.624 13.806 17.326 1.00 0.00 N -ATOM 3239 HZ1 LYS 205 6.294 14.118 18.227 1.00 0.00 H -ATOM 3240 HZ2 LYS 205 6.190 12.894 17.314 1.00 0.00 H -ATOM 3241 HZ3 LYS 205 7.634 13.818 17.329 1.00 0.00 H -ATOM 3242 C LYS 205 4.137 13.988 12.027 1.00 0.00 C -ATOM 3243 O LYS 205 5.148 14.584 11.642 1.00 0.00 O -ATOM 3244 N ARG 206 3.412 13.441 11.087 1.00 0.00 N -ATOM 3245 H ARG 206 2.618 12.964 11.491 1.00 0.00 H -ATOM 3246 CA ARG 206 3.637 13.387 9.569 1.00 0.00 C -ATOM 3247 HA ARG 206 4.687 13.104 9.493 1.00 0.00 H -ATOM 3248 CB ARG 206 2.681 12.245 9.026 1.00 0.00 C -ATOM 3249 HB2 ARG 206 2.403 11.403 9.660 1.00 0.00 H -ATOM 3250 HB3 ARG 206 1.718 12.699 8.797 1.00 0.00 H -ATOM 3251 CG ARG 206 3.371 11.661 7.821 1.00 0.00 C -ATOM 3252 HG2 ARG 206 3.678 12.503 7.200 1.00 0.00 H -ATOM 3253 HG3 ARG 206 4.251 11.113 8.156 1.00 0.00 H -ATOM 3254 CD ARG 206 2.620 10.685 6.907 1.00 0.00 C -ATOM 3255 HD2 ARG 206 1.818 11.131 6.318 1.00 0.00 H -ATOM 3256 HD3 ARG 206 3.347 10.363 6.162 1.00 0.00 H -ATOM 3257 NE ARG 206 2.114 9.452 7.614 1.00 0.00 N -ATOM 3258 HE ARG 206 2.865 8.864 7.944 1.00 0.00 H -ATOM 3259 CZ ARG 206 0.872 9.184 8.055 1.00 0.00 C -ATOM 3260 NH1 ARG 206 -0.073 10.019 7.789 1.00 0.00 N -ATOM 3261 HH11 ARG 206 0.097 10.827 7.207 1.00 0.00 H -ATOM 3262 HH12 ARG 206 -1.033 9.716 7.871 1.00 0.00 H -ATOM 3263 NH2 ARG 206 0.689 8.142 8.788 1.00 0.00 N -ATOM 3264 HH21 ARG 206 1.334 7.378 8.931 1.00 0.00 H -ATOM 3265 HH22 ARG 206 -0.256 8.094 9.142 1.00 0.00 H -ATOM 3266 C ARG 206 3.578 14.674 8.734 1.00 0.00 C -ATOM 3267 O ARG 206 4.481 14.938 8.014 1.00 0.00 O -ATOM 3268 N THR 207 2.624 15.531 9.061 1.00 0.00 N -ATOM 3269 H THR 207 1.984 15.231 9.783 1.00 0.00 H -ATOM 3270 CA THR 207 2.586 16.915 8.580 1.00 0.00 C -ATOM 3271 HA THR 207 2.655 16.899 7.491 1.00 0.00 H -ATOM 3272 CB THR 207 1.245 17.581 8.921 1.00 0.00 C -ATOM 3273 HB THR 207 1.083 17.715 9.991 1.00 0.00 H -ATOM 3274 CG2 THR 207 1.060 18.982 8.359 1.00 0.00 C -ATOM 3275 HG21 THR 207 1.335 18.982 7.305 1.00 0.00 H -ATOM 3276 HG22 THR 207 0.054 19.381 8.491 1.00 0.00 H -ATOM 3277 HG23 THR 207 1.800 19.623 8.838 1.00 0.00 H -ATOM 3278 OG1 THR 207 0.039 16.822 8.655 1.00 0.00 O -ATOM 3279 HG1 THR 207 0.134 15.988 9.121 1.00 0.00 H -ATOM 3280 C THR 207 3.659 17.750 9.229 1.00 0.00 C -ATOM 3281 O THR 207 4.226 18.628 8.581 1.00 0.00 O -ATOM 3282 N THR 208 4.097 17.380 10.493 1.00 0.00 N -ATOM 3283 H THR 208 3.737 16.581 10.998 1.00 0.00 H -ATOM 3284 CA THR 208 5.246 18.060 11.139 1.00 0.00 C -ATOM 3285 HA THR 208 5.169 19.118 10.889 1.00 0.00 H -ATOM 3286 CB THR 208 5.209 17.798 12.676 1.00 0.00 C -ATOM 3287 HB THR 208 5.268 16.744 12.946 1.00 0.00 H -ATOM 3288 CG2 THR 208 6.295 18.526 13.480 1.00 0.00 C -ATOM 3289 HG21 THR 208 6.291 18.094 14.481 1.00 0.00 H -ATOM 3290 HG22 THR 208 7.304 18.335 13.112 1.00 0.00 H -ATOM 3291 HG23 THR 208 6.126 19.603 13.484 1.00 0.00 H -ATOM 3292 OG1 THR 208 3.955 18.165 13.215 1.00 0.00 O -ATOM 3293 HG1 THR 208 3.323 17.655 12.705 1.00 0.00 H -ATOM 3294 C THR 208 6.532 17.555 10.486 1.00 0.00 C -ATOM 3295 O THR 208 7.369 18.344 10.110 1.00 0.00 O -ATOM 3296 N ALA 209 6.787 16.287 10.349 1.00 0.00 N -ATOM 3297 H ALA 209 6.188 15.606 10.793 1.00 0.00 H -ATOM 3298 CA ALA 209 7.958 15.723 9.750 1.00 0.00 C -ATOM 3299 HA ALA 209 8.841 16.059 10.295 1.00 0.00 H -ATOM 3300 CB ALA 209 7.819 14.215 9.805 1.00 0.00 C -ATOM 3301 HB1 ALA 209 6.919 13.891 9.283 1.00 0.00 H -ATOM 3302 HB2 ALA 209 8.787 13.877 9.437 1.00 0.00 H -ATOM 3303 HB3 ALA 209 7.785 13.980 10.869 1.00 0.00 H -ATOM 3304 C ALA 209 8.108 16.134 8.314 1.00 0.00 C -ATOM 3305 O ALA 209 9.174 16.511 7.814 1.00 0.00 O -ATOM 3306 N ALA 210 7.029 16.231 7.548 1.00 0.00 N -ATOM 3307 H ALA 210 6.119 15.943 7.881 1.00 0.00 H -ATOM 3308 CA ALA 210 7.051 16.687 6.163 1.00 0.00 C -ATOM 3309 HA ALA 210 7.807 16.064 5.687 1.00 0.00 H -ATOM 3310 CB ALA 210 5.673 16.382 5.534 1.00 0.00 C -ATOM 3311 HB1 ALA 210 5.682 16.660 4.480 1.00 0.00 H -ATOM 3312 HB2 ALA 210 5.501 15.309 5.624 1.00 0.00 H -ATOM 3313 HB3 ALA 210 4.855 16.916 6.017 1.00 0.00 H -ATOM 3314 C ALA 210 7.394 18.270 6.098 1.00 0.00 C -ATOM 3315 O ALA 210 8.046 18.716 5.118 1.00 0.00 O -ATOM 3316 N THR 211 7.020 18.973 7.141 1.00 0.00 N -ATOM 3317 H THR 211 6.491 18.433 7.811 1.00 0.00 H -ATOM 3318 CA THR 211 7.193 20.441 7.299 1.00 0.00 C -ATOM 3319 HA THR 211 6.872 21.015 6.429 1.00 0.00 H -ATOM 3320 CB THR 211 6.320 21.112 8.396 1.00 0.00 C -ATOM 3321 HB THR 211 6.554 20.630 9.345 1.00 0.00 H -ATOM 3322 CG2 THR 211 6.668 22.567 8.521 1.00 0.00 C -ATOM 3323 HG21 THR 211 6.483 23.127 7.605 1.00 0.00 H -ATOM 3324 HG22 THR 211 5.991 22.931 9.293 1.00 0.00 H -ATOM 3325 HG23 THR 211 7.672 22.624 8.940 1.00 0.00 H -ATOM 3326 OG1 THR 211 5.039 20.994 7.948 1.00 0.00 O -ATOM 3327 HG1 THR 211 4.715 20.104 8.107 1.00 0.00 H -ATOM 3328 C THR 211 8.692 20.734 7.640 1.00 0.00 C -ATOM 3329 O THR 211 9.242 21.803 7.418 1.00 0.00 O -ATOM 3330 N LEU 212 9.391 19.693 8.012 1.00 0.00 N -ATOM 3331 H LEU 212 8.836 18.859 8.146 1.00 0.00 H -ATOM 3332 CA LEU 212 10.826 19.697 8.312 1.00 0.00 C -ATOM 3333 HA LEU 212 11.070 20.707 8.639 1.00 0.00 H -ATOM 3334 CB LEU 212 11.113 18.872 9.590 1.00 0.00 C -ATOM 3335 HB2 LEU 212 10.448 19.261 10.360 1.00 0.00 H -ATOM 3336 HB3 LEU 212 10.766 17.868 9.349 1.00 0.00 H -ATOM 3337 CG LEU 212 12.636 18.868 9.905 1.00 0.00 C -ATOM 3338 HG LEU 212 13.147 18.528 9.005 1.00 0.00 H -ATOM 3339 CD1 LEU 212 13.238 20.193 10.449 1.00 0.00 C -ATOM 3340 HD11 LEU 212 13.128 20.391 11.515 1.00 0.00 H -ATOM 3341 HD12 LEU 212 14.319 20.162 10.320 1.00 0.00 H -ATOM 3342 HD13 LEU 212 13.041 21.105 9.885 1.00 0.00 H -ATOM 3343 CD2 LEU 212 12.955 17.871 10.941 1.00 0.00 C -ATOM 3344 HD21 LEU 212 14.038 17.862 11.066 1.00 0.00 H -ATOM 3345 HD22 LEU 212 12.364 18.041 11.841 1.00 0.00 H -ATOM 3346 HD23 LEU 212 12.616 16.877 10.651 1.00 0.00 H -ATOM 3347 C LEU 212 11.763 19.266 7.178 1.00 0.00 C -ATOM 3348 O LEU 212 12.809 19.884 6.952 1.00 0.00 O -ATOM 3349 N MET 213 11.345 18.208 6.433 1.00 0.00 N -ATOM 3350 H MET 213 10.423 17.861 6.659 1.00 0.00 H -ATOM 3351 CA MET 213 12.166 17.445 5.469 1.00 0.00 C -ATOM 3352 HA MET 213 13.168 17.873 5.431 1.00 0.00 H -ATOM 3353 CB MET 213 12.276 15.977 5.925 1.00 0.00 C -ATOM 3354 HB2 MET 213 11.246 15.628 5.855 1.00 0.00 H -ATOM 3355 HB3 MET 213 12.889 15.381 5.247 1.00 0.00 H -ATOM 3356 CG MET 213 13.044 15.781 7.281 1.00 0.00 C -ATOM 3357 HG2 MET 213 14.100 16.018 7.151 1.00 0.00 H -ATOM 3358 HG3 MET 213 12.599 16.514 7.955 1.00 0.00 H -ATOM 3359 SD MET 213 13.021 14.142 8.076 1.00 0.00 S -ATOM 3360 CE MET 213 11.328 14.123 8.753 1.00 0.00 C -ATOM 3361 HE1 MET 213 11.274 14.777 9.624 1.00 0.00 H -ATOM 3362 HE2 MET 213 10.620 14.426 7.982 1.00 0.00 H -ATOM 3363 HE3 MET 213 11.152 13.065 8.942 1.00 0.00 H -ATOM 3364 C MET 213 11.528 17.608 4.052 1.00 0.00 C -ATOM 3365 O MET 213 10.381 17.244 3.839 1.00 0.00 O -ATOM 3366 N ASN 214 12.284 18.239 3.172 1.00 0.00 N -ATOM 3367 H ASN 214 13.190 18.489 3.543 1.00 0.00 H -ATOM 3368 CA ASN 214 11.848 18.720 1.881 1.00 0.00 C -ATOM 3369 HA ASN 214 11.279 19.644 1.971 1.00 0.00 H -ATOM 3370 CB ASN 214 13.155 19.238 1.218 1.00 0.00 C -ATOM 3371 HB2 ASN 214 13.600 19.946 1.917 1.00 0.00 H -ATOM 3372 HB3 ASN 214 13.821 18.413 0.966 1.00 0.00 H -ATOM 3373 CG ASN 214 12.987 20.030 -0.067 1.00 0.00 C -ATOM 3374 OD1 ASN 214 11.920 20.553 -0.447 1.00 0.00 O -ATOM 3375 ND2 ASN 214 14.023 20.087 -0.899 1.00 0.00 N -ATOM 3376 HD21 ASN 214 13.883 20.478 -1.819 1.00 0.00 H -ATOM 3377 HD22 ASN 214 14.945 19.762 -0.646 1.00 0.00 H -ATOM 3378 C ASN 214 11.149 17.654 0.976 1.00 0.00 C -ATOM 3379 O ASN 214 10.116 17.861 0.438 1.00 0.00 O -ATOM 3380 N ALA 215 11.628 16.467 0.977 1.00 0.00 N -ATOM 3381 H ALA 215 12.295 16.156 1.667 1.00 0.00 H -ATOM 3382 CA ALA 215 11.200 15.452 -0.011 1.00 0.00 C -ATOM 3383 HA ALA 215 10.746 15.952 -0.867 1.00 0.00 H -ATOM 3384 CB ALA 215 12.465 14.742 -0.421 1.00 0.00 C -ATOM 3385 HB1 ALA 215 13.181 15.410 -0.901 1.00 0.00 H -ATOM 3386 HB2 ALA 215 12.952 14.077 0.290 1.00 0.00 H -ATOM 3387 HB3 ALA 215 12.184 14.106 -1.261 1.00 0.00 H -ATOM 3388 C ALA 215 10.260 14.414 0.591 1.00 0.00 C -ATOM 3389 O ALA 215 9.592 13.723 -0.107 1.00 0.00 O -ATOM 3390 N TYR 216 10.180 14.393 1.900 1.00 0.00 N -ATOM 3391 H TYR 216 10.579 15.138 2.451 1.00 0.00 H -ATOM 3392 CA TYR 216 9.360 13.531 2.740 1.00 0.00 C -ATOM 3393 HA TYR 216 9.707 12.497 2.724 1.00 0.00 H -ATOM 3394 CB TYR 216 9.495 14.011 4.232 1.00 0.00 C -ATOM 3395 HB2 TYR 216 10.554 14.039 4.488 1.00 0.00 H -ATOM 3396 HB3 TYR 216 9.247 15.073 4.230 1.00 0.00 H -ATOM 3397 CG TYR 216 8.821 13.298 5.380 1.00 0.00 C -ATOM 3398 CD1 TYR 216 7.432 13.202 5.404 1.00 0.00 C -ATOM 3399 HD1 TYR 216 6.843 13.706 4.653 1.00 0.00 H -ATOM 3400 CE1 TYR 216 6.708 12.452 6.350 1.00 0.00 C -ATOM 3401 HE1 TYR 216 5.639 12.322 6.262 1.00 0.00 H -ATOM 3402 CZ TYR 216 7.440 11.740 7.304 1.00 0.00 C -ATOM 3403 OH TYR 216 6.814 11.042 8.262 1.00 0.00 O -ATOM 3404 HH TYR 216 6.257 10.413 7.798 1.00 0.00 H -ATOM 3405 CE2 TYR 216 8.807 11.800 7.387 1.00 0.00 C -ATOM 3406 HE2 TYR 216 9.274 11.218 8.168 1.00 0.00 H -ATOM 3407 CD2 TYR 216 9.504 12.595 6.416 1.00 0.00 C -ATOM 3408 HD2 TYR 216 10.579 12.630 6.512 1.00 0.00 H -ATOM 3409 C TYR 216 7.958 13.324 2.156 1.00 0.00 C -ATOM 3410 O TYR 216 7.527 12.178 1.968 1.00 0.00 O -ATOM 3411 N SER 217 7.238 14.450 1.863 1.00 0.00 N -ATOM 3412 H SER 217 7.676 15.352 1.980 1.00 0.00 H -ATOM 3413 CA SER 217 5.895 14.463 1.136 1.00 0.00 C -ATOM 3414 HA SER 217 5.199 14.062 1.874 1.00 0.00 H -ATOM 3415 CB SER 217 5.490 15.882 0.876 1.00 0.00 C -ATOM 3416 HB2 SER 217 4.676 15.874 0.151 1.00 0.00 H -ATOM 3417 HB3 SER 217 5.106 16.320 1.797 1.00 0.00 H -ATOM 3418 OG SER 217 6.598 16.575 0.345 1.00 0.00 O -ATOM 3419 HG SER 217 7.278 16.761 0.997 1.00 0.00 H -ATOM 3420 C SER 217 5.737 13.635 -0.180 1.00 0.00 C -ATOM 3421 O SER 217 4.601 13.338 -0.533 1.00 0.00 O -ATOM 3422 N SER 218 6.824 13.088 -0.720 1.00 0.00 N -ATOM 3423 H SER 218 7.697 13.321 -0.268 1.00 0.00 H -ATOM 3424 CA SER 218 6.866 12.131 -1.781 1.00 0.00 C -ATOM 3425 HA SER 218 5.923 11.610 -1.946 1.00 0.00 H -ATOM 3426 CB SER 218 7.216 12.902 -3.109 1.00 0.00 C -ATOM 3427 HB2 SER 218 8.300 12.959 -3.197 1.00 0.00 H -ATOM 3428 HB3 SER 218 7.050 12.236 -3.955 1.00 0.00 H -ATOM 3429 OG SER 218 6.498 14.100 -3.314 1.00 0.00 O -ATOM 3430 HG SER 218 5.574 13.851 -3.397 1.00 0.00 H -ATOM 3431 C SER 218 7.921 11.012 -1.708 1.00 0.00 C -ATOM 3432 O SER 218 8.056 10.224 -2.653 1.00 0.00 O -ATOM 3433 N ARG 219 8.643 10.945 -0.544 1.00 0.00 N -ATOM 3434 H ARG 219 8.450 11.645 0.157 1.00 0.00 H -ATOM 3435 CA ARG 219 9.774 10.016 -0.202 1.00 0.00 C -ATOM 3436 HA ARG 219 9.763 9.242 -0.970 1.00 0.00 H -ATOM 3437 CB ARG 219 11.105 10.759 -0.242 1.00 0.00 C -ATOM 3438 HB2 ARG 219 11.149 11.511 0.547 1.00 0.00 H -ATOM 3439 HB3 ARG 219 11.881 10.046 0.036 1.00 0.00 H -ATOM 3440 CG ARG 219 11.455 11.442 -1.520 1.00 0.00 C -ATOM 3441 HG2 ARG 219 10.714 12.221 -1.699 1.00 0.00 H -ATOM 3442 HG3 ARG 219 12.476 11.798 -1.380 1.00 0.00 H -ATOM 3443 CD ARG 219 11.431 10.592 -2.786 1.00 0.00 C -ATOM 3444 HD2 ARG 219 12.110 9.766 -2.576 1.00 0.00 H -ATOM 3445 HD3 ARG 219 10.393 10.288 -2.921 1.00 0.00 H -ATOM 3446 NE ARG 219 11.868 11.269 -3.974 1.00 0.00 N -ATOM 3447 HE ARG 219 12.491 12.035 -3.767 1.00 0.00 H -ATOM 3448 CZ ARG 219 11.243 11.480 -5.116 1.00 0.00 C -ATOM 3449 NH1 ARG 219 10.264 10.721 -5.434 1.00 0.00 N -ATOM 3450 HH11 ARG 219 10.101 9.888 -4.886 1.00 0.00 H -ATOM 3451 HH12 ARG 219 9.856 10.781 -6.356 1.00 0.00 H -ATOM 3452 NH2 ARG 219 11.560 12.464 -5.878 1.00 0.00 N -ATOM 3453 HH21 ARG 219 12.310 13.111 -5.676 1.00 0.00 H -ATOM 3454 HH22 ARG 219 11.056 12.464 -6.754 1.00 0.00 H -ATOM 3455 C ARG 219 9.609 9.159 1.094 1.00 0.00 C -ATOM 3456 O ARG 219 10.290 8.130 1.184 1.00 0.00 O -ATOM 3457 N SER 220 8.827 9.591 2.062 1.00 0.00 N -ATOM 3458 H SER 220 8.267 10.424 1.952 1.00 0.00 H -ATOM 3459 CA SER 220 8.385 8.805 3.254 1.00 0.00 C -ATOM 3460 HA SER 220 9.220 8.211 3.626 1.00 0.00 H -ATOM 3461 CB SER 220 7.842 9.664 4.349 1.00 0.00 C -ATOM 3462 HB2 SER 220 8.627 10.420 4.358 1.00 0.00 H -ATOM 3463 HB3 SER 220 6.878 10.016 3.980 1.00 0.00 H -ATOM 3464 OG SER 220 7.795 8.958 5.578 1.00 0.00 O -ATOM 3465 HG SER 220 7.060 9.370 6.041 1.00 0.00 H -ATOM 3466 C SER 220 7.313 7.762 2.920 1.00 0.00 C -ATOM 3467 O SER 220 6.620 7.877 1.901 1.00 0.00 O -ATOM 3468 N HIE 221 7.179 6.652 3.594 1.00 0.00 N -ATOM 3469 H HIE 221 7.697 6.626 4.460 1.00 0.00 H -ATOM 3470 CA HIE 221 6.423 5.457 3.224 1.00 0.00 C -ATOM 3471 HA HIE 221 5.766 5.802 2.426 1.00 0.00 H -ATOM 3472 CB HIE 221 7.350 4.297 2.765 1.00 0.00 C -ATOM 3473 HB2 HIE 221 8.019 4.045 3.588 1.00 0.00 H -ATOM 3474 HB3 HIE 221 6.629 3.526 2.494 1.00 0.00 H -ATOM 3475 CG HIE 221 8.245 4.242 1.550 1.00 0.00 C -ATOM 3476 ND1 HIE 221 7.829 3.833 0.276 1.00 0.00 N -ATOM 3477 CE1 HIE 221 8.947 3.845 -0.451 1.00 0.00 C -ATOM 3478 HE1 HIE 221 8.957 3.509 -1.478 1.00 0.00 H -ATOM 3479 NE2 HIE 221 10.000 4.317 0.225 1.00 0.00 N -ATOM 3480 HE2 HIE 221 10.986 4.330 0.008 1.00 0.00 H -ATOM 3481 CD2 HIE 221 9.542 4.430 1.519 1.00 0.00 C -ATOM 3482 HD2 HIE 221 10.130 4.702 2.383 1.00 0.00 H -ATOM 3483 C HIE 221 5.710 4.983 4.494 1.00 0.00 C -ATOM 3484 O HIE 221 6.298 4.722 5.539 1.00 0.00 O -ATOM 3485 N SER 222 4.386 4.711 4.363 1.00 0.00 N -ATOM 3486 H SER 222 3.907 4.804 3.478 1.00 0.00 H -ATOM 3487 CA SER 222 3.493 4.388 5.525 1.00 0.00 C -ATOM 3488 HA SER 222 4.063 4.380 6.453 1.00 0.00 H -ATOM 3489 CB SER 222 2.414 5.450 5.543 1.00 0.00 C -ATOM 3490 HB2 SER 222 1.801 5.370 4.645 1.00 0.00 H -ATOM 3491 HB3 SER 222 1.788 5.186 6.395 1.00 0.00 H -ATOM 3492 OG SER 222 2.933 6.763 5.655 1.00 0.00 O -ATOM 3493 HG SER 222 3.347 6.859 6.517 1.00 0.00 H -ATOM 3494 C SER 222 2.910 2.998 5.558 1.00 0.00 C -ATOM 3495 O SER 222 2.260 2.602 4.600 1.00 0.00 O -ATOM 3496 N VAL 223 3.033 2.329 6.715 1.00 0.00 N -ATOM 3497 H VAL 223 3.516 2.812 7.459 1.00 0.00 H -ATOM 3498 CA VAL 223 2.442 1.004 6.954 1.00 0.00 C -ATOM 3499 HA VAL 223 2.018 0.685 6.002 1.00 0.00 H -ATOM 3500 CB VAL 223 3.479 -0.077 7.270 1.00 0.00 C -ATOM 3501 HB VAL 223 4.042 0.384 8.082 1.00 0.00 H -ATOM 3502 CG1 VAL 223 2.812 -1.374 7.842 1.00 0.00 C -ATOM 3503 HG11 VAL 223 2.474 -1.332 8.878 1.00 0.00 H -ATOM 3504 HG12 VAL 223 2.051 -1.754 7.162 1.00 0.00 H -ATOM 3505 HG13 VAL 223 3.530 -2.194 7.794 1.00 0.00 H -ATOM 3506 CG2 VAL 223 4.414 -0.292 6.091 1.00 0.00 C -ATOM 3507 HG21 VAL 223 5.156 -1.047 6.348 1.00 0.00 H -ATOM 3508 HG22 VAL 223 3.817 -0.750 5.301 1.00 0.00 H -ATOM 3509 HG23 VAL 223 4.885 0.646 5.801 1.00 0.00 H -ATOM 3510 C VAL 223 1.399 1.107 8.031 1.00 0.00 C -ATOM 3511 O VAL 223 1.745 1.510 9.135 1.00 0.00 O -ATOM 3512 N PHE 224 0.236 0.640 7.716 1.00 0.00 N -ATOM 3513 H PHE 224 -0.017 0.308 6.797 1.00 0.00 H -ATOM 3514 CA PHE 224 -0.810 0.313 8.751 1.00 0.00 C -ATOM 3515 HA PHE 224 -0.354 0.547 9.712 1.00 0.00 H -ATOM 3516 CB PHE 224 -2.059 1.148 8.609 1.00 0.00 C -ATOM 3517 HB2 PHE 224 -1.789 2.198 8.494 1.00 0.00 H -ATOM 3518 HB3 PHE 224 -2.466 0.888 7.632 1.00 0.00 H -ATOM 3519 CG PHE 224 -3.156 0.858 9.673 1.00 0.00 C -ATOM 3520 CD1 PHE 224 -4.404 0.375 9.251 1.00 0.00 C -ATOM 3521 HD1 PHE 224 -4.437 0.031 8.228 1.00 0.00 H -ATOM 3522 CE1 PHE 224 -5.441 0.068 10.136 1.00 0.00 C -ATOM 3523 HE1 PHE 224 -6.390 -0.269 9.746 1.00 0.00 H -ATOM 3524 CZ PHE 224 -5.273 0.307 11.486 1.00 0.00 C -ATOM 3525 HZ PHE 224 -6.170 0.092 12.047 1.00 0.00 H -ATOM 3526 CE2 PHE 224 -4.103 1.043 11.902 1.00 0.00 C -ATOM 3527 HE2 PHE 224 -4.100 1.444 12.905 1.00 0.00 H -ATOM 3528 CD2 PHE 224 -3.023 1.346 11.000 1.00 0.00 C -ATOM 3529 HD2 PHE 224 -2.129 1.851 11.336 1.00 0.00 H -ATOM 3530 C PHE 224 -1.146 -1.187 8.891 1.00 0.00 C -ATOM 3531 O PHE 224 -1.202 -1.884 7.882 1.00 0.00 O -ATOM 3532 N SER 225 -1.443 -1.696 10.123 1.00 0.00 N -ATOM 3533 H SER 225 -1.694 -1.061 10.867 1.00 0.00 H -ATOM 3534 CA SER 225 -1.773 -3.133 10.293 1.00 0.00 C -ATOM 3535 HA SER 225 -1.912 -3.553 9.296 1.00 0.00 H -ATOM 3536 CB SER 225 -0.628 -3.916 10.903 1.00 0.00 C -ATOM 3537 HB2 SER 225 0.265 -3.589 10.372 1.00 0.00 H -ATOM 3538 HB3 SER 225 -0.446 -3.611 11.934 1.00 0.00 H -ATOM 3539 OG SER 225 -0.728 -5.379 10.707 1.00 0.00 O -ATOM 3540 HG SER 225 -0.301 -5.692 9.906 1.00 0.00 H -ATOM 3541 C SER 225 -2.961 -3.456 11.185 1.00 0.00 C -ATOM 3542 O SER 225 -3.167 -2.814 12.197 1.00 0.00 O -ATOM 3543 N VAL 226 -3.742 -4.492 10.837 1.00 0.00 N -ATOM 3544 H VAL 226 -3.465 -5.122 10.098 1.00 0.00 H -ATOM 3545 CA VAL 226 -4.872 -4.877 11.678 1.00 0.00 C -ATOM 3546 HA VAL 226 -4.773 -4.344 12.623 1.00 0.00 H -ATOM 3547 CB VAL 226 -6.125 -4.480 10.827 1.00 0.00 C -ATOM 3548 HB VAL 226 -6.261 -4.995 9.877 1.00 0.00 H -ATOM 3549 CG1 VAL 226 -7.379 -4.738 11.665 1.00 0.00 C -ATOM 3550 HG11 VAL 226 -7.638 -5.789 11.546 1.00 0.00 H -ATOM 3551 HG12 VAL 226 -7.215 -4.517 12.719 1.00 0.00 H -ATOM 3552 HG13 VAL 226 -8.169 -4.042 11.384 1.00 0.00 H -ATOM 3553 CG2 VAL 226 -6.205 -2.999 10.479 1.00 0.00 C -ATOM 3554 HG21 VAL 226 -6.181 -2.416 11.400 1.00 0.00 H -ATOM 3555 HG22 VAL 226 -5.375 -2.874 9.785 1.00 0.00 H -ATOM 3556 HG23 VAL 226 -7.123 -2.622 10.027 1.00 0.00 H -ATOM 3557 C VAL 226 -4.670 -6.380 11.937 1.00 0.00 C -ATOM 3558 O VAL 226 -4.496 -7.189 11.047 1.00 0.00 O -ATOM 3559 N THR 227 -4.476 -6.796 13.223 1.00 0.00 N -ATOM 3560 H THR 227 -4.433 -6.150 14.000 1.00 0.00 H -ATOM 3561 CA THR 227 -4.694 -8.235 13.600 1.00 0.00 C -ATOM 3562 HA THR 227 -4.491 -8.909 12.767 1.00 0.00 H -ATOM 3563 CB THR 227 -3.703 -8.505 14.802 1.00 0.00 C -ATOM 3564 HB THR 227 -3.913 -7.785 15.593 1.00 0.00 H -ATOM 3565 CG2 THR 227 -3.993 -9.829 15.480 1.00 0.00 C -ATOM 3566 HG21 THR 227 -4.056 -10.600 14.712 1.00 0.00 H -ATOM 3567 HG22 THR 227 -3.251 -10.151 16.210 1.00 0.00 H -ATOM 3568 HG23 THR 227 -4.966 -9.810 15.969 1.00 0.00 H -ATOM 3569 OG1 THR 227 -2.322 -8.564 14.470 1.00 0.00 O -ATOM 3570 HG1 THR 227 -2.075 -7.749 14.025 1.00 0.00 H -ATOM 3571 C THR 227 -6.145 -8.415 13.990 1.00 0.00 C -ATOM 3572 O THR 227 -6.674 -7.617 14.750 1.00 0.00 O -ATOM 3573 N ILE 228 -6.869 -9.510 13.605 1.00 0.00 N -ATOM 3574 H ILE 228 -6.566 -10.218 12.952 1.00 0.00 H -ATOM 3575 CA ILE 228 -8.172 -9.904 14.143 1.00 0.00 C -ATOM 3576 HA ILE 228 -8.498 -9.106 14.811 1.00 0.00 H -ATOM 3577 CB ILE 228 -9.179 -10.087 13.048 1.00 0.00 C -ATOM 3578 HB ILE 228 -8.836 -10.920 12.435 1.00 0.00 H -ATOM 3579 CG2 ILE 228 -10.515 -10.428 13.580 1.00 0.00 C -ATOM 3580 HG21 ILE 228 -11.371 -10.344 12.911 1.00 0.00 H -ATOM 3581 HG22 ILE 228 -10.605 -11.370 14.120 1.00 0.00 H -ATOM 3582 HG23 ILE 228 -10.618 -9.687 14.373 1.00 0.00 H -ATOM 3583 CG1 ILE 228 -9.452 -8.803 12.175 1.00 0.00 C -ATOM 3584 HG12 ILE 228 -10.357 -8.261 12.448 1.00 0.00 H -ATOM 3585 HG13 ILE 228 -8.664 -8.088 12.411 1.00 0.00 H -ATOM 3586 CD1 ILE 228 -9.323 -8.957 10.634 1.00 0.00 C -ATOM 3587 HD11 ILE 228 -8.309 -9.223 10.335 1.00 0.00 H -ATOM 3588 HD12 ILE 228 -9.998 -9.793 10.460 1.00 0.00 H -ATOM 3589 HD13 ILE 228 -9.656 -8.074 10.087 1.00 0.00 H -ATOM 3590 C ILE 228 -8.034 -11.224 15.027 1.00 0.00 C -ATOM 3591 O ILE 228 -7.384 -12.233 14.685 1.00 0.00 O -ATOM 3592 N HIE 229 -8.636 -11.147 16.180 1.00 0.00 N -ATOM 3593 H HIE 229 -9.154 -10.290 16.312 1.00 0.00 H -ATOM 3594 CA HIE 229 -8.982 -12.345 16.913 1.00 0.00 C -ATOM 3595 HA HIE 229 -8.462 -13.221 16.526 1.00 0.00 H -ATOM 3596 CB HIE 229 -8.601 -12.205 18.421 1.00 0.00 C -ATOM 3597 HB2 HIE 229 -9.195 -11.528 19.036 1.00 0.00 H -ATOM 3598 HB3 HIE 229 -8.808 -13.214 18.779 1.00 0.00 H -ATOM 3599 CG HIE 229 -7.171 -11.796 18.651 1.00 0.00 C -ATOM 3600 ND1 HIE 229 -6.607 -11.403 19.899 1.00 0.00 N -ATOM 3601 CE1 HIE 229 -5.272 -11.485 19.742 1.00 0.00 C -ATOM 3602 HE1 HIE 229 -4.633 -11.200 20.564 1.00 0.00 H -ATOM 3603 NE2 HIE 229 -4.939 -11.757 18.496 1.00 0.00 N -ATOM 3604 HE2 HIE 229 -4.040 -11.625 18.056 1.00 0.00 H -ATOM 3605 CD2 HIE 229 -6.142 -11.976 17.800 1.00 0.00 C -ATOM 3606 HD2 HIE 229 -6.225 -12.359 16.793 1.00 0.00 H -ATOM 3607 C HIE 229 -10.473 -12.771 16.748 1.00 0.00 C -ATOM 3608 O HIE 229 -11.401 -11.939 16.694 1.00 0.00 O -ATOM 3609 N MET 230 -10.645 -14.039 16.567 1.00 0.00 N -ATOM 3610 H MET 230 -9.869 -14.677 16.464 1.00 0.00 H -ATOM 3611 CA MET 230 -12.012 -14.642 16.459 1.00 0.00 C -ATOM 3612 HA MET 230 -12.792 -13.969 16.814 1.00 0.00 H -ATOM 3613 CB MET 230 -12.264 -15.069 14.975 1.00 0.00 C -ATOM 3614 HB2 MET 230 -11.410 -15.685 14.693 1.00 0.00 H -ATOM 3615 HB3 MET 230 -13.165 -15.673 14.867 1.00 0.00 H -ATOM 3616 CG MET 230 -12.374 -13.818 14.074 1.00 0.00 C -ATOM 3617 HG2 MET 230 -13.433 -13.576 13.988 1.00 0.00 H -ATOM 3618 HG3 MET 230 -11.967 -12.890 14.477 1.00 0.00 H -ATOM 3619 SD MET 230 -11.634 -14.247 12.441 1.00 0.00 S -ATOM 3620 CE MET 230 -9.861 -14.277 12.802 1.00 0.00 C -ATOM 3621 HE1 MET 230 -9.722 -14.395 13.876 1.00 0.00 H -ATOM 3622 HE2 MET 230 -9.407 -15.002 12.125 1.00 0.00 H -ATOM 3623 HE3 MET 230 -9.468 -13.286 12.577 1.00 0.00 H -ATOM 3624 C MET 230 -12.264 -15.937 17.252 1.00 0.00 C -ATOM 3625 O MET 230 -11.474 -16.893 17.109 1.00 0.00 O -ATOM 3626 N LYS 231 -13.356 -16.031 17.974 1.00 0.00 N -ATOM 3627 H LYS 231 -13.967 -15.229 18.023 1.00 0.00 H -ATOM 3628 CA LYS 231 -13.721 -17.214 18.725 1.00 0.00 C -ATOM 3629 HA LYS 231 -12.755 -17.521 19.124 1.00 0.00 H -ATOM 3630 CB LYS 231 -14.599 -16.865 19.893 1.00 0.00 C -ATOM 3631 HB2 LYS 231 -14.195 -16.128 20.587 1.00 0.00 H -ATOM 3632 HB3 LYS 231 -15.524 -16.419 19.528 1.00 0.00 H -ATOM 3633 CG LYS 231 -14.893 -18.020 20.789 1.00 0.00 C -ATOM 3634 HG2 LYS 231 -15.539 -18.685 20.215 1.00 0.00 H -ATOM 3635 HG3 LYS 231 -13.972 -18.516 21.097 1.00 0.00 H -ATOM 3636 CD LYS 231 -15.800 -17.682 21.983 1.00 0.00 C -ATOM 3637 HD2 LYS 231 -15.392 -16.784 22.450 1.00 0.00 H -ATOM 3638 HD3 LYS 231 -16.680 -17.270 21.490 1.00 0.00 H -ATOM 3639 CE LYS 231 -15.954 -19.011 22.747 1.00 0.00 C -ATOM 3640 HE2 LYS 231 -16.468 -19.736 22.115 1.00 0.00 H -ATOM 3641 HE3 LYS 231 -14.979 -19.394 23.044 1.00 0.00 H -ATOM 3642 NZ LYS 231 -16.499 -18.881 24.061 1.00 0.00 N -ATOM 3643 HZ1 LYS 231 -15.747 -18.667 24.701 1.00 0.00 H -ATOM 3644 HZ2 LYS 231 -17.132 -18.096 23.985 1.00 0.00 H -ATOM 3645 HZ3 LYS 231 -16.927 -19.765 24.294 1.00 0.00 H -ATOM 3646 C LYS 231 -14.173 -18.420 17.821 1.00 0.00 C -ATOM 3647 O LYS 231 -14.932 -18.203 16.890 1.00 0.00 O -ATOM 3648 N GLU 232 -13.645 -19.593 18.151 1.00 0.00 N -ATOM 3649 H GLU 232 -13.106 -19.543 19.004 1.00 0.00 H -ATOM 3650 CA GLU 232 -14.014 -20.880 17.513 1.00 0.00 C -ATOM 3651 HA GLU 232 -14.481 -20.542 16.587 1.00 0.00 H -ATOM 3652 CB GLU 232 -12.758 -21.624 17.207 1.00 0.00 C -ATOM 3653 HB2 GLU 232 -12.247 -21.860 18.141 1.00 0.00 H -ATOM 3654 HB3 GLU 232 -13.021 -22.638 16.904 1.00 0.00 H -ATOM 3655 CG GLU 232 -11.822 -21.208 16.116 1.00 0.00 C -ATOM 3656 HG2 GLU 232 -11.641 -20.150 16.313 1.00 0.00 H -ATOM 3657 HG3 GLU 232 -10.856 -21.693 16.252 1.00 0.00 H -ATOM 3658 CD GLU 232 -12.206 -21.370 14.643 1.00 0.00 C -ATOM 3659 OE1 GLU 232 -13.325 -21.041 14.265 1.00 0.00 O -ATOM 3660 OE2 GLU 232 -11.333 -21.650 13.804 1.00 0.00 O -ATOM 3661 C GLU 232 -15.025 -21.709 18.411 1.00 0.00 C -ATOM 3662 O GLU 232 -15.119 -21.435 19.604 1.00 0.00 O -ATOM 3663 N THR 233 -15.630 -22.686 17.813 1.00 0.00 N -ATOM 3664 H THR 233 -15.619 -22.792 16.808 1.00 0.00 H -ATOM 3665 CA THR 233 -16.763 -23.460 18.402 1.00 0.00 C -ATOM 3666 HA THR 233 -17.485 -22.747 18.799 1.00 0.00 H -ATOM 3667 CB THR 233 -17.561 -24.263 17.489 1.00 0.00 C -ATOM 3668 HB THR 233 -17.859 -23.564 16.707 1.00 0.00 H -ATOM 3669 CG2 THR 233 -17.017 -25.513 16.928 1.00 0.00 C -ATOM 3670 HG21 THR 233 -17.691 -26.198 16.412 1.00 0.00 H -ATOM 3671 HG22 THR 233 -16.179 -25.267 16.275 1.00 0.00 H -ATOM 3672 HG23 THR 233 -16.662 -26.114 17.765 1.00 0.00 H -ATOM 3673 OG1 THR 233 -18.710 -24.591 18.243 1.00 0.00 O -ATOM 3674 HG1 THR 233 -19.468 -24.523 17.657 1.00 0.00 H -ATOM 3675 C THR 233 -16.175 -24.281 19.571 1.00 0.00 C -ATOM 3676 O THR 233 -15.056 -24.783 19.517 1.00 0.00 O -ATOM 3677 N THR 234 -16.948 -24.291 20.691 1.00 0.00 N -ATOM 3678 H THR 234 -17.872 -23.888 20.634 1.00 0.00 H -ATOM 3679 CA THR 234 -16.632 -24.927 21.954 1.00 0.00 C -ATOM 3680 HA THR 234 -15.691 -24.548 22.354 1.00 0.00 H -ATOM 3681 CB THR 234 -17.752 -24.770 22.933 1.00 0.00 C -ATOM 3682 HB THR 234 -17.511 -25.385 23.800 1.00 0.00 H -ATOM 3683 CG2 THR 234 -18.016 -23.337 23.337 1.00 0.00 C -ATOM 3684 HG21 THR 234 -18.840 -23.296 24.049 1.00 0.00 H -ATOM 3685 HG22 THR 234 -17.156 -22.900 23.843 1.00 0.00 H -ATOM 3686 HG23 THR 234 -18.246 -22.605 22.562 1.00 0.00 H -ATOM 3687 OG1 THR 234 -18.978 -25.271 22.384 1.00 0.00 O -ATOM 3688 HG1 THR 234 -19.103 -26.145 22.760 1.00 0.00 H -ATOM 3689 C THR 234 -16.345 -26.424 21.827 1.00 0.00 C -ATOM 3690 O THR 234 -15.531 -26.950 22.588 1.00 0.00 O -ATOM 3691 N ILE 235 -16.986 -27.218 20.924 1.00 0.00 N -ATOM 3692 H ILE 235 -17.692 -26.795 20.339 1.00 0.00 H -ATOM 3693 CA ILE 235 -16.518 -28.565 20.600 1.00 0.00 C -ATOM 3694 HA ILE 235 -16.497 -29.084 21.558 1.00 0.00 H -ATOM 3695 CB ILE 235 -17.688 -29.182 19.754 1.00 0.00 C -ATOM 3696 HB ILE 235 -18.628 -29.098 20.298 1.00 0.00 H -ATOM 3697 CG2 ILE 235 -17.884 -28.512 18.403 1.00 0.00 C -ATOM 3698 HG21 ILE 235 -18.582 -29.109 17.817 1.00 0.00 H -ATOM 3699 HG22 ILE 235 -18.248 -27.491 18.518 1.00 0.00 H -ATOM 3700 HG23 ILE 235 -16.959 -28.549 17.827 1.00 0.00 H -ATOM 3701 CG1 ILE 235 -17.564 -30.714 19.483 1.00 0.00 C -ATOM 3702 HG12 ILE 235 -18.458 -31.172 19.057 1.00 0.00 H -ATOM 3703 HG13 ILE 235 -16.781 -30.778 18.727 1.00 0.00 H -ATOM 3704 CD1 ILE 235 -17.284 -31.564 20.718 1.00 0.00 C -ATOM 3705 HD11 ILE 235 -18.089 -31.354 21.424 1.00 0.00 H -ATOM 3706 HD12 ILE 235 -17.261 -32.580 20.325 1.00 0.00 H -ATOM 3707 HD13 ILE 235 -16.358 -31.258 21.204 1.00 0.00 H -ATOM 3708 C ILE 235 -15.199 -28.660 20.020 1.00 0.00 C -ATOM 3709 O ILE 235 -14.565 -29.689 20.133 1.00 0.00 O -ATOM 3710 N ASP 236 -14.711 -27.685 19.314 1.00 0.00 N -ATOM 3711 H ASP 236 -15.242 -26.888 18.994 1.00 0.00 H -ATOM 3712 CA ASP 236 -13.368 -27.749 18.703 1.00 0.00 C -ATOM 3713 HA ASP 236 -13.242 -28.764 18.330 1.00 0.00 H -ATOM 3714 CB ASP 236 -13.369 -26.875 17.411 1.00 0.00 C -ATOM 3715 HB2 ASP 236 -14.353 -26.875 16.945 1.00 0.00 H -ATOM 3716 HB3 ASP 236 -13.241 -25.849 17.755 1.00 0.00 H -ATOM 3717 CG ASP 236 -12.210 -27.232 16.415 1.00 0.00 C -ATOM 3718 OD1 ASP 236 -12.024 -26.464 15.459 1.00 0.00 O -ATOM 3719 OD2 ASP 236 -11.583 -28.296 16.492 1.00 0.00 O -ATOM 3720 C ASP 236 -12.283 -27.357 19.682 1.00 0.00 C -ATOM 3721 O ASP 236 -11.233 -28.107 19.608 1.00 0.00 O -ATOM 3722 N GLY 237 -12.543 -26.464 20.598 1.00 0.00 N -ATOM 3723 H GLY 237 -13.389 -25.921 20.493 1.00 0.00 H -ATOM 3724 CA GLY 237 -11.595 -26.191 21.696 1.00 0.00 C -ATOM 3725 HA2 GLY 237 -11.277 -27.134 22.141 1.00 0.00 H -ATOM 3726 HA3 GLY 237 -10.751 -25.641 21.280 1.00 0.00 H -ATOM 3727 C GLY 237 -12.157 -25.226 22.734 1.00 0.00 C -ATOM 3728 O GLY 237 -13.065 -24.449 22.540 1.00 0.00 O -ATOM 3729 N GLU 238 -11.831 -25.459 23.970 1.00 0.00 N -ATOM 3730 H GLU 238 -11.236 -26.273 24.028 1.00 0.00 H -ATOM 3731 CA GLU 238 -12.068 -24.678 25.195 1.00 0.00 C -ATOM 3732 HA GLU 238 -13.142 -24.634 25.375 1.00 0.00 H -ATOM 3733 CB GLU 238 -11.487 -25.419 26.494 1.00 0.00 C -ATOM 3734 HB2 GLU 238 -10.400 -25.360 26.456 1.00 0.00 H -ATOM 3735 HB3 GLU 238 -11.739 -24.793 27.351 1.00 0.00 H -ATOM 3736 CG GLU 238 -11.901 -26.908 26.676 1.00 0.00 C -ATOM 3737 HG2 GLU 238 -11.416 -27.448 25.862 1.00 0.00 H -ATOM 3738 HG3 GLU 238 -11.442 -27.264 27.599 1.00 0.00 H -ATOM 3739 CD GLU 238 -13.385 -27.146 26.781 1.00 0.00 C -ATOM 3740 OE1 GLU 238 -13.805 -28.166 26.229 1.00 0.00 O -ATOM 3741 OE2 GLU 238 -14.122 -26.308 27.304 1.00 0.00 O -ATOM 3742 C GLU 238 -11.586 -23.206 25.063 1.00 0.00 C -ATOM 3743 O GLU 238 -10.457 -22.853 25.375 1.00 0.00 O -ATOM 3744 N GLU 239 -12.554 -22.341 24.770 1.00 0.00 N -ATOM 3745 H GLU 239 -13.382 -22.780 24.394 1.00 0.00 H -ATOM 3746 CA GLU 239 -12.275 -20.923 24.539 1.00 0.00 C -ATOM 3747 HA GLU 239 -13.159 -20.490 24.071 1.00 0.00 H -ATOM 3748 CB GLU 239 -12.039 -20.218 25.905 1.00 0.00 C -ATOM 3749 HB2 GLU 239 -11.209 -20.659 26.458 1.00 0.00 H -ATOM 3750 HB3 GLU 239 -11.751 -19.187 25.696 1.00 0.00 H -ATOM 3751 CG GLU 239 -13.244 -20.262 26.875 1.00 0.00 C -ATOM 3752 HG2 GLU 239 -13.637 -21.275 26.970 1.00 0.00 H -ATOM 3753 HG3 GLU 239 -12.832 -20.009 27.851 1.00 0.00 H -ATOM 3754 CD GLU 239 -14.335 -19.234 26.577 1.00 0.00 C -ATOM 3755 OE1 GLU 239 -15.090 -19.035 27.532 1.00 0.00 O -ATOM 3756 OE2 GLU 239 -14.281 -18.569 25.549 1.00 0.00 O -ATOM 3757 C GLU 239 -11.172 -20.714 23.492 1.00 0.00 C -ATOM 3758 O GLU 239 -10.191 -19.968 23.719 1.00 0.00 O -ATOM 3759 N LEU 240 -11.340 -21.352 22.374 1.00 0.00 N -ATOM 3760 H LEU 240 -12.219 -21.820 22.209 1.00 0.00 H -ATOM 3761 CA LEU 240 -10.361 -21.336 21.303 1.00 0.00 C -ATOM 3762 HA LEU 240 -9.395 -21.125 21.764 1.00 0.00 H -ATOM 3763 CB LEU 240 -10.419 -22.776 20.717 1.00 0.00 C -ATOM 3764 HB2 LEU 240 -10.027 -23.427 21.498 1.00 0.00 H -ATOM 3765 HB3 LEU 240 -11.443 -22.978 20.403 1.00 0.00 H -ATOM 3766 CG LEU 240 -9.634 -23.025 19.382 1.00 0.00 C -ATOM 3767 HG LEU 240 -10.033 -22.307 18.664 1.00 0.00 H -ATOM 3768 CD1 LEU 240 -8.139 -22.849 19.587 1.00 0.00 C -ATOM 3769 HD11 LEU 240 -8.071 -22.079 20.356 1.00 0.00 H -ATOM 3770 HD12 LEU 240 -7.695 -23.783 19.930 1.00 0.00 H -ATOM 3771 HD13 LEU 240 -7.587 -22.669 18.664 1.00 0.00 H -ATOM 3772 CD2 LEU 240 -9.888 -24.457 18.921 1.00 0.00 C -ATOM 3773 HD21 LEU 240 -9.522 -24.592 17.903 1.00 0.00 H -ATOM 3774 HD22 LEU 240 -9.490 -25.313 19.468 1.00 0.00 H -ATOM 3775 HD23 LEU 240 -10.956 -24.639 18.808 1.00 0.00 H -ATOM 3776 C LEU 240 -10.646 -20.178 20.280 1.00 0.00 C -ATOM 3777 O LEU 240 -11.695 -19.708 20.065 1.00 0.00 O -ATOM 3778 N VAL 241 -9.576 -19.782 19.636 1.00 0.00 N -ATOM 3779 H VAL 241 -8.691 -20.186 19.907 1.00 0.00 H -ATOM 3780 CA VAL 241 -9.403 -18.491 18.865 1.00 0.00 C -ATOM 3781 HA VAL 241 -10.393 -18.078 18.678 1.00 0.00 H -ATOM 3782 CB VAL 241 -8.645 -17.373 19.622 1.00 0.00 C -ATOM 3783 HB VAL 241 -7.589 -17.643 19.605 1.00 0.00 H -ATOM 3784 CG1 VAL 241 -8.636 -15.944 19.012 1.00 0.00 C -ATOM 3785 HG11 VAL 241 -9.672 -15.605 19.032 1.00 0.00 H -ATOM 3786 HG12 VAL 241 -8.011 -15.277 19.607 1.00 0.00 H -ATOM 3787 HG13 VAL 241 -8.351 -15.963 17.960 1.00 0.00 H -ATOM 3788 CG2 VAL 241 -9.143 -17.205 21.033 1.00 0.00 C -ATOM 3789 HG21 VAL 241 -10.184 -16.886 21.065 1.00 0.00 H -ATOM 3790 HG22 VAL 241 -9.095 -18.119 21.624 1.00 0.00 H -ATOM 3791 HG23 VAL 241 -8.550 -16.450 21.549 1.00 0.00 H -ATOM 3792 C VAL 241 -8.579 -18.794 17.559 1.00 0.00 C -ATOM 3793 O VAL 241 -7.441 -19.318 17.572 1.00 0.00 O -ATOM 3794 N LYS 242 -9.190 -18.472 16.439 1.00 0.00 N -ATOM 3795 H LYS 242 -10.166 -18.295 16.629 1.00 0.00 H -ATOM 3796 CA LYS 242 -8.634 -18.118 15.142 1.00 0.00 C -ATOM 3797 HA LYS 242 -7.731 -18.694 14.942 1.00 0.00 H -ATOM 3798 CB LYS 242 -9.682 -18.378 14.132 1.00 0.00 C -ATOM 3799 HB2 LYS 242 -10.215 -19.328 14.178 1.00 0.00 H -ATOM 3800 HB3 LYS 242 -10.479 -17.656 14.309 1.00 0.00 H -ATOM 3801 CG LYS 242 -9.246 -18.110 12.633 1.00 0.00 C -ATOM 3802 HG2 LYS 242 -8.772 -17.142 12.476 1.00 0.00 H -ATOM 3803 HG3 LYS 242 -8.365 -18.692 12.362 1.00 0.00 H -ATOM 3804 CD LYS 242 -10.305 -18.417 11.599 1.00 0.00 C -ATOM 3805 HD2 LYS 242 -9.961 -18.029 10.640 1.00 0.00 H -ATOM 3806 HD3 LYS 242 -10.568 -19.469 11.707 1.00 0.00 H -ATOM 3807 CE LYS 242 -11.640 -17.772 11.888 1.00 0.00 C -ATOM 3808 HE2 LYS 242 -12.078 -18.208 12.786 1.00 0.00 H -ATOM 3809 HE3 LYS 242 -11.467 -16.707 12.041 1.00 0.00 H -ATOM 3810 NZ LYS 242 -12.507 -17.991 10.747 1.00 0.00 N -ATOM 3811 HZ1 LYS 242 -12.756 -18.924 10.449 1.00 0.00 H -ATOM 3812 HZ2 LYS 242 -13.394 -17.537 10.909 1.00 0.00 H -ATOM 3813 HZ3 LYS 242 -12.080 -17.538 9.951 1.00 0.00 H -ATOM 3814 C LYS 242 -8.191 -16.678 14.968 1.00 0.00 C -ATOM 3815 O LYS 242 -8.775 -15.788 15.570 1.00 0.00 O -ATOM 3816 N ILE 243 -7.062 -16.494 14.240 1.00 0.00 N -ATOM 3817 H ILE 243 -6.533 -17.346 14.122 1.00 0.00 H -ATOM 3818 CA ILE 243 -6.402 -15.201 13.974 1.00 0.00 C -ATOM 3819 HA ILE 243 -7.041 -14.415 14.376 1.00 0.00 H -ATOM 3820 CB ILE 243 -4.999 -15.202 14.725 1.00 0.00 C -ATOM 3821 HB ILE 243 -4.501 -16.083 14.322 1.00 0.00 H -ATOM 3822 CG2 ILE 243 -4.110 -13.956 14.365 1.00 0.00 C -ATOM 3823 HG21 ILE 243 -3.725 -14.091 13.355 1.00 0.00 H -ATOM 3824 HG22 ILE 243 -4.535 -12.970 14.550 1.00 0.00 H -ATOM 3825 HG23 ILE 243 -3.247 -13.975 15.030 1.00 0.00 H -ATOM 3826 CG1 ILE 243 -5.272 -15.187 16.315 1.00 0.00 C -ATOM 3827 HG12 ILE 243 -4.539 -14.531 16.784 1.00 0.00 H -ATOM 3828 HG13 ILE 243 -6.296 -14.814 16.338 1.00 0.00 H -ATOM 3829 CD1 ILE 243 -5.176 -16.569 16.995 1.00 0.00 C -ATOM 3830 HD11 ILE 243 -5.592 -17.345 16.354 1.00 0.00 H -ATOM 3831 HD12 ILE 243 -4.152 -16.769 17.307 1.00 0.00 H -ATOM 3832 HD13 ILE 243 -5.809 -16.567 17.883 1.00 0.00 H -ATOM 3833 C ILE 243 -6.228 -15.043 12.491 1.00 0.00 C -ATOM 3834 O ILE 243 -6.163 -15.922 11.687 1.00 0.00 O -ATOM 3835 N GLY 244 -6.292 -13.767 11.986 1.00 0.00 N -ATOM 3836 H GLY 244 -6.195 -13.062 12.704 1.00 0.00 H -ATOM 3837 CA GLY 244 -5.847 -13.367 10.675 1.00 0.00 C -ATOM 3838 HA2 GLY 244 -5.155 -14.130 10.318 1.00 0.00 H -ATOM 3839 HA3 GLY 244 -6.670 -13.500 9.973 1.00 0.00 H -ATOM 3840 C GLY 244 -5.395 -11.912 10.581 1.00 0.00 C -ATOM 3841 O GLY 244 -5.757 -11.105 11.414 1.00 0.00 O -ATOM 3842 N LYS 245 -4.551 -11.530 9.618 1.00 0.00 N -ATOM 3843 H LYS 245 -4.206 -12.304 9.066 1.00 0.00 H -ATOM 3844 CA LYS 245 -3.856 -10.245 9.505 1.00 0.00 C -ATOM 3845 HA LYS 245 -4.225 -9.537 10.247 1.00 0.00 H -ATOM 3846 CB LYS 245 -2.377 -10.413 9.838 1.00 0.00 C -ATOM 3847 HB2 LYS 245 -1.957 -11.009 9.029 1.00 0.00 H -ATOM 3848 HB3 LYS 245 -1.848 -9.461 9.788 1.00 0.00 H -ATOM 3849 CG LYS 245 -2.107 -10.978 11.243 1.00 0.00 C -ATOM 3850 HG2 LYS 245 -2.422 -10.142 11.869 1.00 0.00 H -ATOM 3851 HG3 LYS 245 -2.611 -11.913 11.484 1.00 0.00 H -ATOM 3852 CD LYS 245 -0.665 -11.123 11.545 1.00 0.00 C -ATOM 3853 HD2 LYS 245 -0.309 -12.082 11.169 1.00 0.00 H -ATOM 3854 HD3 LYS 245 -0.005 -10.414 11.045 1.00 0.00 H -ATOM 3855 CE LYS 245 -0.420 -11.303 13.033 1.00 0.00 C -ATOM 3856 HE2 LYS 245 -0.938 -10.483 13.530 1.00 0.00 H -ATOM 3857 HE3 LYS 245 -0.880 -12.223 13.393 1.00 0.00 H -ATOM 3858 NZ LYS 245 1.030 -11.248 13.419 1.00 0.00 N -ATOM 3859 HZ1 LYS 245 1.285 -10.286 13.245 1.00 0.00 H -ATOM 3860 HZ2 LYS 245 1.071 -11.489 14.399 1.00 0.00 H -ATOM 3861 HZ3 LYS 245 1.582 -11.888 12.867 1.00 0.00 H -ATOM 3862 C LYS 245 -3.993 -9.564 8.145 1.00 0.00 C -ATOM 3863 O LYS 245 -3.974 -10.161 7.092 1.00 0.00 O -ATOM 3864 N LEU 246 -3.860 -8.229 8.158 1.00 0.00 N -ATOM 3865 H LEU 246 -3.928 -7.787 9.064 1.00 0.00 H -ATOM 3866 CA LEU 246 -4.041 -7.323 7.052 1.00 0.00 C -ATOM 3867 HA LEU 246 -3.597 -7.822 6.190 1.00 0.00 H -ATOM 3868 CB LEU 246 -5.520 -7.093 6.729 1.00 0.00 C -ATOM 3869 HB2 LEU 246 -5.967 -8.086 6.659 1.00 0.00 H -ATOM 3870 HB3 LEU 246 -5.874 -6.534 7.595 1.00 0.00 H -ATOM 3871 CG LEU 246 -5.787 -6.219 5.501 1.00 0.00 C -ATOM 3872 HG LEU 246 -5.485 -5.193 5.709 1.00 0.00 H -ATOM 3873 CD1 LEU 246 -4.996 -6.509 4.200 1.00 0.00 C -ATOM 3874 HD11 LEU 246 -3.961 -6.792 4.390 1.00 0.00 H -ATOM 3875 HD12 LEU 246 -5.336 -7.333 3.571 1.00 0.00 H -ATOM 3876 HD13 LEU 246 -5.090 -5.595 3.614 1.00 0.00 H -ATOM 3877 CD2 LEU 246 -7.356 -6.285 5.166 1.00 0.00 C -ATOM 3878 HD21 LEU 246 -7.620 -5.718 4.273 1.00 0.00 H -ATOM 3879 HD22 LEU 246 -7.715 -7.297 4.978 1.00 0.00 H -ATOM 3880 HD23 LEU 246 -7.925 -5.870 5.998 1.00 0.00 H -ATOM 3881 C LEU 246 -3.204 -6.045 7.248 1.00 0.00 C -ATOM 3882 O LEU 246 -3.561 -5.197 8.087 1.00 0.00 O -ATOM 3883 N ASN 247 -2.104 -6.029 6.480 1.00 0.00 N -ATOM 3884 H ASN 247 -1.832 -6.867 5.986 1.00 0.00 H -ATOM 3885 CA ASN 247 -1.197 -4.864 6.381 1.00 0.00 C -ATOM 3886 HA ASN 247 -1.216 -4.290 7.308 1.00 0.00 H -ATOM 3887 CB ASN 247 0.309 -5.251 6.156 1.00 0.00 C -ATOM 3888 HB2 ASN 247 0.423 -5.948 5.326 1.00 0.00 H -ATOM 3889 HB3 ASN 247 0.779 -4.313 5.859 1.00 0.00 H -ATOM 3890 CG ASN 247 1.006 -5.894 7.289 1.00 0.00 C -ATOM 3891 OD1 ASN 247 0.437 -6.208 8.271 1.00 0.00 O -ATOM 3892 ND2 ASN 247 2.272 -6.155 7.276 1.00 0.00 N -ATOM 3893 HD21 ASN 247 2.660 -6.474 8.152 1.00 0.00 H -ATOM 3894 HD22 ASN 247 2.915 -5.985 6.516 1.00 0.00 H -ATOM 3895 C ASN 247 -1.745 -4.049 5.195 1.00 0.00 C -ATOM 3896 O ASN 247 -2.204 -4.586 4.209 1.00 0.00 O -ATOM 3897 N LEU 248 -1.553 -2.751 5.222 1.00 0.00 N -ATOM 3898 H LEU 248 -1.247 -2.436 6.131 1.00 0.00 H -ATOM 3899 CA LEU 248 -2.246 -1.737 4.396 1.00 0.00 C -ATOM 3900 HA LEU 248 -2.427 -2.086 3.380 1.00 0.00 H -ATOM 3901 CB LEU 248 -3.453 -1.253 5.139 1.00 0.00 C -ATOM 3902 HB2 LEU 248 -3.087 -0.861 6.086 1.00 0.00 H -ATOM 3903 HB3 LEU 248 -3.834 -0.336 4.690 1.00 0.00 H -ATOM 3904 CG LEU 248 -4.616 -2.297 5.217 1.00 0.00 C -ATOM 3905 HG LEU 248 -4.100 -3.189 5.571 1.00 0.00 H -ATOM 3906 CD1 LEU 248 -5.771 -1.847 6.113 1.00 0.00 C -ATOM 3907 HD11 LEU 248 -5.333 -1.469 7.037 1.00 0.00 H -ATOM 3908 HD12 LEU 248 -6.398 -1.040 5.735 1.00 0.00 H -ATOM 3909 HD13 LEU 248 -6.509 -2.604 6.379 1.00 0.00 H -ATOM 3910 CD2 LEU 248 -5.300 -2.681 3.875 1.00 0.00 C -ATOM 3911 HD21 LEU 248 -4.529 -3.135 3.251 1.00 0.00 H -ATOM 3912 HD22 LEU 248 -6.209 -3.277 3.949 1.00 0.00 H -ATOM 3913 HD23 LEU 248 -5.550 -1.749 3.368 1.00 0.00 H -ATOM 3914 C LEU 248 -1.214 -0.626 4.250 1.00 0.00 C -ATOM 3915 O LEU 248 -0.749 -0.080 5.288 1.00 0.00 O -ATOM 3916 N VAL 249 -0.786 -0.283 3.040 1.00 0.00 N -ATOM 3917 H VAL 249 -1.068 -0.854 2.257 1.00 0.00 H -ATOM 3918 CA VAL 249 0.525 0.383 2.837 1.00 0.00 C -ATOM 3919 HA VAL 249 0.845 0.980 3.692 1.00 0.00 H -ATOM 3920 CB VAL 249 1.555 -0.759 2.705 1.00 0.00 C -ATOM 3921 HB VAL 249 1.406 -1.270 1.754 1.00 0.00 H -ATOM 3922 CG1 VAL 249 2.985 -0.202 2.583 1.00 0.00 C -ATOM 3923 HG11 VAL 249 3.717 -1.001 2.474 1.00 0.00 H -ATOM 3924 HG12 VAL 249 3.090 0.571 1.822 1.00 0.00 H -ATOM 3925 HG13 VAL 249 3.258 0.310 3.507 1.00 0.00 H -ATOM 3926 CG2 VAL 249 1.444 -1.857 3.770 1.00 0.00 C -ATOM 3927 HG21 VAL 249 1.788 -1.496 4.739 1.00 0.00 H -ATOM 3928 HG22 VAL 249 0.455 -2.311 3.823 1.00 0.00 H -ATOM 3929 HG23 VAL 249 2.112 -2.679 3.515 1.00 0.00 H -ATOM 3930 C VAL 249 0.568 1.339 1.619 1.00 0.00 C -ATOM 3931 O VAL 249 0.084 1.037 0.512 1.00 0.00 O -ATOM 3932 N ASP 250 1.218 2.527 1.808 1.00 0.00 N -ATOM 3933 H ASP 250 1.602 2.669 2.730 1.00 0.00 H -ATOM 3934 CA ASP 250 1.382 3.634 0.897 1.00 0.00 C -ATOM 3935 HA ASP 250 0.995 3.343 -0.079 1.00 0.00 H -ATOM 3936 CB ASP 250 0.638 4.883 1.566 1.00 0.00 C -ATOM 3937 HB2 ASP 250 -0.341 4.579 1.938 1.00 0.00 H -ATOM 3938 HB3 ASP 250 1.293 5.126 2.403 1.00 0.00 H -ATOM 3939 CG ASP 250 0.480 6.062 0.584 1.00 0.00 C -ATOM 3940 OD1 ASP 250 0.556 5.791 -0.665 1.00 0.00 O -ATOM 3941 OD2 ASP 250 0.299 7.181 1.030 1.00 0.00 O -ATOM 3942 C ASP 250 2.842 4.056 0.632 1.00 0.00 C -ATOM 3943 O ASP 250 3.538 4.466 1.593 1.00 0.00 O -ATOM 3944 N LEU 251 3.340 3.985 -0.594 1.00 0.00 N -ATOM 3945 H LEU 251 2.718 3.637 -1.311 1.00 0.00 H -ATOM 3946 CA LEU 251 4.809 4.183 -0.943 1.00 0.00 C -ATOM 3947 HA LEU 251 5.395 4.036 -0.036 1.00 0.00 H -ATOM 3948 CB LEU 251 5.245 3.109 -2.018 1.00 0.00 C -ATOM 3949 HB2 LEU 251 4.824 3.322 -3.001 1.00 0.00 H -ATOM 3950 HB3 LEU 251 6.302 3.348 -2.143 1.00 0.00 H -ATOM 3951 CG LEU 251 5.026 1.602 -1.712 1.00 0.00 C -ATOM 3952 HG LEU 251 3.967 1.355 -1.642 1.00 0.00 H -ATOM 3953 CD1 LEU 251 5.586 0.681 -2.864 1.00 0.00 C -ATOM 3954 HD11 LEU 251 6.623 0.927 -3.094 1.00 0.00 H -ATOM 3955 HD12 LEU 251 5.456 -0.373 -2.618 1.00 0.00 H -ATOM 3956 HD13 LEU 251 5.064 0.935 -3.788 1.00 0.00 H -ATOM 3957 CD2 LEU 251 5.852 1.165 -0.486 1.00 0.00 C -ATOM 3958 HD21 LEU 251 5.773 0.086 -0.356 1.00 0.00 H -ATOM 3959 HD22 LEU 251 6.905 1.346 -0.698 1.00 0.00 H -ATOM 3960 HD23 LEU 251 5.549 1.772 0.368 1.00 0.00 H -ATOM 3961 C LEU 251 5.172 5.568 -1.374 1.00 0.00 C -ATOM 3962 O LEU 251 4.376 6.245 -2.036 1.00 0.00 O -ATOM 3963 N ALA 252 6.432 5.967 -1.281 1.00 0.00 N -ATOM 3964 H ALA 252 6.942 5.522 -0.533 1.00 0.00 H -ATOM 3965 CA ALA 252 7.087 7.079 -2.038 1.00 0.00 C -ATOM 3966 HA ALA 252 6.731 8.035 -1.652 1.00 0.00 H -ATOM 3967 CB ALA 252 8.620 6.914 -1.727 1.00 0.00 C -ATOM 3968 HB1 ALA 252 8.946 5.970 -2.163 1.00 0.00 H -ATOM 3969 HB2 ALA 252 9.166 7.771 -2.122 1.00 0.00 H -ATOM 3970 HB3 ALA 252 8.749 6.882 -0.645 1.00 0.00 H -ATOM 3971 C ALA 252 6.794 7.009 -3.554 1.00 0.00 C -ATOM 3972 O ALA 252 6.532 5.954 -4.177 1.00 0.00 O -ATOM 3973 N GLY 253 6.747 8.205 -4.182 1.00 0.00 N -ATOM 3974 H GLY 253 6.729 8.959 -3.510 1.00 0.00 H -ATOM 3975 CA GLY 253 6.994 8.578 -5.576 1.00 0.00 C -ATOM 3976 HA2 GLY 253 6.176 8.298 -6.239 1.00 0.00 H -ATOM 3977 HA3 GLY 253 7.219 9.637 -5.705 1.00 0.00 H -ATOM 3978 C GLY 253 8.160 7.843 -6.156 1.00 0.00 C -ATOM 3979 O GLY 253 9.270 8.231 -5.741 1.00 0.00 O -ATOM 3980 N SER 254 7.885 6.926 -7.056 1.00 0.00 N -ATOM 3981 H SER 254 6.919 6.662 -7.183 1.00 0.00 H -ATOM 3982 CA SER 254 8.816 5.951 -7.692 1.00 0.00 C -ATOM 3983 HA SER 254 9.651 5.878 -6.994 1.00 0.00 H -ATOM 3984 CB SER 254 8.238 4.516 -7.763 1.00 0.00 C -ATOM 3985 HB2 SER 254 8.698 4.006 -8.611 1.00 0.00 H -ATOM 3986 HB3 SER 254 8.309 3.910 -6.860 1.00 0.00 H -ATOM 3987 OG SER 254 6.872 4.532 -8.076 1.00 0.00 O -ATOM 3988 HG SER 254 6.808 4.367 -9.019 1.00 0.00 H -ATOM 3989 C SER 254 9.395 6.335 -9.068 1.00 0.00 C -ATOM 3990 O SER 254 9.886 5.475 -9.775 1.00 0.00 O -ATOM 3991 N GLU 255 9.394 7.584 -9.479 1.00 0.00 N -ATOM 3992 H GLU 255 9.021 8.264 -8.833 1.00 0.00 H -ATOM 3993 CA GLU 255 9.991 8.021 -10.734 1.00 0.00 C -ATOM 3994 HA GLU 255 9.646 7.350 -11.521 1.00 0.00 H -ATOM 3995 CB GLU 255 9.565 9.492 -11.067 1.00 0.00 C -ATOM 3996 HB2 GLU 255 9.697 9.748 -12.119 1.00 0.00 H -ATOM 3997 HB3 GLU 255 8.499 9.545 -10.848 1.00 0.00 H -ATOM 3998 CG GLU 255 10.228 10.546 -10.152 1.00 0.00 C -ATOM 3999 HG2 GLU 255 11.291 10.364 -9.996 1.00 0.00 H -ATOM 4000 HG3 GLU 255 10.229 11.482 -10.710 1.00 0.00 H -ATOM 4001 CD GLU 255 9.632 10.687 -8.765 1.00 0.00 C -ATOM 4002 OE1 GLU 255 10.171 11.537 -8.080 1.00 0.00 O -ATOM 4003 OE2 GLU 255 8.623 10.115 -8.343 1.00 0.00 O -ATOM 4004 C GLU 255 11.530 7.936 -10.619 1.00 0.00 C -ATOM 4005 O GLU 255 12.108 7.958 -9.556 1.00 0.00 O -ATOM 4006 N ASN 256 12.124 8.063 -11.823 1.00 0.00 N -ATOM 4007 H ASN 256 11.525 8.008 -12.634 1.00 0.00 H -ATOM 4008 CA ASN 256 13.539 7.865 -12.088 1.00 0.00 C -ATOM 4009 HA ASN 256 13.720 6.796 -12.199 1.00 0.00 H -ATOM 4010 CB ASN 256 14.045 8.325 -13.476 1.00 0.00 C -ATOM 4011 HB2 ASN 256 13.421 7.876 -14.248 1.00 0.00 H -ATOM 4012 HB3 ASN 256 14.007 9.407 -13.606 1.00 0.00 H -ATOM 4013 CG ASN 256 15.478 7.869 -13.826 1.00 0.00 C -ATOM 4014 OD1 ASN 256 15.798 6.684 -13.834 1.00 0.00 O -ATOM 4015 ND2 ASN 256 16.405 8.780 -14.167 1.00 0.00 N -ATOM 4016 HD21 ASN 256 17.306 8.544 -14.559 1.00 0.00 H -ATOM 4017 HD22 ASN 256 16.119 9.747 -14.123 1.00 0.00 H -ATOM 4018 C ASN 256 14.460 8.403 -11.004 1.00 0.00 C -ATOM 4019 O ASN 256 15.288 7.717 -10.363 1.00 0.00 O -ATOM 4020 N ILE 257 14.335 9.737 -10.784 1.00 0.00 N -ATOM 4021 H ILE 257 13.664 10.290 -11.296 1.00 0.00 H -ATOM 4022 CA ILE 257 15.305 10.510 -9.879 1.00 0.00 C -ATOM 4023 HA ILE 257 16.279 10.220 -10.273 1.00 0.00 H -ATOM 4024 CB ILE 257 15.315 12.078 -10.137 1.00 0.00 C -ATOM 4025 HB ILE 257 15.431 12.292 -11.199 1.00 0.00 H -ATOM 4026 CG2 ILE 257 13.954 12.672 -9.757 1.00 0.00 C -ATOM 4027 HG21 ILE 257 14.020 13.761 -9.753 1.00 0.00 H -ATOM 4028 HG22 ILE 257 13.171 12.228 -10.373 1.00 0.00 H -ATOM 4029 HG23 ILE 257 13.744 12.553 -8.695 1.00 0.00 H -ATOM 4030 CG1 ILE 257 16.423 12.881 -9.419 1.00 0.00 C -ATOM 4031 HG12 ILE 257 16.254 13.958 -9.381 1.00 0.00 H -ATOM 4032 HG13 ILE 257 16.392 12.541 -8.383 1.00 0.00 H -ATOM 4033 CD1 ILE 257 17.913 12.813 -9.846 1.00 0.00 C -ATOM 4034 HD11 ILE 257 18.075 13.244 -10.833 1.00 0.00 H -ATOM 4035 HD12 ILE 257 18.604 13.298 -9.156 1.00 0.00 H -ATOM 4036 HD13 ILE 257 18.122 11.743 -9.870 1.00 0.00 H -ATOM 4037 C ILE 257 15.279 10.111 -8.355 1.00 0.00 C -ATOM 4038 O ILE 257 16.296 10.306 -7.645 1.00 0.00 O -ATOM 4039 N GLY 258 14.209 9.504 -7.877 1.00 0.00 N -ATOM 4040 H GLY 258 13.399 9.316 -8.450 1.00 0.00 H -ATOM 4041 CA GLY 258 14.185 8.881 -6.479 1.00 0.00 C -ATOM 4042 HA2 GLY 258 14.912 9.380 -5.839 1.00 0.00 H -ATOM 4043 HA3 GLY 258 13.184 9.088 -6.105 1.00 0.00 H -ATOM 4044 C GLY 258 14.442 7.321 -6.558 1.00 0.00 C -ATOM 4045 O GLY 258 14.701 6.697 -5.564 1.00 0.00 O -ATOM 4046 N ARG 259 14.386 6.681 -7.771 1.00 0.00 N -ATOM 4047 H ARG 259 14.171 7.290 -8.548 1.00 0.00 H -ATOM 4048 CA ARG 259 14.527 5.246 -8.058 1.00 0.00 C -ATOM 4049 HA ARG 259 14.278 4.696 -7.151 1.00 0.00 H -ATOM 4050 CB ARG 259 13.456 4.983 -9.144 1.00 0.00 C -ATOM 4051 HB2 ARG 259 12.522 5.426 -8.797 1.00 0.00 H -ATOM 4052 HB3 ARG 259 13.795 5.458 -10.065 1.00 0.00 H -ATOM 4053 CG ARG 259 13.306 3.481 -9.420 1.00 0.00 C -ATOM 4054 HG2 ARG 259 14.282 3.108 -9.732 1.00 0.00 H -ATOM 4055 HG3 ARG 259 13.147 2.995 -8.458 1.00 0.00 H -ATOM 4056 CD ARG 259 12.320 3.035 -10.478 1.00 0.00 C -ATOM 4057 HD2 ARG 259 12.369 1.946 -10.461 1.00 0.00 H -ATOM 4058 HD3 ARG 259 11.304 3.328 -10.215 1.00 0.00 H -ATOM 4059 NE ARG 259 12.666 3.520 -11.809 1.00 0.00 N -ATOM 4060 HE ARG 259 13.563 3.295 -12.216 1.00 0.00 H -ATOM 4061 CZ ARG 259 11.987 4.321 -12.608 1.00 0.00 C -ATOM 4062 NH1 ARG 259 10.811 4.788 -12.292 1.00 0.00 N -ATOM 4063 HH11 ARG 259 10.405 4.662 -11.376 1.00 0.00 H -ATOM 4064 HH12 ARG 259 10.309 5.288 -13.011 1.00 0.00 H -ATOM 4065 NH2 ARG 259 12.535 4.576 -13.737 1.00 0.00 N -ATOM 4066 HH21 ARG 259 13.481 4.264 -13.907 1.00 0.00 H -ATOM 4067 HH22 ARG 259 12.100 5.088 -14.491 1.00 0.00 H -ATOM 4068 C ARG 259 15.845 4.684 -8.474 1.00 0.00 C -ATOM 4069 O ARG 259 16.202 3.550 -8.096 1.00 0.00 O -ATOM 4070 N SER 260 16.627 5.528 -9.085 1.00 0.00 N -ATOM 4071 H SER 260 16.126 6.355 -9.378 1.00 0.00 H -ATOM 4072 CA SER 260 18.115 5.481 -9.477 1.00 0.00 C -ATOM 4073 HA SER 260 18.132 4.446 -9.817 1.00 0.00 H -ATOM 4074 CB SER 260 18.435 6.482 -10.611 1.00 0.00 C -ATOM 4075 HB2 SER 260 19.475 6.444 -10.933 1.00 0.00 H -ATOM 4076 HB3 SER 260 17.828 6.309 -11.500 1.00 0.00 H -ATOM 4077 OG SER 260 18.092 7.812 -10.247 1.00 0.00 O -ATOM 4078 HG SER 260 17.144 7.923 -10.349 1.00 0.00 H -ATOM 4079 C SER 260 19.027 5.533 -8.326 1.00 0.00 C -ATOM 4080 O SER 260 18.812 6.188 -7.302 1.00 0.00 O -ATOM 4081 N GLY 261 20.043 4.710 -8.364 1.00 0.00 N -ATOM 4082 H GLY 261 20.151 4.084 -9.150 1.00 0.00 H -ATOM 4083 CA GLY 261 21.123 4.512 -7.290 1.00 0.00 C -ATOM 4084 HA2 GLY 261 20.670 4.571 -6.300 1.00 0.00 H -ATOM 4085 HA3 GLY 261 21.698 3.590 -7.371 1.00 0.00 H -ATOM 4086 C GLY 261 22.242 5.619 -7.226 1.00 0.00 C -ATOM 4087 O GLY 261 22.789 5.923 -6.158 1.00 0.00 O -ATOM 4088 N ALA 262 22.479 6.357 -8.299 1.00 0.00 N -ATOM 4089 H ALA 262 22.038 6.092 -9.168 1.00 0.00 H -ATOM 4090 CA ALA 262 23.679 7.215 -8.501 1.00 0.00 C -ATOM 4091 HA ALA 262 24.587 6.616 -8.433 1.00 0.00 H -ATOM 4092 CB ALA 262 23.857 7.694 -9.971 1.00 0.00 C -ATOM 4093 HB1 ALA 262 24.729 8.336 -10.090 1.00 0.00 H -ATOM 4094 HB2 ALA 262 23.961 6.887 -10.696 1.00 0.00 H -ATOM 4095 HB3 ALA 262 22.987 8.286 -10.254 1.00 0.00 H -ATOM 4096 C ALA 262 23.779 8.449 -7.618 1.00 0.00 C -ATOM 4097 O ALA 262 24.888 9.007 -7.449 1.00 0.00 O -ATOM 4098 N VAL 263 22.665 8.913 -7.036 1.00 0.00 N -ATOM 4099 H VAL 263 21.753 8.538 -7.252 1.00 0.00 H -ATOM 4100 CA VAL 263 22.613 10.055 -6.199 1.00 0.00 C -ATOM 4101 HA VAL 263 22.870 10.889 -6.852 1.00 0.00 H -ATOM 4102 CB VAL 263 21.142 10.366 -5.707 1.00 0.00 C -ATOM 4103 HB VAL 263 21.156 11.080 -4.883 1.00 0.00 H -ATOM 4104 CG1 VAL 263 20.209 10.926 -6.862 1.00 0.00 C -ATOM 4105 HG11 VAL 263 20.621 11.815 -7.341 1.00 0.00 H -ATOM 4106 HG12 VAL 263 20.108 10.119 -7.589 1.00 0.00 H -ATOM 4107 HG13 VAL 263 19.223 11.180 -6.472 1.00 0.00 H -ATOM 4108 CG2 VAL 263 20.540 9.075 -5.110 1.00 0.00 C -ATOM 4109 HG21 VAL 263 21.022 8.778 -4.178 1.00 0.00 H -ATOM 4110 HG22 VAL 263 19.564 9.386 -4.736 1.00 0.00 H -ATOM 4111 HG23 VAL 263 20.409 8.259 -5.820 1.00 0.00 H -ATOM 4112 C VAL 263 23.509 9.932 -4.937 1.00 0.00 C -ATOM 4113 O VAL 263 24.080 10.932 -4.478 1.00 0.00 O -ATOM 4114 N ASP 264 23.793 8.701 -4.477 1.00 0.00 N -ATOM 4115 H ASP 264 23.209 7.981 -4.878 1.00 0.00 H -ATOM 4116 CA ASP 264 24.726 8.314 -3.398 1.00 0.00 C -ATOM 4117 HA ASP 264 24.516 8.889 -2.497 1.00 0.00 H -ATOM 4118 CB ASP 264 24.549 6.829 -3.101 1.00 0.00 C -ATOM 4119 HB2 ASP 264 23.487 6.613 -2.986 1.00 0.00 H -ATOM 4120 HB3 ASP 264 24.866 6.247 -3.967 1.00 0.00 H -ATOM 4121 CG ASP 264 25.184 6.310 -1.816 1.00 0.00 C -ATOM 4122 OD1 ASP 264 25.020 6.807 -0.691 1.00 0.00 O -ATOM 4123 OD2 ASP 264 25.892 5.293 -1.856 1.00 0.00 O -ATOM 4124 C ASP 264 26.246 8.545 -3.774 1.00 0.00 C -ATOM 4125 O ASP 264 27.054 8.792 -2.841 1.00 0.00 O -ATOM 4126 N LYS 265 26.689 8.665 -5.057 1.00 0.00 N -ATOM 4127 H LYS 265 26.023 8.375 -5.759 1.00 0.00 H -ATOM 4128 CA LYS 265 28.004 9.294 -5.396 1.00 0.00 C -ATOM 4129 HA LYS 265 28.785 8.719 -4.898 1.00 0.00 H -ATOM 4130 CB LYS 265 28.223 9.322 -6.922 1.00 0.00 C -ATOM 4131 HB2 LYS 265 27.523 9.996 -7.414 1.00 0.00 H -ATOM 4132 HB3 LYS 265 29.198 9.779 -7.089 1.00 0.00 H -ATOM 4133 CG LYS 265 28.277 7.913 -7.511 1.00 0.00 C -ATOM 4134 HG2 LYS 265 28.840 7.219 -6.888 1.00 0.00 H -ATOM 4135 HG3 LYS 265 27.259 7.533 -7.601 1.00 0.00 H -ATOM 4136 CD LYS 265 28.818 7.991 -8.934 1.00 0.00 C -ATOM 4137 HD2 LYS 265 28.191 7.246 -9.425 1.00 0.00 H -ATOM 4138 HD3 LYS 265 28.732 9.020 -9.281 1.00 0.00 H -ATOM 4139 CE LYS 265 30.280 7.508 -8.817 1.00 0.00 C -ATOM 4140 HE2 LYS 265 30.858 7.813 -9.690 1.00 0.00 H -ATOM 4141 HE3 LYS 265 30.760 7.826 -7.892 1.00 0.00 H -ATOM 4142 NZ LYS 265 30.344 6.023 -8.919 1.00 0.00 N -ATOM 4143 HZ1 LYS 265 31.308 5.729 -8.984 1.00 0.00 H -ATOM 4144 HZ2 LYS 265 29.899 5.503 -8.176 1.00 0.00 H -ATOM 4145 HZ3 LYS 265 29.898 5.735 -9.778 1.00 0.00 H -ATOM 4146 C LYS 265 28.222 10.705 -4.913 1.00 0.00 C -ATOM 4147 O LYS 265 29.293 11.102 -4.554 1.00 0.00 O -ATOM 4148 N ARG 266 27.182 11.549 -5.009 1.00 0.00 N -ATOM 4149 H ARG 266 26.291 11.108 -5.185 1.00 0.00 H -ATOM 4150 CA ARG 266 27.180 12.960 -4.758 1.00 0.00 C -ATOM 4151 HA ARG 266 28.204 13.324 -4.849 1.00 0.00 H -ATOM 4152 CB ARG 266 26.411 13.723 -5.903 1.00 0.00 C -ATOM 4153 HB2 ARG 266 25.420 13.292 -6.045 1.00 0.00 H -ATOM 4154 HB3 ARG 266 26.387 14.746 -5.532 1.00 0.00 H -ATOM 4155 CG ARG 266 27.270 13.744 -7.121 1.00 0.00 C -ATOM 4156 HG2 ARG 266 28.312 14.029 -6.972 1.00 0.00 H -ATOM 4157 HG3 ARG 266 27.287 12.735 -7.531 1.00 0.00 H -ATOM 4158 CD ARG 266 26.636 14.743 -8.024 1.00 0.00 C -ATOM 4159 HD2 ARG 266 25.594 14.461 -8.173 1.00 0.00 H -ATOM 4160 HD3 ARG 266 26.627 15.766 -7.645 1.00 0.00 H -ATOM 4161 NE ARG 266 27.188 14.769 -9.412 1.00 0.00 N -ATOM 4162 HE ARG 266 28.119 15.153 -9.470 1.00 0.00 H -ATOM 4163 CZ ARG 266 26.655 14.473 -10.619 1.00 0.00 C -ATOM 4164 NH1 ARG 266 25.418 14.050 -10.739 1.00 0.00 N -ATOM 4165 HH11 ARG 266 24.732 14.031 -9.997 1.00 0.00 H -ATOM 4166 HH12 ARG 266 25.091 13.890 -11.680 1.00 0.00 H -ATOM 4167 NH2 ARG 266 27.419 14.615 -11.756 1.00 0.00 N -ATOM 4168 HH21 ARG 266 28.373 14.893 -11.575 1.00 0.00 H -ATOM 4169 HH22 ARG 266 26.995 14.423 -12.652 1.00 0.00 H -ATOM 4170 C ARG 266 26.652 13.450 -3.393 1.00 0.00 C -ATOM 4171 O ARG 266 27.050 14.526 -2.930 1.00 0.00 O -ATOM 4172 N ALA 267 25.904 12.569 -2.648 1.00 0.00 N -ATOM 4173 H ALA 267 25.464 11.736 -3.013 1.00 0.00 H -ATOM 4174 CA ALA 267 25.545 12.792 -1.234 1.00 0.00 C -ATOM 4175 HA ALA 267 26.411 13.053 -0.625 1.00 0.00 H -ATOM 4176 CB ALA 267 24.583 13.900 -1.062 1.00 0.00 C -ATOM 4177 HB1 ALA 267 24.107 13.682 -0.106 1.00 0.00 H -ATOM 4178 HB2 ALA 267 25.078 14.869 -1.000 1.00 0.00 H -ATOM 4179 HB3 ALA 267 23.868 13.751 -1.871 1.00 0.00 H -ATOM 4180 C ALA 267 24.951 11.476 -0.617 1.00 0.00 C -ATOM 4181 O ALA 267 24.108 10.738 -1.177 1.00 0.00 O -ATOM 4182 N ARG 268 25.369 11.201 0.626 1.00 0.00 N -ATOM 4183 H ARG 268 25.966 11.878 1.080 1.00 0.00 H -ATOM 4184 CA ARG 268 25.044 9.935 1.287 1.00 0.00 C -ATOM 4185 HA ARG 268 25.228 9.152 0.550 1.00 0.00 H -ATOM 4186 CB ARG 268 25.922 9.692 2.492 1.00 0.00 C -ATOM 4187 HB2 ARG 268 26.940 9.709 2.103 1.00 0.00 H -ATOM 4188 HB3 ARG 268 25.846 10.468 3.254 1.00 0.00 H -ATOM 4189 CG ARG 268 25.592 8.381 3.210 1.00 0.00 C -ATOM 4190 HG2 ARG 268 24.589 8.384 3.635 1.00 0.00 H -ATOM 4191 HG3 ARG 268 25.706 7.582 2.477 1.00 0.00 H -ATOM 4192 CD ARG 268 26.592 8.129 4.311 1.00 0.00 C -ATOM 4193 HD2 ARG 268 27.589 8.369 3.942 1.00 0.00 H -ATOM 4194 HD3 ARG 268 26.334 8.799 5.131 1.00 0.00 H -ATOM 4195 NE ARG 268 26.656 6.700 4.749 1.00 0.00 N -ATOM 4196 HE ARG 268 25.946 6.163 4.274 1.00 0.00 H -ATOM 4197 CZ ARG 268 27.509 6.063 5.568 1.00 0.00 C -ATOM 4198 NH1 ARG 268 28.533 6.624 6.054 1.00 0.00 N -ATOM 4199 HH11 ARG 268 28.684 7.579 5.760 1.00 0.00 H -ATOM 4200 HH12 ARG 268 29.246 5.963 6.328 1.00 0.00 H -ATOM 4201 NH2 ARG 268 27.276 4.814 5.805 1.00 0.00 N -ATOM 4202 HH21 ARG 268 26.566 4.288 5.317 1.00 0.00 H -ATOM 4203 HH22 ARG 268 27.927 4.443 6.482 1.00 0.00 H -ATOM 4204 C ARG 268 23.576 9.991 1.667 1.00 0.00 C -ATOM 4205 O ARG 268 22.838 9.000 1.647 1.00 0.00 O -ATOM 4206 N GLU 269 23.100 11.163 2.126 1.00 0.00 N -ATOM 4207 H GLU 269 23.751 11.935 2.154 1.00 0.00 H -ATOM 4208 CA GLU 269 21.702 11.479 2.475 1.00 0.00 C -ATOM 4209 HA GLU 269 21.400 10.970 3.390 1.00 0.00 H -ATOM 4210 CB GLU 269 21.626 12.966 2.832 1.00 0.00 C -ATOM 4211 HB2 GLU 269 22.193 13.502 2.071 1.00 0.00 H -ATOM 4212 HB3 GLU 269 20.563 13.199 2.762 1.00 0.00 H -ATOM 4213 CG GLU 269 22.101 13.173 4.278 1.00 0.00 C -ATOM 4214 HG2 GLU 269 21.876 14.183 4.621 1.00 0.00 H -ATOM 4215 HG3 GLU 269 21.661 12.446 4.962 1.00 0.00 H -ATOM 4216 CD GLU 269 23.599 12.976 4.482 1.00 0.00 C -ATOM 4217 OE1 GLU 269 24.027 12.685 5.622 1.00 0.00 O -ATOM 4218 OE2 GLU 269 24.410 13.271 3.539 1.00 0.00 O -ATOM 4219 C GLU 269 20.768 11.077 1.342 1.00 0.00 C -ATOM 4220 O GLU 269 19.916 10.184 1.507 1.00 0.00 O -ATOM 4221 N ALA 270 21.207 11.548 0.177 1.00 0.00 N -ATOM 4222 H ALA 270 21.961 12.212 0.281 1.00 0.00 H -ATOM 4223 CA ALA 270 20.448 11.392 -0.987 1.00 0.00 C -ATOM 4224 HA ALA 270 19.410 11.695 -0.849 1.00 0.00 H -ATOM 4225 CB ALA 270 21.005 12.378 -2.057 1.00 0.00 C -ATOM 4226 HB1 ALA 270 21.910 11.982 -2.517 1.00 0.00 H -ATOM 4227 HB2 ALA 270 20.272 12.487 -2.856 1.00 0.00 H -ATOM 4228 HB3 ALA 270 21.271 13.339 -1.616 1.00 0.00 H -ATOM 4229 C ALA 270 20.466 9.957 -1.517 1.00 0.00 C -ATOM 4230 O ALA 270 19.387 9.537 -2.039 1.00 0.00 O -ATOM 4231 N GLY 271 21.442 9.163 -1.251 1.00 0.00 N -ATOM 4232 H GLY 271 22.327 9.565 -0.978 1.00 0.00 H -ATOM 4233 CA GLY 271 21.432 7.754 -1.410 1.00 0.00 C -ATOM 4234 HA2 GLY 271 21.065 7.462 -2.394 1.00 0.00 H -ATOM 4235 HA3 GLY 271 22.440 7.356 -1.291 1.00 0.00 H -ATOM 4236 C GLY 271 20.564 6.992 -0.376 1.00 0.00 C -ATOM 4237 O GLY 271 19.906 6.039 -0.696 1.00 0.00 O -ATOM 4238 N ASN 272 20.623 7.411 0.959 1.00 0.00 N -ATOM 4239 H ASN 272 21.254 8.143 1.252 1.00 0.00 H -ATOM 4240 CA ASN 272 19.794 6.803 2.035 1.00 0.00 C -ATOM 4241 HA ASN 272 20.070 5.749 2.017 1.00 0.00 H -ATOM 4242 CB ASN 272 20.110 7.423 3.368 1.00 0.00 C -ATOM 4243 HB2 ASN 272 19.946 8.500 3.327 1.00 0.00 H -ATOM 4244 HB3 ASN 272 19.333 7.133 4.076 1.00 0.00 H -ATOM 4245 CG ASN 272 21.442 7.008 3.961 1.00 0.00 C -ATOM 4246 OD1 ASN 272 21.830 5.840 3.912 1.00 0.00 O -ATOM 4247 ND2 ASN 272 22.163 7.870 4.533 1.00 0.00 N -ATOM 4248 HD21 ASN 272 22.927 7.488 5.073 1.00 0.00 H -ATOM 4249 HD22 ASN 272 21.701 8.739 4.760 1.00 0.00 H -ATOM 4250 C ASN 272 18.321 7.006 1.600 1.00 0.00 C -ATOM 4251 O ASN 272 17.423 6.104 1.820 1.00 0.00 O -ATOM 4252 N ILE 273 17.982 8.142 1.002 1.00 0.00 N -ATOM 4253 H ILE 273 18.638 8.910 1.002 1.00 0.00 H -ATOM 4254 CA ILE 273 16.675 8.345 0.478 1.00 0.00 C -ATOM 4255 HA ILE 273 15.998 8.083 1.292 1.00 0.00 H -ATOM 4256 CB ILE 273 16.532 9.811 0.080 1.00 0.00 C -ATOM 4257 HB ILE 273 17.370 10.140 -0.535 1.00 0.00 H -ATOM 4258 CG2 ILE 273 15.164 10.151 -0.532 1.00 0.00 C -ATOM 4259 HG21 ILE 273 14.712 11.025 -0.062 1.00 0.00 H -ATOM 4260 HG22 ILE 273 15.284 10.415 -1.583 1.00 0.00 H -ATOM 4261 HG23 ILE 273 14.453 9.360 -0.299 1.00 0.00 H -ATOM 4262 CG1 ILE 273 16.616 10.665 1.325 1.00 0.00 C -ATOM 4263 HG12 ILE 273 15.664 10.759 1.847 1.00 0.00 H -ATOM 4264 HG13 ILE 273 17.281 10.300 2.108 1.00 0.00 H -ATOM 4265 CD1 ILE 273 16.999 12.153 1.021 1.00 0.00 C -ATOM 4266 HD11 ILE 273 16.850 12.738 1.930 1.00 0.00 H -ATOM 4267 HD12 ILE 273 18.027 12.152 0.657 1.00 0.00 H -ATOM 4268 HD13 ILE 273 16.316 12.616 0.310 1.00 0.00 H -ATOM 4269 C ILE 273 16.490 7.340 -0.689 1.00 0.00 C -ATOM 4270 O ILE 273 15.586 6.484 -0.599 1.00 0.00 O -ATOM 4271 N ASN 274 17.367 7.336 -1.697 1.00 0.00 N -ATOM 4272 H ASN 274 18.099 8.022 -1.815 1.00 0.00 H -ATOM 4273 CA ASN 274 17.046 6.438 -2.846 1.00 0.00 C -ATOM 4274 HA ASN 274 15.978 6.524 -3.043 1.00 0.00 H -ATOM 4275 CB ASN 274 17.826 6.902 -4.050 1.00 0.00 C -ATOM 4276 HB2 ASN 274 18.872 7.074 -3.792 1.00 0.00 H -ATOM 4277 HB3 ASN 274 17.860 6.095 -4.781 1.00 0.00 H -ATOM 4278 CG ASN 274 17.263 8.146 -4.700 1.00 0.00 C -ATOM 4279 OD1 ASN 274 16.590 8.993 -4.049 1.00 0.00 O -ATOM 4280 ND2 ASN 274 17.474 8.343 -5.977 1.00 0.00 N -ATOM 4281 HD21 ASN 274 17.086 9.140 -6.460 1.00 0.00 H -ATOM 4282 HD22 ASN 274 18.029 7.625 -6.421 1.00 0.00 H -ATOM 4283 C ASN 274 17.184 4.880 -2.581 1.00 0.00 C -ATOM 4284 O ASN 274 16.568 4.077 -3.317 1.00 0.00 O -ATOM 4285 N GLN 275 17.833 4.474 -1.536 1.00 0.00 N -ATOM 4286 H GLN 275 18.324 5.108 -0.924 1.00 0.00 H -ATOM 4287 CA GLN 275 17.977 3.012 -1.409 1.00 0.00 C -ATOM 4288 HA GLN 275 18.485 2.738 -2.333 1.00 0.00 H -ATOM 4289 CB GLN 275 18.912 2.809 -0.154 1.00 0.00 C -ATOM 4290 HB2 GLN 275 19.779 3.470 -0.142 1.00 0.00 H -ATOM 4291 HB3 GLN 275 18.314 3.057 0.723 1.00 0.00 H -ATOM 4292 CG GLN 275 19.379 1.370 0.174 1.00 0.00 C -ATOM 4293 HG2 GLN 275 19.727 1.288 1.204 1.00 0.00 H -ATOM 4294 HG3 GLN 275 18.523 0.738 -0.062 1.00 0.00 H -ATOM 4295 CD GLN 275 20.529 0.929 -0.703 1.00 0.00 C -ATOM 4296 OE1 GLN 275 21.235 1.659 -1.391 1.00 0.00 O -ATOM 4297 NE2 GLN 275 20.901 -0.313 -0.635 1.00 0.00 N -ATOM 4298 HE21 GLN 275 21.654 -0.614 -1.236 1.00 0.00 H -ATOM 4299 HE22 GLN 275 20.296 -1.002 -0.209 1.00 0.00 H -ATOM 4300 C GLN 275 16.656 2.161 -1.321 1.00 0.00 C -ATOM 4301 O GLN 275 16.681 1.110 -1.916 1.00 0.00 O -ATOM 4302 N SER 276 15.520 2.564 -0.741 1.00 0.00 N -ATOM 4303 H SER 276 15.608 3.441 -0.249 1.00 0.00 H -ATOM 4304 CA SER 276 14.231 1.774 -0.700 1.00 0.00 C -ATOM 4305 HA SER 276 14.459 0.770 -0.344 1.00 0.00 H -ATOM 4306 CB SER 276 13.226 2.496 0.225 1.00 0.00 C -ATOM 4307 HB2 SER 276 12.253 2.050 0.019 1.00 0.00 H -ATOM 4308 HB3 SER 276 13.340 2.248 1.280 1.00 0.00 H -ATOM 4309 OG SER 276 13.177 3.889 0.131 1.00 0.00 O -ATOM 4310 HG SER 276 13.832 4.281 0.713 1.00 0.00 H -ATOM 4311 C SER 276 13.504 1.582 -1.997 1.00 0.00 C -ATOM 4312 O SER 276 12.883 0.503 -2.203 1.00 0.00 O -ATOM 4313 N LEU 277 13.544 2.540 -2.887 1.00 0.00 N -ATOM 4314 H LEU 277 14.075 3.374 -2.679 1.00 0.00 H -ATOM 4315 CA LEU 277 12.937 2.376 -4.217 1.00 0.00 C -ATOM 4316 HA LEU 277 11.929 1.976 -4.116 1.00 0.00 H -ATOM 4317 CB LEU 277 12.865 3.856 -4.694 1.00 0.00 C -ATOM 4318 HB2 LEU 277 13.752 4.424 -4.415 1.00 0.00 H -ATOM 4319 HB3 LEU 277 12.703 3.901 -5.771 1.00 0.00 H -ATOM 4320 CG LEU 277 11.609 4.564 -4.055 1.00 0.00 C -ATOM 4321 HG LEU 277 11.848 4.647 -2.995 1.00 0.00 H -ATOM 4322 CD1 LEU 277 11.435 5.999 -4.558 1.00 0.00 C -ATOM 4323 HD11 LEU 277 11.307 6.106 -5.636 1.00 0.00 H -ATOM 4324 HD12 LEU 277 10.756 6.597 -3.951 1.00 0.00 H -ATOM 4325 HD13 LEU 277 12.354 6.574 -4.431 1.00 0.00 H -ATOM 4326 CD2 LEU 277 10.300 3.904 -4.187 1.00 0.00 C -ATOM 4327 HD21 LEU 277 9.567 4.596 -3.773 1.00 0.00 H -ATOM 4328 HD22 LEU 277 10.038 3.761 -5.236 1.00 0.00 H -ATOM 4329 HD23 LEU 277 10.152 2.991 -3.611 1.00 0.00 H -ATOM 4330 C LEU 277 13.809 1.517 -5.090 1.00 0.00 C -ATOM 4331 O LEU 277 13.273 0.658 -5.817 1.00 0.00 O -ATOM 4332 N LEU 278 15.165 1.721 -5.042 1.00 0.00 N -ATOM 4333 H LEU 278 15.390 2.510 -4.452 1.00 0.00 H -ATOM 4334 CA LEU 278 16.203 0.894 -5.610 1.00 0.00 C -ATOM 4335 HA LEU 278 16.002 0.831 -6.679 1.00 0.00 H -ATOM 4336 CB LEU 278 17.568 1.524 -5.324 1.00 0.00 C -ATOM 4337 HB2 LEU 278 17.485 2.501 -5.800 1.00 0.00 H -ATOM 4338 HB3 LEU 278 17.638 1.630 -4.242 1.00 0.00 H -ATOM 4339 CG LEU 278 18.815 0.750 -5.841 1.00 0.00 C -ATOM 4340 HG LEU 278 18.758 -0.313 -5.604 1.00 0.00 H -ATOM 4341 CD1 LEU 278 18.991 0.843 -7.337 1.00 0.00 C -ATOM 4342 HD11 LEU 278 18.882 1.888 -7.630 1.00 0.00 H -ATOM 4343 HD12 LEU 278 19.920 0.309 -7.535 1.00 0.00 H -ATOM 4344 HD13 LEU 278 18.128 0.342 -7.775 1.00 0.00 H -ATOM 4345 CD2 LEU 278 19.989 1.329 -4.977 1.00 0.00 C -ATOM 4346 HD21 LEU 278 19.820 1.224 -3.905 1.00 0.00 H -ATOM 4347 HD22 LEU 278 20.892 0.734 -5.111 1.00 0.00 H -ATOM 4348 HD23 LEU 278 20.114 2.400 -5.138 1.00 0.00 H -ATOM 4349 C LEU 278 16.106 -0.588 -5.181 1.00 0.00 C -ATOM 4350 O LEU 278 16.007 -1.540 -5.966 1.00 0.00 O -ATOM 4351 N THR 279 15.949 -0.743 -3.845 1.00 0.00 N -ATOM 4352 H THR 279 16.118 0.048 -3.240 1.00 0.00 H -ATOM 4353 CA THR 279 15.882 -2.148 -3.332 1.00 0.00 C -ATOM 4354 HA THR 279 16.660 -2.634 -3.920 1.00 0.00 H -ATOM 4355 CB THR 279 16.165 -2.199 -1.830 1.00 0.00 C -ATOM 4356 HB THR 279 15.376 -1.764 -1.216 1.00 0.00 H -ATOM 4357 CG2 THR 279 16.489 -3.548 -1.306 1.00 0.00 C -ATOM 4358 HG21 THR 279 15.638 -4.167 -1.023 1.00 0.00 H -ATOM 4359 HG22 THR 279 17.117 -4.109 -1.998 1.00 0.00 H -ATOM 4360 HG23 THR 279 17.055 -3.486 -0.377 1.00 0.00 H -ATOM 4361 OG1 THR 279 17.338 -1.468 -1.649 1.00 0.00 O -ATOM 4362 HG1 THR 279 17.197 -0.520 -1.706 1.00 0.00 H -ATOM 4363 C THR 279 14.629 -2.838 -3.701 1.00 0.00 C -ATOM 4364 O THR 279 14.727 -4.004 -4.121 1.00 0.00 O -ATOM 4365 N LEU 280 13.441 -2.222 -3.647 1.00 0.00 N -ATOM 4366 H LEU 280 13.323 -1.320 -3.209 1.00 0.00 H -ATOM 4367 CA LEU 280 12.203 -2.835 -4.078 1.00 0.00 C -ATOM 4368 HA LEU 280 12.057 -3.783 -3.560 1.00 0.00 H -ATOM 4369 CB LEU 280 11.140 -1.784 -3.848 1.00 0.00 C -ATOM 4370 HB2 LEU 280 10.978 -1.551 -2.795 1.00 0.00 H -ATOM 4371 HB3 LEU 280 11.495 -0.884 -4.350 1.00 0.00 H -ATOM 4372 CG LEU 280 9.636 -2.099 -4.385 1.00 0.00 C -ATOM 4373 HG LEU 280 9.708 -2.432 -5.421 1.00 0.00 H -ATOM 4374 CD1 LEU 280 9.009 -3.262 -3.513 1.00 0.00 C -ATOM 4375 HD11 LEU 280 8.140 -3.591 -4.083 1.00 0.00 H -ATOM 4376 HD12 LEU 280 9.883 -3.913 -3.491 1.00 0.00 H -ATOM 4377 HD13 LEU 280 8.819 -2.829 -2.530 1.00 0.00 H -ATOM 4378 CD2 LEU 280 8.612 -0.977 -4.301 1.00 0.00 C -ATOM 4379 HD21 LEU 280 8.933 -0.199 -4.993 1.00 0.00 H -ATOM 4380 HD22 LEU 280 7.636 -1.320 -4.645 1.00 0.00 H -ATOM 4381 HD23 LEU 280 8.537 -0.588 -3.286 1.00 0.00 H -ATOM 4382 C LEU 280 12.305 -3.396 -5.504 1.00 0.00 C -ATOM 4383 O LEU 280 11.779 -4.437 -5.822 1.00 0.00 O -ATOM 4384 N GLY 281 12.846 -2.626 -6.407 1.00 0.00 N -ATOM 4385 H GLY 281 13.235 -1.725 -6.168 1.00 0.00 H -ATOM 4386 CA GLY 281 13.043 -3.123 -7.802 1.00 0.00 C -ATOM 4387 HA2 GLY 281 12.064 -3.485 -8.116 1.00 0.00 H -ATOM 4388 HA3 GLY 281 13.347 -2.311 -8.463 1.00 0.00 H -ATOM 4389 C GLY 281 14.056 -4.232 -7.967 1.00 0.00 C -ATOM 4390 O GLY 281 13.860 -5.146 -8.730 1.00 0.00 O -ATOM 4391 N ARG 282 15.218 -4.200 -7.217 1.00 0.00 N -ATOM 4392 H ARG 282 15.369 -3.358 -6.680 1.00 0.00 H -ATOM 4393 CA ARG 282 16.168 -5.323 -7.197 1.00 0.00 C -ATOM 4394 HA ARG 282 16.462 -5.448 -8.238 1.00 0.00 H -ATOM 4395 CB ARG 282 17.367 -5.022 -6.237 1.00 0.00 C -ATOM 4396 HB2 ARG 282 16.949 -4.584 -5.331 1.00 0.00 H -ATOM 4397 HB3 ARG 282 17.881 -5.973 -6.102 1.00 0.00 H -ATOM 4398 CG ARG 282 18.329 -3.957 -6.945 1.00 0.00 C -ATOM 4399 HG2 ARG 282 18.823 -4.504 -7.749 1.00 0.00 H -ATOM 4400 HG3 ARG 282 17.727 -3.206 -7.455 1.00 0.00 H -ATOM 4401 CD ARG 282 19.340 -3.394 -6.019 1.00 0.00 C -ATOM 4402 HD2 ARG 282 18.857 -2.593 -5.459 1.00 0.00 H -ATOM 4403 HD3 ARG 282 19.674 -4.189 -5.353 1.00 0.00 H -ATOM 4404 NE ARG 282 20.435 -2.713 -6.673 1.00 0.00 N -ATOM 4405 HE ARG 282 20.443 -2.767 -7.682 1.00 0.00 H -ATOM 4406 CZ ARG 282 21.402 -2.055 -6.045 1.00 0.00 C -ATOM 4407 NH1 ARG 282 21.579 -2.045 -4.788 1.00 0.00 N -ATOM 4408 HH11 ARG 282 20.979 -2.570 -4.167 1.00 0.00 H -ATOM 4409 HH12 ARG 282 22.335 -1.465 -4.457 1.00 0.00 H -ATOM 4410 NH2 ARG 282 22.393 -1.599 -6.752 1.00 0.00 N -ATOM 4411 HH21 ARG 282 22.390 -1.707 -7.756 1.00 0.00 H -ATOM 4412 HH22 ARG 282 23.261 -1.284 -6.345 1.00 0.00 H -ATOM 4413 C ARG 282 15.531 -6.615 -6.682 1.00 0.00 C -ATOM 4414 O ARG 282 15.774 -7.693 -7.210 1.00 0.00 O -ATOM 4415 N VAL 283 14.634 -6.462 -5.702 1.00 0.00 N -ATOM 4416 H VAL 283 14.541 -5.575 -5.229 1.00 0.00 H -ATOM 4417 CA VAL 283 13.777 -7.593 -5.176 1.00 0.00 C -ATOM 4418 HA VAL 283 14.350 -8.479 -4.903 1.00 0.00 H -ATOM 4419 CB VAL 283 13.029 -7.041 -3.897 1.00 0.00 C -ATOM 4420 HB VAL 283 12.587 -6.074 -4.138 1.00 0.00 H -ATOM 4421 CG1 VAL 283 11.890 -7.929 -3.401 1.00 0.00 C -ATOM 4422 HG11 VAL 283 11.581 -7.631 -2.399 1.00 0.00 H -ATOM 4423 HG12 VAL 283 10.972 -7.891 -3.989 1.00 0.00 H -ATOM 4424 HG13 VAL 283 12.168 -8.983 -3.438 1.00 0.00 H -ATOM 4425 CG2 VAL 283 13.999 -7.018 -2.735 1.00 0.00 C -ATOM 4426 HG21 VAL 283 13.547 -6.951 -1.745 1.00 0.00 H -ATOM 4427 HG22 VAL 283 14.573 -7.942 -2.671 1.00 0.00 H -ATOM 4428 HG23 VAL 283 14.622 -6.137 -2.886 1.00 0.00 H -ATOM 4429 C VAL 283 12.828 -8.103 -6.239 1.00 0.00 C -ATOM 4430 O VAL 283 12.837 -9.325 -6.546 1.00 0.00 O -ATOM 4431 N ILE 284 12.059 -7.287 -6.945 1.00 0.00 N -ATOM 4432 H ILE 284 11.994 -6.330 -6.628 1.00 0.00 H -ATOM 4433 CA ILE 284 11.120 -7.737 -7.999 1.00 0.00 C -ATOM 4434 HA ILE 284 10.520 -8.563 -7.619 1.00 0.00 H -ATOM 4435 CB ILE 284 10.071 -6.660 -8.225 1.00 0.00 C -ATOM 4436 HB ILE 284 10.627 -5.742 -8.413 1.00 0.00 H -ATOM 4437 CG2 ILE 284 9.256 -7.096 -9.495 1.00 0.00 C -ATOM 4438 HG21 ILE 284 8.353 -6.498 -9.617 1.00 0.00 H -ATOM 4439 HG22 ILE 284 9.767 -6.967 -10.449 1.00 0.00 H -ATOM 4440 HG23 ILE 284 8.918 -8.132 -9.504 1.00 0.00 H -ATOM 4441 CG1 ILE 284 9.168 -6.547 -6.944 1.00 0.00 C -ATOM 4442 HG12 ILE 284 8.480 -7.384 -6.820 1.00 0.00 H -ATOM 4443 HG13 ILE 284 9.801 -6.279 -6.099 1.00 0.00 H -ATOM 4444 CD1 ILE 284 8.235 -5.331 -7.016 1.00 0.00 C -ATOM 4445 HD11 ILE 284 7.364 -5.611 -7.607 1.00 0.00 H -ATOM 4446 HD12 ILE 284 7.857 -5.125 -6.014 1.00 0.00 H -ATOM 4447 HD13 ILE 284 8.824 -4.467 -7.324 1.00 0.00 H -ATOM 4448 C ILE 284 11.839 -8.389 -9.217 1.00 0.00 C -ATOM 4449 O ILE 284 11.343 -9.434 -9.725 1.00 0.00 O -ATOM 4450 N THR 285 13.087 -7.895 -9.522 1.00 0.00 N -ATOM 4451 H THR 285 13.407 -7.075 -9.030 1.00 0.00 H -ATOM 4452 CA THR 285 13.956 -8.385 -10.625 1.00 0.00 C -ATOM 4453 HA THR 285 13.465 -8.349 -11.598 1.00 0.00 H -ATOM 4454 CB THR 285 15.228 -7.516 -10.766 1.00 0.00 C -ATOM 4455 HB THR 285 15.818 -7.642 -9.858 1.00 0.00 H -ATOM 4456 CG2 THR 285 16.129 -7.729 -11.979 1.00 0.00 C -ATOM 4457 HG21 THR 285 16.763 -6.843 -12.017 1.00 0.00 H -ATOM 4458 HG22 THR 285 16.623 -8.697 -11.900 1.00 0.00 H -ATOM 4459 HG23 THR 285 15.608 -7.683 -12.936 1.00 0.00 H -ATOM 4460 OG1 THR 285 14.785 -6.206 -10.963 1.00 0.00 O -ATOM 4461 HG1 THR 285 14.357 -5.978 -10.134 1.00 0.00 H -ATOM 4462 C THR 285 14.358 -9.829 -10.306 1.00 0.00 C -ATOM 4463 O THR 285 14.447 -10.722 -11.187 1.00 0.00 O -ATOM 4464 N ALA 286 14.705 -10.082 -9.031 1.00 0.00 N -ATOM 4465 H ALA 286 14.908 -9.301 -8.424 1.00 0.00 H -ATOM 4466 CA ALA 286 15.165 -11.396 -8.597 1.00 0.00 C -ATOM 4467 HA ALA 286 15.922 -11.709 -9.315 1.00 0.00 H -ATOM 4468 CB ALA 286 15.964 -11.233 -7.276 1.00 0.00 C -ATOM 4469 HB1 ALA 286 15.321 -10.752 -6.540 1.00 0.00 H -ATOM 4470 HB2 ALA 286 16.393 -12.185 -6.960 1.00 0.00 H -ATOM 4471 HB3 ALA 286 16.894 -10.681 -7.415 1.00 0.00 H -ATOM 4472 C ALA 286 13.977 -12.493 -8.536 1.00 0.00 C -ATOM 4473 O ALA 286 14.111 -13.664 -8.794 1.00 0.00 O -ATOM 4474 N LEU 287 12.719 -12.069 -8.320 1.00 0.00 N -ATOM 4475 H LEU 287 12.609 -11.079 -8.161 1.00 0.00 H -ATOM 4476 CA LEU 287 11.524 -12.906 -8.173 1.00 0.00 C -ATOM 4477 HA LEU 287 11.836 -13.778 -7.599 1.00 0.00 H -ATOM 4478 CB LEU 287 10.477 -12.096 -7.345 1.00 0.00 C -ATOM 4479 HB2 LEU 287 10.433 -11.114 -7.815 1.00 0.00 H -ATOM 4480 HB3 LEU 287 9.528 -12.631 -7.323 1.00 0.00 H -ATOM 4481 CG LEU 287 10.919 -11.904 -5.880 1.00 0.00 C -ATOM 4482 HG LEU 287 11.923 -11.489 -5.790 1.00 0.00 H -ATOM 4483 CD1 LEU 287 10.077 -10.843 -5.200 1.00 0.00 C -ATOM 4484 HD11 LEU 287 9.993 -9.874 -5.691 1.00 0.00 H -ATOM 4485 HD12 LEU 287 9.070 -11.165 -4.937 1.00 0.00 H -ATOM 4486 HD13 LEU 287 10.549 -10.625 -4.242 1.00 0.00 H -ATOM 4487 CD2 LEU 287 10.763 -13.216 -5.029 1.00 0.00 C -ATOM 4488 HD21 LEU 287 11.540 -13.929 -5.306 1.00 0.00 H -ATOM 4489 HD22 LEU 287 10.897 -13.005 -3.968 1.00 0.00 H -ATOM 4490 HD23 LEU 287 9.779 -13.673 -5.132 1.00 0.00 H -ATOM 4491 C LEU 287 10.990 -13.370 -9.467 1.00 0.00 C -ATOM 4492 O LEU 287 10.650 -14.553 -9.657 1.00 0.00 O -ATOM 4493 N VAL 288 10.893 -12.417 -10.414 1.00 0.00 N -ATOM 4494 H VAL 288 11.144 -11.458 -10.224 1.00 0.00 H -ATOM 4495 CA VAL 288 10.559 -12.738 -11.886 1.00 0.00 C -ATOM 4496 HA VAL 288 9.657 -13.347 -11.818 1.00 0.00 H -ATOM 4497 CB VAL 288 10.254 -11.440 -12.651 1.00 0.00 C -ATOM 4498 HB VAL 288 9.619 -10.935 -11.922 1.00 0.00 H -ATOM 4499 CG1 VAL 288 11.527 -10.649 -12.875 1.00 0.00 C -ATOM 4500 HG11 VAL 288 12.231 -11.235 -13.467 1.00 0.00 H -ATOM 4501 HG12 VAL 288 11.223 -9.700 -13.317 1.00 0.00 H -ATOM 4502 HG13 VAL 288 12.082 -10.464 -11.956 1.00 0.00 H -ATOM 4503 CG2 VAL 288 9.578 -11.586 -13.982 1.00 0.00 C -ATOM 4504 HG21 VAL 288 8.660 -12.163 -13.866 1.00 0.00 H -ATOM 4505 HG22 VAL 288 9.308 -10.610 -14.385 1.00 0.00 H -ATOM 4506 HG23 VAL 288 10.295 -12.076 -14.640 1.00 0.00 H -ATOM 4507 C VAL 288 11.660 -13.574 -12.538 1.00 0.00 C -ATOM 4508 O VAL 288 11.422 -14.283 -13.527 1.00 0.00 O -ATOM 4509 N GLU 289 12.867 -13.546 -12.127 1.00 0.00 N -ATOM 4510 H GLU 289 13.018 -12.919 -11.351 1.00 0.00 H -ATOM 4511 CA GLU 289 14.017 -14.429 -12.412 1.00 0.00 C -ATOM 4512 HA GLU 289 14.002 -14.595 -13.490 1.00 0.00 H -ATOM 4513 CB GLU 289 15.337 -13.697 -12.252 1.00 0.00 C -ATOM 4514 HB2 GLU 289 15.348 -12.953 -13.048 1.00 0.00 H -ATOM 4515 HB3 GLU 289 15.328 -13.263 -11.253 1.00 0.00 H -ATOM 4516 CG GLU 289 16.672 -14.538 -12.393 1.00 0.00 C -ATOM 4517 HG2 GLU 289 17.520 -13.862 -12.283 1.00 0.00 H -ATOM 4518 HG3 GLU 289 16.762 -15.285 -11.605 1.00 0.00 H -ATOM 4519 CD GLU 289 16.749 -15.274 -13.708 1.00 0.00 C -ATOM 4520 OE1 GLU 289 16.204 -14.800 -14.705 1.00 0.00 O -ATOM 4521 OE2 GLU 289 17.550 -16.271 -13.899 1.00 0.00 O -ATOM 4522 C GLU 289 13.991 -15.745 -11.664 1.00 0.00 C -ATOM 4523 O GLU 289 14.737 -16.736 -11.977 1.00 0.00 O -ATOM 4524 N ARG 290 13.071 -15.782 -10.649 1.00 0.00 N -ATOM 4525 H ARG 290 12.597 -14.903 -10.499 1.00 0.00 H -ATOM 4526 CA ARG 290 12.652 -16.920 -9.919 1.00 0.00 C -ATOM 4527 HA ARG 290 11.899 -16.641 -9.183 1.00 0.00 H -ATOM 4528 CB ARG 290 11.854 -17.958 -10.795 1.00 0.00 C -ATOM 4529 HB2 ARG 290 12.497 -18.187 -11.644 1.00 0.00 H -ATOM 4530 HB3 ARG 290 11.691 -18.812 -10.138 1.00 0.00 H -ATOM 4531 CG ARG 290 10.464 -17.489 -11.168 1.00 0.00 C -ATOM 4532 HG2 ARG 290 9.815 -17.318 -10.309 1.00 0.00 H -ATOM 4533 HG3 ARG 290 10.584 -16.585 -11.766 1.00 0.00 H -ATOM 4534 CD ARG 290 9.686 -18.489 -11.898 1.00 0.00 C -ATOM 4535 HD2 ARG 290 10.126 -18.695 -12.873 1.00 0.00 H -ATOM 4536 HD3 ARG 290 9.605 -19.460 -11.410 1.00 0.00 H -ATOM 4537 NE ARG 290 8.303 -18.087 -12.086 1.00 0.00 N -ATOM 4538 HE ARG 290 7.873 -17.735 -11.241 1.00 0.00 H -ATOM 4539 CZ ARG 290 7.471 -18.507 -13.040 1.00 0.00 C -ATOM 4540 NH1 ARG 290 7.894 -19.263 -14.024 1.00 0.00 N -ATOM 4541 HH11 ARG 290 8.857 -19.558 -14.099 1.00 0.00 H -ATOM 4542 HH12 ARG 290 7.221 -19.469 -14.749 1.00 0.00 H -ATOM 4543 NH2 ARG 290 6.192 -18.062 -13.066 1.00 0.00 N -ATOM 4544 HH21 ARG 290 5.807 -17.447 -12.364 1.00 0.00 H -ATOM 4545 HH22 ARG 290 5.674 -18.235 -13.917 1.00 0.00 H -ATOM 4546 C ARG 290 13.853 -17.507 -9.091 1.00 0.00 C -ATOM 4547 O ARG 290 13.767 -18.575 -8.504 1.00 0.00 O -ATOM 4548 N THR 291 14.988 -16.828 -9.026 1.00 0.00 N -ATOM 4549 H THR 291 15.008 -15.918 -9.462 1.00 0.00 H -ATOM 4550 CA THR 291 16.134 -17.277 -8.236 1.00 0.00 C -ATOM 4551 HA THR 291 16.371 -18.312 -8.481 1.00 0.00 H -ATOM 4552 CB THR 291 17.339 -16.426 -8.605 1.00 0.00 C -ATOM 4553 HB THR 291 17.502 -16.649 -9.659 1.00 0.00 H -ATOM 4554 CG2 THR 291 17.312 -14.896 -8.420 1.00 0.00 C -ATOM 4555 HG21 THR 291 18.351 -14.635 -8.621 1.00 0.00 H -ATOM 4556 HG22 THR 291 16.596 -14.517 -9.150 1.00 0.00 H -ATOM 4557 HG23 THR 291 16.977 -14.658 -7.410 1.00 0.00 H -ATOM 4558 OG1 THR 291 18.540 -16.780 -7.888 1.00 0.00 O -ATOM 4559 HG1 THR 291 18.781 -17.702 -8.004 1.00 0.00 H -ATOM 4560 C THR 291 15.809 -17.250 -6.693 1.00 0.00 C -ATOM 4561 O THR 291 15.146 -16.325 -6.160 1.00 0.00 O -ATOM 4562 N PRO 292 16.372 -18.259 -5.886 1.00 0.00 N -ATOM 4563 CD PRO 292 17.290 -19.380 -6.140 1.00 0.00 C -ATOM 4564 HD2 PRO 292 18.215 -19.045 -6.609 1.00 0.00 H -ATOM 4565 HD3 PRO 292 16.706 -20.152 -6.642 1.00 0.00 H -ATOM 4566 CG PRO 292 17.597 -20.020 -4.797 1.00 0.00 C -ATOM 4567 HG2 PRO 292 18.619 -19.795 -4.497 1.00 0.00 H -ATOM 4568 HG3 PRO 292 17.484 -21.086 -4.991 1.00 0.00 H -ATOM 4569 CB PRO 292 16.600 -19.504 -3.849 1.00 0.00 C -ATOM 4570 HB2 PRO 292 17.152 -19.279 -2.938 1.00 0.00 H -ATOM 4571 HB3 PRO 292 15.791 -20.191 -3.598 1.00 0.00 H -ATOM 4572 CA PRO 292 16.165 -18.186 -4.441 1.00 0.00 C -ATOM 4573 HA PRO 292 15.107 -18.019 -4.238 1.00 0.00 H -ATOM 4574 C PRO 292 16.876 -16.978 -3.712 1.00 0.00 C -ATOM 4575 O PRO 292 16.470 -16.598 -2.614 1.00 0.00 O -ATOM 4576 N HIE 293 17.846 -16.353 -4.386 1.00 0.00 N -ATOM 4577 H HIE 293 17.973 -16.620 -5.352 1.00 0.00 H -ATOM 4578 CA HIE 293 18.704 -15.246 -3.806 1.00 0.00 C -ATOM 4579 HA HIE 293 18.583 -15.319 -2.725 1.00 0.00 H -ATOM 4580 CB HIE 293 20.082 -15.654 -4.193 1.00 0.00 C -ATOM 4581 HB2 HIE 293 20.068 -15.633 -5.283 1.00 0.00 H -ATOM 4582 HB3 HIE 293 20.695 -14.868 -3.755 1.00 0.00 H -ATOM 4583 CG HIE 293 20.542 -16.982 -3.645 1.00 0.00 C -ATOM 4584 ND1 HIE 293 20.804 -17.253 -2.328 1.00 0.00 N -ATOM 4585 CE1 HIE 293 21.168 -18.559 -2.328 1.00 0.00 C -ATOM 4586 HE1 HIE 293 21.296 -19.146 -1.430 1.00 0.00 H -ATOM 4587 NE2 HIE 293 21.171 -19.099 -3.571 1.00 0.00 N -ATOM 4588 HE2 HIE 293 21.351 -20.053 -3.849 1.00 0.00 H -ATOM 4589 CD2 HIE 293 20.797 -18.076 -4.386 1.00 0.00 C -ATOM 4590 HD2 HIE 293 20.649 -18.130 -5.455 1.00 0.00 H -ATOM 4591 C HIE 293 18.308 -13.835 -4.211 1.00 0.00 C -ATOM 4592 O HIE 293 18.434 -13.443 -5.349 1.00 0.00 O -ATOM 4593 N VAL 294 17.838 -13.160 -3.146 1.00 0.00 N -ATOM 4594 H VAL 294 17.938 -13.558 -2.223 1.00 0.00 H -ATOM 4595 CA VAL 294 17.100 -11.843 -3.235 1.00 0.00 C -ATOM 4596 HA VAL 294 17.315 -11.425 -4.218 1.00 0.00 H -ATOM 4597 CB VAL 294 15.608 -12.034 -3.125 1.00 0.00 C -ATOM 4598 HB VAL 294 15.364 -12.489 -2.165 1.00 0.00 H -ATOM 4599 CG1 VAL 294 14.794 -10.756 -3.370 1.00 0.00 C -ATOM 4600 HG11 VAL 294 14.925 -10.092 -2.515 1.00 0.00 H -ATOM 4601 HG12 VAL 294 15.125 -10.272 -4.288 1.00 0.00 H -ATOM 4602 HG13 VAL 294 13.723 -10.947 -3.440 1.00 0.00 H -ATOM 4603 CG2 VAL 294 15.066 -13.054 -4.088 1.00 0.00 C -ATOM 4604 HG21 VAL 294 15.345 -12.862 -5.123 1.00 0.00 H -ATOM 4605 HG22 VAL 294 15.360 -14.082 -3.877 1.00 0.00 H -ATOM 4606 HG23 VAL 294 13.977 -13.082 -4.033 1.00 0.00 H -ATOM 4607 C VAL 294 17.568 -10.855 -2.188 1.00 0.00 C -ATOM 4608 O VAL 294 17.640 -11.162 -1.020 1.00 0.00 O -ATOM 4609 N PRO 295 17.896 -9.588 -2.566 1.00 0.00 N -ATOM 4610 CD PRO 295 18.025 -9.093 -3.922 1.00 0.00 C -ATOM 4611 HD2 PRO 295 17.164 -9.236 -4.576 1.00 0.00 H -ATOM 4612 HD3 PRO 295 18.849 -9.534 -4.481 1.00 0.00 H -ATOM 4613 CG PRO 295 18.345 -7.637 -3.816 1.00 0.00 C -ATOM 4614 HG2 PRO 295 17.438 -7.072 -3.601 1.00 0.00 H -ATOM 4615 HG3 PRO 295 18.978 -7.162 -4.565 1.00 0.00 H -ATOM 4616 CB PRO 295 19.205 -7.659 -2.607 1.00 0.00 C -ATOM 4617 HB2 PRO 295 19.404 -6.648 -2.251 1.00 0.00 H -ATOM 4618 HB3 PRO 295 20.164 -8.144 -2.786 1.00 0.00 H -ATOM 4619 CA PRO 295 18.446 -8.563 -1.617 1.00 0.00 C -ATOM 4620 HA PRO 295 19.182 -9.018 -0.955 1.00 0.00 H -ATOM 4621 C PRO 295 17.370 -7.913 -0.673 1.00 0.00 C -ATOM 4622 O PRO 295 17.298 -6.695 -0.633 1.00 0.00 O -ATOM 4623 N TYR 296 16.578 -8.694 0.034 1.00 0.00 N -ATOM 4624 H TYR 296 16.690 -9.656 -0.251 1.00 0.00 H -ATOM 4625 CA TYR 296 15.646 -8.149 1.011 1.00 0.00 C -ATOM 4626 HA TYR 296 14.948 -7.459 0.537 1.00 0.00 H -ATOM 4627 CB TYR 296 14.940 -9.332 1.640 1.00 0.00 C -ATOM 4628 HB2 TYR 296 15.649 -9.875 2.264 1.00 0.00 H -ATOM 4629 HB3 TYR 296 14.179 -8.987 2.341 1.00 0.00 H -ATOM 4630 CG TYR 296 14.138 -10.186 0.661 1.00 0.00 C -ATOM 4631 CD1 TYR 296 13.004 -9.633 0.048 1.00 0.00 C -ATOM 4632 HD1 TYR 296 12.796 -8.582 0.188 1.00 0.00 H -ATOM 4633 CE1 TYR 296 12.106 -10.476 -0.676 1.00 0.00 C -ATOM 4634 HE1 TYR 296 11.111 -10.159 -0.952 1.00 0.00 H -ATOM 4635 CZ TYR 296 12.483 -11.819 -0.850 1.00 0.00 C -ATOM 4636 OH TYR 296 11.586 -12.656 -1.388 1.00 0.00 O -ATOM 4637 HH TYR 296 10.719 -12.255 -1.480 1.00 0.00 H -ATOM 4638 CE2 TYR 296 13.671 -12.327 -0.319 1.00 0.00 C -ATOM 4639 HE2 TYR 296 13.877 -13.384 -0.411 1.00 0.00 H -ATOM 4640 CD2 TYR 296 14.532 -11.475 0.372 1.00 0.00 C -ATOM 4641 HD2 TYR 296 15.366 -11.848 0.948 1.00 0.00 H -ATOM 4642 C TYR 296 16.207 -7.230 2.127 1.00 0.00 C -ATOM 4643 O TYR 296 15.627 -6.263 2.474 1.00 0.00 O -ATOM 4644 N ARG 297 17.416 -7.550 2.651 1.00 0.00 N -ATOM 4645 H ARG 297 17.945 -8.377 2.414 1.00 0.00 H -ATOM 4646 CA ARG 297 17.872 -6.835 3.912 1.00 0.00 C -ATOM 4647 HA ARG 297 17.084 -6.857 4.664 1.00 0.00 H -ATOM 4648 CB ARG 297 19.037 -7.625 4.584 1.00 0.00 C -ATOM 4649 HB2 ARG 297 19.358 -7.215 5.541 1.00 0.00 H -ATOM 4650 HB3 ARG 297 18.607 -8.624 4.658 1.00 0.00 H -ATOM 4651 CG ARG 297 20.314 -7.668 3.787 1.00 0.00 C -ATOM 4652 HG2 ARG 297 20.160 -8.192 2.843 1.00 0.00 H -ATOM 4653 HG3 ARG 297 20.629 -6.639 3.613 1.00 0.00 H -ATOM 4654 CD ARG 297 21.330 -8.527 4.549 1.00 0.00 C -ATOM 4655 HD2 ARG 297 21.502 -7.923 5.439 1.00 0.00 H -ATOM 4656 HD3 ARG 297 20.904 -9.515 4.728 1.00 0.00 H -ATOM 4657 NE ARG 297 22.575 -8.651 3.770 1.00 0.00 N -ATOM 4658 HE ARG 297 22.757 -7.968 3.048 1.00 0.00 H -ATOM 4659 CZ ARG 297 23.532 -9.503 3.947 1.00 0.00 C -ATOM 4660 NH1 ARG 297 23.382 -10.546 4.681 1.00 0.00 N -ATOM 4661 HH11 ARG 297 22.414 -10.802 4.816 1.00 0.00 H -ATOM 4662 HH12 ARG 297 24.140 -11.207 4.774 1.00 0.00 H -ATOM 4663 NH2 ARG 297 24.642 -9.220 3.336 1.00 0.00 N -ATOM 4664 HH21 ARG 297 24.701 -8.355 2.818 1.00 0.00 H -ATOM 4665 HH22 ARG 297 25.411 -9.853 3.505 1.00 0.00 H -ATOM 4666 C ARG 297 18.309 -5.335 3.724 1.00 0.00 C -ATOM 4667 O ARG 297 18.473 -4.576 4.649 1.00 0.00 O -ATOM 4668 N GLU 298 18.586 -5.002 2.442 1.00 0.00 N -ATOM 4669 H GLU 298 18.334 -5.644 1.705 1.00 0.00 H -ATOM 4670 CA GLU 298 19.439 -3.817 2.142 1.00 0.00 C -ATOM 4671 HA GLU 298 20.281 -3.770 2.833 1.00 0.00 H -ATOM 4672 CB GLU 298 19.923 -3.911 0.647 1.00 0.00 C -ATOM 4673 HB2 GLU 298 19.081 -3.937 -0.044 1.00 0.00 H -ATOM 4674 HB3 GLU 298 20.504 -3.007 0.464 1.00 0.00 H -ATOM 4675 CG GLU 298 20.649 -5.211 0.403 1.00 0.00 C -ATOM 4676 HG2 GLU 298 20.026 -6.089 0.572 1.00 0.00 H -ATOM 4677 HG3 GLU 298 20.772 -5.300 -0.677 1.00 0.00 H -ATOM 4678 CD GLU 298 21.934 -5.420 1.187 1.00 0.00 C -ATOM 4679 OE1 GLU 298 22.647 -4.463 1.502 1.00 0.00 O -ATOM 4680 OE2 GLU 298 22.414 -6.587 1.400 1.00 0.00 O -ATOM 4681 C GLU 298 18.634 -2.555 2.326 1.00 0.00 C -ATOM 4682 O GLU 298 19.137 -1.424 2.152 1.00 0.00 O -ATOM 4683 N SER 299 17.295 -2.698 2.512 1.00 0.00 N -ATOM 4684 H SER 299 16.890 -3.598 2.291 1.00 0.00 H -ATOM 4685 CA SER 299 16.386 -1.631 2.914 1.00 0.00 C -ATOM 4686 HA SER 299 16.965 -0.780 3.273 1.00 0.00 H -ATOM 4687 CB SER 299 15.657 -1.082 1.617 1.00 0.00 C -ATOM 4688 HB2 SER 299 16.371 -0.539 0.999 1.00 0.00 H -ATOM 4689 HB3 SER 299 15.229 -1.945 1.105 1.00 0.00 H -ATOM 4690 OG SER 299 14.663 -0.095 1.926 1.00 0.00 O -ATOM 4691 HG SER 299 15.166 0.675 2.196 1.00 0.00 H -ATOM 4692 C SER 299 15.412 -2.105 3.975 1.00 0.00 C -ATOM 4693 O SER 299 14.731 -3.139 3.865 1.00 0.00 O -ATOM 4694 N LYS 300 15.061 -1.188 4.895 1.00 0.00 N -ATOM 4695 H LYS 300 15.399 -0.244 4.768 1.00 0.00 H -ATOM 4696 CA LYS 300 14.009 -1.375 5.925 1.00 0.00 C -ATOM 4697 HA LYS 300 14.318 -2.250 6.494 1.00 0.00 H -ATOM 4698 CB LYS 300 13.919 -0.176 6.918 1.00 0.00 C -ATOM 4699 HB2 LYS 300 13.576 0.657 6.303 1.00 0.00 H -ATOM 4700 HB3 LYS 300 13.204 -0.542 7.654 1.00 0.00 H -ATOM 4701 CG LYS 300 15.172 0.323 7.669 1.00 0.00 C -ATOM 4702 HG2 LYS 300 15.964 0.596 6.973 1.00 0.00 H -ATOM 4703 HG3 LYS 300 14.898 1.282 8.108 1.00 0.00 H -ATOM 4704 CD LYS 300 15.724 -0.653 8.720 1.00 0.00 C -ATOM 4705 HD2 LYS 300 15.219 -0.518 9.677 1.00 0.00 H -ATOM 4706 HD3 LYS 300 15.617 -1.678 8.367 1.00 0.00 H -ATOM 4707 CE LYS 300 17.227 -0.510 8.945 1.00 0.00 C -ATOM 4708 HE2 LYS 300 17.621 -1.190 9.700 1.00 0.00 H -ATOM 4709 HE3 LYS 300 17.696 -0.755 7.991 1.00 0.00 H -ATOM 4710 NZ LYS 300 17.657 0.888 9.310 1.00 0.00 N -ATOM 4711 HZ1 LYS 300 17.540 1.055 10.298 1.00 0.00 H -ATOM 4712 HZ2 LYS 300 18.646 1.084 9.274 1.00 0.00 H -ATOM 4713 HZ3 LYS 300 17.170 1.666 8.889 1.00 0.00 H -ATOM 4714 C LYS 300 12.658 -1.690 5.312 1.00 0.00 C -ATOM 4715 O LYS 300 11.938 -2.563 5.847 1.00 0.00 O -ATOM 4716 N LEU 301 12.434 -1.157 4.111 1.00 0.00 N -ATOM 4717 H LEU 301 12.979 -0.322 3.959 1.00 0.00 H -ATOM 4718 CA LEU 301 11.234 -1.280 3.266 1.00 0.00 C -ATOM 4719 HA LEU 301 10.369 -1.062 3.891 1.00 0.00 H -ATOM 4720 CB LEU 301 11.248 -0.277 2.043 1.00 0.00 C -ATOM 4721 HB2 LEU 301 11.668 0.705 2.259 1.00 0.00 H -ATOM 4722 HB3 LEU 301 11.851 -0.745 1.265 1.00 0.00 H -ATOM 4723 CG LEU 301 9.857 -0.197 1.400 1.00 0.00 C -ATOM 4724 HG LEU 301 9.430 -1.190 1.263 1.00 0.00 H -ATOM 4725 CD1 LEU 301 8.939 0.658 2.191 1.00 0.00 C -ATOM 4726 HD11 LEU 301 8.746 0.109 3.111 1.00 0.00 H -ATOM 4727 HD12 LEU 301 9.309 1.674 2.330 1.00 0.00 H -ATOM 4728 HD13 LEU 301 8.006 0.584 1.633 1.00 0.00 H -ATOM 4729 CD2 LEU 301 9.859 0.436 0.008 1.00 0.00 C -ATOM 4730 HD21 LEU 301 10.528 -0.065 -0.690 1.00 0.00 H -ATOM 4731 HD22 LEU 301 8.866 0.330 -0.427 1.00 0.00 H -ATOM 4732 HD23 LEU 301 10.106 1.495 0.098 1.00 0.00 H -ATOM 4733 C LEU 301 11.077 -2.690 2.850 1.00 0.00 C -ATOM 4734 O LEU 301 10.031 -3.320 2.906 1.00 0.00 O -ATOM 4735 N THR 302 12.154 -3.225 2.209 1.00 0.00 N -ATOM 4736 H THR 302 12.984 -2.658 2.113 1.00 0.00 H -ATOM 4737 CA THR 302 12.243 -4.632 1.788 1.00 0.00 C -ATOM 4738 HA THR 302 11.300 -4.904 1.312 1.00 0.00 H -ATOM 4739 CB THR 302 13.257 -4.744 0.618 1.00 0.00 C -ATOM 4740 HB THR 302 13.348 -5.811 0.416 1.00 0.00 H -ATOM 4741 CG2 THR 302 12.734 -3.910 -0.562 1.00 0.00 C -ATOM 4742 HG21 THR 302 12.959 -4.423 -1.496 1.00 0.00 H -ATOM 4743 HG22 THR 302 11.652 -3.956 -0.439 1.00 0.00 H -ATOM 4744 HG23 THR 302 13.106 -2.893 -0.678 1.00 0.00 H -ATOM 4745 OG1 THR 302 14.497 -4.176 0.983 1.00 0.00 O -ATOM 4746 HG1 THR 302 14.739 -4.639 1.789 1.00 0.00 H -ATOM 4747 C THR 302 12.497 -5.548 2.921 1.00 0.00 C -ATOM 4748 O THR 302 12.228 -6.727 2.689 1.00 0.00 O -ATOM 4749 N ARG 303 12.855 -5.134 4.135 1.00 0.00 N -ATOM 4750 H ARG 303 13.122 -4.167 4.250 1.00 0.00 H -ATOM 4751 CA ARG 303 12.653 -5.998 5.337 1.00 0.00 C -ATOM 4752 HA ARG 303 12.987 -7.004 5.082 1.00 0.00 H -ATOM 4753 CB ARG 303 13.585 -5.659 6.473 1.00 0.00 C -ATOM 4754 HB2 ARG 303 13.410 -4.680 6.917 1.00 0.00 H -ATOM 4755 HB3 ARG 303 13.384 -6.472 7.171 1.00 0.00 H -ATOM 4756 CG ARG 303 14.997 -5.729 5.977 1.00 0.00 C -ATOM 4757 HG2 ARG 303 15.284 -6.741 5.693 1.00 0.00 H -ATOM 4758 HG3 ARG 303 15.083 -5.132 5.069 1.00 0.00 H -ATOM 4759 CD ARG 303 15.960 -5.061 6.938 1.00 0.00 C -ATOM 4760 HD2 ARG 303 16.890 -5.043 6.370 1.00 0.00 H -ATOM 4761 HD3 ARG 303 15.541 -4.064 7.077 1.00 0.00 H -ATOM 4762 NE ARG 303 16.056 -5.747 8.201 1.00 0.00 N -ATOM 4763 HE ARG 303 15.590 -6.617 8.416 1.00 0.00 H -ATOM 4764 CZ ARG 303 16.827 -5.326 9.208 1.00 0.00 C -ATOM 4765 NH1 ARG 303 17.494 -4.190 9.125 1.00 0.00 N -ATOM 4766 HH11 ARG 303 17.482 -3.710 8.237 1.00 0.00 H -ATOM 4767 HH12 ARG 303 18.234 -3.999 9.784 1.00 0.00 H -ATOM 4768 NH2 ARG 303 17.046 -6.037 10.296 1.00 0.00 N -ATOM 4769 HH21 ARG 303 16.799 -7.017 10.288 1.00 0.00 H -ATOM 4770 HH22 ARG 303 17.659 -5.756 11.048 1.00 0.00 H -ATOM 4771 C ARG 303 11.176 -6.120 5.874 1.00 0.00 C -ATOM 4772 O ARG 303 10.714 -7.237 6.063 1.00 0.00 O -ATOM 4773 N ILE 304 10.398 -5.043 6.098 1.00 0.00 N -ATOM 4774 H ILE 304 10.901 -4.172 6.194 1.00 0.00 H -ATOM 4775 CA ILE 304 8.913 -5.082 6.184 1.00 0.00 C -ATOM 4776 HA ILE 304 8.636 -5.597 7.103 1.00 0.00 H -ATOM 4777 CB ILE 304 8.391 -3.633 6.258 1.00 0.00 C -ATOM 4778 HB ILE 304 8.901 -2.967 5.563 1.00 0.00 H -ATOM 4779 CG2 ILE 304 6.894 -3.488 6.178 1.00 0.00 C -ATOM 4780 HG21 ILE 304 6.408 -3.831 5.265 1.00 0.00 H -ATOM 4781 HG22 ILE 304 6.480 -4.082 6.993 1.00 0.00 H -ATOM 4782 HG23 ILE 304 6.561 -2.463 6.342 1.00 0.00 H -ATOM 4783 CG1 ILE 304 8.889 -3.163 7.707 1.00 0.00 C -ATOM 4784 HG12 ILE 304 8.401 -3.864 8.384 1.00 0.00 H -ATOM 4785 HG13 ILE 304 9.967 -3.242 7.847 1.00 0.00 H -ATOM 4786 CD1 ILE 304 8.425 -1.765 8.239 1.00 0.00 C -ATOM 4787 HD11 ILE 304 7.366 -1.506 8.218 1.00 0.00 H -ATOM 4788 HD12 ILE 304 8.709 -1.546 9.269 1.00 0.00 H -ATOM 4789 HD13 ILE 304 8.905 -1.003 7.625 1.00 0.00 H -ATOM 4790 C ILE 304 8.136 -5.831 5.091 1.00 0.00 C -ATOM 4791 O ILE 304 7.152 -6.458 5.231 1.00 0.00 O -ATOM 4792 N LEU 305 8.600 -5.697 3.858 1.00 0.00 N -ATOM 4793 H LEU 305 9.367 -5.088 3.613 1.00 0.00 H -ATOM 4794 CA LEU 305 7.862 -6.276 2.696 1.00 0.00 C -ATOM 4795 HA LEU 305 6.876 -6.566 3.057 1.00 0.00 H -ATOM 4796 CB LEU 305 7.670 -5.201 1.594 1.00 0.00 C -ATOM 4797 HB2 LEU 305 8.691 -4.855 1.435 1.00 0.00 H -ATOM 4798 HB3 LEU 305 7.337 -5.616 0.642 1.00 0.00 H -ATOM 4799 CG LEU 305 6.805 -4.011 1.955 1.00 0.00 C -ATOM 4800 HG LEU 305 7.147 -3.482 2.844 1.00 0.00 H -ATOM 4801 CD1 LEU 305 6.877 -3.007 0.833 1.00 0.00 C -ATOM 4802 HD11 LEU 305 6.563 -2.012 1.146 1.00 0.00 H -ATOM 4803 HD12 LEU 305 7.886 -2.799 0.479 1.00 0.00 H -ATOM 4804 HD13 LEU 305 6.293 -3.418 0.010 1.00 0.00 H -ATOM 4805 CD2 LEU 305 5.357 -4.446 2.073 1.00 0.00 C -ATOM 4806 HD21 LEU 305 4.788 -3.612 2.483 1.00 0.00 H -ATOM 4807 HD22 LEU 305 4.885 -4.784 1.150 1.00 0.00 H -ATOM 4808 HD23 LEU 305 5.069 -5.305 2.680 1.00 0.00 H -ATOM 4809 C LEU 305 8.412 -7.633 2.143 1.00 0.00 C -ATOM 4810 O LEU 305 7.759 -8.261 1.280 1.00 0.00 O -ATOM 4811 N GLN 306 9.461 -8.184 2.744 1.00 0.00 N -ATOM 4812 H GLN 306 9.808 -7.660 3.535 1.00 0.00 H -ATOM 4813 CA GLN 306 10.041 -9.454 2.449 1.00 0.00 C -ATOM 4814 HA GLN 306 10.491 -9.409 1.457 1.00 0.00 H -ATOM 4815 CB GLN 306 11.119 -9.829 3.517 1.00 0.00 C -ATOM 4816 HB2 GLN 306 11.846 -9.016 3.497 1.00 0.00 H -ATOM 4817 HB3 GLN 306 10.768 -9.879 4.548 1.00 0.00 H -ATOM 4818 CG GLN 306 11.903 -11.203 3.315 1.00 0.00 C -ATOM 4819 HG2 GLN 306 11.234 -12.014 3.602 1.00 0.00 H -ATOM 4820 HG3 GLN 306 12.144 -11.289 2.256 1.00 0.00 H -ATOM 4821 CD GLN 306 13.099 -11.313 4.195 1.00 0.00 C -ATOM 4822 OE1 GLN 306 14.137 -11.805 3.692 1.00 0.00 O -ATOM 4823 NE2 GLN 306 13.050 -11.003 5.477 1.00 0.00 N -ATOM 4824 HE21 GLN 306 13.772 -11.325 6.106 1.00 0.00 H -ATOM 4825 HE22 GLN 306 12.154 -10.742 5.863 1.00 0.00 H -ATOM 4826 C GLN 306 9.052 -10.579 2.419 1.00 0.00 C -ATOM 4827 O GLN 306 9.062 -11.290 1.411 1.00 0.00 O -ATOM 4828 N ASP 307 8.148 -10.704 3.369 1.00 0.00 N -ATOM 4829 H ASP 307 8.236 -10.140 4.202 1.00 0.00 H -ATOM 4830 CA ASP 307 7.049 -11.696 3.280 1.00 0.00 C -ATOM 4831 HA ASP 307 7.505 -12.595 2.861 1.00 0.00 H -ATOM 4832 CB ASP 307 6.431 -12.021 4.662 1.00 0.00 C -ATOM 4833 HB2 ASP 307 7.250 -11.916 5.374 1.00 0.00 H -ATOM 4834 HB3 ASP 307 5.767 -11.209 4.957 1.00 0.00 H -ATOM 4835 CG ASP 307 5.829 -13.422 4.748 1.00 0.00 C -ATOM 4836 OD1 ASP 307 6.366 -14.368 4.204 1.00 0.00 O -ATOM 4837 OD2 ASP 307 4.746 -13.536 5.378 1.00 0.00 O -ATOM 4838 C ASP 307 5.928 -11.512 2.200 1.00 0.00 C -ATOM 4839 O ASP 307 5.165 -12.496 1.892 1.00 0.00 O -ATOM 4840 N SER 308 5.732 -10.291 1.760 1.00 0.00 N -ATOM 4841 H SER 308 6.281 -9.525 2.122 1.00 0.00 H -ATOM 4842 CA SER 308 4.620 -9.968 0.739 1.00 0.00 C -ATOM 4843 HA SER 308 3.706 -10.516 0.972 1.00 0.00 H -ATOM 4844 CB SER 308 4.434 -8.459 0.916 1.00 0.00 C -ATOM 4845 HB2 SER 308 5.403 -8.004 0.709 1.00 0.00 H -ATOM 4846 HB3 SER 308 3.687 -8.082 0.217 1.00 0.00 H -ATOM 4847 OG SER 308 3.972 -8.051 2.182 1.00 0.00 O -ATOM 4848 HG SER 308 4.650 -8.348 2.794 1.00 0.00 H -ATOM 4849 C SER 308 5.125 -10.212 -0.672 1.00 0.00 C -ATOM 4850 O SER 308 4.435 -10.753 -1.514 1.00 0.00 O -ATOM 4851 N LEU 309 6.373 -9.846 -0.862 1.00 0.00 N -ATOM 4852 H LEU 309 6.918 -9.482 -0.094 1.00 0.00 H -ATOM 4853 CA LEU 309 7.158 -9.973 -2.056 1.00 0.00 C -ATOM 4854 HA LEU 309 6.543 -9.812 -2.943 1.00 0.00 H -ATOM 4855 CB LEU 309 8.239 -8.859 -1.969 1.00 0.00 C -ATOM 4856 HB2 LEU 309 8.702 -8.916 -0.983 1.00 0.00 H -ATOM 4857 HB3 LEU 309 9.090 -8.961 -2.642 1.00 0.00 H -ATOM 4858 CG LEU 309 7.685 -7.469 -2.248 1.00 0.00 C -ATOM 4859 HG LEU 309 7.010 -7.204 -1.433 1.00 0.00 H -ATOM 4860 CD1 LEU 309 8.844 -6.456 -2.207 1.00 0.00 C -ATOM 4861 HD11 LEU 309 9.397 -6.672 -1.294 1.00 0.00 H -ATOM 4862 HD12 LEU 309 9.455 -6.521 -3.107 1.00 0.00 H -ATOM 4863 HD13 LEU 309 8.465 -5.439 -2.101 1.00 0.00 H -ATOM 4864 CD2 LEU 309 6.844 -7.194 -3.488 1.00 0.00 C -ATOM 4865 HD21 LEU 309 5.922 -7.774 -3.433 1.00 0.00 H -ATOM 4866 HD22 LEU 309 6.709 -6.117 -3.400 1.00 0.00 H -ATOM 4867 HD23 LEU 309 7.347 -7.393 -4.434 1.00 0.00 H -ATOM 4868 C LEU 309 7.802 -11.376 -2.204 1.00 0.00 C -ATOM 4869 O LEU 309 9.025 -11.541 -2.070 1.00 0.00 O -ATOM 4870 N GLY 310 6.905 -12.376 -2.524 1.00 0.00 N -ATOM 4871 H GLY 310 5.942 -12.070 -2.505 1.00 0.00 H -ATOM 4872 CA GLY 310 7.197 -13.783 -2.754 1.00 0.00 C -ATOM 4873 HA2 GLY 310 6.371 -14.180 -3.345 1.00 0.00 H -ATOM 4874 HA3 GLY 310 8.186 -13.838 -3.209 1.00 0.00 H -ATOM 4875 C GLY 310 7.327 -14.779 -1.602 1.00 0.00 C -ATOM 4876 O GLY 310 7.476 -15.996 -1.807 1.00 0.00 O -ATOM 4877 N GLY 311 7.277 -14.300 -0.369 1.00 0.00 N -ATOM 4878 H GLY 311 7.412 -13.312 -0.211 1.00 0.00 H -ATOM 4879 CA GLY 311 6.931 -15.053 0.811 1.00 0.00 C -ATOM 4880 HA2 GLY 311 7.569 -15.936 0.852 1.00 0.00 H -ATOM 4881 HA3 GLY 311 7.276 -14.481 1.674 1.00 0.00 H -ATOM 4882 C GLY 311 5.484 -15.448 0.961 1.00 0.00 C -ATOM 4883 O GLY 311 4.850 -15.720 -0.009 1.00 0.00 O -ATOM 4884 N ARG 312 5.040 -15.729 2.174 1.00 0.00 N -ATOM 4885 H ARG 312 5.656 -15.368 2.889 1.00 0.00 H -ATOM 4886 CA ARG 312 3.760 -16.396 2.567 1.00 0.00 C -ATOM 4887 HA ARG 312 3.553 -17.174 1.833 1.00 0.00 H -ATOM 4888 CB ARG 312 3.762 -17.028 3.985 1.00 0.00 C -ATOM 4889 HB2 ARG 312 4.045 -16.230 4.670 1.00 0.00 H -ATOM 4890 HB3 ARG 312 2.776 -17.403 4.259 1.00 0.00 H -ATOM 4891 CG ARG 312 4.667 -18.238 4.263 1.00 0.00 C -ATOM 4892 HG2 ARG 312 5.661 -17.814 4.126 1.00 0.00 H -ATOM 4893 HG3 ARG 312 4.606 -18.496 5.319 1.00 0.00 H -ATOM 4894 CD ARG 312 4.325 -19.443 3.386 1.00 0.00 C -ATOM 4895 HD2 ARG 312 3.259 -19.656 3.464 1.00 0.00 H -ATOM 4896 HD3 ARG 312 4.583 -19.236 2.348 1.00 0.00 H -ATOM 4897 NE ARG 312 5.011 -20.684 3.816 1.00 0.00 N -ATOM 4898 HE ARG 312 5.615 -20.681 4.624 1.00 0.00 H -ATOM 4899 CZ ARG 312 4.772 -21.836 3.338 1.00 0.00 C -ATOM 4900 NH1 ARG 312 4.028 -22.093 2.333 1.00 0.00 N -ATOM 4901 HH11 ARG 312 3.576 -21.324 1.860 1.00 0.00 H -ATOM 4902 HH12 ARG 312 4.080 -23.043 1.993 1.00 0.00 H -ATOM 4903 NH2 ARG 312 5.299 -22.880 3.915 1.00 0.00 N -ATOM 4904 HH21 ARG 312 5.921 -22.782 4.705 1.00 0.00 H -ATOM 4905 HH22 ARG 312 5.276 -23.798 3.493 1.00 0.00 H -ATOM 4906 C ARG 312 2.582 -15.476 2.504 1.00 0.00 C -ATOM 4907 O ARG 312 1.548 -15.908 1.983 1.00 0.00 O -ATOM 4908 N THR 313 2.694 -14.191 2.755 1.00 0.00 N -ATOM 4909 H THR 313 3.637 -13.838 2.832 1.00 0.00 H -ATOM 4910 CA THR 313 1.526 -13.357 2.893 1.00 0.00 C -ATOM 4911 HA THR 313 0.666 -13.797 3.399 1.00 0.00 H -ATOM 4912 CB THR 313 2.014 -12.223 3.793 1.00 0.00 C -ATOM 4913 HB THR 313 2.893 -11.800 3.307 1.00 0.00 H -ATOM 4914 CG2 THR 313 1.260 -10.923 3.855 1.00 0.00 C -ATOM 4915 HG21 THR 313 2.004 -10.284 4.328 1.00 0.00 H -ATOM 4916 HG22 THR 313 0.917 -10.533 2.897 1.00 0.00 H -ATOM 4917 HG23 THR 313 0.529 -11.016 4.658 1.00 0.00 H -ATOM 4918 OG1 THR 313 2.230 -12.723 5.108 1.00 0.00 O -ATOM 4919 HG1 THR 313 3.099 -13.132 5.127 1.00 0.00 H -ATOM 4920 C THR 313 1.072 -12.878 1.482 1.00 0.00 C -ATOM 4921 O THR 313 1.819 -12.281 0.734 1.00 0.00 O -ATOM 4922 N ARG 314 -0.220 -13.226 1.181 1.00 0.00 N -ATOM 4923 H ARG 314 -0.744 -13.544 1.984 1.00 0.00 H -ATOM 4924 CA ARG 314 -0.946 -13.035 -0.085 1.00 0.00 C -ATOM 4925 HA ARG 314 -0.382 -13.338 -0.966 1.00 0.00 H -ATOM 4926 CB ARG 314 -2.303 -13.737 -0.001 1.00 0.00 C -ATOM 4927 HB2 ARG 314 -2.758 -13.377 0.921 1.00 0.00 H -ATOM 4928 HB3 ARG 314 -2.932 -13.582 -0.877 1.00 0.00 H -ATOM 4929 CG ARG 314 -2.175 -15.301 0.152 1.00 0.00 C -ATOM 4930 HG2 ARG 314 -1.589 -15.653 -0.698 1.00 0.00 H -ATOM 4931 HG3 ARG 314 -1.626 -15.519 1.069 1.00 0.00 H -ATOM 4932 CD ARG 314 -3.569 -15.939 0.143 1.00 0.00 C -ATOM 4933 HD2 ARG 314 -3.752 -15.871 1.216 1.00 0.00 H -ATOM 4934 HD3 ARG 314 -4.228 -15.369 -0.511 1.00 0.00 H -ATOM 4935 NE ARG 314 -3.670 -17.323 -0.289 1.00 0.00 N -ATOM 4936 HE ARG 314 -2.799 -17.764 -0.548 1.00 0.00 H -ATOM 4937 CZ ARG 314 -4.715 -18.078 -0.229 1.00 0.00 C -ATOM 4938 NH1 ARG 314 -5.906 -17.681 0.165 1.00 0.00 N -ATOM 4939 HH11 ARG 314 -6.048 -16.682 0.165 1.00 0.00 H -ATOM 4940 HH12 ARG 314 -6.674 -18.334 0.235 1.00 0.00 H -ATOM 4941 NH2 ARG 314 -4.524 -19.327 -0.555 1.00 0.00 N -ATOM 4942 HH21 ARG 314 -3.619 -19.754 -0.417 1.00 0.00 H -ATOM 4943 HH22 ARG 314 -5.300 -19.952 -0.390 1.00 0.00 H -ATOM 4944 C ARG 314 -1.050 -11.497 -0.250 1.00 0.00 C -ATOM 4945 O ARG 314 -1.392 -10.730 0.636 1.00 0.00 O -ATOM 4946 N THR 315 -0.675 -11.076 -1.447 1.00 0.00 N -ATOM 4947 H THR 315 -0.368 -11.775 -2.109 1.00 0.00 H -ATOM 4948 CA THR 315 -0.436 -9.702 -1.693 1.00 0.00 C -ATOM 4949 HA THR 315 -0.814 -9.127 -0.849 1.00 0.00 H -ATOM 4950 CB THR 315 1.088 -9.386 -1.683 1.00 0.00 C -ATOM 4951 HB THR 315 1.538 -10.066 -2.406 1.00 0.00 H -ATOM 4952 CG2 THR 315 1.419 -7.934 -2.017 1.00 0.00 C -ATOM 4953 HG21 THR 315 2.423 -7.700 -1.662 1.00 0.00 H -ATOM 4954 HG22 THR 315 1.377 -7.967 -3.105 1.00 0.00 H -ATOM 4955 HG23 THR 315 0.650 -7.298 -1.579 1.00 0.00 H -ATOM 4956 OG1 THR 315 1.541 -9.661 -0.371 1.00 0.00 O -ATOM 4957 HG1 THR 315 1.906 -10.544 -0.287 1.00 0.00 H -ATOM 4958 C THR 315 -1.175 -9.118 -2.898 1.00 0.00 C -ATOM 4959 O THR 315 -1.159 -9.624 -4.034 1.00 0.00 O -ATOM 4960 N SER 316 -1.809 -7.967 -2.676 1.00 0.00 N -ATOM 4961 H SER 316 -1.844 -7.559 -1.753 1.00 0.00 H -ATOM 4962 CA SER 316 -2.466 -7.183 -3.703 1.00 0.00 C -ATOM 4963 HA SER 316 -2.426 -7.783 -4.612 1.00 0.00 H -ATOM 4964 CB SER 316 -3.987 -7.008 -3.422 1.00 0.00 C -ATOM 4965 HB2 SER 316 -4.388 -7.996 -3.195 1.00 0.00 H -ATOM 4966 HB3 SER 316 -4.182 -6.341 -2.583 1.00 0.00 H -ATOM 4967 OG SER 316 -4.567 -6.540 -4.605 1.00 0.00 O -ATOM 4968 HG SER 316 -5.464 -6.870 -4.689 1.00 0.00 H -ATOM 4969 C SER 316 -1.646 -5.913 -4.060 1.00 0.00 C -ATOM 4970 O SER 316 -1.444 -5.042 -3.243 1.00 0.00 O -ATOM 4971 N ILE 317 -1.380 -5.752 -5.332 1.00 0.00 N -ATOM 4972 H ILE 317 -1.816 -6.379 -5.994 1.00 0.00 H -ATOM 4973 CA ILE 317 -0.583 -4.606 -5.932 1.00 0.00 C -ATOM 4974 HA ILE 317 -0.113 -4.099 -5.089 1.00 0.00 H -ATOM 4975 CB ILE 317 0.661 -5.049 -6.749 1.00 0.00 C -ATOM 4976 HB ILE 317 0.319 -5.714 -7.540 1.00 0.00 H -ATOM 4977 CG2 ILE 317 1.285 -3.789 -7.385 1.00 0.00 C -ATOM 4978 HG21 ILE 317 1.959 -4.055 -8.199 1.00 0.00 H -ATOM 4979 HG22 ILE 317 0.612 -3.059 -7.834 1.00 0.00 H -ATOM 4980 HG23 ILE 317 1.891 -3.229 -6.672 1.00 0.00 H -ATOM 4981 CG1 ILE 317 1.722 -5.823 -5.865 1.00 0.00 C -ATOM 4982 HG12 ILE 317 1.967 -5.078 -5.107 1.00 0.00 H -ATOM 4983 HG13 ILE 317 1.121 -6.643 -5.472 1.00 0.00 H -ATOM 4984 CD1 ILE 317 2.990 -6.297 -6.617 1.00 0.00 C -ATOM 4985 HD11 ILE 317 2.606 -6.831 -7.486 1.00 0.00 H -ATOM 4986 HD12 ILE 317 3.496 -5.378 -6.916 1.00 0.00 H -ATOM 4987 HD13 ILE 317 3.721 -6.801 -5.985 1.00 0.00 H -ATOM 4988 C ILE 317 -1.442 -3.700 -6.765 1.00 0.00 C -ATOM 4989 O ILE 317 -2.208 -4.073 -7.658 1.00 0.00 O -ATOM 4990 N ILE 318 -1.468 -2.420 -6.306 1.00 0.00 N -ATOM 4991 H ILE 318 -0.884 -2.182 -5.517 1.00 0.00 H -ATOM 4992 CA ILE 318 -2.370 -1.369 -6.901 1.00 0.00 C -ATOM 4993 HA ILE 318 -3.017 -1.883 -7.610 1.00 0.00 H -ATOM 4994 CB ILE 318 -3.220 -0.681 -5.731 1.00 0.00 C -ATOM 4995 HB ILE 318 -2.594 -0.368 -4.896 1.00 0.00 H -ATOM 4996 CG2 ILE 318 -4.012 0.616 -6.300 1.00 0.00 C -ATOM 4997 HG21 ILE 318 -3.300 1.435 -6.411 1.00 0.00 H -ATOM 4998 HG22 ILE 318 -4.572 0.440 -7.218 1.00 0.00 H -ATOM 4999 HG23 ILE 318 -4.721 1.065 -5.605 1.00 0.00 H -ATOM 5000 CG1 ILE 318 -4.084 -1.766 -5.143 1.00 0.00 C -ATOM 5001 HG12 ILE 318 -4.772 -2.267 -5.824 1.00 0.00 H -ATOM 5002 HG13 ILE 318 -3.410 -2.471 -4.655 1.00 0.00 H -ATOM 5003 CD1 ILE 318 -5.089 -1.284 -4.043 1.00 0.00 C -ATOM 5004 HD11 ILE 318 -4.510 -0.742 -3.296 1.00 0.00 H -ATOM 5005 HD12 ILE 318 -5.850 -0.638 -4.479 1.00 0.00 H -ATOM 5006 HD13 ILE 318 -5.615 -2.152 -3.644 1.00 0.00 H -ATOM 5007 C ILE 318 -1.341 -0.454 -7.576 1.00 0.00 C -ATOM 5008 O ILE 318 -0.729 0.403 -6.900 1.00 0.00 O -ATOM 5009 N ALA 319 -1.134 -0.666 -8.900 1.00 0.00 N -ATOM 5010 H ALA 319 -1.848 -1.234 -9.333 1.00 0.00 H -ATOM 5011 CA ALA 319 -0.357 0.214 -9.769 1.00 0.00 C -ATOM 5012 HA ALA 319 0.494 0.567 -9.186 1.00 0.00 H -ATOM 5013 CB ALA 319 0.198 -0.570 -10.986 1.00 0.00 C -ATOM 5014 HB1 ALA 319 0.960 0.055 -11.451 1.00 0.00 H -ATOM 5015 HB2 ALA 319 0.561 -1.577 -10.784 1.00 0.00 H -ATOM 5016 HB3 ALA 319 -0.685 -0.585 -11.626 1.00 0.00 H -ATOM 5017 C ALA 319 -1.265 1.432 -10.160 1.00 0.00 C -ATOM 5018 O ALA 319 -2.398 1.337 -10.564 1.00 0.00 O -ATOM 5019 N THR 320 -0.708 2.582 -9.913 1.00 0.00 N -ATOM 5020 H THR 320 0.132 2.589 -9.352 1.00 0.00 H -ATOM 5021 CA THR 320 -1.366 3.912 -10.030 1.00 0.00 C -ATOM 5022 HA THR 320 -2.409 3.767 -10.313 1.00 0.00 H -ATOM 5023 CB THR 320 -1.353 4.629 -8.634 1.00 0.00 C -ATOM 5024 HB THR 320 -1.800 5.599 -8.851 1.00 0.00 H -ATOM 5025 CG2 THR 320 -2.325 3.929 -7.698 1.00 0.00 C -ATOM 5026 HG21 THR 320 -1.938 2.928 -7.506 1.00 0.00 H -ATOM 5027 HG22 THR 320 -2.375 4.375 -6.703 1.00 0.00 H -ATOM 5028 HG23 THR 320 -3.336 3.940 -8.106 1.00 0.00 H -ATOM 5029 OG1 THR 320 -0.149 4.859 -8.038 1.00 0.00 O -ATOM 5030 HG1 THR 320 0.190 3.963 -7.979 1.00 0.00 H -ATOM 5031 C THR 320 -0.757 4.835 -11.157 1.00 0.00 C -ATOM 5032 O THR 320 0.438 4.756 -11.425 1.00 0.00 O -ATOM 5033 N ILE 321 -1.564 5.626 -11.871 1.00 0.00 N -ATOM 5034 H ILE 321 -2.484 5.586 -11.458 1.00 0.00 H -ATOM 5035 CA ILE 321 -1.229 6.254 -13.210 1.00 0.00 C -ATOM 5036 HA ILE 321 -0.140 6.301 -13.243 1.00 0.00 H -ATOM 5037 CB ILE 321 -1.872 5.356 -14.286 1.00 0.00 C -ATOM 5038 HB ILE 321 -2.947 5.469 -14.148 1.00 0.00 H -ATOM 5039 CG2 ILE 321 -1.667 5.991 -15.686 1.00 0.00 C -ATOM 5040 HG21 ILE 321 -1.643 5.223 -16.459 1.00 0.00 H -ATOM 5041 HG22 ILE 321 -2.561 6.557 -15.951 1.00 0.00 H -ATOM 5042 HG23 ILE 321 -0.787 6.634 -15.699 1.00 0.00 H -ATOM 5043 CG1 ILE 321 -1.440 3.879 -14.408 1.00 0.00 C -ATOM 5044 HG12 ILE 321 -1.753 3.427 -13.467 1.00 0.00 H -ATOM 5045 HG13 ILE 321 -1.969 3.361 -15.208 1.00 0.00 H -ATOM 5046 CD1 ILE 321 0.060 3.614 -14.564 1.00 0.00 C -ATOM 5047 HD11 ILE 321 0.645 4.266 -13.915 1.00 0.00 H -ATOM 5048 HD12 ILE 321 0.157 2.575 -14.250 1.00 0.00 H -ATOM 5049 HD13 ILE 321 0.251 3.662 -15.636 1.00 0.00 H -ATOM 5050 C ILE 321 -1.683 7.698 -13.286 1.00 0.00 C -ATOM 5051 O ILE 321 -2.869 7.986 -13.008 1.00 0.00 O -ATOM 5052 N SER 322 -0.769 8.663 -13.589 1.00 0.00 N -ATOM 5053 H SER 322 0.177 8.416 -13.842 1.00 0.00 H -ATOM 5054 CA SER 322 -1.256 10.006 -14.079 1.00 0.00 C -ATOM 5055 HA SER 322 -2.259 10.153 -13.680 1.00 0.00 H -ATOM 5056 CB SER 322 -0.269 11.056 -13.559 1.00 0.00 C -ATOM 5057 HB2 SER 322 0.672 10.814 -14.054 1.00 0.00 H -ATOM 5058 HB3 SER 322 -0.675 12.014 -13.887 1.00 0.00 H -ATOM 5059 OG SER 322 -0.209 11.119 -12.128 1.00 0.00 O -ATOM 5060 HG SER 322 0.556 11.667 -11.938 1.00 0.00 H -ATOM 5061 C SER 322 -1.346 10.144 -15.600 1.00 0.00 C -ATOM 5062 O SER 322 -0.562 9.443 -16.246 1.00 0.00 O -ATOM 5063 N PRO 323 -2.264 10.925 -16.159 1.00 0.00 N -ATOM 5064 CD PRO 323 -3.395 11.539 -15.519 1.00 0.00 C -ATOM 5065 HD2 PRO 323 -3.219 12.360 -14.825 1.00 0.00 H -ATOM 5066 HD3 PRO 323 -3.828 10.733 -14.927 1.00 0.00 H -ATOM 5067 CG PRO 323 -4.249 12.062 -16.689 1.00 0.00 C -ATOM 5068 HG2 PRO 323 -3.896 13.070 -16.908 1.00 0.00 H -ATOM 5069 HG3 PRO 323 -5.310 12.133 -16.449 1.00 0.00 H -ATOM 5070 CB PRO 323 -4.018 10.989 -17.782 1.00 0.00 C -ATOM 5071 HB2 PRO 323 -4.295 11.352 -18.772 1.00 0.00 H -ATOM 5072 HB3 PRO 323 -4.581 10.108 -17.473 1.00 0.00 H -ATOM 5073 CA PRO 323 -2.542 10.720 -17.606 1.00 0.00 C -ATOM 5074 HA PRO 323 -2.373 9.663 -17.812 1.00 0.00 H -ATOM 5075 C PRO 323 -1.612 11.478 -18.583 1.00 0.00 C -ATOM 5076 O PRO 323 -1.444 10.943 -19.694 1.00 0.00 O -ATOM 5077 N ALA 324 -1.136 12.633 -18.194 1.00 0.00 N -ATOM 5078 H ALA 324 -1.382 13.031 -17.299 1.00 0.00 H -ATOM 5079 CA ALA 324 -0.683 13.582 -19.166 1.00 0.00 C -ATOM 5080 HA ALA 324 -1.436 13.596 -19.953 1.00 0.00 H -ATOM 5081 CB ALA 324 -0.522 14.934 -18.490 1.00 0.00 C -ATOM 5082 HB1 ALA 324 -0.183 15.632 -19.255 1.00 0.00 H -ATOM 5083 HB2 ALA 324 -1.506 15.234 -18.131 1.00 0.00 H -ATOM 5084 HB3 ALA 324 0.186 14.843 -17.666 1.00 0.00 H -ATOM 5085 C ALA 324 0.635 13.205 -19.846 1.00 0.00 C -ATOM 5086 O ALA 324 1.488 12.457 -19.335 1.00 0.00 O -ATOM 5087 N SER 325 0.939 13.833 -20.995 1.00 0.00 N -ATOM 5088 H SER 325 0.278 14.448 -21.447 1.00 0.00 H -ATOM 5089 CA SER 325 1.977 13.530 -21.991 1.00 0.00 C -ATOM 5090 HA SER 325 1.814 12.540 -22.419 1.00 0.00 H -ATOM 5091 CB SER 325 1.880 14.468 -23.154 1.00 0.00 C -ATOM 5092 HB2 SER 325 0.868 14.611 -23.535 1.00 0.00 H -ATOM 5093 HB3 SER 325 2.105 15.502 -22.895 1.00 0.00 H -ATOM 5094 OG SER 325 2.723 13.959 -24.224 1.00 0.00 O -ATOM 5095 HG SER 325 3.164 14.747 -24.552 1.00 0.00 H -ATOM 5096 C SER 325 3.452 13.546 -21.458 1.00 0.00 C -ATOM 5097 O SER 325 4.271 12.669 -21.810 1.00 0.00 O -ATOM 5098 N LEU 326 3.662 14.362 -20.452 1.00 0.00 N -ATOM 5099 H LEU 326 2.939 14.996 -20.144 1.00 0.00 H -ATOM 5100 CA LEU 326 4.988 14.414 -19.745 1.00 0.00 C -ATOM 5101 HA LEU 326 5.735 14.690 -20.490 1.00 0.00 H -ATOM 5102 CB LEU 326 4.952 15.599 -18.784 1.00 0.00 C -ATOM 5103 HB2 LEU 326 4.228 15.255 -18.043 1.00 0.00 H -ATOM 5104 HB3 LEU 326 5.946 15.608 -18.336 1.00 0.00 H -ATOM 5105 CG LEU 326 4.572 16.940 -19.385 1.00 0.00 C -ATOM 5106 HG LEU 326 3.527 16.972 -19.696 1.00 0.00 H -ATOM 5107 CD1 LEU 326 4.694 17.938 -18.267 1.00 0.00 C -ATOM 5108 HD11 LEU 326 4.002 17.712 -17.456 1.00 0.00 H -ATOM 5109 HD12 LEU 326 5.668 17.959 -17.778 1.00 0.00 H -ATOM 5110 HD13 LEU 326 4.376 18.926 -18.598 1.00 0.00 H -ATOM 5111 CD2 LEU 326 5.532 17.300 -20.498 1.00 0.00 C -ATOM 5112 HD21 LEU 326 5.235 18.304 -20.800 1.00 0.00 H -ATOM 5113 HD22 LEU 326 6.590 17.160 -20.278 1.00 0.00 H -ATOM 5114 HD23 LEU 326 5.456 16.571 -21.306 1.00 0.00 H -ATOM 5115 C LEU 326 5.303 13.152 -18.966 1.00 0.00 C -ATOM 5116 O LEU 326 6.477 12.787 -18.761 1.00 0.00 O -ATOM 5117 N ASN 327 4.290 12.303 -18.650 1.00 0.00 N -ATOM 5118 H ASN 327 3.340 12.448 -18.962 1.00 0.00 H -ATOM 5119 CA ASN 327 4.417 11.139 -17.843 1.00 0.00 C -ATOM 5120 HA ASN 327 5.228 11.185 -17.117 1.00 0.00 H -ATOM 5121 CB ASN 327 3.171 11.005 -16.950 1.00 0.00 C -ATOM 5122 HB2 ASN 327 2.294 10.984 -17.597 1.00 0.00 H -ATOM 5123 HB3 ASN 327 3.348 10.167 -16.275 1.00 0.00 H -ATOM 5124 CG ASN 327 2.965 12.116 -15.973 1.00 0.00 C -ATOM 5125 OD1 ASN 327 3.958 12.540 -15.386 1.00 0.00 O -ATOM 5126 ND2 ASN 327 1.779 12.698 -15.986 1.00 0.00 N -ATOM 5127 HD21 ASN 327 1.581 13.542 -15.468 1.00 0.00 H -ATOM 5128 HD22 ASN 327 1.066 12.310 -16.587 1.00 0.00 H -ATOM 5129 C ASN 327 4.759 9.899 -18.682 1.00 0.00 C -ATOM 5130 O ASN 327 4.839 8.845 -18.101 1.00 0.00 O -ATOM 5131 N LEU 328 4.932 9.909 -20.004 1.00 0.00 N -ATOM 5132 H LEU 328 4.633 10.732 -20.508 1.00 0.00 H -ATOM 5133 CA LEU 328 4.975 8.669 -20.826 1.00 0.00 C -ATOM 5134 HA LEU 328 3.951 8.306 -20.745 1.00 0.00 H -ATOM 5135 CB LEU 328 5.142 9.095 -22.257 1.00 0.00 C -ATOM 5136 HB2 LEU 328 4.555 10.009 -22.329 1.00 0.00 H -ATOM 5137 HB3 LEU 328 6.173 9.376 -22.472 1.00 0.00 H -ATOM 5138 CG LEU 328 4.693 8.145 -23.355 1.00 0.00 C -ATOM 5139 HG LEU 328 3.747 7.705 -23.039 1.00 0.00 H -ATOM 5140 CD1 LEU 328 4.341 9.012 -24.611 1.00 0.00 C -ATOM 5141 HD11 LEU 328 3.659 9.811 -24.325 1.00 0.00 H -ATOM 5142 HD12 LEU 328 5.194 9.431 -25.145 1.00 0.00 H -ATOM 5143 HD13 LEU 328 3.816 8.418 -25.360 1.00 0.00 H -ATOM 5144 CD2 LEU 328 5.748 7.124 -23.782 1.00 0.00 C -ATOM 5145 HD21 LEU 328 6.673 7.534 -24.190 1.00 0.00 H -ATOM 5146 HD22 LEU 328 6.074 6.541 -22.921 1.00 0.00 H -ATOM 5147 HD23 LEU 328 5.310 6.349 -24.410 1.00 0.00 H -ATOM 5148 C LEU 328 5.918 7.496 -20.442 1.00 0.00 C -ATOM 5149 O LEU 328 5.376 6.446 -20.246 1.00 0.00 O -ATOM 5150 N GLU 329 7.225 7.711 -20.342 1.00 0.00 N -ATOM 5151 H GLU 329 7.553 8.598 -20.698 1.00 0.00 H -ATOM 5152 CA GLU 329 8.316 6.760 -20.107 1.00 0.00 C -ATOM 5153 HA GLU 329 8.281 5.928 -20.810 1.00 0.00 H -ATOM 5154 CB GLU 329 9.627 7.434 -20.301 1.00 0.00 C -ATOM 5155 HB2 GLU 329 9.774 7.532 -21.377 1.00 0.00 H -ATOM 5156 HB3 GLU 329 9.570 8.395 -19.793 1.00 0.00 H -ATOM 5157 CG GLU 329 10.867 6.648 -19.829 1.00 0.00 C -ATOM 5158 HG2 GLU 329 11.784 7.208 -20.013 1.00 0.00 H -ATOM 5159 HG3 GLU 329 10.878 6.381 -18.772 1.00 0.00 H -ATOM 5160 CD GLU 329 11.043 5.336 -20.597 1.00 0.00 C -ATOM 5161 OE1 GLU 329 10.730 5.396 -21.797 1.00 0.00 O -ATOM 5162 OE2 GLU 329 11.611 4.339 -20.051 1.00 0.00 O -ATOM 5163 C GLU 329 8.102 6.180 -18.687 1.00 0.00 C -ATOM 5164 O GLU 329 8.397 5.019 -18.476 1.00 0.00 O -ATOM 5165 N GLU 330 7.658 7.047 -17.752 1.00 0.00 N -ATOM 5166 H GLU 330 7.300 7.907 -18.142 1.00 0.00 H -ATOM 5167 CA GLU 330 7.336 6.654 -16.382 1.00 0.00 C -ATOM 5168 HA GLU 330 8.184 6.042 -16.073 1.00 0.00 H -ATOM 5169 CB GLU 330 7.451 7.831 -15.388 1.00 0.00 C -ATOM 5170 HB2 GLU 330 6.707 8.593 -15.621 1.00 0.00 H -ATOM 5171 HB3 GLU 330 7.207 7.435 -14.402 1.00 0.00 H -ATOM 5172 CG GLU 330 8.802 8.491 -15.240 1.00 0.00 C -ATOM 5173 HG2 GLU 330 9.142 8.874 -16.202 1.00 0.00 H -ATOM 5174 HG3 GLU 330 8.673 9.319 -14.542 1.00 0.00 H -ATOM 5175 CD GLU 330 9.769 7.526 -14.579 1.00 0.00 C -ATOM 5176 OE1 GLU 330 9.460 6.512 -13.937 1.00 0.00 O -ATOM 5177 OE2 GLU 330 10.934 7.929 -14.480 1.00 0.00 O -ATOM 5178 C GLU 330 6.001 5.853 -16.215 1.00 0.00 C -ATOM 5179 O GLU 330 5.951 4.908 -15.406 1.00 0.00 O -ATOM 5180 N THR 331 4.961 6.244 -17.005 1.00 0.00 N -ATOM 5181 H THR 331 5.112 6.942 -17.718 1.00 0.00 H -ATOM 5182 CA THR 331 3.687 5.525 -17.049 1.00 0.00 C -ATOM 5183 HA THR 331 3.209 5.505 -16.070 1.00 0.00 H -ATOM 5184 CB THR 331 2.696 6.279 -17.987 1.00 0.00 C -ATOM 5185 HB THR 331 3.276 6.536 -18.874 1.00 0.00 H -ATOM 5186 CG2 THR 331 1.365 5.702 -18.342 1.00 0.00 C -ATOM 5187 HG21 THR 331 1.037 6.316 -19.180 1.00 0.00 H -ATOM 5188 HG22 THR 331 1.370 4.701 -18.775 1.00 0.00 H -ATOM 5189 HG23 THR 331 0.609 5.699 -17.558 1.00 0.00 H -ATOM 5190 OG1 THR 331 2.413 7.571 -17.406 1.00 0.00 O -ATOM 5191 HG1 THR 331 3.197 8.125 -17.409 1.00 0.00 H -ATOM 5192 C THR 331 4.048 4.107 -17.539 1.00 0.00 C -ATOM 5193 O THR 331 3.603 3.140 -16.908 1.00 0.00 O -ATOM 5194 N LEU 332 4.867 3.922 -18.614 1.00 0.00 N -ATOM 5195 H LEU 332 5.135 4.825 -18.979 1.00 0.00 H -ATOM 5196 CA LEU 332 5.461 2.666 -19.144 1.00 0.00 C -ATOM 5197 HA LEU 332 4.623 2.049 -19.468 1.00 0.00 H -ATOM 5198 CB LEU 332 6.227 2.948 -20.448 1.00 0.00 C -ATOM 5199 HB2 LEU 332 6.811 3.863 -20.362 1.00 0.00 H -ATOM 5200 HB3 LEU 332 7.009 2.214 -20.638 1.00 0.00 H -ATOM 5201 CG LEU 332 5.375 3.010 -21.726 1.00 0.00 C -ATOM 5202 HG LEU 332 4.680 3.830 -21.550 1.00 0.00 H -ATOM 5203 CD1 LEU 332 6.261 3.409 -22.873 1.00 0.00 C -ATOM 5204 HD11 LEU 332 5.596 3.916 -23.572 1.00 0.00 H -ATOM 5205 HD12 LEU 332 6.918 4.236 -22.605 1.00 0.00 H -ATOM 5206 HD13 LEU 332 6.825 2.565 -23.274 1.00 0.00 H -ATOM 5207 CD2 LEU 332 4.492 1.731 -22.049 1.00 0.00 C -ATOM 5208 HD21 LEU 332 3.603 1.714 -21.418 1.00 0.00 H -ATOM 5209 HD22 LEU 332 4.252 1.824 -23.108 1.00 0.00 H -ATOM 5210 HD23 LEU 332 5.027 0.795 -21.884 1.00 0.00 H -ATOM 5211 C LEU 332 6.383 1.878 -18.233 1.00 0.00 C -ATOM 5212 O LEU 332 6.452 0.621 -18.330 1.00 0.00 O -ATOM 5213 N SER 333 7.114 2.635 -17.346 1.00 0.00 N -ATOM 5214 H SER 333 6.997 3.631 -17.225 1.00 0.00 H -ATOM 5215 CA SER 333 7.880 1.917 -16.273 1.00 0.00 C -ATOM 5216 HA SER 333 8.486 1.125 -16.717 1.00 0.00 H -ATOM 5217 CB SER 333 8.825 2.907 -15.591 1.00 0.00 C -ATOM 5218 HB2 SER 333 9.424 3.541 -16.244 1.00 0.00 H -ATOM 5219 HB3 SER 333 8.276 3.597 -14.951 1.00 0.00 H -ATOM 5220 OG SER 333 9.590 2.278 -14.626 1.00 0.00 O -ATOM 5221 HG SER 333 9.167 2.066 -13.792 1.00 0.00 H -ATOM 5222 C SER 333 7.047 1.252 -15.248 1.00 0.00 C -ATOM 5223 O SER 333 7.134 0.067 -15.041 1.00 0.00 O -ATOM 5224 N THR 334 5.999 1.954 -14.709 1.00 0.00 N -ATOM 5225 H THR 334 5.964 2.905 -15.046 1.00 0.00 H -ATOM 5226 CA THR 334 5.004 1.435 -13.768 1.00 0.00 C -ATOM 5227 HA THR 334 5.509 1.230 -12.824 1.00 0.00 H -ATOM 5228 CB THR 334 3.859 2.459 -13.423 1.00 0.00 C -ATOM 5229 HB THR 334 3.440 3.055 -14.233 1.00 0.00 H -ATOM 5230 CG2 THR 334 2.657 1.908 -12.689 1.00 0.00 C -ATOM 5231 HG21 THR 334 2.072 1.305 -13.385 1.00 0.00 H -ATOM 5232 HG22 THR 334 3.043 1.312 -11.862 1.00 0.00 H -ATOM 5233 HG23 THR 334 2.067 2.727 -12.277 1.00 0.00 H -ATOM 5234 OG1 THR 334 4.563 3.284 -12.503 1.00 0.00 O -ATOM 5235 HG1 THR 334 4.018 4.073 -12.529 1.00 0.00 H -ATOM 5236 C THR 334 4.373 0.151 -14.284 1.00 0.00 C -ATOM 5237 O THR 334 4.232 -0.863 -13.580 1.00 0.00 O -ATOM 5238 N LEU 335 3.774 0.235 -15.489 1.00 0.00 N -ATOM 5239 H LEU 335 3.915 1.096 -15.997 1.00 0.00 H -ATOM 5240 CA LEU 335 2.978 -0.911 -16.096 1.00 0.00 C -ATOM 5241 HA LEU 335 2.250 -1.333 -15.403 1.00 0.00 H -ATOM 5242 CB LEU 335 2.175 -0.427 -17.350 1.00 0.00 C -ATOM 5243 HB2 LEU 335 2.904 0.018 -18.028 1.00 0.00 H -ATOM 5244 HB3 LEU 335 1.803 -1.333 -17.828 1.00 0.00 H -ATOM 5245 CG LEU 335 1.096 0.655 -17.107 1.00 0.00 C -ATOM 5246 HG LEU 335 1.481 1.593 -16.707 1.00 0.00 H -ATOM 5247 CD1 LEU 335 0.338 0.811 -18.451 1.00 0.00 C -ATOM 5248 HD11 LEU 335 -0.074 -0.154 -18.747 1.00 0.00 H -ATOM 5249 HD12 LEU 335 -0.383 1.616 -18.307 1.00 0.00 H -ATOM 5250 HD13 LEU 335 1.043 1.302 -19.122 1.00 0.00 H -ATOM 5251 CD2 LEU 335 0.184 0.347 -15.951 1.00 0.00 C -ATOM 5252 HD21 LEU 335 0.816 0.379 -15.065 1.00 0.00 H -ATOM 5253 HD22 LEU 335 -0.536 1.165 -15.949 1.00 0.00 H -ATOM 5254 HD23 LEU 335 -0.342 -0.596 -16.102 1.00 0.00 H -ATOM 5255 C LEU 335 3.938 -2.061 -16.387 1.00 0.00 C -ATOM 5256 O LEU 335 3.539 -3.221 -16.324 1.00 0.00 O -ATOM 5257 N GLU 336 5.163 -1.797 -16.786 1.00 0.00 N -ATOM 5258 H GLU 336 5.411 -0.829 -16.937 1.00 0.00 H -ATOM 5259 CA GLU 336 6.295 -2.722 -16.973 1.00 0.00 C -ATOM 5260 HA GLU 336 5.724 -3.461 -17.536 1.00 0.00 H -ATOM 5261 CB GLU 336 7.547 -2.161 -17.658 1.00 0.00 C -ATOM 5262 HB2 GLU 336 7.298 -1.617 -18.570 1.00 0.00 H -ATOM 5263 HB3 GLU 336 7.955 -1.358 -17.045 1.00 0.00 H -ATOM 5264 CG GLU 336 8.729 -3.112 -17.672 1.00 0.00 C -ATOM 5265 HG2 GLU 336 9.618 -2.557 -17.973 1.00 0.00 H -ATOM 5266 HG3 GLU 336 8.949 -3.436 -16.655 1.00 0.00 H -ATOM 5267 CD GLU 336 8.490 -4.321 -18.561 1.00 0.00 C -ATOM 5268 OE1 GLU 336 7.578 -4.291 -19.425 1.00 0.00 O -ATOM 5269 OE2 GLU 336 9.187 -5.331 -18.325 1.00 0.00 O -ATOM 5270 C GLU 336 6.690 -3.449 -15.604 1.00 0.00 C -ATOM 5271 O GLU 336 6.743 -4.707 -15.486 1.00 0.00 O -ATOM 5272 N TYR 337 6.903 -2.686 -14.513 1.00 0.00 N -ATOM 5273 H TYR 337 6.956 -1.682 -14.608 1.00 0.00 H -ATOM 5274 CA TYR 337 7.079 -3.321 -13.153 1.00 0.00 C -ATOM 5275 HA TYR 337 7.817 -4.108 -13.308 1.00 0.00 H -ATOM 5276 CB TYR 337 7.544 -2.234 -12.209 1.00 0.00 C -ATOM 5277 HB2 TYR 337 7.152 -1.342 -12.697 1.00 0.00 H -ATOM 5278 HB3 TYR 337 7.120 -2.391 -11.216 1.00 0.00 H -ATOM 5279 CG TYR 337 9.029 -2.033 -12.223 1.00 0.00 C -ATOM 5280 CD1 TYR 337 9.836 -2.994 -11.607 1.00 0.00 C -ATOM 5281 HD1 TYR 337 9.311 -3.789 -11.100 1.00 0.00 H -ATOM 5282 CE1 TYR 337 11.213 -2.850 -11.615 1.00 0.00 C -ATOM 5283 HE1 TYR 337 11.924 -3.592 -11.285 1.00 0.00 H -ATOM 5284 CZ TYR 337 11.771 -1.660 -12.107 1.00 0.00 C -ATOM 5285 OH TYR 337 13.151 -1.472 -12.138 1.00 0.00 O -ATOM 5286 HH TYR 337 13.603 -2.291 -11.922 1.00 0.00 H -ATOM 5287 CE2 TYR 337 11.007 -0.588 -12.529 1.00 0.00 C -ATOM 5288 HE2 TYR 337 11.539 0.334 -12.719 1.00 0.00 H -ATOM 5289 CD2 TYR 337 9.590 -0.803 -12.625 1.00 0.00 C -ATOM 5290 HD2 TYR 337 8.916 -0.070 -13.041 1.00 0.00 H -ATOM 5291 C TYR 337 5.822 -3.979 -12.577 1.00 0.00 C -ATOM 5292 O TYR 337 5.981 -5.020 -11.855 1.00 0.00 O -ATOM 5293 N ALA 338 4.588 -3.510 -12.965 1.00 0.00 N -ATOM 5294 H ALA 338 4.373 -2.631 -13.418 1.00 0.00 H -ATOM 5295 CA ALA 338 3.380 -4.169 -12.464 1.00 0.00 C -ATOM 5296 HA ALA 338 3.352 -4.298 -11.382 1.00 0.00 H -ATOM 5297 CB ALA 338 2.203 -3.275 -12.833 1.00 0.00 C -ATOM 5298 HB1 ALA 338 2.256 -2.370 -12.227 1.00 0.00 H -ATOM 5299 HB2 ALA 338 2.209 -3.048 -13.899 1.00 0.00 H -ATOM 5300 HB3 ALA 338 1.335 -3.810 -12.451 1.00 0.00 H -ATOM 5301 C ALA 338 3.288 -5.597 -13.073 1.00 0.00 C -ATOM 5302 O ALA 338 2.965 -6.597 -12.419 1.00 0.00 O -ATOM 5303 N HIE 339 3.653 -5.740 -14.351 1.00 0.00 N -ATOM 5304 H HIE 339 3.821 -4.882 -14.858 1.00 0.00 H -ATOM 5305 CA HIE 339 3.764 -6.957 -15.111 1.00 0.00 C -ATOM 5306 HA HIE 339 2.793 -7.434 -14.981 1.00 0.00 H -ATOM 5307 CB HIE 339 3.999 -6.614 -16.626 1.00 0.00 C -ATOM 5308 HB2 HIE 339 3.088 -6.114 -16.955 1.00 0.00 H -ATOM 5309 HB3 HIE 339 4.762 -5.840 -16.711 1.00 0.00 H -ATOM 5310 CG HIE 339 4.164 -7.821 -17.456 1.00 0.00 C -ATOM 5311 ND1 HIE 339 5.417 -8.400 -17.672 1.00 0.00 N -ATOM 5312 CE1 HIE 339 5.237 -9.558 -18.335 1.00 0.00 C -ATOM 5313 HE1 HIE 339 6.086 -10.148 -18.648 1.00 0.00 H -ATOM 5314 NE2 HIE 339 3.926 -9.795 -18.530 1.00 0.00 N -ATOM 5315 HE2 HIE 339 3.526 -10.491 -19.143 1.00 0.00 H -ATOM 5316 CD2 HIE 339 3.275 -8.683 -18.020 1.00 0.00 C -ATOM 5317 HD2 HIE 339 2.208 -8.533 -18.085 1.00 0.00 H -ATOM 5318 C HIE 339 4.765 -7.913 -14.585 1.00 0.00 C -ATOM 5319 O HIE 339 4.403 -9.021 -14.207 1.00 0.00 O -ATOM 5320 N ARG 340 5.986 -7.504 -14.365 1.00 0.00 N -ATOM 5321 H ARG 340 6.097 -6.512 -14.521 1.00 0.00 H -ATOM 5322 CA ARG 340 7.051 -8.219 -13.753 1.00 0.00 C -ATOM 5323 HA ARG 340 7.296 -9.031 -14.436 1.00 0.00 H -ATOM 5324 CB ARG 340 8.269 -7.314 -13.470 1.00 0.00 C -ATOM 5325 HB2 ARG 340 7.856 -6.348 -13.183 1.00 0.00 H -ATOM 5326 HB3 ARG 340 8.910 -7.790 -12.728 1.00 0.00 H -ATOM 5327 CG ARG 340 9.018 -6.977 -14.843 1.00 0.00 C -ATOM 5328 HG2 ARG 340 9.495 -7.911 -15.141 1.00 0.00 H -ATOM 5329 HG3 ARG 340 8.246 -6.651 -15.539 1.00 0.00 H -ATOM 5330 CD ARG 340 10.117 -5.854 -14.772 1.00 0.00 C -ATOM 5331 HD2 ARG 340 9.562 -4.961 -14.486 1.00 0.00 H -ATOM 5332 HD3 ARG 340 10.892 -6.027 -14.024 1.00 0.00 H -ATOM 5333 NE ARG 340 10.748 -5.541 -15.957 1.00 0.00 N -ATOM 5334 HE ARG 340 10.239 -5.772 -16.799 1.00 0.00 H -ATOM 5335 CZ ARG 340 11.715 -4.648 -16.081 1.00 0.00 C -ATOM 5336 NH1 ARG 340 12.418 -4.207 -15.067 1.00 0.00 N -ATOM 5337 HH11 ARG 340 12.431 -4.775 -14.233 1.00 0.00 H -ATOM 5338 HH12 ARG 340 13.053 -3.432 -15.190 1.00 0.00 H -ATOM 5339 NH2 ARG 340 12.051 -3.998 -17.158 1.00 0.00 N -ATOM 5340 HH21 ARG 340 11.533 -4.336 -17.956 1.00 0.00 H -ATOM 5341 HH22 ARG 340 12.861 -3.408 -17.284 1.00 0.00 H -ATOM 5342 C ARG 340 6.558 -8.789 -12.358 1.00 0.00 C -ATOM 5343 O ARG 340 6.792 -10.019 -12.102 1.00 0.00 O -ATOM 5344 N ALA 341 5.834 -8.047 -11.527 1.00 0.00 N -ATOM 5345 H ALA 341 5.709 -7.050 -11.637 1.00 0.00 H -ATOM 5346 CA ALA 341 5.281 -8.519 -10.254 1.00 0.00 C -ATOM 5347 HA ALA 341 6.102 -8.964 -9.692 1.00 0.00 H -ATOM 5348 CB ALA 341 4.771 -7.327 -9.437 1.00 0.00 C -ATOM 5349 HB1 ALA 341 4.311 -7.653 -8.505 1.00 0.00 H -ATOM 5350 HB2 ALA 341 5.519 -6.572 -9.193 1.00 0.00 H -ATOM 5351 HB3 ALA 341 3.962 -6.805 -9.949 1.00 0.00 H -ATOM 5352 C ALA 341 4.139 -9.557 -10.369 1.00 0.00 C -ATOM 5353 O ALA 341 4.162 -10.471 -9.557 1.00 0.00 O -ATOM 5354 N LYS 342 3.237 -9.491 -11.398 1.00 0.00 N -ATOM 5355 H LYS 342 3.371 -8.769 -12.091 1.00 0.00 H -ATOM 5356 CA LYS 342 2.137 -10.477 -11.622 1.00 0.00 C -ATOM 5357 HA LYS 342 1.469 -10.471 -10.760 1.00 0.00 H -ATOM 5358 CB LYS 342 1.318 -9.970 -12.873 1.00 0.00 C -ATOM 5359 HB2 LYS 342 1.070 -8.916 -12.753 1.00 0.00 H -ATOM 5360 HB3 LYS 342 2.009 -10.172 -13.691 1.00 0.00 H -ATOM 5361 CG LYS 342 0.057 -10.865 -13.205 1.00 0.00 C -ATOM 5362 HG2 LYS 342 -0.397 -10.473 -14.115 1.00 0.00 H -ATOM 5363 HG3 LYS 342 0.419 -11.849 -13.501 1.00 0.00 H -ATOM 5364 CD LYS 342 -0.967 -11.008 -12.042 1.00 0.00 C -ATOM 5365 HD2 LYS 342 -0.453 -11.055 -11.084 1.00 0.00 H -ATOM 5366 HD3 LYS 342 -1.504 -10.058 -12.040 1.00 0.00 H -ATOM 5367 CE LYS 342 -2.064 -12.068 -12.195 1.00 0.00 C -ATOM 5368 HE2 LYS 342 -2.761 -11.747 -12.969 1.00 0.00 H -ATOM 5369 HE3 LYS 342 -1.616 -13.035 -12.423 1.00 0.00 H -ATOM 5370 NZ LYS 342 -2.890 -12.168 -10.979 1.00 0.00 N -ATOM 5371 HZ1 LYS 342 -3.462 -11.338 -10.912 1.00 0.00 H -ATOM 5372 HZ2 LYS 342 -3.603 -12.879 -11.055 1.00 0.00 H -ATOM 5373 HZ3 LYS 342 -2.364 -12.181 -10.115 1.00 0.00 H -ATOM 5374 C LYS 342 2.570 -11.939 -11.867 1.00 0.00 C -ATOM 5375 O LYS 342 1.855 -12.876 -11.774 1.00 0.00 O -ATOM 5376 N ASN 343 3.912 -12.134 -12.019 1.00 0.00 N -ATOM 5377 H ASN 343 4.504 -11.317 -11.960 1.00 0.00 H -ATOM 5378 CA ASN 343 4.573 -13.419 -12.120 1.00 0.00 C -ATOM 5379 HA ASN 343 4.048 -14.015 -12.864 1.00 0.00 H -ATOM 5380 CB ASN 343 6.036 -13.236 -12.708 1.00 0.00 C -ATOM 5381 HB2 ASN 343 6.000 -12.334 -13.319 1.00 0.00 H -ATOM 5382 HB3 ASN 343 6.729 -13.048 -11.888 1.00 0.00 H -ATOM 5383 CG ASN 343 6.537 -14.352 -13.532 1.00 0.00 C -ATOM 5384 OD1 ASN 343 7.536 -14.945 -13.318 1.00 0.00 O -ATOM 5385 ND2 ASN 343 5.725 -14.793 -14.476 1.00 0.00 N -ATOM 5386 HD21 ASN 343 6.080 -15.571 -15.013 1.00 0.00 H -ATOM 5387 HD22 ASN 343 4.895 -14.265 -14.703 1.00 0.00 H -ATOM 5388 C ASN 343 4.643 -14.231 -10.858 1.00 0.00 C -ATOM 5389 O ASN 343 4.703 -15.471 -10.778 1.00 0.00 O -ATOM 5390 N ILE 344 4.580 -13.401 -9.736 1.00 0.00 N -ATOM 5391 H ILE 344 4.417 -12.424 -9.935 1.00 0.00 H -ATOM 5392 CA ILE 344 5.079 -13.756 -8.365 1.00 0.00 C -ATOM 5393 HA ILE 344 5.790 -14.571 -8.501 1.00 0.00 H -ATOM 5394 CB ILE 344 5.741 -12.542 -7.626 1.00 0.00 C -ATOM 5395 HB ILE 344 4.951 -11.905 -7.229 1.00 0.00 H -ATOM 5396 CG2 ILE 344 6.551 -13.052 -6.424 1.00 0.00 C -ATOM 5397 HG21 ILE 344 7.300 -13.783 -6.725 1.00 0.00 H -ATOM 5398 HG22 ILE 344 7.048 -12.261 -5.863 1.00 0.00 H -ATOM 5399 HG23 ILE 344 5.847 -13.469 -5.704 1.00 0.00 H -ATOM 5400 CG1 ILE 344 6.777 -11.729 -8.527 1.00 0.00 C -ATOM 5401 HG12 ILE 344 7.691 -12.303 -8.681 1.00 0.00 H -ATOM 5402 HG13 ILE 344 6.382 -11.465 -9.508 1.00 0.00 H -ATOM 5403 CD1 ILE 344 7.269 -10.366 -7.981 1.00 0.00 C -ATOM 5404 HD11 ILE 344 7.692 -10.379 -6.976 1.00 0.00 H -ATOM 5405 HD12 ILE 344 8.079 -9.978 -8.599 1.00 0.00 H -ATOM 5406 HD13 ILE 344 6.429 -9.675 -7.934 1.00 0.00 H -ATOM 5407 C ILE 344 4.021 -14.544 -7.588 1.00 0.00 C -ATOM 5408 O ILE 344 2.911 -14.103 -7.406 1.00 0.00 O -ATOM 5409 N LEU 345 4.466 -15.706 -7.100 1.00 0.00 N -ATOM 5410 H LEU 345 5.404 -16.079 -7.137 1.00 0.00 H -ATOM 5411 CA LEU 345 3.583 -16.576 -6.229 1.00 0.00 C -ATOM 5412 HA LEU 345 2.522 -16.337 -6.275 1.00 0.00 H -ATOM 5413 CB LEU 345 3.734 -18.000 -6.567 1.00 0.00 C -ATOM 5414 HB2 LEU 345 4.754 -18.289 -6.313 1.00 0.00 H -ATOM 5415 HB3 LEU 345 3.081 -18.603 -5.935 1.00 0.00 H -ATOM 5416 CG LEU 345 3.511 -18.400 -8.007 1.00 0.00 C -ATOM 5417 HG LEU 345 4.351 -17.955 -8.539 1.00 0.00 H -ATOM 5418 CD1 LEU 345 3.596 -19.929 -8.172 1.00 0.00 C -ATOM 5419 HD11 LEU 345 4.521 -20.315 -7.743 1.00 0.00 H -ATOM 5420 HD12 LEU 345 2.739 -20.409 -7.700 1.00 0.00 H -ATOM 5421 HD13 LEU 345 3.641 -20.161 -9.236 1.00 0.00 H -ATOM 5422 CD2 LEU 345 2.223 -17.950 -8.696 1.00 0.00 C -ATOM 5423 HD21 LEU 345 2.231 -18.349 -9.711 1.00 0.00 H -ATOM 5424 HD22 LEU 345 1.289 -18.231 -8.213 1.00 0.00 H -ATOM 5425 HD23 LEU 345 2.270 -16.865 -8.793 1.00 0.00 H -ATOM 5426 C LEU 345 3.949 -16.279 -4.785 1.00 0.00 C -ATOM 5427 O LEU 345 5.057 -16.228 -4.372 1.00 0.00 O -ATOM 5428 N ASN 346 2.942 -16.210 -3.929 1.00 0.00 N -ATOM 5429 H ASN 346 2.018 -16.412 -4.282 1.00 0.00 H -ATOM 5430 CA ASN 346 3.153 -16.264 -2.404 1.00 0.00 C -ATOM 5431 HA ASN 346 4.125 -15.899 -2.075 1.00 0.00 H -ATOM 5432 CB ASN 346 2.134 -15.449 -1.637 1.00 0.00 C -ATOM 5433 HB2 ASN 346 1.134 -15.804 -1.889 1.00 0.00 H -ATOM 5434 HB3 ASN 346 2.292 -15.663 -0.580 1.00 0.00 H -ATOM 5435 CG ASN 346 2.342 -13.955 -1.778 1.00 0.00 C -ATOM 5436 OD1 ASN 346 1.491 -13.237 -2.286 1.00 0.00 O -ATOM 5437 ND2 ASN 346 3.482 -13.410 -1.395 1.00 0.00 N -ATOM 5438 HD21 ASN 346 3.396 -12.405 -1.332 1.00 0.00 H -ATOM 5439 HD22 ASN 346 4.100 -13.934 -0.793 1.00 0.00 H -ATOM 5440 C ASN 346 3.144 -17.782 -2.022 1.00 0.00 C -ATOM 5441 O ASN 346 2.617 -18.631 -2.734 1.00 0.00 O -ATOM 5442 N LYS 347 3.858 -18.164 -0.978 1.00 0.00 N -ATOM 5443 H LYS 347 4.240 -17.457 -0.365 1.00 0.00 H -ATOM 5444 CA LYS 347 4.349 -19.550 -0.962 1.00 0.00 C -ATOM 5445 HA LYS 347 4.495 -20.057 -1.916 1.00 0.00 H -ATOM 5446 CB LYS 347 5.658 -19.539 -0.146 1.00 0.00 C -ATOM 5447 HB2 LYS 347 5.776 -18.620 0.428 1.00 0.00 H -ATOM 5448 HB3 LYS 347 5.788 -20.454 0.432 1.00 0.00 H -ATOM 5449 CG LYS 347 6.825 -19.557 -1.142 1.00 0.00 C -ATOM 5450 HG2 LYS 347 6.809 -20.537 -1.621 1.00 0.00 H -ATOM 5451 HG3 LYS 347 6.635 -18.757 -1.858 1.00 0.00 H -ATOM 5452 CD LYS 347 8.149 -19.275 -0.387 1.00 0.00 C -ATOM 5453 HD2 LYS 347 8.120 -18.373 0.224 1.00 0.00 H -ATOM 5454 HD3 LYS 347 8.344 -20.111 0.283 1.00 0.00 H -ATOM 5455 CE LYS 347 9.273 -19.247 -1.398 1.00 0.00 C -ATOM 5456 HE2 LYS 347 10.182 -19.432 -0.825 1.00 0.00 H -ATOM 5457 HE3 LYS 347 9.213 -20.069 -2.111 1.00 0.00 H -ATOM 5458 NZ LYS 347 9.342 -17.956 -2.095 1.00 0.00 N -ATOM 5459 HZ1 LYS 347 9.960 -17.982 -2.893 1.00 0.00 H -ATOM 5460 HZ2 LYS 347 8.448 -17.618 -2.421 1.00 0.00 H -ATOM 5461 HZ3 LYS 347 9.795 -17.213 -1.581 1.00 0.00 H -ATOM 5462 C LYS 347 3.304 -20.616 -0.498 1.00 0.00 C -ATOM 5463 O LYS 347 2.691 -20.397 0.609 1.00 0.00 O -ATOM 5464 OXT LYS 347 3.026 -21.636 -1.216 1.00 0.00 O -TER 5465 LYS 347 -HETATM 5466 O1B ADP 348 0.332 9.196 -5.215 1.00 0.00 O -HETATM 5467 PB ADP 348 0.948 10.258 -4.398 1.00 0.00 P -HETATM 5468 O2B ADP 348 2.261 10.491 -4.877 1.00 0.00 O -HETATM 5469 O3B ADP 348 0.861 10.020 -2.955 1.00 0.00 O -HETATM 5470 O3A ADP 348 0.169 11.517 -4.718 1.00 0.00 O -HETATM 5471 PA ADP 348 -0.266 12.627 -3.834 1.00 0.00 P -HETATM 5472 O1A ADP 348 0.846 13.263 -3.076 1.00 0.00 O -HETATM 5473 O2A ADP 348 -1.503 12.239 -3.127 1.00 0.00 O -HETATM 5474 O5* ADP 348 -0.776 13.668 -4.933 1.00 0.00 O -HETATM 5475 C5* ADP 348 -1.734 13.248 -5.962 1.00 0.00 C -HETATM 5476 H50 ADP 348 -1.943 12.179 -5.943 1.00 0.00 H -HETATM 5477 H51 ADP 348 -1.316 13.503 -6.936 1.00 0.00 H -HETATM 5478 C4* ADP 348 -3.057 14.000 -5.725 1.00 0.00 C -HETATM 5479 H40 ADP 348 -2.873 15.050 -5.500 1.00 0.00 H -HETATM 5480 O4* ADP 348 -3.723 13.964 -6.997 1.00 0.00 O -HETATM 5481 C1* ADP 348 -5.120 13.930 -6.647 1.00 0.00 C -HETATM 5482 H10 ADP 348 -5.699 14.715 -7.135 1.00 0.00 H -HETATM 5483 N9 ADP 348 -5.710 12.641 -7.167 1.00 0.00 N -HETATM 5484 C8 ADP 348 -5.104 11.424 -7.456 1.00 0.00 C -HETATM 5485 H80 ADP 348 -4.085 11.180 -7.194 1.00 0.00 H -HETATM 5486 N7 ADP 348 -5.921 10.492 -7.911 1.00 0.00 N -HETATM 5487 C5 ADP 348 -7.166 11.087 -7.885 1.00 0.00 C -HETATM 5488 C6 ADP 348 -8.449 10.633 -8.207 1.00 0.00 C -HETATM 5489 N6 ADP 348 -8.831 9.458 -8.630 1.00 0.00 N -HETATM 5490 H60 ADP 348 -8.115 8.747 -8.686 1.00 0.00 H -HETATM 5491 H61 ADP 348 -9.749 9.256 -8.997 1.00 0.00 H -HETATM 5492 N1 ADP 348 -9.464 11.507 -8.188 1.00 0.00 N -HETATM 5493 C2 ADP 348 -9.200 12.736 -7.743 1.00 0.00 C -HETATM 5494 H2 ADP 348 -10.020 13.437 -7.786 1.00 0.00 H -HETATM 5495 N3 ADP 348 -8.062 13.233 -7.267 1.00 0.00 N -HETATM 5496 C4 ADP 348 -7.087 12.354 -7.405 1.00 0.00 C -HETATM 5497 C3* ADP 348 -4.038 13.447 -4.709 1.00 0.00 C -HETATM 5498 H30 ADP 348 -4.077 12.364 -4.824 1.00 0.00 H -HETATM 5499 O3* ADP 348 -3.758 13.682 -3.342 1.00 0.00 O -HETATM 5500 H3* ADP 348 -2.978 13.143 -3.188 1.00 0.00 H -HETATM 5501 C2* ADP 348 -5.322 14.141 -5.139 1.00 0.00 C -HETATM 5502 H20 ADP 348 -6.148 13.527 -4.778 1.00 0.00 H -HETATM 5503 O2* ADP 348 -5.435 15.563 -4.767 1.00 0.00 O -HETATM 5504 H2* ADP 348 -4.640 15.782 -4.274 1.00 0.00 H -HETATM 5505 MG MG 349 1.781 9.697 -1.337 1.00 0.00 Mg -HETATM 5506 O WAT 438 2.017 7.636 -1.561 1.00 0.00 O -HETATM 5507 H1 WAT 438 2.890 7.246 -1.545 1.00 0.00 H -HETATM 5508 H2 WAT 438 1.446 6.961 -1.192 1.00 0.00 H -HETATM 5509 O WAT 439 1.810 11.775 -1.352 1.00 0.00 O -HETATM 5510 H1 WAT 439 2.077 12.437 -0.715 1.00 0.00 H -HETATM 5511 H2 WAT 439 1.449 12.277 -2.083 1.00 0.00 H -HETATM 5512 O WAT 440 19.736 -3.030 10.581 1.00 0.00 O -HETATM 5513 H1 WAT 440 20.382 -3.628 10.203 1.00 0.00 H -HETATM 5514 H2 WAT 440 20.225 -2.529 11.233 1.00 0.00 H -HETATM 5515 O WAT 441 2.624 9.607 0.536 1.00 0.00 O -HETATM 5516 H1 WAT 441 2.870 8.817 1.017 1.00 0.00 H -HETATM 5517 H2 WAT 441 3.043 10.321 1.016 1.00 0.00 H -CONECT 5481 5480 5482 5483 5501 -CONECT 5493 5492 5494 5495 -CONECT 5501 5481 5497 5502 5503 -CONECT 5497 5478 5498 5499 5501 -CONECT 5496 5483 5487 5495 -CONECT 5478 5475 5479 5480 5497 -CONECT 5487 5486 5488 5496 -CONECT 5475 5474 5476 5477 5478 -CONECT 5488 5487 5489 5492 -CONECT 5484 5483 5485 5486 -CONECT 5482 5481 -CONECT 5494 5493 -CONECT 5504 5503 -CONECT 5502 5501 -CONECT 5500 5499 -CONECT 5498 5497 -CONECT 5479 5478 -CONECT 5476 5475 -CONECT 5477 5475 -CONECT 5490 5489 -CONECT 5491 5489 -CONECT 5485 5484 -CONECT 5492 5488 5493 -CONECT 5495 5493 5496 -CONECT 5489 5488 5490 5491 -CONECT 5486 5484 5487 -CONECT 5483 5481 5484 5496 -CONECT 5472 5471 -CONECT 5466 5467 -CONECT 5503 5501 5504 -CONECT 5473 5471 -CONECT 5468 5467 -CONECT 5499 5497 5500 -CONECT 5470 5467 5471 -CONECT 5469 5467 -CONECT 5480 5478 5481 -CONECT 5474 5471 5475 -CONECT 5471 5470 5472 5473 5474 -CONECT 5467 5466 5468 5469 5470 -CONECT 5507 5506 -CONECT 5508 5506 -CONECT 5506 5507 5508 -CONECT 5510 5509 -CONECT 5511 5509 -CONECT 5509 5510 5511 -CONECT 5513 5512 -CONECT 5514 5512 -CONECT 5512 5513 5514 -CONECT 5516 5515 -CONECT 5517 5515 -CONECT 5515 5516 5517 -END diff --git a/receptor/eg5_adp_mg_04000.pdb b/receptor/eg5_adp_mg_04000.pdb deleted file mode 100644 index f2e7083..0000000 --- a/receptor/eg5_adp_mg_04000.pdb +++ /dev/null @@ -1,5595 +0,0 @@ -HELIX 1 1 LEU 15 LYS 19 1 5 -HELIX 2 2 LYS 45 SER 47 1 3 -HELIX 3 3 GLN 63 ILE 79 1 17 -HELIX 4 4 LYS 96 MET 100 1 5 -HELIX 5 5 ILE 120 ASP 134 1 15 -HELIX 6 6 LYS 192 LEU 212 1 21 -HELIX 7 7 TYR 216 ARG 219 1 4 -HELIX 8 8 ASN 256 ARG 259 1 4 -HELIX 9 9 ARG 268 ILE 273 1 6 -HELIX 10 10 GLN 275 GLU 289 1 15 -HELIX 11 11 LYS 300 ILE 304 1 5 -HELIX 12 12 SER 325 ASN 343 1 19 -SHEET 1 1 1 GLN 5 CYS 10 0 -SHEET 2 2 1 VAL 26 ASP 29 0 -SHEET 3 3 1 GLU 34 VAL 37 0 -SHEET 4 4 1 LYS 49 THR 52 0 -SHEET 5 5 1 MET 55 PHE 57 0 -SHEET 6 6 1 ASN 83 TYR 89 0 -SHEET 7 7 1 PHE 139 TYR 149 0 -SHEET 8 8 1 GLU 152 PHE 154 0 -SHEET 9 9 1 GLN 168 ASP 171 0 -SHEET 10 10 1 VAL 179 LYS 182 0 -SHEET 11 11 1 HIE 221 LYS 231 0 -SHEET 12 12 1 VAL 241 ASP 250 0 -SHEET 13 13 1 ARG 314 ILE 321 0 -CRYST1 88.503 88.503 88.503 109.47 109.47 109.47 1 -ATOM 1 N GLY 1 1.865 -21.763 -4.134 1.00 0.00 N -ATOM 2 H1 GLY 1 1.542 -22.237 -4.965 1.00 0.00 H -ATOM 3 H2 GLY 1 2.252 -22.469 -3.525 1.00 0.00 H -ATOM 4 H3 GLY 1 2.625 -21.123 -4.317 1.00 0.00 H -ATOM 5 CA GLY 1 0.786 -20.850 -3.502 1.00 0.00 C -ATOM 6 HA2 GLY 1 0.014 -21.528 -3.141 1.00 0.00 H -ATOM 7 HA3 GLY 1 1.085 -20.284 -2.619 1.00 0.00 H -ATOM 8 C GLY 1 0.282 -19.889 -4.437 1.00 0.00 C -ATOM 9 O GLY 1 0.633 -20.006 -5.607 1.00 0.00 O -ATOM 10 N LYS 2 -0.625 -19.001 -3.960 1.00 0.00 N -ATOM 11 H LYS 2 -0.740 -19.144 -2.966 1.00 0.00 H -ATOM 12 CA LYS 2 -1.375 -17.962 -4.578 1.00 0.00 C -ATOM 13 HA LYS 2 -1.975 -18.434 -5.355 1.00 0.00 H -ATOM 14 CB LYS 2 -2.375 -17.303 -3.627 1.00 0.00 C -ATOM 15 HB2 LYS 2 -2.887 -18.048 -3.016 1.00 0.00 H -ATOM 16 HB3 LYS 2 -1.738 -16.693 -2.988 1.00 0.00 H -ATOM 17 CG LYS 2 -3.586 -16.572 -4.455 1.00 0.00 C -ATOM 18 HG2 LYS 2 -3.173 -15.884 -5.193 1.00 0.00 H -ATOM 19 HG3 LYS 2 -3.902 -17.387 -5.107 1.00 0.00 H -ATOM 20 CD LYS 2 -4.643 -15.929 -3.511 1.00 0.00 C -ATOM 21 HD2 LYS 2 -4.964 -16.778 -2.908 1.00 0.00 H -ATOM 22 HD3 LYS 2 -4.259 -15.113 -2.898 1.00 0.00 H -ATOM 23 CE LYS 2 -5.812 -15.482 -4.348 1.00 0.00 C -ATOM 24 HE2 LYS 2 -5.518 -14.531 -4.792 1.00 0.00 H -ATOM 25 HE3 LYS 2 -5.943 -16.262 -5.098 1.00 0.00 H -ATOM 26 NZ LYS 2 -6.994 -15.320 -3.535 1.00 0.00 N -ATOM 27 HZ1 LYS 2 -7.346 -16.236 -3.294 1.00 0.00 H -ATOM 28 HZ2 LYS 2 -6.728 -14.828 -2.694 1.00 0.00 H -ATOM 29 HZ3 LYS 2 -7.713 -14.749 -3.957 1.00 0.00 H -ATOM 30 C LYS 2 -0.439 -16.907 -5.233 1.00 0.00 C -ATOM 31 O LYS 2 0.504 -16.413 -4.590 1.00 0.00 O -ATOM 32 N ASN 3 -0.652 -16.653 -6.507 1.00 0.00 N -ATOM 33 H ASN 3 -1.380 -17.214 -6.924 1.00 0.00 H -ATOM 34 CA ASN 3 0.079 -15.744 -7.325 1.00 0.00 C -ATOM 35 HA ASN 3 1.157 -15.838 -7.190 1.00 0.00 H -ATOM 36 CB ASN 3 -0.315 -16.023 -8.839 1.00 0.00 C -ATOM 37 HB2 ASN 3 -0.050 -17.026 -9.176 1.00 0.00 H -ATOM 38 HB3 ASN 3 -1.400 -15.937 -8.787 1.00 0.00 H -ATOM 39 CG ASN 3 0.295 -15.156 -9.900 1.00 0.00 C -ATOM 40 OD1 ASN 3 -0.357 -14.671 -10.871 1.00 0.00 O -ATOM 41 ND2 ASN 3 1.545 -14.899 -9.749 1.00 0.00 N -ATOM 42 HD21 ASN 3 1.978 -14.193 -10.329 1.00 0.00 H -ATOM 43 HD22 ASN 3 2.025 -15.164 -8.900 1.00 0.00 H -ATOM 44 C ASN 3 -0.278 -14.256 -6.868 1.00 0.00 C -ATOM 45 O ASN 3 -1.441 -13.901 -6.561 1.00 0.00 O -ATOM 46 N ILE 4 0.756 -13.396 -6.862 1.00 0.00 N -ATOM 47 H ILE 4 1.620 -13.773 -7.223 1.00 0.00 H -ATOM 48 CA ILE 4 0.700 -11.963 -6.524 1.00 0.00 C -ATOM 49 HA ILE 4 0.285 -11.909 -5.518 1.00 0.00 H -ATOM 50 CB ILE 4 2.118 -11.340 -6.632 1.00 0.00 C -ATOM 51 HB ILE 4 2.638 -11.760 -7.493 1.00 0.00 H -ATOM 52 CG2 ILE 4 2.087 -9.737 -6.755 1.00 0.00 C -ATOM 53 HG21 ILE 4 3.070 -9.334 -6.999 1.00 0.00 H -ATOM 54 HG22 ILE 4 1.457 -9.437 -7.593 1.00 0.00 H -ATOM 55 HG23 ILE 4 1.790 -9.341 -5.785 1.00 0.00 H -ATOM 56 CG1 ILE 4 2.867 -11.657 -5.318 1.00 0.00 C -ATOM 57 HG12 ILE 4 2.212 -11.559 -4.453 1.00 0.00 H -ATOM 58 HG13 ILE 4 3.140 -12.712 -5.294 1.00 0.00 H -ATOM 59 CD1 ILE 4 4.172 -10.885 -4.909 1.00 0.00 C -ATOM 60 HD11 ILE 4 3.941 -9.839 -4.710 1.00 0.00 H -ATOM 61 HD12 ILE 4 4.429 -11.257 -3.917 1.00 0.00 H -ATOM 62 HD13 ILE 4 4.928 -10.791 -5.688 1.00 0.00 H -ATOM 63 C ILE 4 -0.275 -11.319 -7.511 1.00 0.00 C -ATOM 64 O ILE 4 -0.177 -11.585 -8.725 1.00 0.00 O -ATOM 65 N GLN 5 -1.189 -10.441 -7.009 1.00 0.00 N -ATOM 66 H GLN 5 -1.076 -10.144 -6.050 1.00 0.00 H -ATOM 67 CA GLN 5 -2.252 -9.721 -7.765 1.00 0.00 C -ATOM 68 HA GLN 5 -2.550 -10.303 -8.638 1.00 0.00 H -ATOM 69 CB GLN 5 -3.449 -9.607 -6.824 1.00 0.00 C -ATOM 70 HB2 GLN 5 -3.592 -10.528 -6.258 1.00 0.00 H -ATOM 71 HB3 GLN 5 -3.238 -8.802 -6.119 1.00 0.00 H -ATOM 72 CG GLN 5 -4.657 -9.369 -7.708 1.00 0.00 C -ATOM 73 HG2 GLN 5 -4.455 -8.540 -8.386 1.00 0.00 H -ATOM 74 HG3 GLN 5 -4.970 -10.295 -8.192 1.00 0.00 H -ATOM 75 CD GLN 5 -5.820 -9.008 -6.860 1.00 0.00 C -ATOM 76 OE1 GLN 5 -5.817 -8.159 -5.977 1.00 0.00 O -ATOM 77 NE2 GLN 5 -6.909 -9.691 -6.949 1.00 0.00 N -ATOM 78 HE21 GLN 5 -7.774 -9.283 -6.624 1.00 0.00 H -ATOM 79 HE22 GLN 5 -7.006 -10.499 -7.548 1.00 0.00 H -ATOM 80 C GLN 5 -1.755 -8.365 -8.219 1.00 0.00 C -ATOM 81 O GLN 5 -0.957 -7.759 -7.506 1.00 0.00 O -ATOM 82 N VAL 6 -2.104 -8.047 -9.450 1.00 0.00 N -ATOM 83 H VAL 6 -2.782 -8.617 -9.934 1.00 0.00 H -ATOM 84 CA VAL 6 -1.817 -6.620 -9.851 1.00 0.00 C -ATOM 85 HA VAL 6 -1.608 -5.988 -8.988 1.00 0.00 H -ATOM 86 CB VAL 6 -0.610 -6.417 -10.809 1.00 0.00 C -ATOM 87 HB VAL 6 -0.752 -6.863 -11.793 1.00 0.00 H -ATOM 88 CG1 VAL 6 -0.314 -4.958 -11.064 1.00 0.00 C -ATOM 89 HG11 VAL 6 -1.017 -4.631 -11.829 1.00 0.00 H -ATOM 90 HG12 VAL 6 -0.405 -4.377 -10.146 1.00 0.00 H -ATOM 91 HG13 VAL 6 0.707 -4.816 -11.419 1.00 0.00 H -ATOM 92 CG2 VAL 6 0.691 -7.018 -10.240 1.00 0.00 C -ATOM 93 HG21 VAL 6 0.821 -6.664 -9.218 1.00 0.00 H -ATOM 94 HG22 VAL 6 0.588 -8.095 -10.109 1.00 0.00 H -ATOM 95 HG23 VAL 6 1.609 -6.746 -10.762 1.00 0.00 H -ATOM 96 C VAL 6 -3.086 -5.970 -10.476 1.00 0.00 C -ATOM 97 O VAL 6 -3.796 -6.586 -11.279 1.00 0.00 O -ATOM 98 N VAL 7 -3.389 -4.735 -10.010 1.00 0.00 N -ATOM 99 H VAL 7 -2.806 -4.277 -9.323 1.00 0.00 H -ATOM 100 CA VAL 7 -4.459 -3.903 -10.623 1.00 0.00 C -ATOM 101 HA VAL 7 -4.763 -4.412 -11.537 1.00 0.00 H -ATOM 102 CB VAL 7 -5.724 -3.850 -9.721 1.00 0.00 C -ATOM 103 HB VAL 7 -6.372 -3.108 -10.189 1.00 0.00 H -ATOM 104 CG1 VAL 7 -6.416 -5.263 -9.748 1.00 0.00 C -ATOM 105 HG11 VAL 7 -7.275 -5.314 -9.078 1.00 0.00 H -ATOM 106 HG12 VAL 7 -6.797 -5.321 -10.768 1.00 0.00 H -ATOM 107 HG13 VAL 7 -5.705 -6.058 -9.526 1.00 0.00 H -ATOM 108 CG2 VAL 7 -5.528 -3.292 -8.339 1.00 0.00 C -ATOM 109 HG21 VAL 7 -4.877 -2.423 -8.437 1.00 0.00 H -ATOM 110 HG22 VAL 7 -6.471 -2.885 -7.973 1.00 0.00 H -ATOM 111 HG23 VAL 7 -5.105 -4.017 -7.644 1.00 0.00 H -ATOM 112 C VAL 7 -3.960 -2.486 -10.997 1.00 0.00 C -ATOM 113 O VAL 7 -3.082 -1.968 -10.387 1.00 0.00 O -ATOM 114 N VAL 8 -4.599 -1.966 -12.054 1.00 0.00 N -ATOM 115 H VAL 8 -5.409 -2.496 -12.341 1.00 0.00 H -ATOM 116 CA VAL 8 -4.316 -0.677 -12.686 1.00 0.00 C -ATOM 117 HA VAL 8 -3.406 -0.269 -12.244 1.00 0.00 H -ATOM 118 CB VAL 8 -4.183 -0.729 -14.279 1.00 0.00 C -ATOM 119 HB VAL 8 -5.148 -1.014 -14.699 1.00 0.00 H -ATOM 120 CG1 VAL 8 -3.898 0.701 -14.760 1.00 0.00 C -ATOM 121 HG11 VAL 8 -3.111 1.141 -14.149 1.00 0.00 H -ATOM 122 HG12 VAL 8 -3.505 0.693 -15.776 1.00 0.00 H -ATOM 123 HG13 VAL 8 -4.760 1.351 -14.613 1.00 0.00 H -ATOM 124 CG2 VAL 8 -3.068 -1.550 -14.839 1.00 0.00 C -ATOM 125 HG21 VAL 8 -3.041 -2.518 -14.338 1.00 0.00 H -ATOM 126 HG22 VAL 8 -3.340 -1.822 -15.859 1.00 0.00 H -ATOM 127 HG23 VAL 8 -2.098 -1.073 -14.703 1.00 0.00 H -ATOM 128 C VAL 8 -5.342 0.339 -12.255 1.00 0.00 C -ATOM 129 O VAL 8 -6.509 0.160 -12.460 1.00 0.00 O -ATOM 130 N ARG 9 -4.927 1.557 -11.872 1.00 0.00 N -ATOM 131 H ARG 9 -3.924 1.644 -11.781 1.00 0.00 H -ATOM 132 CA ARG 9 -5.755 2.724 -11.612 1.00 0.00 C -ATOM 133 HA ARG 9 -6.637 2.623 -12.243 1.00 0.00 H -ATOM 134 CB ARG 9 -6.075 2.907 -10.108 1.00 0.00 C -ATOM 135 HB2 ARG 9 -6.464 1.989 -9.668 1.00 0.00 H -ATOM 136 HB3 ARG 9 -5.166 3.142 -9.556 1.00 0.00 H -ATOM 137 CG ARG 9 -7.131 4.001 -9.947 1.00 0.00 C -ATOM 138 HG2 ARG 9 -6.802 4.964 -10.338 1.00 0.00 H -ATOM 139 HG3 ARG 9 -7.991 3.681 -10.536 1.00 0.00 H -ATOM 140 CD ARG 9 -7.631 4.134 -8.477 1.00 0.00 C -ATOM 141 HD2 ARG 9 -7.720 3.112 -8.108 1.00 0.00 H -ATOM 142 HD3 ARG 9 -6.786 4.593 -7.963 1.00 0.00 H -ATOM 143 NE ARG 9 -8.903 4.909 -8.327 1.00 0.00 N -ATOM 144 HE ARG 9 -9.411 5.068 -9.185 1.00 0.00 H -ATOM 145 CZ ARG 9 -9.406 5.343 -7.224 1.00 0.00 C -ATOM 146 NH1 ARG 9 -8.732 5.560 -6.112 1.00 0.00 N -ATOM 147 HH11 ARG 9 -7.731 5.428 -6.160 1.00 0.00 H -ATOM 148 HH12 ARG 9 -9.258 5.995 -5.368 1.00 0.00 H -ATOM 149 NH2 ARG 9 -10.615 5.802 -7.174 1.00 0.00 N -ATOM 150 HH21 ARG 9 -11.188 5.962 -7.991 1.00 0.00 H -ATOM 151 HH22 ARG 9 -10.918 6.266 -6.330 1.00 0.00 H -ATOM 152 C ARG 9 -5.235 3.980 -12.125 1.00 0.00 C -ATOM 153 O ARG 9 -4.260 4.478 -11.523 1.00 0.00 O -ATOM 154 N CYS 10 -5.852 4.497 -13.213 1.00 0.00 N -ATOM 155 H CYS 10 -6.500 3.988 -13.797 1.00 0.00 H -ATOM 156 CA CYS 10 -5.554 5.884 -13.649 1.00 0.00 C -ATOM 157 HA CYS 10 -4.498 6.031 -13.426 1.00 0.00 H -ATOM 158 CB CYS 10 -5.721 5.937 -15.194 1.00 0.00 C -ATOM 159 HB2 CYS 10 -5.055 5.252 -15.718 1.00 0.00 H -ATOM 160 HB3 CYS 10 -6.773 5.782 -15.434 1.00 0.00 H -ATOM 161 SG CYS 10 -5.308 7.568 -15.925 1.00 0.00 S -ATOM 162 HG CYS 10 -6.258 8.257 -15.286 1.00 0.00 H -ATOM 163 C CYS 10 -6.378 6.937 -12.948 1.00 0.00 C -ATOM 164 O CYS 10 -7.573 6.762 -12.801 1.00 0.00 O -ATOM 165 N ARG 11 -5.729 8.001 -12.539 1.00 0.00 N -ATOM 166 H ARG 11 -4.722 7.938 -12.583 1.00 0.00 H -ATOM 167 CA ARG 11 -6.372 9.165 -11.993 1.00 0.00 C -ATOM 168 HA ARG 11 -7.191 8.727 -11.423 1.00 0.00 H -ATOM 169 CB ARG 11 -5.510 9.950 -10.991 1.00 0.00 C -ATOM 170 HB2 ARG 11 -6.013 10.831 -10.590 1.00 0.00 H -ATOM 171 HB3 ARG 11 -5.200 9.236 -10.228 1.00 0.00 H -ATOM 172 CG ARG 11 -4.137 10.482 -11.441 1.00 0.00 C -ATOM 173 HG2 ARG 11 -3.485 9.676 -11.777 1.00 0.00 H -ATOM 174 HG3 ARG 11 -4.328 11.134 -12.294 1.00 0.00 H -ATOM 175 CD ARG 11 -3.394 11.350 -10.404 1.00 0.00 C -ATOM 176 HD2 ARG 11 -4.029 12.155 -10.036 1.00 0.00 H -ATOM 177 HD3 ARG 11 -3.170 10.647 -9.603 1.00 0.00 H -ATOM 178 NE ARG 11 -2.191 11.897 -10.961 1.00 0.00 N -ATOM 179 HE ARG 11 -1.315 11.620 -10.541 1.00 0.00 H -ATOM 180 CZ ARG 11 -2.106 12.932 -11.801 1.00 0.00 C -ATOM 181 NH1 ARG 11 -3.221 13.487 -12.267 1.00 0.00 N -ATOM 182 HH11 ARG 11 -4.101 13.043 -12.048 1.00 0.00 H -ATOM 183 HH12 ARG 11 -3.190 14.231 -12.949 1.00 0.00 H -ATOM 184 NH2 ARG 11 -1.000 13.490 -12.113 1.00 0.00 N -ATOM 185 HH21 ARG 11 -0.135 13.004 -11.923 1.00 0.00 H -ATOM 186 HH22 ARG 11 -0.910 14.341 -12.650 1.00 0.00 H -ATOM 187 C ARG 11 -7.006 10.118 -13.025 1.00 0.00 C -ATOM 188 O ARG 11 -6.643 10.031 -14.202 1.00 0.00 O -ATOM 189 N PRO 12 -7.891 11.051 -12.686 1.00 0.00 N -ATOM 190 CD PRO 12 -8.661 11.145 -11.446 1.00 0.00 C -ATOM 191 HD2 PRO 12 -8.155 11.290 -10.492 1.00 0.00 H -ATOM 192 HD3 PRO 12 -9.238 10.230 -11.310 1.00 0.00 H -ATOM 193 CG PRO 12 -9.762 12.049 -11.782 1.00 0.00 C -ATOM 194 HG2 PRO 12 -9.819 12.872 -11.068 1.00 0.00 H -ATOM 195 HG3 PRO 12 -10.755 11.601 -11.781 1.00 0.00 H -ATOM 196 CB PRO 12 -9.509 12.740 -13.090 1.00 0.00 C -ATOM 197 HB2 PRO 12 -9.527 13.825 -12.974 1.00 0.00 H -ATOM 198 HB3 PRO 12 -10.311 12.465 -13.774 1.00 0.00 H -ATOM 199 CA PRO 12 -8.171 12.165 -13.595 1.00 0.00 C -ATOM 200 HA PRO 12 -8.325 12.027 -14.665 1.00 0.00 H -ATOM 201 C PRO 12 -7.086 13.227 -13.424 1.00 0.00 C -ATOM 202 O PRO 12 -6.089 12.958 -12.740 1.00 0.00 O -ATOM 203 N PHE 13 -7.204 14.369 -14.049 1.00 0.00 N -ATOM 204 H PHE 13 -8.099 14.624 -14.442 1.00 0.00 H -ATOM 205 CA PHE 13 -6.120 15.460 -14.158 1.00 0.00 C -ATOM 206 HA PHE 13 -5.155 14.954 -14.198 1.00 0.00 H -ATOM 207 CB PHE 13 -6.294 16.291 -15.421 1.00 0.00 C -ATOM 208 HB2 PHE 13 -7.298 16.713 -15.448 1.00 0.00 H -ATOM 209 HB3 PHE 13 -5.560 17.097 -15.432 1.00 0.00 H -ATOM 210 CG PHE 13 -6.069 15.481 -16.707 1.00 0.00 C -ATOM 211 CD1 PHE 13 -4.981 15.843 -17.562 1.00 0.00 C -ATOM 212 HD1 PHE 13 -4.260 16.569 -17.217 1.00 0.00 H -ATOM 213 CE1 PHE 13 -4.840 15.210 -18.814 1.00 0.00 C -ATOM 214 HE1 PHE 13 -4.034 15.427 -19.500 1.00 0.00 H -ATOM 215 CZ PHE 13 -5.748 14.255 -19.225 1.00 0.00 C -ATOM 216 HZ PHE 13 -5.560 13.727 -20.149 1.00 0.00 H -ATOM 217 CE2 PHE 13 -6.851 13.946 -18.453 1.00 0.00 C -ATOM 218 HE2 PHE 13 -7.544 13.173 -18.748 1.00 0.00 H -ATOM 219 CD2 PHE 13 -6.997 14.552 -17.193 1.00 0.00 C -ATOM 220 HD2 PHE 13 -7.856 14.312 -16.584 1.00 0.00 H -ATOM 221 C PHE 13 -6.062 16.403 -12.955 1.00 0.00 C -ATOM 222 O PHE 13 -7.127 16.856 -12.585 1.00 0.00 O -ATOM 223 N ASN 14 -4.859 16.565 -12.358 1.00 0.00 N -ATOM 224 H ASN 14 -4.094 15.967 -12.640 1.00 0.00 H -ATOM 225 CA ASN 14 -4.559 17.535 -11.349 1.00 0.00 C -ATOM 226 HA ASN 14 -5.430 17.794 -10.748 1.00 0.00 H -ATOM 227 CB ASN 14 -3.503 16.966 -10.391 1.00 0.00 C -ATOM 228 HB2 ASN 14 -2.535 16.875 -10.885 1.00 0.00 H -ATOM 229 HB3 ASN 14 -3.162 17.694 -9.655 1.00 0.00 H -ATOM 230 CG ASN 14 -3.859 15.615 -9.735 1.00 0.00 C -ATOM 231 OD1 ASN 14 -4.941 15.085 -9.584 1.00 0.00 O -ATOM 232 ND2 ASN 14 -2.849 14.891 -9.260 1.00 0.00 N -ATOM 233 HD21 ASN 14 -3.039 14.022 -8.782 1.00 0.00 H -ATOM 234 HD22 ASN 14 -1.927 15.129 -9.597 1.00 0.00 H -ATOM 235 C ASN 14 -4.064 18.889 -11.837 1.00 0.00 C -ATOM 236 O ASN 14 -3.972 19.147 -13.063 1.00 0.00 O -ATOM 237 N LEU 15 -3.829 19.840 -10.888 1.00 0.00 N -ATOM 238 H LEU 15 -3.931 19.566 -9.921 1.00 0.00 H -ATOM 239 CA LEU 15 -3.589 21.244 -11.225 1.00 0.00 C -ATOM 240 HA LEU 15 -4.413 21.480 -11.899 1.00 0.00 H -ATOM 241 CB LEU 15 -3.820 22.126 -9.981 1.00 0.00 C -ATOM 242 HB2 LEU 15 -4.709 21.785 -9.453 1.00 0.00 H -ATOM 243 HB3 LEU 15 -2.947 21.909 -9.366 1.00 0.00 H -ATOM 244 CG LEU 15 -3.879 23.703 -9.926 1.00 0.00 C -ATOM 245 HG LEU 15 -3.002 24.005 -10.499 1.00 0.00 H -ATOM 246 CD1 LEU 15 -5.026 24.256 -10.820 1.00 0.00 C -ATOM 247 HD11 LEU 15 -4.982 23.809 -11.813 1.00 0.00 H -ATOM 248 HD12 LEU 15 -5.944 24.008 -10.290 1.00 0.00 H -ATOM 249 HD13 LEU 15 -4.873 25.331 -10.918 1.00 0.00 H -ATOM 250 CD2 LEU 15 -3.877 24.419 -8.582 1.00 0.00 C -ATOM 251 HD21 LEU 15 -2.913 24.238 -8.106 1.00 0.00 H -ATOM 252 HD22 LEU 15 -4.055 25.494 -8.598 1.00 0.00 H -ATOM 253 HD23 LEU 15 -4.675 23.994 -7.972 1.00 0.00 H -ATOM 254 C LEU 15 -2.241 21.498 -11.967 1.00 0.00 C -ATOM 255 O LEU 15 -2.282 22.223 -12.961 1.00 0.00 O -ATOM 256 N ALA 16 -1.119 20.857 -11.672 1.00 0.00 N -ATOM 257 H ALA 16 -1.190 20.355 -10.799 1.00 0.00 H -ATOM 258 CA ALA 16 0.133 20.851 -12.425 1.00 0.00 C -ATOM 259 HA ALA 16 0.690 21.787 -12.442 1.00 0.00 H -ATOM 260 CB ALA 16 0.943 19.717 -11.733 1.00 0.00 C -ATOM 261 HB1 ALA 16 1.229 19.991 -10.718 1.00 0.00 H -ATOM 262 HB2 ALA 16 0.289 18.848 -11.670 1.00 0.00 H -ATOM 263 HB3 ALA 16 1.720 19.562 -12.483 1.00 0.00 H -ATOM 264 C ALA 16 -0.029 20.513 -13.966 1.00 0.00 C -ATOM 265 O ALA 16 0.655 21.039 -14.776 1.00 0.00 O -ATOM 266 N GLU 17 -1.056 19.710 -14.337 1.00 0.00 N -ATOM 267 H GLU 17 -1.722 19.362 -13.662 1.00 0.00 H -ATOM 268 CA GLU 17 -1.287 19.342 -15.746 1.00 0.00 C -ATOM 269 HA GLU 17 -0.309 19.420 -16.222 1.00 0.00 H -ATOM 270 CB GLU 17 -1.930 17.921 -15.839 1.00 0.00 C -ATOM 271 HB2 GLU 17 -2.779 17.973 -15.157 1.00 0.00 H -ATOM 272 HB3 GLU 17 -2.235 17.583 -16.829 1.00 0.00 H -ATOM 273 CG GLU 17 -1.024 16.812 -15.284 1.00 0.00 C -ATOM 274 HG2 GLU 17 -0.901 16.025 -16.029 1.00 0.00 H -ATOM 275 HG3 GLU 17 0.003 17.168 -15.216 1.00 0.00 H -ATOM 276 CD GLU 17 -1.488 16.205 -13.977 1.00 0.00 C -ATOM 277 OE1 GLU 17 -2.680 15.830 -13.851 1.00 0.00 O -ATOM 278 OE2 GLU 17 -0.573 15.893 -13.195 1.00 0.00 O -ATOM 279 C GLU 17 -2.267 20.300 -16.458 1.00 0.00 C -ATOM 280 O GLU 17 -2.066 20.582 -17.615 1.00 0.00 O -ATOM 281 N ARG 18 -3.268 20.810 -15.722 1.00 0.00 N -ATOM 282 H ARG 18 -3.345 20.463 -14.776 1.00 0.00 H -ATOM 283 CA ARG 18 -4.223 21.885 -16.099 1.00 0.00 C -ATOM 284 HA ARG 18 -4.693 21.558 -17.027 1.00 0.00 H -ATOM 285 CB ARG 18 -5.254 22.028 -14.932 1.00 0.00 C -ATOM 286 HB2 ARG 18 -4.801 22.131 -13.944 1.00 0.00 H -ATOM 287 HB3 ARG 18 -5.828 22.948 -15.039 1.00 0.00 H -ATOM 288 CG ARG 18 -6.183 20.769 -14.899 1.00 0.00 C -ATOM 289 HG2 ARG 18 -7.046 20.901 -15.551 1.00 0.00 H -ATOM 290 HG3 ARG 18 -5.659 19.850 -15.163 1.00 0.00 H -ATOM 291 CD ARG 18 -6.947 20.682 -13.518 1.00 0.00 C -ATOM 292 HD2 ARG 18 -7.475 19.729 -13.502 1.00 0.00 H -ATOM 293 HD3 ARG 18 -6.206 20.699 -12.718 1.00 0.00 H -ATOM 294 NE ARG 18 -7.965 21.821 -13.341 1.00 0.00 N -ATOM 295 HE ARG 18 -8.104 22.365 -14.180 1.00 0.00 H -ATOM 296 CZ ARG 18 -8.347 22.496 -12.310 1.00 0.00 C -ATOM 297 NH1 ARG 18 -8.198 22.074 -11.087 1.00 0.00 N -ATOM 298 HH11 ARG 18 -7.861 21.142 -10.896 1.00 0.00 H -ATOM 299 HH12 ARG 18 -8.621 22.659 -10.381 1.00 0.00 H -ATOM 300 NH2 ARG 18 -8.877 23.705 -12.508 1.00 0.00 N -ATOM 301 HH21 ARG 18 -9.070 23.951 -13.468 1.00 0.00 H -ATOM 302 HH22 ARG 18 -9.058 24.366 -11.766 1.00 0.00 H -ATOM 303 C ARG 18 -3.528 23.209 -16.322 1.00 0.00 C -ATOM 304 O ARG 18 -4.021 23.972 -17.156 1.00 0.00 O -ATOM 305 N LYS 19 -2.471 23.532 -15.567 1.00 0.00 N -ATOM 306 H LYS 19 -2.379 22.887 -14.796 1.00 0.00 H -ATOM 307 CA LYS 19 -1.526 24.667 -15.773 1.00 0.00 C -ATOM 308 HA LYS 19 -2.156 25.507 -16.064 1.00 0.00 H -ATOM 309 CB LYS 19 -0.644 24.824 -14.525 1.00 0.00 C -ATOM 310 HB2 LYS 19 -1.281 24.886 -13.643 1.00 0.00 H -ATOM 311 HB3 LYS 19 -0.011 23.951 -14.362 1.00 0.00 H -ATOM 312 CG LYS 19 0.179 26.147 -14.540 1.00 0.00 C -ATOM 313 HG2 LYS 19 0.853 26.155 -15.398 1.00 0.00 H -ATOM 314 HG3 LYS 19 -0.484 27.005 -14.436 1.00 0.00 H -ATOM 315 CD LYS 19 0.998 26.027 -13.250 1.00 0.00 C -ATOM 316 HD2 LYS 19 1.472 26.983 -13.030 1.00 0.00 H -ATOM 317 HD3 LYS 19 0.246 25.800 -12.494 1.00 0.00 H -ATOM 318 CE LYS 19 2.033 24.857 -13.093 1.00 0.00 C -ATOM 319 HE2 LYS 19 2.320 24.840 -12.041 1.00 0.00 H -ATOM 320 HE3 LYS 19 1.596 23.919 -13.438 1.00 0.00 H -ATOM 321 NZ LYS 19 3.183 25.166 -13.975 1.00 0.00 N -ATOM 322 HZ1 LYS 19 3.424 26.143 -14.066 1.00 0.00 H -ATOM 323 HZ2 LYS 19 3.996 24.707 -13.589 1.00 0.00 H -ATOM 324 HZ3 LYS 19 3.112 24.821 -14.921 1.00 0.00 H -ATOM 325 C LYS 19 -0.736 24.405 -17.079 1.00 0.00 C -ATOM 326 O LYS 19 -0.475 25.238 -17.899 1.00 0.00 O -ATOM 327 N ALA 20 -0.345 23.163 -17.349 1.00 0.00 N -ATOM 328 H ALA 20 -0.559 22.492 -16.626 1.00 0.00 H -ATOM 329 CA ALA 20 0.490 22.664 -18.463 1.00 0.00 C -ATOM 330 HA ALA 20 1.185 23.483 -18.646 1.00 0.00 H -ATOM 331 CB ALA 20 1.178 21.318 -18.091 1.00 0.00 C -ATOM 332 HB1 ALA 20 1.807 20.983 -18.915 1.00 0.00 H -ATOM 333 HB2 ALA 20 1.734 21.345 -17.153 1.00 0.00 H -ATOM 334 HB3 ALA 20 0.338 20.648 -17.909 1.00 0.00 H -ATOM 335 C ALA 20 -0.224 22.462 -19.836 1.00 0.00 C -ATOM 336 O ALA 20 0.446 22.171 -20.816 1.00 0.00 O -ATOM 337 N SER 21 -1.575 22.617 -19.929 1.00 0.00 N -ATOM 338 H SER 21 -2.034 22.851 -19.060 1.00 0.00 H -ATOM 339 CA SER 21 -2.479 22.259 -20.995 1.00 0.00 C -ATOM 340 HA SER 21 -3.480 22.217 -20.566 1.00 0.00 H -ATOM 341 CB SER 21 -2.484 23.306 -22.133 1.00 0.00 C -ATOM 342 HB2 SER 21 -1.484 23.495 -22.524 1.00 0.00 H -ATOM 343 HB3 SER 21 -3.141 22.974 -22.936 1.00 0.00 H -ATOM 344 OG SER 21 -3.015 24.490 -21.549 1.00 0.00 O -ATOM 345 HG SER 21 -2.303 25.067 -21.263 1.00 0.00 H -ATOM 346 C SER 21 -2.257 20.874 -21.637 1.00 0.00 C -ATOM 347 O SER 21 -2.565 20.529 -22.769 1.00 0.00 O -ATOM 348 N ALA 22 -1.804 19.969 -20.718 1.00 0.00 N -ATOM 349 H ALA 22 -1.598 20.270 -19.776 1.00 0.00 H -ATOM 350 CA ALA 22 -1.371 18.651 -20.988 1.00 0.00 C -ATOM 351 HA ALA 22 -0.628 18.720 -21.783 1.00 0.00 H -ATOM 352 CB ALA 22 -0.542 18.126 -19.749 1.00 0.00 C -ATOM 353 HB1 ALA 22 0.420 18.638 -19.719 1.00 0.00 H -ATOM 354 HB2 ALA 22 -0.976 18.244 -18.756 1.00 0.00 H -ATOM 355 HB3 ALA 22 -0.178 17.107 -19.871 1.00 0.00 H -ATOM 356 C ALA 22 -2.472 17.684 -21.516 1.00 0.00 C -ATOM 357 O ALA 22 -3.632 17.571 -21.064 1.00 0.00 O -ATOM 358 N HIE 23 -1.988 16.983 -22.561 1.00 0.00 N -ATOM 359 H HIE 23 -1.061 17.277 -22.835 1.00 0.00 H -ATOM 360 CA HIE 23 -2.734 16.042 -23.385 1.00 0.00 C -ATOM 361 HA HIE 23 -3.646 16.585 -23.630 1.00 0.00 H -ATOM 362 CB HIE 23 -1.969 15.646 -24.659 1.00 0.00 C -ATOM 363 HB2 HIE 23 -1.165 14.974 -24.359 1.00 0.00 H -ATOM 364 HB3 HIE 23 -2.564 15.023 -25.328 1.00 0.00 H -ATOM 365 CG HIE 23 -1.438 16.724 -25.524 1.00 0.00 C -ATOM 366 ND1 HIE 23 -0.107 16.943 -25.758 1.00 0.00 N -ATOM 367 CE1 HIE 23 -0.028 18.005 -26.584 1.00 0.00 C -ATOM 368 HE1 HIE 23 0.876 18.379 -27.041 1.00 0.00 H -ATOM 369 NE2 HIE 23 -1.295 18.510 -26.731 1.00 0.00 N -ATOM 370 HE2 HIE 23 -1.477 19.373 -27.224 1.00 0.00 H -ATOM 371 CD2 HIE 23 -2.243 17.669 -26.068 1.00 0.00 C -ATOM 372 HD2 HIE 23 -3.317 17.728 -26.164 1.00 0.00 H -ATOM 373 C HIE 23 -3.044 14.737 -22.646 1.00 0.00 C -ATOM 374 O HIE 23 -2.364 14.297 -21.723 1.00 0.00 O -ATOM 375 N SER 24 -4.135 14.023 -23.054 1.00 0.00 N -ATOM 376 H SER 24 -4.631 14.343 -23.874 1.00 0.00 H -ATOM 377 CA SER 24 -4.558 12.738 -22.449 1.00 0.00 C -ATOM 378 HA SER 24 -4.270 12.734 -21.397 1.00 0.00 H -ATOM 379 CB SER 24 -6.040 12.607 -22.624 1.00 0.00 C -ATOM 380 HB2 SER 24 -6.508 13.544 -22.320 1.00 0.00 H -ATOM 381 HB3 SER 24 -6.332 12.438 -23.660 1.00 0.00 H -ATOM 382 OG SER 24 -6.531 11.483 -21.976 1.00 0.00 O -ATOM 383 HG SER 24 -6.564 10.783 -22.632 1.00 0.00 H -ATOM 384 C SER 24 -3.991 11.535 -23.290 1.00 0.00 C -ATOM 385 O SER 24 -4.187 11.480 -24.478 1.00 0.00 O -ATOM 386 N ILE 25 -3.188 10.691 -22.635 1.00 0.00 N -ATOM 387 H ILE 25 -3.023 10.837 -21.650 1.00 0.00 H -ATOM 388 CA ILE 25 -2.548 9.538 -23.327 1.00 0.00 C -ATOM 389 HA ILE 25 -2.866 9.505 -24.370 1.00 0.00 H -ATOM 390 CB ILE 25 -1.049 9.625 -23.291 1.00 0.00 C -ATOM 391 HB ILE 25 -0.663 8.712 -23.742 1.00 0.00 H -ATOM 392 CG2 ILE 25 -0.550 10.872 -24.144 1.00 0.00 C -ATOM 393 HG21 ILE 25 -0.684 11.797 -23.584 1.00 0.00 H -ATOM 394 HG22 ILE 25 0.427 10.757 -24.611 1.00 0.00 H -ATOM 395 HG23 ILE 25 -1.226 10.958 -24.994 1.00 0.00 H -ATOM 396 CG1 ILE 25 -0.529 9.669 -21.863 1.00 0.00 C -ATOM 397 HG12 ILE 25 -0.846 10.567 -21.333 1.00 0.00 H -ATOM 398 HG13 ILE 25 -1.105 8.970 -21.258 1.00 0.00 H -ATOM 399 CD1 ILE 25 0.954 9.362 -21.782 1.00 0.00 C -ATOM 400 HD11 ILE 25 1.354 9.604 -20.797 1.00 0.00 H -ATOM 401 HD12 ILE 25 1.303 8.345 -21.963 1.00 0.00 H -ATOM 402 HD13 ILE 25 1.489 9.994 -22.489 1.00 0.00 H -ATOM 403 C ILE 25 -3.065 8.182 -22.752 1.00 0.00 C -ATOM 404 O ILE 25 -2.908 7.181 -23.426 1.00 0.00 O -ATOM 405 N VAL 26 -3.604 8.073 -21.503 1.00 0.00 N -ATOM 406 H VAL 26 -3.566 8.861 -20.871 1.00 0.00 H -ATOM 407 CA VAL 26 -4.164 6.856 -20.971 1.00 0.00 C -ATOM 408 HA VAL 26 -3.647 6.096 -21.556 1.00 0.00 H -ATOM 409 CB VAL 26 -3.747 6.610 -19.495 1.00 0.00 C -ATOM 410 HB VAL 26 -4.089 7.491 -18.951 1.00 0.00 H -ATOM 411 CG1 VAL 26 -4.419 5.321 -18.884 1.00 0.00 C -ATOM 412 HG11 VAL 26 -5.509 5.308 -18.916 1.00 0.00 H -ATOM 413 HG12 VAL 26 -4.062 4.478 -19.477 1.00 0.00 H -ATOM 414 HG13 VAL 26 -4.008 5.384 -17.877 1.00 0.00 H -ATOM 415 CG2 VAL 26 -2.172 6.687 -19.359 1.00 0.00 C -ATOM 416 HG21 VAL 26 -1.695 6.219 -20.220 1.00 0.00 H -ATOM 417 HG22 VAL 26 -1.809 7.708 -19.480 1.00 0.00 H -ATOM 418 HG23 VAL 26 -1.809 6.283 -18.414 1.00 0.00 H -ATOM 419 C VAL 26 -5.625 6.683 -21.274 1.00 0.00 C -ATOM 420 O VAL 26 -6.418 7.635 -21.207 1.00 0.00 O -ATOM 421 N GLU 27 -6.002 5.454 -21.592 1.00 0.00 N -ATOM 422 H GLU 27 -5.290 4.760 -21.769 1.00 0.00 H -ATOM 423 CA GLU 27 -7.373 5.024 -21.759 1.00 0.00 C -ATOM 424 HA GLU 27 -8.083 5.603 -21.169 1.00 0.00 H -ATOM 425 CB GLU 27 -7.835 5.126 -23.266 1.00 0.00 C -ATOM 426 HB2 GLU 27 -7.769 6.135 -23.673 1.00 0.00 H -ATOM 427 HB3 GLU 27 -7.075 4.613 -23.854 1.00 0.00 H -ATOM 428 CG GLU 27 -9.231 4.579 -23.628 1.00 0.00 C -ATOM 429 HG2 GLU 27 -9.189 4.482 -24.713 1.00 0.00 H -ATOM 430 HG3 GLU 27 -9.350 3.551 -23.284 1.00 0.00 H -ATOM 431 CD GLU 27 -10.288 5.565 -23.079 1.00 0.00 C -ATOM 432 OE1 GLU 27 -10.309 6.659 -23.685 1.00 0.00 O -ATOM 433 OE2 GLU 27 -11.032 5.251 -22.125 1.00 0.00 O -ATOM 434 C GLU 27 -7.520 3.583 -21.252 1.00 0.00 C -ATOM 435 O GLU 27 -6.511 2.784 -21.350 1.00 0.00 O -ATOM 436 N CYS 28 -8.712 3.187 -20.758 1.00 0.00 N -ATOM 437 H CYS 28 -9.441 3.885 -20.750 1.00 0.00 H -ATOM 438 CA CYS 28 -9.001 1.881 -20.096 1.00 0.00 C -ATOM 439 HA CYS 28 -8.207 1.188 -20.371 1.00 0.00 H -ATOM 440 CB CYS 28 -9.036 2.122 -18.611 1.00 0.00 C -ATOM 441 HB2 CYS 28 -9.454 3.111 -18.429 1.00 0.00 H -ATOM 442 HB3 CYS 28 -9.626 1.343 -18.130 1.00 0.00 H -ATOM 443 SG CYS 28 -7.366 2.322 -17.914 1.00 0.00 S -ATOM 444 HG CYS 28 -7.291 3.655 -17.938 1.00 0.00 H -ATOM 445 C CYS 28 -10.348 1.298 -20.464 1.00 0.00 C -ATOM 446 O CYS 28 -11.392 1.998 -20.466 1.00 0.00 O -ATOM 447 N ASP 29 -10.288 -0.039 -20.670 1.00 0.00 N -ATOM 448 H ASP 29 -9.413 -0.543 -20.699 1.00 0.00 H -ATOM 449 CA ASP 29 -11.469 -0.850 -21.104 1.00 0.00 C -ATOM 450 HA ASP 29 -12.229 -0.148 -21.446 1.00 0.00 H -ATOM 451 CB ASP 29 -11.133 -1.391 -22.482 1.00 0.00 C -ATOM 452 HB2 ASP 29 -10.728 -0.681 -23.203 1.00 0.00 H -ATOM 453 HB3 ASP 29 -10.289 -2.076 -22.385 1.00 0.00 H -ATOM 454 CG ASP 29 -12.232 -2.189 -23.098 1.00 0.00 C -ATOM 455 OD1 ASP 29 -12.124 -2.508 -24.337 1.00 0.00 O -ATOM 456 OD2 ASP 29 -13.136 -2.724 -22.407 1.00 0.00 O -ATOM 457 C ASP 29 -11.970 -1.894 -20.055 1.00 0.00 C -ATOM 458 O ASP 29 -11.362 -2.995 -19.956 1.00 0.00 O -ATOM 459 N PRO 30 -13.111 -1.603 -19.388 1.00 0.00 N -ATOM 460 CD PRO 30 -13.847 -0.335 -19.378 1.00 0.00 C -ATOM 461 HD2 PRO 30 -14.213 -0.041 -20.361 1.00 0.00 H -ATOM 462 HD3 PRO 30 -13.352 0.499 -18.879 1.00 0.00 H -ATOM 463 CG PRO 30 -15.193 -0.657 -18.658 1.00 0.00 C -ATOM 464 HG2 PRO 30 -15.819 -1.193 -19.371 1.00 0.00 H -ATOM 465 HG3 PRO 30 -15.694 0.156 -18.131 1.00 0.00 H -ATOM 466 CB PRO 30 -14.825 -1.790 -17.697 1.00 0.00 C -ATOM 467 HB2 PRO 30 -15.671 -2.451 -17.514 1.00 0.00 H -ATOM 468 HB3 PRO 30 -14.425 -1.348 -16.784 1.00 0.00 H -ATOM 469 CA PRO 30 -13.646 -2.522 -18.395 1.00 0.00 C -ATOM 470 HA PRO 30 -12.885 -2.794 -17.662 1.00 0.00 H -ATOM 471 C PRO 30 -14.118 -3.907 -18.946 1.00 0.00 C -ATOM 472 O PRO 30 -13.962 -4.874 -18.185 1.00 0.00 O -ATOM 473 N VAL 31 -14.602 -3.958 -20.220 1.00 0.00 N -ATOM 474 H VAL 31 -14.630 -3.114 -20.773 1.00 0.00 H -ATOM 475 CA VAL 31 -15.039 -5.173 -20.850 1.00 0.00 C -ATOM 476 HA VAL 31 -15.697 -5.684 -20.147 1.00 0.00 H -ATOM 477 CB VAL 31 -15.796 -4.781 -22.138 1.00 0.00 C -ATOM 478 HB VAL 31 -15.130 -4.142 -22.718 1.00 0.00 H -ATOM 479 CG1 VAL 31 -16.273 -5.911 -23.001 1.00 0.00 C -ATOM 480 HG11 VAL 31 -15.520 -6.446 -23.581 1.00 0.00 H -ATOM 481 HG12 VAL 31 -16.838 -6.638 -22.419 1.00 0.00 H -ATOM 482 HG13 VAL 31 -16.968 -5.544 -23.756 1.00 0.00 H -ATOM 483 CG2 VAL 31 -16.999 -3.930 -21.826 1.00 0.00 C -ATOM 484 HG21 VAL 31 -16.714 -3.144 -21.126 1.00 0.00 H -ATOM 485 HG22 VAL 31 -17.428 -3.457 -22.710 1.00 0.00 H -ATOM 486 HG23 VAL 31 -17.775 -4.536 -21.359 1.00 0.00 H -ATOM 487 C VAL 31 -13.939 -6.178 -21.178 1.00 0.00 C -ATOM 488 O VAL 31 -14.223 -7.363 -21.066 1.00 0.00 O -ATOM 489 N ARG 32 -12.692 -5.727 -21.491 1.00 0.00 N -ATOM 490 H ARG 32 -12.618 -4.725 -21.584 1.00 0.00 H -ATOM 491 CA ARG 32 -11.376 -6.398 -21.771 1.00 0.00 C -ATOM 492 HA ARG 32 -11.606 -7.404 -22.122 1.00 0.00 H -ATOM 493 CB ARG 32 -10.708 -5.708 -22.947 1.00 0.00 C -ATOM 494 HB2 ARG 32 -10.466 -4.703 -22.599 1.00 0.00 H -ATOM 495 HB3 ARG 32 -9.759 -6.215 -23.118 1.00 0.00 H -ATOM 496 CG ARG 32 -11.548 -5.700 -24.246 1.00 0.00 C -ATOM 497 HG2 ARG 32 -11.855 -6.703 -24.546 1.00 0.00 H -ATOM 498 HG3 ARG 32 -12.386 -5.059 -23.971 1.00 0.00 H -ATOM 499 CD ARG 32 -10.700 -4.993 -25.384 1.00 0.00 C -ATOM 500 HD2 ARG 32 -11.349 -4.644 -26.188 1.00 0.00 H -ATOM 501 HD3 ARG 32 -10.367 -4.103 -24.852 1.00 0.00 H -ATOM 502 NE ARG 32 -9.496 -5.849 -25.775 1.00 0.00 N -ATOM 503 HE ARG 32 -8.597 -5.482 -25.496 1.00 0.00 H -ATOM 504 CZ ARG 32 -9.460 -6.974 -26.522 1.00 0.00 C -ATOM 505 NH1 ARG 32 -10.480 -7.435 -27.108 1.00 0.00 N -ATOM 506 HH11 ARG 32 -11.327 -6.902 -26.968 1.00 0.00 H -ATOM 507 HH12 ARG 32 -10.486 -8.346 -27.543 1.00 0.00 H -ATOM 508 NH2 ARG 32 -8.316 -7.565 -26.811 1.00 0.00 N -ATOM 509 HH21 ARG 32 -7.450 -7.183 -26.460 1.00 0.00 H -ATOM 510 HH22 ARG 32 -8.302 -8.330 -27.469 1.00 0.00 H -ATOM 511 C ARG 32 -10.441 -6.530 -20.571 1.00 0.00 C -ATOM 512 O ARG 32 -9.528 -7.335 -20.587 1.00 0.00 O -ATOM 513 N LYS 33 -10.765 -5.729 -19.580 1.00 0.00 N -ATOM 514 H LYS 33 -11.579 -5.131 -19.604 1.00 0.00 H -ATOM 515 CA LYS 33 -9.808 -5.439 -18.482 1.00 0.00 C -ATOM 516 HA LYS 33 -10.186 -4.604 -17.892 1.00 0.00 H -ATOM 517 CB LYS 33 -9.777 -6.526 -17.434 1.00 0.00 C -ATOM 518 HB2 LYS 33 -9.600 -7.515 -17.858 1.00 0.00 H -ATOM 519 HB3 LYS 33 -8.981 -6.337 -16.714 1.00 0.00 H -ATOM 520 CG LYS 33 -11.098 -6.595 -16.664 1.00 0.00 C -ATOM 521 HG2 LYS 33 -11.177 -5.605 -16.214 1.00 0.00 H -ATOM 522 HG3 LYS 33 -11.894 -6.657 -17.406 1.00 0.00 H -ATOM 523 CD LYS 33 -11.462 -7.481 -15.618 1.00 0.00 C -ATOM 524 HD2 LYS 33 -10.908 -7.158 -14.737 1.00 0.00 H -ATOM 525 HD3 LYS 33 -12.491 -7.357 -15.280 1.00 0.00 H -ATOM 526 CE LYS 33 -11.157 -8.846 -16.068 1.00 0.00 C -ATOM 527 HE2 LYS 33 -11.878 -9.150 -16.828 1.00 0.00 H -ATOM 528 HE3 LYS 33 -10.180 -8.790 -16.545 1.00 0.00 H -ATOM 529 NZ LYS 33 -11.030 -9.690 -14.948 1.00 0.00 N -ATOM 530 HZ1 LYS 33 -10.308 -10.331 -15.241 1.00 0.00 H -ATOM 531 HZ2 LYS 33 -10.653 -9.221 -14.137 1.00 0.00 H -ATOM 532 HZ3 LYS 33 -11.804 -10.296 -14.712 1.00 0.00 H -ATOM 533 C LYS 33 -8.370 -5.053 -19.050 1.00 0.00 C -ATOM 534 O LYS 33 -7.350 -5.610 -18.740 1.00 0.00 O -ATOM 535 N GLU 34 -8.463 -4.072 -19.938 1.00 0.00 N -ATOM 536 H GLU 34 -9.317 -3.591 -20.181 1.00 0.00 H -ATOM 537 CA GLU 34 -7.271 -3.588 -20.644 1.00 0.00 C -ATOM 538 HA GLU 34 -6.400 -4.098 -20.233 1.00 0.00 H -ATOM 539 CB GLU 34 -7.495 -3.855 -22.112 1.00 0.00 C -ATOM 540 HB2 GLU 34 -7.619 -4.926 -22.273 1.00 0.00 H -ATOM 541 HB3 GLU 34 -8.327 -3.234 -22.444 1.00 0.00 H -ATOM 542 CG GLU 34 -6.345 -3.557 -23.064 1.00 0.00 C -ATOM 543 HG2 GLU 34 -5.983 -2.544 -22.886 1.00 0.00 H -ATOM 544 HG3 GLU 34 -5.553 -4.299 -22.965 1.00 0.00 H -ATOM 545 CD GLU 34 -6.747 -3.761 -24.470 1.00 0.00 C -ATOM 546 OE1 GLU 34 -7.197 -4.883 -24.791 1.00 0.00 O -ATOM 547 OE2 GLU 34 -6.643 -2.864 -25.357 1.00 0.00 O -ATOM 548 C GLU 34 -6.982 -2.139 -20.508 1.00 0.00 C -ATOM 549 O GLU 34 -7.874 -1.276 -20.573 1.00 0.00 O -ATOM 550 N VAL 35 -5.673 -1.784 -20.348 1.00 0.00 N -ATOM 551 H VAL 35 -4.959 -2.454 -20.100 1.00 0.00 H -ATOM 552 CA VAL 35 -5.188 -0.418 -20.506 1.00 0.00 C -ATOM 553 HA VAL 35 -6.017 0.289 -20.544 1.00 0.00 H -ATOM 554 CB VAL 35 -4.359 0.057 -19.259 1.00 0.00 C -ATOM 555 HB VAL 35 -5.148 -0.018 -18.510 1.00 0.00 H -ATOM 556 CG1 VAL 35 -3.285 -0.957 -18.930 1.00 0.00 C -ATOM 557 HG11 VAL 35 -3.568 -1.993 -18.741 1.00 0.00 H -ATOM 558 HG12 VAL 35 -2.495 -1.010 -19.679 1.00 0.00 H -ATOM 559 HG13 VAL 35 -2.831 -0.563 -18.020 1.00 0.00 H -ATOM 560 CG2 VAL 35 -3.772 1.405 -19.340 1.00 0.00 C -ATOM 561 HG21 VAL 35 -3.437 1.696 -18.344 1.00 0.00 H -ATOM 562 HG22 VAL 35 -3.009 1.414 -20.117 1.00 0.00 H -ATOM 563 HG23 VAL 35 -4.589 2.097 -19.544 1.00 0.00 H -ATOM 564 C VAL 35 -4.345 -0.270 -21.735 1.00 0.00 C -ATOM 565 O VAL 35 -3.550 -1.139 -21.998 1.00 0.00 O -ATOM 566 N SER 36 -4.623 0.892 -22.404 1.00 0.00 N -ATOM 567 H SER 36 -5.369 1.514 -22.127 1.00 0.00 H -ATOM 568 CA SER 36 -3.775 1.507 -23.470 1.00 0.00 C -ATOM 569 HA SER 36 -3.009 0.749 -23.630 1.00 0.00 H -ATOM 570 CB SER 36 -4.437 1.720 -24.863 1.00 0.00 C -ATOM 571 HB2 SER 36 -3.652 1.844 -25.608 1.00 0.00 H -ATOM 572 HB3 SER 36 -5.016 0.821 -25.077 1.00 0.00 H -ATOM 573 OG SER 36 -5.220 2.907 -24.918 1.00 0.00 O -ATOM 574 HG SER 36 -6.048 2.595 -24.547 1.00 0.00 H -ATOM 575 C SER 36 -3.085 2.802 -23.156 1.00 0.00 C -ATOM 576 O SER 36 -3.559 3.521 -22.258 1.00 0.00 O -ATOM 577 N VAL 37 -1.905 3.061 -23.773 1.00 0.00 N -ATOM 578 H VAL 37 -1.633 2.298 -24.377 1.00 0.00 H -ATOM 579 CA VAL 37 -1.080 4.227 -23.673 1.00 0.00 C -ATOM 580 HA VAL 37 -1.642 5.083 -23.299 1.00 0.00 H -ATOM 581 CB VAL 37 0.097 3.949 -22.714 1.00 0.00 C -ATOM 582 HB VAL 37 0.655 3.095 -23.098 1.00 0.00 H -ATOM 583 CG1 VAL 37 0.963 5.244 -22.565 1.00 0.00 C -ATOM 584 HG11 VAL 37 1.245 5.695 -23.515 1.00 0.00 H -ATOM 585 HG12 VAL 37 0.289 5.928 -22.051 1.00 0.00 H -ATOM 586 HG13 VAL 37 1.772 5.135 -21.842 1.00 0.00 H -ATOM 587 CG2 VAL 37 -0.435 3.392 -21.368 1.00 0.00 C -ATOM 588 HG21 VAL 37 -0.753 2.350 -21.388 1.00 0.00 H -ATOM 589 HG22 VAL 37 0.317 3.418 -20.580 1.00 0.00 H -ATOM 590 HG23 VAL 37 -1.258 3.898 -20.864 1.00 0.00 H -ATOM 591 C VAL 37 -0.496 4.626 -25.007 1.00 0.00 C -ATOM 592 O VAL 37 0.336 3.920 -25.598 1.00 0.00 O -ATOM 593 N ARG 38 -1.045 5.739 -25.611 1.00 0.00 N -ATOM 594 H ARG 38 -1.753 6.205 -25.061 1.00 0.00 H -ATOM 595 CA ARG 38 -0.558 6.480 -26.764 1.00 0.00 C -ATOM 596 HA ARG 38 -0.586 5.935 -27.708 1.00 0.00 H -ATOM 597 CB ARG 38 -1.500 7.649 -26.969 1.00 0.00 C -ATOM 598 HB2 ARG 38 -2.485 7.321 -26.637 1.00 0.00 H -ATOM 599 HB3 ARG 38 -1.192 8.410 -26.253 1.00 0.00 H -ATOM 600 CG ARG 38 -1.549 8.238 -28.388 1.00 0.00 C -ATOM 601 HG2 ARG 38 -0.573 8.456 -28.821 1.00 0.00 H -ATOM 602 HG3 ARG 38 -1.932 7.528 -29.120 1.00 0.00 H -ATOM 603 CD ARG 38 -2.518 9.435 -28.394 1.00 0.00 C -ATOM 604 HD2 ARG 38 -3.456 9.222 -27.882 1.00 0.00 H -ATOM 605 HD3 ARG 38 -2.088 10.359 -28.006 1.00 0.00 H -ATOM 606 NE ARG 38 -2.962 9.816 -29.767 1.00 0.00 N -ATOM 607 HE ARG 38 -2.436 9.290 -30.450 1.00 0.00 H -ATOM 608 CZ ARG 38 -3.922 10.573 -30.245 1.00 0.00 C -ATOM 609 NH1 ARG 38 -4.656 11.340 -29.534 1.00 0.00 N -ATOM 610 HH11 ARG 38 -4.567 11.269 -28.530 1.00 0.00 H -ATOM 611 HH12 ARG 38 -5.509 11.766 -29.867 1.00 0.00 H -ATOM 612 NH2 ARG 38 -4.093 10.614 -31.556 1.00 0.00 N -ATOM 613 HH21 ARG 38 -3.305 10.296 -32.102 1.00 0.00 H -ATOM 614 HH22 ARG 38 -4.945 10.895 -32.023 1.00 0.00 H -ATOM 615 C ARG 38 0.924 6.801 -26.677 1.00 0.00 C -ATOM 616 O ARG 38 1.362 7.375 -25.642 1.00 0.00 O -ATOM 617 N THR 39 1.731 6.612 -27.738 1.00 0.00 N -ATOM 618 H THR 39 1.382 6.143 -28.563 1.00 0.00 H -ATOM 619 CA THR 39 3.166 6.885 -27.695 1.00 0.00 C -ATOM 620 HA THR 39 3.556 6.485 -26.759 1.00 0.00 H -ATOM 621 CB THR 39 3.789 6.061 -28.790 1.00 0.00 C -ATOM 622 HB THR 39 4.830 6.337 -28.954 1.00 0.00 H -ATOM 623 CG2 THR 39 3.763 4.565 -28.413 1.00 0.00 C -ATOM 624 HG21 THR 39 4.333 4.082 -29.206 1.00 0.00 H -ATOM 625 HG22 THR 39 4.337 4.374 -27.507 1.00 0.00 H -ATOM 626 HG23 THR 39 2.761 4.152 -28.296 1.00 0.00 H -ATOM 627 OG1 THR 39 3.079 6.143 -30.019 1.00 0.00 O -ATOM 628 HG1 THR 39 3.478 6.660 -30.723 1.00 0.00 H -ATOM 629 C THR 39 3.509 8.395 -27.776 1.00 0.00 C -ATOM 630 O THR 39 4.705 8.710 -27.834 1.00 0.00 O -ATOM 631 N GLY 40 2.538 9.258 -27.829 1.00 0.00 N -ATOM 632 H GLY 40 1.581 8.945 -27.915 1.00 0.00 H -ATOM 633 CA GLY 40 2.685 10.717 -27.720 1.00 0.00 C -ATOM 634 HA2 GLY 40 3.364 11.038 -26.931 1.00 0.00 H -ATOM 635 HA3 GLY 40 3.036 11.171 -28.648 1.00 0.00 H -ATOM 636 C GLY 40 1.325 11.390 -27.603 1.00 0.00 C -ATOM 637 O GLY 40 0.296 10.739 -27.706 1.00 0.00 O -ATOM 638 N GLY 41 1.353 12.701 -27.247 1.00 0.00 N -ATOM 639 H GLY 41 2.244 13.175 -27.243 1.00 0.00 H -ATOM 640 CA GLY 41 0.157 13.547 -27.050 1.00 0.00 C -ATOM 641 HA2 GLY 41 -0.268 13.372 -26.062 1.00 0.00 H -ATOM 642 HA3 GLY 41 0.561 14.560 -27.039 1.00 0.00 H -ATOM 643 C GLY 41 -0.954 13.522 -28.155 1.00 0.00 C -ATOM 644 O GLY 41 -2.175 13.575 -27.967 1.00 0.00 O -ATOM 645 N LEU 42 -0.564 13.292 -29.421 1.00 0.00 N -ATOM 646 H LEU 42 0.436 13.256 -29.562 1.00 0.00 H -ATOM 647 CA LEU 42 -1.280 13.271 -30.653 1.00 0.00 C -ATOM 648 HA LEU 42 -2.276 12.945 -30.352 1.00 0.00 H -ATOM 649 CB LEU 42 -1.244 14.693 -31.345 1.00 0.00 C -ATOM 650 HB2 LEU 42 -0.183 14.917 -31.452 1.00 0.00 H -ATOM 651 HB3 LEU 42 -1.733 14.746 -32.319 1.00 0.00 H -ATOM 652 CG LEU 42 -1.697 15.918 -30.447 1.00 0.00 C -ATOM 653 HG LEU 42 -1.302 15.740 -29.447 1.00 0.00 H -ATOM 654 CD1 LEU 42 -1.198 17.265 -30.921 1.00 0.00 C -ATOM 655 HD11 LEU 42 -0.126 17.132 -31.069 1.00 0.00 H -ATOM 656 HD12 LEU 42 -1.635 17.575 -31.870 1.00 0.00 H -ATOM 657 HD13 LEU 42 -1.447 18.109 -30.278 1.00 0.00 H -ATOM 658 CD2 LEU 42 -3.257 16.059 -30.473 1.00 0.00 C -ATOM 659 HD21 LEU 42 -3.572 15.824 -31.490 1.00 0.00 H -ATOM 660 HD22 LEU 42 -3.690 15.275 -29.852 1.00 0.00 H -ATOM 661 HD23 LEU 42 -3.646 16.991 -30.063 1.00 0.00 H -ATOM 662 C LEU 42 -0.824 12.122 -31.598 1.00 0.00 C -ATOM 663 O LEU 42 -1.243 12.047 -32.739 1.00 0.00 O -ATOM 664 N ALA 43 0.043 11.156 -31.121 1.00 0.00 N -ATOM 665 H ALA 43 0.217 11.087 -30.128 1.00 0.00 H -ATOM 666 CA ALA 43 0.507 9.971 -31.895 1.00 0.00 C -ATOM 667 HA ALA 43 1.132 10.355 -32.701 1.00 0.00 H -ATOM 668 CB ALA 43 1.413 9.180 -30.991 1.00 0.00 C -ATOM 669 HB1 ALA 43 1.693 8.291 -31.556 1.00 0.00 H -ATOM 670 HB2 ALA 43 2.264 9.791 -30.688 1.00 0.00 H -ATOM 671 HB3 ALA 43 0.946 8.723 -30.118 1.00 0.00 H -ATOM 672 C ALA 43 -0.573 9.134 -32.546 1.00 0.00 C -ATOM 673 O ALA 43 -1.737 9.244 -32.262 1.00 0.00 O -ATOM 674 N ASP 44 -0.138 8.356 -33.573 1.00 0.00 N -ATOM 675 H ASP 44 0.830 8.459 -33.841 1.00 0.00 H -ATOM 676 CA ASP 44 -1.001 7.336 -34.334 1.00 0.00 C -ATOM 677 HA ASP 44 -1.767 7.768 -34.978 1.00 0.00 H -ATOM 678 CB ASP 44 -0.080 6.557 -35.323 1.00 0.00 C -ATOM 679 HB2 ASP 44 0.230 7.121 -36.202 1.00 0.00 H -ATOM 680 HB3 ASP 44 0.889 6.319 -34.884 1.00 0.00 H -ATOM 681 CG ASP 44 -0.737 5.195 -35.876 1.00 0.00 C -ATOM 682 OD1 ASP 44 -1.989 5.070 -36.020 1.00 0.00 O -ATOM 683 OD2 ASP 44 0.024 4.244 -36.174 1.00 0.00 O -ATOM 684 C ASP 44 -1.719 6.442 -33.336 1.00 0.00 C -ATOM 685 O ASP 44 -1.050 5.618 -32.727 1.00 0.00 O -ATOM 686 N LYS 45 -3.012 6.609 -33.240 1.00 0.00 N -ATOM 687 H LYS 45 -3.462 7.293 -33.831 1.00 0.00 H -ATOM 688 CA LYS 45 -3.876 5.671 -32.465 1.00 0.00 C -ATOM 689 HA LYS 45 -3.681 5.823 -31.404 1.00 0.00 H -ATOM 690 CB LYS 45 -5.401 5.988 -32.740 1.00 0.00 C -ATOM 691 HB2 LYS 45 -5.637 7.036 -32.553 1.00 0.00 H -ATOM 692 HB3 LYS 45 -5.557 5.771 -33.796 1.00 0.00 H -ATOM 693 CG LYS 45 -6.457 5.148 -31.919 1.00 0.00 C -ATOM 694 HG2 LYS 45 -6.454 4.116 -32.272 1.00 0.00 H -ATOM 695 HG3 LYS 45 -6.236 5.124 -30.852 1.00 0.00 H -ATOM 696 CD LYS 45 -7.941 5.664 -32.103 1.00 0.00 C -ATOM 697 HD2 LYS 45 -7.926 6.727 -31.862 1.00 0.00 H -ATOM 698 HD3 LYS 45 -8.273 5.688 -33.142 1.00 0.00 H -ATOM 699 CE LYS 45 -9.034 4.877 -31.336 1.00 0.00 C -ATOM 700 HE2 LYS 45 -9.329 3.965 -31.855 1.00 0.00 H -ATOM 701 HE3 LYS 45 -8.742 4.610 -30.321 1.00 0.00 H -ATOM 702 NZ LYS 45 -10.245 5.698 -31.336 1.00 0.00 N -ATOM 703 HZ1 LYS 45 -11.033 5.096 -31.526 1.00 0.00 H -ATOM 704 HZ2 LYS 45 -10.387 6.177 -30.457 1.00 0.00 H -ATOM 705 HZ3 LYS 45 -10.212 6.417 -32.045 1.00 0.00 H -ATOM 706 C LYS 45 -3.581 4.158 -32.619 1.00 0.00 C -ATOM 707 O LYS 45 -3.543 3.441 -31.595 1.00 0.00 O -ATOM 708 N SER 46 -3.294 3.600 -33.862 1.00 0.00 N -ATOM 709 H SER 46 -3.223 4.284 -34.602 1.00 0.00 H -ATOM 710 CA SER 46 -3.048 2.192 -34.161 1.00 0.00 C -ATOM 711 HA SER 46 -3.683 1.678 -33.440 1.00 0.00 H -ATOM 712 CB SER 46 -3.402 1.772 -35.614 1.00 0.00 C -ATOM 713 HB2 SER 46 -3.429 0.686 -35.711 1.00 0.00 H -ATOM 714 HB3 SER 46 -4.396 2.092 -35.926 1.00 0.00 H -ATOM 715 OG SER 46 -2.372 2.297 -36.497 1.00 0.00 O -ATOM 716 HG SER 46 -2.178 3.196 -36.219 1.00 0.00 H -ATOM 717 C SER 46 -1.560 1.751 -33.880 1.00 0.00 C -ATOM 718 O SER 46 -1.076 0.631 -34.061 1.00 0.00 O -ATOM 719 N SER 47 -0.753 2.664 -33.287 1.00 0.00 N -ATOM 720 H SER 47 -1.054 3.621 -33.175 1.00 0.00 H -ATOM 721 CA SER 47 0.557 2.374 -32.777 1.00 0.00 C -ATOM 722 HA SER 47 0.853 1.360 -33.047 1.00 0.00 H -ATOM 723 CB SER 47 1.606 3.317 -33.399 1.00 0.00 C -ATOM 724 HB2 SER 47 1.385 4.379 -33.291 1.00 0.00 H -ATOM 725 HB3 SER 47 2.540 3.185 -32.854 1.00 0.00 H -ATOM 726 OG SER 47 1.629 2.904 -34.752 1.00 0.00 O -ATOM 727 HG SER 47 0.909 3.322 -35.231 1.00 0.00 H -ATOM 728 C SER 47 0.548 2.605 -31.202 1.00 0.00 C -ATOM 729 O SER 47 1.614 2.672 -30.641 1.00 0.00 O -ATOM 730 N ARG 48 -0.548 2.576 -30.442 1.00 0.00 N -ATOM 731 H ARG 48 -1.344 2.356 -31.024 1.00 0.00 H -ATOM 732 CA ARG 48 -0.567 2.578 -28.927 1.00 0.00 C -ATOM 733 HA ARG 48 0.142 3.342 -28.609 1.00 0.00 H -ATOM 734 CB ARG 48 -1.940 2.887 -28.345 1.00 0.00 C -ATOM 735 HB2 ARG 48 -1.888 3.096 -27.277 1.00 0.00 H -ATOM 736 HB3 ARG 48 -2.406 3.749 -28.824 1.00 0.00 H -ATOM 737 CG ARG 48 -2.889 1.675 -28.552 1.00 0.00 C -ATOM 738 HG2 ARG 48 -2.729 1.295 -29.561 1.00 0.00 H -ATOM 739 HG3 ARG 48 -2.760 0.837 -27.866 1.00 0.00 H -ATOM 740 CD ARG 48 -4.357 2.145 -28.504 1.00 0.00 C -ATOM 741 HD2 ARG 48 -4.661 2.391 -27.486 1.00 0.00 H -ATOM 742 HD3 ARG 48 -4.434 2.990 -29.188 1.00 0.00 H -ATOM 743 NE ARG 48 -5.242 1.021 -28.820 1.00 0.00 N -ATOM 744 HE ARG 48 -5.428 0.430 -28.023 1.00 0.00 H -ATOM 745 CZ ARG 48 -5.770 0.715 -29.968 1.00 0.00 C -ATOM 746 NH1 ARG 48 -5.483 1.391 -31.078 1.00 0.00 N -ATOM 747 HH11 ARG 48 -4.917 2.213 -30.921 1.00 0.00 H -ATOM 748 HH12 ARG 48 -5.939 1.198 -31.959 1.00 0.00 H -ATOM 749 NH2 ARG 48 -6.566 -0.338 -30.033 1.00 0.00 N -ATOM 750 HH21 ARG 48 -7.096 -0.708 -29.256 1.00 0.00 H -ATOM 751 HH22 ARG 48 -6.906 -0.540 -30.962 1.00 0.00 H -ATOM 752 C ARG 48 0.046 1.312 -28.295 1.00 0.00 C -ATOM 753 O ARG 48 0.111 0.293 -28.953 1.00 0.00 O -ATOM 754 N LYS 49 0.450 1.411 -27.042 1.00 0.00 N -ATOM 755 H LYS 49 0.266 2.280 -26.561 1.00 0.00 H -ATOM 756 CA LYS 49 0.859 0.257 -26.248 1.00 0.00 C -ATOM 757 HA LYS 49 1.399 -0.506 -26.811 1.00 0.00 H -ATOM 758 CB LYS 49 1.888 0.590 -25.100 1.00 0.00 C -ATOM 759 HB2 LYS 49 1.227 0.935 -24.306 1.00 0.00 H -ATOM 760 HB3 LYS 49 2.376 -0.323 -24.759 1.00 0.00 H -ATOM 761 CG LYS 49 3.006 1.578 -25.279 1.00 0.00 C -ATOM 762 HG2 LYS 49 2.480 2.459 -25.649 1.00 0.00 H -ATOM 763 HG3 LYS 49 3.397 1.719 -24.271 1.00 0.00 H -ATOM 764 CD LYS 49 4.117 1.300 -26.308 1.00 0.00 C -ATOM 765 HD2 LYS 49 3.746 1.403 -27.327 1.00 0.00 H -ATOM 766 HD3 LYS 49 4.841 2.085 -26.089 1.00 0.00 H -ATOM 767 CE LYS 49 4.930 0.037 -25.988 1.00 0.00 C -ATOM 768 HE2 LYS 49 5.256 0.267 -24.974 1.00 0.00 H -ATOM 769 HE3 LYS 49 4.216 -0.783 -25.925 1.00 0.00 H -ATOM 770 NZ LYS 49 5.998 -0.055 -27.095 1.00 0.00 N -ATOM 771 HZ1 LYS 49 6.646 -0.816 -26.950 1.00 0.00 H -ATOM 772 HZ2 LYS 49 5.622 -0.124 -28.031 1.00 0.00 H -ATOM 773 HZ3 LYS 49 6.608 0.749 -27.102 1.00 0.00 H -ATOM 774 C LYS 49 -0.403 -0.323 -25.585 1.00 0.00 C -ATOM 775 O LYS 49 -1.305 0.436 -25.329 1.00 0.00 O -ATOM 776 N THR 50 -0.474 -1.623 -25.253 1.00 0.00 N -ATOM 777 H THR 50 0.381 -2.136 -25.409 1.00 0.00 H -ATOM 778 CA THR 50 -1.640 -2.257 -24.750 1.00 0.00 C -ATOM 779 HA THR 50 -2.214 -1.442 -24.310 1.00 0.00 H -ATOM 780 CB THR 50 -2.436 -2.947 -25.864 1.00 0.00 C -ATOM 781 HB THR 50 -1.773 -3.617 -26.412 1.00 0.00 H -ATOM 782 CG2 THR 50 -3.639 -3.753 -25.306 1.00 0.00 C -ATOM 783 HG21 THR 50 -4.242 -3.958 -26.191 1.00 0.00 H -ATOM 784 HG22 THR 50 -3.136 -4.676 -25.020 1.00 0.00 H -ATOM 785 HG23 THR 50 -4.050 -3.255 -24.427 1.00 0.00 H -ATOM 786 OG1 THR 50 -2.969 -1.977 -26.618 1.00 0.00 O -ATOM 787 HG1 THR 50 -2.429 -1.919 -27.409 1.00 0.00 H -ATOM 788 C THR 50 -1.266 -3.342 -23.707 1.00 0.00 C -ATOM 789 O THR 50 -0.442 -4.237 -24.000 1.00 0.00 O -ATOM 790 N TYR 51 -1.926 -3.384 -22.523 1.00 0.00 N -ATOM 791 H TYR 51 -2.521 -2.632 -22.207 1.00 0.00 H -ATOM 792 CA TYR 51 -1.648 -4.337 -21.499 1.00 0.00 C -ATOM 793 HA TYR 51 -1.225 -5.248 -21.922 1.00 0.00 H -ATOM 794 CB TYR 51 -0.580 -3.850 -20.496 1.00 0.00 C -ATOM 795 HB2 TYR 51 -1.175 -3.166 -19.891 1.00 0.00 H -ATOM 796 HB3 TYR 51 -0.383 -4.584 -19.714 1.00 0.00 H -ATOM 797 CG TYR 51 0.686 -3.188 -21.004 1.00 0.00 C -ATOM 798 CD1 TYR 51 1.913 -3.790 -20.851 1.00 0.00 C -ATOM 799 HD1 TYR 51 2.092 -4.723 -20.337 1.00 0.00 H -ATOM 800 CE1 TYR 51 3.109 -3.139 -21.147 1.00 0.00 C -ATOM 801 HE1 TYR 51 4.039 -3.681 -21.053 1.00 0.00 H -ATOM 802 CZ TYR 51 3.061 -1.803 -21.640 1.00 0.00 C -ATOM 803 OH TYR 51 4.176 -1.208 -22.113 1.00 0.00 O -ATOM 804 HH TYR 51 4.794 -1.915 -22.317 1.00 0.00 H -ATOM 805 CE2 TYR 51 1.799 -1.132 -21.733 1.00 0.00 C -ATOM 806 HE2 TYR 51 1.861 -0.146 -22.172 1.00 0.00 H -ATOM 807 CD2 TYR 51 0.634 -1.804 -21.328 1.00 0.00 C -ATOM 808 HD2 TYR 51 -0.315 -1.289 -21.363 1.00 0.00 H -ATOM 809 C TYR 51 -2.924 -4.742 -20.742 1.00 0.00 C -ATOM 810 O TYR 51 -3.655 -3.948 -20.169 1.00 0.00 O -ATOM 811 N THR 52 -3.195 -6.004 -20.617 1.00 0.00 N -ATOM 812 H THR 52 -2.549 -6.630 -21.078 1.00 0.00 H -ATOM 813 CA THR 52 -4.332 -6.603 -19.884 1.00 0.00 C -ATOM 814 HA THR 52 -5.222 -5.993 -19.730 1.00 0.00 H -ATOM 815 CB THR 52 -4.927 -7.857 -20.507 1.00 0.00 C -ATOM 816 HB THR 52 -4.307 -8.690 -20.175 1.00 0.00 H -ATOM 817 CG2 THR 52 -6.376 -8.231 -20.208 1.00 0.00 C -ATOM 818 HG21 THR 52 -6.594 -8.200 -19.141 1.00 0.00 H -ATOM 819 HG22 THR 52 -7.027 -7.584 -20.797 1.00 0.00 H -ATOM 820 HG23 THR 52 -6.518 -9.247 -20.577 1.00 0.00 H -ATOM 821 OG1 THR 52 -4.734 -7.790 -21.926 1.00 0.00 O -ATOM 822 HG1 THR 52 -3.779 -7.834 -22.003 1.00 0.00 H -ATOM 823 C THR 52 -3.828 -6.987 -18.415 1.00 0.00 C -ATOM 824 O THR 52 -2.725 -7.449 -18.233 1.00 0.00 O -ATOM 825 N PHE 53 -4.729 -6.816 -17.446 1.00 0.00 N -ATOM 826 H PHE 53 -5.675 -6.566 -17.697 1.00 0.00 H -ATOM 827 CA PHE 53 -4.470 -7.200 -16.034 1.00 0.00 C -ATOM 828 HA PHE 53 -3.817 -8.066 -15.925 1.00 0.00 H -ATOM 829 CB PHE 53 -3.909 -5.909 -15.345 1.00 0.00 C -ATOM 830 HB2 PHE 53 -4.598 -5.079 -15.499 1.00 0.00 H -ATOM 831 HB3 PHE 53 -3.827 -6.144 -14.285 1.00 0.00 H -ATOM 832 CG PHE 53 -2.554 -5.448 -15.807 1.00 0.00 C -ATOM 833 CD1 PHE 53 -1.380 -6.206 -15.543 1.00 0.00 C -ATOM 834 HD1 PHE 53 -1.408 -7.107 -14.947 1.00 0.00 H -ATOM 835 CE1 PHE 53 -0.111 -5.788 -15.926 1.00 0.00 C -ATOM 836 HE1 PHE 53 0.702 -6.448 -15.663 1.00 0.00 H -ATOM 837 CZ PHE 53 0.073 -4.689 -16.731 1.00 0.00 C -ATOM 838 HZ PHE 53 1.066 -4.389 -17.034 1.00 0.00 H -ATOM 839 CE2 PHE 53 -1.029 -3.934 -17.066 1.00 0.00 C -ATOM 840 HE2 PHE 53 -0.966 -3.175 -17.831 1.00 0.00 H -ATOM 841 CD2 PHE 53 -2.326 -4.319 -16.599 1.00 0.00 C -ATOM 842 HD2 PHE 53 -3.141 -3.767 -17.046 1.00 0.00 H -ATOM 843 C PHE 53 -5.678 -7.618 -15.226 1.00 0.00 C -ATOM 844 O PHE 53 -6.799 -7.659 -15.740 1.00 0.00 O -ATOM 845 N ASP 54 -5.503 -8.062 -13.960 1.00 0.00 N -ATOM 846 H ASP 54 -4.603 -8.168 -13.514 1.00 0.00 H -ATOM 847 CA ASP 54 -6.589 -8.659 -13.189 1.00 0.00 C -ATOM 848 HA ASP 54 -6.914 -9.564 -13.703 1.00 0.00 H -ATOM 849 CB ASP 54 -6.029 -9.094 -11.877 1.00 0.00 C -ATOM 850 HB2 ASP 54 -6.019 -8.223 -11.220 1.00 0.00 H -ATOM 851 HB3 ASP 54 -6.768 -9.749 -11.415 1.00 0.00 H -ATOM 852 CG ASP 54 -4.643 -9.838 -11.859 1.00 0.00 C -ATOM 853 OD1 ASP 54 -3.912 -9.824 -10.850 1.00 0.00 O -ATOM 854 OD2 ASP 54 -4.321 -10.570 -12.777 1.00 0.00 O -ATOM 855 C ASP 54 -7.866 -7.842 -13.176 1.00 0.00 C -ATOM 856 O ASP 54 -8.934 -8.423 -13.462 1.00 0.00 O -ATOM 857 N MET 55 -7.708 -6.537 -12.962 1.00 0.00 N -ATOM 858 H MET 55 -6.749 -6.269 -12.789 1.00 0.00 H -ATOM 859 CA MET 55 -8.733 -5.479 -13.120 1.00 0.00 C -ATOM 860 HA MET 55 -9.324 -5.791 -13.982 1.00 0.00 H -ATOM 861 CB MET 55 -9.480 -5.306 -11.838 1.00 0.00 C -ATOM 862 HB2 MET 55 -8.946 -4.614 -11.186 1.00 0.00 H -ATOM 863 HB3 MET 55 -10.474 -4.900 -12.027 1.00 0.00 H -ATOM 864 CG MET 55 -9.859 -6.540 -10.990 1.00 0.00 C -ATOM 865 HG2 MET 55 -10.571 -7.080 -11.613 1.00 0.00 H -ATOM 866 HG3 MET 55 -8.972 -7.155 -10.842 1.00 0.00 H -ATOM 867 SD MET 55 -10.615 -6.265 -9.367 1.00 0.00 S -ATOM 868 CE MET 55 -11.871 -7.535 -9.362 1.00 0.00 C -ATOM 869 HE1 MET 55 -11.408 -8.522 -9.365 1.00 0.00 H -ATOM 870 HE2 MET 55 -12.397 -7.509 -8.408 1.00 0.00 H -ATOM 871 HE3 MET 55 -12.599 -7.412 -10.164 1.00 0.00 H -ATOM 872 C MET 55 -8.054 -4.144 -13.525 1.00 0.00 C -ATOM 873 O MET 55 -6.890 -3.904 -13.195 1.00 0.00 O -ATOM 874 N VAL 56 -8.824 -3.330 -14.207 1.00 0.00 N -ATOM 875 H VAL 56 -9.755 -3.662 -14.417 1.00 0.00 H -ATOM 876 CA VAL 56 -8.290 -2.175 -14.918 1.00 0.00 C -ATOM 877 HA VAL 56 -7.356 -1.919 -14.416 1.00 0.00 H -ATOM 878 CB VAL 56 -8.018 -2.478 -16.368 1.00 0.00 C -ATOM 879 HB VAL 56 -8.852 -2.942 -16.895 1.00 0.00 H -ATOM 880 CG1 VAL 56 -7.592 -1.209 -17.036 1.00 0.00 C -ATOM 881 HG11 VAL 56 -8.466 -0.593 -17.247 1.00 0.00 H -ATOM 882 HG12 VAL 56 -6.894 -0.670 -16.395 1.00 0.00 H -ATOM 883 HG13 VAL 56 -7.064 -1.235 -17.990 1.00 0.00 H -ATOM 884 CG2 VAL 56 -6.751 -3.367 -16.509 1.00 0.00 C -ATOM 885 HG21 VAL 56 -6.415 -3.375 -17.546 1.00 0.00 H -ATOM 886 HG22 VAL 56 -5.907 -2.921 -15.981 1.00 0.00 H -ATOM 887 HG23 VAL 56 -6.919 -4.416 -16.264 1.00 0.00 H -ATOM 888 C VAL 56 -9.250 -0.999 -14.631 1.00 0.00 C -ATOM 889 O VAL 56 -10.428 -1.144 -15.015 1.00 0.00 O -ATOM 890 N PHE 57 -8.748 0.144 -14.209 1.00 0.00 N -ATOM 891 H PHE 57 -7.803 0.121 -13.849 1.00 0.00 H -ATOM 892 CA PHE 57 -9.625 1.317 -13.811 1.00 0.00 C -ATOM 893 HA PHE 57 -10.610 1.181 -14.258 1.00 0.00 H -ATOM 894 CB PHE 57 -9.651 1.439 -12.299 1.00 0.00 C -ATOM 895 HB2 PHE 57 -8.668 1.743 -11.939 1.00 0.00 H -ATOM 896 HB3 PHE 57 -10.253 2.306 -12.024 1.00 0.00 H -ATOM 897 CG PHE 57 -10.018 0.130 -11.601 1.00 0.00 C -ATOM 898 CD1 PHE 57 -11.266 -0.438 -11.827 1.00 0.00 C -ATOM 899 HD1 PHE 57 -11.933 -0.030 -12.573 1.00 0.00 H -ATOM 900 CE1 PHE 57 -11.610 -1.623 -11.169 1.00 0.00 C -ATOM 901 HE1 PHE 57 -12.575 -2.063 -11.367 1.00 0.00 H -ATOM 902 CZ PHE 57 -10.744 -2.277 -10.215 1.00 0.00 C -ATOM 903 HZ PHE 57 -11.001 -3.179 -9.680 1.00 0.00 H -ATOM 904 CE2 PHE 57 -9.507 -1.649 -9.969 1.00 0.00 C -ATOM 905 HE2 PHE 57 -8.884 -2.155 -9.247 1.00 0.00 H -ATOM 906 CD2 PHE 57 -9.121 -0.473 -10.667 1.00 0.00 C -ATOM 907 HD2 PHE 57 -8.144 -0.022 -10.577 1.00 0.00 H -ATOM 908 C PHE 57 -9.203 2.641 -14.402 1.00 0.00 C -ATOM 909 O PHE 57 -7.973 2.926 -14.451 1.00 0.00 O -ATOM 910 N GLY 58 -10.145 3.421 -14.936 1.00 0.00 N -ATOM 911 H GLY 58 -11.118 3.155 -14.894 1.00 0.00 H -ATOM 912 CA GLY 58 -9.921 4.694 -15.564 1.00 0.00 C -ATOM 913 HA2 GLY 58 -8.867 4.904 -15.746 1.00 0.00 H -ATOM 914 HA3 GLY 58 -10.444 4.677 -16.519 1.00 0.00 H -ATOM 915 C GLY 58 -10.432 5.838 -14.743 1.00 0.00 C -ATOM 916 O GLY 58 -10.854 5.612 -13.601 1.00 0.00 O -ATOM 917 N ALA 59 -10.127 7.087 -15.173 1.00 0.00 N -ATOM 918 H ALA 59 -9.640 7.071 -16.058 1.00 0.00 H -ATOM 919 CA ALA 59 -10.254 8.305 -14.366 1.00 0.00 C -ATOM 920 HA ALA 59 -9.420 8.321 -13.664 1.00 0.00 H -ATOM 921 CB ALA 59 -10.063 9.365 -15.417 1.00 0.00 C -ATOM 922 HB1 ALA 59 -9.030 9.436 -15.759 1.00 0.00 H -ATOM 923 HB2 ALA 59 -10.880 9.243 -16.130 1.00 0.00 H -ATOM 924 HB3 ALA 59 -10.233 10.370 -15.031 1.00 0.00 H -ATOM 925 C ALA 59 -11.631 8.420 -13.654 1.00 0.00 C -ATOM 926 O ALA 59 -11.750 9.132 -12.654 1.00 0.00 O -ATOM 927 N SER 60 -12.679 7.923 -14.270 1.00 0.00 N -ATOM 928 H SER 60 -12.483 7.639 -15.220 1.00 0.00 H -ATOM 929 CA SER 60 -14.079 7.875 -13.827 1.00 0.00 C -ATOM 930 HA SER 60 -14.334 8.931 -13.741 1.00 0.00 H -ATOM 931 CB SER 60 -14.920 7.413 -14.987 1.00 0.00 C -ATOM 932 HB2 SER 60 -15.904 7.444 -14.521 1.00 0.00 H -ATOM 933 HB3 SER 60 -14.963 8.136 -15.802 1.00 0.00 H -ATOM 934 OG SER 60 -14.665 6.101 -15.431 1.00 0.00 O -ATOM 935 HG SER 60 -13.752 6.140 -15.726 1.00 0.00 H -ATOM 936 C SER 60 -14.305 7.062 -12.568 1.00 0.00 C -ATOM 937 O SER 60 -15.190 7.434 -11.730 1.00 0.00 O -ATOM 938 N THR 61 -13.474 6.048 -12.303 1.00 0.00 N -ATOM 939 H THR 61 -12.811 5.854 -13.039 1.00 0.00 H -ATOM 940 CA THR 61 -13.665 5.032 -11.181 1.00 0.00 C -ATOM 941 HA THR 61 -14.655 4.597 -11.312 1.00 0.00 H -ATOM 942 CB THR 61 -12.548 3.991 -11.334 1.00 0.00 C -ATOM 943 HB THR 61 -11.657 4.506 -11.693 1.00 0.00 H -ATOM 944 CG2 THR 61 -12.140 3.221 -10.041 1.00 0.00 C -ATOM 945 HG21 THR 61 -11.615 3.933 -9.405 1.00 0.00 H -ATOM 946 HG22 THR 61 -12.936 2.754 -9.462 1.00 0.00 H -ATOM 947 HG23 THR 61 -11.498 2.395 -10.348 1.00 0.00 H -ATOM 948 OG1 THR 61 -12.942 2.998 -12.269 1.00 0.00 O -ATOM 949 HG1 THR 61 -12.791 3.303 -13.168 1.00 0.00 H -ATOM 950 C THR 61 -13.565 5.618 -9.784 1.00 0.00 C -ATOM 951 O THR 61 -12.654 6.361 -9.420 1.00 0.00 O -ATOM 952 N LYS 62 -14.617 5.462 -8.991 1.00 0.00 N -ATOM 953 H LYS 62 -15.366 4.859 -9.300 1.00 0.00 H -ATOM 954 CA LYS 62 -14.755 6.054 -7.636 1.00 0.00 C -ATOM 955 HA LYS 62 -14.490 7.110 -7.587 1.00 0.00 H -ATOM 956 CB LYS 62 -16.207 6.088 -7.197 1.00 0.00 C -ATOM 957 HB2 LYS 62 -16.554 5.056 -7.208 1.00 0.00 H -ATOM 958 HB3 LYS 62 -16.261 6.483 -6.182 1.00 0.00 H -ATOM 959 CG LYS 62 -17.039 6.906 -8.130 1.00 0.00 C -ATOM 960 HG2 LYS 62 -16.676 7.931 -8.212 1.00 0.00 H -ATOM 961 HG3 LYS 62 -17.032 6.475 -9.132 1.00 0.00 H -ATOM 962 CD LYS 62 -18.458 6.998 -7.564 1.00 0.00 C -ATOM 963 HD2 LYS 62 -18.816 5.985 -7.381 1.00 0.00 H -ATOM 964 HD3 LYS 62 -18.341 7.667 -6.711 1.00 0.00 H -ATOM 965 CE LYS 62 -19.473 7.626 -8.477 1.00 0.00 C -ATOM 966 HE2 LYS 62 -19.104 8.484 -9.037 1.00 0.00 H -ATOM 967 HE3 LYS 62 -19.859 6.853 -9.142 1.00 0.00 H -ATOM 968 NZ LYS 62 -20.596 8.141 -7.755 1.00 0.00 N -ATOM 969 HZ1 LYS 62 -21.213 8.679 -8.346 1.00 0.00 H -ATOM 970 HZ2 LYS 62 -21.098 7.352 -7.372 1.00 0.00 H -ATOM 971 HZ3 LYS 62 -20.286 8.737 -7.000 1.00 0.00 H -ATOM 972 C LYS 62 -13.806 5.344 -6.642 1.00 0.00 C -ATOM 973 O LYS 62 -13.159 4.367 -6.972 1.00 0.00 O -ATOM 974 N GLN 63 -13.666 5.801 -5.406 1.00 0.00 N -ATOM 975 H GLN 63 -14.077 6.707 -5.232 1.00 0.00 H -ATOM 976 CA GLN 63 -12.961 5.060 -4.319 1.00 0.00 C -ATOM 977 HA GLN 63 -11.982 4.704 -4.642 1.00 0.00 H -ATOM 978 CB GLN 63 -12.836 5.887 -3.039 1.00 0.00 C -ATOM 979 HB2 GLN 63 -13.826 6.157 -2.670 1.00 0.00 H -ATOM 980 HB3 GLN 63 -12.365 5.244 -2.297 1.00 0.00 H -ATOM 981 CG GLN 63 -12.125 7.259 -3.148 1.00 0.00 C -ATOM 982 HG2 GLN 63 -12.320 7.721 -4.116 1.00 0.00 H -ATOM 983 HG3 GLN 63 -12.613 7.912 -2.425 1.00 0.00 H -ATOM 984 CD GLN 63 -10.614 7.161 -2.940 1.00 0.00 C -ATOM 985 OE1 GLN 63 -9.901 6.526 -3.704 1.00 0.00 O -ATOM 986 NE2 GLN 63 -10.174 7.793 -1.888 1.00 0.00 N -ATOM 987 HE21 GLN 63 -9.205 7.644 -1.647 1.00 0.00 H -ATOM 988 HE22 GLN 63 -10.826 8.367 -1.371 1.00 0.00 H -ATOM 989 C GLN 63 -13.735 3.717 -4.076 1.00 0.00 C -ATOM 990 O GLN 63 -13.118 2.667 -3.927 1.00 0.00 O -ATOM 991 N ILE 64 -15.045 3.849 -3.791 1.00 0.00 N -ATOM 992 H ILE 64 -15.585 4.700 -3.851 1.00 0.00 H -ATOM 993 CA ILE 64 -15.915 2.696 -3.397 1.00 0.00 C -ATOM 994 HA ILE 64 -15.410 2.298 -2.517 1.00 0.00 H -ATOM 995 CB ILE 64 -17.411 3.162 -3.151 1.00 0.00 C -ATOM 996 HB ILE 64 -17.487 3.992 -2.448 1.00 0.00 H -ATOM 997 CG2 ILE 64 -18.053 3.650 -4.481 1.00 0.00 C -ATOM 998 HG21 ILE 64 -17.427 4.405 -4.956 1.00 0.00 H -ATOM 999 HG22 ILE 64 -18.278 2.804 -5.130 1.00 0.00 H -ATOM 1000 HG23 ILE 64 -18.968 4.224 -4.329 1.00 0.00 H -ATOM 1001 CG1 ILE 64 -18.305 1.939 -2.654 1.00 0.00 C -ATOM 1002 HG12 ILE 64 -19.305 2.332 -2.475 1.00 0.00 H -ATOM 1003 HG13 ILE 64 -18.512 1.190 -3.419 1.00 0.00 H -ATOM 1004 CD1 ILE 64 -17.758 1.248 -1.428 1.00 0.00 C -ATOM 1005 HD11 ILE 64 -18.495 0.528 -1.071 1.00 0.00 H -ATOM 1006 HD12 ILE 64 -16.816 0.751 -1.659 1.00 0.00 H -ATOM 1007 HD13 ILE 64 -17.504 1.972 -0.655 1.00 0.00 H -ATOM 1008 C ILE 64 -15.792 1.554 -4.457 1.00 0.00 C -ATOM 1009 O ILE 64 -15.867 0.344 -4.057 1.00 0.00 O -ATOM 1010 N ASP 65 -15.553 1.858 -5.744 1.00 0.00 N -ATOM 1011 H ASP 65 -15.498 2.829 -6.019 1.00 0.00 H -ATOM 1012 CA ASP 65 -15.492 0.909 -6.906 1.00 0.00 C -ATOM 1013 HA ASP 65 -16.369 0.262 -6.898 1.00 0.00 H -ATOM 1014 CB ASP 65 -15.269 1.696 -8.169 1.00 0.00 C -ATOM 1015 HB2 ASP 65 -14.510 2.471 -8.060 1.00 0.00 H -ATOM 1016 HB3 ASP 65 -15.024 0.930 -8.903 1.00 0.00 H -ATOM 1017 CG ASP 65 -16.546 2.352 -8.738 1.00 0.00 C -ATOM 1018 OD1 ASP 65 -16.459 3.090 -9.754 1.00 0.00 O -ATOM 1019 OD2 ASP 65 -17.642 2.007 -8.187 1.00 0.00 O -ATOM 1020 C ASP 65 -14.255 0.015 -6.787 1.00 0.00 C -ATOM 1021 O ASP 65 -14.384 -1.189 -6.949 1.00 0.00 O -ATOM 1022 N VAL 66 -13.097 0.588 -6.423 1.00 0.00 N -ATOM 1023 H VAL 66 -13.172 1.590 -6.520 1.00 0.00 H -ATOM 1024 CA VAL 66 -11.760 -0.036 -6.154 1.00 0.00 C -ATOM 1025 HA VAL 66 -11.487 -0.671 -6.997 1.00 0.00 H -ATOM 1026 CB VAL 66 -10.553 0.957 -6.106 1.00 0.00 C -ATOM 1027 HB VAL 66 -10.712 1.613 -5.250 1.00 0.00 H -ATOM 1028 CG1 VAL 66 -9.278 0.087 -5.943 1.00 0.00 C -ATOM 1029 HG11 VAL 66 -8.338 0.632 -6.028 1.00 0.00 H -ATOM 1030 HG12 VAL 66 -9.249 -0.481 -5.013 1.00 0.00 H -ATOM 1031 HG13 VAL 66 -9.167 -0.730 -6.655 1.00 0.00 H -ATOM 1032 CG2 VAL 66 -10.477 1.845 -7.411 1.00 0.00 C -ATOM 1033 HG21 VAL 66 -11.312 2.545 -7.440 1.00 0.00 H -ATOM 1034 HG22 VAL 66 -9.605 2.479 -7.250 1.00 0.00 H -ATOM 1035 HG23 VAL 66 -10.351 1.312 -8.353 1.00 0.00 H -ATOM 1036 C VAL 66 -11.884 -0.905 -4.950 1.00 0.00 C -ATOM 1037 O VAL 66 -11.477 -2.033 -5.003 1.00 0.00 O -ATOM 1038 N TYR 67 -12.582 -0.286 -3.919 1.00 0.00 N -ATOM 1039 H TYR 67 -12.827 0.686 -4.045 1.00 0.00 H -ATOM 1040 CA TYR 67 -12.849 -0.977 -2.652 1.00 0.00 C -ATOM 1041 HA TYR 67 -11.875 -1.338 -2.320 1.00 0.00 H -ATOM 1042 CB TYR 67 -13.475 -0.082 -1.570 1.00 0.00 C -ATOM 1043 HB2 TYR 67 -12.901 0.845 -1.557 1.00 0.00 H -ATOM 1044 HB3 TYR 67 -14.423 0.290 -1.960 1.00 0.00 H -ATOM 1045 CG TYR 67 -13.523 -0.712 -0.180 1.00 0.00 C -ATOM 1046 CD1 TYR 67 -14.551 -1.675 0.109 1.00 0.00 C -ATOM 1047 HD1 TYR 67 -15.367 -1.842 -0.578 1.00 0.00 H -ATOM 1048 CE1 TYR 67 -14.565 -2.207 1.404 1.00 0.00 C -ATOM 1049 HE1 TYR 67 -15.443 -2.771 1.681 1.00 0.00 H -ATOM 1050 CZ TYR 67 -13.519 -1.989 2.290 1.00 0.00 C -ATOM 1051 OH TYR 67 -13.455 -2.534 3.493 1.00 0.00 O -ATOM 1052 HH TYR 67 -14.183 -3.156 3.571 1.00 0.00 H -ATOM 1053 CE2 TYR 67 -12.396 -1.245 1.880 1.00 0.00 C -ATOM 1054 HE2 TYR 67 -11.613 -1.122 2.614 1.00 0.00 H -ATOM 1055 CD2 TYR 67 -12.355 -0.598 0.629 1.00 0.00 C -ATOM 1056 HD2 TYR 67 -11.522 -0.024 0.252 1.00 0.00 H -ATOM 1057 C TYR 67 -13.697 -2.272 -2.873 1.00 0.00 C -ATOM 1058 O TYR 67 -13.184 -3.399 -2.658 1.00 0.00 O -ATOM 1059 N ARG 68 -14.873 -2.152 -3.522 1.00 0.00 N -ATOM 1060 H ARG 68 -15.202 -1.245 -3.824 1.00 0.00 H -ATOM 1061 CA ARG 68 -15.833 -3.273 -3.732 1.00 0.00 C -ATOM 1062 HA ARG 68 -16.106 -3.852 -2.849 1.00 0.00 H -ATOM 1063 CB ARG 68 -17.140 -2.744 -4.370 1.00 0.00 C -ATOM 1064 HB2 ARG 68 -16.876 -2.054 -5.171 1.00 0.00 H -ATOM 1065 HB3 ARG 68 -17.491 -3.699 -4.761 1.00 0.00 H -ATOM 1066 CG ARG 68 -18.272 -2.200 -3.449 1.00 0.00 C -ATOM 1067 HG2 ARG 68 -18.612 -3.059 -2.871 1.00 0.00 H -ATOM 1068 HG3 ARG 68 -17.873 -1.398 -2.828 1.00 0.00 H -ATOM 1069 CD ARG 68 -19.351 -1.580 -4.362 1.00 0.00 C -ATOM 1070 HD2 ARG 68 -18.906 -0.763 -4.929 1.00 0.00 H -ATOM 1071 HD3 ARG 68 -19.668 -2.339 -5.078 1.00 0.00 H -ATOM 1072 NE ARG 68 -20.537 -1.117 -3.601 1.00 0.00 N -ATOM 1073 HE ARG 68 -20.986 -1.756 -2.961 1.00 0.00 H -ATOM 1074 CZ ARG 68 -21.020 0.138 -3.740 1.00 0.00 C -ATOM 1075 NH1 ARG 68 -20.818 0.864 -4.801 1.00 0.00 N -ATOM 1076 HH11 ARG 68 -20.373 0.380 -5.569 1.00 0.00 H -ATOM 1077 HH12 ARG 68 -21.375 1.694 -4.940 1.00 0.00 H -ATOM 1078 NH2 ARG 68 -21.831 0.574 -2.843 1.00 0.00 N -ATOM 1079 HH21 ARG 68 -21.927 0.015 -2.008 1.00 0.00 H -ATOM 1080 HH22 ARG 68 -22.144 1.534 -2.854 1.00 0.00 H -ATOM 1081 C ARG 68 -15.293 -4.404 -4.697 1.00 0.00 C -ATOM 1082 O ARG 68 -15.690 -5.572 -4.472 1.00 0.00 O -ATOM 1083 N SER 69 -14.346 -4.040 -5.573 1.00 0.00 N -ATOM 1084 H SER 69 -14.188 -3.047 -5.665 1.00 0.00 H -ATOM 1085 CA SER 69 -13.763 -4.958 -6.555 1.00 0.00 C -ATOM 1086 HA SER 69 -14.509 -5.663 -6.921 1.00 0.00 H -ATOM 1087 CB SER 69 -13.298 -4.138 -7.727 1.00 0.00 C -ATOM 1088 HB2 SER 69 -12.499 -3.482 -7.377 1.00 0.00 H -ATOM 1089 HB3 SER 69 -12.863 -4.810 -8.466 1.00 0.00 H -ATOM 1090 OG SER 69 -14.299 -3.396 -8.271 1.00 0.00 O -ATOM 1091 HG SER 69 -14.265 -2.509 -7.905 1.00 0.00 H -ATOM 1092 C SER 69 -12.632 -5.783 -5.962 1.00 0.00 C -ATOM 1093 O SER 69 -12.623 -7.000 -6.193 1.00 0.00 O -ATOM 1094 N VAL 70 -11.731 -5.088 -5.266 1.00 0.00 N -ATOM 1095 H VAL 70 -11.948 -4.128 -5.039 1.00 0.00 H -ATOM 1096 CA VAL 70 -10.406 -5.573 -4.863 1.00 0.00 C -ATOM 1097 HA VAL 70 -10.083 -6.442 -5.437 1.00 0.00 H -ATOM 1098 CB VAL 70 -9.311 -4.491 -5.165 1.00 0.00 C -ATOM 1099 HB VAL 70 -9.527 -3.614 -4.555 1.00 0.00 H -ATOM 1100 CG1 VAL 70 -7.862 -4.935 -4.693 1.00 0.00 C -ATOM 1101 HG11 VAL 70 -7.487 -5.854 -5.144 1.00 0.00 H -ATOM 1102 HG12 VAL 70 -7.193 -4.106 -4.918 1.00 0.00 H -ATOM 1103 HG13 VAL 70 -7.776 -5.114 -3.621 1.00 0.00 H -ATOM 1104 CG2 VAL 70 -9.163 -3.970 -6.613 1.00 0.00 C -ATOM 1105 HG21 VAL 70 -10.139 -3.759 -7.049 1.00 0.00 H -ATOM 1106 HG22 VAL 70 -8.532 -3.081 -6.647 1.00 0.00 H -ATOM 1107 HG23 VAL 70 -8.650 -4.674 -7.269 1.00 0.00 H -ATOM 1108 C VAL 70 -10.345 -5.844 -3.373 1.00 0.00 C -ATOM 1109 O VAL 70 -9.909 -6.961 -3.070 1.00 0.00 O -ATOM 1110 N VAL 71 -10.602 -4.913 -2.486 1.00 0.00 N -ATOM 1111 H VAL 71 -10.932 -3.995 -2.750 1.00 0.00 H -ATOM 1112 CA VAL 71 -10.465 -5.061 -1.103 1.00 0.00 C -ATOM 1113 HA VAL 71 -9.593 -5.686 -0.910 1.00 0.00 H -ATOM 1114 CB VAL 71 -10.241 -3.692 -0.428 1.00 0.00 C -ATOM 1115 HB VAL 71 -11.224 -3.228 -0.348 1.00 0.00 H -ATOM 1116 CG1 VAL 71 -9.743 -3.920 1.001 1.00 0.00 C -ATOM 1117 HG11 VAL 71 -9.634 -2.957 1.498 1.00 0.00 H -ATOM 1118 HG12 VAL 71 -10.512 -4.416 1.594 1.00 0.00 H -ATOM 1119 HG13 VAL 71 -8.778 -4.423 1.065 1.00 0.00 H -ATOM 1120 CG2 VAL 71 -9.342 -2.802 -1.264 1.00 0.00 C -ATOM 1121 HG21 VAL 71 -9.753 -2.359 -2.171 1.00 0.00 H -ATOM 1122 HG22 VAL 71 -9.061 -1.912 -0.700 1.00 0.00 H -ATOM 1123 HG23 VAL 71 -8.467 -3.341 -1.627 1.00 0.00 H -ATOM 1124 C VAL 71 -11.604 -5.873 -0.456 1.00 0.00 C -ATOM 1125 O VAL 71 -11.254 -6.764 0.306 1.00 0.00 O -ATOM 1126 N CYS 72 -12.849 -5.791 -0.833 1.00 0.00 N -ATOM 1127 H CYS 72 -13.057 -5.073 -1.514 1.00 0.00 H -ATOM 1128 CA CYS 72 -13.956 -6.474 -0.235 1.00 0.00 C -ATOM 1129 HA CYS 72 -14.103 -6.219 0.814 1.00 0.00 H -ATOM 1130 CB CYS 72 -15.263 -5.964 -0.893 1.00 0.00 C -ATOM 1131 HB2 CYS 72 -15.382 -4.893 -0.724 1.00 0.00 H -ATOM 1132 HB3 CYS 72 -15.115 -6.150 -1.956 1.00 0.00 H -ATOM 1133 SG CYS 72 -16.740 -6.768 -0.218 1.00 0.00 S -ATOM 1134 HG CYS 72 -17.660 -5.819 -0.416 1.00 0.00 H -ATOM 1135 C CYS 72 -13.873 -8.038 -0.333 1.00 0.00 C -ATOM 1136 O CYS 72 -14.196 -8.745 0.603 1.00 0.00 O -ATOM 1137 N PRO 73 -13.296 -8.665 -1.484 1.00 0.00 N -ATOM 1138 CD PRO 73 -13.257 -8.104 -2.796 1.00 0.00 C -ATOM 1139 HD2 PRO 73 -12.699 -7.180 -2.652 1.00 0.00 H -ATOM 1140 HD3 PRO 73 -14.235 -7.770 -3.140 1.00 0.00 H -ATOM 1141 CG PRO 73 -12.632 -9.112 -3.750 1.00 0.00 C -ATOM 1142 HG2 PRO 73 -11.573 -8.874 -3.839 1.00 0.00 H -ATOM 1143 HG3 PRO 73 -13.150 -9.119 -4.710 1.00 0.00 H -ATOM 1144 CB PRO 73 -12.849 -10.445 -3.025 1.00 0.00 C -ATOM 1145 HB2 PRO 73 -12.130 -11.251 -3.173 1.00 0.00 H -ATOM 1146 HB3 PRO 73 -13.821 -10.799 -3.368 1.00 0.00 H -ATOM 1147 CA PRO 73 -12.956 -10.069 -1.554 1.00 0.00 C -ATOM 1148 HA PRO 73 -13.772 -10.662 -1.144 1.00 0.00 H -ATOM 1149 C PRO 73 -11.671 -10.366 -0.794 1.00 0.00 C -ATOM 1150 O PRO 73 -11.662 -11.297 -0.042 1.00 0.00 O -ATOM 1151 N ILE 74 -10.603 -9.521 -0.837 1.00 0.00 N -ATOM 1152 H ILE 74 -10.665 -8.657 -1.356 1.00 0.00 H -ATOM 1153 CA ILE 74 -9.353 -9.695 0.015 1.00 0.00 C -ATOM 1154 HA ILE 74 -9.037 -10.698 -0.273 1.00 0.00 H -ATOM 1155 CB ILE 74 -8.183 -8.759 -0.435 1.00 0.00 C -ATOM 1156 HB ILE 74 -8.571 -7.878 -0.947 1.00 0.00 H -ATOM 1157 CG2 ILE 74 -7.454 -8.262 0.847 1.00 0.00 C -ATOM 1158 HG21 ILE 74 -6.835 -7.400 0.601 1.00 0.00 H -ATOM 1159 HG22 ILE 74 -8.168 -7.892 1.582 1.00 0.00 H -ATOM 1160 HG23 ILE 74 -6.865 -9.089 1.244 1.00 0.00 H -ATOM 1161 CG1 ILE 74 -7.309 -9.560 -1.461 1.00 0.00 C -ATOM 1162 HG12 ILE 74 -6.895 -10.462 -1.011 1.00 0.00 H -ATOM 1163 HG13 ILE 74 -8.046 -9.879 -2.200 1.00 0.00 H -ATOM 1164 CD1 ILE 74 -6.266 -8.602 -1.954 1.00 0.00 C -ATOM 1165 HD11 ILE 74 -5.471 -8.496 -1.216 1.00 0.00 H -ATOM 1166 HD12 ILE 74 -5.851 -9.050 -2.857 1.00 0.00 H -ATOM 1167 HD13 ILE 74 -6.716 -7.654 -2.247 1.00 0.00 H -ATOM 1168 C ILE 74 -9.675 -9.806 1.454 1.00 0.00 C -ATOM 1169 O ILE 74 -9.039 -10.637 2.126 1.00 0.00 O -ATOM 1170 N LEU 75 -10.574 -8.979 1.995 1.00 0.00 N -ATOM 1171 H LEU 75 -11.114 -8.334 1.436 1.00 0.00 H -ATOM 1172 CA LEU 75 -10.955 -8.987 3.415 1.00 0.00 C -ATOM 1173 HA LEU 75 -9.956 -8.977 3.850 1.00 0.00 H -ATOM 1174 CB LEU 75 -11.768 -7.763 3.787 1.00 0.00 C -ATOM 1175 HB2 LEU 75 -12.459 -7.459 3.001 1.00 0.00 H -ATOM 1176 HB3 LEU 75 -12.414 -7.970 4.640 1.00 0.00 H -ATOM 1177 CG LEU 75 -10.867 -6.557 3.970 1.00 0.00 C -ATOM 1178 HG LEU 75 -10.104 -6.500 3.194 1.00 0.00 H -ATOM 1179 CD1 LEU 75 -11.670 -5.210 3.770 1.00 0.00 C -ATOM 1180 HD11 LEU 75 -12.499 -4.977 4.439 1.00 0.00 H -ATOM 1181 HD12 LEU 75 -10.939 -4.404 3.828 1.00 0.00 H -ATOM 1182 HD13 LEU 75 -12.081 -5.200 2.761 1.00 0.00 H -ATOM 1183 CD2 LEU 75 -10.246 -6.576 5.364 1.00 0.00 C -ATOM 1184 HD21 LEU 75 -11.047 -6.488 6.098 1.00 0.00 H -ATOM 1185 HD22 LEU 75 -9.517 -7.383 5.432 1.00 0.00 H -ATOM 1186 HD23 LEU 75 -9.694 -5.639 5.447 1.00 0.00 H -ATOM 1187 C LEU 75 -11.555 -10.380 3.714 1.00 0.00 C -ATOM 1188 O LEU 75 -11.200 -11.064 4.673 1.00 0.00 O -ATOM 1189 N ASP 76 -12.505 -10.930 2.929 1.00 0.00 N -ATOM 1190 H ASP 76 -12.702 -10.522 2.026 1.00 0.00 H -ATOM 1191 CA ASP 76 -13.100 -12.306 3.078 1.00 0.00 C -ATOM 1192 HA ASP 76 -13.600 -12.396 4.042 1.00 0.00 H -ATOM 1193 CB ASP 76 -14.184 -12.639 2.023 1.00 0.00 C -ATOM 1194 HB2 ASP 76 -14.010 -12.247 1.021 1.00 0.00 H -ATOM 1195 HB3 ASP 76 -14.317 -13.721 2.001 1.00 0.00 H -ATOM 1196 CG ASP 76 -15.534 -12.090 2.571 1.00 0.00 C -ATOM 1197 OD1 ASP 76 -15.869 -12.304 3.779 1.00 0.00 O -ATOM 1198 OD2 ASP 76 -16.377 -11.560 1.803 1.00 0.00 O -ATOM 1199 C ASP 76 -11.992 -13.409 3.115 1.00 0.00 C -ATOM 1200 O ASP 76 -12.201 -14.465 3.749 1.00 0.00 O -ATOM 1201 N GLU 77 -10.787 -13.157 2.550 1.00 0.00 N -ATOM 1202 H GLU 77 -10.688 -12.321 1.991 1.00 0.00 H -ATOM 1203 CA GLU 77 -9.562 -13.998 2.649 1.00 0.00 C -ATOM 1204 HA GLU 77 -9.908 -15.028 2.565 1.00 0.00 H -ATOM 1205 CB GLU 77 -8.623 -13.720 1.464 1.00 0.00 C -ATOM 1206 HB2 GLU 77 -9.181 -13.507 0.552 1.00 0.00 H -ATOM 1207 HB3 GLU 77 -7.948 -12.907 1.735 1.00 0.00 H -ATOM 1208 CG GLU 77 -7.681 -14.858 1.096 1.00 0.00 C -ATOM 1209 HG2 GLU 77 -6.833 -14.756 1.775 1.00 0.00 H -ATOM 1210 HG3 GLU 77 -8.149 -15.815 1.322 1.00 0.00 H -ATOM 1211 CD GLU 77 -7.183 -14.848 -0.376 1.00 0.00 C -ATOM 1212 OE1 GLU 77 -7.326 -13.814 -1.092 1.00 0.00 O -ATOM 1213 OE2 GLU 77 -6.853 -15.912 -0.908 1.00 0.00 O -ATOM 1214 C GLU 77 -8.806 -13.800 4.025 1.00 0.00 C -ATOM 1215 O GLU 77 -8.281 -14.822 4.476 1.00 0.00 O -ATOM 1216 N VAL 78 -8.899 -12.598 4.615 1.00 0.00 N -ATOM 1217 H VAL 78 -9.446 -11.858 4.196 1.00 0.00 H -ATOM 1218 CA VAL 78 -8.530 -12.374 5.991 1.00 0.00 C -ATOM 1219 HA VAL 78 -7.629 -12.976 6.104 1.00 0.00 H -ATOM 1220 CB VAL 78 -8.075 -10.888 6.231 1.00 0.00 C -ATOM 1221 HB VAL 78 -8.918 -10.222 6.042 1.00 0.00 H -ATOM 1222 CG1 VAL 78 -7.607 -10.634 7.668 1.00 0.00 C -ATOM 1223 HG11 VAL 78 -8.332 -10.978 8.406 1.00 0.00 H -ATOM 1224 HG12 VAL 78 -6.650 -11.135 7.809 1.00 0.00 H -ATOM 1225 HG13 VAL 78 -7.533 -9.555 7.807 1.00 0.00 H -ATOM 1226 CG2 VAL 78 -6.912 -10.514 5.358 1.00 0.00 C -ATOM 1227 HG21 VAL 78 -6.320 -9.666 5.704 1.00 0.00 H -ATOM 1228 HG22 VAL 78 -6.181 -11.323 5.331 1.00 0.00 H -ATOM 1229 HG23 VAL 78 -7.278 -10.277 4.359 1.00 0.00 H -ATOM 1230 C VAL 78 -9.466 -12.918 7.042 1.00 0.00 C -ATOM 1231 O VAL 78 -9.016 -13.479 8.020 1.00 0.00 O -ATOM 1232 N ILE 79 -10.767 -13.017 6.709 1.00 0.00 N -ATOM 1233 H ILE 79 -11.113 -12.602 5.855 1.00 0.00 H -ATOM 1234 CA ILE 79 -11.824 -13.706 7.449 1.00 0.00 C -ATOM 1235 HA ILE 79 -11.706 -13.450 8.502 1.00 0.00 H -ATOM 1236 CB ILE 79 -13.201 -13.289 7.056 1.00 0.00 C -ATOM 1237 HB ILE 79 -13.416 -13.585 6.029 1.00 0.00 H -ATOM 1238 CG2 ILE 79 -14.253 -14.097 7.831 1.00 0.00 C -ATOM 1239 HG21 ILE 79 -14.347 -15.113 7.447 1.00 0.00 H -ATOM 1240 HG22 ILE 79 -14.077 -14.132 8.906 1.00 0.00 H -ATOM 1241 HG23 ILE 79 -15.229 -13.672 7.597 1.00 0.00 H -ATOM 1242 CG1 ILE 79 -13.495 -11.733 7.142 1.00 0.00 C -ATOM 1243 HG12 ILE 79 -12.701 -11.153 6.672 1.00 0.00 H -ATOM 1244 HG13 ILE 79 -14.479 -11.548 6.711 1.00 0.00 H -ATOM 1245 CD1 ILE 79 -13.459 -11.129 8.604 1.00 0.00 C -ATOM 1246 HD11 ILE 79 -13.631 -11.897 9.358 1.00 0.00 H -ATOM 1247 HD12 ILE 79 -12.481 -10.681 8.778 1.00 0.00 H -ATOM 1248 HD13 ILE 79 -14.146 -10.284 8.646 1.00 0.00 H -ATOM 1249 C ILE 79 -11.563 -15.167 7.404 1.00 0.00 C -ATOM 1250 O ILE 79 -11.757 -15.887 8.414 1.00 0.00 O -ATOM 1251 N MET 80 -10.979 -15.697 6.301 1.00 0.00 N -ATOM 1252 H MET 80 -10.866 -15.027 5.554 1.00 0.00 H -ATOM 1253 CA MET 80 -10.552 -17.054 6.147 1.00 0.00 C -ATOM 1254 HA MET 80 -11.327 -17.622 6.661 1.00 0.00 H -ATOM 1255 CB MET 80 -10.303 -17.481 4.633 1.00 0.00 C -ATOM 1256 HB2 MET 80 -11.106 -17.117 3.993 1.00 0.00 H -ATOM 1257 HB3 MET 80 -9.333 -17.220 4.207 1.00 0.00 H -ATOM 1258 CG MET 80 -10.447 -18.984 4.368 1.00 0.00 C -ATOM 1259 HG2 MET 80 -9.557 -19.564 4.615 1.00 0.00 H -ATOM 1260 HG3 MET 80 -11.232 -19.351 5.029 1.00 0.00 H -ATOM 1261 SD MET 80 -10.873 -19.453 2.682 1.00 0.00 S -ATOM 1262 CE MET 80 -9.331 -19.149 1.791 1.00 0.00 C -ATOM 1263 HE1 MET 80 -8.583 -18.613 2.374 1.00 0.00 H -ATOM 1264 HE2 MET 80 -8.857 -20.088 1.507 1.00 0.00 H -ATOM 1265 HE3 MET 80 -9.572 -18.619 0.869 1.00 0.00 H -ATOM 1266 C MET 80 -9.284 -17.400 6.993 1.00 0.00 C -ATOM 1267 O MET 80 -8.911 -18.553 6.911 1.00 0.00 O -ATOM 1268 N GLY 81 -8.725 -16.434 7.749 1.00 0.00 N -ATOM 1269 H GLY 81 -9.105 -15.502 7.677 1.00 0.00 H -ATOM 1270 CA GLY 81 -7.490 -16.589 8.511 1.00 0.00 C -ATOM 1271 HA2 GLY 81 -7.474 -15.844 9.305 1.00 0.00 H -ATOM 1272 HA3 GLY 81 -7.574 -17.531 9.054 1.00 0.00 H -ATOM 1273 C GLY 81 -6.083 -16.518 7.779 1.00 0.00 C -ATOM 1274 O GLY 81 -5.108 -16.885 8.372 1.00 0.00 O -ATOM 1275 N TYR 82 -6.080 -16.123 6.495 1.00 0.00 N -ATOM 1276 H TYR 82 -6.945 -15.987 5.993 1.00 0.00 H -ATOM 1277 CA TYR 82 -4.804 -15.732 5.908 1.00 0.00 C -ATOM 1278 HA TYR 82 -4.005 -16.354 6.314 1.00 0.00 H -ATOM 1279 CB TYR 82 -4.921 -15.936 4.417 1.00 0.00 C -ATOM 1280 HB2 TYR 82 -5.846 -15.529 4.007 1.00 0.00 H -ATOM 1281 HB3 TYR 82 -4.038 -15.470 3.977 1.00 0.00 H -ATOM 1282 CG TYR 82 -4.944 -17.407 4.002 1.00 0.00 C -ATOM 1283 CD1 TYR 82 -6.059 -18.183 3.855 1.00 0.00 C -ATOM 1284 HD1 TYR 82 -7.040 -17.780 4.060 1.00 0.00 H -ATOM 1285 CE1 TYR 82 -5.962 -19.528 3.469 1.00 0.00 C -ATOM 1286 HE1 TYR 82 -6.824 -20.167 3.588 1.00 0.00 H -ATOM 1287 CZ TYR 82 -4.699 -20.134 3.140 1.00 0.00 C -ATOM 1288 OH TYR 82 -4.559 -21.453 2.924 1.00 0.00 O -ATOM 1289 HH TYR 82 -5.334 -21.817 3.357 1.00 0.00 H -ATOM 1290 CE2 TYR 82 -3.596 -19.267 3.016 1.00 0.00 C -ATOM 1291 HE2 TYR 82 -2.652 -19.650 2.656 1.00 0.00 H -ATOM 1292 CD2 TYR 82 -3.759 -17.905 3.378 1.00 0.00 C -ATOM 1293 HD2 TYR 82 -2.926 -17.224 3.276 1.00 0.00 H -ATOM 1294 C TYR 82 -4.429 -14.304 6.145 1.00 0.00 C -ATOM 1295 O TYR 82 -5.263 -13.438 6.581 1.00 0.00 O -ATOM 1296 N ASN 83 -3.115 -14.037 6.046 1.00 0.00 N -ATOM 1297 H ASN 83 -2.499 -14.806 5.821 1.00 0.00 H -ATOM 1298 CA ASN 83 -2.553 -12.675 6.139 1.00 0.00 C -ATOM 1299 HA ASN 83 -3.214 -12.041 6.729 1.00 0.00 H -ATOM 1300 CB ASN 83 -1.240 -12.594 6.870 1.00 0.00 C -ATOM 1301 HB2 ASN 83 -0.427 -13.024 6.287 1.00 0.00 H -ATOM 1302 HB3 ASN 83 -1.078 -11.543 7.105 1.00 0.00 H -ATOM 1303 CG ASN 83 -1.326 -13.340 8.213 1.00 0.00 C -ATOM 1304 OD1 ASN 83 -2.244 -13.176 8.984 1.00 0.00 O -ATOM 1305 ND2 ASN 83 -0.352 -14.126 8.558 1.00 0.00 N -ATOM 1306 HD21 ASN 83 -0.366 -14.421 9.524 1.00 0.00 H -ATOM 1307 HD22 ASN 83 0.189 -14.536 7.811 1.00 0.00 H -ATOM 1308 C ASN 83 -2.468 -12.121 4.687 1.00 0.00 C -ATOM 1309 O ASN 83 -1.838 -12.813 3.867 1.00 0.00 O -ATOM 1310 N CYS 84 -2.855 -10.922 4.386 1.00 0.00 N -ATOM 1311 H CYS 84 -3.298 -10.347 5.088 1.00 0.00 H -ATOM 1312 CA CYS 84 -2.888 -10.328 3.074 1.00 0.00 C -ATOM 1313 HA CYS 84 -2.367 -10.905 2.310 1.00 0.00 H -ATOM 1314 CB CYS 84 -4.292 -10.126 2.470 1.00 0.00 C -ATOM 1315 HB2 CYS 84 -4.853 -9.472 3.136 1.00 0.00 H -ATOM 1316 HB3 CYS 84 -4.236 -9.635 1.498 1.00 0.00 H -ATOM 1317 SG CYS 84 -5.259 -11.691 2.529 1.00 0.00 S -ATOM 1318 HG CYS 84 -6.042 -11.404 1.486 1.00 0.00 H -ATOM 1319 C CYS 84 -2.163 -8.922 3.139 1.00 0.00 C -ATOM 1320 O CYS 84 -2.000 -8.291 4.205 1.00 0.00 O -ATOM 1321 N THR 85 -1.763 -8.437 1.944 1.00 0.00 N -ATOM 1322 H THR 85 -1.872 -9.059 1.155 1.00 0.00 H -ATOM 1323 CA THR 85 -1.160 -7.173 1.724 1.00 0.00 C -ATOM 1324 HA THR 85 -1.311 -6.466 2.540 1.00 0.00 H -ATOM 1325 CB THR 85 0.339 -7.370 1.585 1.00 0.00 C -ATOM 1326 HB THR 85 0.558 -8.303 1.066 1.00 0.00 H -ATOM 1327 CG2 THR 85 1.145 -6.101 1.168 1.00 0.00 C -ATOM 1328 HG21 THR 85 0.970 -5.835 0.126 1.00 0.00 H -ATOM 1329 HG22 THR 85 0.976 -5.376 1.964 1.00 0.00 H -ATOM 1330 HG23 THR 85 2.219 -6.281 1.218 1.00 0.00 H -ATOM 1331 OG1 THR 85 0.730 -7.688 2.905 1.00 0.00 O -ATOM 1332 HG1 THR 85 1.654 -7.900 2.760 1.00 0.00 H -ATOM 1333 C THR 85 -1.595 -6.535 0.452 1.00 0.00 C -ATOM 1334 O THR 85 -1.873 -7.180 -0.559 1.00 0.00 O -ATOM 1335 N ILE 86 -1.618 -5.190 0.409 1.00 0.00 N -ATOM 1336 H ILE 86 -1.467 -4.651 1.249 1.00 0.00 H -ATOM 1337 CA ILE 86 -1.776 -4.313 -0.728 1.00 0.00 C -ATOM 1338 HA ILE 86 -1.640 -4.875 -1.651 1.00 0.00 H -ATOM 1339 CB ILE 86 -3.251 -3.805 -0.815 1.00 0.00 C -ATOM 1340 HB ILE 86 -3.427 -2.984 -0.120 1.00 0.00 H -ATOM 1341 CG2 ILE 86 -3.528 -3.141 -2.149 1.00 0.00 C -ATOM 1342 HG21 ILE 86 -4.569 -2.853 -2.291 1.00 0.00 H -ATOM 1343 HG22 ILE 86 -2.909 -2.252 -2.272 1.00 0.00 H -ATOM 1344 HG23 ILE 86 -3.105 -3.762 -2.938 1.00 0.00 H -ATOM 1345 CG1 ILE 86 -4.305 -4.951 -0.626 1.00 0.00 C -ATOM 1346 HG12 ILE 86 -4.391 -5.650 -1.459 1.00 0.00 H -ATOM 1347 HG13 ILE 86 -4.045 -5.626 0.190 1.00 0.00 H -ATOM 1348 CD1 ILE 86 -5.655 -4.514 -0.284 1.00 0.00 C -ATOM 1349 HD11 ILE 86 -5.592 -3.818 0.553 1.00 0.00 H -ATOM 1350 HD12 ILE 86 -5.996 -3.997 -1.180 1.00 0.00 H -ATOM 1351 HD13 ILE 86 -6.323 -5.317 0.027 1.00 0.00 H -ATOM 1352 C ILE 86 -0.816 -3.079 -0.580 1.00 0.00 C -ATOM 1353 O ILE 86 -0.839 -2.309 0.401 1.00 0.00 O -ATOM 1354 N PHE 87 0.156 -3.029 -1.553 1.00 0.00 N -ATOM 1355 H PHE 87 0.083 -3.672 -2.328 1.00 0.00 H -ATOM 1356 CA PHE 87 0.933 -1.847 -1.964 1.00 0.00 C -ATOM 1357 HA PHE 87 1.055 -1.148 -1.137 1.00 0.00 H -ATOM 1358 CB PHE 87 2.263 -2.417 -2.555 1.00 0.00 C -ATOM 1359 HB2 PHE 87 1.831 -3.022 -3.352 1.00 0.00 H -ATOM 1360 HB3 PHE 87 2.891 -1.654 -3.015 1.00 0.00 H -ATOM 1361 CG PHE 87 3.099 -3.247 -1.645 1.00 0.00 C -ATOM 1362 CD1 PHE 87 3.994 -2.625 -0.761 1.00 0.00 C -ATOM 1363 HD1 PHE 87 4.065 -1.548 -0.740 1.00 0.00 H -ATOM 1364 CE1 PHE 87 4.880 -3.333 0.049 1.00 0.00 C -ATOM 1365 HE1 PHE 87 5.562 -2.728 0.628 1.00 0.00 H -ATOM 1366 CZ PHE 87 4.978 -4.728 -0.035 1.00 0.00 C -ATOM 1367 HZ PHE 87 5.666 -5.266 0.601 1.00 0.00 H -ATOM 1368 CE2 PHE 87 4.121 -5.403 -0.976 1.00 0.00 C -ATOM 1369 HE2 PHE 87 3.991 -6.471 -0.875 1.00 0.00 H -ATOM 1370 CD2 PHE 87 3.138 -4.665 -1.682 1.00 0.00 C -ATOM 1371 HD2 PHE 87 2.365 -5.123 -2.281 1.00 0.00 H -ATOM 1372 C PHE 87 0.294 -0.978 -3.061 1.00 0.00 C -ATOM 1373 O PHE 87 -0.178 -1.471 -4.078 1.00 0.00 O -ATOM 1374 N ALA 88 0.171 0.303 -2.803 1.00 0.00 N -ATOM 1375 H ALA 88 0.416 0.661 -1.890 1.00 0.00 H -ATOM 1376 CA ALA 88 0.029 1.231 -3.914 1.00 0.00 C -ATOM 1377 HA ALA 88 -0.514 0.755 -4.731 1.00 0.00 H -ATOM 1378 CB ALA 88 -0.857 2.301 -3.444 1.00 0.00 C -ATOM 1379 HB1 ALA 88 -1.002 2.915 -4.333 1.00 0.00 H -ATOM 1380 HB2 ALA 88 -1.785 1.899 -3.037 1.00 0.00 H -ATOM 1381 HB3 ALA 88 -0.413 2.877 -2.632 1.00 0.00 H -ATOM 1382 C ALA 88 1.396 1.729 -4.446 1.00 0.00 C -ATOM 1383 O ALA 88 2.302 2.192 -3.723 1.00 0.00 O -ATOM 1384 N TYR 89 1.602 1.482 -5.724 1.00 0.00 N -ATOM 1385 H TYR 89 0.914 0.925 -6.211 1.00 0.00 H -ATOM 1386 CA TYR 89 2.937 1.746 -6.408 1.00 0.00 C -ATOM 1387 HA TYR 89 3.625 2.216 -5.705 1.00 0.00 H -ATOM 1388 CB TYR 89 3.530 0.431 -6.933 1.00 0.00 C -ATOM 1389 HB2 TYR 89 3.596 -0.190 -6.039 1.00 0.00 H -ATOM 1390 HB3 TYR 89 2.811 0.002 -7.630 1.00 0.00 H -ATOM 1391 CG TYR 89 4.893 0.547 -7.625 1.00 0.00 C -ATOM 1392 CD1 TYR 89 4.961 0.740 -9.002 1.00 0.00 C -ATOM 1393 HD1 TYR 89 4.061 0.807 -9.596 1.00 0.00 H -ATOM 1394 CE1 TYR 89 6.240 0.962 -9.623 1.00 0.00 C -ATOM 1395 HE1 TYR 89 6.315 1.235 -10.665 1.00 0.00 H -ATOM 1396 CZ TYR 89 7.419 0.809 -8.856 1.00 0.00 C -ATOM 1397 OH TYR 89 8.686 0.779 -9.359 1.00 0.00 O -ATOM 1398 HH TYR 89 8.582 1.250 -10.189 1.00 0.00 H -ATOM 1399 CE2 TYR 89 7.316 0.536 -7.483 1.00 0.00 C -ATOM 1400 HE2 TYR 89 8.225 0.235 -6.983 1.00 0.00 H -ATOM 1401 CD2 TYR 89 6.057 0.482 -6.837 1.00 0.00 C -ATOM 1402 HD2 TYR 89 6.072 0.376 -5.763 1.00 0.00 H -ATOM 1403 C TYR 89 2.630 2.871 -7.453 1.00 0.00 C -ATOM 1404 O TYR 89 1.495 2.905 -8.018 1.00 0.00 O -ATOM 1405 N GLY 90 3.556 3.742 -7.655 1.00 0.00 N -ATOM 1406 H GLY 90 4.314 3.657 -6.994 1.00 0.00 H -ATOM 1407 CA GLY 90 3.403 4.873 -8.556 1.00 0.00 C -ATOM 1408 HA2 GLY 90 3.544 4.562 -9.592 1.00 0.00 H -ATOM 1409 HA3 GLY 90 2.403 5.285 -8.423 1.00 0.00 H -ATOM 1410 C GLY 90 4.341 6.106 -8.354 1.00 0.00 C -ATOM 1411 O GLY 90 4.932 6.280 -7.316 1.00 0.00 O -ATOM 1412 N GLN 91 4.522 6.866 -9.381 1.00 0.00 N -ATOM 1413 H GLN 91 4.083 6.690 -10.273 1.00 0.00 H -ATOM 1414 CA GLN 91 5.256 8.168 -9.316 1.00 0.00 C -ATOM 1415 HA GLN 91 6.253 7.957 -8.928 1.00 0.00 H -ATOM 1416 CB GLN 91 5.243 8.812 -10.708 1.00 0.00 C -ATOM 1417 HB2 GLN 91 5.777 8.114 -11.352 1.00 0.00 H -ATOM 1418 HB3 GLN 91 4.192 8.908 -10.981 1.00 0.00 H -ATOM 1419 CG GLN 91 5.740 10.293 -10.713 1.00 0.00 C -ATOM 1420 HG2 GLN 91 5.114 10.927 -10.085 1.00 0.00 H -ATOM 1421 HG3 GLN 91 6.662 10.134 -10.154 1.00 0.00 H -ATOM 1422 CD GLN 91 5.879 10.962 -12.063 1.00 0.00 C -ATOM 1423 OE1 GLN 91 5.379 10.527 -13.073 1.00 0.00 O -ATOM 1424 NE2 GLN 91 6.724 11.996 -12.208 1.00 0.00 N -ATOM 1425 HE21 GLN 91 6.952 12.321 -13.137 1.00 0.00 H -ATOM 1426 HE22 GLN 91 7.235 12.308 -11.394 1.00 0.00 H -ATOM 1427 C GLN 91 4.581 9.090 -8.310 1.00 0.00 C -ATOM 1428 O GLN 91 3.392 8.992 -8.034 1.00 0.00 O -ATOM 1429 N THR 92 5.325 10.008 -7.739 1.00 0.00 N -ATOM 1430 H THR 92 6.325 9.856 -7.739 1.00 0.00 H -ATOM 1431 CA THR 92 4.776 11.057 -6.865 1.00 0.00 C -ATOM 1432 HA THR 92 4.410 10.689 -5.907 1.00 0.00 H -ATOM 1433 CB THR 92 5.917 12.090 -6.620 1.00 0.00 C -ATOM 1434 HB THR 92 6.269 12.415 -7.598 1.00 0.00 H -ATOM 1435 CG2 THR 92 5.572 13.271 -5.728 1.00 0.00 C -ATOM 1436 HG21 THR 92 5.648 12.981 -4.680 1.00 0.00 H -ATOM 1437 HG22 THR 92 6.227 14.109 -5.964 1.00 0.00 H -ATOM 1438 HG23 THR 92 4.591 13.611 -6.059 1.00 0.00 H -ATOM 1439 OG1 THR 92 7.006 11.555 -5.993 1.00 0.00 O -ATOM 1440 HG1 THR 92 7.680 11.478 -6.674 1.00 0.00 H -ATOM 1441 C THR 92 3.659 11.855 -7.624 1.00 0.00 C -ATOM 1442 O THR 92 3.889 12.458 -8.673 1.00 0.00 O -ATOM 1443 N GLY 93 2.457 11.906 -7.011 1.00 0.00 N -ATOM 1444 H GLY 93 2.436 11.455 -6.107 1.00 0.00 H -ATOM 1445 CA GLY 93 1.183 12.506 -7.485 1.00 0.00 C -ATOM 1446 HA2 GLY 93 0.689 13.064 -6.690 1.00 0.00 H -ATOM 1447 HA3 GLY 93 1.420 13.222 -8.271 1.00 0.00 H -ATOM 1448 C GLY 93 0.159 11.494 -8.070 1.00 0.00 C -ATOM 1449 O GLY 93 -0.981 11.848 -8.244 1.00 0.00 O -ATOM 1450 N THR 94 0.492 10.216 -8.307 1.00 0.00 N -ATOM 1451 H THR 94 1.436 9.975 -8.041 1.00 0.00 H -ATOM 1452 CA THR 94 -0.366 9.140 -8.973 1.00 0.00 C -ATOM 1453 HA THR 94 -0.704 9.491 -9.949 1.00 0.00 H -ATOM 1454 CB THR 94 0.448 7.886 -9.272 1.00 0.00 C -ATOM 1455 HB THR 94 -0.174 7.071 -9.642 1.00 0.00 H -ATOM 1456 CG2 THR 94 1.405 8.166 -10.384 1.00 0.00 C -ATOM 1457 HG21 THR 94 2.010 9.010 -10.053 1.00 0.00 H -ATOM 1458 HG22 THR 94 2.087 7.328 -10.528 1.00 0.00 H -ATOM 1459 HG23 THR 94 0.790 8.412 -11.250 1.00 0.00 H -ATOM 1460 OG1 THR 94 1.037 7.333 -8.097 1.00 0.00 O -ATOM 1461 HG1 THR 94 0.536 6.526 -7.954 1.00 0.00 H -ATOM 1462 C THR 94 -1.669 8.754 -8.229 1.00 0.00 C -ATOM 1463 O THR 94 -2.593 8.188 -8.914 1.00 0.00 O -ATOM 1464 N GLY 95 -1.815 9.081 -6.895 1.00 0.00 N -ATOM 1465 H GLY 95 -0.954 9.498 -6.569 1.00 0.00 H -ATOM 1466 CA GLY 95 -2.965 8.814 -6.005 1.00 0.00 C -ATOM 1467 HA2 GLY 95 -3.124 9.695 -5.384 1.00 0.00 H -ATOM 1468 HA3 GLY 95 -3.856 8.575 -6.588 1.00 0.00 H -ATOM 1469 C GLY 95 -2.852 7.670 -5.067 1.00 0.00 C -ATOM 1470 O GLY 95 -3.852 7.139 -4.657 1.00 0.00 O -ATOM 1471 N LYS 96 -1.620 7.320 -4.731 1.00 0.00 N -ATOM 1472 H LYS 96 -0.814 7.845 -5.038 1.00 0.00 H -ATOM 1473 CA LYS 96 -1.343 6.274 -3.751 1.00 0.00 C -ATOM 1474 HA LYS 96 -1.700 5.341 -4.187 1.00 0.00 H -ATOM 1475 CB LYS 96 0.149 6.142 -3.485 1.00 0.00 C -ATOM 1476 HB2 LYS 96 0.615 7.106 -3.282 1.00 0.00 H -ATOM 1477 HB3 LYS 96 0.390 5.461 -2.669 1.00 0.00 H -ATOM 1478 CG LYS 96 0.875 5.514 -4.696 1.00 0.00 C -ATOM 1479 HG2 LYS 96 0.519 4.495 -4.846 1.00 0.00 H -ATOM 1480 HG3 LYS 96 0.681 6.072 -5.612 1.00 0.00 H -ATOM 1481 CD LYS 96 2.368 5.523 -4.729 1.00 0.00 C -ATOM 1482 HD2 LYS 96 2.797 4.889 -3.954 1.00 0.00 H -ATOM 1483 HD3 LYS 96 2.750 5.199 -5.698 1.00 0.00 H -ATOM 1484 CE LYS 96 2.971 6.924 -4.455 1.00 0.00 C -ATOM 1485 HE2 LYS 96 2.887 7.191 -3.401 1.00 0.00 H -ATOM 1486 HE3 LYS 96 4.043 6.843 -4.633 1.00 0.00 H -ATOM 1487 NZ LYS 96 2.518 8.074 -5.364 1.00 0.00 N -ATOM 1488 HZ1 LYS 96 2.914 7.943 -6.283 1.00 0.00 H -ATOM 1489 HZ2 LYS 96 1.508 8.053 -5.347 1.00 0.00 H -ATOM 1490 HZ3 LYS 96 2.754 8.995 -5.024 1.00 0.00 H -ATOM 1491 C LYS 96 -2.029 6.597 -2.414 1.00 0.00 C -ATOM 1492 O LYS 96 -2.983 5.944 -2.044 1.00 0.00 O -ATOM 1493 N THR 97 -1.571 7.702 -1.787 1.00 0.00 N -ATOM 1494 H THR 97 -0.731 8.143 -2.134 1.00 0.00 H -ATOM 1495 CA THR 97 -2.296 8.196 -0.607 1.00 0.00 C -ATOM 1496 HA THR 97 -2.309 7.393 0.130 1.00 0.00 H -ATOM 1497 CB THR 97 -1.492 9.356 0.004 1.00 0.00 C -ATOM 1498 HB THR 97 -1.667 10.278 -0.553 1.00 0.00 H -ATOM 1499 CG2 THR 97 -1.948 9.569 1.426 1.00 0.00 C -ATOM 1500 HG21 THR 97 -1.378 10.259 2.049 1.00 0.00 H -ATOM 1501 HG22 THR 97 -3.004 9.838 1.400 1.00 0.00 H -ATOM 1502 HG23 THR 97 -2.015 8.680 2.053 1.00 0.00 H -ATOM 1503 OG1 THR 97 -0.120 9.099 -0.007 1.00 0.00 O -ATOM 1504 HG1 THR 97 -0.006 8.345 0.577 1.00 0.00 H -ATOM 1505 C THR 97 -3.815 8.494 -0.806 1.00 0.00 C -ATOM 1506 O THR 97 -4.654 8.183 0.012 1.00 0.00 O -ATOM 1507 N PHE 98 -4.218 8.898 -1.983 1.00 0.00 N -ATOM 1508 H PHE 98 -3.563 9.053 -2.736 1.00 0.00 H -ATOM 1509 CA PHE 98 -5.622 9.089 -2.281 1.00 0.00 C -ATOM 1510 HA PHE 98 -6.068 9.705 -1.502 1.00 0.00 H -ATOM 1511 CB PHE 98 -5.849 9.842 -3.602 1.00 0.00 C -ATOM 1512 HB2 PHE 98 -5.291 10.774 -3.501 1.00 0.00 H -ATOM 1513 HB3 PHE 98 -5.478 9.322 -4.484 1.00 0.00 H -ATOM 1514 CG PHE 98 -7.302 10.238 -3.803 1.00 0.00 C -ATOM 1515 CD1 PHE 98 -8.100 9.497 -4.651 1.00 0.00 C -ATOM 1516 HD1 PHE 98 -7.594 8.733 -5.224 1.00 0.00 H -ATOM 1517 CE1 PHE 98 -9.484 9.670 -4.642 1.00 0.00 C -ATOM 1518 HE1 PHE 98 -10.073 9.094 -5.340 1.00 0.00 H -ATOM 1519 CZ PHE 98 -10.135 10.555 -3.728 1.00 0.00 C -ATOM 1520 HZ PHE 98 -11.203 10.659 -3.602 1.00 0.00 H -ATOM 1521 CE2 PHE 98 -9.320 11.399 -2.954 1.00 0.00 C -ATOM 1522 HE2 PHE 98 -9.803 12.062 -2.252 1.00 0.00 H -ATOM 1523 CD2 PHE 98 -7.896 11.249 -2.936 1.00 0.00 C -ATOM 1524 HD2 PHE 98 -7.260 11.806 -2.264 1.00 0.00 H -ATOM 1525 C PHE 98 -6.420 7.728 -2.169 1.00 0.00 C -ATOM 1526 O PHE 98 -7.297 7.634 -1.341 1.00 0.00 O -ATOM 1527 N THR 99 -5.981 6.655 -2.842 1.00 0.00 N -ATOM 1528 H THR 99 -5.214 6.787 -3.486 1.00 0.00 H -ATOM 1529 CA THR 99 -6.520 5.295 -2.710 1.00 0.00 C -ATOM 1530 HA THR 99 -7.592 5.218 -2.892 1.00 0.00 H -ATOM 1531 CB THR 99 -5.840 4.361 -3.703 1.00 0.00 C -ATOM 1532 HB THR 99 -4.805 4.121 -3.461 1.00 0.00 H -ATOM 1533 CG2 THR 99 -6.588 3.119 -3.883 1.00 0.00 C -ATOM 1534 HG21 THR 99 -6.646 2.596 -2.928 1.00 0.00 H -ATOM 1535 HG22 THR 99 -7.559 3.229 -4.366 1.00 0.00 H -ATOM 1536 HG23 THR 99 -5.987 2.443 -4.491 1.00 0.00 H -ATOM 1537 OG1 THR 99 -5.863 4.764 -5.058 1.00 0.00 O -ATOM 1538 HG1 THR 99 -5.273 5.494 -5.259 1.00 0.00 H -ATOM 1539 C THR 99 -6.444 4.721 -1.322 1.00 0.00 C -ATOM 1540 O THR 99 -7.401 4.018 -0.868 1.00 0.00 O -ATOM 1541 N MET 100 -5.370 4.986 -0.587 1.00 0.00 N -ATOM 1542 H MET 100 -4.724 5.601 -1.062 1.00 0.00 H -ATOM 1543 CA MET 100 -5.084 4.404 0.791 1.00 0.00 C -ATOM 1544 HA MET 100 -5.500 3.410 0.630 1.00 0.00 H -ATOM 1545 CB MET 100 -3.602 4.259 1.110 1.00 0.00 C -ATOM 1546 HB2 MET 100 -3.118 5.235 1.141 1.00 0.00 H -ATOM 1547 HB3 MET 100 -3.624 3.719 2.055 1.00 0.00 H -ATOM 1548 CG MET 100 -2.881 3.363 0.063 1.00 0.00 C -ATOM 1549 HG2 MET 100 -2.555 3.989 -0.769 1.00 0.00 H -ATOM 1550 HG3 MET 100 -1.926 3.065 0.498 1.00 0.00 H -ATOM 1551 SD MET 100 -3.722 1.810 -0.421 1.00 0.00 S -ATOM 1552 CE MET 100 -2.377 0.718 0.030 1.00 0.00 C -ATOM 1553 HE1 MET 100 -2.525 -0.343 -0.174 1.00 0.00 H -ATOM 1554 HE2 MET 100 -1.571 1.126 -0.579 1.00 0.00 H -ATOM 1555 HE3 MET 100 -2.129 0.830 1.085 1.00 0.00 H -ATOM 1556 C MET 100 -6.001 5.066 1.835 1.00 0.00 C -ATOM 1557 O MET 100 -6.769 4.424 2.491 1.00 0.00 O -ATOM 1558 N GLU 101 -6.075 6.404 1.971 1.00 0.00 N -ATOM 1559 H GLU 101 -5.526 6.926 1.302 1.00 0.00 H -ATOM 1560 CA GLU 101 -6.883 7.012 3.041 1.00 0.00 C -ATOM 1561 HA GLU 101 -7.619 6.340 3.485 1.00 0.00 H -ATOM 1562 CB GLU 101 -5.910 7.395 4.244 1.00 0.00 C -ATOM 1563 HB2 GLU 101 -6.330 7.341 5.249 1.00 0.00 H -ATOM 1564 HB3 GLU 101 -5.083 6.685 4.255 1.00 0.00 H -ATOM 1565 CG GLU 101 -5.391 8.811 4.000 1.00 0.00 C -ATOM 1566 HG2 GLU 101 -5.035 8.989 2.985 1.00 0.00 H -ATOM 1567 HG3 GLU 101 -6.110 9.575 4.298 1.00 0.00 H -ATOM 1568 CD GLU 101 -4.074 9.120 4.814 1.00 0.00 C -ATOM 1569 OE1 GLU 101 -3.216 8.214 4.908 1.00 0.00 O -ATOM 1570 OE2 GLU 101 -3.922 10.234 5.322 1.00 0.00 O -ATOM 1571 C GLU 101 -7.775 8.131 2.503 1.00 0.00 C -ATOM 1572 O GLU 101 -8.907 8.251 2.980 1.00 0.00 O -ATOM 1573 N GLY 102 -7.475 8.795 1.388 1.00 0.00 N -ATOM 1574 H GLY 102 -6.671 8.464 0.875 1.00 0.00 H -ATOM 1575 CA GLY 102 -8.227 9.877 0.836 1.00 0.00 C -ATOM 1576 HA2 GLY 102 -7.783 10.325 -0.052 1.00 0.00 H -ATOM 1577 HA3 GLY 102 -9.222 9.500 0.598 1.00 0.00 H -ATOM 1578 C GLY 102 -8.516 11.067 1.845 1.00 0.00 C -ATOM 1579 O GLY 102 -7.673 11.712 2.357 1.00 0.00 O -ATOM 1580 N GLU 103 -9.760 11.310 2.011 1.00 0.00 N -ATOM 1581 H GLU 103 -10.399 10.708 1.512 1.00 0.00 H -ATOM 1582 CA GLU 103 -10.343 12.270 2.932 1.00 0.00 C -ATOM 1583 HA GLU 103 -9.676 12.352 3.790 1.00 0.00 H -ATOM 1584 CB GLU 103 -10.455 13.699 2.410 1.00 0.00 C -ATOM 1585 HB2 GLU 103 -9.527 13.896 1.873 1.00 0.00 H -ATOM 1586 HB3 GLU 103 -11.239 13.720 1.654 1.00 0.00 H -ATOM 1587 CG GLU 103 -10.736 14.704 3.449 1.00 0.00 C -ATOM 1588 HG2 GLU 103 -11.226 15.582 3.031 1.00 0.00 H -ATOM 1589 HG3 GLU 103 -11.514 14.266 4.076 1.00 0.00 H -ATOM 1590 CD GLU 103 -9.530 15.149 4.275 1.00 0.00 C -ATOM 1591 OE1 GLU 103 -9.448 14.766 5.449 1.00 0.00 O -ATOM 1592 OE2 GLU 103 -8.662 15.790 3.634 1.00 0.00 O -ATOM 1593 C GLU 103 -11.814 11.735 3.309 1.00 0.00 C -ATOM 1594 O GLU 103 -12.525 11.362 2.344 1.00 0.00 O -ATOM 1595 N ARG 104 -12.218 11.661 4.586 1.00 0.00 N -ATOM 1596 H ARG 104 -11.621 11.860 5.375 1.00 0.00 H -ATOM 1597 CA ARG 104 -13.496 10.987 5.039 1.00 0.00 C -ATOM 1598 HA ARG 104 -14.054 10.549 4.211 1.00 0.00 H -ATOM 1599 CB ARG 104 -13.176 9.789 5.953 1.00 0.00 C -ATOM 1600 HB2 ARG 104 -14.087 9.198 6.047 1.00 0.00 H -ATOM 1601 HB3 ARG 104 -12.401 9.185 5.480 1.00 0.00 H -ATOM 1602 CG ARG 104 -12.850 10.126 7.436 1.00 0.00 C -ATOM 1603 HG2 ARG 104 -11.869 10.592 7.333 1.00 0.00 H -ATOM 1604 HG3 ARG 104 -13.572 10.850 7.815 1.00 0.00 H -ATOM 1605 CD ARG 104 -12.682 9.001 8.401 1.00 0.00 C -ATOM 1606 HD2 ARG 104 -13.596 8.484 8.695 1.00 0.00 H -ATOM 1607 HD3 ARG 104 -11.975 8.283 7.985 1.00 0.00 H -ATOM 1608 NE ARG 104 -11.998 9.540 9.583 1.00 0.00 N -ATOM 1609 HE ARG 104 -10.988 9.555 9.559 1.00 0.00 H -ATOM 1610 CZ ARG 104 -12.613 10.190 10.516 1.00 0.00 C -ATOM 1611 NH1 ARG 104 -13.841 10.150 10.792 1.00 0.00 N -ATOM 1612 HH11 ARG 104 -14.413 9.560 10.204 1.00 0.00 H -ATOM 1613 HH12 ARG 104 -14.099 10.324 11.753 1.00 0.00 H -ATOM 1614 NH2 ARG 104 -11.882 10.858 11.329 1.00 0.00 N -ATOM 1615 HH21 ARG 104 -10.947 11.100 11.034 1.00 0.00 H -ATOM 1616 HH22 ARG 104 -12.276 11.275 12.160 1.00 0.00 H -ATOM 1617 C ARG 104 -14.471 11.933 5.774 1.00 0.00 C -ATOM 1618 O ARG 104 -14.119 13.035 6.239 1.00 0.00 O -ATOM 1619 N SER 105 -15.743 11.474 5.932 1.00 0.00 N -ATOM 1620 H SER 105 -15.914 10.489 5.788 1.00 0.00 H -ATOM 1621 CA SER 105 -16.806 12.261 6.523 1.00 0.00 C -ATOM 1622 HA SER 105 -16.648 13.318 6.308 1.00 0.00 H -ATOM 1623 CB SER 105 -18.146 11.825 5.919 1.00 0.00 C -ATOM 1624 HB2 SER 105 -18.403 10.807 6.210 1.00 0.00 H -ATOM 1625 HB3 SER 105 -18.893 12.422 6.441 1.00 0.00 H -ATOM 1626 OG SER 105 -18.221 11.887 4.528 1.00 0.00 O -ATOM 1627 HG SER 105 -17.592 11.267 4.151 1.00 0.00 H -ATOM 1628 C SER 105 -16.755 12.153 8.051 1.00 0.00 C -ATOM 1629 O SER 105 -16.044 11.330 8.556 1.00 0.00 O -ATOM 1630 N PRO 106 -17.361 13.014 8.850 1.00 0.00 N -ATOM 1631 CD PRO 106 -17.748 14.341 8.434 1.00 0.00 C -ATOM 1632 HD2 PRO 106 -18.573 14.275 7.724 1.00 0.00 H -ATOM 1633 HD3 PRO 106 -16.985 14.879 7.872 1.00 0.00 H -ATOM 1634 CG PRO 106 -18.164 15.119 9.648 1.00 0.00 C -ATOM 1635 HG2 PRO 106 -19.097 15.605 9.364 1.00 0.00 H -ATOM 1636 HG3 PRO 106 -17.493 15.936 9.913 1.00 0.00 H -ATOM 1637 CB PRO 106 -18.297 14.111 10.793 1.00 0.00 C -ATOM 1638 HB2 PRO 106 -19.340 13.818 10.914 1.00 0.00 H -ATOM 1639 HB3 PRO 106 -17.933 14.563 11.716 1.00 0.00 H -ATOM 1640 CA PRO 106 -17.485 12.850 10.326 1.00 0.00 C -ATOM 1641 HA PRO 106 -16.456 12.911 10.676 1.00 0.00 H -ATOM 1642 C PRO 106 -18.213 11.587 10.714 1.00 0.00 C -ATOM 1643 O PRO 106 -19.127 11.135 9.958 1.00 0.00 O -ATOM 1644 N ASN 107 -17.847 10.957 11.815 1.00 0.00 N -ATOM 1645 H ASN 107 -17.272 11.531 12.416 1.00 0.00 H -ATOM 1646 CA ASN 107 -18.264 9.650 12.167 1.00 0.00 C -ATOM 1647 HA ASN 107 -17.943 8.900 11.445 1.00 0.00 H -ATOM 1648 CB ASN 107 -17.597 9.371 13.537 1.00 0.00 C -ATOM 1649 HB2 ASN 107 -17.317 10.328 13.979 1.00 0.00 H -ATOM 1650 HB3 ASN 107 -18.243 8.791 14.195 1.00 0.00 H -ATOM 1651 CG ASN 107 -16.409 8.509 13.403 1.00 0.00 C -ATOM 1652 OD1 ASN 107 -15.307 8.974 13.099 1.00 0.00 O -ATOM 1653 ND2 ASN 107 -16.549 7.207 13.567 1.00 0.00 N -ATOM 1654 HD21 ASN 107 -15.680 6.695 13.525 1.00 0.00 H -ATOM 1655 HD22 ASN 107 -17.422 6.725 13.731 1.00 0.00 H -ATOM 1656 C ASN 107 -19.791 9.446 12.149 1.00 0.00 C -ATOM 1657 O ASN 107 -20.612 10.251 12.515 1.00 0.00 O -ATOM 1658 N GLU 108 -20.160 8.248 11.697 1.00 0.00 N -ATOM 1659 H GLU 108 -19.379 7.644 11.485 1.00 0.00 H -ATOM 1660 CA GLU 108 -21.530 7.719 11.547 1.00 0.00 C -ATOM 1661 HA GLU 108 -21.516 6.761 11.028 1.00 0.00 H -ATOM 1662 CB GLU 108 -22.129 7.411 12.963 1.00 0.00 C -ATOM 1663 HB2 GLU 108 -22.565 8.326 13.363 1.00 0.00 H -ATOM 1664 HB3 GLU 108 -22.968 6.722 12.864 1.00 0.00 H -ATOM 1665 CG GLU 108 -21.103 6.854 14.000 1.00 0.00 C -ATOM 1666 HG2 GLU 108 -20.330 7.569 14.280 1.00 0.00 H -ATOM 1667 HG3 GLU 108 -21.617 6.630 14.935 1.00 0.00 H -ATOM 1668 CD GLU 108 -20.291 5.648 13.467 1.00 0.00 C -ATOM 1669 OE1 GLU 108 -20.859 4.649 12.971 1.00 0.00 O -ATOM 1670 OE2 GLU 108 -19.029 5.700 13.624 1.00 0.00 O -ATOM 1671 C GLU 108 -22.496 8.676 10.724 1.00 0.00 C -ATOM 1672 O GLU 108 -23.733 8.418 10.834 1.00 0.00 O -ATOM 1673 N GLU 109 -22.052 9.756 10.110 1.00 0.00 N -ATOM 1674 H GLU 109 -21.062 9.915 10.233 1.00 0.00 H -ATOM 1675 CA GLU 109 -22.911 10.558 9.266 1.00 0.00 C -ATOM 1676 HA GLU 109 -23.876 10.717 9.749 1.00 0.00 H -ATOM 1677 CB GLU 109 -22.257 11.957 9.100 1.00 0.00 C -ATOM 1678 HB2 GLU 109 -21.291 11.789 8.627 1.00 0.00 H -ATOM 1679 HB3 GLU 109 -22.881 12.457 8.360 1.00 0.00 H -ATOM 1680 CG GLU 109 -22.114 12.721 10.432 1.00 0.00 C -ATOM 1681 HG2 GLU 109 -21.391 12.197 11.058 1.00 0.00 H -ATOM 1682 HG3 GLU 109 -21.609 13.676 10.291 1.00 0.00 H -ATOM 1683 CD GLU 109 -23.461 12.977 11.152 1.00 0.00 C -ATOM 1684 OE1 GLU 109 -24.527 13.135 10.457 1.00 0.00 O -ATOM 1685 OE2 GLU 109 -23.443 12.971 12.390 1.00 0.00 O -ATOM 1686 C GLU 109 -23.188 9.800 7.989 1.00 0.00 C -ATOM 1687 O GLU 109 -24.306 9.759 7.495 1.00 0.00 O -ATOM 1688 N TYR 110 -22.126 9.271 7.351 1.00 0.00 N -ATOM 1689 H TYR 110 -21.268 9.310 7.884 1.00 0.00 H -ATOM 1690 CA TYR 110 -22.026 8.568 6.085 1.00 0.00 C -ATOM 1691 HA TYR 110 -23.028 8.365 5.709 1.00 0.00 H -ATOM 1692 CB TYR 110 -21.231 9.394 5.125 1.00 0.00 C -ATOM 1693 HB2 TYR 110 -20.393 9.737 5.731 1.00 0.00 H -ATOM 1694 HB3 TYR 110 -20.855 8.867 4.248 1.00 0.00 H -ATOM 1695 CG TYR 110 -22.115 10.545 4.557 1.00 0.00 C -ATOM 1696 CD1 TYR 110 -22.670 10.430 3.330 1.00 0.00 C -ATOM 1697 HD1 TYR 110 -22.613 9.461 2.856 1.00 0.00 H -ATOM 1698 CE1 TYR 110 -23.240 11.509 2.688 1.00 0.00 C -ATOM 1699 HE1 TYR 110 -23.661 11.407 1.699 1.00 0.00 H -ATOM 1700 CZ TYR 110 -23.244 12.755 3.328 1.00 0.00 C -ATOM 1701 OH TYR 110 -23.865 13.838 2.872 1.00 0.00 O -ATOM 1702 HH TYR 110 -24.368 13.554 2.105 1.00 0.00 H -ATOM 1703 CE2 TYR 110 -22.764 12.835 4.661 1.00 0.00 C -ATOM 1704 HE2 TYR 110 -22.827 13.770 5.198 1.00 0.00 H -ATOM 1705 CD2 TYR 110 -22.162 11.720 5.286 1.00 0.00 C -ATOM 1706 HD2 TYR 110 -21.808 11.832 6.300 1.00 0.00 H -ATOM 1707 C TYR 110 -21.287 7.236 6.346 1.00 0.00 C -ATOM 1708 O TYR 110 -20.299 7.107 7.067 1.00 0.00 O -ATOM 1709 N THR 111 -21.925 6.192 5.688 1.00 0.00 N -ATOM 1710 H THR 111 -22.859 6.382 5.351 1.00 0.00 H -ATOM 1711 CA THR 111 -21.354 4.811 5.761 1.00 0.00 C -ATOM 1712 HA THR 111 -20.935 4.756 6.765 1.00 0.00 H -ATOM 1713 CB THR 111 -22.432 3.711 5.626 1.00 0.00 C -ATOM 1714 HB THR 111 -23.318 4.022 6.180 1.00 0.00 H -ATOM 1715 CG2 THR 111 -22.901 3.590 4.217 1.00 0.00 C -ATOM 1716 HG21 THR 111 -23.183 4.592 3.898 1.00 0.00 H -ATOM 1717 HG22 THR 111 -22.203 3.156 3.501 1.00 0.00 H -ATOM 1718 HG23 THR 111 -23.838 3.037 4.275 1.00 0.00 H -ATOM 1719 OG1 THR 111 -21.912 2.386 6.011 1.00 0.00 O -ATOM 1720 HG1 THR 111 -22.669 1.843 6.246 1.00 0.00 H -ATOM 1721 C THR 111 -20.252 4.533 4.741 1.00 0.00 C -ATOM 1722 O THR 111 -20.090 5.282 3.781 1.00 0.00 O -ATOM 1723 N TRP 112 -19.418 3.507 5.002 1.00 0.00 N -ATOM 1724 H TRP 112 -19.670 2.923 5.787 1.00 0.00 H -ATOM 1725 CA TRP 112 -18.267 3.092 4.121 1.00 0.00 C -ATOM 1726 HA TRP 112 -17.447 3.811 4.095 1.00 0.00 H -ATOM 1727 CB TRP 112 -17.782 1.740 4.593 1.00 0.00 C -ATOM 1728 HB2 TRP 112 -16.917 1.427 4.007 1.00 0.00 H -ATOM 1729 HB3 TRP 112 -17.411 1.805 5.617 1.00 0.00 H -ATOM 1730 CG TRP 112 -18.764 0.665 4.485 1.00 0.00 C -ATOM 1731 CD1 TRP 112 -19.585 0.361 5.572 1.00 0.00 C -ATOM 1732 HD1 TRP 112 -19.734 1.041 6.398 1.00 0.00 H -ATOM 1733 NE1 TRP 112 -20.335 -0.692 5.223 1.00 0.00 N -ATOM 1734 HE1 TRP 112 -21.107 -1.052 5.766 1.00 0.00 H -ATOM 1735 CE2 TRP 112 -20.003 -1.169 3.990 1.00 0.00 C -ATOM 1736 CZ2 TRP 112 -20.588 -2.205 3.298 1.00 0.00 C -ATOM 1737 HZ2 TRP 112 -21.502 -2.563 3.751 1.00 0.00 H -ATOM 1738 CH2 TRP 112 -20.054 -2.561 2.050 1.00 0.00 C -ATOM 1739 HH2 TRP 112 -20.531 -3.323 1.451 1.00 0.00 H -ATOM 1740 CZ3 TRP 112 -18.962 -1.842 1.568 1.00 0.00 C -ATOM 1741 HZ3 TRP 112 -18.524 -2.111 0.618 1.00 0.00 H -ATOM 1742 CE3 TRP 112 -18.343 -0.803 2.253 1.00 0.00 C -ATOM 1743 HE3 TRP 112 -17.625 -0.175 1.745 1.00 0.00 H -ATOM 1744 CD2 TRP 112 -18.954 -0.403 3.480 1.00 0.00 C -ATOM 1745 C TRP 112 -18.517 2.891 2.593 1.00 0.00 C -ATOM 1746 O TRP 112 -17.533 2.903 1.869 1.00 0.00 O -ATOM 1747 N GLU 113 -19.751 2.798 2.146 1.00 0.00 N -ATOM 1748 H GLU 113 -20.429 2.518 2.839 1.00 0.00 H -ATOM 1749 CA GLU 113 -20.163 2.792 0.683 1.00 0.00 C -ATOM 1750 HA GLU 113 -19.352 2.350 0.105 1.00 0.00 H -ATOM 1751 CB GLU 113 -21.430 1.921 0.512 1.00 0.00 C -ATOM 1752 HB2 GLU 113 -22.238 2.378 1.084 1.00 0.00 H -ATOM 1753 HB3 GLU 113 -21.680 1.958 -0.549 1.00 0.00 H -ATOM 1754 CG GLU 113 -21.251 0.463 0.931 1.00 0.00 C -ATOM 1755 HG2 GLU 113 -20.330 0.103 0.473 1.00 0.00 H -ATOM 1756 HG3 GLU 113 -21.133 0.485 2.014 1.00 0.00 H -ATOM 1757 CD GLU 113 -22.388 -0.351 0.565 1.00 0.00 C -ATOM 1758 OE1 GLU 113 -22.265 -0.845 -0.553 1.00 0.00 O -ATOM 1759 OE2 GLU 113 -23.311 -0.522 1.389 1.00 0.00 O -ATOM 1760 C GLU 113 -20.468 4.162 0.083 1.00 0.00 C -ATOM 1761 O GLU 113 -20.314 4.370 -1.128 1.00 0.00 O -ATOM 1762 N GLU 114 -20.992 5.091 0.879 1.00 0.00 N -ATOM 1763 H GLU 114 -21.150 4.853 1.848 1.00 0.00 H -ATOM 1764 CA GLU 114 -21.369 6.424 0.523 1.00 0.00 C -ATOM 1765 HA GLU 114 -21.667 6.552 -0.518 1.00 0.00 H -ATOM 1766 CB GLU 114 -22.674 6.856 1.273 1.00 0.00 C -ATOM 1767 HB2 GLU 114 -22.502 6.754 2.345 1.00 0.00 H -ATOM 1768 HB3 GLU 114 -22.938 7.883 1.022 1.00 0.00 H -ATOM 1769 CG GLU 114 -23.911 6.076 0.937 1.00 0.00 C -ATOM 1770 HG2 GLU 114 -23.873 5.077 1.370 1.00 0.00 H -ATOM 1771 HG3 GLU 114 -24.674 6.577 1.534 1.00 0.00 H -ATOM 1772 CD GLU 114 -24.355 6.053 -0.618 1.00 0.00 C -ATOM 1773 OE1 GLU 114 -25.224 5.244 -1.042 1.00 0.00 O -ATOM 1774 OE2 GLU 114 -23.872 6.975 -1.292 1.00 0.00 O -ATOM 1775 C GLU 114 -20.388 7.531 0.762 1.00 0.00 C -ATOM 1776 O GLU 114 -20.635 8.534 0.101 1.00 0.00 O -ATOM 1777 N ASP 115 -19.402 7.425 1.655 1.00 0.00 N -ATOM 1778 H ASP 115 -19.317 6.511 2.074 1.00 0.00 H -ATOM 1779 CA ASP 115 -18.523 8.499 2.046 1.00 0.00 C -ATOM 1780 HA ASP 115 -19.124 9.387 2.243 1.00 0.00 H -ATOM 1781 CB ASP 115 -17.882 7.978 3.387 1.00 0.00 C -ATOM 1782 HB2 ASP 115 -18.646 7.772 4.135 1.00 0.00 H -ATOM 1783 HB3 ASP 115 -17.395 7.027 3.167 1.00 0.00 H -ATOM 1784 CG ASP 115 -16.905 8.963 4.000 1.00 0.00 C -ATOM 1785 OD1 ASP 115 -16.687 10.060 3.397 1.00 0.00 O -ATOM 1786 OD2 ASP 115 -16.371 8.623 5.072 1.00 0.00 O -ATOM 1787 C ASP 115 -17.596 8.874 0.845 1.00 0.00 C -ATOM 1788 O ASP 115 -16.728 8.073 0.436 1.00 0.00 O -ATOM 1789 N PRO 116 -17.705 10.087 0.242 1.00 0.00 N -ATOM 1790 CD PRO 116 -18.405 11.268 0.745 1.00 0.00 C -ATOM 1791 HD2 PRO 116 -18.069 11.367 1.777 1.00 0.00 H -ATOM 1792 HD3 PRO 116 -19.486 11.284 0.617 1.00 0.00 H -ATOM 1793 CG PRO 116 -17.951 12.403 -0.126 1.00 0.00 C -ATOM 1794 HG2 PRO 116 -16.924 12.711 0.070 1.00 0.00 H -ATOM 1795 HG3 PRO 116 -18.657 13.232 -0.173 1.00 0.00 H -ATOM 1796 CB PRO 116 -17.922 11.683 -1.489 1.00 0.00 C -ATOM 1797 HB2 PRO 116 -17.370 12.180 -2.287 1.00 0.00 H -ATOM 1798 HB3 PRO 116 -18.929 11.460 -1.843 1.00 0.00 H -ATOM 1799 CA PRO 116 -17.303 10.328 -1.131 1.00 0.00 C -ATOM 1800 HA PRO 116 -17.779 9.561 -1.741 1.00 0.00 H -ATOM 1801 C PRO 116 -15.847 10.280 -1.500 1.00 0.00 C -ATOM 1802 O PRO 116 -15.509 9.714 -2.505 1.00 0.00 O -ATOM 1803 N LEU 117 -14.937 10.929 -0.754 1.00 0.00 N -ATOM 1804 H LEU 117 -15.208 11.299 0.147 1.00 0.00 H -ATOM 1805 CA LEU 117 -13.488 11.023 -0.975 1.00 0.00 C -ATOM 1806 HA LEU 117 -13.359 10.885 -2.048 1.00 0.00 H -ATOM 1807 CB LEU 117 -13.015 12.396 -0.739 1.00 0.00 C -ATOM 1808 HB2 LEU 117 -13.391 12.671 0.246 1.00 0.00 H -ATOM 1809 HB3 LEU 117 -11.939 12.556 -0.688 1.00 0.00 H -ATOM 1810 CG LEU 117 -13.608 13.410 -1.675 1.00 0.00 C -ATOM 1811 HG LEU 117 -14.625 13.139 -1.957 1.00 0.00 H -ATOM 1812 CD1 LEU 117 -13.653 14.840 -1.096 1.00 0.00 C -ATOM 1813 HD11 LEU 117 -14.364 14.910 -0.273 1.00 0.00 H -ATOM 1814 HD12 LEU 117 -12.631 14.926 -0.729 1.00 0.00 H -ATOM 1815 HD13 LEU 117 -13.976 15.523 -1.882 1.00 0.00 H -ATOM 1816 CD2 LEU 117 -12.800 13.551 -2.935 1.00 0.00 C -ATOM 1817 HD21 LEU 117 -13.341 14.033 -3.750 1.00 0.00 H -ATOM 1818 HD22 LEU 117 -11.808 13.956 -2.735 1.00 0.00 H -ATOM 1819 HD23 LEU 117 -12.676 12.557 -3.365 1.00 0.00 H -ATOM 1820 C LEU 117 -12.644 9.959 -0.224 1.00 0.00 C -ATOM 1821 O LEU 117 -11.420 9.808 -0.405 1.00 0.00 O -ATOM 1822 N ALA 118 -13.288 9.136 0.590 1.00 0.00 N -ATOM 1823 H ALA 118 -14.297 9.189 0.588 1.00 0.00 H -ATOM 1824 CA ALA 118 -12.630 8.254 1.594 1.00 0.00 C -ATOM 1825 HA ALA 118 -11.889 8.858 2.119 1.00 0.00 H -ATOM 1826 CB ALA 118 -13.726 7.742 2.528 1.00 0.00 C -ATOM 1827 HB1 ALA 118 -13.267 6.988 3.169 1.00 0.00 H -ATOM 1828 HB2 ALA 118 -14.000 8.570 3.181 1.00 0.00 H -ATOM 1829 HB3 ALA 118 -14.654 7.398 2.071 1.00 0.00 H -ATOM 1830 C ALA 118 -11.829 7.090 0.799 1.00 0.00 C -ATOM 1831 O ALA 118 -12.354 6.463 -0.137 1.00 0.00 O -ATOM 1832 N GLY 119 -10.576 6.823 1.184 1.00 0.00 N -ATOM 1833 H GLY 119 -10.148 7.316 1.954 1.00 0.00 H -ATOM 1834 CA GLY 119 -9.767 5.652 0.685 1.00 0.00 C -ATOM 1835 HA2 GLY 119 -9.913 5.561 -0.391 1.00 0.00 H -ATOM 1836 HA3 GLY 119 -8.695 5.809 0.810 1.00 0.00 H -ATOM 1837 C GLY 119 -9.977 4.269 1.346 1.00 0.00 C -ATOM 1838 O GLY 119 -10.994 4.111 2.054 1.00 0.00 O -ATOM 1839 N ILE 120 -9.067 3.287 1.092 1.00 0.00 N -ATOM 1840 H ILE 120 -8.176 3.520 0.675 1.00 0.00 H -ATOM 1841 CA ILE 120 -9.171 1.967 1.680 1.00 0.00 C -ATOM 1842 HA ILE 120 -10.127 1.529 1.393 1.00 0.00 H -ATOM 1843 CB ILE 120 -8.197 0.953 1.053 1.00 0.00 C -ATOM 1844 HB ILE 120 -7.199 1.226 1.397 1.00 0.00 H -ATOM 1845 CG2 ILE 120 -8.470 -0.462 1.666 1.00 0.00 C -ATOM 1846 HG21 ILE 120 -7.922 -1.221 1.108 1.00 0.00 H -ATOM 1847 HG22 ILE 120 -8.224 -0.388 2.725 1.00 0.00 H -ATOM 1848 HG23 ILE 120 -9.522 -0.748 1.635 1.00 0.00 H -ATOM 1849 CG1 ILE 120 -8.350 0.879 -0.484 1.00 0.00 C -ATOM 1850 HG12 ILE 120 -9.301 0.378 -0.659 1.00 0.00 H -ATOM 1851 HG13 ILE 120 -8.491 1.867 -0.921 1.00 0.00 H -ATOM 1852 CD1 ILE 120 -7.165 0.200 -1.187 1.00 0.00 C -ATOM 1853 HD11 ILE 120 -7.334 -0.003 -2.245 1.00 0.00 H -ATOM 1854 HD12 ILE 120 -6.259 0.806 -1.194 1.00 0.00 H -ATOM 1855 HD13 ILE 120 -6.981 -0.757 -0.699 1.00 0.00 H -ATOM 1856 C ILE 120 -9.267 1.878 3.196 1.00 0.00 C -ATOM 1857 O ILE 120 -10.142 1.214 3.727 1.00 0.00 O -ATOM 1858 N ILE 121 -8.299 2.490 3.935 1.00 0.00 N -ATOM 1859 H ILE 121 -7.663 3.078 3.416 1.00 0.00 H -ATOM 1860 CA ILE 121 -8.210 2.437 5.386 1.00 0.00 C -ATOM 1861 HA ILE 121 -8.023 1.385 5.604 1.00 0.00 H -ATOM 1862 CB ILE 121 -7.030 3.210 5.983 1.00 0.00 C -ATOM 1863 HB ILE 121 -6.940 4.238 5.630 1.00 0.00 H -ATOM 1864 CG2 ILE 121 -7.096 3.428 7.580 1.00 0.00 C -ATOM 1865 HG21 ILE 121 -6.755 2.554 8.135 1.00 0.00 H -ATOM 1866 HG22 ILE 121 -6.522 4.295 7.908 1.00 0.00 H -ATOM 1867 HG23 ILE 121 -8.114 3.589 7.935 1.00 0.00 H -ATOM 1868 CG1 ILE 121 -5.706 2.560 5.553 1.00 0.00 C -ATOM 1869 HG12 ILE 121 -5.529 1.757 6.269 1.00 0.00 H -ATOM 1870 HG13 ILE 121 -5.647 2.300 4.497 1.00 0.00 H -ATOM 1871 CD1 ILE 121 -4.609 3.609 5.674 1.00 0.00 C -ATOM 1872 HD11 ILE 121 -3.610 3.293 5.376 1.00 0.00 H -ATOM 1873 HD12 ILE 121 -4.734 4.423 4.960 1.00 0.00 H -ATOM 1874 HD13 ILE 121 -4.556 3.984 6.697 1.00 0.00 H -ATOM 1875 C ILE 121 -9.567 2.813 6.070 1.00 0.00 C -ATOM 1876 O ILE 121 -10.117 1.938 6.798 1.00 0.00 O -ATOM 1877 N PRO 122 -10.181 4.013 5.950 1.00 0.00 N -ATOM 1878 CD PRO 122 -9.740 5.234 5.277 1.00 0.00 C -ATOM 1879 HD2 PRO 122 -9.304 5.165 4.281 1.00 0.00 H -ATOM 1880 HD3 PRO 122 -8.943 5.644 5.897 1.00 0.00 H -ATOM 1881 CG PRO 122 -10.959 6.206 5.143 1.00 0.00 C -ATOM 1882 HG2 PRO 122 -11.453 6.215 4.172 1.00 0.00 H -ATOM 1883 HG3 PRO 122 -10.670 7.245 5.307 1.00 0.00 H -ATOM 1884 CB PRO 122 -11.875 5.782 6.213 1.00 0.00 C -ATOM 1885 HB2 PRO 122 -12.925 5.737 5.928 1.00 0.00 H -ATOM 1886 HB3 PRO 122 -11.824 6.481 7.049 1.00 0.00 H -ATOM 1887 CA PRO 122 -11.382 4.348 6.683 1.00 0.00 C -ATOM 1888 HA PRO 122 -11.113 4.362 7.739 1.00 0.00 H -ATOM 1889 C PRO 122 -12.491 3.390 6.366 1.00 0.00 C -ATOM 1890 O PRO 122 -13.268 3.002 7.263 1.00 0.00 O -ATOM 1891 N ARG 123 -12.610 2.885 5.121 1.00 0.00 N -ATOM 1892 H ARG 123 -11.961 3.244 4.436 1.00 0.00 H -ATOM 1893 CA ARG 123 -13.592 1.825 4.683 1.00 0.00 C -ATOM 1894 HA ARG 123 -14.562 2.231 4.972 1.00 0.00 H -ATOM 1895 CB ARG 123 -13.679 1.640 3.148 1.00 0.00 C -ATOM 1896 HB2 ARG 123 -12.659 1.570 2.769 1.00 0.00 H -ATOM 1897 HB3 ARG 123 -14.245 0.758 2.853 1.00 0.00 H -ATOM 1898 CG ARG 123 -14.191 2.957 2.615 1.00 0.00 C -ATOM 1899 HG2 ARG 123 -15.156 3.137 3.089 1.00 0.00 H -ATOM 1900 HG3 ARG 123 -13.562 3.812 2.864 1.00 0.00 H -ATOM 1901 CD ARG 123 -14.318 2.822 1.130 1.00 0.00 C -ATOM 1902 HD2 ARG 123 -13.564 2.189 0.663 1.00 0.00 H -ATOM 1903 HD3 ARG 123 -15.208 2.260 0.845 1.00 0.00 H -ATOM 1904 NE ARG 123 -14.285 4.099 0.504 1.00 0.00 N -ATOM 1905 HE ARG 123 -13.353 4.388 0.241 1.00 0.00 H -ATOM 1906 CZ ARG 123 -15.239 4.976 0.250 1.00 0.00 C -ATOM 1907 NH1 ARG 123 -16.450 4.773 0.485 1.00 0.00 N -ATOM 1908 HH11 ARG 123 -16.663 4.140 1.242 1.00 0.00 H -ATOM 1909 HH12 ARG 123 -17.110 5.475 0.183 1.00 0.00 H -ATOM 1910 NH2 ARG 123 -15.026 6.067 -0.366 1.00 0.00 N -ATOM 1911 HH21 ARG 123 -14.066 6.321 -0.549 1.00 0.00 H -ATOM 1912 HH22 ARG 123 -15.791 6.718 -0.479 1.00 0.00 H -ATOM 1913 C ARG 123 -13.456 0.510 5.293 1.00 0.00 C -ATOM 1914 O ARG 123 -14.392 0.034 5.964 1.00 0.00 O -ATOM 1915 N THR 124 -12.273 -0.096 5.243 1.00 0.00 N -ATOM 1916 H THR 124 -11.624 0.402 4.651 1.00 0.00 H -ATOM 1917 CA THR 124 -11.769 -1.250 6.041 1.00 0.00 C -ATOM 1918 HA THR 124 -12.295 -2.115 5.638 1.00 0.00 H -ATOM 1919 CB THR 124 -10.277 -1.319 5.900 1.00 0.00 C -ATOM 1920 HB THR 124 -9.729 -0.567 6.468 1.00 0.00 H -ATOM 1921 CG2 THR 124 -9.735 -2.564 6.553 1.00 0.00 C -ATOM 1922 HG21 THR 124 -10.190 -3.446 6.103 1.00 0.00 H -ATOM 1923 HG22 THR 124 -8.649 -2.485 6.579 1.00 0.00 H -ATOM 1924 HG23 THR 124 -9.983 -2.672 7.609 1.00 0.00 H -ATOM 1925 OG1 THR 124 -9.867 -1.193 4.565 1.00 0.00 O -ATOM 1926 HG1 THR 124 -9.931 -0.262 4.343 1.00 0.00 H -ATOM 1927 C THR 124 -12.146 -1.105 7.589 1.00 0.00 C -ATOM 1928 O THR 124 -12.814 -2.029 8.119 1.00 0.00 O -ATOM 1929 N LEU 125 -11.779 -0.014 8.284 1.00 0.00 N -ATOM 1930 H LEU 125 -11.290 0.714 7.785 1.00 0.00 H -ATOM 1931 CA LEU 125 -12.051 0.122 9.688 1.00 0.00 C -ATOM 1932 HA LEU 125 -11.615 -0.696 10.262 1.00 0.00 H -ATOM 1933 CB LEU 125 -11.293 1.393 10.064 1.00 0.00 C -ATOM 1934 HB2 LEU 125 -10.243 1.382 9.770 1.00 0.00 H -ATOM 1935 HB3 LEU 125 -11.669 2.296 9.583 1.00 0.00 H -ATOM 1936 CG LEU 125 -11.131 1.668 11.548 1.00 0.00 C -ATOM 1937 HG LEU 125 -12.120 1.907 11.939 1.00 0.00 H -ATOM 1938 CD1 LEU 125 -10.410 0.615 12.421 1.00 0.00 C -ATOM 1939 HD11 LEU 125 -10.948 -0.332 12.372 1.00 0.00 H -ATOM 1940 HD12 LEU 125 -9.421 0.517 11.972 1.00 0.00 H -ATOM 1941 HD13 LEU 125 -10.300 0.852 13.480 1.00 0.00 H -ATOM 1942 CD2 LEU 125 -10.274 2.900 11.669 1.00 0.00 C -ATOM 1943 HD21 LEU 125 -10.457 3.483 10.765 1.00 0.00 H -ATOM 1944 HD22 LEU 125 -10.554 3.534 12.510 1.00 0.00 H -ATOM 1945 HD23 LEU 125 -9.195 2.767 11.742 1.00 0.00 H -ATOM 1946 C LEU 125 -13.542 0.227 10.057 1.00 0.00 C -ATOM 1947 O LEU 125 -13.911 -0.158 11.155 1.00 0.00 O -ATOM 1948 N HIE 126 -14.426 0.645 9.159 1.00 0.00 N -ATOM 1949 H HIE 126 -14.081 1.065 8.307 1.00 0.00 H -ATOM 1950 CA HIE 126 -15.899 0.528 9.232 1.00 0.00 C -ATOM 1951 HA HIE 126 -16.207 0.747 10.255 1.00 0.00 H -ATOM 1952 CB HIE 126 -16.646 1.574 8.422 1.00 0.00 C -ATOM 1953 HB2 HIE 126 -16.327 2.572 8.723 1.00 0.00 H -ATOM 1954 HB3 HIE 126 -16.330 1.486 7.383 1.00 0.00 H -ATOM 1955 CG HIE 126 -18.138 1.516 8.581 1.00 0.00 C -ATOM 1956 ND1 HIE 126 -18.957 0.430 8.770 1.00 0.00 N -ATOM 1957 CE1 HIE 126 -20.215 0.920 8.905 1.00 0.00 C -ATOM 1958 HE1 HIE 126 -21.050 0.236 8.881 1.00 0.00 H -ATOM 1959 NE2 HIE 126 -20.214 2.240 8.723 1.00 0.00 N -ATOM 1960 HE2 HIE 126 -21.023 2.823 8.885 1.00 0.00 H -ATOM 1961 CD2 HIE 126 -18.948 2.664 8.513 1.00 0.00 C -ATOM 1962 HD2 HIE 126 -18.641 3.695 8.428 1.00 0.00 H -ATOM 1963 C HIE 126 -16.357 -0.937 8.926 1.00 0.00 C -ATOM 1964 O HIE 126 -16.947 -1.640 9.715 1.00 0.00 O -ATOM 1965 N GLN 127 -16.178 -1.348 7.653 1.00 0.00 N -ATOM 1966 H GLN 127 -15.616 -0.681 7.145 1.00 0.00 H -ATOM 1967 CA GLN 127 -16.804 -2.530 7.033 1.00 0.00 C -ATOM 1968 HA GLN 127 -17.872 -2.311 7.031 1.00 0.00 H -ATOM 1969 CB GLN 127 -16.363 -2.570 5.599 1.00 0.00 C -ATOM 1970 HB2 GLN 127 -16.416 -1.569 5.171 1.00 0.00 H -ATOM 1971 HB3 GLN 127 -15.292 -2.764 5.533 1.00 0.00 H -ATOM 1972 CG GLN 127 -17.177 -3.516 4.782 1.00 0.00 C -ATOM 1973 HG2 GLN 127 -18.114 -3.794 5.264 1.00 0.00 H -ATOM 1974 HG3 GLN 127 -17.511 -2.975 3.897 1.00 0.00 H -ATOM 1975 CD GLN 127 -16.417 -4.772 4.409 1.00 0.00 C -ATOM 1976 OE1 GLN 127 -15.336 -4.758 3.905 1.00 0.00 O -ATOM 1977 NE2 GLN 127 -16.966 -5.941 4.518 1.00 0.00 N -ATOM 1978 HE21 GLN 127 -16.457 -6.686 4.062 1.00 0.00 H -ATOM 1979 HE22 GLN 127 -17.931 -6.019 4.807 1.00 0.00 H -ATOM 1980 C GLN 127 -16.533 -3.878 7.626 1.00 0.00 C -ATOM 1981 O GLN 127 -17.486 -4.705 7.811 1.00 0.00 O -ATOM 1982 N ILE 128 -15.289 -4.017 8.129 1.00 0.00 N -ATOM 1983 H ILE 128 -14.645 -3.241 8.159 1.00 0.00 H -ATOM 1984 CA ILE 128 -14.888 -5.234 8.967 1.00 0.00 C -ATOM 1985 HA ILE 128 -14.944 -6.069 8.270 1.00 0.00 H -ATOM 1986 CB ILE 128 -13.400 -5.141 9.355 1.00 0.00 C -ATOM 1987 HB ILE 128 -12.898 -4.771 8.462 1.00 0.00 H -ATOM 1988 CG2 ILE 128 -13.091 -4.142 10.563 1.00 0.00 C -ATOM 1989 HG21 ILE 128 -12.033 -4.012 10.787 1.00 0.00 H -ATOM 1990 HG22 ILE 128 -13.441 -3.144 10.300 1.00 0.00 H -ATOM 1991 HG23 ILE 128 -13.693 -4.450 11.419 1.00 0.00 H -ATOM 1992 CG1 ILE 128 -12.849 -6.522 9.675 1.00 0.00 C -ATOM 1993 HG12 ILE 128 -11.888 -6.322 10.147 1.00 0.00 H -ATOM 1994 HG13 ILE 128 -13.531 -6.935 10.419 1.00 0.00 H -ATOM 1995 CD1 ILE 128 -12.572 -7.466 8.447 1.00 0.00 C -ATOM 1996 HD11 ILE 128 -11.819 -8.222 8.673 1.00 0.00 H -ATOM 1997 HD12 ILE 128 -13.511 -7.846 8.045 1.00 0.00 H -ATOM 1998 HD13 ILE 128 -12.212 -6.823 7.643 1.00 0.00 H -ATOM 1999 C ILE 128 -15.869 -5.551 10.095 1.00 0.00 C -ATOM 2000 O ILE 128 -16.182 -6.742 10.293 1.00 0.00 O -ATOM 2001 N PHE 129 -16.399 -4.559 10.812 1.00 0.00 N -ATOM 2002 H PHE 129 -16.092 -3.601 10.725 1.00 0.00 H -ATOM 2003 CA PHE 129 -17.394 -4.836 11.878 1.00 0.00 C -ATOM 2004 HA PHE 129 -16.998 -5.652 12.483 1.00 0.00 H -ATOM 2005 CB PHE 129 -17.591 -3.526 12.756 1.00 0.00 C -ATOM 2006 HB2 PHE 129 -17.751 -2.624 12.163 1.00 0.00 H -ATOM 2007 HB3 PHE 129 -18.435 -3.715 13.420 1.00 0.00 H -ATOM 2008 CG PHE 129 -16.410 -3.164 13.659 1.00 0.00 C -ATOM 2009 CD1 PHE 129 -15.414 -2.327 13.095 1.00 0.00 C -ATOM 2010 HD1 PHE 129 -15.534 -1.900 12.111 1.00 0.00 H -ATOM 2011 CE1 PHE 129 -14.318 -1.975 13.845 1.00 0.00 C -ATOM 2012 HE1 PHE 129 -13.569 -1.377 13.345 1.00 0.00 H -ATOM 2013 CZ PHE 129 -14.188 -2.409 15.182 1.00 0.00 C -ATOM 2014 HZ PHE 129 -13.320 -2.280 15.811 1.00 0.00 H -ATOM 2015 CE2 PHE 129 -15.201 -3.270 15.729 1.00 0.00 C -ATOM 2016 HE2 PHE 129 -15.049 -3.671 16.720 1.00 0.00 H -ATOM 2017 CD2 PHE 129 -16.318 -3.591 14.982 1.00 0.00 C -ATOM 2018 HD2 PHE 129 -17.071 -4.149 15.518 1.00 0.00 H -ATOM 2019 C PHE 129 -18.647 -5.486 11.356 1.00 0.00 C -ATOM 2020 O PHE 129 -19.171 -6.512 11.810 1.00 0.00 O -ATOM 2021 N GLU 130 -19.199 -4.844 10.325 1.00 0.00 N -ATOM 2022 H GLU 130 -18.739 -3.982 10.067 1.00 0.00 H -ATOM 2023 CA GLU 130 -20.378 -5.224 9.569 1.00 0.00 C -ATOM 2024 HA GLU 130 -21.288 -5.256 10.169 1.00 0.00 H -ATOM 2025 CB GLU 130 -20.717 -4.183 8.544 1.00 0.00 C -ATOM 2026 HB2 GLU 130 -20.089 -4.208 7.654 1.00 0.00 H -ATOM 2027 HB3 GLU 130 -21.654 -4.520 8.097 1.00 0.00 H -ATOM 2028 CG GLU 130 -20.830 -2.696 9.000 1.00 0.00 C -ATOM 2029 HG2 GLU 130 -19.796 -2.551 9.315 1.00 0.00 H -ATOM 2030 HG3 GLU 130 -20.955 -2.048 8.134 1.00 0.00 H -ATOM 2031 CD GLU 130 -21.897 -2.499 10.087 1.00 0.00 C -ATOM 2032 OE1 GLU 130 -22.943 -3.220 10.143 1.00 0.00 O -ATOM 2033 OE2 GLU 130 -21.694 -1.540 10.874 1.00 0.00 O -ATOM 2034 C GLU 130 -20.205 -6.637 9.074 1.00 0.00 C -ATOM 2035 O GLU 130 -21.119 -7.448 9.140 1.00 0.00 O -ATOM 2036 N LYS 131 -19.070 -6.956 8.476 1.00 0.00 N -ATOM 2037 H LYS 131 -18.335 -6.264 8.476 1.00 0.00 H -ATOM 2038 CA LYS 131 -18.770 -8.312 7.922 1.00 0.00 C -ATOM 2039 HA LYS 131 -19.617 -8.654 7.327 1.00 0.00 H -ATOM 2040 CB LYS 131 -17.434 -8.260 7.151 1.00 0.00 C -ATOM 2041 HB2 LYS 131 -17.660 -7.731 6.225 1.00 0.00 H -ATOM 2042 HB3 LYS 131 -16.767 -7.591 7.695 1.00 0.00 H -ATOM 2043 CG LYS 131 -16.888 -9.691 6.914 1.00 0.00 C -ATOM 2044 HG2 LYS 131 -15.852 -9.538 6.615 1.00 0.00 H -ATOM 2045 HG3 LYS 131 -16.774 -10.197 7.873 1.00 0.00 H -ATOM 2046 CD LYS 131 -17.718 -10.657 6.033 1.00 0.00 C -ATOM 2047 HD2 LYS 131 -17.204 -11.619 6.054 1.00 0.00 H -ATOM 2048 HD3 LYS 131 -18.675 -10.847 6.518 1.00 0.00 H -ATOM 2049 CE LYS 131 -18.008 -10.076 4.646 1.00 0.00 C -ATOM 2050 HE2 LYS 131 -18.796 -9.326 4.714 1.00 0.00 H -ATOM 2051 HE3 LYS 131 -17.156 -9.515 4.261 1.00 0.00 H -ATOM 2052 NZ LYS 131 -18.549 -11.027 3.648 1.00 0.00 N -ATOM 2053 HZ1 LYS 131 -17.805 -11.506 3.161 1.00 0.00 H -ATOM 2054 HZ2 LYS 131 -19.035 -11.783 4.109 1.00 0.00 H -ATOM 2055 HZ3 LYS 131 -19.142 -10.582 2.961 1.00 0.00 H -ATOM 2056 C LYS 131 -18.746 -9.298 9.110 1.00 0.00 C -ATOM 2057 O LYS 131 -19.269 -10.438 8.943 1.00 0.00 O -ATOM 2058 N LEU 132 -17.992 -9.028 10.184 1.00 0.00 N -ATOM 2059 H LEU 132 -17.496 -8.149 10.207 1.00 0.00 H -ATOM 2060 CA LEU 132 -17.920 -9.907 11.381 1.00 0.00 C -ATOM 2061 HA LEU 132 -17.432 -10.817 11.035 1.00 0.00 H -ATOM 2062 CB LEU 132 -16.999 -9.166 12.408 1.00 0.00 C -ATOM 2063 HB2 LEU 132 -17.406 -8.158 12.481 1.00 0.00 H -ATOM 2064 HB3 LEU 132 -17.154 -9.644 13.376 1.00 0.00 H -ATOM 2065 CG LEU 132 -15.451 -9.146 12.066 1.00 0.00 C -ATOM 2066 HG LEU 132 -15.351 -8.973 10.995 1.00 0.00 H -ATOM 2067 CD1 LEU 132 -14.567 -8.141 12.877 1.00 0.00 C -ATOM 2068 HD11 LEU 132 -15.067 -7.172 12.860 1.00 0.00 H -ATOM 2069 HD12 LEU 132 -14.454 -8.487 13.904 1.00 0.00 H -ATOM 2070 HD13 LEU 132 -13.582 -8.170 12.412 1.00 0.00 H -ATOM 2071 CD2 LEU 132 -14.722 -10.444 12.253 1.00 0.00 C -ATOM 2072 HD21 LEU 132 -14.270 -10.612 13.231 1.00 0.00 H -ATOM 2073 HD22 LEU 132 -15.466 -11.227 12.107 1.00 0.00 H -ATOM 2074 HD23 LEU 132 -14.014 -10.439 11.423 1.00 0.00 H -ATOM 2075 C LEU 132 -19.385 -10.308 11.973 1.00 0.00 C -ATOM 2076 O LEU 132 -19.626 -11.453 12.301 1.00 0.00 O -ATOM 2077 N THR 133 -20.273 -9.288 12.073 1.00 0.00 N -ATOM 2078 H THR 133 -19.871 -8.430 11.723 1.00 0.00 H -ATOM 2079 CA THR 133 -21.574 -9.390 12.644 1.00 0.00 C -ATOM 2080 HA THR 133 -21.587 -10.045 13.515 1.00 0.00 H -ATOM 2081 CB THR 133 -22.073 -7.986 13.073 1.00 0.00 C -ATOM 2082 HB THR 133 -23.119 -8.048 13.376 1.00 0.00 H -ATOM 2083 CG2 THR 133 -21.209 -7.306 14.113 1.00 0.00 C -ATOM 2084 HG21 THR 133 -21.546 -6.315 14.415 1.00 0.00 H -ATOM 2085 HG22 THR 133 -21.304 -7.903 15.021 1.00 0.00 H -ATOM 2086 HG23 THR 133 -20.148 -7.271 13.870 1.00 0.00 H -ATOM 2087 OG1 THR 133 -21.947 -7.063 12.016 1.00 0.00 O -ATOM 2088 HG1 THR 133 -21.064 -6.980 11.650 1.00 0.00 H -ATOM 2089 C THR 133 -22.618 -9.917 11.583 1.00 0.00 C -ATOM 2090 O THR 133 -23.603 -10.476 11.987 1.00 0.00 O -ATOM 2091 N ASP 134 -22.432 -9.811 10.275 1.00 0.00 N -ATOM 2092 H ASP 134 -21.694 -9.218 9.922 1.00 0.00 H -ATOM 2093 CA ASP 134 -23.197 -10.666 9.286 1.00 0.00 C -ATOM 2094 HA ASP 134 -24.240 -10.464 9.530 1.00 0.00 H -ATOM 2095 CB ASP 134 -22.805 -10.228 7.863 1.00 0.00 C -ATOM 2096 HB2 ASP 134 -22.514 -9.177 7.841 1.00 0.00 H -ATOM 2097 HB3 ASP 134 -21.835 -10.646 7.596 1.00 0.00 H -ATOM 2098 CG ASP 134 -23.843 -10.388 6.773 1.00 0.00 C -ATOM 2099 OD1 ASP 134 -23.674 -10.080 5.590 1.00 0.00 O -ATOM 2100 OD2 ASP 134 -25.026 -10.763 7.078 1.00 0.00 O -ATOM 2101 C ASP 134 -22.952 -12.184 9.402 1.00 0.00 C -ATOM 2102 O ASP 134 -23.834 -13.004 9.461 1.00 0.00 O -ATOM 2103 N ASN 135 -21.726 -12.587 9.627 1.00 0.00 N -ATOM 2104 H ASN 135 -21.008 -11.878 9.686 1.00 0.00 H -ATOM 2105 CA ASN 135 -21.384 -13.974 9.939 1.00 0.00 C -ATOM 2106 HA ASN 135 -22.003 -14.623 9.320 1.00 0.00 H -ATOM 2107 CB ASN 135 -19.854 -14.119 9.630 1.00 0.00 C -ATOM 2108 HB2 ASN 135 -19.288 -13.464 10.294 1.00 0.00 H -ATOM 2109 HB3 ASN 135 -19.523 -15.078 10.029 1.00 0.00 H -ATOM 2110 CG ASN 135 -19.337 -13.946 8.240 1.00 0.00 C -ATOM 2111 OD1 ASN 135 -20.188 -13.874 7.332 1.00 0.00 O -ATOM 2112 ND2 ASN 135 -18.041 -14.007 7.893 1.00 0.00 N -ATOM 2113 HD21 ASN 135 -17.735 -13.993 6.931 1.00 0.00 H -ATOM 2114 HD22 ASN 135 -17.394 -13.990 8.669 1.00 0.00 H -ATOM 2115 C ASN 135 -21.765 -14.268 11.352 1.00 0.00 C -ATOM 2116 O ASN 135 -21.579 -15.477 11.666 1.00 0.00 O -ATOM 2117 N GLY 136 -22.218 -13.335 12.209 1.00 0.00 N -ATOM 2118 H GLY 136 -22.306 -12.348 12.014 1.00 0.00 H -ATOM 2119 CA GLY 136 -22.604 -13.553 13.610 1.00 0.00 C -ATOM 2120 HA2 GLY 136 -23.255 -12.721 13.879 1.00 0.00 H -ATOM 2121 HA3 GLY 136 -23.223 -14.444 13.498 1.00 0.00 H -ATOM 2122 C GLY 136 -21.480 -13.953 14.561 1.00 0.00 C -ATOM 2123 O GLY 136 -21.778 -14.607 15.586 1.00 0.00 O -ATOM 2124 N THR 137 -20.181 -13.706 14.131 1.00 0.00 N -ATOM 2125 H THR 137 -20.009 -13.049 13.383 1.00 0.00 H -ATOM 2126 CA THR 137 -18.959 -14.028 15.018 1.00 0.00 C -ATOM 2127 HA THR 137 -19.112 -15.000 15.486 1.00 0.00 H -ATOM 2128 CB THR 137 -17.636 -13.965 14.212 1.00 0.00 C -ATOM 2129 HB THR 137 -16.815 -14.058 14.924 1.00 0.00 H -ATOM 2130 CG2 THR 137 -17.487 -14.956 13.100 1.00 0.00 C -ATOM 2131 HG21 THR 137 -17.796 -15.951 13.421 1.00 0.00 H -ATOM 2132 HG22 THR 137 -18.104 -14.729 12.231 1.00 0.00 H -ATOM 2133 HG23 THR 137 -16.470 -14.906 12.710 1.00 0.00 H -ATOM 2134 OG1 THR 137 -17.397 -12.707 13.611 1.00 0.00 O -ATOM 2135 HG1 THR 137 -18.109 -12.378 13.057 1.00 0.00 H -ATOM 2136 C THR 137 -18.938 -13.065 16.194 1.00 0.00 C -ATOM 2137 O THR 137 -19.471 -11.914 16.131 1.00 0.00 O -ATOM 2138 N GLU 138 -18.087 -13.507 17.190 1.00 0.00 N -ATOM 2139 H GLU 138 -17.816 -14.480 17.195 1.00 0.00 H -ATOM 2140 CA GLU 138 -17.465 -12.702 18.296 1.00 0.00 C -ATOM 2141 HA GLU 138 -17.991 -11.747 18.321 1.00 0.00 H -ATOM 2142 CB GLU 138 -17.736 -13.422 19.592 1.00 0.00 C -ATOM 2143 HB2 GLU 138 -17.174 -14.357 19.600 1.00 0.00 H -ATOM 2144 HB3 GLU 138 -17.370 -12.750 20.368 1.00 0.00 H -ATOM 2145 CG GLU 138 -19.198 -13.688 19.927 1.00 0.00 C -ATOM 2146 HG2 GLU 138 -19.691 -14.455 19.330 1.00 0.00 H -ATOM 2147 HG3 GLU 138 -19.309 -14.056 20.947 1.00 0.00 H -ATOM 2148 CD GLU 138 -20.031 -12.334 19.926 1.00 0.00 C -ATOM 2149 OE1 GLU 138 -21.134 -12.390 19.375 1.00 0.00 O -ATOM 2150 OE2 GLU 138 -19.619 -11.367 20.594 1.00 0.00 O -ATOM 2151 C GLU 138 -15.936 -12.445 18.068 1.00 0.00 C -ATOM 2152 O GLU 138 -15.291 -13.317 17.386 1.00 0.00 O -ATOM 2153 N PHE 139 -15.412 -11.229 18.377 1.00 0.00 N -ATOM 2154 H PHE 139 -15.938 -10.511 18.855 1.00 0.00 H -ATOM 2155 CA PHE 139 -14.242 -10.636 17.650 1.00 0.00 C -ATOM 2156 HA PHE 139 -13.482 -11.392 17.452 1.00 0.00 H -ATOM 2157 CB PHE 139 -14.681 -10.010 16.286 1.00 0.00 C -ATOM 2158 HB2 PHE 139 -13.819 -9.502 15.854 1.00 0.00 H -ATOM 2159 HB3 PHE 139 -15.106 -10.736 15.591 1.00 0.00 H -ATOM 2160 CG PHE 139 -15.774 -8.971 16.301 1.00 0.00 C -ATOM 2161 CD1 PHE 139 -17.110 -9.341 16.057 1.00 0.00 C -ATOM 2162 HD1 PHE 139 -17.396 -10.359 15.834 1.00 0.00 H -ATOM 2163 CE1 PHE 139 -18.093 -8.329 16.126 1.00 0.00 C -ATOM 2164 HE1 PHE 139 -19.144 -8.531 15.981 1.00 0.00 H -ATOM 2165 CZ PHE 139 -17.792 -7.029 16.476 1.00 0.00 C -ATOM 2166 HZ PHE 139 -18.644 -6.376 16.602 1.00 0.00 H -ATOM 2167 CE2 PHE 139 -16.467 -6.638 16.781 1.00 0.00 C -ATOM 2168 HE2 PHE 139 -16.286 -5.627 17.111 1.00 0.00 H -ATOM 2169 CD2 PHE 139 -15.502 -7.629 16.633 1.00 0.00 C -ATOM 2170 HD2 PHE 139 -14.484 -7.417 16.927 1.00 0.00 H -ATOM 2171 C PHE 139 -13.514 -9.590 18.483 1.00 0.00 C -ATOM 2172 O PHE 139 -14.113 -9.141 19.495 1.00 0.00 O -ATOM 2173 N SER 140 -12.263 -9.255 18.053 1.00 0.00 N -ATOM 2174 H SER 140 -11.877 -9.584 17.180 1.00 0.00 H -ATOM 2175 CA SER 140 -11.599 -7.994 18.480 1.00 0.00 C -ATOM 2176 HA SER 140 -12.333 -7.198 18.608 1.00 0.00 H -ATOM 2177 CB SER 140 -10.736 -8.137 19.746 1.00 0.00 C -ATOM 2178 HB2 SER 140 -11.375 -8.438 20.576 1.00 0.00 H -ATOM 2179 HB3 SER 140 -10.034 -8.950 19.559 1.00 0.00 H -ATOM 2180 OG SER 140 -10.121 -6.953 20.142 1.00 0.00 O -ATOM 2181 HG SER 140 -10.839 -6.355 20.362 1.00 0.00 H -ATOM 2182 C SER 140 -10.685 -7.470 17.338 1.00 0.00 C -ATOM 2183 O SER 140 -9.797 -8.179 16.835 1.00 0.00 O -ATOM 2184 N VAL 141 -10.958 -6.286 16.866 1.00 0.00 N -ATOM 2185 H VAL 141 -11.541 -5.750 17.493 1.00 0.00 H -ATOM 2186 CA VAL 141 -10.144 -5.574 15.851 1.00 0.00 C -ATOM 2187 HA VAL 141 -9.701 -6.351 15.227 1.00 0.00 H -ATOM 2188 CB VAL 141 -11.078 -4.733 14.883 1.00 0.00 C -ATOM 2189 HB VAL 141 -11.583 -3.927 15.417 1.00 0.00 H -ATOM 2190 CG1 VAL 141 -10.177 -4.075 13.788 1.00 0.00 C -ATOM 2191 HG11 VAL 141 -9.518 -3.285 14.151 1.00 0.00 H -ATOM 2192 HG12 VAL 141 -9.656 -4.817 13.183 1.00 0.00 H -ATOM 2193 HG13 VAL 141 -10.802 -3.428 13.172 1.00 0.00 H -ATOM 2194 CG2 VAL 141 -12.150 -5.639 14.242 1.00 0.00 C -ATOM 2195 HG21 VAL 141 -12.881 -5.843 15.022 1.00 0.00 H -ATOM 2196 HG22 VAL 141 -12.765 -5.165 13.477 1.00 0.00 H -ATOM 2197 HG23 VAL 141 -11.732 -6.574 13.869 1.00 0.00 H -ATOM 2198 C VAL 141 -8.951 -4.752 16.354 1.00 0.00 C -ATOM 2199 O VAL 141 -9.204 -4.018 17.277 1.00 0.00 O -ATOM 2200 N LYS 142 -7.736 -4.964 15.799 1.00 0.00 N -ATOM 2201 H LYS 142 -7.621 -5.585 15.012 1.00 0.00 H -ATOM 2202 CA LYS 142 -6.497 -4.327 16.325 1.00 0.00 C -ATOM 2203 HA LYS 142 -6.734 -3.597 17.098 1.00 0.00 H -ATOM 2204 CB LYS 142 -5.747 -5.380 17.116 1.00 0.00 C -ATOM 2205 HB2 LYS 142 -5.738 -6.328 16.576 1.00 0.00 H -ATOM 2206 HB3 LYS 142 -4.724 -5.083 17.346 1.00 0.00 H -ATOM 2207 CG LYS 142 -6.480 -5.851 18.449 1.00 0.00 C -ATOM 2208 HG2 LYS 142 -6.372 -5.018 19.144 1.00 0.00 H -ATOM 2209 HG3 LYS 142 -7.536 -6.095 18.337 1.00 0.00 H -ATOM 2210 CD LYS 142 -5.901 -7.237 19.002 1.00 0.00 C -ATOM 2211 HD2 LYS 142 -5.787 -7.918 18.158 1.00 0.00 H -ATOM 2212 HD3 LYS 142 -4.925 -7.014 19.431 1.00 0.00 H -ATOM 2213 CE LYS 142 -6.803 -7.981 20.001 1.00 0.00 C -ATOM 2214 HE2 LYS 142 -7.693 -8.393 19.526 1.00 0.00 H -ATOM 2215 HE3 LYS 142 -6.281 -8.875 20.339 1.00 0.00 H -ATOM 2216 NZ LYS 142 -7.078 -7.167 21.158 1.00 0.00 N -ATOM 2217 HZ1 LYS 142 -7.922 -7.463 21.628 1.00 0.00 H -ATOM 2218 HZ2 LYS 142 -6.287 -7.291 21.773 1.00 0.00 H -ATOM 2219 HZ3 LYS 142 -7.043 -6.162 21.067 1.00 0.00 H -ATOM 2220 C LYS 142 -5.612 -3.668 15.286 1.00 0.00 C -ATOM 2221 O LYS 142 -5.398 -4.141 14.152 1.00 0.00 O -ATOM 2222 N VAL 143 -5.119 -2.484 15.601 1.00 0.00 N -ATOM 2223 H VAL 143 -4.999 -2.253 16.577 1.00 0.00 H -ATOM 2224 CA VAL 143 -4.482 -1.571 14.658 1.00 0.00 C -ATOM 2225 HA VAL 143 -4.461 -2.119 13.716 1.00 0.00 H -ATOM 2226 CB VAL 143 -5.276 -0.268 14.420 1.00 0.00 C -ATOM 2227 HB VAL 143 -4.745 0.407 13.749 1.00 0.00 H -ATOM 2228 CG1 VAL 143 -6.635 -0.538 13.838 1.00 0.00 C -ATOM 2229 HG11 VAL 143 -6.438 -1.086 12.916 1.00 0.00 H -ATOM 2230 HG12 VAL 143 -7.082 -1.122 14.643 1.00 0.00 H -ATOM 2231 HG13 VAL 143 -7.146 0.419 13.741 1.00 0.00 H -ATOM 2232 CG2 VAL 143 -5.488 0.598 15.773 1.00 0.00 C -ATOM 2233 HG21 VAL 143 -5.949 1.553 15.522 1.00 0.00 H -ATOM 2234 HG22 VAL 143 -6.130 0.086 16.491 1.00 0.00 H -ATOM 2235 HG23 VAL 143 -4.502 0.822 16.179 1.00 0.00 H -ATOM 2236 C VAL 143 -3.002 -1.335 14.950 1.00 0.00 C -ATOM 2237 O VAL 143 -2.645 -1.311 16.122 1.00 0.00 O -ATOM 2238 N SER 144 -2.216 -1.055 13.880 1.00 0.00 N -ATOM 2239 H SER 144 -2.559 -1.113 12.932 1.00 0.00 H -ATOM 2240 CA SER 144 -0.804 -0.630 14.115 1.00 0.00 C -ATOM 2241 HA SER 144 -0.667 0.163 14.851 1.00 0.00 H -ATOM 2242 CB SER 144 -0.026 -1.882 14.533 1.00 0.00 C -ATOM 2243 HB2 SER 144 -0.151 -1.928 15.615 1.00 0.00 H -ATOM 2244 HB3 SER 144 -0.352 -2.813 14.071 1.00 0.00 H -ATOM 2245 OG SER 144 1.320 -1.765 14.332 1.00 0.00 O -ATOM 2246 HG SER 144 1.761 -2.329 14.972 1.00 0.00 H -ATOM 2247 C SER 144 -0.291 0.033 12.777 1.00 0.00 C -ATOM 2248 O SER 144 -0.907 -0.044 11.677 1.00 0.00 O -ATOM 2249 N LEU 145 0.755 0.863 12.887 1.00 0.00 N -ATOM 2250 H LEU 145 1.270 0.799 13.754 1.00 0.00 H -ATOM 2251 CA LEU 145 1.471 1.511 11.835 1.00 0.00 C -ATOM 2252 HA LEU 145 1.475 0.803 11.006 1.00 0.00 H -ATOM 2253 CB LEU 145 0.839 2.811 11.390 1.00 0.00 C -ATOM 2254 HB2 LEU 145 -0.116 2.541 10.940 1.00 0.00 H -ATOM 2255 HB3 LEU 145 0.567 3.489 12.199 1.00 0.00 H -ATOM 2256 CG LEU 145 1.584 3.560 10.299 1.00 0.00 C -ATOM 2257 HG LEU 145 2.252 2.903 9.741 1.00 0.00 H -ATOM 2258 CD1 LEU 145 0.593 4.257 9.348 1.00 0.00 C -ATOM 2259 HD11 LEU 145 1.131 4.815 8.582 1.00 0.00 H -ATOM 2260 HD12 LEU 145 -0.114 3.550 8.914 1.00 0.00 H -ATOM 2261 HD13 LEU 145 -0.074 4.922 9.895 1.00 0.00 H -ATOM 2262 CD2 LEU 145 2.418 4.700 10.857 1.00 0.00 C -ATOM 2263 HD21 LEU 145 1.874 5.324 11.567 1.00 0.00 H -ATOM 2264 HD22 LEU 145 3.236 4.268 11.434 1.00 0.00 H -ATOM 2265 HD23 LEU 145 2.786 5.304 10.027 1.00 0.00 H -ATOM 2266 C LEU 145 2.992 1.709 12.149 1.00 0.00 C -ATOM 2267 O LEU 145 3.329 2.156 13.245 1.00 0.00 O -ATOM 2268 N LEU 146 3.846 1.543 11.135 1.00 0.00 N -ATOM 2269 H LEU 146 3.501 1.094 10.299 1.00 0.00 H -ATOM 2270 CA LEU 146 5.154 2.151 11.042 1.00 0.00 C -ATOM 2271 HA LEU 146 5.269 2.764 11.936 1.00 0.00 H -ATOM 2272 CB LEU 146 6.286 1.146 11.301 1.00 0.00 C -ATOM 2273 HB2 LEU 146 7.202 1.699 11.508 1.00 0.00 H -ATOM 2274 HB3 LEU 146 6.116 0.590 12.223 1.00 0.00 H -ATOM 2275 CG LEU 146 6.498 0.115 10.171 1.00 0.00 C -ATOM 2276 HG LEU 146 5.555 -0.204 9.727 1.00 0.00 H -ATOM 2277 CD1 LEU 146 7.474 0.462 9.056 1.00 0.00 C -ATOM 2278 HD11 LEU 146 7.303 1.404 8.534 1.00 0.00 H -ATOM 2279 HD12 LEU 146 8.461 0.536 9.511 1.00 0.00 H -ATOM 2280 HD13 LEU 146 7.357 -0.355 8.343 1.00 0.00 H -ATOM 2281 CD2 LEU 146 6.937 -1.264 10.832 1.00 0.00 C -ATOM 2282 HD21 LEU 146 7.761 -1.069 11.517 1.00 0.00 H -ATOM 2283 HD22 LEU 146 6.173 -1.819 11.376 1.00 0.00 H -ATOM 2284 HD23 LEU 146 7.223 -1.893 9.989 1.00 0.00 H -ATOM 2285 C LEU 146 5.439 2.963 9.800 1.00 0.00 C -ATOM 2286 O LEU 146 4.732 2.794 8.788 1.00 0.00 O -ATOM 2287 N GLU 147 6.503 3.805 9.796 1.00 0.00 N -ATOM 2288 H GLU 147 7.066 3.918 10.628 1.00 0.00 H -ATOM 2289 CA GLU 147 6.846 4.640 8.690 1.00 0.00 C -ATOM 2290 HA GLU 147 6.396 4.216 7.793 1.00 0.00 H -ATOM 2291 CB GLU 147 6.157 6.034 8.872 1.00 0.00 C -ATOM 2292 HB2 GLU 147 5.089 5.818 8.829 1.00 0.00 H -ATOM 2293 HB3 GLU 147 6.401 6.378 9.876 1.00 0.00 H -ATOM 2294 CG GLU 147 6.574 7.092 7.813 1.00 0.00 C -ATOM 2295 HG2 GLU 147 7.369 7.719 8.215 1.00 0.00 H -ATOM 2296 HG3 GLU 147 7.051 6.708 6.911 1.00 0.00 H -ATOM 2297 CD GLU 147 5.352 7.872 7.358 1.00 0.00 C -ATOM 2298 OE1 GLU 147 5.366 9.131 7.075 1.00 0.00 O -ATOM 2299 OE2 GLU 147 4.252 7.302 7.137 1.00 0.00 O -ATOM 2300 C GLU 147 8.350 4.713 8.447 1.00 0.00 C -ATOM 2301 O GLU 147 9.075 4.562 9.433 1.00 0.00 O -ATOM 2302 N ILE 148 8.693 4.912 7.228 1.00 0.00 N -ATOM 2303 H ILE 148 8.034 5.135 6.495 1.00 0.00 H -ATOM 2304 CA ILE 148 10.121 4.973 6.904 1.00 0.00 C -ATOM 2305 HA ILE 148 10.588 5.026 7.888 1.00 0.00 H -ATOM 2306 CB ILE 148 10.474 3.675 6.125 1.00 0.00 C -ATOM 2307 HB ILE 148 10.197 3.927 5.101 1.00 0.00 H -ATOM 2308 CG2 ILE 148 12.013 3.494 6.180 1.00 0.00 C -ATOM 2309 HG21 ILE 148 12.529 4.352 5.749 1.00 0.00 H -ATOM 2310 HG22 ILE 148 12.483 3.326 7.150 1.00 0.00 H -ATOM 2311 HG23 ILE 148 12.278 2.628 5.574 1.00 0.00 H -ATOM 2312 CG1 ILE 148 9.825 2.311 6.549 1.00 0.00 C -ATOM 2313 HG12 ILE 148 10.162 2.113 7.567 1.00 0.00 H -ATOM 2314 HG13 ILE 148 8.740 2.396 6.598 1.00 0.00 H -ATOM 2315 CD1 ILE 148 10.160 1.182 5.580 1.00 0.00 C -ATOM 2316 HD11 ILE 148 9.396 0.404 5.546 1.00 0.00 H -ATOM 2317 HD12 ILE 148 10.131 1.624 4.585 1.00 0.00 H -ATOM 2318 HD13 ILE 148 11.145 0.720 5.639 1.00 0.00 H -ATOM 2319 C ILE 148 10.446 6.268 6.200 1.00 0.00 C -ATOM 2320 O ILE 148 9.682 6.762 5.385 1.00 0.00 O -ATOM 2321 N TYR 149 11.697 6.698 6.310 1.00 0.00 N -ATOM 2322 H TYR 149 12.226 6.195 7.006 1.00 0.00 H -ATOM 2323 CA TYR 149 12.376 7.802 5.574 1.00 0.00 C -ATOM 2324 HA TYR 149 12.154 7.800 4.508 1.00 0.00 H -ATOM 2325 CB TYR 149 11.849 9.109 6.103 1.00 0.00 C -ATOM 2326 HB2 TYR 149 10.776 9.103 5.912 1.00 0.00 H -ATOM 2327 HB3 TYR 149 12.015 9.084 7.180 1.00 0.00 H -ATOM 2328 CG TYR 149 12.521 10.329 5.545 1.00 0.00 C -ATOM 2329 CD1 TYR 149 13.287 11.116 6.391 1.00 0.00 C -ATOM 2330 HD1 TYR 149 13.456 10.758 7.396 1.00 0.00 H -ATOM 2331 CE1 TYR 149 14.046 12.178 5.864 1.00 0.00 C -ATOM 2332 HE1 TYR 149 14.739 12.764 6.449 1.00 0.00 H -ATOM 2333 CZ TYR 149 13.879 12.621 4.526 1.00 0.00 C -ATOM 2334 OH TYR 149 14.535 13.744 4.052 1.00 0.00 O -ATOM 2335 HH TYR 149 15.192 14.051 4.681 1.00 0.00 H -ATOM 2336 CE2 TYR 149 13.050 11.939 3.694 1.00 0.00 C -ATOM 2337 HE2 TYR 149 12.896 12.236 2.667 1.00 0.00 H -ATOM 2338 CD2 TYR 149 12.441 10.787 4.193 1.00 0.00 C -ATOM 2339 HD2 TYR 149 11.855 10.166 3.533 1.00 0.00 H -ATOM 2340 C TYR 149 13.903 7.667 5.700 1.00 0.00 C -ATOM 2341 O TYR 149 14.394 7.574 6.827 1.00 0.00 O -ATOM 2342 N ASN 150 14.689 7.750 4.599 1.00 0.00 N -ATOM 2343 H ASN 150 14.171 7.771 3.732 1.00 0.00 H -ATOM 2344 CA ASN 150 16.163 7.605 4.547 1.00 0.00 C -ATOM 2345 HA ASN 150 16.361 7.300 3.520 1.00 0.00 H -ATOM 2346 CB ASN 150 16.806 8.998 4.876 1.00 0.00 C -ATOM 2347 HB2 ASN 150 16.166 9.740 4.397 1.00 0.00 H -ATOM 2348 HB3 ASN 150 16.806 9.154 5.955 1.00 0.00 H -ATOM 2349 CG ASN 150 18.267 9.052 4.533 1.00 0.00 C -ATOM 2350 OD1 ASN 150 18.783 8.031 4.094 1.00 0.00 O -ATOM 2351 ND2 ASN 150 18.985 10.109 4.822 1.00 0.00 N -ATOM 2352 HD21 ASN 150 19.990 10.012 4.820 1.00 0.00 H -ATOM 2353 HD22 ASN 150 18.466 10.867 5.242 1.00 0.00 H -ATOM 2354 C ASN 150 16.762 6.313 5.325 1.00 0.00 C -ATOM 2355 O ASN 150 17.706 6.406 6.125 1.00 0.00 O -ATOM 2356 N GLU 151 16.056 5.153 5.328 1.00 0.00 N -ATOM 2357 H GLU 151 15.216 5.226 4.772 1.00 0.00 H -ATOM 2358 CA GLU 151 16.322 3.975 6.155 1.00 0.00 C -ATOM 2359 HA GLU 151 15.529 3.227 6.105 1.00 0.00 H -ATOM 2360 CB GLU 151 17.591 3.260 5.747 1.00 0.00 C -ATOM 2361 HB2 GLU 151 18.418 3.954 5.899 1.00 0.00 H -ATOM 2362 HB3 GLU 151 17.811 2.361 6.322 1.00 0.00 H -ATOM 2363 CG GLU 151 17.748 2.788 4.271 1.00 0.00 C -ATOM 2364 HG2 GLU 151 17.635 3.665 3.633 1.00 0.00 H -ATOM 2365 HG3 GLU 151 18.678 2.276 4.026 1.00 0.00 H -ATOM 2366 CD GLU 151 16.688 1.769 3.914 1.00 0.00 C -ATOM 2367 OE1 GLU 151 16.644 0.717 4.580 1.00 0.00 O -ATOM 2368 OE2 GLU 151 15.919 1.963 2.931 1.00 0.00 O -ATOM 2369 C GLU 151 16.199 4.191 7.643 1.00 0.00 C -ATOM 2370 O GLU 151 16.559 3.281 8.395 1.00 0.00 O -ATOM 2371 N GLU 152 15.573 5.235 8.190 1.00 0.00 N -ATOM 2372 H GLU 152 15.312 6.049 7.651 1.00 0.00 H -ATOM 2373 CA GLU 152 15.287 5.405 9.591 1.00 0.00 C -ATOM 2374 HA GLU 152 15.872 4.695 10.174 1.00 0.00 H -ATOM 2375 CB GLU 152 15.648 6.877 10.022 1.00 0.00 C -ATOM 2376 HB2 GLU 152 15.053 7.525 9.377 1.00 0.00 H -ATOM 2377 HB3 GLU 152 15.280 7.097 11.025 1.00 0.00 H -ATOM 2378 CG GLU 152 17.137 7.323 9.940 1.00 0.00 C -ATOM 2379 HG2 GLU 152 17.827 6.537 10.244 1.00 0.00 H -ATOM 2380 HG3 GLU 152 17.322 7.432 8.871 1.00 0.00 H -ATOM 2381 CD GLU 152 17.400 8.620 10.719 1.00 0.00 C -ATOM 2382 OE1 GLU 152 16.488 9.340 11.171 1.00 0.00 O -ATOM 2383 OE2 GLU 152 18.589 8.817 11.023 1.00 0.00 O -ATOM 2384 C GLU 152 13.846 5.188 9.890 1.00 0.00 C -ATOM 2385 O GLU 152 13.017 5.483 9.059 1.00 0.00 O -ATOM 2386 N LEU 153 13.566 4.593 11.004 1.00 0.00 N -ATOM 2387 H LEU 153 14.256 4.478 11.732 1.00 0.00 H -ATOM 2388 CA LEU 153 12.266 4.076 11.274 1.00 0.00 C -ATOM 2389 HA LEU 153 11.734 3.969 10.328 1.00 0.00 H -ATOM 2390 CB LEU 153 12.323 2.730 12.070 1.00 0.00 C -ATOM 2391 HB2 LEU 153 12.944 2.951 12.937 1.00 0.00 H -ATOM 2392 HB3 LEU 153 11.325 2.450 12.406 1.00 0.00 H -ATOM 2393 CG LEU 153 12.986 1.542 11.374 1.00 0.00 C -ATOM 2394 HG LEU 153 14.039 1.786 11.238 1.00 0.00 H -ATOM 2395 CD1 LEU 153 12.906 0.223 12.073 1.00 0.00 C -ATOM 2396 HD11 LEU 153 13.432 0.297 13.025 1.00 0.00 H -ATOM 2397 HD12 LEU 153 11.864 -0.019 12.279 1.00 0.00 H -ATOM 2398 HD13 LEU 153 13.351 -0.522 11.412 1.00 0.00 H -ATOM 2399 CD2 LEU 153 12.347 1.345 9.969 1.00 0.00 C -ATOM 2400 HD21 LEU 153 12.472 2.154 9.250 1.00 0.00 H -ATOM 2401 HD22 LEU 153 12.596 0.356 9.584 1.00 0.00 H -ATOM 2402 HD23 LEU 153 11.262 1.385 10.058 1.00 0.00 H -ATOM 2403 C LEU 153 11.466 5.101 12.096 1.00 0.00 C -ATOM 2404 O LEU 153 11.819 5.321 13.283 1.00 0.00 O -ATOM 2405 N PHE 154 10.496 5.809 11.503 1.00 0.00 N -ATOM 2406 H PHE 154 10.073 5.481 10.646 1.00 0.00 H -ATOM 2407 CA PHE 154 9.714 6.865 12.233 1.00 0.00 C -ATOM 2408 HA PHE 154 10.427 7.304 12.932 1.00 0.00 H -ATOM 2409 CB PHE 154 9.277 8.001 11.247 1.00 0.00 C -ATOM 2410 HB2 PHE 154 8.926 7.532 10.329 1.00 0.00 H -ATOM 2411 HB3 PHE 154 8.378 8.519 11.584 1.00 0.00 H -ATOM 2412 CG PHE 154 10.328 8.979 10.843 1.00 0.00 C -ATOM 2413 CD1 PHE 154 11.323 8.613 9.936 1.00 0.00 C -ATOM 2414 HD1 PHE 154 11.385 7.585 9.612 1.00 0.00 H -ATOM 2415 CE1 PHE 154 12.331 9.590 9.665 1.00 0.00 C -ATOM 2416 HE1 PHE 154 13.161 9.388 9.004 1.00 0.00 H -ATOM 2417 CZ PHE 154 12.339 10.844 10.258 1.00 0.00 C -ATOM 2418 HZ PHE 154 13.175 11.518 10.142 1.00 0.00 H -ATOM 2419 CE2 PHE 154 11.265 11.199 11.087 1.00 0.00 C -ATOM 2420 HE2 PHE 154 11.271 12.206 11.476 1.00 0.00 H -ATOM 2421 CD2 PHE 154 10.211 10.270 11.352 1.00 0.00 C -ATOM 2422 HD2 PHE 154 9.482 10.545 12.100 1.00 0.00 H -ATOM 2423 C PHE 154 8.548 6.317 13.033 1.00 0.00 C -ATOM 2424 O PHE 154 7.848 5.404 12.585 1.00 0.00 O -ATOM 2425 N ASP 155 8.290 6.842 14.214 1.00 0.00 N -ATOM 2426 H ASP 155 8.842 7.622 14.541 1.00 0.00 H -ATOM 2427 CA ASP 155 7.143 6.467 15.063 1.00 0.00 C -ATOM 2428 HA ASP 155 6.630 5.544 14.788 1.00 0.00 H -ATOM 2429 CB ASP 155 7.602 6.451 16.536 1.00 0.00 C -ATOM 2430 HB2 ASP 155 8.513 5.862 16.643 1.00 0.00 H -ATOM 2431 HB3 ASP 155 7.809 7.441 16.942 1.00 0.00 H -ATOM 2432 CG ASP 155 6.592 5.884 17.493 1.00 0.00 C -ATOM 2433 OD1 ASP 155 6.941 5.480 18.646 1.00 0.00 O -ATOM 2434 OD2 ASP 155 5.384 5.812 17.126 1.00 0.00 O -ATOM 2435 C ASP 155 6.036 7.528 14.773 1.00 0.00 C -ATOM 2436 O ASP 155 6.232 8.729 14.623 1.00 0.00 O -ATOM 2437 N LEU 156 4.802 7.040 14.685 1.00 0.00 N -ATOM 2438 H LEU 156 4.761 6.038 14.801 1.00 0.00 H -ATOM 2439 CA LEU 156 3.565 7.869 14.457 1.00 0.00 C -ATOM 2440 HA LEU 156 3.641 8.859 14.908 1.00 0.00 H -ATOM 2441 CB LEU 156 3.115 7.984 12.943 1.00 0.00 C -ATOM 2442 HB2 LEU 156 3.024 6.991 12.504 1.00 0.00 H -ATOM 2443 HB3 LEU 156 2.133 8.431 12.788 1.00 0.00 H -ATOM 2444 CG LEU 156 4.118 8.652 12.013 1.00 0.00 C -ATOM 2445 HG LEU 156 5.094 8.207 12.203 1.00 0.00 H -ATOM 2446 CD1 LEU 156 3.718 8.534 10.566 1.00 0.00 C -ATOM 2447 HD11 LEU 156 2.665 8.798 10.476 1.00 0.00 H -ATOM 2448 HD12 LEU 156 4.395 9.009 9.855 1.00 0.00 H -ATOM 2449 HD13 LEU 156 3.774 7.492 10.256 1.00 0.00 H -ATOM 2450 CD2 LEU 156 4.168 10.188 12.234 1.00 0.00 C -ATOM 2451 HD21 LEU 156 4.670 10.855 11.532 1.00 0.00 H -ATOM 2452 HD22 LEU 156 3.180 10.586 12.465 1.00 0.00 H -ATOM 2453 HD23 LEU 156 4.782 10.341 13.121 1.00 0.00 H -ATOM 2454 C LEU 156 2.330 7.284 15.189 1.00 0.00 C -ATOM 2455 O LEU 156 1.383 8.027 15.511 1.00 0.00 O -ATOM 2456 N LEU 157 2.363 6.001 15.593 1.00 0.00 N -ATOM 2457 H LEU 157 3.199 5.472 15.393 1.00 0.00 H -ATOM 2458 CA LEU 157 1.298 5.328 16.361 1.00 0.00 C -ATOM 2459 HA LEU 157 0.337 5.662 15.968 1.00 0.00 H -ATOM 2460 CB LEU 157 1.475 3.823 16.253 1.00 0.00 C -ATOM 2461 HB2 LEU 157 1.768 3.535 15.244 1.00 0.00 H -ATOM 2462 HB3 LEU 157 2.207 3.454 16.971 1.00 0.00 H -ATOM 2463 CG LEU 157 0.149 3.030 16.654 1.00 0.00 C -ATOM 2464 HG LEU 157 -0.183 3.448 17.604 1.00 0.00 H -ATOM 2465 CD1 LEU 157 -0.862 3.193 15.560 1.00 0.00 C -ATOM 2466 HD11 LEU 157 -0.346 2.890 14.649 1.00 0.00 H -ATOM 2467 HD12 LEU 157 -1.753 2.604 15.779 1.00 0.00 H -ATOM 2468 HD13 LEU 157 -1.136 4.235 15.403 1.00 0.00 H -ATOM 2469 CD2 LEU 157 0.510 1.575 16.961 1.00 0.00 C -ATOM 2470 HD21 LEU 157 0.935 1.606 17.964 1.00 0.00 H -ATOM 2471 HD22 LEU 157 -0.436 1.033 16.981 1.00 0.00 H -ATOM 2472 HD23 LEU 157 1.184 1.097 16.249 1.00 0.00 H -ATOM 2473 C LEU 157 1.267 5.799 17.808 1.00 0.00 C -ATOM 2474 O LEU 157 0.174 5.844 18.365 1.00 0.00 O -ATOM 2475 N ASN 158 2.404 6.189 18.417 1.00 0.00 N -ATOM 2476 H ASN 158 3.316 6.222 17.985 1.00 0.00 H -ATOM 2477 CA ASN 158 2.481 6.706 19.815 1.00 0.00 C -ATOM 2478 HA ASN 158 1.850 6.192 20.541 1.00 0.00 H -ATOM 2479 CB ASN 158 3.857 6.612 20.330 1.00 0.00 C -ATOM 2480 HB2 ASN 158 4.634 6.811 19.592 1.00 0.00 H -ATOM 2481 HB3 ASN 158 4.133 7.227 21.186 1.00 0.00 H -ATOM 2482 CG ASN 158 4.100 5.193 20.836 1.00 0.00 C -ATOM 2483 OD1 ASN 158 3.236 4.628 21.540 1.00 0.00 O -ATOM 2484 ND2 ASN 158 5.218 4.571 20.572 1.00 0.00 N -ATOM 2485 HD21 ASN 158 5.411 3.736 21.107 1.00 0.00 H -ATOM 2486 HD22 ASN 158 5.929 4.953 19.965 1.00 0.00 H -ATOM 2487 C ASN 158 2.003 8.205 19.835 1.00 0.00 C -ATOM 2488 O ASN 158 2.051 8.923 18.821 1.00 0.00 O -ATOM 2489 N PRO 159 1.450 8.695 20.991 1.00 0.00 N -ATOM 2490 CD PRO 159 1.101 7.912 22.140 1.00 0.00 C -ATOM 2491 HD2 PRO 159 1.995 7.503 22.611 1.00 0.00 H -ATOM 2492 HD3 PRO 159 0.441 7.078 21.902 1.00 0.00 H -ATOM 2493 CG PRO 159 0.439 8.968 23.061 1.00 0.00 C -ATOM 2494 HG2 PRO 159 1.127 9.455 23.751 1.00 0.00 H -ATOM 2495 HG3 PRO 159 -0.334 8.462 23.640 1.00 0.00 H -ATOM 2496 CB PRO 159 -0.111 10.021 22.122 1.00 0.00 C -ATOM 2497 HB2 PRO 159 -0.177 10.971 22.653 1.00 0.00 H -ATOM 2498 HB3 PRO 159 -1.131 9.798 21.810 1.00 0.00 H -ATOM 2499 CA PRO 159 0.957 10.057 20.990 1.00 0.00 C -ATOM 2500 HA PRO 159 0.430 10.222 20.049 1.00 0.00 H -ATOM 2501 C PRO 159 2.003 11.169 21.100 1.00 0.00 C -ATOM 2502 O PRO 159 1.799 12.351 20.646 1.00 0.00 O -ATOM 2503 N SER 160 3.155 10.830 21.613 1.00 0.00 N -ATOM 2504 H SER 160 3.333 9.853 21.800 1.00 0.00 H -ATOM 2505 CA SER 160 4.254 11.729 21.960 1.00 0.00 C -ATOM 2506 HA SER 160 3.879 12.492 22.642 1.00 0.00 H -ATOM 2507 CB SER 160 5.263 10.895 22.874 1.00 0.00 C -ATOM 2508 HB2 SER 160 4.709 10.577 23.757 1.00 0.00 H -ATOM 2509 HB3 SER 160 5.505 9.936 22.416 1.00 0.00 H -ATOM 2510 OG SER 160 6.423 11.674 23.227 1.00 0.00 O -ATOM 2511 HG SER 160 6.703 11.246 24.039 1.00 0.00 H -ATOM 2512 C SER 160 4.961 12.385 20.751 1.00 0.00 C -ATOM 2513 O SER 160 5.266 11.711 19.792 1.00 0.00 O -ATOM 2514 N SER 161 4.860 13.703 20.805 1.00 0.00 N -ATOM 2515 H SER 161 4.565 14.032 21.713 1.00 0.00 H -ATOM 2516 CA SER 161 4.915 14.585 19.673 1.00 0.00 C -ATOM 2517 HA SER 161 4.088 14.211 19.069 1.00 0.00 H -ATOM 2518 CB SER 161 4.626 16.026 20.070 1.00 0.00 C -ATOM 2519 HB2 SER 161 5.412 16.424 20.712 1.00 0.00 H -ATOM 2520 HB3 SER 161 4.558 16.640 19.171 1.00 0.00 H -ATOM 2521 OG SER 161 3.481 16.098 20.780 1.00 0.00 O -ATOM 2522 HG SER 161 3.632 15.984 21.722 1.00 0.00 H -ATOM 2523 C SER 161 6.315 14.640 19.050 1.00 0.00 C -ATOM 2524 O SER 161 6.461 15.102 17.907 1.00 0.00 O -ATOM 2525 N ASP 162 7.404 14.197 19.681 1.00 0.00 N -ATOM 2526 H ASP 162 7.275 13.765 20.584 1.00 0.00 H -ATOM 2527 CA ASP 162 8.856 14.206 19.211 1.00 0.00 C -ATOM 2528 HA ASP 162 8.960 15.239 18.877 1.00 0.00 H -ATOM 2529 CB ASP 162 9.900 13.892 20.344 1.00 0.00 C -ATOM 2530 HB2 ASP 162 9.762 14.642 21.122 1.00 0.00 H -ATOM 2531 HB3 ASP 162 9.710 12.951 20.860 1.00 0.00 H -ATOM 2532 CG ASP 162 11.445 14.032 20.026 1.00 0.00 C -ATOM 2533 OD1 ASP 162 12.243 13.815 20.992 1.00 0.00 O -ATOM 2534 OD2 ASP 162 11.751 14.307 18.850 1.00 0.00 O -ATOM 2535 C ASP 162 9.110 13.351 17.947 1.00 0.00 C -ATOM 2536 O ASP 162 9.197 12.122 17.981 1.00 0.00 O -ATOM 2537 N VAL 163 9.413 14.018 16.810 1.00 0.00 N -ATOM 2538 H VAL 163 9.446 15.024 16.886 1.00 0.00 H -ATOM 2539 CA VAL 163 9.757 13.520 15.506 1.00 0.00 C -ATOM 2540 HA VAL 163 9.091 12.761 15.097 1.00 0.00 H -ATOM 2541 CB VAL 163 9.593 14.687 14.491 1.00 0.00 C -ATOM 2542 HB VAL 163 10.014 15.628 14.846 1.00 0.00 H -ATOM 2543 CG1 VAL 163 10.217 14.349 13.036 1.00 0.00 C -ATOM 2544 HG11 VAL 163 9.960 15.192 12.395 1.00 0.00 H -ATOM 2545 HG12 VAL 163 11.296 14.274 13.170 1.00 0.00 H -ATOM 2546 HG13 VAL 163 9.642 13.532 12.599 1.00 0.00 H -ATOM 2547 CG2 VAL 163 8.102 14.991 14.237 1.00 0.00 C -ATOM 2548 HG21 VAL 163 7.609 15.120 15.201 1.00 0.00 H -ATOM 2549 HG22 VAL 163 8.073 15.905 13.643 1.00 0.00 H -ATOM 2550 HG23 VAL 163 7.610 14.187 13.690 1.00 0.00 H -ATOM 2551 C VAL 163 11.175 12.881 15.441 1.00 0.00 C -ATOM 2552 O VAL 163 11.340 12.077 14.558 1.00 0.00 O -ATOM 2553 N SER 164 12.064 13.169 16.417 1.00 0.00 N -ATOM 2554 H SER 164 11.745 13.640 17.251 1.00 0.00 H -ATOM 2555 CA SER 164 13.433 12.575 16.474 1.00 0.00 C -ATOM 2556 HA SER 164 13.683 12.445 15.422 1.00 0.00 H -ATOM 2557 CB SER 164 14.418 13.463 17.114 1.00 0.00 C -ATOM 2558 HB2 SER 164 15.358 13.012 16.796 1.00 0.00 H -ATOM 2559 HB3 SER 164 14.272 14.486 16.770 1.00 0.00 H -ATOM 2560 OG SER 164 14.335 13.337 18.493 1.00 0.00 O -ATOM 2561 HG SER 164 13.527 13.772 18.777 1.00 0.00 H -ATOM 2562 C SER 164 13.442 11.162 17.079 1.00 0.00 C -ATOM 2563 O SER 164 14.343 10.367 16.832 1.00 0.00 O -ATOM 2564 N GLU 165 12.390 10.848 17.877 1.00 0.00 N -ATOM 2565 H GLU 165 11.698 11.563 18.048 1.00 0.00 H -ATOM 2566 CA GLU 165 12.202 9.495 18.425 1.00 0.00 C -ATOM 2567 HA GLU 165 13.012 9.253 19.113 1.00 0.00 H -ATOM 2568 CB GLU 165 10.890 9.343 19.212 1.00 0.00 C -ATOM 2569 HB2 GLU 165 10.086 9.698 18.568 1.00 0.00 H -ATOM 2570 HB3 GLU 165 10.714 8.311 19.516 1.00 0.00 H -ATOM 2571 CG GLU 165 10.923 10.321 20.454 1.00 0.00 C -ATOM 2572 HG2 GLU 165 11.170 11.316 20.081 1.00 0.00 H -ATOM 2573 HG3 GLU 165 9.906 10.305 20.844 1.00 0.00 H -ATOM 2574 CD GLU 165 11.934 9.770 21.468 1.00 0.00 C -ATOM 2575 OE1 GLU 165 12.224 10.512 22.407 1.00 0.00 O -ATOM 2576 OE2 GLU 165 12.421 8.607 21.447 1.00 0.00 O -ATOM 2577 C GLU 165 12.168 8.520 17.230 1.00 0.00 C -ATOM 2578 O GLU 165 11.641 8.967 16.198 1.00 0.00 O -ATOM 2579 N ARG 166 12.777 7.353 17.359 1.00 0.00 N -ATOM 2580 H ARG 166 13.306 7.216 18.208 1.00 0.00 H -ATOM 2581 CA ARG 166 12.670 6.226 16.426 1.00 0.00 C -ATOM 2582 HA ARG 166 12.137 6.490 15.512 1.00 0.00 H -ATOM 2583 CB ARG 166 14.082 5.770 15.961 1.00 0.00 C -ATOM 2584 HB2 ARG 166 14.608 5.612 16.901 1.00 0.00 H -ATOM 2585 HB3 ARG 166 14.123 4.906 15.298 1.00 0.00 H -ATOM 2586 CG ARG 166 14.867 6.871 15.191 1.00 0.00 C -ATOM 2587 HG2 ARG 166 14.877 7.826 15.718 1.00 0.00 H -ATOM 2588 HG3 ARG 166 15.896 6.547 15.037 1.00 0.00 H -ATOM 2589 CD ARG 166 14.353 7.160 13.840 1.00 0.00 C -ATOM 2590 HD2 ARG 166 14.745 6.350 13.224 1.00 0.00 H -ATOM 2591 HD3 ARG 166 13.271 7.035 13.799 1.00 0.00 H -ATOM 2592 NE ARG 166 14.808 8.470 13.273 1.00 0.00 N -ATOM 2593 HE ARG 166 15.662 8.571 12.744 1.00 0.00 H -ATOM 2594 CZ ARG 166 14.109 9.567 13.247 1.00 0.00 C -ATOM 2595 NH1 ARG 166 12.999 9.710 13.926 1.00 0.00 N -ATOM 2596 HH11 ARG 166 12.610 9.015 14.548 1.00 0.00 H -ATOM 2597 HH12 ARG 166 12.571 10.624 13.931 1.00 0.00 H -ATOM 2598 NH2 ARG 166 14.596 10.611 12.686 1.00 0.00 N -ATOM 2599 HH21 ARG 166 15.217 10.304 11.951 1.00 0.00 H -ATOM 2600 HH22 ARG 166 13.973 11.405 12.627 1.00 0.00 H -ATOM 2601 C ARG 166 11.974 5.027 17.006 1.00 0.00 C -ATOM 2602 O ARG 166 11.846 4.946 18.167 1.00 0.00 O -ATOM 2603 N LEU 167 11.698 4.009 16.191 1.00 0.00 N -ATOM 2604 H LEU 167 11.949 4.089 15.216 1.00 0.00 H -ATOM 2605 CA LEU 167 11.445 2.634 16.614 1.00 0.00 C -ATOM 2606 HA LEU 167 10.833 2.654 17.516 1.00 0.00 H -ATOM 2607 CB LEU 167 10.553 1.988 15.543 1.00 0.00 C -ATOM 2608 HB2 LEU 167 11.056 2.019 14.575 1.00 0.00 H -ATOM 2609 HB3 LEU 167 10.521 0.904 15.657 1.00 0.00 H -ATOM 2610 CG LEU 167 9.173 2.590 15.406 1.00 0.00 C -ATOM 2611 HG LEU 167 9.312 3.619 15.073 1.00 0.00 H -ATOM 2612 CD1 LEU 167 8.347 1.930 14.232 1.00 0.00 C -ATOM 2613 HD11 LEU 167 8.686 2.327 13.275 1.00 0.00 H -ATOM 2614 HD12 LEU 167 8.521 0.858 14.330 1.00 0.00 H -ATOM 2615 HD13 LEU 167 7.278 2.007 14.429 1.00 0.00 H -ATOM 2616 CD2 LEU 167 8.332 2.682 16.715 1.00 0.00 C -ATOM 2617 HD21 LEU 167 8.111 1.644 16.963 1.00 0.00 H -ATOM 2618 HD22 LEU 167 8.912 3.154 17.508 1.00 0.00 H -ATOM 2619 HD23 LEU 167 7.445 3.275 16.489 1.00 0.00 H -ATOM 2620 C LEU 167 12.801 1.922 16.953 1.00 0.00 C -ATOM 2621 O LEU 167 13.886 2.447 16.684 1.00 0.00 O -ATOM 2622 N GLN 168 12.632 0.770 17.548 1.00 0.00 N -ATOM 2623 H GLN 168 11.665 0.502 17.660 1.00 0.00 H -ATOM 2624 CA GLN 168 13.643 -0.204 17.934 1.00 0.00 C -ATOM 2625 HA GLN 168 14.620 0.236 17.739 1.00 0.00 H -ATOM 2626 CB GLN 168 13.476 -0.665 19.444 1.00 0.00 C -ATOM 2627 HB2 GLN 168 12.494 -1.132 19.379 1.00 0.00 H -ATOM 2628 HB3 GLN 168 14.266 -1.383 19.669 1.00 0.00 H -ATOM 2629 CG GLN 168 13.378 0.371 20.540 1.00 0.00 C -ATOM 2630 HG2 GLN 168 14.328 0.814 20.841 1.00 0.00 H -ATOM 2631 HG3 GLN 168 12.683 1.139 20.202 1.00 0.00 H -ATOM 2632 CD GLN 168 12.839 -0.167 21.868 1.00 0.00 C -ATOM 2633 OE1 GLN 168 13.485 -0.948 22.529 1.00 0.00 O -ATOM 2634 NE2 GLN 168 11.607 0.175 22.272 1.00 0.00 N -ATOM 2635 HE21 GLN 168 11.356 -0.072 23.219 1.00 0.00 H -ATOM 2636 HE22 GLN 168 11.024 0.908 21.893 1.00 0.00 H -ATOM 2637 C GLN 168 13.434 -1.448 17.028 1.00 0.00 C -ATOM 2638 O GLN 168 12.312 -1.820 16.854 1.00 0.00 O -ATOM 2639 N MET 169 14.537 -2.005 16.514 1.00 0.00 N -ATOM 2640 H MET 169 15.400 -1.664 16.915 1.00 0.00 H -ATOM 2641 CA MET 169 14.476 -3.137 15.587 1.00 0.00 C -ATOM 2642 HA MET 169 13.464 -3.540 15.575 1.00 0.00 H -ATOM 2643 CB MET 169 14.635 -2.560 14.159 1.00 0.00 C -ATOM 2644 HB2 MET 169 13.798 -1.877 14.014 1.00 0.00 H -ATOM 2645 HB3 MET 169 15.590 -2.047 14.045 1.00 0.00 H -ATOM 2646 CG MET 169 14.550 -3.628 13.088 1.00 0.00 C -ATOM 2647 HG2 MET 169 15.314 -4.361 13.347 1.00 0.00 H -ATOM 2648 HG3 MET 169 13.580 -4.093 13.263 1.00 0.00 H -ATOM 2649 SD MET 169 14.853 -2.978 11.370 1.00 0.00 S -ATOM 2650 CE MET 169 16.611 -2.923 11.553 1.00 0.00 C -ATOM 2651 HE1 MET 169 17.004 -3.890 11.865 1.00 0.00 H -ATOM 2652 HE2 MET 169 17.109 -2.637 10.627 1.00 0.00 H -ATOM 2653 HE3 MET 169 16.887 -2.172 12.293 1.00 0.00 H -ATOM 2654 C MET 169 15.518 -4.330 15.994 1.00 0.00 C -ATOM 2655 O MET 169 16.507 -4.050 16.631 1.00 0.00 O -ATOM 2656 N PHE 170 15.208 -5.598 15.558 1.00 0.00 N -ATOM 2657 H PHE 170 14.252 -5.703 15.253 1.00 0.00 H -ATOM 2658 CA PHE 170 16.049 -6.768 15.722 1.00 0.00 C -ATOM 2659 HA PHE 170 17.095 -6.461 15.703 1.00 0.00 H -ATOM 2660 CB PHE 170 15.741 -7.354 17.135 1.00 0.00 C -ATOM 2661 HB2 PHE 170 14.653 -7.305 17.190 1.00 0.00 H -ATOM 2662 HB3 PHE 170 16.189 -8.330 17.319 1.00 0.00 H -ATOM 2663 CG PHE 170 16.227 -6.581 18.299 1.00 0.00 C -ATOM 2664 CD1 PHE 170 17.537 -6.751 18.778 1.00 0.00 C -ATOM 2665 HD1 PHE 170 18.192 -7.390 18.206 1.00 0.00 H -ATOM 2666 CE1 PHE 170 17.991 -6.204 19.989 1.00 0.00 C -ATOM 2667 HE1 PHE 170 18.981 -6.466 20.331 1.00 0.00 H -ATOM 2668 CZ PHE 170 17.052 -5.618 20.865 1.00 0.00 C -ATOM 2669 HZ PHE 170 17.374 -5.283 21.839 1.00 0.00 H -ATOM 2670 CE2 PHE 170 15.749 -5.401 20.478 1.00 0.00 C -ATOM 2671 HE2 PHE 170 15.006 -4.872 21.056 1.00 0.00 H -ATOM 2672 CD2 PHE 170 15.340 -5.892 19.165 1.00 0.00 C -ATOM 2673 HD2 PHE 170 14.324 -5.696 18.856 1.00 0.00 H -ATOM 2674 C PHE 170 15.792 -7.882 14.650 1.00 0.00 C -ATOM 2675 O PHE 170 14.668 -8.035 14.166 1.00 0.00 O -ATOM 2676 N ASP 171 16.690 -8.763 14.242 1.00 0.00 N -ATOM 2677 H ASP 171 17.604 -8.646 14.656 1.00 0.00 H -ATOM 2678 CA ASP 171 16.335 -9.942 13.436 1.00 0.00 C -ATOM 2679 HA ASP 171 15.771 -9.591 12.571 1.00 0.00 H -ATOM 2680 CB ASP 171 17.564 -10.691 12.905 1.00 0.00 C -ATOM 2681 HB2 ASP 171 18.086 -11.134 13.753 1.00 0.00 H -ATOM 2682 HB3 ASP 171 17.229 -11.487 12.241 1.00 0.00 H -ATOM 2683 CG ASP 171 18.436 -9.775 12.046 1.00 0.00 C -ATOM 2684 OD1 ASP 171 17.890 -8.776 11.460 1.00 0.00 O -ATOM 2685 OD2 ASP 171 19.656 -10.088 11.799 1.00 0.00 O -ATOM 2686 C ASP 171 15.518 -10.930 14.262 1.00 0.00 C -ATOM 2687 O ASP 171 15.727 -11.166 15.469 1.00 0.00 O -ATOM 2688 N ASP 172 14.571 -11.579 13.537 1.00 0.00 N -ATOM 2689 H ASP 172 14.572 -11.376 12.547 1.00 0.00 H -ATOM 2690 CA ASP 172 13.715 -12.671 14.006 1.00 0.00 C -ATOM 2691 HA ASP 172 13.242 -12.422 14.955 1.00 0.00 H -ATOM 2692 CB ASP 172 12.699 -12.818 12.915 1.00 0.00 C -ATOM 2693 HB2 ASP 172 12.176 -11.870 12.788 1.00 0.00 H -ATOM 2694 HB3 ASP 172 13.166 -13.012 11.950 1.00 0.00 H -ATOM 2695 CG ASP 172 11.710 -13.959 13.001 1.00 0.00 C -ATOM 2696 OD1 ASP 172 10.791 -13.917 12.212 1.00 0.00 O -ATOM 2697 OD2 ASP 172 11.771 -14.916 13.834 1.00 0.00 O -ATOM 2698 C ASP 172 14.485 -14.027 14.223 1.00 0.00 C -ATOM 2699 O ASP 172 15.007 -14.638 13.248 1.00 0.00 O -ATOM 2700 N PRO 173 14.599 -14.551 15.495 1.00 0.00 N -ATOM 2701 CD PRO 173 13.914 -14.021 16.663 1.00 0.00 C -ATOM 2702 HD2 PRO 173 12.879 -13.769 16.433 1.00 0.00 H -ATOM 2703 HD3 PRO 173 14.444 -13.173 17.096 1.00 0.00 H -ATOM 2704 CG PRO 173 13.939 -15.198 17.706 1.00 0.00 C -ATOM 2705 HG2 PRO 173 13.014 -15.719 17.465 1.00 0.00 H -ATOM 2706 HG3 PRO 173 13.947 -14.876 18.748 1.00 0.00 H -ATOM 2707 CB PRO 173 15.236 -15.973 17.294 1.00 0.00 C -ATOM 2708 HB2 PRO 173 15.091 -17.005 17.614 1.00 0.00 H -ATOM 2709 HB3 PRO 173 16.127 -15.528 17.738 1.00 0.00 H -ATOM 2710 CA PRO 173 15.369 -15.737 15.792 1.00 0.00 C -ATOM 2711 HA PRO 173 16.383 -15.538 15.448 1.00 0.00 H -ATOM 2712 C PRO 173 14.959 -16.997 15.015 1.00 0.00 C -ATOM 2713 O PRO 173 15.713 -17.979 14.984 1.00 0.00 O -ATOM 2714 N ARG 174 13.712 -17.029 14.418 1.00 0.00 N -ATOM 2715 H ARG 174 13.065 -16.258 14.507 1.00 0.00 H -ATOM 2716 CA ARG 174 13.358 -18.271 13.581 1.00 0.00 C -ATOM 2717 HA ARG 174 13.584 -19.141 14.197 1.00 0.00 H -ATOM 2718 CB ARG 174 11.865 -18.065 13.182 1.00 0.00 C -ATOM 2719 HB2 ARG 174 11.734 -17.199 12.533 1.00 0.00 H -ATOM 2720 HB3 ARG 174 11.691 -18.981 12.617 1.00 0.00 H -ATOM 2721 CG ARG 174 10.953 -18.138 14.392 1.00 0.00 C -ATOM 2722 HG2 ARG 174 10.999 -19.169 14.743 1.00 0.00 H -ATOM 2723 HG3 ARG 174 11.225 -17.460 15.201 1.00 0.00 H -ATOM 2724 CD ARG 174 9.554 -17.821 13.946 1.00 0.00 C -ATOM 2725 HD2 ARG 174 9.188 -18.335 13.057 1.00 0.00 H -ATOM 2726 HD3 ARG 174 8.891 -18.107 14.761 1.00 0.00 H -ATOM 2727 NE ARG 174 9.367 -16.388 13.599 1.00 0.00 N -ATOM 2728 HE ARG 174 10.244 -15.913 13.438 1.00 0.00 H -ATOM 2729 CZ ARG 174 8.259 -15.700 13.243 1.00 0.00 C -ATOM 2730 NH1 ARG 174 7.138 -16.312 13.178 1.00 0.00 N -ATOM 2731 HH11 ARG 174 7.129 -17.304 13.365 1.00 0.00 H -ATOM 2732 HH12 ARG 174 6.291 -15.841 12.898 1.00 0.00 H -ATOM 2733 NH2 ARG 174 8.248 -14.443 12.899 1.00 0.00 N -ATOM 2734 HH21 ARG 174 9.116 -13.981 12.666 1.00 0.00 H -ATOM 2735 HH22 ARG 174 7.357 -14.029 12.666 1.00 0.00 H -ATOM 2736 C ARG 174 14.212 -18.438 12.301 1.00 0.00 C -ATOM 2737 O ARG 174 14.714 -19.573 12.062 1.00 0.00 O -ATOM 2738 N ASN 175 14.387 -17.361 11.564 1.00 0.00 N -ATOM 2739 H ASN 175 13.901 -16.521 11.847 1.00 0.00 H -ATOM 2740 CA ASN 175 15.079 -17.455 10.264 1.00 0.00 C -ATOM 2741 HA ASN 175 15.723 -18.325 10.393 1.00 0.00 H -ATOM 2742 CB ASN 175 14.022 -17.761 9.134 1.00 0.00 C -ATOM 2743 HB2 ASN 175 14.619 -17.752 8.222 1.00 0.00 H -ATOM 2744 HB3 ASN 175 13.475 -18.677 9.357 1.00 0.00 H -ATOM 2745 CG ASN 175 13.005 -16.597 9.003 1.00 0.00 C -ATOM 2746 OD1 ASN 175 13.359 -15.436 9.110 1.00 0.00 O -ATOM 2747 ND2 ASN 175 11.744 -16.804 8.683 1.00 0.00 N -ATOM 2748 HD21 ASN 175 11.174 -15.991 8.869 1.00 0.00 H -ATOM 2749 HD22 ASN 175 11.248 -17.684 8.663 1.00 0.00 H -ATOM 2750 C ASN 175 16.028 -16.243 9.922 1.00 0.00 C -ATOM 2751 O ASN 175 16.802 -16.342 8.964 1.00 0.00 O -ATOM 2752 N LYS 176 16.028 -15.152 10.691 1.00 0.00 N -ATOM 2753 H LYS 176 15.427 -15.055 11.496 1.00 0.00 H -ATOM 2754 CA LYS 176 16.729 -13.977 10.367 1.00 0.00 C -ATOM 2755 HA LYS 176 16.262 -13.280 11.062 1.00 0.00 H -ATOM 2756 CB LYS 176 18.205 -14.105 10.876 1.00 0.00 C -ATOM 2757 HB2 LYS 176 18.705 -14.707 10.117 1.00 0.00 H -ATOM 2758 HB3 LYS 176 18.583 -13.085 10.803 1.00 0.00 H -ATOM 2759 CG LYS 176 18.410 -14.723 12.302 1.00 0.00 C -ATOM 2760 HG2 LYS 176 17.710 -14.302 13.023 1.00 0.00 H -ATOM 2761 HG3 LYS 176 18.095 -15.764 12.364 1.00 0.00 H -ATOM 2762 CD LYS 176 19.889 -14.752 12.667 1.00 0.00 C -ATOM 2763 HD2 LYS 176 20.104 -15.356 13.548 1.00 0.00 H -ATOM 2764 HD3 LYS 176 20.502 -15.276 11.934 1.00 0.00 H -ATOM 2765 CE LYS 176 20.493 -13.413 12.967 1.00 0.00 C -ATOM 2766 HE2 LYS 176 21.567 -13.543 12.841 1.00 0.00 H -ATOM 2767 HE3 LYS 176 20.042 -12.772 12.210 1.00 0.00 H -ATOM 2768 NZ LYS 176 20.107 -12.929 14.359 1.00 0.00 N -ATOM 2769 HZ1 LYS 176 20.719 -13.217 15.108 1.00 0.00 H -ATOM 2770 HZ2 LYS 176 20.160 -11.926 14.462 1.00 0.00 H -ATOM 2771 HZ3 LYS 176 19.160 -13.217 14.566 1.00 0.00 H -ATOM 2772 C LYS 176 16.493 -13.256 8.986 1.00 0.00 C -ATOM 2773 O LYS 176 17.050 -12.192 8.779 1.00 0.00 O -ATOM 2774 N ARG 177 15.636 -13.820 8.123 1.00 0.00 N -ATOM 2775 H ARG 177 15.196 -14.717 8.270 1.00 0.00 H -ATOM 2776 CA ARG 177 15.000 -13.125 7.006 1.00 0.00 C -ATOM 2777 HA ARG 177 15.668 -12.465 6.453 1.00 0.00 H -ATOM 2778 CB ARG 177 14.534 -14.241 6.065 1.00 0.00 C -ATOM 2779 HB2 ARG 177 15.302 -14.966 5.792 1.00 0.00 H -ATOM 2780 HB3 ARG 177 13.728 -14.817 6.521 1.00 0.00 H -ATOM 2781 CG ARG 177 13.980 -13.586 4.777 1.00 0.00 C -ATOM 2782 HG2 ARG 177 13.112 -12.943 4.926 1.00 0.00 H -ATOM 2783 HG3 ARG 177 14.826 -13.137 4.257 1.00 0.00 H -ATOM 2784 CD ARG 177 13.430 -14.749 3.925 1.00 0.00 C -ATOM 2785 HD2 ARG 177 13.188 -14.305 2.959 1.00 0.00 H -ATOM 2786 HD3 ARG 177 14.210 -15.501 3.807 1.00 0.00 H -ATOM 2787 NE ARG 177 12.116 -15.311 4.527 1.00 0.00 N -ATOM 2788 HE ARG 177 11.318 -14.703 4.412 1.00 0.00 H -ATOM 2789 CZ ARG 177 11.809 -16.542 4.699 1.00 0.00 C -ATOM 2790 NH1 ARG 177 12.650 -17.502 4.636 1.00 0.00 N -ATOM 2791 HH11 ARG 177 13.611 -17.305 4.398 1.00 0.00 H -ATOM 2792 HH12 ARG 177 12.276 -18.440 4.636 1.00 0.00 H -ATOM 2793 NH2 ARG 177 10.591 -16.933 4.778 1.00 0.00 N -ATOM 2794 HH21 ARG 177 9.906 -16.190 4.770 1.00 0.00 H -ATOM 2795 HH22 ARG 177 10.359 -17.911 4.876 1.00 0.00 H -ATOM 2796 C ARG 177 13.827 -12.260 7.549 1.00 0.00 C -ATOM 2797 O ARG 177 13.603 -11.131 7.091 1.00 0.00 O -ATOM 2798 N GLY 178 13.013 -12.718 8.458 1.00 0.00 N -ATOM 2799 H GLY 178 13.253 -13.601 8.885 1.00 0.00 H -ATOM 2800 CA GLY 178 12.017 -11.898 9.048 1.00 0.00 C -ATOM 2801 HA2 GLY 178 11.506 -11.367 8.244 1.00 0.00 H -ATOM 2802 HA3 GLY 178 11.225 -12.432 9.573 1.00 0.00 H -ATOM 2803 C GLY 178 12.728 -10.915 10.075 1.00 0.00 C -ATOM 2804 O GLY 178 13.952 -11.020 10.320 1.00 0.00 O -ATOM 2805 N VAL 179 11.950 -10.078 10.796 1.00 0.00 N -ATOM 2806 H VAL 179 10.972 -10.091 10.545 1.00 0.00 H -ATOM 2807 CA VAL 179 12.443 -9.023 11.683 1.00 0.00 C -ATOM 2808 HA VAL 179 13.359 -9.406 12.134 1.00 0.00 H -ATOM 2809 CB VAL 179 12.574 -7.690 10.845 1.00 0.00 C -ATOM 2810 HB VAL 179 12.845 -7.950 9.822 1.00 0.00 H -ATOM 2811 CG1 VAL 179 11.232 -6.938 10.699 1.00 0.00 C -ATOM 2812 HG11 VAL 179 10.641 -7.384 9.898 1.00 0.00 H -ATOM 2813 HG12 VAL 179 10.628 -6.920 11.606 1.00 0.00 H -ATOM 2814 HG13 VAL 179 11.483 -5.930 10.372 1.00 0.00 H -ATOM 2815 CG2 VAL 179 13.571 -6.706 11.368 1.00 0.00 C -ATOM 2816 HG21 VAL 179 13.081 -6.219 12.211 1.00 0.00 H -ATOM 2817 HG22 VAL 179 14.478 -7.210 11.701 1.00 0.00 H -ATOM 2818 HG23 VAL 179 13.883 -6.034 10.568 1.00 0.00 H -ATOM 2819 C VAL 179 11.445 -8.861 12.855 1.00 0.00 C -ATOM 2820 O VAL 179 10.266 -9.279 12.734 1.00 0.00 O -ATOM 2821 N ILE 180 11.852 -8.247 13.941 1.00 0.00 N -ATOM 2822 H ILE 180 12.844 -8.092 14.057 1.00 0.00 H -ATOM 2823 CA ILE 180 10.985 -7.799 15.038 1.00 0.00 C -ATOM 2824 HA ILE 180 9.909 -7.927 14.915 1.00 0.00 H -ATOM 2825 CB ILE 180 11.311 -8.723 16.277 1.00 0.00 C -ATOM 2826 HB ILE 180 12.392 -8.603 16.348 1.00 0.00 H -ATOM 2827 CG2 ILE 180 10.689 -8.219 17.584 1.00 0.00 C -ATOM 2828 HG21 ILE 180 9.633 -8.121 17.332 1.00 0.00 H -ATOM 2829 HG22 ILE 180 10.953 -8.934 18.363 1.00 0.00 H -ATOM 2830 HG23 ILE 180 11.014 -7.208 17.828 1.00 0.00 H -ATOM 2831 CG1 ILE 180 11.065 -10.218 16.052 1.00 0.00 C -ATOM 2832 HG12 ILE 180 10.015 -10.343 15.784 1.00 0.00 H -ATOM 2833 HG13 ILE 180 11.680 -10.610 15.242 1.00 0.00 H -ATOM 2834 CD1 ILE 180 11.444 -11.198 17.121 1.00 0.00 C -ATOM 2835 HD11 ILE 180 11.255 -12.205 16.748 1.00 0.00 H -ATOM 2836 HD12 ILE 180 12.524 -11.140 17.251 1.00 0.00 H -ATOM 2837 HD13 ILE 180 10.881 -11.057 18.044 1.00 0.00 H -ATOM 2838 C ILE 180 11.255 -6.284 15.267 1.00 0.00 C -ATOM 2839 O ILE 180 12.408 -5.830 15.148 1.00 0.00 O -ATOM 2840 N ILE 181 10.164 -5.503 15.535 1.00 0.00 N -ATOM 2841 H ILE 181 9.276 -5.981 15.498 1.00 0.00 H -ATOM 2842 CA ILE 181 10.140 -4.094 15.917 1.00 0.00 C -ATOM 2843 HA ILE 181 11.204 -3.860 15.861 1.00 0.00 H -ATOM 2844 CB ILE 181 9.369 -3.281 14.870 1.00 0.00 C -ATOM 2845 HB ILE 181 8.306 -3.396 15.084 1.00 0.00 H -ATOM 2846 CG2 ILE 181 9.769 -1.812 14.954 1.00 0.00 C -ATOM 2847 HG21 ILE 181 9.227 -1.303 14.157 1.00 0.00 H -ATOM 2848 HG22 ILE 181 9.385 -1.383 15.879 1.00 0.00 H -ATOM 2849 HG23 ILE 181 10.847 -1.653 14.934 1.00 0.00 H -ATOM 2850 CG1 ILE 181 9.480 -3.830 13.381 1.00 0.00 C -ATOM 2851 HG12 ILE 181 9.066 -4.829 13.239 1.00 0.00 H -ATOM 2852 HG13 ILE 181 8.964 -3.172 12.682 1.00 0.00 H -ATOM 2853 CD1 ILE 181 10.981 -3.897 12.899 1.00 0.00 C -ATOM 2854 HD11 ILE 181 10.976 -4.038 11.818 1.00 0.00 H -ATOM 2855 HD12 ILE 181 11.525 -3.009 13.224 1.00 0.00 H -ATOM 2856 HD13 ILE 181 11.404 -4.817 13.299 1.00 0.00 H -ATOM 2857 C ILE 181 9.599 -3.901 17.366 1.00 0.00 C -ATOM 2858 O ILE 181 8.588 -4.485 17.629 1.00 0.00 O -ATOM 2859 N LYS 182 10.226 -3.092 18.248 1.00 0.00 N -ATOM 2860 H LYS 182 11.036 -2.571 17.945 1.00 0.00 H -ATOM 2861 CA LYS 182 9.825 -2.953 19.662 1.00 0.00 C -ATOM 2862 HA LYS 182 8.955 -3.569 19.887 1.00 0.00 H -ATOM 2863 CB LYS 182 10.964 -3.319 20.664 1.00 0.00 C -ATOM 2864 HB2 LYS 182 11.408 -4.202 20.206 1.00 0.00 H -ATOM 2865 HB3 LYS 182 11.764 -2.587 20.555 1.00 0.00 H -ATOM 2866 CG LYS 182 10.572 -3.308 22.161 1.00 0.00 C -ATOM 2867 HG2 LYS 182 10.209 -2.340 22.502 1.00 0.00 H -ATOM 2868 HG3 LYS 182 9.743 -3.963 22.429 1.00 0.00 H -ATOM 2869 CD LYS 182 11.662 -3.861 23.128 1.00 0.00 C -ATOM 2870 HD2 LYS 182 12.235 -4.629 22.609 1.00 0.00 H -ATOM 2871 HD3 LYS 182 12.492 -3.155 23.168 1.00 0.00 H -ATOM 2872 CE LYS 182 11.261 -4.354 24.490 1.00 0.00 C -ATOM 2873 HE2 LYS 182 10.805 -5.343 24.546 1.00 0.00 H -ATOM 2874 HE3 LYS 182 12.118 -4.249 25.156 1.00 0.00 H -ATOM 2875 NZ LYS 182 10.317 -3.413 25.101 1.00 0.00 N -ATOM 2876 HZ1 LYS 182 10.619 -2.458 25.231 1.00 0.00 H -ATOM 2877 HZ2 LYS 182 9.414 -3.341 24.655 1.00 0.00 H -ATOM 2878 HZ3 LYS 182 10.014 -3.845 25.962 1.00 0.00 H -ATOM 2879 C LYS 182 9.385 -1.530 19.812 1.00 0.00 C -ATOM 2880 O LYS 182 9.923 -0.533 19.329 1.00 0.00 O -ATOM 2881 N GLY 183 8.267 -1.343 20.511 1.00 0.00 N -ATOM 2882 H GLY 183 7.853 -2.212 20.817 1.00 0.00 H -ATOM 2883 CA GLY 183 7.530 -0.045 20.652 1.00 0.00 C -ATOM 2884 HA2 GLY 183 7.086 0.021 21.645 1.00 0.00 H -ATOM 2885 HA3 GLY 183 8.255 0.764 20.569 1.00 0.00 H -ATOM 2886 C GLY 183 6.414 0.100 19.614 1.00 0.00 C -ATOM 2887 O GLY 183 6.178 1.234 19.212 1.00 0.00 O -ATOM 2888 N LEU 184 5.985 -1.025 19.111 1.00 0.00 N -ATOM 2889 H LEU 184 6.498 -1.807 19.492 1.00 0.00 H -ATOM 2890 CA LEU 184 5.042 -1.279 18.021 1.00 0.00 C -ATOM 2891 HA LEU 184 4.600 -0.298 17.847 1.00 0.00 H -ATOM 2892 CB LEU 184 5.853 -1.623 16.731 1.00 0.00 C -ATOM 2893 HB2 LEU 184 6.658 -0.919 16.522 1.00 0.00 H -ATOM 2894 HB3 LEU 184 6.392 -2.569 16.762 1.00 0.00 H -ATOM 2895 CG LEU 184 4.989 -1.555 15.423 1.00 0.00 C -ATOM 2896 HG LEU 184 4.062 -2.127 15.447 1.00 0.00 H -ATOM 2897 CD1 LEU 184 4.452 -0.173 15.186 1.00 0.00 C -ATOM 2898 HD11 LEU 184 3.921 -0.140 14.234 1.00 0.00 H -ATOM 2899 HD12 LEU 184 3.677 0.036 15.921 1.00 0.00 H -ATOM 2900 HD13 LEU 184 5.328 0.474 15.220 1.00 0.00 H -ATOM 2901 CD2 LEU 184 5.635 -1.962 14.065 1.00 0.00 C -ATOM 2902 HD21 LEU 184 4.935 -1.782 13.249 1.00 0.00 H -ATOM 2903 HD22 LEU 184 6.521 -1.344 13.919 1.00 0.00 H -ATOM 2904 HD23 LEU 184 5.897 -3.018 14.018 1.00 0.00 H -ATOM 2905 C LEU 184 3.972 -2.268 18.440 1.00 0.00 C -ATOM 2906 O LEU 184 3.612 -3.116 17.680 1.00 0.00 O -ATOM 2907 N GLU 185 3.371 -2.227 19.646 1.00 0.00 N -ATOM 2908 H GLU 185 3.668 -1.544 20.329 1.00 0.00 H -ATOM 2909 CA GLU 185 2.394 -3.145 20.142 1.00 0.00 C -ATOM 2910 HA GLU 185 2.623 -4.129 19.735 1.00 0.00 H -ATOM 2911 CB GLU 185 2.457 -3.228 21.706 1.00 0.00 C -ATOM 2912 HB2 GLU 185 3.347 -3.769 22.026 1.00 0.00 H -ATOM 2913 HB3 GLU 185 2.603 -2.189 22.001 1.00 0.00 H -ATOM 2914 CG GLU 185 1.186 -3.695 22.455 1.00 0.00 C -ATOM 2915 HG2 GLU 185 1.540 -3.638 23.484 1.00 0.00 H -ATOM 2916 HG3 GLU 185 0.327 -3.040 22.309 1.00 0.00 H -ATOM 2917 CD GLU 185 0.841 -5.155 22.203 1.00 0.00 C -ATOM 2918 OE1 GLU 185 -0.030 -5.685 22.900 1.00 0.00 O -ATOM 2919 OE2 GLU 185 1.157 -5.799 21.154 1.00 0.00 O -ATOM 2920 C GLU 185 1.005 -2.735 19.581 1.00 0.00 C -ATOM 2921 O GLU 185 0.661 -1.537 19.567 1.00 0.00 O -ATOM 2922 N GLU 186 0.116 -3.680 19.227 1.00 0.00 N -ATOM 2923 H GLU 186 0.358 -4.651 19.368 1.00 0.00 H -ATOM 2924 CA GLU 186 -1.188 -3.282 18.624 1.00 0.00 C -ATOM 2925 HA GLU 186 -1.032 -2.647 17.751 1.00 0.00 H -ATOM 2926 CB GLU 186 -2.024 -4.431 18.004 1.00 0.00 C -ATOM 2927 HB2 GLU 186 -2.305 -5.150 18.774 1.00 0.00 H -ATOM 2928 HB3 GLU 186 -2.977 -4.047 17.639 1.00 0.00 H -ATOM 2929 CG GLU 186 -1.342 -5.113 16.764 1.00 0.00 C -ATOM 2930 HG2 GLU 186 -2.155 -5.450 16.121 1.00 0.00 H -ATOM 2931 HG3 GLU 186 -0.743 -4.426 16.168 1.00 0.00 H -ATOM 2932 CD GLU 186 -0.450 -6.354 17.153 1.00 0.00 C -ATOM 2933 OE1 GLU 186 -0.973 -7.297 17.835 1.00 0.00 O -ATOM 2934 OE2 GLU 186 0.742 -6.316 16.764 1.00 0.00 O -ATOM 2935 C GLU 186 -2.077 -2.535 19.669 1.00 0.00 C -ATOM 2936 O GLU 186 -1.989 -2.775 20.873 1.00 0.00 O -ATOM 2937 N ILE 187 -3.007 -1.785 19.137 1.00 0.00 N -ATOM 2938 H ILE 187 -2.976 -1.612 18.142 1.00 0.00 H -ATOM 2939 CA ILE 187 -4.057 -1.179 19.850 1.00 0.00 C -ATOM 2940 HA ILE 187 -3.940 -1.272 20.930 1.00 0.00 H -ATOM 2941 CB ILE 187 -4.009 0.379 19.438 1.00 0.00 C -ATOM 2942 HB ILE 187 -4.168 0.423 18.361 1.00 0.00 H -ATOM 2943 CG2 ILE 187 -5.172 1.079 20.105 1.00 0.00 C -ATOM 2944 HG21 ILE 187 -5.014 2.149 20.243 1.00 0.00 H -ATOM 2945 HG22 ILE 187 -6.128 0.972 19.594 1.00 0.00 H -ATOM 2946 HG23 ILE 187 -5.236 0.745 21.140 1.00 0.00 H -ATOM 2947 CG1 ILE 187 -2.834 1.097 19.936 1.00 0.00 C -ATOM 2948 HG12 ILE 187 -2.840 1.229 21.018 1.00 0.00 H -ATOM 2949 HG13 ILE 187 -1.931 0.518 19.740 1.00 0.00 H -ATOM 2950 CD1 ILE 187 -2.554 2.427 19.247 1.00 0.00 C -ATOM 2951 HD11 ILE 187 -3.206 3.190 19.674 1.00 0.00 H -ATOM 2952 HD12 ILE 187 -1.518 2.755 19.325 1.00 0.00 H -ATOM 2953 HD13 ILE 187 -2.688 2.331 18.170 1.00 0.00 H -ATOM 2954 C ILE 187 -5.414 -1.797 19.525 1.00 0.00 C -ATOM 2955 O ILE 187 -5.867 -1.886 18.384 1.00 0.00 O -ATOM 2956 N THR 188 -6.185 -2.132 20.544 1.00 0.00 N -ATOM 2957 H THR 188 -5.957 -1.896 21.499 1.00 0.00 H -ATOM 2958 CA THR 188 -7.536 -2.661 20.297 1.00 0.00 C -ATOM 2959 HA THR 188 -7.654 -3.231 19.376 1.00 0.00 H -ATOM 2960 CB THR 188 -8.011 -3.355 21.542 1.00 0.00 C -ATOM 2961 HB THR 188 -8.066 -2.583 22.310 1.00 0.00 H -ATOM 2962 CG2 THR 188 -9.354 -4.103 21.415 1.00 0.00 C -ATOM 2963 HG21 THR 188 -9.338 -4.711 20.510 1.00 0.00 H -ATOM 2964 HG22 THR 188 -9.576 -4.600 22.359 1.00 0.00 H -ATOM 2965 HG23 THR 188 -10.189 -3.411 21.297 1.00 0.00 H -ATOM 2966 OG1 THR 188 -7.063 -4.340 21.904 1.00 0.00 O -ATOM 2967 HG1 THR 188 -6.455 -3.927 22.523 1.00 0.00 H -ATOM 2968 C THR 188 -8.427 -1.512 20.044 1.00 0.00 C -ATOM 2969 O THR 188 -8.361 -0.521 20.706 1.00 0.00 O -ATOM 2970 N VAL 189 -9.388 -1.670 19.086 1.00 0.00 N -ATOM 2971 H VAL 189 -9.416 -2.572 18.633 1.00 0.00 H -ATOM 2972 CA VAL 189 -10.478 -0.736 18.861 1.00 0.00 C -ATOM 2973 HA VAL 189 -10.131 0.278 19.056 1.00 0.00 H -ATOM 2974 CB VAL 189 -10.974 -0.962 17.368 1.00 0.00 C -ATOM 2975 HB VAL 189 -11.419 -1.923 17.111 1.00 0.00 H -ATOM 2976 CG1 VAL 189 -12.183 -0.132 17.023 1.00 0.00 C -ATOM 2977 HG11 VAL 189 -12.365 -0.215 15.952 1.00 0.00 H -ATOM 2978 HG12 VAL 189 -13.041 -0.504 17.583 1.00 0.00 H -ATOM 2979 HG13 VAL 189 -11.973 0.901 17.303 1.00 0.00 H -ATOM 2980 CG2 VAL 189 -9.884 -0.782 16.392 1.00 0.00 C -ATOM 2981 HG21 VAL 189 -10.189 -1.101 15.395 1.00 0.00 H -ATOM 2982 HG22 VAL 189 -9.567 0.260 16.365 1.00 0.00 H -ATOM 2983 HG23 VAL 189 -9.036 -1.435 16.595 1.00 0.00 H -ATOM 2984 C VAL 189 -11.647 -0.945 19.808 1.00 0.00 C -ATOM 2985 O VAL 189 -12.424 -1.845 19.626 1.00 0.00 O -ATOM 2986 N HIE 190 -11.609 -0.055 20.855 1.00 0.00 N -ATOM 2987 H HIE 190 -10.858 0.618 20.904 1.00 0.00 H -ATOM 2988 CA HIE 190 -12.711 0.174 21.815 1.00 0.00 C -ATOM 2989 HA HIE 190 -13.336 -0.706 21.969 1.00 0.00 H -ATOM 2990 CB HIE 190 -12.042 0.467 23.213 1.00 0.00 C -ATOM 2991 HB2 HIE 190 -11.603 1.463 23.155 1.00 0.00 H -ATOM 2992 HB3 HIE 190 -12.827 0.631 23.950 1.00 0.00 H -ATOM 2993 CG HIE 190 -11.173 -0.541 23.901 1.00 0.00 C -ATOM 2994 ND1 HIE 190 -10.375 -0.213 24.992 1.00 0.00 N -ATOM 2995 CE1 HIE 190 -9.795 -1.326 25.431 1.00 0.00 C -ATOM 2996 HE1 HIE 190 -9.196 -1.450 26.322 1.00 0.00 H -ATOM 2997 NE2 HIE 190 -10.127 -2.387 24.621 1.00 0.00 N -ATOM 2998 HE2 HIE 190 -9.794 -3.340 24.639 1.00 0.00 H -ATOM 2999 CD2 HIE 190 -10.986 -1.875 23.599 1.00 0.00 C -ATOM 3000 HD2 HIE 190 -11.411 -2.349 22.727 1.00 0.00 H -ATOM 3001 C HIE 190 -13.739 1.268 21.402 1.00 0.00 C -ATOM 3002 O HIE 190 -14.843 1.363 21.966 1.00 0.00 O -ATOM 3003 N ASN 191 -13.392 2.035 20.439 1.00 0.00 N -ATOM 3004 H ASN 191 -12.589 1.745 19.901 1.00 0.00 H -ATOM 3005 CA ASN 191 -14.129 3.157 19.932 1.00 0.00 C -ATOM 3006 HA ASN 191 -15.161 2.897 19.697 1.00 0.00 H -ATOM 3007 CB ASN 191 -14.183 4.300 20.984 1.00 0.00 C -ATOM 3008 HB2 ASN 191 -14.791 3.964 21.823 1.00 0.00 H -ATOM 3009 HB3 ASN 191 -13.184 4.585 21.315 1.00 0.00 H -ATOM 3010 CG ASN 191 -14.714 5.573 20.408 1.00 0.00 C -ATOM 3011 OD1 ASN 191 -14.059 6.429 19.851 1.00 0.00 O -ATOM 3012 ND2 ASN 191 -16.002 5.816 20.485 1.00 0.00 N -ATOM 3013 HD21 ASN 191 -16.333 6.640 20.004 1.00 0.00 H -ATOM 3014 HD22 ASN 191 -16.552 5.031 20.802 1.00 0.00 H -ATOM 3015 C ASN 191 -13.470 3.585 18.616 1.00 0.00 C -ATOM 3016 O ASN 191 -12.289 3.976 18.539 1.00 0.00 O -ATOM 3017 N LYS 192 -14.312 3.674 17.505 1.00 0.00 N -ATOM 3018 H LYS 192 -15.238 3.296 17.650 1.00 0.00 H -ATOM 3019 CA LYS 192 -13.854 4.210 16.176 1.00 0.00 C -ATOM 3020 HA LYS 192 -12.970 3.677 15.826 1.00 0.00 H -ATOM 3021 CB LYS 192 -14.971 4.070 15.104 1.00 0.00 C -ATOM 3022 HB2 LYS 192 -15.862 4.503 15.560 1.00 0.00 H -ATOM 3023 HB3 LYS 192 -14.707 4.719 14.269 1.00 0.00 H -ATOM 3024 CG LYS 192 -15.105 2.644 14.631 1.00 0.00 C -ATOM 3025 HG2 LYS 192 -14.152 2.292 14.238 1.00 0.00 H -ATOM 3026 HG3 LYS 192 -15.544 2.078 15.452 1.00 0.00 H -ATOM 3027 CD LYS 192 -16.091 2.533 13.503 1.00 0.00 C -ATOM 3028 HD2 LYS 192 -15.760 3.048 12.602 1.00 0.00 H -ATOM 3029 HD3 LYS 192 -16.048 1.474 13.250 1.00 0.00 H -ATOM 3030 CE LYS 192 -17.483 2.996 13.924 1.00 0.00 C -ATOM 3031 HE2 LYS 192 -17.617 2.460 14.864 1.00 0.00 H -ATOM 3032 HE3 LYS 192 -17.622 4.011 14.296 1.00 0.00 H -ATOM 3033 NZ LYS 192 -18.487 2.589 12.950 1.00 0.00 N -ATOM 3034 HZ1 LYS 192 -18.334 3.002 12.042 1.00 0.00 H -ATOM 3035 HZ2 LYS 192 -18.656 1.606 12.794 1.00 0.00 H -ATOM 3036 HZ3 LYS 192 -19.325 3.090 13.212 1.00 0.00 H -ATOM 3037 C LYS 192 -13.309 5.569 16.218 1.00 0.00 C -ATOM 3038 O LYS 192 -12.178 5.775 15.743 1.00 0.00 O -ATOM 3039 N ASP 193 -14.016 6.573 16.703 1.00 0.00 N -ATOM 3040 H ASP 193 -14.938 6.265 16.978 1.00 0.00 H -ATOM 3041 CA ASP 193 -13.602 7.974 16.862 1.00 0.00 C -ATOM 3042 HA ASP 193 -13.594 8.346 15.837 1.00 0.00 H -ATOM 3043 CB ASP 193 -14.684 8.848 17.609 1.00 0.00 C -ATOM 3044 HB2 ASP 193 -14.741 8.620 18.673 1.00 0.00 H -ATOM 3045 HB3 ASP 193 -14.246 9.845 17.571 1.00 0.00 H -ATOM 3046 CG ASP 193 -16.082 8.868 16.972 1.00 0.00 C -ATOM 3047 OD1 ASP 193 -16.724 9.927 16.815 1.00 0.00 O -ATOM 3048 OD2 ASP 193 -16.653 7.782 16.822 1.00 0.00 O -ATOM 3049 C ASP 193 -12.219 8.216 17.442 1.00 0.00 C -ATOM 3050 O ASP 193 -11.515 9.109 16.981 1.00 0.00 O -ATOM 3051 N GLU 194 -11.778 7.405 18.436 1.00 0.00 N -ATOM 3052 H GLU 194 -12.427 6.715 18.787 1.00 0.00 H -ATOM 3053 CA GLU 194 -10.497 7.649 19.170 1.00 0.00 C -ATOM 3054 HA GLU 194 -10.203 8.697 19.122 1.00 0.00 H -ATOM 3055 CB GLU 194 -10.757 7.111 20.604 1.00 0.00 C -ATOM 3056 HB2 GLU 194 -11.527 7.747 21.042 1.00 0.00 H -ATOM 3057 HB3 GLU 194 -11.129 6.087 20.602 1.00 0.00 H -ATOM 3058 CG GLU 194 -9.430 7.279 21.380 1.00 0.00 C -ATOM 3059 HG2 GLU 194 -8.795 6.402 21.249 1.00 0.00 H -ATOM 3060 HG3 GLU 194 -8.980 8.207 21.027 1.00 0.00 H -ATOM 3061 CD GLU 194 -9.501 7.392 22.926 1.00 0.00 C -ATOM 3062 OE1 GLU 194 -10.478 6.858 23.514 1.00 0.00 O -ATOM 3063 OE2 GLU 194 -8.713 8.134 23.569 1.00 0.00 O -ATOM 3064 C GLU 194 -9.344 6.855 18.443 1.00 0.00 C -ATOM 3065 O GLU 194 -8.198 7.229 18.569 1.00 0.00 O -ATOM 3066 N VAL 195 -9.666 5.877 17.535 1.00 0.00 N -ATOM 3067 H VAL 195 -10.652 5.740 17.359 1.00 0.00 H -ATOM 3068 CA VAL 195 -8.670 5.413 16.577 1.00 0.00 C -ATOM 3069 HA VAL 195 -7.746 5.173 17.104 1.00 0.00 H -ATOM 3070 CB VAL 195 -9.099 4.011 16.060 1.00 0.00 C -ATOM 3071 HB VAL 195 -10.148 4.013 15.764 1.00 0.00 H -ATOM 3072 CG1 VAL 195 -8.178 3.368 15.005 1.00 0.00 C -ATOM 3073 HG11 VAL 195 -8.206 2.278 15.007 1.00 0.00 H -ATOM 3074 HG12 VAL 195 -8.469 3.803 14.048 1.00 0.00 H -ATOM 3075 HG13 VAL 195 -7.159 3.724 15.154 1.00 0.00 H -ATOM 3076 CG2 VAL 195 -9.054 3.070 17.285 1.00 0.00 C -ATOM 3077 HG21 VAL 195 -8.052 2.679 17.463 1.00 0.00 H -ATOM 3078 HG22 VAL 195 -9.404 3.483 18.231 1.00 0.00 H -ATOM 3079 HG23 VAL 195 -9.717 2.226 17.095 1.00 0.00 H -ATOM 3080 C VAL 195 -8.601 6.405 15.417 1.00 0.00 C -ATOM 3081 O VAL 195 -7.497 6.758 15.047 1.00 0.00 O -ATOM 3082 N TYR 196 -9.724 7.041 15.041 1.00 0.00 N -ATOM 3083 H TYR 196 -10.615 6.671 15.337 1.00 0.00 H -ATOM 3084 CA TYR 196 -9.669 8.341 14.357 1.00 0.00 C -ATOM 3085 HA TYR 196 -8.966 8.041 13.580 1.00 0.00 H -ATOM 3086 CB TYR 196 -10.955 8.683 13.694 1.00 0.00 C -ATOM 3087 HB2 TYR 196 -11.672 8.840 14.499 1.00 0.00 H -ATOM 3088 HB3 TYR 196 -10.834 9.651 13.207 1.00 0.00 H -ATOM 3089 CG TYR 196 -11.435 7.646 12.628 1.00 0.00 C -ATOM 3090 CD1 TYR 196 -12.605 6.939 12.830 1.00 0.00 C -ATOM 3091 HD1 TYR 196 -13.260 7.127 13.668 1.00 0.00 H -ATOM 3092 CE1 TYR 196 -12.879 5.766 12.023 1.00 0.00 C -ATOM 3093 HE1 TYR 196 -13.740 5.145 12.223 1.00 0.00 H -ATOM 3094 CZ TYR 196 -12.153 5.707 10.793 1.00 0.00 C -ATOM 3095 OH TYR 196 -12.667 4.809 9.893 1.00 0.00 O -ATOM 3096 HH TYR 196 -13.622 4.898 9.934 1.00 0.00 H -ATOM 3097 CE2 TYR 196 -10.962 6.466 10.562 1.00 0.00 C -ATOM 3098 HE2 TYR 196 -10.404 6.251 9.663 1.00 0.00 H -ATOM 3099 CD2 TYR 196 -10.584 7.405 11.514 1.00 0.00 C -ATOM 3100 HD2 TYR 196 -9.760 8.081 11.339 1.00 0.00 H -ATOM 3101 C TYR 196 -8.935 9.475 15.119 1.00 0.00 C -ATOM 3102 O TYR 196 -8.443 10.363 14.445 1.00 0.00 O -ATOM 3103 N GLN 197 -8.785 9.555 16.464 1.00 0.00 N -ATOM 3104 H GLN 197 -9.457 9.022 16.998 1.00 0.00 H -ATOM 3105 CA GLN 197 -7.806 10.479 17.127 1.00 0.00 C -ATOM 3106 HA GLN 197 -7.848 11.421 16.581 1.00 0.00 H -ATOM 3107 CB GLN 197 -8.332 10.796 18.512 1.00 0.00 C -ATOM 3108 HB2 GLN 197 -8.334 9.973 19.227 1.00 0.00 H -ATOM 3109 HB3 GLN 197 -7.613 11.489 18.950 1.00 0.00 H -ATOM 3110 CG GLN 197 -9.657 11.551 18.480 1.00 0.00 C -ATOM 3111 HG2 GLN 197 -10.507 10.931 18.194 1.00 0.00 H -ATOM 3112 HG3 GLN 197 -9.975 11.780 19.497 1.00 0.00 H -ATOM 3113 CD GLN 197 -9.672 12.872 17.705 1.00 0.00 C -ATOM 3114 OE1 GLN 197 -10.435 13.019 16.773 1.00 0.00 O -ATOM 3115 NE2 GLN 197 -8.818 13.813 18.063 1.00 0.00 N -ATOM 3116 HE21 GLN 197 -8.910 14.677 17.549 1.00 0.00 H -ATOM 3117 HE22 GLN 197 -8.148 13.744 18.816 1.00 0.00 H -ATOM 3118 C GLN 197 -6.373 9.992 17.049 1.00 0.00 C -ATOM 3119 O GLN 197 -5.460 10.819 16.866 1.00 0.00 O -ATOM 3120 N ILE 198 -6.115 8.713 17.106 1.00 0.00 N -ATOM 3121 H ILE 198 -6.879 8.083 17.302 1.00 0.00 H -ATOM 3122 CA ILE 198 -4.704 8.211 16.870 1.00 0.00 C -ATOM 3123 HA ILE 198 -3.967 8.698 17.509 1.00 0.00 H -ATOM 3124 CB ILE 198 -4.630 6.770 17.356 1.00 0.00 C -ATOM 3125 HB ILE 198 -5.337 6.166 16.787 1.00 0.00 H -ATOM 3126 CG2 ILE 198 -3.268 6.098 17.150 1.00 0.00 C -ATOM 3127 HG21 ILE 198 -2.481 6.558 17.747 1.00 0.00 H -ATOM 3128 HG22 ILE 198 -3.236 5.040 17.411 1.00 0.00 H -ATOM 3129 HG23 ILE 198 -2.953 6.160 16.107 1.00 0.00 H -ATOM 3130 CG1 ILE 198 -4.935 6.605 18.874 1.00 0.00 C -ATOM 3131 HG12 ILE 198 -4.049 6.711 19.499 1.00 0.00 H -ATOM 3132 HG13 ILE 198 -5.684 7.346 19.151 1.00 0.00 H -ATOM 3133 CD1 ILE 198 -5.516 5.268 19.255 1.00 0.00 C -ATOM 3134 HD11 ILE 198 -6.581 5.058 19.139 1.00 0.00 H -ATOM 3135 HD12 ILE 198 -4.913 4.434 18.893 1.00 0.00 H -ATOM 3136 HD13 ILE 198 -5.363 5.087 20.318 1.00 0.00 H -ATOM 3137 C ILE 198 -4.185 8.450 15.453 1.00 0.00 C -ATOM 3138 O ILE 198 -3.028 8.919 15.258 1.00 0.00 O -ATOM 3139 N LEU 199 -5.018 8.267 14.470 1.00 0.00 N -ATOM 3140 H LEU 199 -5.940 7.923 14.700 1.00 0.00 H -ATOM 3141 CA LEU 199 -4.701 8.630 13.078 1.00 0.00 C -ATOM 3142 HA LEU 199 -3.678 8.285 12.921 1.00 0.00 H -ATOM 3143 CB LEU 199 -5.663 7.843 12.214 1.00 0.00 C -ATOM 3144 HB2 LEU 199 -6.694 7.849 12.568 1.00 0.00 H -ATOM 3145 HB3 LEU 199 -5.688 8.419 11.289 1.00 0.00 H -ATOM 3146 CG LEU 199 -5.443 6.338 12.203 1.00 0.00 C -ATOM 3147 HG LEU 199 -5.693 5.898 13.168 1.00 0.00 H -ATOM 3148 CD1 LEU 199 -6.334 5.749 11.164 1.00 0.00 C -ATOM 3149 HD11 LEU 199 -6.263 4.676 11.343 1.00 0.00 H -ATOM 3150 HD12 LEU 199 -7.359 5.972 11.464 1.00 0.00 H -ATOM 3151 HD13 LEU 199 -6.017 6.022 10.158 1.00 0.00 H -ATOM 3152 CD2 LEU 199 -3.989 5.946 11.748 1.00 0.00 C -ATOM 3153 HD21 LEU 199 -3.745 6.475 10.828 1.00 0.00 H -ATOM 3154 HD22 LEU 199 -3.235 6.256 12.472 1.00 0.00 H -ATOM 3155 HD23 LEU 199 -4.027 4.860 11.666 1.00 0.00 H -ATOM 3156 C LEU 199 -4.707 10.178 12.810 1.00 0.00 C -ATOM 3157 O LEU 199 -4.089 10.607 11.842 1.00 0.00 O -ATOM 3158 N GLU 200 -5.300 11.055 13.642 1.00 0.00 N -ATOM 3159 H GLU 200 -5.831 10.588 14.364 1.00 0.00 H -ATOM 3160 CA GLU 200 -5.245 12.487 13.504 1.00 0.00 C -ATOM 3161 HA GLU 200 -5.255 12.774 12.452 1.00 0.00 H -ATOM 3162 CB GLU 200 -6.393 13.157 14.333 1.00 0.00 C -ATOM 3163 HB2 GLU 200 -7.337 12.693 14.045 1.00 0.00 H -ATOM 3164 HB3 GLU 200 -6.333 12.925 15.396 1.00 0.00 H -ATOM 3165 CG GLU 200 -6.695 14.632 14.166 1.00 0.00 C -ATOM 3166 HG2 GLU 200 -7.623 14.895 14.672 1.00 0.00 H -ATOM 3167 HG3 GLU 200 -5.883 15.148 14.678 1.00 0.00 H -ATOM 3168 CD GLU 200 -6.878 15.164 12.743 1.00 0.00 C -ATOM 3169 OE1 GLU 200 -6.407 16.302 12.424 1.00 0.00 O -ATOM 3170 OE2 GLU 200 -7.502 14.507 11.891 1.00 0.00 O -ATOM 3171 C GLU 200 -3.835 13.008 14.056 1.00 0.00 C -ATOM 3172 O GLU 200 -3.056 13.688 13.326 1.00 0.00 O -ATOM 3173 N LYS 201 -3.499 12.550 15.249 1.00 0.00 N -ATOM 3174 H LYS 201 -4.205 12.021 15.742 1.00 0.00 H -ATOM 3175 CA LYS 201 -2.277 12.796 15.915 1.00 0.00 C -ATOM 3176 HA LYS 201 -2.117 13.869 16.023 1.00 0.00 H -ATOM 3177 CB LYS 201 -2.329 12.035 17.239 1.00 0.00 C -ATOM 3178 HB2 LYS 201 -2.729 11.037 17.060 1.00 0.00 H -ATOM 3179 HB3 LYS 201 -1.316 12.072 17.639 1.00 0.00 H -ATOM 3180 CG LYS 201 -3.317 12.578 18.292 1.00 0.00 C -ATOM 3181 HG2 LYS 201 -2.964 13.490 18.771 1.00 0.00 H -ATOM 3182 HG3 LYS 201 -4.226 12.925 17.799 1.00 0.00 H -ATOM 3183 CD LYS 201 -3.668 11.526 19.384 1.00 0.00 C -ATOM 3184 HD2 LYS 201 -3.768 10.523 18.972 1.00 0.00 H -ATOM 3185 HD3 LYS 201 -2.859 11.385 20.100 1.00 0.00 H -ATOM 3186 CE LYS 201 -5.014 11.889 20.024 1.00 0.00 C -ATOM 3187 HE2 LYS 201 -5.726 11.927 19.200 1.00 0.00 H -ATOM 3188 HE3 LYS 201 -5.391 11.038 20.591 1.00 0.00 H -ATOM 3189 NZ LYS 201 -4.901 13.096 20.823 1.00 0.00 N -ATOM 3190 HZ1 LYS 201 -5.748 13.213 21.360 1.00 0.00 H -ATOM 3191 HZ2 LYS 201 -4.253 12.978 21.588 1.00 0.00 H -ATOM 3192 HZ3 LYS 201 -4.725 13.904 20.242 1.00 0.00 H -ATOM 3193 C LYS 201 -1.054 12.273 15.061 1.00 0.00 C -ATOM 3194 O LYS 201 -0.083 13.041 14.816 1.00 0.00 O -ATOM 3195 N GLY 202 -1.104 11.013 14.579 1.00 0.00 N -ATOM 3196 H GLY 202 -1.846 10.367 14.809 1.00 0.00 H -ATOM 3197 CA GLY 202 -0.005 10.592 13.698 1.00 0.00 C -ATOM 3198 HA2 GLY 202 0.919 10.484 14.267 1.00 0.00 H -ATOM 3199 HA3 GLY 202 -0.173 9.576 13.342 1.00 0.00 H -ATOM 3200 C GLY 202 0.167 11.486 12.434 1.00 0.00 C -ATOM 3201 O GLY 202 1.276 11.972 12.101 1.00 0.00 O -ATOM 3202 N ALA 203 -0.990 11.796 11.744 1.00 0.00 N -ATOM 3203 H ALA 203 -1.871 11.449 12.093 1.00 0.00 H -ATOM 3204 CA ALA 203 -1.007 12.665 10.613 1.00 0.00 C -ATOM 3205 HA ALA 203 -0.308 12.221 9.905 1.00 0.00 H -ATOM 3206 CB ALA 203 -2.416 12.704 10.123 1.00 0.00 C -ATOM 3207 HB1 ALA 203 -2.487 13.294 9.209 1.00 0.00 H -ATOM 3208 HB2 ALA 203 -2.871 11.736 9.916 1.00 0.00 H -ATOM 3209 HB3 ALA 203 -3.011 13.239 10.863 1.00 0.00 H -ATOM 3210 C ALA 203 -0.455 14.034 10.814 1.00 0.00 C -ATOM 3211 O ALA 203 0.255 14.550 9.994 1.00 0.00 O -ATOM 3212 N ALA 204 -0.790 14.727 11.985 1.00 0.00 N -ATOM 3213 H ALA 204 -1.284 14.156 12.657 1.00 0.00 H -ATOM 3214 CA ALA 204 -0.181 15.960 12.542 1.00 0.00 C -ATOM 3215 HA ALA 204 -0.178 16.754 11.797 1.00 0.00 H -ATOM 3216 CB ALA 204 -1.076 16.517 13.694 1.00 0.00 C -ATOM 3217 HB1 ALA 204 -2.079 16.730 13.321 1.00 0.00 H -ATOM 3218 HB2 ALA 204 -1.166 15.760 14.473 1.00 0.00 H -ATOM 3219 HB3 ALA 204 -0.665 17.478 14.003 1.00 0.00 H -ATOM 3220 C ALA 204 1.372 15.924 12.805 1.00 0.00 C -ATOM 3221 O ALA 204 1.995 16.955 12.604 1.00 0.00 O -ATOM 3222 N LYS 205 1.912 14.780 13.296 1.00 0.00 N -ATOM 3223 H LYS 205 1.318 13.994 13.519 1.00 0.00 H -ATOM 3224 CA LYS 205 3.353 14.546 13.456 1.00 0.00 C -ATOM 3225 HA LYS 205 3.833 15.430 13.873 1.00 0.00 H -ATOM 3226 CB LYS 205 3.520 13.324 14.540 1.00 0.00 C -ATOM 3227 HB2 LYS 205 2.961 13.651 15.418 1.00 0.00 H -ATOM 3228 HB3 LYS 205 3.249 12.359 14.111 1.00 0.00 H -ATOM 3229 CG LYS 205 4.897 13.201 15.093 1.00 0.00 C -ATOM 3230 HG2 LYS 205 5.530 12.947 14.243 1.00 0.00 H -ATOM 3231 HG3 LYS 205 5.196 14.132 15.575 1.00 0.00 H -ATOM 3232 CD LYS 205 4.979 11.966 16.021 1.00 0.00 C -ATOM 3233 HD2 LYS 205 4.388 12.265 16.887 1.00 0.00 H -ATOM 3234 HD3 LYS 205 4.534 11.060 15.612 1.00 0.00 H -ATOM 3235 CE LYS 205 6.397 11.860 16.590 1.00 0.00 C -ATOM 3236 HE2 LYS 205 7.028 12.226 15.781 1.00 0.00 H -ATOM 3237 HE3 LYS 205 6.506 12.497 17.468 1.00 0.00 H -ATOM 3238 NZ LYS 205 6.879 10.510 17.001 1.00 0.00 N -ATOM 3239 HZ1 LYS 205 7.634 10.621 17.663 1.00 0.00 H -ATOM 3240 HZ2 LYS 205 6.225 9.845 17.390 1.00 0.00 H -ATOM 3241 HZ3 LYS 205 7.419 10.100 16.252 1.00 0.00 H -ATOM 3242 C LYS 205 4.124 14.218 12.202 1.00 0.00 C -ATOM 3243 O LYS 205 5.108 14.850 11.893 1.00 0.00 O -ATOM 3244 N ARG 206 3.547 13.445 11.226 1.00 0.00 N -ATOM 3245 H ARG 206 2.706 13.002 11.568 1.00 0.00 H -ATOM 3246 CA ARG 206 4.030 13.277 9.883 1.00 0.00 C -ATOM 3247 HA ARG 206 5.090 13.032 9.928 1.00 0.00 H -ATOM 3248 CB ARG 206 3.156 12.142 9.295 1.00 0.00 C -ATOM 3249 HB2 ARG 206 3.422 11.181 9.735 1.00 0.00 H -ATOM 3250 HB3 ARG 206 2.112 12.341 9.542 1.00 0.00 H -ATOM 3251 CG ARG 206 3.278 11.874 7.857 1.00 0.00 C -ATOM 3252 HG2 ARG 206 3.268 12.849 7.369 1.00 0.00 H -ATOM 3253 HG3 ARG 206 4.240 11.423 7.614 1.00 0.00 H -ATOM 3254 CD ARG 206 2.250 10.946 7.274 1.00 0.00 C -ATOM 3255 HD2 ARG 206 1.243 11.234 7.576 1.00 0.00 H -ATOM 3256 HD3 ARG 206 2.247 11.059 6.189 1.00 0.00 H -ATOM 3257 NE ARG 206 2.517 9.542 7.622 1.00 0.00 N -ATOM 3258 HE ARG 206 3.382 9.183 7.244 1.00 0.00 H -ATOM 3259 CZ ARG 206 1.586 8.667 8.190 1.00 0.00 C -ATOM 3260 NH1 ARG 206 0.428 9.123 8.472 1.00 0.00 N -ATOM 3261 HH11 ARG 206 0.052 9.916 7.972 1.00 0.00 H -ATOM 3262 HH12 ARG 206 -0.164 8.474 8.972 1.00 0.00 H -ATOM 3263 NH2 ARG 206 1.813 7.439 8.516 1.00 0.00 N -ATOM 3264 HH21 ARG 206 2.713 7.062 8.254 1.00 0.00 H -ATOM 3265 HH22 ARG 206 1.167 6.910 9.084 1.00 0.00 H -ATOM 3266 C ARG 206 3.957 14.580 9.146 1.00 0.00 C -ATOM 3267 O ARG 206 4.820 14.849 8.280 1.00 0.00 O -ATOM 3268 N THR 207 2.962 15.407 9.380 1.00 0.00 N -ATOM 3269 H THR 207 2.252 15.043 9.998 1.00 0.00 H -ATOM 3270 CA THR 207 2.857 16.771 8.813 1.00 0.00 C -ATOM 3271 HA THR 207 2.873 16.682 7.727 1.00 0.00 H -ATOM 3272 CB THR 207 1.547 17.465 9.221 1.00 0.00 C -ATOM 3273 HB THR 207 1.332 17.367 10.285 1.00 0.00 H -ATOM 3274 CG2 THR 207 1.455 18.948 8.685 1.00 0.00 C -ATOM 3275 HG21 THR 207 1.799 19.630 9.462 1.00 0.00 H -ATOM 3276 HG22 THR 207 1.964 19.054 7.727 1.00 0.00 H -ATOM 3277 HG23 THR 207 0.443 19.249 8.418 1.00 0.00 H -ATOM 3278 OG1 THR 207 0.614 16.748 8.452 1.00 0.00 O -ATOM 3279 HG1 THR 207 0.459 15.894 8.862 1.00 0.00 H -ATOM 3280 C THR 207 4.026 17.641 9.267 1.00 0.00 C -ATOM 3281 O THR 207 4.595 18.430 8.490 1.00 0.00 O -ATOM 3282 N THR 208 4.280 17.524 10.623 1.00 0.00 N -ATOM 3283 H THR 208 3.594 17.084 11.219 1.00 0.00 H -ATOM 3284 CA THR 208 5.426 18.204 11.176 1.00 0.00 C -ATOM 3285 HA THR 208 5.302 19.267 10.965 1.00 0.00 H -ATOM 3286 CB THR 208 5.520 18.135 12.731 1.00 0.00 C -ATOM 3287 HB THR 208 5.590 17.063 12.914 1.00 0.00 H -ATOM 3288 CG2 THR 208 6.701 18.958 13.313 1.00 0.00 C -ATOM 3289 HG21 THR 208 6.688 18.945 14.403 1.00 0.00 H -ATOM 3290 HG22 THR 208 7.659 18.535 13.012 1.00 0.00 H -ATOM 3291 HG23 THR 208 6.579 19.993 12.991 1.00 0.00 H -ATOM 3292 OG1 THR 208 4.355 18.635 13.252 1.00 0.00 O -ATOM 3293 HG1 THR 208 3.927 17.948 13.768 1.00 0.00 H -ATOM 3294 C THR 208 6.748 17.774 10.511 1.00 0.00 C -ATOM 3295 O THR 208 7.488 18.598 9.992 1.00 0.00 O -ATOM 3296 N ALA 209 6.938 16.469 10.404 1.00 0.00 N -ATOM 3297 H ALA 209 6.354 15.755 10.814 1.00 0.00 H -ATOM 3298 CA ALA 209 8.086 15.987 9.692 1.00 0.00 C -ATOM 3299 HA ALA 209 9.000 16.246 10.228 1.00 0.00 H -ATOM 3300 CB ALA 209 8.062 14.463 9.775 1.00 0.00 C -ATOM 3301 HB1 ALA 209 9.058 14.021 9.829 1.00 0.00 H -ATOM 3302 HB2 ALA 209 7.509 14.180 10.670 1.00 0.00 H -ATOM 3303 HB3 ALA 209 7.523 14.174 8.873 1.00 0.00 H -ATOM 3304 C ALA 209 8.203 16.432 8.213 1.00 0.00 C -ATOM 3305 O ALA 209 9.293 16.861 7.820 1.00 0.00 O -ATOM 3306 N ALA 210 7.120 16.433 7.438 1.00 0.00 N -ATOM 3307 H ALA 210 6.228 16.202 7.850 1.00 0.00 H -ATOM 3308 CA ALA 210 7.140 16.968 6.057 1.00 0.00 C -ATOM 3309 HA ALA 210 7.995 16.599 5.489 1.00 0.00 H -ATOM 3310 CB ALA 210 5.863 16.401 5.430 1.00 0.00 C -ATOM 3311 HB1 ALA 210 4.995 16.909 5.852 1.00 0.00 H -ATOM 3312 HB2 ALA 210 5.758 16.555 4.357 1.00 0.00 H -ATOM 3313 HB3 ALA 210 5.796 15.350 5.707 1.00 0.00 H -ATOM 3314 C ALA 210 7.311 18.481 6.013 1.00 0.00 C -ATOM 3315 O ALA 210 7.895 19.076 5.074 1.00 0.00 O -ATOM 3316 N THR 211 6.980 19.221 7.042 1.00 0.00 N -ATOM 3317 H THR 211 6.487 18.777 7.803 1.00 0.00 H -ATOM 3318 CA THR 211 7.271 20.639 7.155 1.00 0.00 C -ATOM 3319 HA THR 211 7.150 21.090 6.169 1.00 0.00 H -ATOM 3320 CB THR 211 6.314 21.300 8.143 1.00 0.00 C -ATOM 3321 HB THR 211 6.503 20.861 9.123 1.00 0.00 H -ATOM 3322 CG2 THR 211 6.473 22.769 8.291 1.00 0.00 C -ATOM 3323 HG21 THR 211 5.981 23.278 7.463 1.00 0.00 H -ATOM 3324 HG22 THR 211 5.871 23.099 9.138 1.00 0.00 H -ATOM 3325 HG23 THR 211 7.504 23.108 8.389 1.00 0.00 H -ATOM 3326 OG1 THR 211 4.953 20.962 7.818 1.00 0.00 O -ATOM 3327 HG1 THR 211 4.732 20.082 8.131 1.00 0.00 H -ATOM 3328 C THR 211 8.669 20.895 7.565 1.00 0.00 C -ATOM 3329 O THR 211 9.402 21.752 7.061 1.00 0.00 O -ATOM 3330 N LEU 212 9.154 20.006 8.468 1.00 0.00 N -ATOM 3331 H LEU 212 8.555 19.279 8.833 1.00 0.00 H -ATOM 3332 CA LEU 212 10.582 19.973 8.764 1.00 0.00 C -ATOM 3333 HA LEU 212 10.800 20.994 9.077 1.00 0.00 H -ATOM 3334 CB LEU 212 10.796 19.104 10.047 1.00 0.00 C -ATOM 3335 HB2 LEU 212 10.019 19.347 10.772 1.00 0.00 H -ATOM 3336 HB3 LEU 212 10.550 18.082 9.760 1.00 0.00 H -ATOM 3337 CG LEU 212 12.144 19.246 10.757 1.00 0.00 C -ATOM 3338 HG LEU 212 12.974 19.093 10.068 1.00 0.00 H -ATOM 3339 CD1 LEU 212 12.308 20.609 11.475 1.00 0.00 C -ATOM 3340 HD11 LEU 212 12.957 20.612 12.351 1.00 0.00 H -ATOM 3341 HD12 LEU 212 12.584 21.314 10.691 1.00 0.00 H -ATOM 3342 HD13 LEU 212 11.397 20.975 11.949 1.00 0.00 H -ATOM 3343 CD2 LEU 212 12.346 18.110 11.682 1.00 0.00 C -ATOM 3344 HD21 LEU 212 13.386 18.093 12.013 1.00 0.00 H -ATOM 3345 HD22 LEU 212 11.705 18.263 12.550 1.00 0.00 H -ATOM 3346 HD23 LEU 212 12.112 17.109 11.323 1.00 0.00 H -ATOM 3347 C LEU 212 11.561 19.488 7.574 1.00 0.00 C -ATOM 3348 O LEU 212 12.665 20.001 7.439 1.00 0.00 O -ATOM 3349 N MET 213 11.136 18.603 6.645 1.00 0.00 N -ATOM 3350 H MET 213 10.260 18.109 6.739 1.00 0.00 H -ATOM 3351 CA MET 213 12.077 18.008 5.622 1.00 0.00 C -ATOM 3352 HA MET 213 13.025 18.539 5.532 1.00 0.00 H -ATOM 3353 CB MET 213 12.409 16.585 6.141 1.00 0.00 C -ATOM 3354 HB2 MET 213 11.439 16.114 6.303 1.00 0.00 H -ATOM 3355 HB3 MET 213 12.966 15.929 5.472 1.00 0.00 H -ATOM 3356 CG MET 213 13.113 16.720 7.515 1.00 0.00 C -ATOM 3357 HG2 MET 213 13.839 17.524 7.395 1.00 0.00 H -ATOM 3358 HG3 MET 213 12.417 17.082 8.271 1.00 0.00 H -ATOM 3359 SD MET 213 13.928 15.206 7.975 1.00 0.00 S -ATOM 3360 CE MET 213 12.458 14.228 8.315 1.00 0.00 C -ATOM 3361 HE1 MET 213 12.837 13.254 8.625 1.00 0.00 H -ATOM 3362 HE2 MET 213 11.852 14.683 9.097 1.00 0.00 H -ATOM 3363 HE3 MET 213 11.870 14.121 7.403 1.00 0.00 H -ATOM 3364 C MET 213 11.493 17.959 4.248 1.00 0.00 C -ATOM 3365 O MET 213 10.527 17.259 4.080 1.00 0.00 O -ATOM 3366 N ASN 214 12.001 18.799 3.317 1.00 0.00 N -ATOM 3367 H ASN 214 12.554 19.561 3.686 1.00 0.00 H -ATOM 3368 CA ASN 214 11.316 19.072 2.039 1.00 0.00 C -ATOM 3369 HA ASN 214 10.351 19.506 2.302 1.00 0.00 H -ATOM 3370 CB ASN 214 12.023 20.250 1.296 1.00 0.00 C -ATOM 3371 HB2 ASN 214 12.446 20.943 2.022 1.00 0.00 H -ATOM 3372 HB3 ASN 214 12.945 19.971 0.783 1.00 0.00 H -ATOM 3373 CG ASN 214 11.130 21.092 0.459 1.00 0.00 C -ATOM 3374 OD1 ASN 214 10.608 22.150 0.766 1.00 0.00 O -ATOM 3375 ND2 ASN 214 11.269 20.824 -0.830 1.00 0.00 N -ATOM 3376 HD21 ASN 214 10.975 21.488 -1.531 1.00 0.00 H -ATOM 3377 HD22 ASN 214 11.789 20.016 -1.141 1.00 0.00 H -ATOM 3378 C ASN 214 10.994 17.898 1.067 1.00 0.00 C -ATOM 3379 O ASN 214 9.944 17.942 0.410 1.00 0.00 O -ATOM 3380 N ALA 215 11.867 16.928 0.924 1.00 0.00 N -ATOM 3381 H ALA 215 12.702 16.928 1.492 1.00 0.00 H -ATOM 3382 CA ALA 215 11.643 15.709 0.153 1.00 0.00 C -ATOM 3383 HA ALA 215 11.240 15.919 -0.838 1.00 0.00 H -ATOM 3384 CB ALA 215 12.989 15.032 -0.109 1.00 0.00 C -ATOM 3385 HB1 ALA 215 12.838 14.139 -0.716 1.00 0.00 H -ATOM 3386 HB2 ALA 215 13.609 15.751 -0.645 1.00 0.00 H -ATOM 3387 HB3 ALA 215 13.429 14.797 0.860 1.00 0.00 H -ATOM 3388 C ALA 215 10.715 14.720 0.814 1.00 0.00 C -ATOM 3389 O ALA 215 10.068 13.846 0.203 1.00 0.00 O -ATOM 3390 N TYR 216 10.582 14.807 2.129 1.00 0.00 N -ATOM 3391 H TYR 216 11.083 15.583 2.536 1.00 0.00 H -ATOM 3392 CA TYR 216 9.884 13.780 2.942 1.00 0.00 C -ATOM 3393 HA TYR 216 10.569 12.957 3.144 1.00 0.00 H -ATOM 3394 CB TYR 216 9.648 14.233 4.393 1.00 0.00 C -ATOM 3395 HB2 TYR 216 10.639 14.522 4.745 1.00 0.00 H -ATOM 3396 HB3 TYR 216 8.897 15.023 4.363 1.00 0.00 H -ATOM 3397 CG TYR 216 9.112 13.233 5.353 1.00 0.00 C -ATOM 3398 CD1 TYR 216 7.728 12.987 5.508 1.00 0.00 C -ATOM 3399 HD1 TYR 216 7.022 13.387 4.795 1.00 0.00 H -ATOM 3400 CE1 TYR 216 7.234 12.006 6.337 1.00 0.00 C -ATOM 3401 HE1 TYR 216 6.157 11.930 6.383 1.00 0.00 H -ATOM 3402 CZ TYR 216 8.092 11.241 7.198 1.00 0.00 C -ATOM 3403 OH TYR 216 7.559 10.334 8.071 1.00 0.00 O -ATOM 3404 HH TYR 216 6.733 9.949 7.768 1.00 0.00 H -ATOM 3405 CE2 TYR 216 9.467 11.449 7.069 1.00 0.00 C -ATOM 3406 HE2 TYR 216 10.173 10.895 7.670 1.00 0.00 H -ATOM 3407 CD2 TYR 216 9.970 12.457 6.216 1.00 0.00 C -ATOM 3408 HD2 TYR 216 11.024 12.561 6.005 1.00 0.00 H -ATOM 3409 C TYR 216 8.560 13.196 2.328 1.00 0.00 C -ATOM 3410 O TYR 216 8.534 12.045 1.943 1.00 0.00 O -ATOM 3411 N SER 217 7.621 14.039 2.154 1.00 0.00 N -ATOM 3412 H SER 217 7.782 14.971 2.506 1.00 0.00 H -ATOM 3413 CA SER 217 6.256 13.677 1.507 1.00 0.00 C -ATOM 3414 HA SER 217 5.735 13.040 2.220 1.00 0.00 H -ATOM 3415 CB SER 217 5.369 14.961 1.533 1.00 0.00 C -ATOM 3416 HB2 SER 217 4.383 14.755 1.119 1.00 0.00 H -ATOM 3417 HB3 SER 217 5.187 15.249 2.568 1.00 0.00 H -ATOM 3418 OG SER 217 6.059 16.017 0.944 1.00 0.00 O -ATOM 3419 HG SER 217 5.552 16.810 1.131 1.00 0.00 H -ATOM 3420 C SER 217 6.302 13.071 0.108 1.00 0.00 C -ATOM 3421 O SER 217 5.281 12.460 -0.314 1.00 0.00 O -ATOM 3422 N SER 218 7.423 13.133 -0.722 1.00 0.00 N -ATOM 3423 H SER 218 8.227 13.554 -0.280 1.00 0.00 H -ATOM 3424 CA SER 218 7.538 12.351 -2.005 1.00 0.00 C -ATOM 3425 HA SER 218 6.601 11.960 -2.402 1.00 0.00 H -ATOM 3426 CB SER 218 8.192 13.267 -2.994 1.00 0.00 C -ATOM 3427 HB2 SER 218 8.364 12.789 -3.958 1.00 0.00 H -ATOM 3428 HB3 SER 218 7.481 14.052 -3.252 1.00 0.00 H -ATOM 3429 OG SER 218 9.316 14.040 -2.647 1.00 0.00 O -ATOM 3430 HG SER 218 9.034 14.823 -2.168 1.00 0.00 H -ATOM 3431 C SER 218 8.435 11.137 -1.812 1.00 0.00 C -ATOM 3432 O SER 218 8.700 10.337 -2.745 1.00 0.00 O -ATOM 3433 N ARG 219 9.080 10.915 -0.653 1.00 0.00 N -ATOM 3434 H ARG 219 8.908 11.641 0.028 1.00 0.00 H -ATOM 3435 CA ARG 219 10.110 9.934 -0.345 1.00 0.00 C -ATOM 3436 HA ARG 219 10.176 9.184 -1.133 1.00 0.00 H -ATOM 3437 CB ARG 219 11.497 10.510 -0.336 1.00 0.00 C -ATOM 3438 HB2 ARG 219 11.602 11.223 0.482 1.00 0.00 H -ATOM 3439 HB3 ARG 219 12.249 9.745 -0.142 1.00 0.00 H -ATOM 3440 CG ARG 219 11.984 11.251 -1.619 1.00 0.00 C -ATOM 3441 HG2 ARG 219 11.141 11.834 -1.987 1.00 0.00 H -ATOM 3442 HG3 ARG 219 12.823 11.917 -1.411 1.00 0.00 H -ATOM 3443 CD ARG 219 12.273 10.288 -2.787 1.00 0.00 C -ATOM 3444 HD2 ARG 219 13.137 9.636 -2.660 1.00 0.00 H -ATOM 3445 HD3 ARG 219 11.367 9.683 -2.737 1.00 0.00 H -ATOM 3446 NE ARG 219 12.467 11.094 -4.069 1.00 0.00 N -ATOM 3447 HE ARG 219 13.247 11.731 -4.145 1.00 0.00 H -ATOM 3448 CZ ARG 219 11.568 11.296 -5.017 1.00 0.00 C -ATOM 3449 NH1 ARG 219 10.406 10.708 -5.073 1.00 0.00 N -ATOM 3450 HH11 ARG 219 10.114 10.175 -4.268 1.00 0.00 H -ATOM 3451 HH12 ARG 219 9.844 10.690 -5.913 1.00 0.00 H -ATOM 3452 NH2 ARG 219 11.885 12.050 -6.001 1.00 0.00 N -ATOM 3453 HH21 ARG 219 12.600 12.758 -5.921 1.00 0.00 H -ATOM 3454 HH22 ARG 219 11.182 12.139 -6.721 1.00 0.00 H -ATOM 3455 C ARG 219 9.884 9.181 0.939 1.00 0.00 C -ATOM 3456 O ARG 219 10.802 8.616 1.488 1.00 0.00 O -ATOM 3457 N SER 220 8.672 9.195 1.485 1.00 0.00 N -ATOM 3458 H SER 220 7.923 9.708 1.043 1.00 0.00 H -ATOM 3459 CA SER 220 8.240 8.467 2.768 1.00 0.00 C -ATOM 3460 HA SER 220 9.143 7.955 3.104 1.00 0.00 H -ATOM 3461 CB SER 220 7.606 9.456 3.806 1.00 0.00 C -ATOM 3462 HB2 SER 220 7.127 8.931 4.634 1.00 0.00 H -ATOM 3463 HB3 SER 220 8.380 10.123 4.187 1.00 0.00 H -ATOM 3464 OG SER 220 6.692 10.187 3.064 1.00 0.00 O -ATOM 3465 HG SER 220 7.197 10.927 2.721 1.00 0.00 H -ATOM 3466 C SER 220 7.185 7.360 2.478 1.00 0.00 C -ATOM 3467 O SER 220 6.567 7.327 1.428 1.00 0.00 O -ATOM 3468 N HIE 221 7.065 6.413 3.473 1.00 0.00 N -ATOM 3469 H HIE 221 7.689 6.446 4.267 1.00 0.00 H -ATOM 3470 CA HIE 221 6.450 5.083 3.123 1.00 0.00 C -ATOM 3471 HA HIE 221 5.739 5.223 2.308 1.00 0.00 H -ATOM 3472 CB HIE 221 7.522 3.997 2.928 1.00 0.00 C -ATOM 3473 HB2 HIE 221 8.158 3.987 3.814 1.00 0.00 H -ATOM 3474 HB3 HIE 221 7.016 3.052 2.735 1.00 0.00 H -ATOM 3475 CG HIE 221 8.478 4.325 1.853 1.00 0.00 C -ATOM 3476 ND1 HIE 221 8.590 3.549 0.713 1.00 0.00 N -ATOM 3477 CE1 HIE 221 9.702 3.988 0.057 1.00 0.00 C -ATOM 3478 HE1 HIE 221 10.099 3.671 -0.897 1.00 0.00 H -ATOM 3479 NE2 HIE 221 10.222 5.061 0.681 1.00 0.00 N -ATOM 3480 HE2 HIE 221 11.024 5.543 0.300 1.00 0.00 H -ATOM 3481 CD2 HIE 221 9.500 5.289 1.843 1.00 0.00 C -ATOM 3482 HD2 HIE 221 9.861 5.984 2.587 1.00 0.00 H -ATOM 3483 C HIE 221 5.729 4.601 4.400 1.00 0.00 C -ATOM 3484 O HIE 221 6.347 4.178 5.408 1.00 0.00 O -ATOM 3485 N SER 222 4.408 4.748 4.344 1.00 0.00 N -ATOM 3486 H SER 222 4.018 5.089 3.477 1.00 0.00 H -ATOM 3487 CA SER 222 3.488 4.327 5.446 1.00 0.00 C -ATOM 3488 HA SER 222 4.101 4.417 6.343 1.00 0.00 H -ATOM 3489 CB SER 222 2.167 5.196 5.423 1.00 0.00 C -ATOM 3490 HB2 SER 222 1.566 4.834 4.589 1.00 0.00 H -ATOM 3491 HB3 SER 222 1.671 4.916 6.352 1.00 0.00 H -ATOM 3492 OG SER 222 2.469 6.562 5.428 1.00 0.00 O -ATOM 3493 HG SER 222 3.123 6.761 6.103 1.00 0.00 H -ATOM 3494 C SER 222 3.172 2.872 5.358 1.00 0.00 C -ATOM 3495 O SER 222 2.538 2.496 4.377 1.00 0.00 O -ATOM 3496 N VAL 223 3.285 2.083 6.460 1.00 0.00 N -ATOM 3497 H VAL 223 3.722 2.461 7.289 1.00 0.00 H -ATOM 3498 CA VAL 223 2.907 0.707 6.537 1.00 0.00 C -ATOM 3499 HA VAL 223 2.493 0.230 5.649 1.00 0.00 H -ATOM 3500 CB VAL 223 4.152 -0.042 6.876 1.00 0.00 C -ATOM 3501 HB VAL 223 4.579 0.516 7.710 1.00 0.00 H -ATOM 3502 CG1 VAL 223 4.097 -1.520 7.142 1.00 0.00 C -ATOM 3503 HG11 VAL 223 3.368 -1.702 7.931 1.00 0.00 H -ATOM 3504 HG12 VAL 223 3.712 -2.011 6.249 1.00 0.00 H -ATOM 3505 HG13 VAL 223 5.055 -1.943 7.443 1.00 0.00 H -ATOM 3506 CG2 VAL 223 5.291 0.122 5.845 1.00 0.00 C -ATOM 3507 HG21 VAL 223 5.041 -0.334 4.886 1.00 0.00 H -ATOM 3508 HG22 VAL 223 5.637 1.142 5.680 1.00 0.00 H -ATOM 3509 HG23 VAL 223 6.174 -0.464 6.101 1.00 0.00 H -ATOM 3510 C VAL 223 1.841 0.566 7.599 1.00 0.00 C -ATOM 3511 O VAL 223 2.105 0.295 8.785 1.00 0.00 O -ATOM 3512 N PHE 224 0.600 0.813 7.252 1.00 0.00 N -ATOM 3513 H PHE 224 0.384 0.962 6.277 1.00 0.00 H -ATOM 3514 CA PHE 224 -0.525 0.476 8.064 1.00 0.00 C -ATOM 3515 HA PHE 224 -0.374 0.891 9.060 1.00 0.00 H -ATOM 3516 CB PHE 224 -1.780 1.196 7.671 1.00 0.00 C -ATOM 3517 HB2 PHE 224 -1.569 2.265 7.643 1.00 0.00 H -ATOM 3518 HB3 PHE 224 -2.029 0.967 6.635 1.00 0.00 H -ATOM 3519 CG PHE 224 -3.018 1.106 8.601 1.00 0.00 C -ATOM 3520 CD1 PHE 224 -4.083 0.265 8.290 1.00 0.00 C -ATOM 3521 HD1 PHE 224 -4.068 -0.163 7.299 1.00 0.00 H -ATOM 3522 CE1 PHE 224 -5.316 0.329 8.954 1.00 0.00 C -ATOM 3523 HE1 PHE 224 -6.132 -0.362 8.804 1.00 0.00 H -ATOM 3524 CZ PHE 224 -5.252 0.861 10.248 1.00 0.00 C -ATOM 3525 HZ PHE 224 -5.993 0.808 11.032 1.00 0.00 H -ATOM 3526 CE2 PHE 224 -4.146 1.601 10.672 1.00 0.00 C -ATOM 3527 HE2 PHE 224 -4.066 2.012 11.668 1.00 0.00 H -ATOM 3528 CD2 PHE 224 -3.089 1.826 9.804 1.00 0.00 C -ATOM 3529 HD2 PHE 224 -2.288 2.468 10.140 1.00 0.00 H -ATOM 3530 C PHE 224 -0.756 -1.024 8.098 1.00 0.00 C -ATOM 3531 O PHE 224 -0.456 -1.696 7.083 1.00 0.00 O -ATOM 3532 N SER 225 -1.336 -1.512 9.148 1.00 0.00 N -ATOM 3533 H SER 225 -1.631 -0.821 9.823 1.00 0.00 H -ATOM 3534 CA SER 225 -1.947 -2.816 9.306 1.00 0.00 C -ATOM 3535 HA SER 225 -2.423 -2.987 8.340 1.00 0.00 H -ATOM 3536 CB SER 225 -0.940 -3.928 9.399 1.00 0.00 C -ATOM 3537 HB2 SER 225 -1.348 -4.898 9.114 1.00 0.00 H -ATOM 3538 HB3 SER 225 -0.196 -3.798 8.614 1.00 0.00 H -ATOM 3539 OG SER 225 -0.308 -4.005 10.700 1.00 0.00 O -ATOM 3540 HG SER 225 0.388 -3.348 10.624 1.00 0.00 H -ATOM 3541 C SER 225 -3.103 -2.892 10.327 1.00 0.00 C -ATOM 3542 O SER 225 -3.012 -2.330 11.383 1.00 0.00 O -ATOM 3543 N VAL 226 -4.078 -3.676 9.982 1.00 0.00 N -ATOM 3544 H VAL 226 -4.035 -4.153 9.091 1.00 0.00 H -ATOM 3545 CA VAL 226 -5.201 -4.157 10.818 1.00 0.00 C -ATOM 3546 HA VAL 226 -5.030 -3.735 11.808 1.00 0.00 H -ATOM 3547 CB VAL 226 -6.558 -3.459 10.400 1.00 0.00 C -ATOM 3548 HB VAL 226 -6.385 -2.382 10.409 1.00 0.00 H -ATOM 3549 CG1 VAL 226 -6.843 -3.872 8.939 1.00 0.00 C -ATOM 3550 HG11 VAL 226 -7.692 -3.349 8.496 1.00 0.00 H -ATOM 3551 HG12 VAL 226 -6.017 -3.664 8.260 1.00 0.00 H -ATOM 3552 HG13 VAL 226 -7.227 -4.891 8.968 1.00 0.00 H -ATOM 3553 CG2 VAL 226 -7.810 -3.755 11.271 1.00 0.00 C -ATOM 3554 HG21 VAL 226 -8.047 -4.819 11.251 1.00 0.00 H -ATOM 3555 HG22 VAL 226 -7.572 -3.434 12.286 1.00 0.00 H -ATOM 3556 HG23 VAL 226 -8.756 -3.372 10.887 1.00 0.00 H -ATOM 3557 C VAL 226 -5.264 -5.705 10.936 1.00 0.00 C -ATOM 3558 O VAL 226 -5.300 -6.399 9.973 1.00 0.00 O -ATOM 3559 N THR 227 -5.147 -6.172 12.208 1.00 0.00 N -ATOM 3560 H THR 227 -5.019 -5.514 12.964 1.00 0.00 H -ATOM 3561 CA THR 227 -5.239 -7.575 12.695 1.00 0.00 C -ATOM 3562 HA THR 227 -5.051 -8.171 11.801 1.00 0.00 H -ATOM 3563 CB THR 227 -4.161 -7.958 13.717 1.00 0.00 C -ATOM 3564 HB THR 227 -4.228 -7.273 14.563 1.00 0.00 H -ATOM 3565 CG2 THR 227 -4.211 -9.393 14.191 1.00 0.00 C -ATOM 3566 HG21 THR 227 -3.249 -9.590 14.664 1.00 0.00 H -ATOM 3567 HG22 THR 227 -4.994 -9.568 14.928 1.00 0.00 H -ATOM 3568 HG23 THR 227 -4.383 -10.063 13.349 1.00 0.00 H -ATOM 3569 OG1 THR 227 -2.908 -7.746 13.121 1.00 0.00 O -ATOM 3570 HG1 THR 227 -2.829 -6.790 13.110 1.00 0.00 H -ATOM 3571 C THR 227 -6.593 -7.905 13.313 1.00 0.00 C -ATOM 3572 O THR 227 -7.154 -6.985 13.864 1.00 0.00 O -ATOM 3573 N ILE 228 -7.217 -9.056 13.097 1.00 0.00 N -ATOM 3574 H ILE 228 -6.757 -9.763 12.542 1.00 0.00 H -ATOM 3575 CA ILE 228 -8.571 -9.329 13.605 1.00 0.00 C -ATOM 3576 HA ILE 228 -8.755 -8.540 14.334 1.00 0.00 H -ATOM 3577 CB ILE 228 -9.651 -9.357 12.502 1.00 0.00 C -ATOM 3578 HB ILE 228 -9.435 -10.149 11.785 1.00 0.00 H -ATOM 3579 CG2 ILE 228 -10.960 -9.591 13.298 1.00 0.00 C -ATOM 3580 HG21 ILE 228 -11.716 -9.356 12.549 1.00 0.00 H -ATOM 3581 HG22 ILE 228 -11.093 -10.606 13.674 1.00 0.00 H -ATOM 3582 HG23 ILE 228 -11.034 -8.922 14.157 1.00 0.00 H -ATOM 3583 CG1 ILE 228 -9.765 -7.994 11.709 1.00 0.00 C -ATOM 3584 HG12 ILE 228 -10.810 -7.853 11.437 1.00 0.00 H -ATOM 3585 HG13 ILE 228 -9.476 -7.091 12.246 1.00 0.00 H -ATOM 3586 CD1 ILE 228 -9.049 -7.920 10.380 1.00 0.00 C -ATOM 3587 HD11 ILE 228 -9.454 -8.714 9.752 1.00 0.00 H -ATOM 3588 HD12 ILE 228 -9.279 -7.013 9.821 1.00 0.00 H -ATOM 3589 HD13 ILE 228 -7.984 -8.015 10.590 1.00 0.00 H -ATOM 3590 C ILE 228 -8.529 -10.608 14.371 1.00 0.00 C -ATOM 3591 O ILE 228 -8.159 -11.644 13.834 1.00 0.00 O -ATOM 3592 N HIE 229 -9.053 -10.614 15.632 1.00 0.00 N -ATOM 3593 H HIE 229 -9.229 -9.731 16.090 1.00 0.00 H -ATOM 3594 CA HIE 229 -9.289 -11.895 16.330 1.00 0.00 C -ATOM 3595 HA HIE 229 -8.704 -12.705 15.893 1.00 0.00 H -ATOM 3596 CB HIE 229 -9.023 -11.838 17.830 1.00 0.00 C -ATOM 3597 HB2 HIE 229 -9.521 -10.943 18.204 1.00 0.00 H -ATOM 3598 HB3 HIE 229 -9.515 -12.687 18.305 1.00 0.00 H -ATOM 3599 CG HIE 229 -7.542 -11.668 18.180 1.00 0.00 C -ATOM 3600 ND1 HIE 229 -6.927 -12.198 19.296 1.00 0.00 N -ATOM 3601 CE1 HIE 229 -5.640 -11.902 19.145 1.00 0.00 C -ATOM 3602 HE1 HIE 229 -4.880 -12.075 19.892 1.00 0.00 H -ATOM 3603 NE2 HIE 229 -5.379 -11.170 18.017 1.00 0.00 N -ATOM 3604 HE2 HIE 229 -4.450 -10.840 17.798 1.00 0.00 H -ATOM 3605 CD2 HIE 229 -6.627 -10.987 17.403 1.00 0.00 C -ATOM 3606 HD2 HIE 229 -6.867 -10.494 16.471 1.00 0.00 H -ATOM 3607 C HIE 229 -10.763 -12.399 15.981 1.00 0.00 C -ATOM 3608 O HIE 229 -11.647 -11.497 15.970 1.00 0.00 O -ATOM 3609 N MET 230 -11.097 -13.697 15.695 1.00 0.00 N -ATOM 3610 H MET 230 -10.301 -14.319 15.694 1.00 0.00 H -ATOM 3611 CA MET 230 -12.474 -14.174 15.488 1.00 0.00 C -ATOM 3612 HA MET 230 -13.119 -13.444 15.975 1.00 0.00 H -ATOM 3613 CB MET 230 -12.747 -14.253 13.967 1.00 0.00 C -ATOM 3614 HB2 MET 230 -12.242 -15.115 13.530 1.00 0.00 H -ATOM 3615 HB3 MET 230 -13.818 -14.366 13.801 1.00 0.00 H -ATOM 3616 CG MET 230 -12.172 -13.078 13.138 1.00 0.00 C -ATOM 3617 HG2 MET 230 -12.656 -12.143 13.422 1.00 0.00 H -ATOM 3618 HG3 MET 230 -11.129 -12.858 13.369 1.00 0.00 H -ATOM 3619 SD MET 230 -12.144 -13.196 11.313 1.00 0.00 S -ATOM 3620 CE MET 230 -10.364 -13.552 11.190 1.00 0.00 C -ATOM 3621 HE1 MET 230 -9.986 -14.506 11.560 1.00 0.00 H -ATOM 3622 HE2 MET 230 -10.103 -13.448 10.137 1.00 0.00 H -ATOM 3623 HE3 MET 230 -9.812 -12.757 11.691 1.00 0.00 H -ATOM 3624 C MET 230 -12.706 -15.472 16.196 1.00 0.00 C -ATOM 3625 O MET 230 -11.991 -16.438 15.818 1.00 0.00 O -ATOM 3626 N LYS 231 -13.539 -15.484 17.210 1.00 0.00 N -ATOM 3627 H LYS 231 -14.078 -14.642 17.348 1.00 0.00 H -ATOM 3628 CA LYS 231 -13.861 -16.687 17.946 1.00 0.00 C -ATOM 3629 HA LYS 231 -12.966 -17.184 18.319 1.00 0.00 H -ATOM 3630 CB LYS 231 -14.638 -16.350 19.204 1.00 0.00 C -ATOM 3631 HB2 LYS 231 -14.019 -15.804 19.915 1.00 0.00 H -ATOM 3632 HB3 LYS 231 -15.521 -15.785 18.907 1.00 0.00 H -ATOM 3633 CG LYS 231 -15.148 -17.642 19.984 1.00 0.00 C -ATOM 3634 HG2 LYS 231 -16.060 -17.944 19.469 1.00 0.00 H -ATOM 3635 HG3 LYS 231 -14.398 -18.433 20.007 1.00 0.00 H -ATOM 3636 CD LYS 231 -15.437 -17.403 21.499 1.00 0.00 C -ATOM 3637 HD2 LYS 231 -14.506 -17.083 21.967 1.00 0.00 H -ATOM 3638 HD3 LYS 231 -16.252 -16.700 21.672 1.00 0.00 H -ATOM 3639 CE LYS 231 -15.738 -18.719 22.242 1.00 0.00 C -ATOM 3640 HE2 LYS 231 -16.634 -19.141 21.787 1.00 0.00 H -ATOM 3641 HE3 LYS 231 -14.925 -19.439 22.151 1.00 0.00 H -ATOM 3642 NZ LYS 231 -15.962 -18.450 23.680 1.00 0.00 N -ATOM 3643 HZ1 LYS 231 -16.747 -17.818 23.750 1.00 0.00 H -ATOM 3644 HZ2 LYS 231 -16.303 -19.261 24.176 1.00 0.00 H -ATOM 3645 HZ3 LYS 231 -15.161 -18.057 24.154 1.00 0.00 H -ATOM 3646 C LYS 231 -14.520 -17.729 17.070 1.00 0.00 C -ATOM 3647 O LYS 231 -15.380 -17.334 16.276 1.00 0.00 O -ATOM 3648 N GLU 232 -14.162 -19.006 17.264 1.00 0.00 N -ATOM 3649 H GLU 232 -13.467 -19.236 17.960 1.00 0.00 H -ATOM 3650 CA GLU 232 -14.840 -20.097 16.614 1.00 0.00 C -ATOM 3651 HA GLU 232 -15.509 -19.749 15.826 1.00 0.00 H -ATOM 3652 CB GLU 232 -13.816 -21.043 15.935 1.00 0.00 C -ATOM 3653 HB2 GLU 232 -13.069 -21.366 16.662 1.00 0.00 H -ATOM 3654 HB3 GLU 232 -14.366 -21.938 15.646 1.00 0.00 H -ATOM 3655 CG GLU 232 -13.111 -20.464 14.717 1.00 0.00 C -ATOM 3656 HG2 GLU 232 -12.907 -19.406 14.881 1.00 0.00 H -ATOM 3657 HG3 GLU 232 -12.101 -20.843 14.567 1.00 0.00 H -ATOM 3658 CD GLU 232 -13.773 -20.673 13.371 1.00 0.00 C -ATOM 3659 OE1 GLU 232 -13.476 -21.679 12.718 1.00 0.00 O -ATOM 3660 OE2 GLU 232 -14.725 -19.927 13.023 1.00 0.00 O -ATOM 3661 C GLU 232 -15.748 -20.850 17.490 1.00 0.00 C -ATOM 3662 O GLU 232 -15.764 -20.656 18.721 1.00 0.00 O -ATOM 3663 N THR 233 -16.593 -21.727 16.963 1.00 0.00 N -ATOM 3664 H THR 233 -16.502 -22.027 16.003 1.00 0.00 H -ATOM 3665 CA THR 233 -17.696 -22.354 17.696 1.00 0.00 C -ATOM 3666 HA THR 233 -18.135 -21.676 18.427 1.00 0.00 H -ATOM 3667 CB THR 233 -18.898 -22.804 16.892 1.00 0.00 C -ATOM 3668 HB THR 233 -19.622 -23.305 17.537 1.00 0.00 H -ATOM 3669 CG2 THR 233 -19.698 -21.734 16.189 1.00 0.00 C -ATOM 3670 HG21 THR 233 -19.972 -20.955 16.899 1.00 0.00 H -ATOM 3671 HG22 THR 233 -19.076 -21.328 15.391 1.00 0.00 H -ATOM 3672 HG23 THR 233 -20.615 -22.128 15.749 1.00 0.00 H -ATOM 3673 OG1 THR 233 -18.555 -23.716 15.882 1.00 0.00 O -ATOM 3674 HG1 THR 233 -17.854 -23.399 15.309 1.00 0.00 H -ATOM 3675 C THR 233 -17.211 -23.495 18.507 1.00 0.00 C -ATOM 3676 O THR 233 -16.244 -24.131 18.158 1.00 0.00 O -ATOM 3677 N THR 234 -17.979 -23.940 19.522 1.00 0.00 N -ATOM 3678 H THR 234 -18.760 -23.407 19.875 1.00 0.00 H -ATOM 3679 CA THR 234 -17.627 -25.204 20.190 1.00 0.00 C -ATOM 3680 HA THR 234 -16.687 -25.078 20.728 1.00 0.00 H -ATOM 3681 CB THR 234 -18.643 -25.598 21.263 1.00 0.00 C -ATOM 3682 HB THR 234 -18.311 -26.548 21.681 1.00 0.00 H -ATOM 3683 CG2 THR 234 -18.709 -24.570 22.338 1.00 0.00 C -ATOM 3684 HG21 THR 234 -19.067 -23.591 22.021 1.00 0.00 H -ATOM 3685 HG22 THR 234 -19.406 -24.822 23.137 1.00 0.00 H -ATOM 3686 HG23 THR 234 -17.746 -24.386 22.812 1.00 0.00 H -ATOM 3687 OG1 THR 234 -19.910 -25.815 20.756 1.00 0.00 O -ATOM 3688 HG1 THR 234 -20.107 -26.754 20.751 1.00 0.00 H -ATOM 3689 C THR 234 -17.548 -26.392 19.256 1.00 0.00 C -ATOM 3690 O THR 234 -16.763 -27.350 19.589 1.00 0.00 O -ATOM 3691 N ILE 235 -18.308 -26.353 18.133 1.00 0.00 N -ATOM 3692 H ILE 235 -18.846 -25.521 17.933 1.00 0.00 H -ATOM 3693 CA ILE 235 -18.318 -27.477 17.137 1.00 0.00 C -ATOM 3694 HA ILE 235 -18.277 -28.470 17.584 1.00 0.00 H -ATOM 3695 CB ILE 235 -19.562 -27.378 16.189 1.00 0.00 C -ATOM 3696 HB ILE 235 -19.437 -26.430 15.664 1.00 0.00 H -ATOM 3697 CG2 ILE 235 -19.702 -28.588 15.230 1.00 0.00 C -ATOM 3698 HG21 ILE 235 -19.729 -29.508 15.815 1.00 0.00 H -ATOM 3699 HG22 ILE 235 -20.644 -28.587 14.681 1.00 0.00 H -ATOM 3700 HG23 ILE 235 -18.845 -28.795 14.589 1.00 0.00 H -ATOM 3701 CG1 ILE 235 -20.820 -27.400 17.125 1.00 0.00 C -ATOM 3702 HG12 ILE 235 -21.625 -28.074 16.834 1.00 0.00 H -ATOM 3703 HG13 ILE 235 -20.542 -27.614 18.157 1.00 0.00 H -ATOM 3704 CD1 ILE 235 -21.542 -26.099 17.210 1.00 0.00 C -ATOM 3705 HD11 ILE 235 -22.543 -26.271 17.605 1.00 0.00 H -ATOM 3706 HD12 ILE 235 -21.093 -25.402 17.919 1.00 0.00 H -ATOM 3707 HD13 ILE 235 -21.500 -25.640 16.222 1.00 0.00 H -ATOM 3708 C ILE 235 -17.111 -27.452 16.223 1.00 0.00 C -ATOM 3709 O ILE 235 -16.682 -28.462 15.693 1.00 0.00 O -ATOM 3710 N ASP 236 -16.395 -26.316 16.114 1.00 0.00 N -ATOM 3711 H ASP 236 -16.731 -25.526 16.646 1.00 0.00 H -ATOM 3712 CA ASP 236 -15.104 -26.144 15.478 1.00 0.00 C -ATOM 3713 HA ASP 236 -15.078 -26.901 14.693 1.00 0.00 H -ATOM 3714 CB ASP 236 -14.969 -24.701 14.925 1.00 0.00 C -ATOM 3715 HB2 ASP 236 -15.117 -24.045 15.782 1.00 0.00 H -ATOM 3716 HB3 ASP 236 -13.997 -24.389 14.544 1.00 0.00 H -ATOM 3717 CG ASP 236 -16.004 -24.176 13.955 1.00 0.00 C -ATOM 3718 OD1 ASP 236 -16.280 -24.784 12.907 1.00 0.00 O -ATOM 3719 OD2 ASP 236 -16.609 -23.090 14.154 1.00 0.00 O -ATOM 3720 C ASP 236 -13.975 -26.450 16.457 1.00 0.00 C -ATOM 3721 O ASP 236 -13.046 -27.234 16.067 1.00 0.00 O -ATOM 3722 N GLY 237 -13.989 -25.862 17.650 1.00 0.00 N -ATOM 3723 H GLY 237 -14.736 -25.250 17.946 1.00 0.00 H -ATOM 3724 CA GLY 237 -13.038 -26.084 18.743 1.00 0.00 C -ATOM 3725 HA2 GLY 237 -13.007 -27.150 18.966 1.00 0.00 H -ATOM 3726 HA3 GLY 237 -12.059 -25.789 18.366 1.00 0.00 H -ATOM 3727 C GLY 237 -13.388 -25.291 20.019 1.00 0.00 C -ATOM 3728 O GLY 237 -13.788 -24.120 19.925 1.00 0.00 O -ATOM 3729 N GLU 238 -13.190 -25.961 21.165 1.00 0.00 N -ATOM 3730 H GLU 238 -12.991 -26.951 21.206 1.00 0.00 H -ATOM 3731 CA GLU 238 -13.293 -25.288 22.491 1.00 0.00 C -ATOM 3732 HA GLU 238 -14.236 -24.749 22.401 1.00 0.00 H -ATOM 3733 CB GLU 238 -13.064 -26.265 23.626 1.00 0.00 C -ATOM 3734 HB2 GLU 238 -12.125 -26.803 23.498 1.00 0.00 H -ATOM 3735 HB3 GLU 238 -13.035 -25.658 24.532 1.00 0.00 H -ATOM 3736 CG GLU 238 -14.277 -27.185 23.922 1.00 0.00 C -ATOM 3737 HG2 GLU 238 -15.166 -26.602 24.161 1.00 0.00 H -ATOM 3738 HG3 GLU 238 -14.436 -27.623 22.938 1.00 0.00 H -ATOM 3739 CD GLU 238 -14.003 -28.185 24.999 1.00 0.00 C -ATOM 3740 OE1 GLU 238 -14.281 -29.358 24.679 1.00 0.00 O -ATOM 3741 OE2 GLU 238 -13.550 -27.882 26.087 1.00 0.00 O -ATOM 3742 C GLU 238 -12.284 -24.136 22.649 1.00 0.00 C -ATOM 3743 O GLU 238 -11.101 -24.406 22.420 1.00 0.00 O -ATOM 3744 N GLU 239 -12.847 -22.974 23.057 1.00 0.00 N -ATOM 3745 H GLU 239 -13.823 -23.058 23.307 1.00 0.00 H -ATOM 3746 CA GLU 239 -12.160 -21.695 23.358 1.00 0.00 C -ATOM 3747 HA GLU 239 -12.935 -20.943 23.507 1.00 0.00 H -ATOM 3748 CB GLU 239 -11.377 -21.709 24.657 1.00 0.00 C -ATOM 3749 HB2 GLU 239 -10.533 -22.399 24.637 1.00 0.00 H -ATOM 3750 HB3 GLU 239 -11.056 -20.694 24.889 1.00 0.00 H -ATOM 3751 CG GLU 239 -12.225 -22.191 25.835 1.00 0.00 C -ATOM 3752 HG2 GLU 239 -12.350 -23.273 25.800 1.00 0.00 H -ATOM 3753 HG3 GLU 239 -11.695 -21.931 26.751 1.00 0.00 H -ATOM 3754 CD GLU 239 -13.625 -21.432 26.034 1.00 0.00 C -ATOM 3755 OE1 GLU 239 -14.515 -22.083 26.676 1.00 0.00 O -ATOM 3756 OE2 GLU 239 -13.726 -20.262 25.562 1.00 0.00 O -ATOM 3757 C GLU 239 -11.219 -21.217 22.181 1.00 0.00 C -ATOM 3758 O GLU 239 -10.211 -20.508 22.322 1.00 0.00 O -ATOM 3759 N LEU 240 -11.542 -21.701 20.959 1.00 0.00 N -ATOM 3760 H LEU 240 -12.264 -22.407 20.908 1.00 0.00 H -ATOM 3761 CA LEU 240 -10.782 -21.427 19.716 1.00 0.00 C -ATOM 3762 HA LEU 240 -9.704 -21.473 19.866 1.00 0.00 H -ATOM 3763 CB LEU 240 -11.131 -22.569 18.774 1.00 0.00 C -ATOM 3764 HB2 LEU 240 -10.927 -23.486 19.326 1.00 0.00 H -ATOM 3765 HB3 LEU 240 -12.201 -22.651 18.582 1.00 0.00 H -ATOM 3766 CG LEU 240 -10.564 -22.540 17.372 1.00 0.00 C -ATOM 3767 HG LEU 240 -10.857 -21.627 16.853 1.00 0.00 H -ATOM 3768 CD1 LEU 240 -9.059 -22.689 17.483 1.00 0.00 C -ATOM 3769 HD11 LEU 240 -8.712 -21.811 18.030 1.00 0.00 H -ATOM 3770 HD12 LEU 240 -8.802 -23.617 17.993 1.00 0.00 H -ATOM 3771 HD13 LEU 240 -8.582 -22.687 16.503 1.00 0.00 H -ATOM 3772 CD2 LEU 240 -11.179 -23.763 16.623 1.00 0.00 C -ATOM 3773 HD21 LEU 240 -10.775 -24.620 17.160 1.00 0.00 H -ATOM 3774 HD22 LEU 240 -12.266 -23.805 16.685 1.00 0.00 H -ATOM 3775 HD23 LEU 240 -10.761 -23.672 15.620 1.00 0.00 H -ATOM 3776 C LEU 240 -11.153 -20.098 19.095 1.00 0.00 C -ATOM 3777 O LEU 240 -12.251 -19.490 19.361 1.00 0.00 O -ATOM 3778 N VAL 241 -10.263 -19.566 18.304 1.00 0.00 N -ATOM 3779 H VAL 241 -9.402 -20.082 18.191 1.00 0.00 H -ATOM 3780 CA VAL 241 -10.333 -18.387 17.437 1.00 0.00 C -ATOM 3781 HA VAL 241 -11.376 -18.157 17.223 1.00 0.00 H -ATOM 3782 CB VAL 241 -9.636 -17.178 18.109 1.00 0.00 C -ATOM 3783 HB VAL 241 -9.731 -16.289 17.486 1.00 0.00 H -ATOM 3784 CG1 VAL 241 -10.250 -16.733 19.372 1.00 0.00 C -ATOM 3785 HG11 VAL 241 -9.661 -16.005 19.930 1.00 0.00 H -ATOM 3786 HG12 VAL 241 -11.156 -16.187 19.112 1.00 0.00 H -ATOM 3787 HG13 VAL 241 -10.348 -17.568 20.065 1.00 0.00 H -ATOM 3788 CG2 VAL 241 -8.172 -17.547 18.296 1.00 0.00 C -ATOM 3789 HG21 VAL 241 -8.120 -18.421 18.945 1.00 0.00 H -ATOM 3790 HG22 VAL 241 -7.809 -17.763 17.291 1.00 0.00 H -ATOM 3791 HG23 VAL 241 -7.591 -16.724 18.711 1.00 0.00 H -ATOM 3792 C VAL 241 -9.779 -18.778 16.062 1.00 0.00 C -ATOM 3793 O VAL 241 -9.062 -19.730 16.059 1.00 0.00 O -ATOM 3794 N LYS 242 -10.001 -18.059 14.969 1.00 0.00 N -ATOM 3795 H LYS 242 -10.845 -17.506 15.000 1.00 0.00 H -ATOM 3796 CA LYS 242 -9.099 -17.796 13.842 1.00 0.00 C -ATOM 3797 HA LYS 242 -8.274 -18.508 13.825 1.00 0.00 H -ATOM 3798 CB LYS 242 -9.879 -17.654 12.542 1.00 0.00 C -ATOM 3799 HB2 LYS 242 -10.719 -16.978 12.703 1.00 0.00 H -ATOM 3800 HB3 LYS 242 -9.269 -17.141 11.797 1.00 0.00 H -ATOM 3801 CG LYS 242 -10.395 -19.029 12.087 1.00 0.00 C -ATOM 3802 HG2 LYS 242 -9.596 -19.592 11.605 1.00 0.00 H -ATOM 3803 HG3 LYS 242 -10.853 -19.516 12.947 1.00 0.00 H -ATOM 3804 CD LYS 242 -11.479 -18.801 11.053 1.00 0.00 C -ATOM 3805 HD2 LYS 242 -12.421 -18.549 11.538 1.00 0.00 H -ATOM 3806 HD3 LYS 242 -11.141 -17.962 10.445 1.00 0.00 H -ATOM 3807 CE LYS 242 -11.680 -19.848 10.014 1.00 0.00 C -ATOM 3808 HE2 LYS 242 -12.573 -19.644 9.424 1.00 0.00 H -ATOM 3809 HE3 LYS 242 -10.821 -19.749 9.350 1.00 0.00 H -ATOM 3810 NZ LYS 242 -11.761 -21.253 10.472 1.00 0.00 N -ATOM 3811 HZ1 LYS 242 -11.931 -21.820 9.653 1.00 0.00 H -ATOM 3812 HZ2 LYS 242 -10.876 -21.507 10.888 1.00 0.00 H -ATOM 3813 HZ3 LYS 242 -12.485 -21.379 11.165 1.00 0.00 H -ATOM 3814 C LYS 242 -8.412 -16.428 14.129 1.00 0.00 C -ATOM 3815 O LYS 242 -9.052 -15.527 14.622 1.00 0.00 O -ATOM 3816 N ILE 243 -7.198 -16.200 13.634 1.00 0.00 N -ATOM 3817 H ILE 243 -6.777 -17.014 13.210 1.00 0.00 H -ATOM 3818 CA ILE 243 -6.414 -14.949 13.652 1.00 0.00 C -ATOM 3819 HA ILE 243 -7.113 -14.139 13.859 1.00 0.00 H -ATOM 3820 CB ILE 243 -5.339 -14.957 14.779 1.00 0.00 C -ATOM 3821 HB ILE 243 -4.845 -15.929 14.782 1.00 0.00 H -ATOM 3822 CG2 ILE 243 -4.307 -13.789 14.573 1.00 0.00 C -ATOM 3823 HG21 ILE 243 -3.644 -13.726 15.436 1.00 0.00 H -ATOM 3824 HG22 ILE 243 -3.760 -14.039 13.664 1.00 0.00 H -ATOM 3825 HG23 ILE 243 -4.755 -12.806 14.425 1.00 0.00 H -ATOM 3826 CG1 ILE 243 -5.849 -14.782 16.246 1.00 0.00 C -ATOM 3827 HG12 ILE 243 -5.871 -13.719 16.485 1.00 0.00 H -ATOM 3828 HG13 ILE 243 -6.900 -15.049 16.355 1.00 0.00 H -ATOM 3829 CD1 ILE 243 -5.006 -15.463 17.342 1.00 0.00 C -ATOM 3830 HD11 ILE 243 -3.966 -15.135 17.315 1.00 0.00 H -ATOM 3831 HD12 ILE 243 -5.392 -15.047 18.272 1.00 0.00 H -ATOM 3832 HD13 ILE 243 -5.028 -16.553 17.360 1.00 0.00 H -ATOM 3833 C ILE 243 -5.992 -14.673 12.254 1.00 0.00 C -ATOM 3834 O ILE 243 -5.349 -15.551 11.665 1.00 0.00 O -ATOM 3835 N GLY 244 -6.145 -13.427 11.800 1.00 0.00 N -ATOM 3836 H GLY 244 -6.721 -12.852 12.399 1.00 0.00 H -ATOM 3837 CA GLY 244 -5.811 -12.966 10.388 1.00 0.00 C -ATOM 3838 HA2 GLY 244 -4.976 -13.589 10.064 1.00 0.00 H -ATOM 3839 HA3 GLY 244 -6.604 -13.181 9.672 1.00 0.00 H -ATOM 3840 C GLY 244 -5.367 -11.512 10.401 1.00 0.00 C -ATOM 3841 O GLY 244 -5.748 -10.715 11.280 1.00 0.00 O -ATOM 3842 N LYS 245 -4.606 -11.056 9.370 1.00 0.00 N -ATOM 3843 H LYS 245 -4.406 -11.738 8.652 1.00 0.00 H -ATOM 3844 CA LYS 245 -4.044 -9.715 9.269 1.00 0.00 C -ATOM 3845 HA LYS 245 -4.599 -9.069 9.950 1.00 0.00 H -ATOM 3846 CB LYS 245 -2.570 -9.679 9.673 1.00 0.00 C -ATOM 3847 HB2 LYS 245 -2.339 -10.310 10.531 1.00 0.00 H -ATOM 3848 HB3 LYS 245 -2.101 -10.283 8.897 1.00 0.00 H -ATOM 3849 CG LYS 245 -1.880 -8.326 9.767 1.00 0.00 C -ATOM 3850 HG2 LYS 245 -1.785 -7.952 8.748 1.00 0.00 H -ATOM 3851 HG3 LYS 245 -2.545 -7.670 10.328 1.00 0.00 H -ATOM 3852 CD LYS 245 -0.538 -8.348 10.414 1.00 0.00 C -ATOM 3853 HD2 LYS 245 -0.738 -8.592 11.456 1.00 0.00 H -ATOM 3854 HD3 LYS 245 0.065 -9.142 9.972 1.00 0.00 H -ATOM 3855 CE LYS 245 -0.036 -6.962 10.449 1.00 0.00 C -ATOM 3856 HE2 LYS 245 0.005 -6.614 9.417 1.00 0.00 H -ATOM 3857 HE3 LYS 245 -0.740 -6.406 11.068 1.00 0.00 H -ATOM 3858 NZ LYS 245 1.245 -6.896 11.166 1.00 0.00 N -ATOM 3859 HZ1 LYS 245 1.278 -6.005 11.639 1.00 0.00 H -ATOM 3860 HZ2 LYS 245 1.389 -7.560 11.914 1.00 0.00 H -ATOM 3861 HZ3 LYS 245 2.046 -7.074 10.577 1.00 0.00 H -ATOM 3862 C LYS 245 -4.155 -9.064 7.886 1.00 0.00 C -ATOM 3863 O LYS 245 -3.959 -9.779 6.890 1.00 0.00 O -ATOM 3864 N LEU 246 -4.327 -7.788 7.757 1.00 0.00 N -ATOM 3865 H LEU 246 -4.743 -7.310 8.543 1.00 0.00 H -ATOM 3866 CA LEU 246 -4.157 -7.086 6.453 1.00 0.00 C -ATOM 3867 HA LEU 246 -3.829 -7.742 5.647 1.00 0.00 H -ATOM 3868 CB LEU 246 -5.477 -6.430 6.021 1.00 0.00 C -ATOM 3869 HB2 LEU 246 -6.111 -7.272 5.743 1.00 0.00 H -ATOM 3870 HB3 LEU 246 -5.744 -5.707 6.792 1.00 0.00 H -ATOM 3871 CG LEU 246 -5.469 -5.627 4.698 1.00 0.00 C -ATOM 3872 HG LEU 246 -4.714 -4.843 4.764 1.00 0.00 H -ATOM 3873 CD1 LEU 246 -5.227 -6.381 3.363 1.00 0.00 C -ATOM 3874 HD11 LEU 246 -4.500 -7.154 3.614 1.00 0.00 H -ATOM 3875 HD12 LEU 246 -6.156 -6.881 3.091 1.00 0.00 H -ATOM 3876 HD13 LEU 246 -4.935 -5.765 2.512 1.00 0.00 H -ATOM 3877 CD2 LEU 246 -6.841 -4.993 4.652 1.00 0.00 C -ATOM 3878 HD21 LEU 246 -6.872 -4.414 3.728 1.00 0.00 H -ATOM 3879 HD22 LEU 246 -7.584 -5.785 4.552 1.00 0.00 H -ATOM 3880 HD23 LEU 246 -6.913 -4.360 5.535 1.00 0.00 H -ATOM 3881 C LEU 246 -3.149 -5.948 6.639 1.00 0.00 C -ATOM 3882 O LEU 246 -3.305 -5.094 7.468 1.00 0.00 O -ATOM 3883 N ASN 247 -2.163 -5.877 5.770 1.00 0.00 N -ATOM 3884 H ASN 247 -2.018 -6.657 5.145 1.00 0.00 H -ATOM 3885 CA ASN 247 -1.324 -4.780 5.549 1.00 0.00 C -ATOM 3886 HA ASN 247 -1.306 -4.177 6.458 1.00 0.00 H -ATOM 3887 CB ASN 247 0.127 -5.253 5.216 1.00 0.00 C -ATOM 3888 HB2 ASN 247 0.192 -5.579 4.178 1.00 0.00 H -ATOM 3889 HB3 ASN 247 0.822 -4.427 5.366 1.00 0.00 H -ATOM 3890 CG ASN 247 0.686 -6.291 6.157 1.00 0.00 C -ATOM 3891 OD1 ASN 247 0.880 -6.018 7.334 1.00 0.00 O -ATOM 3892 ND2 ASN 247 0.787 -7.512 5.763 1.00 0.00 N -ATOM 3893 HD21 ASN 247 1.071 -8.147 6.496 1.00 0.00 H -ATOM 3894 HD22 ASN 247 0.390 -7.765 4.868 1.00 0.00 H -ATOM 3895 C ASN 247 -1.736 -3.832 4.434 1.00 0.00 C -ATOM 3896 O ASN 247 -2.045 -4.259 3.319 1.00 0.00 O -ATOM 3897 N LEU 248 -1.637 -2.521 4.695 1.00 0.00 N -ATOM 3898 H LEU 248 -1.162 -2.305 5.559 1.00 0.00 H -ATOM 3899 CA LEU 248 -1.960 -1.490 3.733 1.00 0.00 C -ATOM 3900 HA LEU 248 -2.078 -1.868 2.717 1.00 0.00 H -ATOM 3901 CB LEU 248 -3.254 -0.783 4.073 1.00 0.00 C -ATOM 3902 HB2 LEU 248 -3.293 -0.321 5.059 1.00 0.00 H -ATOM 3903 HB3 LEU 248 -3.344 0.096 3.434 1.00 0.00 H -ATOM 3904 CG LEU 248 -4.560 -1.657 4.152 1.00 0.00 C -ATOM 3905 HG LEU 248 -4.304 -2.412 4.896 1.00 0.00 H -ATOM 3906 CD1 LEU 248 -5.816 -0.866 4.554 1.00 0.00 C -ATOM 3907 HD11 LEU 248 -6.025 -0.169 3.741 1.00 0.00 H -ATOM 3908 HD12 LEU 248 -6.692 -1.501 4.685 1.00 0.00 H -ATOM 3909 HD13 LEU 248 -5.588 -0.273 5.441 1.00 0.00 H -ATOM 3910 CD2 LEU 248 -4.814 -2.256 2.793 1.00 0.00 C -ATOM 3911 HD21 LEU 248 -3.938 -2.876 2.601 1.00 0.00 H -ATOM 3912 HD22 LEU 248 -5.720 -2.862 2.776 1.00 0.00 H -ATOM 3913 HD23 LEU 248 -4.994 -1.448 2.084 1.00 0.00 H -ATOM 3914 C LEU 248 -0.830 -0.482 3.623 1.00 0.00 C -ATOM 3915 O LEU 248 -0.441 0.181 4.619 1.00 0.00 O -ATOM 3916 N VAL 249 -0.162 -0.463 2.429 1.00 0.00 N -ATOM 3917 H VAL 249 -0.329 -1.276 1.855 1.00 0.00 H -ATOM 3918 CA VAL 249 1.195 0.129 2.228 1.00 0.00 C -ATOM 3919 HA VAL 249 1.492 0.613 3.159 1.00 0.00 H -ATOM 3920 CB VAL 249 2.206 -0.999 1.923 1.00 0.00 C -ATOM 3921 HB VAL 249 1.923 -1.480 0.987 1.00 0.00 H -ATOM 3922 CG1 VAL 249 3.540 -0.270 1.895 1.00 0.00 C -ATOM 3923 HG11 VAL 249 3.589 0.413 1.046 1.00 0.00 H -ATOM 3924 HG12 VAL 249 3.789 0.282 2.801 1.00 0.00 H -ATOM 3925 HG13 VAL 249 4.351 -1.000 1.925 1.00 0.00 H -ATOM 3926 CG2 VAL 249 2.282 -2.125 2.910 1.00 0.00 C -ATOM 3927 HG21 VAL 249 2.909 -2.974 2.637 1.00 0.00 H -ATOM 3928 HG22 VAL 249 2.658 -1.702 3.842 1.00 0.00 H -ATOM 3929 HG23 VAL 249 1.308 -2.586 3.072 1.00 0.00 H -ATOM 3930 C VAL 249 1.173 1.250 1.192 1.00 0.00 C -ATOM 3931 O VAL 249 0.943 0.940 -0.024 1.00 0.00 O -ATOM 3932 N ASP 250 1.409 2.458 1.666 1.00 0.00 N -ATOM 3933 H ASP 250 1.574 2.454 2.663 1.00 0.00 H -ATOM 3934 CA ASP 250 1.311 3.667 0.810 1.00 0.00 C -ATOM 3935 HA ASP 250 0.892 3.450 -0.172 1.00 0.00 H -ATOM 3936 CB ASP 250 0.358 4.576 1.575 1.00 0.00 C -ATOM 3937 HB2 ASP 250 -0.623 4.108 1.655 1.00 0.00 H -ATOM 3938 HB3 ASP 250 0.860 4.703 2.533 1.00 0.00 H -ATOM 3939 CG ASP 250 0.344 6.002 0.917 1.00 0.00 C -ATOM 3940 OD1 ASP 250 0.823 6.120 -0.230 1.00 0.00 O -ATOM 3941 OD2 ASP 250 -0.165 6.935 1.594 1.00 0.00 O -ATOM 3942 C ASP 250 2.722 4.196 0.569 1.00 0.00 C -ATOM 3943 O ASP 250 3.294 4.866 1.424 1.00 0.00 O -ATOM 3944 N LEU 251 3.356 3.810 -0.518 1.00 0.00 N -ATOM 3945 H LEU 251 2.865 3.130 -1.080 1.00 0.00 H -ATOM 3946 CA LEU 251 4.774 4.109 -0.874 1.00 0.00 C -ATOM 3947 HA LEU 251 5.408 3.861 -0.022 1.00 0.00 H -ATOM 3948 CB LEU 251 5.196 3.054 -1.920 1.00 0.00 C -ATOM 3949 HB2 LEU 251 4.520 3.145 -2.770 1.00 0.00 H -ATOM 3950 HB3 LEU 251 6.215 3.239 -2.260 1.00 0.00 H -ATOM 3951 CG LEU 251 5.172 1.597 -1.562 1.00 0.00 C -ATOM 3952 HG LEU 251 4.130 1.316 -1.407 1.00 0.00 H -ATOM 3953 CD1 LEU 251 5.577 0.800 -2.801 1.00 0.00 C -ATOM 3954 HD11 LEU 251 6.615 1.035 -3.038 1.00 0.00 H -ATOM 3955 HD12 LEU 251 5.457 -0.267 -2.619 1.00 0.00 H -ATOM 3956 HD13 LEU 251 4.951 1.125 -3.632 1.00 0.00 H -ATOM 3957 CD2 LEU 251 5.993 1.072 -0.358 1.00 0.00 C -ATOM 3958 HD21 LEU 251 5.907 -0.004 -0.211 1.00 0.00 H -ATOM 3959 HD22 LEU 251 7.047 1.350 -0.360 1.00 0.00 H -ATOM 3960 HD23 LEU 251 5.496 1.502 0.513 1.00 0.00 H -ATOM 3961 C LEU 251 5.161 5.534 -1.342 1.00 0.00 C -ATOM 3962 O LEU 251 4.302 6.380 -1.688 1.00 0.00 O -ATOM 3963 N ALA 252 6.462 5.781 -1.393 1.00 0.00 N -ATOM 3964 H ALA 252 7.068 5.154 -0.884 1.00 0.00 H -ATOM 3965 CA ALA 252 7.033 6.998 -2.039 1.00 0.00 C -ATOM 3966 HA ALA 252 6.541 7.936 -1.783 1.00 0.00 H -ATOM 3967 CB ALA 252 8.503 7.002 -1.665 1.00 0.00 C -ATOM 3968 HB1 ALA 252 8.995 7.942 -1.915 1.00 0.00 H -ATOM 3969 HB2 ALA 252 8.648 6.786 -0.607 1.00 0.00 H -ATOM 3970 HB3 ALA 252 9.136 6.213 -2.070 1.00 0.00 H -ATOM 3971 C ALA 252 6.867 6.896 -3.590 1.00 0.00 C -ATOM 3972 O ALA 252 6.204 5.999 -4.148 1.00 0.00 O -ATOM 3973 N GLY 253 7.506 7.898 -4.264 1.00 0.00 N -ATOM 3974 H GLY 253 8.001 8.550 -3.673 1.00 0.00 H -ATOM 3975 CA GLY 253 7.534 8.037 -5.679 1.00 0.00 C -ATOM 3976 HA2 GLY 253 6.494 7.989 -6.003 1.00 0.00 H -ATOM 3977 HA3 GLY 253 7.990 9.010 -5.861 1.00 0.00 H -ATOM 3978 C GLY 253 8.374 6.946 -6.344 1.00 0.00 C -ATOM 3979 O GLY 253 9.534 6.842 -6.088 1.00 0.00 O -ATOM 3980 N SER 254 7.750 6.194 -7.244 1.00 0.00 N -ATOM 3981 H SER 254 6.790 6.419 -7.461 1.00 0.00 H -ATOM 3982 CA SER 254 8.397 5.188 -8.076 1.00 0.00 C -ATOM 3983 HA SER 254 8.934 4.494 -7.429 1.00 0.00 H -ATOM 3984 CB SER 254 7.404 4.263 -8.826 1.00 0.00 C -ATOM 3985 HB2 SER 254 7.904 3.350 -9.148 1.00 0.00 H -ATOM 3986 HB3 SER 254 6.611 4.136 -8.088 1.00 0.00 H -ATOM 3987 OG SER 254 6.819 4.918 -9.950 1.00 0.00 O -ATOM 3988 HG SER 254 7.308 4.790 -10.766 1.00 0.00 H -ATOM 3989 C SER 254 9.386 5.776 -9.170 1.00 0.00 C -ATOM 3990 O SER 254 10.170 5.010 -9.811 1.00 0.00 O -ATOM 3991 N GLU 255 9.120 7.023 -9.625 1.00 0.00 N -ATOM 3992 H GLU 255 8.410 7.556 -9.143 1.00 0.00 H -ATOM 3993 CA GLU 255 9.809 7.681 -10.760 1.00 0.00 C -ATOM 3994 HA GLU 255 9.479 7.186 -11.674 1.00 0.00 H -ATOM 3995 CB GLU 255 9.472 9.186 -10.783 1.00 0.00 C -ATOM 3996 HB2 GLU 255 10.019 9.581 -11.639 1.00 0.00 H -ATOM 3997 HB3 GLU 255 8.436 9.310 -11.097 1.00 0.00 H -ATOM 3998 CG GLU 255 9.870 10.131 -9.595 1.00 0.00 C -ATOM 3999 HG2 GLU 255 10.887 9.924 -9.263 1.00 0.00 H -ATOM 4000 HG3 GLU 255 9.834 11.161 -9.951 1.00 0.00 H -ATOM 4001 CD GLU 255 8.982 10.093 -8.324 1.00 0.00 C -ATOM 4002 OE1 GLU 255 7.983 9.366 -8.195 1.00 0.00 O -ATOM 4003 OE2 GLU 255 9.127 11.076 -7.521 1.00 0.00 O -ATOM 4004 C GLU 255 11.319 7.628 -10.693 1.00 0.00 C -ATOM 4005 O GLU 255 11.955 7.341 -9.677 1.00 0.00 O -ATOM 4006 N ASN 256 12.050 7.913 -11.759 1.00 0.00 N -ATOM 4007 H ASN 256 11.482 7.916 -12.594 1.00 0.00 H -ATOM 4008 CA ASN 256 13.485 7.711 -11.907 1.00 0.00 C -ATOM 4009 HA ASN 256 13.704 6.644 -11.873 1.00 0.00 H -ATOM 4010 CB ASN 256 13.892 8.264 -13.309 1.00 0.00 C -ATOM 4011 HB2 ASN 256 13.048 8.300 -13.998 1.00 0.00 H -ATOM 4012 HB3 ASN 256 14.172 9.311 -13.198 1.00 0.00 H -ATOM 4013 CG ASN 256 15.082 7.461 -13.847 1.00 0.00 C -ATOM 4014 OD1 ASN 256 14.930 6.489 -14.537 1.00 0.00 O -ATOM 4015 ND2 ASN 256 16.296 7.868 -13.546 1.00 0.00 N -ATOM 4016 HD21 ASN 256 17.101 7.289 -13.739 1.00 0.00 H -ATOM 4017 HD22 ASN 256 16.385 8.665 -12.932 1.00 0.00 H -ATOM 4018 C ASN 256 14.381 8.334 -10.752 1.00 0.00 C -ATOM 4019 O ASN 256 15.167 7.634 -10.138 1.00 0.00 O -ATOM 4020 N ILE 257 14.072 9.578 -10.416 1.00 0.00 N -ATOM 4021 H ILE 257 13.390 10.114 -10.933 1.00 0.00 H -ATOM 4022 CA ILE 257 14.846 10.248 -9.339 1.00 0.00 C -ATOM 4023 HA ILE 257 15.855 9.958 -9.629 1.00 0.00 H -ATOM 4024 CB ILE 257 14.643 11.800 -9.479 1.00 0.00 C -ATOM 4025 HB ILE 257 15.071 12.308 -8.614 1.00 0.00 H -ATOM 4026 CG2 ILE 257 15.378 12.374 -10.753 1.00 0.00 C -ATOM 4027 HG21 ILE 257 15.348 13.463 -10.770 1.00 0.00 H -ATOM 4028 HG22 ILE 257 16.400 11.996 -10.786 1.00 0.00 H -ATOM 4029 HG23 ILE 257 14.952 11.920 -11.648 1.00 0.00 H -ATOM 4030 CG1 ILE 257 13.143 12.170 -9.460 1.00 0.00 C -ATOM 4031 HG12 ILE 257 12.607 12.006 -10.395 1.00 0.00 H -ATOM 4032 HG13 ILE 257 12.644 11.590 -8.684 1.00 0.00 H -ATOM 4033 CD1 ILE 257 12.929 13.683 -9.304 1.00 0.00 C -ATOM 4034 HD11 ILE 257 13.329 14.028 -8.351 1.00 0.00 H -ATOM 4035 HD12 ILE 257 13.319 14.253 -10.146 1.00 0.00 H -ATOM 4036 HD13 ILE 257 11.868 13.917 -9.214 1.00 0.00 H -ATOM 4037 C ILE 257 14.543 9.736 -7.877 1.00 0.00 C -ATOM 4038 O ILE 257 15.195 10.081 -6.866 1.00 0.00 O -ATOM 4039 N GLY 258 13.464 9.001 -7.718 1.00 0.00 N -ATOM 4040 H GLY 258 12.981 8.776 -8.576 1.00 0.00 H -ATOM 4041 CA GLY 258 13.016 8.396 -6.494 1.00 0.00 C -ATOM 4042 HA2 GLY 258 13.419 8.934 -5.636 1.00 0.00 H -ATOM 4043 HA3 GLY 258 11.927 8.342 -6.480 1.00 0.00 H -ATOM 4044 C GLY 258 13.377 6.906 -6.407 1.00 0.00 C -ATOM 4045 O GLY 258 13.276 6.392 -5.286 1.00 0.00 O -ATOM 4046 N ARG 259 13.844 6.284 -7.525 1.00 0.00 N -ATOM 4047 H ARG 259 13.844 6.784 -8.402 1.00 0.00 H -ATOM 4048 CA ARG 259 14.354 4.890 -7.541 1.00 0.00 C -ATOM 4049 HA ARG 259 14.366 4.683 -6.471 1.00 0.00 H -ATOM 4050 CB ARG 259 13.366 3.918 -8.303 1.00 0.00 C -ATOM 4051 HB2 ARG 259 13.448 2.918 -7.877 1.00 0.00 H -ATOM 4052 HB3 ARG 259 12.316 4.195 -8.218 1.00 0.00 H -ATOM 4053 CG ARG 259 13.709 3.839 -9.789 1.00 0.00 C -ATOM 4054 HG2 ARG 259 13.833 4.844 -10.193 1.00 0.00 H -ATOM 4055 HG3 ARG 259 14.704 3.402 -9.861 1.00 0.00 H -ATOM 4056 CD ARG 259 12.742 2.974 -10.633 1.00 0.00 C -ATOM 4057 HD2 ARG 259 13.015 1.930 -10.483 1.00 0.00 H -ATOM 4058 HD3 ARG 259 11.749 3.127 -10.211 1.00 0.00 H -ATOM 4059 NE ARG 259 12.878 3.102 -12.093 1.00 0.00 N -ATOM 4060 HE ARG 259 13.475 2.450 -12.584 1.00 0.00 H -ATOM 4061 CZ ARG 259 12.221 3.990 -12.868 1.00 0.00 C -ATOM 4062 NH1 ARG 259 11.367 4.807 -12.380 1.00 0.00 N -ATOM 4063 HH11 ARG 259 10.990 4.655 -11.455 1.00 0.00 H -ATOM 4064 HH12 ARG 259 10.720 5.347 -12.938 1.00 0.00 H -ATOM 4065 NH2 ARG 259 12.417 3.926 -14.145 1.00 0.00 N -ATOM 4066 HH21 ARG 259 13.305 3.489 -14.351 1.00 0.00 H -ATOM 4067 HH22 ARG 259 12.100 4.597 -14.830 1.00 0.00 H -ATOM 4068 C ARG 259 15.813 4.636 -7.915 1.00 0.00 C -ATOM 4069 O ARG 259 16.328 3.498 -7.723 1.00 0.00 O -ATOM 4070 N SER 260 16.486 5.517 -8.577 1.00 0.00 N -ATOM 4071 H SER 260 15.959 6.354 -8.783 1.00 0.00 H -ATOM 4072 CA SER 260 17.891 5.585 -8.998 1.00 0.00 C -ATOM 4073 HA SER 260 18.037 4.671 -9.574 1.00 0.00 H -ATOM 4074 CB SER 260 18.230 6.733 -9.937 1.00 0.00 C -ATOM 4075 HB2 SER 260 17.615 6.657 -10.834 1.00 0.00 H -ATOM 4076 HB3 SER 260 17.953 7.695 -9.509 1.00 0.00 H -ATOM 4077 OG SER 260 19.602 6.663 -10.297 1.00 0.00 O -ATOM 4078 HG SER 260 19.632 6.070 -11.051 1.00 0.00 H -ATOM 4079 C SER 260 18.928 5.547 -7.866 1.00 0.00 C -ATOM 4080 O SER 260 18.790 6.343 -6.961 1.00 0.00 O -ATOM 4081 N GLY 261 20.018 4.792 -8.028 1.00 0.00 N -ATOM 4082 H GLY 261 20.073 4.206 -8.848 1.00 0.00 H -ATOM 4083 CA GLY 261 21.190 4.860 -7.147 1.00 0.00 C -ATOM 4084 HA2 GLY 261 20.797 4.732 -6.138 1.00 0.00 H -ATOM 4085 HA3 GLY 261 21.780 3.953 -7.280 1.00 0.00 H -ATOM 4086 C GLY 261 22.000 6.131 -7.291 1.00 0.00 C -ATOM 4087 O GLY 261 22.210 6.805 -6.319 1.00 0.00 O -ATOM 4088 N ALA 262 22.453 6.507 -8.518 1.00 0.00 N -ATOM 4089 H ALA 262 22.391 5.954 -9.361 1.00 0.00 H -ATOM 4090 CA ALA 262 23.466 7.610 -8.786 1.00 0.00 C -ATOM 4091 HA ALA 262 24.299 7.618 -8.084 1.00 0.00 H -ATOM 4092 CB ALA 262 23.947 7.377 -10.261 1.00 0.00 C -ATOM 4093 HB1 ALA 262 23.071 7.459 -10.903 1.00 0.00 H -ATOM 4094 HB2 ALA 262 24.700 8.140 -10.456 1.00 0.00 H -ATOM 4095 HB3 ALA 262 24.354 6.367 -10.326 1.00 0.00 H -ATOM 4096 C ALA 262 22.880 8.994 -8.698 1.00 0.00 C -ATOM 4097 O ALA 262 23.366 9.922 -9.444 1.00 0.00 O -ATOM 4098 N VAL 263 21.861 9.257 -7.805 1.00 0.00 N -ATOM 4099 H VAL 263 21.703 8.414 -7.273 1.00 0.00 H -ATOM 4100 CA VAL 263 21.398 10.606 -7.360 1.00 0.00 C -ATOM 4101 HA VAL 263 21.461 11.215 -8.261 1.00 0.00 H -ATOM 4102 CB VAL 263 19.943 10.759 -6.927 1.00 0.00 C -ATOM 4103 HB VAL 263 19.778 11.788 -6.610 1.00 0.00 H -ATOM 4104 CG1 VAL 263 19.045 10.505 -8.103 1.00 0.00 C -ATOM 4105 HG11 VAL 263 19.268 11.212 -8.901 1.00 0.00 H -ATOM 4106 HG12 VAL 263 19.204 9.504 -8.505 1.00 0.00 H -ATOM 4107 HG13 VAL 263 18.011 10.652 -7.792 1.00 0.00 H -ATOM 4108 CG2 VAL 263 19.770 9.833 -5.691 1.00 0.00 C -ATOM 4109 HG21 VAL 263 18.760 9.949 -5.298 1.00 0.00 H -ATOM 4110 HG22 VAL 263 19.809 8.808 -6.059 1.00 0.00 H -ATOM 4111 HG23 VAL 263 20.587 9.947 -4.978 1.00 0.00 H -ATOM 4112 C VAL 263 22.321 11.266 -6.309 1.00 0.00 C -ATOM 4113 O VAL 263 22.234 12.522 -6.075 1.00 0.00 O -ATOM 4114 N ASP 264 23.222 10.546 -5.703 1.00 0.00 N -ATOM 4115 H ASP 264 23.170 9.556 -5.891 1.00 0.00 H -ATOM 4116 CA ASP 264 24.228 10.987 -4.686 1.00 0.00 C -ATOM 4117 HA ASP 264 23.683 11.579 -3.951 1.00 0.00 H -ATOM 4118 CB ASP 264 24.753 9.726 -3.922 1.00 0.00 C -ATOM 4119 HB2 ASP 264 25.511 10.121 -3.244 1.00 0.00 H -ATOM 4120 HB3 ASP 264 24.040 9.260 -3.243 1.00 0.00 H -ATOM 4121 CG ASP 264 25.569 8.690 -4.706 1.00 0.00 C -ATOM 4122 OD1 ASP 264 25.390 8.469 -5.948 1.00 0.00 O -ATOM 4123 OD2 ASP 264 26.463 8.150 -4.008 1.00 0.00 O -ATOM 4124 C ASP 264 25.446 11.804 -5.236 1.00 0.00 C -ATOM 4125 O ASP 264 26.465 11.822 -4.548 1.00 0.00 O -ATOM 4126 N LYS 265 25.354 12.578 -6.336 1.00 0.00 N -ATOM 4127 H LYS 265 24.458 12.607 -6.801 1.00 0.00 H -ATOM 4128 CA LYS 265 26.506 13.180 -7.030 1.00 0.00 C -ATOM 4129 HA LYS 265 27.300 12.446 -7.166 1.00 0.00 H -ATOM 4130 CB LYS 265 26.032 13.736 -8.292 1.00 0.00 C -ATOM 4131 HB2 LYS 265 25.421 14.582 -7.976 1.00 0.00 H -ATOM 4132 HB3 LYS 265 26.937 14.073 -8.797 1.00 0.00 H -ATOM 4133 CG LYS 265 25.378 12.824 -9.319 1.00 0.00 C -ATOM 4134 HG2 LYS 265 24.431 12.418 -8.964 1.00 0.00 H -ATOM 4135 HG3 LYS 265 25.031 13.510 -10.092 1.00 0.00 H -ATOM 4136 CD LYS 265 26.348 11.744 -9.933 1.00 0.00 C -ATOM 4137 HD2 LYS 265 27.294 12.215 -10.199 1.00 0.00 H -ATOM 4138 HD3 LYS 265 26.572 10.908 -9.271 1.00 0.00 H -ATOM 4139 CE LYS 265 25.894 11.112 -11.209 1.00 0.00 C -ATOM 4140 HE2 LYS 265 25.016 10.506 -10.982 1.00 0.00 H -ATOM 4141 HE3 LYS 265 25.546 11.906 -11.868 1.00 0.00 H -ATOM 4142 NZ LYS 265 26.917 10.273 -11.775 1.00 0.00 N -ATOM 4143 HZ1 LYS 265 26.952 9.357 -11.352 1.00 0.00 H -ATOM 4144 HZ2 LYS 265 26.639 10.100 -12.731 1.00 0.00 H -ATOM 4145 HZ3 LYS 265 27.853 10.649 -11.827 1.00 0.00 H -ATOM 4146 C LYS 265 27.179 14.241 -6.191 1.00 0.00 C -ATOM 4147 O LYS 265 28.289 14.687 -6.522 1.00 0.00 O -ATOM 4148 N ARG 266 26.488 14.641 -5.060 1.00 0.00 N -ATOM 4149 H ARG 266 25.569 14.233 -4.956 1.00 0.00 H -ATOM 4150 CA ARG 266 27.001 15.654 -4.167 1.00 0.00 C -ATOM 4151 HA ARG 266 28.014 15.906 -4.481 1.00 0.00 H -ATOM 4152 CB ARG 266 26.030 16.855 -4.275 1.00 0.00 C -ATOM 4153 HB2 ARG 266 25.888 17.124 -5.322 1.00 0.00 H -ATOM 4154 HB3 ARG 266 25.035 16.737 -3.847 1.00 0.00 H -ATOM 4155 CG ARG 266 26.725 18.030 -3.503 1.00 0.00 C -ATOM 4156 HG2 ARG 266 26.685 17.825 -2.433 1.00 0.00 H -ATOM 4157 HG3 ARG 266 27.764 18.093 -3.828 1.00 0.00 H -ATOM 4158 CD ARG 266 26.055 19.414 -3.698 1.00 0.00 C -ATOM 4159 HD2 ARG 266 24.996 19.287 -3.474 1.00 0.00 H -ATOM 4160 HD3 ARG 266 26.553 20.098 -3.010 1.00 0.00 H -ATOM 4161 NE ARG 266 26.258 19.933 -5.016 1.00 0.00 N -ATOM 4162 HE ARG 266 26.744 19.299 -5.634 1.00 0.00 H -ATOM 4163 CZ ARG 266 25.989 21.197 -5.411 1.00 0.00 C -ATOM 4164 NH1 ARG 266 25.362 22.107 -4.733 1.00 0.00 N -ATOM 4165 HH11 ARG 266 24.935 21.972 -3.828 1.00 0.00 H -ATOM 4166 HH12 ARG 266 25.419 23.043 -5.109 1.00 0.00 H -ATOM 4167 NH2 ARG 266 26.465 21.546 -6.529 1.00 0.00 N -ATOM 4168 HH21 ARG 266 26.910 20.878 -7.143 1.00 0.00 H -ATOM 4169 HH22 ARG 266 26.158 22.444 -6.876 1.00 0.00 H -ATOM 4170 C ARG 266 27.090 15.200 -2.718 1.00 0.00 C -ATOM 4171 O ARG 266 28.092 15.562 -2.104 1.00 0.00 O -ATOM 4172 N ALA 267 26.244 14.264 -2.301 1.00 0.00 N -ATOM 4173 H ALA 267 25.479 13.896 -2.848 1.00 0.00 H -ATOM 4174 CA ALA 267 26.340 13.502 -1.014 1.00 0.00 C -ATOM 4175 HA ALA 267 27.366 13.135 -0.971 1.00 0.00 H -ATOM 4176 CB ALA 267 25.926 14.393 0.157 1.00 0.00 C -ATOM 4177 HB1 ALA 267 26.386 15.374 0.049 1.00 0.00 H -ATOM 4178 HB2 ALA 267 24.851 14.578 0.126 1.00 0.00 H -ATOM 4179 HB3 ALA 267 26.223 13.957 1.111 1.00 0.00 H -ATOM 4180 C ALA 267 25.536 12.200 -1.021 1.00 0.00 C -ATOM 4181 O ALA 267 24.488 12.159 -1.624 1.00 0.00 O -ATOM 4182 N ARG 268 25.910 11.237 -0.234 1.00 0.00 N -ATOM 4183 H ARG 268 26.718 11.512 0.304 1.00 0.00 H -ATOM 4184 CA ARG 268 25.406 9.841 -0.122 1.00 0.00 C -ATOM 4185 HA ARG 268 25.587 9.393 -1.100 1.00 0.00 H -ATOM 4186 CB ARG 268 26.386 9.203 0.895 1.00 0.00 C -ATOM 4187 HB2 ARG 268 26.436 9.869 1.756 1.00 0.00 H -ATOM 4188 HB3 ARG 268 26.069 8.180 1.102 1.00 0.00 H -ATOM 4189 CG ARG 268 27.882 9.042 0.348 1.00 0.00 C -ATOM 4190 HG2 ARG 268 28.061 8.372 -0.493 1.00 0.00 H -ATOM 4191 HG3 ARG 268 28.330 9.988 0.045 1.00 0.00 H -ATOM 4192 CD ARG 268 28.920 8.471 1.312 1.00 0.00 C -ATOM 4193 HD2 ARG 268 29.231 9.282 1.969 1.00 0.00 H -ATOM 4194 HD3 ARG 268 28.476 7.744 1.992 1.00 0.00 H -ATOM 4195 NE ARG 268 30.142 7.907 0.666 1.00 0.00 N -ATOM 4196 HE ARG 268 30.954 8.479 0.488 1.00 0.00 H -ATOM 4197 CZ ARG 268 30.354 6.627 0.571 1.00 0.00 C -ATOM 4198 NH1 ARG 268 29.522 5.693 0.705 1.00 0.00 N -ATOM 4199 HH11 ARG 268 28.549 5.935 0.833 1.00 0.00 H -ATOM 4200 HH12 ARG 268 29.836 4.734 0.671 1.00 0.00 H -ATOM 4201 NH2 ARG 268 31.601 6.226 0.362 1.00 0.00 N -ATOM 4202 HH21 ARG 268 32.354 6.875 0.181 1.00 0.00 H -ATOM 4203 HH22 ARG 268 31.752 5.229 0.397 1.00 0.00 H -ATOM 4204 C ARG 268 23.929 9.670 0.155 1.00 0.00 C -ATOM 4205 O ARG 268 23.375 8.614 -0.147 1.00 0.00 O -ATOM 4206 N GLU 269 23.354 10.652 0.906 1.00 0.00 N -ATOM 4207 H GLU 269 23.816 11.549 0.955 1.00 0.00 H -ATOM 4208 CA GLU 269 21.957 10.457 1.391 1.00 0.00 C -ATOM 4209 HA GLU 269 21.845 9.557 1.996 1.00 0.00 H -ATOM 4210 CB GLU 269 21.729 11.743 2.212 1.00 0.00 C -ATOM 4211 HB2 GLU 269 21.790 12.601 1.543 1.00 0.00 H -ATOM 4212 HB3 GLU 269 20.680 11.763 2.510 1.00 0.00 H -ATOM 4213 CG GLU 269 22.665 12.081 3.428 1.00 0.00 C -ATOM 4214 HG2 GLU 269 23.660 12.297 3.037 1.00 0.00 H -ATOM 4215 HG3 GLU 269 22.313 13.009 3.878 1.00 0.00 H -ATOM 4216 CD GLU 269 22.836 11.016 4.499 1.00 0.00 C -ATOM 4217 OE1 GLU 269 23.885 11.146 5.177 1.00 0.00 O -ATOM 4218 OE2 GLU 269 21.992 10.165 4.663 1.00 0.00 O -ATOM 4219 C GLU 269 20.808 10.520 0.424 1.00 0.00 C -ATOM 4220 O GLU 269 19.857 9.859 0.793 1.00 0.00 O -ATOM 4221 N ALA 270 20.905 11.197 -0.679 1.00 0.00 N -ATOM 4222 H ALA 270 21.627 11.875 -0.879 1.00 0.00 H -ATOM 4223 CA ALA 270 19.852 11.044 -1.692 1.00 0.00 C -ATOM 4224 HA ALA 270 18.825 11.145 -1.341 1.00 0.00 H -ATOM 4225 CB ALA 270 20.110 12.089 -2.812 1.00 0.00 C -ATOM 4226 HB1 ALA 270 19.372 11.994 -3.608 1.00 0.00 H -ATOM 4227 HB2 ALA 270 19.879 13.097 -2.465 1.00 0.00 H -ATOM 4228 HB3 ALA 270 21.141 12.059 -3.165 1.00 0.00 H -ATOM 4229 C ALA 270 19.906 9.573 -2.156 1.00 0.00 C -ATOM 4230 O ALA 270 18.840 8.919 -2.300 1.00 0.00 O -ATOM 4231 N GLY 271 21.098 8.944 -2.178 1.00 0.00 N -ATOM 4232 H GLY 271 21.907 9.519 -1.993 1.00 0.00 H -ATOM 4233 CA GLY 271 21.323 7.555 -2.559 1.00 0.00 C -ATOM 4234 HA2 GLY 271 20.932 7.342 -3.553 1.00 0.00 H -ATOM 4235 HA3 GLY 271 22.408 7.554 -2.664 1.00 0.00 H -ATOM 4236 C GLY 271 20.771 6.542 -1.624 1.00 0.00 C -ATOM 4237 O GLY 271 20.243 5.524 -2.018 1.00 0.00 O -ATOM 4238 N ASN 272 20.734 6.918 -0.369 1.00 0.00 N -ATOM 4239 H ASN 272 21.188 7.763 -0.051 1.00 0.00 H -ATOM 4240 CA ASN 272 20.156 6.078 0.692 1.00 0.00 C -ATOM 4241 HA ASN 272 20.123 5.042 0.359 1.00 0.00 H -ATOM 4242 CB ASN 272 21.056 6.147 1.993 1.00 0.00 C -ATOM 4243 HB2 ASN 272 22.115 6.027 1.763 1.00 0.00 H -ATOM 4244 HB3 ASN 272 20.961 7.134 2.444 1.00 0.00 H -ATOM 4245 CG ASN 272 20.587 5.113 3.035 1.00 0.00 C -ATOM 4246 OD1 ASN 272 21.003 3.918 2.964 1.00 0.00 O -ATOM 4247 ND2 ASN 272 19.824 5.451 4.082 1.00 0.00 N -ATOM 4248 HD21 ASN 272 19.443 4.733 4.680 1.00 0.00 H -ATOM 4249 HD22 ASN 272 19.537 6.419 4.127 1.00 0.00 H -ATOM 4250 C ASN 272 18.636 6.422 0.958 1.00 0.00 C -ATOM 4251 O ASN 272 17.842 5.576 1.405 1.00 0.00 O -ATOM 4252 N ILE 273 18.211 7.609 0.476 1.00 0.00 N -ATOM 4253 H ILE 273 18.873 8.317 0.190 1.00 0.00 H -ATOM 4254 CA ILE 273 16.755 7.868 0.553 1.00 0.00 C -ATOM 4255 HA ILE 273 16.366 7.495 1.500 1.00 0.00 H -ATOM 4256 CB ILE 273 16.493 9.492 0.461 1.00 0.00 C -ATOM 4257 HB ILE 273 17.111 9.745 -0.400 1.00 0.00 H -ATOM 4258 CG2 ILE 273 15.018 9.885 0.124 1.00 0.00 C -ATOM 4259 HG21 ILE 273 14.301 9.681 0.918 1.00 0.00 H -ATOM 4260 HG22 ILE 273 14.909 10.936 -0.144 1.00 0.00 H -ATOM 4261 HG23 ILE 273 14.625 9.293 -0.703 1.00 0.00 H -ATOM 4262 CG1 ILE 273 16.994 10.179 1.750 1.00 0.00 C -ATOM 4263 HG12 ILE 273 16.203 10.130 2.498 1.00 0.00 H -ATOM 4264 HG13 ILE 273 17.950 9.789 2.099 1.00 0.00 H -ATOM 4265 CD1 ILE 273 17.175 11.644 1.564 1.00 0.00 C -ATOM 4266 HD11 ILE 273 16.261 12.125 1.215 1.00 0.00 H -ATOM 4267 HD12 ILE 273 17.392 12.077 2.540 1.00 0.00 H -ATOM 4268 HD13 ILE 273 17.929 11.986 0.855 1.00 0.00 H -ATOM 4269 C ILE 273 16.083 7.100 -0.529 1.00 0.00 C -ATOM 4270 O ILE 273 14.948 6.554 -0.391 1.00 0.00 O -ATOM 4271 N ASN 274 16.743 6.933 -1.715 1.00 0.00 N -ATOM 4272 H ASN 274 17.633 7.403 -1.792 1.00 0.00 H -ATOM 4273 CA ASN 274 16.332 5.993 -2.730 1.00 0.00 C -ATOM 4274 HA ASN 274 15.253 6.115 -2.831 1.00 0.00 H -ATOM 4275 CB ASN 274 16.956 6.379 -4.101 1.00 0.00 C -ATOM 4276 HB2 ASN 274 18.043 6.388 -4.026 1.00 0.00 H -ATOM 4277 HB3 ASN 274 16.823 5.590 -4.840 1.00 0.00 H -ATOM 4278 CG ASN 274 16.366 7.691 -4.682 1.00 0.00 C -ATOM 4279 OD1 ASN 274 15.624 8.418 -4.015 1.00 0.00 O -ATOM 4280 ND2 ASN 274 16.507 7.881 -5.987 1.00 0.00 N -ATOM 4281 HD21 ASN 274 16.145 8.768 -6.308 1.00 0.00 H -ATOM 4282 HD22 ASN 274 17.225 7.354 -6.463 1.00 0.00 H -ATOM 4283 C ASN 274 16.626 4.499 -2.459 1.00 0.00 C -ATOM 4284 O ASN 274 16.136 3.719 -3.284 1.00 0.00 O -ATOM 4285 N GLN 275 17.402 4.141 -1.441 1.00 0.00 N -ATOM 4286 H GLN 275 17.725 4.786 -0.734 1.00 0.00 H -ATOM 4287 CA GLN 275 17.773 2.743 -1.285 1.00 0.00 C -ATOM 4288 HA GLN 275 18.353 2.582 -2.195 1.00 0.00 H -ATOM 4289 CB GLN 275 18.844 2.627 -0.070 1.00 0.00 C -ATOM 4290 HB2 GLN 275 19.829 3.040 -0.291 1.00 0.00 H -ATOM 4291 HB3 GLN 275 18.529 3.314 0.715 1.00 0.00 H -ATOM 4292 CG GLN 275 19.176 1.201 0.420 1.00 0.00 C -ATOM 4293 HG2 GLN 275 19.663 1.378 1.379 1.00 0.00 H -ATOM 4294 HG3 GLN 275 18.233 0.764 0.744 1.00 0.00 H -ATOM 4295 CD GLN 275 20.012 0.318 -0.471 1.00 0.00 C -ATOM 4296 OE1 GLN 275 20.369 0.658 -1.617 1.00 0.00 O -ATOM 4297 NE2 GLN 275 20.562 -0.770 -0.027 1.00 0.00 N -ATOM 4298 HE21 GLN 275 21.138 -1.294 -0.670 1.00 0.00 H -ATOM 4299 HE22 GLN 275 20.263 -1.289 0.787 1.00 0.00 H -ATOM 4300 C GLN 275 16.656 1.777 -1.177 1.00 0.00 C -ATOM 4301 O GLN 275 16.748 0.657 -1.712 1.00 0.00 O -ATOM 4302 N SER 276 15.511 2.222 -0.592 1.00 0.00 N -ATOM 4303 H SER 276 15.508 3.084 -0.065 1.00 0.00 H -ATOM 4304 CA SER 276 14.177 1.558 -0.642 1.00 0.00 C -ATOM 4305 HA SER 276 14.176 0.621 -0.087 1.00 0.00 H -ATOM 4306 CB SER 276 13.129 2.380 0.097 1.00 0.00 C -ATOM 4307 HB2 SER 276 12.102 2.039 -0.034 1.00 0.00 H -ATOM 4308 HB3 SER 276 13.437 2.325 1.141 1.00 0.00 H -ATOM 4309 OG SER 276 13.177 3.689 -0.297 1.00 0.00 O -ATOM 4310 HG SER 276 13.956 4.147 0.027 1.00 0.00 H -ATOM 4311 C SER 276 13.645 1.130 -1.999 1.00 0.00 C -ATOM 4312 O SER 276 13.511 -0.053 -2.202 1.00 0.00 O -ATOM 4313 N LEU 277 13.425 2.014 -3.012 1.00 0.00 N -ATOM 4314 H LEU 277 13.384 2.982 -2.725 1.00 0.00 H -ATOM 4315 CA LEU 277 12.875 1.659 -4.286 1.00 0.00 C -ATOM 4316 HA LEU 277 12.278 0.749 -4.221 1.00 0.00 H -ATOM 4317 CB LEU 277 11.980 2.679 -4.886 1.00 0.00 C -ATOM 4318 HB2 LEU 277 12.498 3.618 -5.078 1.00 0.00 H -ATOM 4319 HB3 LEU 277 11.608 2.274 -5.827 1.00 0.00 H -ATOM 4320 CG LEU 277 10.847 3.149 -3.985 1.00 0.00 C -ATOM 4321 HG LEU 277 11.239 3.784 -3.192 1.00 0.00 H -ATOM 4322 CD1 LEU 277 9.821 4.037 -4.740 1.00 0.00 C -ATOM 4323 HD11 LEU 277 9.077 4.384 -4.022 1.00 0.00 H -ATOM 4324 HD12 LEU 277 10.459 4.841 -5.109 1.00 0.00 H -ATOM 4325 HD13 LEU 277 9.304 3.611 -5.600 1.00 0.00 H -ATOM 4326 CD2 LEU 277 10.046 1.916 -3.587 1.00 0.00 C -ATOM 4327 HD21 LEU 277 9.673 1.315 -4.416 1.00 0.00 H -ATOM 4328 HD22 LEU 277 10.649 1.197 -3.031 1.00 0.00 H -ATOM 4329 HD23 LEU 277 9.183 2.241 -3.006 1.00 0.00 H -ATOM 4330 C LEU 277 13.961 1.144 -5.222 1.00 0.00 C -ATOM 4331 O LEU 277 13.588 0.371 -6.142 1.00 0.00 O -ATOM 4332 N LEU 278 15.252 1.468 -4.959 1.00 0.00 N -ATOM 4333 H LEU 278 15.469 2.188 -4.285 1.00 0.00 H -ATOM 4334 CA LEU 278 16.266 0.720 -5.641 1.00 0.00 C -ATOM 4335 HA LEU 278 16.216 0.715 -6.730 1.00 0.00 H -ATOM 4336 CB LEU 278 17.672 1.316 -5.379 1.00 0.00 C -ATOM 4337 HB2 LEU 278 17.752 2.338 -5.750 1.00 0.00 H -ATOM 4338 HB3 LEU 278 17.864 1.339 -4.307 1.00 0.00 H -ATOM 4339 CG LEU 278 18.874 0.475 -5.942 1.00 0.00 C -ATOM 4340 HG LEU 278 18.778 -0.586 -5.711 1.00 0.00 H -ATOM 4341 CD1 LEU 278 18.840 0.641 -7.445 1.00 0.00 C -ATOM 4342 HD11 LEU 278 17.939 0.116 -7.763 1.00 0.00 H -ATOM 4343 HD12 LEU 278 18.937 1.684 -7.746 1.00 0.00 H -ATOM 4344 HD13 LEU 278 19.701 0.164 -7.912 1.00 0.00 H -ATOM 4345 CD2 LEU 278 20.169 1.119 -5.481 1.00 0.00 C -ATOM 4346 HD21 LEU 278 20.275 2.171 -5.740 1.00 0.00 H -ATOM 4347 HD22 LEU 278 20.235 1.050 -4.394 1.00 0.00 H -ATOM 4348 HD23 LEU 278 20.994 0.528 -5.877 1.00 0.00 H -ATOM 4349 C LEU 278 16.283 -0.763 -5.233 1.00 0.00 C -ATOM 4350 O LEU 278 16.414 -1.645 -6.072 1.00 0.00 O -ATOM 4351 N THR 279 16.217 -1.041 -3.912 1.00 0.00 N -ATOM 4352 H THR 279 16.235 -0.237 -3.301 1.00 0.00 H -ATOM 4353 CA THR 279 16.181 -2.424 -3.306 1.00 0.00 C -ATOM 4354 HA THR 279 17.025 -2.948 -3.756 1.00 0.00 H -ATOM 4355 CB THR 279 16.431 -2.421 -1.826 1.00 0.00 C -ATOM 4356 HB THR 279 15.611 -1.893 -1.339 1.00 0.00 H -ATOM 4357 CG2 THR 279 16.634 -3.836 -1.166 1.00 0.00 C -ATOM 4358 HG21 THR 279 17.273 -4.454 -1.797 1.00 0.00 H -ATOM 4359 HG22 THR 279 17.150 -3.745 -0.211 1.00 0.00 H -ATOM 4360 HG23 THR 279 15.642 -4.267 -1.026 1.00 0.00 H -ATOM 4361 OG1 THR 279 17.618 -1.712 -1.591 1.00 0.00 O -ATOM 4362 HG1 THR 279 17.293 -0.815 -1.687 1.00 0.00 H -ATOM 4363 C THR 279 14.981 -3.227 -3.664 1.00 0.00 C -ATOM 4364 O THR 279 15.140 -4.435 -3.995 1.00 0.00 O -ATOM 4365 N LEU 280 13.731 -2.699 -3.693 1.00 0.00 N -ATOM 4366 H LEU 280 13.543 -1.858 -3.166 1.00 0.00 H -ATOM 4367 CA LEU 280 12.605 -3.216 -4.338 1.00 0.00 C -ATOM 4368 HA LEU 280 12.277 -4.080 -3.758 1.00 0.00 H -ATOM 4369 CB LEU 280 11.396 -2.258 -4.073 1.00 0.00 C -ATOM 4370 HB2 LEU 280 11.484 -1.901 -3.047 1.00 0.00 H -ATOM 4371 HB3 LEU 280 11.589 -1.368 -4.672 1.00 0.00 H -ATOM 4372 CG LEU 280 10.056 -2.843 -4.374 1.00 0.00 C -ATOM 4373 HG LEU 280 9.985 -2.916 -5.459 1.00 0.00 H -ATOM 4374 CD1 LEU 280 9.833 -4.295 -3.874 1.00 0.00 C -ATOM 4375 HD11 LEU 280 10.501 -4.872 -4.513 1.00 0.00 H -ATOM 4376 HD12 LEU 280 10.255 -4.337 -2.869 1.00 0.00 H -ATOM 4377 HD13 LEU 280 8.801 -4.630 -3.976 1.00 0.00 H -ATOM 4378 CD2 LEU 280 9.027 -1.857 -3.751 1.00 0.00 C -ATOM 4379 HD21 LEU 280 8.892 -2.013 -2.680 1.00 0.00 H -ATOM 4380 HD22 LEU 280 9.154 -0.799 -3.972 1.00 0.00 H -ATOM 4381 HD23 LEU 280 8.076 -2.050 -4.248 1.00 0.00 H -ATOM 4382 C LEU 280 12.844 -3.721 -5.734 1.00 0.00 C -ATOM 4383 O LEU 280 12.726 -4.918 -6.052 1.00 0.00 O -ATOM 4384 N GLY 281 13.394 -2.836 -6.553 1.00 0.00 N -ATOM 4385 H GLY 281 13.546 -1.857 -6.357 1.00 0.00 H -ATOM 4386 CA GLY 281 13.756 -3.240 -7.934 1.00 0.00 C -ATOM 4387 HA2 GLY 281 12.807 -3.511 -8.394 1.00 0.00 H -ATOM 4388 HA3 GLY 281 14.216 -2.336 -8.335 1.00 0.00 H -ATOM 4389 C GLY 281 14.708 -4.455 -8.044 1.00 0.00 C -ATOM 4390 O GLY 281 14.491 -5.418 -8.791 1.00 0.00 O -ATOM 4391 N ARG 282 15.715 -4.570 -7.159 1.00 0.00 N -ATOM 4392 H ARG 282 15.848 -3.757 -6.576 1.00 0.00 H -ATOM 4393 CA ARG 282 16.674 -5.707 -6.985 1.00 0.00 C -ATOM 4394 HA ARG 282 17.052 -5.895 -7.991 1.00 0.00 H -ATOM 4395 CB ARG 282 17.758 -5.373 -5.976 1.00 0.00 C -ATOM 4396 HB2 ARG 282 17.276 -5.163 -5.022 1.00 0.00 H -ATOM 4397 HB3 ARG 282 18.380 -6.250 -5.799 1.00 0.00 H -ATOM 4398 CG ARG 282 18.663 -4.145 -6.437 1.00 0.00 C -ATOM 4399 HG2 ARG 282 19.083 -4.366 -7.418 1.00 0.00 H -ATOM 4400 HG3 ARG 282 18.069 -3.235 -6.535 1.00 0.00 H -ATOM 4401 CD ARG 282 19.625 -3.790 -5.280 1.00 0.00 C -ATOM 4402 HD2 ARG 282 20.198 -2.878 -5.444 1.00 0.00 H -ATOM 4403 HD3 ARG 282 19.103 -3.570 -4.348 1.00 0.00 H -ATOM 4404 NE ARG 282 20.563 -4.905 -5.060 1.00 0.00 N -ATOM 4405 HE ARG 282 20.729 -5.432 -5.905 1.00 0.00 H -ATOM 4406 CZ ARG 282 21.325 -5.173 -4.009 1.00 0.00 C -ATOM 4407 NH1 ARG 282 21.308 -4.382 -2.972 1.00 0.00 N -ATOM 4408 HH11 ARG 282 20.753 -3.540 -3.024 1.00 0.00 H -ATOM 4409 HH12 ARG 282 22.046 -4.511 -2.294 1.00 0.00 H -ATOM 4410 NH2 ARG 282 22.021 -6.295 -4.001 1.00 0.00 N -ATOM 4411 HH21 ARG 282 21.871 -6.902 -4.795 1.00 0.00 H -ATOM 4412 HH22 ARG 282 22.500 -6.617 -3.173 1.00 0.00 H -ATOM 4413 C ARG 282 15.949 -6.969 -6.534 1.00 0.00 C -ATOM 4414 O ARG 282 16.075 -7.939 -7.223 1.00 0.00 O -ATOM 4415 N VAL 283 15.162 -6.898 -5.503 1.00 0.00 N -ATOM 4416 H VAL 283 15.025 -6.020 -5.024 1.00 0.00 H -ATOM 4417 CA VAL 283 14.200 -7.917 -5.034 1.00 0.00 C -ATOM 4418 HA VAL 283 14.819 -8.765 -4.740 1.00 0.00 H -ATOM 4419 CB VAL 283 13.378 -7.393 -3.782 1.00 0.00 C -ATOM 4420 HB VAL 283 13.084 -6.373 -4.033 1.00 0.00 H -ATOM 4421 CG1 VAL 283 12.143 -8.155 -3.287 1.00 0.00 C -ATOM 4422 HG11 VAL 283 11.492 -8.168 -4.161 1.00 0.00 H -ATOM 4423 HG12 VAL 283 12.428 -9.155 -2.962 1.00 0.00 H -ATOM 4424 HG13 VAL 283 11.671 -7.579 -2.492 1.00 0.00 H -ATOM 4425 CG2 VAL 283 14.253 -7.361 -2.565 1.00 0.00 C -ATOM 4426 HG21 VAL 283 13.624 -7.017 -1.743 1.00 0.00 H -ATOM 4427 HG22 VAL 283 14.531 -8.367 -2.250 1.00 0.00 H -ATOM 4428 HG23 VAL 283 15.143 -6.821 -2.885 1.00 0.00 H -ATOM 4429 C VAL 283 13.300 -8.465 -6.040 1.00 0.00 C -ATOM 4430 O VAL 283 13.296 -9.685 -6.236 1.00 0.00 O -ATOM 4431 N ILE 284 12.652 -7.588 -6.823 1.00 0.00 N -ATOM 4432 H ILE 284 12.729 -6.608 -6.589 1.00 0.00 H -ATOM 4433 CA ILE 284 11.680 -8.001 -7.895 1.00 0.00 C -ATOM 4434 HA ILE 284 11.154 -8.848 -7.456 1.00 0.00 H -ATOM 4435 CB ILE 284 10.796 -6.841 -8.302 1.00 0.00 C -ATOM 4436 HB ILE 284 11.401 -5.935 -8.267 1.00 0.00 H -ATOM 4437 CG2 ILE 284 10.195 -6.861 -9.674 1.00 0.00 C -ATOM 4438 HG21 ILE 284 10.932 -6.517 -10.399 1.00 0.00 H -ATOM 4439 HG22 ILE 284 9.717 -7.803 -9.947 1.00 0.00 H -ATOM 4440 HG23 ILE 284 9.509 -6.022 -9.790 1.00 0.00 H -ATOM 4441 CG1 ILE 284 9.761 -6.664 -7.173 1.00 0.00 C -ATOM 4442 HG12 ILE 284 10.202 -6.615 -6.178 1.00 0.00 H -ATOM 4443 HG13 ILE 284 9.368 -5.666 -7.370 1.00 0.00 H -ATOM 4444 CD1 ILE 284 8.558 -7.594 -7.227 1.00 0.00 C -ATOM 4445 HD11 ILE 284 8.134 -7.521 -6.224 1.00 0.00 H -ATOM 4446 HD12 ILE 284 7.954 -7.142 -8.014 1.00 0.00 H -ATOM 4447 HD13 ILE 284 8.910 -8.549 -7.615 1.00 0.00 H -ATOM 4448 C ILE 284 12.315 -8.685 -9.103 1.00 0.00 C -ATOM 4449 O ILE 284 11.808 -9.754 -9.554 1.00 0.00 O -ATOM 4450 N THR 285 13.495 -8.157 -9.520 1.00 0.00 N -ATOM 4451 H THR 285 13.687 -7.233 -9.163 1.00 0.00 H -ATOM 4452 CA THR 285 14.381 -8.751 -10.580 1.00 0.00 C -ATOM 4453 HA THR 285 13.794 -8.832 -11.495 1.00 0.00 H -ATOM 4454 CB THR 285 15.570 -7.816 -10.820 1.00 0.00 C -ATOM 4455 HB THR 285 16.015 -7.531 -9.867 1.00 0.00 H -ATOM 4456 CG2 THR 285 16.555 -8.461 -11.834 1.00 0.00 C -ATOM 4457 HG21 THR 285 16.874 -9.439 -11.474 1.00 0.00 H -ATOM 4458 HG22 THR 285 16.066 -8.552 -12.804 1.00 0.00 H -ATOM 4459 HG23 THR 285 17.424 -7.814 -11.950 1.00 0.00 H -ATOM 4460 OG1 THR 285 15.139 -6.668 -11.449 1.00 0.00 O -ATOM 4461 HG1 THR 285 15.180 -5.906 -10.865 1.00 0.00 H -ATOM 4462 C THR 285 14.821 -10.155 -10.161 1.00 0.00 C -ATOM 4463 O THR 285 14.670 -11.075 -10.934 1.00 0.00 O -ATOM 4464 N ALA 286 15.300 -10.245 -8.937 1.00 0.00 N -ATOM 4465 H ALA 286 15.305 -9.377 -8.422 1.00 0.00 H -ATOM 4466 CA ALA 286 15.716 -11.471 -8.336 1.00 0.00 C -ATOM 4467 HA ALA 286 16.487 -11.962 -8.930 1.00 0.00 H -ATOM 4468 CB ALA 286 16.529 -11.209 -7.064 1.00 0.00 C -ATOM 4469 HB1 ALA 286 15.994 -10.791 -6.211 1.00 0.00 H -ATOM 4470 HB2 ALA 286 16.927 -12.157 -6.704 1.00 0.00 H -ATOM 4471 HB3 ALA 286 17.358 -10.579 -7.385 1.00 0.00 H -ATOM 4472 C ALA 286 14.602 -12.586 -8.216 1.00 0.00 C -ATOM 4473 O ALA 286 14.885 -13.721 -8.565 1.00 0.00 O -ATOM 4474 N LEU 287 13.390 -12.239 -7.750 1.00 0.00 N -ATOM 4475 H LEU 287 13.253 -11.300 -7.407 1.00 0.00 H -ATOM 4476 CA LEU 287 12.185 -13.103 -7.658 1.00 0.00 C -ATOM 4477 HA LEU 287 12.539 -13.914 -7.021 1.00 0.00 H -ATOM 4478 CB LEU 287 11.084 -12.299 -6.979 1.00 0.00 C -ATOM 4479 HB2 LEU 287 10.918 -11.382 -7.543 1.00 0.00 H -ATOM 4480 HB3 LEU 287 10.146 -12.853 -7.036 1.00 0.00 H -ATOM 4481 CG LEU 287 11.257 -12.020 -5.495 1.00 0.00 C -ATOM 4482 HG LEU 287 12.222 -11.553 -5.300 1.00 0.00 H -ATOM 4483 CD1 LEU 287 10.435 -10.754 -4.945 1.00 0.00 C -ATOM 4484 HD11 LEU 287 10.850 -10.352 -4.022 1.00 0.00 H -ATOM 4485 HD12 LEU 287 10.487 -9.942 -5.671 1.00 0.00 H -ATOM 4486 HD13 LEU 287 9.409 -11.058 -4.734 1.00 0.00 H -ATOM 4487 CD2 LEU 287 11.100 -13.125 -4.538 1.00 0.00 C -ATOM 4488 HD21 LEU 287 11.692 -13.971 -4.885 1.00 0.00 H -ATOM 4489 HD22 LEU 287 11.594 -12.803 -3.622 1.00 0.00 H -ATOM 4490 HD23 LEU 287 10.043 -13.340 -4.378 1.00 0.00 H -ATOM 4491 C LEU 287 11.800 -13.670 -8.971 1.00 0.00 C -ATOM 4492 O LEU 287 11.629 -14.914 -9.086 1.00 0.00 O -ATOM 4493 N VAL 288 11.669 -12.854 -9.970 1.00 0.00 N -ATOM 4494 H VAL 288 11.835 -11.863 -9.857 1.00 0.00 H -ATOM 4495 CA VAL 288 11.321 -13.276 -11.385 1.00 0.00 C -ATOM 4496 HA VAL 288 10.552 -14.034 -11.243 1.00 0.00 H -ATOM 4497 CB VAL 288 10.703 -12.105 -12.161 1.00 0.00 C -ATOM 4498 HB VAL 288 11.462 -11.322 -12.148 1.00 0.00 H -ATOM 4499 CG1 VAL 288 10.195 -12.367 -13.536 1.00 0.00 C -ATOM 4500 HG11 VAL 288 9.445 -13.156 -13.600 1.00 0.00 H -ATOM 4501 HG12 VAL 288 9.904 -11.473 -14.086 1.00 0.00 H -ATOM 4502 HG13 VAL 288 10.988 -12.841 -14.114 1.00 0.00 H -ATOM 4503 CG2 VAL 288 9.556 -11.351 -11.455 1.00 0.00 C -ATOM 4504 HG21 VAL 288 8.661 -11.962 -11.338 1.00 0.00 H -ATOM 4505 HG22 VAL 288 9.818 -11.198 -10.409 1.00 0.00 H -ATOM 4506 HG23 VAL 288 9.437 -10.361 -11.893 1.00 0.00 H -ATOM 4507 C VAL 288 12.416 -13.977 -12.046 1.00 0.00 C -ATOM 4508 O VAL 288 12.180 -14.665 -13.018 1.00 0.00 O -ATOM 4509 N GLU 289 13.647 -13.877 -11.595 1.00 0.00 N -ATOM 4510 H GLU 289 13.785 -13.141 -10.919 1.00 0.00 H -ATOM 4511 CA GLU 289 14.758 -14.763 -11.977 1.00 0.00 C -ATOM 4512 HA GLU 289 14.669 -14.861 -13.059 1.00 0.00 H -ATOM 4513 CB GLU 289 16.090 -13.936 -11.786 1.00 0.00 C -ATOM 4514 HB2 GLU 289 16.195 -13.088 -12.462 1.00 0.00 H -ATOM 4515 HB3 GLU 289 16.227 -13.439 -10.824 1.00 0.00 H -ATOM 4516 CG GLU 289 17.426 -14.715 -11.886 1.00 0.00 C -ATOM 4517 HG2 GLU 289 18.251 -14.087 -11.552 1.00 0.00 H -ATOM 4518 HG3 GLU 289 17.401 -15.651 -11.330 1.00 0.00 H -ATOM 4519 CD GLU 289 17.695 -15.124 -13.361 1.00 0.00 C -ATOM 4520 OE1 GLU 289 16.996 -14.744 -14.337 1.00 0.00 O -ATOM 4521 OE2 GLU 289 18.815 -15.672 -13.471 1.00 0.00 O -ATOM 4522 C GLU 289 14.766 -16.113 -11.236 1.00 0.00 C -ATOM 4523 O GLU 289 15.414 -17.031 -11.750 1.00 0.00 O -ATOM 4524 N ARG 290 14.035 -16.167 -10.103 1.00 0.00 N -ATOM 4525 H ARG 290 13.607 -15.324 -9.747 1.00 0.00 H -ATOM 4526 CA ARG 290 13.816 -17.322 -9.159 1.00 0.00 C -ATOM 4527 HA ARG 290 13.137 -17.028 -8.357 1.00 0.00 H -ATOM 4528 CB ARG 290 12.999 -18.382 -9.904 1.00 0.00 C -ATOM 4529 HB2 ARG 290 13.636 -18.677 -10.737 1.00 0.00 H -ATOM 4530 HB3 ARG 290 12.921 -19.187 -9.173 1.00 0.00 H -ATOM 4531 CG ARG 290 11.583 -17.862 -10.189 1.00 0.00 C -ATOM 4532 HG2 ARG 290 11.125 -17.767 -9.205 1.00 0.00 H -ATOM 4533 HG3 ARG 290 11.654 -16.867 -10.627 1.00 0.00 H -ATOM 4534 CD ARG 290 10.768 -18.843 -11.061 1.00 0.00 C -ATOM 4535 HD2 ARG 290 9.859 -18.326 -11.369 1.00 0.00 H -ATOM 4536 HD3 ARG 290 11.310 -19.053 -11.984 1.00 0.00 H -ATOM 4537 NE ARG 290 10.533 -20.033 -10.248 1.00 0.00 N -ATOM 4538 HE ARG 290 10.596 -19.896 -9.250 1.00 0.00 H -ATOM 4539 CZ ARG 290 10.577 -21.275 -10.459 1.00 0.00 C -ATOM 4540 NH1 ARG 290 10.922 -21.773 -11.585 1.00 0.00 N -ATOM 4541 HH11 ARG 290 10.955 -21.180 -12.402 1.00 0.00 H -ATOM 4542 HH12 ARG 290 11.497 -22.601 -11.633 1.00 0.00 H -ATOM 4543 NH2 ARG 290 10.549 -22.072 -9.455 1.00 0.00 N -ATOM 4544 HH21 ARG 290 10.633 -21.739 -8.504 1.00 0.00 H -ATOM 4545 HH22 ARG 290 10.417 -23.067 -9.575 1.00 0.00 H -ATOM 4546 C ARG 290 15.136 -17.758 -8.505 1.00 0.00 C -ATOM 4547 O ARG 290 15.507 -18.922 -8.405 1.00 0.00 O -ATOM 4548 N THR 291 16.085 -16.815 -8.231 1.00 0.00 N -ATOM 4549 H THR 291 15.916 -15.835 -8.404 1.00 0.00 H -ATOM 4550 CA THR 291 17.344 -17.064 -7.493 1.00 0.00 C -ATOM 4551 HA THR 291 17.762 -18.043 -7.727 1.00 0.00 H -ATOM 4552 CB THR 291 18.422 -15.960 -7.866 1.00 0.00 C -ATOM 4553 HB THR 291 18.680 -16.144 -8.908 1.00 0.00 H -ATOM 4554 CG2 THR 291 17.914 -14.546 -7.669 1.00 0.00 C -ATOM 4555 HG21 THR 291 17.228 -14.293 -8.477 1.00 0.00 H -ATOM 4556 HG22 THR 291 17.409 -14.475 -6.705 1.00 0.00 H -ATOM 4557 HG23 THR 291 18.706 -13.803 -7.773 1.00 0.00 H -ATOM 4558 OG1 THR 291 19.556 -16.107 -6.987 1.00 0.00 O -ATOM 4559 HG1 THR 291 20.076 -16.896 -7.151 1.00 0.00 H -ATOM 4560 C THR 291 16.986 -17.034 -6.011 1.00 0.00 C -ATOM 4561 O THR 291 16.155 -16.205 -5.591 1.00 0.00 O -ATOM 4562 N PRO 292 17.627 -17.849 -5.111 1.00 0.00 N -ATOM 4563 CD PRO 292 18.619 -18.884 -5.423 1.00 0.00 C -ATOM 4564 HD2 PRO 292 19.466 -18.511 -5.998 1.00 0.00 H -ATOM 4565 HD3 PRO 292 18.094 -19.753 -5.820 1.00 0.00 H -ATOM 4566 CG PRO 292 19.266 -19.244 -4.084 1.00 0.00 C -ATOM 4567 HG2 PRO 292 20.139 -18.609 -3.928 1.00 0.00 H -ATOM 4568 HG3 PRO 292 19.624 -20.273 -4.053 1.00 0.00 H -ATOM 4569 CB PRO 292 18.156 -18.950 -3.054 1.00 0.00 C -ATOM 4570 HB2 PRO 292 18.556 -18.519 -2.138 1.00 0.00 H -ATOM 4571 HB3 PRO 292 17.434 -19.765 -3.020 1.00 0.00 H -ATOM 4572 CA PRO 292 17.520 -17.675 -3.629 1.00 0.00 C -ATOM 4573 HA PRO 292 16.461 -17.556 -3.401 1.00 0.00 H -ATOM 4574 C PRO 292 18.222 -16.367 -3.165 1.00 0.00 C -ATOM 4575 O PRO 292 17.945 -15.885 -2.033 1.00 0.00 O -ATOM 4576 N HIE 293 18.924 -15.621 -4.068 1.00 0.00 N -ATOM 4577 H HIE 293 19.031 -15.990 -5.002 1.00 0.00 H -ATOM 4578 CA HIE 293 19.719 -14.393 -3.845 1.00 0.00 C -ATOM 4579 HA HIE 293 20.024 -14.547 -2.810 1.00 0.00 H -ATOM 4580 CB HIE 293 21.015 -14.246 -4.692 1.00 0.00 C -ATOM 4581 HB2 HIE 293 20.729 -13.937 -5.698 1.00 0.00 H -ATOM 4582 HB3 HIE 293 21.627 -13.491 -4.201 1.00 0.00 H -ATOM 4583 CG HIE 293 21.674 -15.588 -4.746 1.00 0.00 C -ATOM 4584 ND1 HIE 293 21.990 -16.284 -3.598 1.00 0.00 N -ATOM 4585 CE1 HIE 293 22.549 -17.435 -3.985 1.00 0.00 C -ATOM 4586 HE1 HIE 293 22.934 -18.159 -3.282 1.00 0.00 H -ATOM 4587 NE2 HIE 293 22.794 -17.409 -5.319 1.00 0.00 N -ATOM 4588 HE2 HIE 293 23.434 -17.981 -5.851 1.00 0.00 H -ATOM 4589 CD2 HIE 293 22.322 -16.231 -5.792 1.00 0.00 C -ATOM 4590 HD2 HIE 293 22.577 -15.856 -6.773 1.00 0.00 H -ATOM 4591 C HIE 293 18.856 -13.094 -3.852 1.00 0.00 C -ATOM 4592 O HIE 293 19.312 -12.052 -4.219 1.00 0.00 O -ATOM 4593 N VAL 294 17.580 -13.106 -3.453 1.00 0.00 N -ATOM 4594 H VAL 294 17.160 -14.002 -3.255 1.00 0.00 H -ATOM 4595 CA VAL 294 16.717 -11.944 -3.238 1.00 0.00 C -ATOM 4596 HA VAL 294 16.664 -11.410 -4.186 1.00 0.00 H -ATOM 4597 CB VAL 294 15.245 -12.465 -2.834 1.00 0.00 C -ATOM 4598 HB VAL 294 15.210 -12.713 -1.773 1.00 0.00 H -ATOM 4599 CG1 VAL 294 14.299 -11.243 -3.095 1.00 0.00 C -ATOM 4600 HG11 VAL 294 14.094 -11.157 -4.161 1.00 0.00 H -ATOM 4601 HG12 VAL 294 13.362 -11.497 -2.600 1.00 0.00 H -ATOM 4602 HG13 VAL 294 14.722 -10.341 -2.652 1.00 0.00 H -ATOM 4603 CG2 VAL 294 14.706 -13.692 -3.601 1.00 0.00 C -ATOM 4604 HG21 VAL 294 14.854 -13.572 -4.674 1.00 0.00 H -ATOM 4605 HG22 VAL 294 15.244 -14.620 -3.405 1.00 0.00 H -ATOM 4606 HG23 VAL 294 13.687 -13.863 -3.252 1.00 0.00 H -ATOM 4607 C VAL 294 17.358 -11.088 -2.097 1.00 0.00 C -ATOM 4608 O VAL 294 17.505 -11.660 -1.004 1.00 0.00 O -ATOM 4609 N PRO 295 17.743 -9.807 -2.338 1.00 0.00 N -ATOM 4610 CD PRO 295 17.896 -9.189 -3.666 1.00 0.00 C -ATOM 4611 HD2 PRO 295 16.987 -8.960 -4.222 1.00 0.00 H -ATOM 4612 HD3 PRO 295 18.613 -9.788 -4.229 1.00 0.00 H -ATOM 4613 CG PRO 295 18.635 -7.847 -3.478 1.00 0.00 C -ATOM 4614 HG2 PRO 295 18.018 -6.949 -3.471 1.00 0.00 H -ATOM 4615 HG3 PRO 295 19.375 -7.725 -4.268 1.00 0.00 H -ATOM 4616 CB PRO 295 19.351 -7.939 -2.080 1.00 0.00 C -ATOM 4617 HB2 PRO 295 19.599 -6.935 -1.737 1.00 0.00 H -ATOM 4618 HB3 PRO 295 20.266 -8.483 -2.317 1.00 0.00 H -ATOM 4619 CA PRO 295 18.378 -8.967 -1.313 1.00 0.00 C -ATOM 4620 HA PRO 295 18.891 -9.624 -0.612 1.00 0.00 H -ATOM 4621 C PRO 295 17.281 -8.248 -0.505 1.00 0.00 C -ATOM 4622 O PRO 295 17.242 -7.017 -0.595 1.00 0.00 O -ATOM 4623 N TYR 296 16.487 -9.002 0.291 1.00 0.00 N -ATOM 4624 H TYR 296 16.698 -9.990 0.331 1.00 0.00 H -ATOM 4625 CA TYR 296 15.491 -8.339 1.114 1.00 0.00 C -ATOM 4626 HA TYR 296 14.817 -7.822 0.430 1.00 0.00 H -ATOM 4627 CB TYR 296 14.789 -9.447 1.884 1.00 0.00 C -ATOM 4628 HB2 TYR 296 15.542 -9.987 2.457 1.00 0.00 H -ATOM 4629 HB3 TYR 296 14.123 -8.957 2.593 1.00 0.00 H -ATOM 4630 CG TYR 296 13.849 -10.339 1.114 1.00 0.00 C -ATOM 4631 CD1 TYR 296 12.700 -9.853 0.412 1.00 0.00 C -ATOM 4632 HD1 TYR 296 12.565 -8.782 0.442 1.00 0.00 H -ATOM 4633 CE1 TYR 296 11.893 -10.681 -0.358 1.00 0.00 C -ATOM 4634 HE1 TYR 296 11.130 -10.190 -0.944 1.00 0.00 H -ATOM 4635 CZ TYR 296 12.049 -12.082 -0.232 1.00 0.00 C -ATOM 4636 OH TYR 296 11.120 -12.899 -0.730 1.00 0.00 O -ATOM 4637 HH TYR 296 10.305 -12.449 -0.967 1.00 0.00 H -ATOM 4638 CE2 TYR 296 13.127 -12.604 0.513 1.00 0.00 C -ATOM 4639 HE2 TYR 296 13.257 -13.667 0.647 1.00 0.00 H -ATOM 4640 CD2 TYR 296 14.045 -11.728 1.151 1.00 0.00 C -ATOM 4641 HD2 TYR 296 14.904 -12.157 1.645 1.00 0.00 H -ATOM 4642 C TYR 296 16.169 -7.382 2.093 1.00 0.00 C -ATOM 4643 O TYR 296 15.714 -6.209 2.272 1.00 0.00 O -ATOM 4644 N ARG 297 17.184 -7.904 2.801 1.00 0.00 N -ATOM 4645 H ARG 297 17.512 -8.825 2.545 1.00 0.00 H -ATOM 4646 CA ARG 297 18.006 -7.264 3.892 1.00 0.00 C -ATOM 4647 HA ARG 297 17.349 -7.071 4.739 1.00 0.00 H -ATOM 4648 CB ARG 297 19.014 -8.250 4.513 1.00 0.00 C -ATOM 4649 HB2 ARG 297 18.508 -9.192 4.724 1.00 0.00 H -ATOM 4650 HB3 ARG 297 19.849 -8.405 3.830 1.00 0.00 H -ATOM 4651 CG ARG 297 19.535 -7.761 5.873 1.00 0.00 C -ATOM 4652 HG2 ARG 297 20.130 -6.850 5.820 1.00 0.00 H -ATOM 4653 HG3 ARG 297 18.652 -7.633 6.500 1.00 0.00 H -ATOM 4654 CD ARG 297 20.522 -8.777 6.444 1.00 0.00 C -ATOM 4655 HD2 ARG 297 20.129 -9.790 6.522 1.00 0.00 H -ATOM 4656 HD3 ARG 297 21.334 -8.832 5.717 1.00 0.00 H -ATOM 4657 NE ARG 297 20.955 -8.369 7.814 1.00 0.00 N -ATOM 4658 HE ARG 297 21.790 -7.807 7.890 1.00 0.00 H -ATOM 4659 CZ ARG 297 20.302 -8.676 8.953 1.00 0.00 C -ATOM 4660 NH1 ARG 297 19.056 -9.003 9.037 1.00 0.00 N -ATOM 4661 HH11 ARG 297 18.517 -9.286 8.231 1.00 0.00 H -ATOM 4662 HH12 ARG 297 18.625 -8.891 9.944 1.00 0.00 H -ATOM 4663 NH2 ARG 297 20.983 -8.452 10.054 1.00 0.00 N -ATOM 4664 HH21 ARG 297 21.850 -7.937 10.116 1.00 0.00 H -ATOM 4665 HH22 ARG 297 20.709 -8.851 10.940 1.00 0.00 H -ATOM 4666 C ARG 297 18.570 -5.901 3.619 1.00 0.00 C -ATOM 4667 O ARG 297 18.555 -5.112 4.539 1.00 0.00 O -ATOM 4668 N GLU 298 18.978 -5.524 2.478 1.00 0.00 N -ATOM 4669 H GLU 298 18.653 -6.248 1.853 1.00 0.00 H -ATOM 4670 CA GLU 298 19.569 -4.257 2.082 1.00 0.00 C -ATOM 4671 HA GLU 298 20.385 -4.186 2.801 1.00 0.00 H -ATOM 4672 CB GLU 298 20.219 -4.304 0.722 1.00 0.00 C -ATOM 4673 HB2 GLU 298 19.422 -4.501 0.004 1.00 0.00 H -ATOM 4674 HB3 GLU 298 20.580 -3.285 0.581 1.00 0.00 H -ATOM 4675 CG GLU 298 21.276 -5.408 0.601 1.00 0.00 C -ATOM 4676 HG2 GLU 298 20.752 -6.351 0.445 1.00 0.00 H -ATOM 4677 HG3 GLU 298 21.820 -5.271 -0.334 1.00 0.00 H -ATOM 4678 CD GLU 298 22.257 -5.655 1.753 1.00 0.00 C -ATOM 4679 OE1 GLU 298 22.865 -4.685 2.214 1.00 0.00 O -ATOM 4680 OE2 GLU 298 22.437 -6.826 2.243 1.00 0.00 O -ATOM 4681 C GLU 298 18.686 -2.999 2.236 1.00 0.00 C -ATOM 4682 O GLU 298 19.227 -1.903 2.080 1.00 0.00 O -ATOM 4683 N SER 299 17.327 -3.086 2.456 1.00 0.00 N -ATOM 4684 H SER 299 16.845 -3.957 2.626 1.00 0.00 H -ATOM 4685 CA SER 299 16.417 -1.979 2.773 1.00 0.00 C -ATOM 4686 HA SER 299 17.042 -1.203 3.217 1.00 0.00 H -ATOM 4687 CB SER 299 15.734 -1.379 1.586 1.00 0.00 C -ATOM 4688 HB2 SER 299 16.449 -0.888 0.927 1.00 0.00 H -ATOM 4689 HB3 SER 299 15.095 -2.148 1.153 1.00 0.00 H -ATOM 4690 OG SER 299 14.881 -0.278 1.983 1.00 0.00 O -ATOM 4691 HG SER 299 15.371 0.493 2.275 1.00 0.00 H -ATOM 4692 C SER 299 15.324 -2.412 3.726 1.00 0.00 C -ATOM 4693 O SER 299 14.890 -3.589 3.649 1.00 0.00 O -ATOM 4694 N LYS 300 14.862 -1.608 4.661 1.00 0.00 N -ATOM 4695 H LYS 300 15.380 -0.743 4.717 1.00 0.00 H -ATOM 4696 CA LYS 300 13.936 -1.954 5.751 1.00 0.00 C -ATOM 4697 HA LYS 300 14.293 -2.942 6.043 1.00 0.00 H -ATOM 4698 CB LYS 300 14.073 -0.884 6.920 1.00 0.00 C -ATOM 4699 HB2 LYS 300 13.870 0.083 6.461 1.00 0.00 H -ATOM 4700 HB3 LYS 300 13.404 -1.212 7.717 1.00 0.00 H -ATOM 4701 CG LYS 300 15.500 -1.037 7.455 1.00 0.00 C -ATOM 4702 HG2 LYS 300 15.675 -2.078 7.723 1.00 0.00 H -ATOM 4703 HG3 LYS 300 16.234 -0.774 6.692 1.00 0.00 H -ATOM 4704 CD LYS 300 15.627 -0.016 8.584 1.00 0.00 C -ATOM 4705 HD2 LYS 300 15.255 0.968 8.300 1.00 0.00 H -ATOM 4706 HD3 LYS 300 15.248 -0.318 9.560 1.00 0.00 H -ATOM 4707 CE LYS 300 17.121 0.121 8.856 1.00 0.00 C -ATOM 4708 HE2 LYS 300 17.351 -0.893 9.182 1.00 0.00 H -ATOM 4709 HE3 LYS 300 17.570 0.279 7.876 1.00 0.00 H -ATOM 4710 NZ LYS 300 17.394 1.202 9.800 1.00 0.00 N -ATOM 4711 HZ1 LYS 300 16.841 1.095 10.637 1.00 0.00 H -ATOM 4712 HZ2 LYS 300 18.374 1.158 10.039 1.00 0.00 H -ATOM 4713 HZ3 LYS 300 17.181 2.089 9.366 1.00 0.00 H -ATOM 4714 C LYS 300 12.522 -2.095 5.300 1.00 0.00 C -ATOM 4715 O LYS 300 11.886 -2.937 5.834 1.00 0.00 O -ATOM 4716 N LEU 301 12.102 -1.423 4.241 1.00 0.00 N -ATOM 4717 H LEU 301 12.656 -0.648 3.906 1.00 0.00 H -ATOM 4718 CA LEU 301 10.907 -1.709 3.468 1.00 0.00 C -ATOM 4719 HA LEU 301 10.065 -1.520 4.135 1.00 0.00 H -ATOM 4720 CB LEU 301 11.078 -0.714 2.267 1.00 0.00 C -ATOM 4721 HB2 LEU 301 11.132 0.290 2.688 1.00 0.00 H -ATOM 4722 HB3 LEU 301 11.956 -1.031 1.705 1.00 0.00 H -ATOM 4723 CG LEU 301 9.770 -0.820 1.371 1.00 0.00 C -ATOM 4724 HG LEU 301 9.597 -1.851 1.062 1.00 0.00 H -ATOM 4725 CD1 LEU 301 8.446 -0.393 1.949 1.00 0.00 C -ATOM 4726 HD11 LEU 301 8.416 0.685 2.110 1.00 0.00 H -ATOM 4727 HD12 LEU 301 7.610 -0.612 1.285 1.00 0.00 H -ATOM 4728 HD13 LEU 301 8.297 -1.089 2.774 1.00 0.00 H -ATOM 4729 CD2 LEU 301 9.943 -0.009 0.134 1.00 0.00 C -ATOM 4730 HD21 LEU 301 9.869 1.018 0.492 1.00 0.00 H -ATOM 4731 HD22 LEU 301 10.927 -0.183 -0.301 1.00 0.00 H -ATOM 4732 HD23 LEU 301 9.148 -0.267 -0.566 1.00 0.00 H -ATOM 4733 C LEU 301 10.844 -3.133 3.044 1.00 0.00 C -ATOM 4734 O LEU 301 9.808 -3.803 3.154 1.00 0.00 O -ATOM 4735 N THR 302 11.845 -3.631 2.328 1.00 0.00 N -ATOM 4736 H THR 302 12.715 -3.119 2.346 1.00 0.00 H -ATOM 4737 CA THR 302 11.939 -5.031 1.907 1.00 0.00 C -ATOM 4738 HA THR 302 10.927 -5.221 1.548 1.00 0.00 H -ATOM 4739 CB THR 302 12.798 -5.132 0.644 1.00 0.00 C -ATOM 4740 HB THR 302 12.839 -6.178 0.341 1.00 0.00 H -ATOM 4741 CG2 THR 302 12.191 -4.394 -0.567 1.00 0.00 C -ATOM 4742 HG21 THR 302 11.108 -4.515 -0.605 1.00 0.00 H -ATOM 4743 HG22 THR 302 12.471 -3.341 -0.599 1.00 0.00 H -ATOM 4744 HG23 THR 302 12.686 -4.706 -1.486 1.00 0.00 H -ATOM 4745 OG1 THR 302 14.062 -4.490 0.859 1.00 0.00 O -ATOM 4746 HG1 THR 302 14.602 -4.959 1.497 1.00 0.00 H -ATOM 4747 C THR 302 12.129 -6.121 3.029 1.00 0.00 C -ATOM 4748 O THR 302 11.358 -7.028 3.092 1.00 0.00 O -ATOM 4749 N ARG 303 12.993 -5.782 4.012 1.00 0.00 N -ATOM 4750 H ARG 303 13.468 -4.904 3.854 1.00 0.00 H -ATOM 4751 CA ARG 303 13.279 -6.503 5.206 1.00 0.00 C -ATOM 4752 HA ARG 303 13.619 -7.483 4.871 1.00 0.00 H -ATOM 4753 CB ARG 303 14.433 -5.783 5.873 1.00 0.00 C -ATOM 4754 HB2 ARG 303 15.241 -5.619 5.160 1.00 0.00 H -ATOM 4755 HB3 ARG 303 14.148 -4.781 6.195 1.00 0.00 H -ATOM 4756 CG ARG 303 15.105 -6.610 6.960 1.00 0.00 C -ATOM 4757 HG2 ARG 303 14.395 -6.971 7.705 1.00 0.00 H -ATOM 4758 HG3 ARG 303 15.563 -7.528 6.591 1.00 0.00 H -ATOM 4759 CD ARG 303 16.258 -5.759 7.490 1.00 0.00 C -ATOM 4760 HD2 ARG 303 17.057 -5.733 6.749 1.00 0.00 H -ATOM 4761 HD3 ARG 303 15.998 -4.710 7.624 1.00 0.00 H -ATOM 4762 NE ARG 303 16.812 -6.168 8.839 1.00 0.00 N -ATOM 4763 HE ARG 303 16.447 -7.012 9.254 1.00 0.00 H -ATOM 4764 CZ ARG 303 17.855 -5.651 9.455 1.00 0.00 C -ATOM 4765 NH1 ARG 303 18.506 -4.618 8.993 1.00 0.00 N -ATOM 4766 HH11 ARG 303 18.114 -4.202 8.160 1.00 0.00 H -ATOM 4767 HH12 ARG 303 19.257 -4.123 9.453 1.00 0.00 H -ATOM 4768 NH2 ARG 303 18.363 -6.121 10.582 1.00 0.00 N -ATOM 4769 HH21 ARG 303 18.155 -7.015 11.000 1.00 0.00 H -ATOM 4770 HH22 ARG 303 19.146 -5.603 10.956 1.00 0.00 H -ATOM 4771 C ARG 303 12.103 -6.658 6.204 1.00 0.00 C -ATOM 4772 O ARG 303 11.983 -7.744 6.805 1.00 0.00 O -ATOM 4773 N ILE 304 11.202 -5.672 6.365 1.00 0.00 N -ATOM 4774 H ILE 304 11.474 -4.760 6.025 1.00 0.00 H -ATOM 4775 CA ILE 304 9.940 -5.768 7.162 1.00 0.00 C -ATOM 4776 HA ILE 304 10.091 -6.347 8.072 1.00 0.00 H -ATOM 4777 CB ILE 304 9.419 -4.309 7.484 1.00 0.00 C -ATOM 4778 HB ILE 304 9.273 -3.788 6.537 1.00 0.00 H -ATOM 4779 CG2 ILE 304 8.062 -4.512 8.216 1.00 0.00 C -ATOM 4780 HG21 ILE 304 7.675 -3.668 8.786 1.00 0.00 H -ATOM 4781 HG22 ILE 304 7.307 -4.943 7.558 1.00 0.00 H -ATOM 4782 HG23 ILE 304 8.253 -5.315 8.928 1.00 0.00 H -ATOM 4783 CG1 ILE 304 10.279 -3.520 8.485 1.00 0.00 C -ATOM 4784 HG12 ILE 304 10.059 -3.832 9.505 1.00 0.00 H -ATOM 4785 HG13 ILE 304 11.342 -3.657 8.290 1.00 0.00 H -ATOM 4786 CD1 ILE 304 9.949 -2.059 8.399 1.00 0.00 C -ATOM 4787 HD11 ILE 304 8.866 -1.956 8.470 1.00 0.00 H -ATOM 4788 HD12 ILE 304 10.487 -1.452 9.127 1.00 0.00 H -ATOM 4789 HD13 ILE 304 10.188 -1.647 7.419 1.00 0.00 H -ATOM 4790 C ILE 304 8.895 -6.665 6.407 1.00 0.00 C -ATOM 4791 O ILE 304 8.254 -7.516 7.004 1.00 0.00 O -ATOM 4792 N LEU 305 8.636 -6.357 5.059 1.00 0.00 N -ATOM 4793 H LEU 305 9.243 -5.634 4.699 1.00 0.00 H -ATOM 4794 CA LEU 305 7.634 -6.927 4.151 1.00 0.00 C -ATOM 4795 HA LEU 305 6.832 -7.390 4.725 1.00 0.00 H -ATOM 4796 CB LEU 305 6.896 -5.751 3.475 1.00 0.00 C -ATOM 4797 HB2 LEU 305 7.655 -5.375 2.789 1.00 0.00 H -ATOM 4798 HB3 LEU 305 6.055 -6.015 2.834 1.00 0.00 H -ATOM 4799 CG LEU 305 6.447 -4.627 4.353 1.00 0.00 C -ATOM 4800 HG LEU 305 7.279 -4.301 4.976 1.00 0.00 H -ATOM 4801 CD1 LEU 305 5.843 -3.422 3.600 1.00 0.00 C -ATOM 4802 HD11 LEU 305 6.719 -2.926 3.184 1.00 0.00 H -ATOM 4803 HD12 LEU 305 5.180 -3.728 2.791 1.00 0.00 H -ATOM 4804 HD13 LEU 305 5.431 -2.656 4.258 1.00 0.00 H -ATOM 4805 CD2 LEU 305 5.326 -5.016 5.356 1.00 0.00 C -ATOM 4806 HD21 LEU 305 5.541 -5.920 5.927 1.00 0.00 H -ATOM 4807 HD22 LEU 305 5.084 -4.231 6.072 1.00 0.00 H -ATOM 4808 HD23 LEU 305 4.473 -5.334 4.756 1.00 0.00 H -ATOM 4809 C LEU 305 7.989 -8.084 3.247 1.00 0.00 C -ATOM 4810 O LEU 305 7.357 -8.459 2.295 1.00 0.00 O -ATOM 4811 N GLN 306 9.082 -8.734 3.638 1.00 0.00 N -ATOM 4812 H GLN 306 9.527 -8.340 4.456 1.00 0.00 H -ATOM 4813 CA GLN 306 9.573 -10.042 3.094 1.00 0.00 C -ATOM 4814 HA GLN 306 9.883 -9.805 2.077 1.00 0.00 H -ATOM 4815 CB GLN 306 10.901 -10.482 3.741 1.00 0.00 C -ATOM 4816 HB2 GLN 306 11.190 -11.488 3.433 1.00 0.00 H -ATOM 4817 HB3 GLN 306 11.772 -9.830 3.673 1.00 0.00 H -ATOM 4818 CG GLN 306 10.770 -10.770 5.232 1.00 0.00 C -ATOM 4819 HG2 GLN 306 11.694 -10.559 5.770 1.00 0.00 H -ATOM 4820 HG3 GLN 306 10.117 -10.012 5.667 1.00 0.00 H -ATOM 4821 CD GLN 306 10.222 -12.129 5.626 1.00 0.00 C -ATOM 4822 OE1 GLN 306 10.232 -13.106 4.866 1.00 0.00 O -ATOM 4823 NE2 GLN 306 9.532 -12.188 6.749 1.00 0.00 N -ATOM 4824 HE21 GLN 306 9.117 -13.053 7.065 1.00 0.00 H -ATOM 4825 HE22 GLN 306 9.524 -11.346 7.307 1.00 0.00 H -ATOM 4826 C GLN 306 8.514 -11.169 3.064 1.00 0.00 C -ATOM 4827 O GLN 306 8.485 -11.972 2.169 1.00 0.00 O -ATOM 4828 N ASP 307 7.497 -11.227 3.969 1.00 0.00 N -ATOM 4829 H ASP 307 7.497 -10.599 4.759 1.00 0.00 H -ATOM 4830 CA ASP 307 6.359 -12.217 3.857 1.00 0.00 C -ATOM 4831 HA ASP 307 6.732 -13.182 3.513 1.00 0.00 H -ATOM 4832 CB ASP 307 5.683 -12.353 5.253 1.00 0.00 C -ATOM 4833 HB2 ASP 307 6.416 -12.207 6.046 1.00 0.00 H -ATOM 4834 HB3 ASP 307 4.922 -11.581 5.361 1.00 0.00 H -ATOM 4835 CG ASP 307 5.095 -13.760 5.406 1.00 0.00 C -ATOM 4836 OD1 ASP 307 5.865 -14.748 5.205 1.00 0.00 O -ATOM 4837 OD2 ASP 307 3.846 -13.891 5.649 1.00 0.00 O -ATOM 4838 C ASP 307 5.295 -11.863 2.887 1.00 0.00 C -ATOM 4839 O ASP 307 4.642 -12.795 2.407 1.00 0.00 O -ATOM 4840 N SER 308 5.200 -10.574 2.525 1.00 0.00 N -ATOM 4841 H SER 308 5.840 -9.889 2.901 1.00 0.00 H -ATOM 4842 CA SER 308 4.342 -10.086 1.498 1.00 0.00 C -ATOM 4843 HA SER 308 3.335 -10.491 1.607 1.00 0.00 H -ATOM 4844 CB SER 308 4.132 -8.570 1.585 1.00 0.00 C -ATOM 4845 HB2 SER 308 5.054 -7.988 1.554 1.00 0.00 H -ATOM 4846 HB3 SER 308 3.539 -8.228 0.737 1.00 0.00 H -ATOM 4847 OG SER 308 3.405 -8.297 2.756 1.00 0.00 O -ATOM 4848 HG SER 308 3.922 -8.552 3.524 1.00 0.00 H -ATOM 4849 C SER 308 4.968 -10.459 0.138 1.00 0.00 C -ATOM 4850 O SER 308 4.308 -10.968 -0.790 1.00 0.00 O -ATOM 4851 N LEU 309 6.241 -10.102 -0.038 1.00 0.00 N -ATOM 4852 H LEU 309 6.623 -9.547 0.714 1.00 0.00 H -ATOM 4853 CA LEU 309 7.031 -10.078 -1.265 1.00 0.00 C -ATOM 4854 HA LEU 309 6.310 -9.860 -2.053 1.00 0.00 H -ATOM 4855 CB LEU 309 8.113 -8.989 -1.041 1.00 0.00 C -ATOM 4856 HB2 LEU 309 8.671 -9.183 -0.126 1.00 0.00 H -ATOM 4857 HB3 LEU 309 8.907 -9.132 -1.774 1.00 0.00 H -ATOM 4858 CG LEU 309 7.660 -7.535 -1.094 1.00 0.00 C -ATOM 4859 HG LEU 309 6.766 -7.364 -0.494 1.00 0.00 H -ATOM 4860 CD1 LEU 309 8.822 -6.588 -0.551 1.00 0.00 C -ATOM 4861 HD11 LEU 309 9.261 -6.894 0.399 1.00 0.00 H -ATOM 4862 HD12 LEU 309 9.552 -6.511 -1.356 1.00 0.00 H -ATOM 4863 HD13 LEU 309 8.425 -5.573 -0.543 1.00 0.00 H -ATOM 4864 CD2 LEU 309 7.311 -7.127 -2.507 1.00 0.00 C -ATOM 4865 HD21 LEU 309 6.509 -7.664 -3.012 1.00 0.00 H -ATOM 4866 HD22 LEU 309 6.912 -6.113 -2.450 1.00 0.00 H -ATOM 4867 HD23 LEU 309 8.232 -7.325 -3.056 1.00 0.00 H -ATOM 4868 C LEU 309 7.579 -11.484 -1.493 1.00 0.00 C -ATOM 4869 O LEU 309 8.776 -11.779 -1.487 1.00 0.00 O -ATOM 4870 N GLY 310 6.640 -12.416 -1.789 1.00 0.00 N -ATOM 4871 H GLY 310 5.676 -12.117 -1.780 1.00 0.00 H -ATOM 4872 CA GLY 310 6.885 -13.790 -2.256 1.00 0.00 C -ATOM 4873 HA2 GLY 310 6.116 -14.054 -2.982 1.00 0.00 H -ATOM 4874 HA3 GLY 310 7.865 -13.804 -2.735 1.00 0.00 H -ATOM 4875 C GLY 310 6.695 -14.908 -1.220 1.00 0.00 C -ATOM 4876 O GLY 310 6.912 -16.126 -1.508 1.00 0.00 O -ATOM 4877 N GLY 311 6.456 -14.491 0.040 1.00 0.00 N -ATOM 4878 H GLY 311 6.459 -13.487 0.141 1.00 0.00 H -ATOM 4879 CA GLY 311 6.294 -15.272 1.314 1.00 0.00 C -ATOM 4880 HA2 GLY 311 6.805 -16.224 1.169 1.00 0.00 H -ATOM 4881 HA3 GLY 311 6.624 -14.731 2.201 1.00 0.00 H -ATOM 4882 C GLY 311 4.873 -15.737 1.635 1.00 0.00 C -ATOM 4883 O GLY 311 4.115 -15.880 0.684 1.00 0.00 O -ATOM 4884 N ARG 312 4.486 -15.969 2.849 1.00 0.00 N -ATOM 4885 H ARG 312 4.988 -15.674 3.674 1.00 0.00 H -ATOM 4886 CA ARG 312 3.151 -16.549 3.158 1.00 0.00 C -ATOM 4887 HA ARG 312 2.929 -17.255 2.358 1.00 0.00 H -ATOM 4888 CB ARG 312 3.182 -17.386 4.421 1.00 0.00 C -ATOM 4889 HB2 ARG 312 3.939 -18.139 4.203 1.00 0.00 H -ATOM 4890 HB3 ARG 312 3.520 -16.798 5.274 1.00 0.00 H -ATOM 4891 CG ARG 312 2.044 -18.317 4.812 1.00 0.00 C -ATOM 4892 HG2 ARG 312 2.436 -18.896 5.648 1.00 0.00 H -ATOM 4893 HG3 ARG 312 1.204 -17.772 5.240 1.00 0.00 H -ATOM 4894 CD ARG 312 1.566 -19.195 3.624 1.00 0.00 C -ATOM 4895 HD2 ARG 312 1.137 -18.540 2.866 1.00 0.00 H -ATOM 4896 HD3 ARG 312 2.406 -19.708 3.155 1.00 0.00 H -ATOM 4897 NE ARG 312 0.628 -20.164 4.252 1.00 0.00 N -ATOM 4898 HE ARG 312 0.549 -20.150 5.259 1.00 0.00 H -ATOM 4899 CZ ARG 312 -0.149 -21.010 3.579 1.00 0.00 C -ATOM 4900 NH1 ARG 312 0.068 -21.375 2.323 1.00 0.00 N -ATOM 4901 HH11 ARG 312 0.623 -20.822 1.685 1.00 0.00 H -ATOM 4902 HH12 ARG 312 -0.305 -22.272 2.046 1.00 0.00 H -ATOM 4903 NH2 ARG 312 -0.891 -21.832 4.224 1.00 0.00 N -ATOM 4904 HH21 ARG 312 -0.714 -21.876 5.218 1.00 0.00 H -ATOM 4905 HH22 ARG 312 -1.271 -22.619 3.719 1.00 0.00 H -ATOM 4906 C ARG 312 1.997 -15.506 3.101 1.00 0.00 C -ATOM 4907 O ARG 312 0.824 -15.887 2.882 1.00 0.00 O -ATOM 4908 N THR 313 2.296 -14.206 3.204 1.00 0.00 N -ATOM 4909 H THR 313 3.264 -13.920 3.222 1.00 0.00 H -ATOM 4910 CA THR 313 1.268 -13.200 2.980 1.00 0.00 C -ATOM 4911 HA THR 313 0.397 -13.550 3.534 1.00 0.00 H -ATOM 4912 CB THR 313 1.731 -11.922 3.662 1.00 0.00 C -ATOM 4913 HB THR 313 2.750 -11.702 3.343 1.00 0.00 H -ATOM 4914 CG2 THR 313 0.805 -10.743 3.371 1.00 0.00 C -ATOM 4915 HG21 THR 313 -0.187 -10.930 3.784 1.00 0.00 H -ATOM 4916 HG22 THR 313 1.227 -9.874 3.874 1.00 0.00 H -ATOM 4917 HG23 THR 313 0.747 -10.525 2.304 1.00 0.00 H -ATOM 4918 OG1 THR 313 1.836 -12.168 5.089 1.00 0.00 O -ATOM 4919 HG1 THR 313 2.349 -12.976 5.146 1.00 0.00 H -ATOM 4920 C THR 313 0.890 -12.928 1.469 1.00 0.00 C -ATOM 4921 O THR 313 1.591 -12.201 0.835 1.00 0.00 O -ATOM 4922 N ARG 314 -0.384 -13.156 1.192 1.00 0.00 N -ATOM 4923 H ARG 314 -0.922 -13.515 1.968 1.00 0.00 H -ATOM 4924 CA ARG 314 -1.023 -12.940 -0.149 1.00 0.00 C -ATOM 4925 HA ARG 314 -0.309 -13.394 -0.836 1.00 0.00 H -ATOM 4926 CB ARG 314 -2.368 -13.719 -0.199 1.00 0.00 C -ATOM 4927 HB2 ARG 314 -3.022 -13.421 0.622 1.00 0.00 H -ATOM 4928 HB3 ARG 314 -2.846 -13.564 -1.166 1.00 0.00 H -ATOM 4929 CG ARG 314 -2.152 -15.248 -0.009 1.00 0.00 C -ATOM 4930 HG2 ARG 314 -1.559 -15.607 -0.849 1.00 0.00 H -ATOM 4931 HG3 ARG 314 -1.658 -15.456 0.941 1.00 0.00 H -ATOM 4932 CD ARG 314 -3.429 -16.084 -0.118 1.00 0.00 C -ATOM 4933 HD2 ARG 314 -4.093 -15.910 0.728 1.00 0.00 H -ATOM 4934 HD3 ARG 314 -3.963 -15.766 -1.015 1.00 0.00 H -ATOM 4935 NE ARG 314 -3.202 -17.523 -0.182 1.00 0.00 N -ATOM 4936 HE ARG 314 -2.294 -17.929 -0.002 1.00 0.00 H -ATOM 4937 CZ ARG 314 -4.191 -18.433 -0.294 1.00 0.00 C -ATOM 4938 NH1 ARG 314 -5.459 -18.172 -0.506 1.00 0.00 N -ATOM 4939 HH11 ARG 314 -5.808 -17.247 -0.713 1.00 0.00 H -ATOM 4940 HH12 ARG 314 -6.044 -18.985 -0.636 1.00 0.00 H -ATOM 4941 NH2 ARG 314 -3.860 -19.664 -0.193 1.00 0.00 N -ATOM 4942 HH21 ARG 314 -2.891 -19.919 -0.058 1.00 0.00 H -ATOM 4943 HH22 ARG 314 -4.593 -20.341 -0.045 1.00 0.00 H -ATOM 4944 C ARG 314 -1.153 -11.434 -0.387 1.00 0.00 C -ATOM 4945 O ARG 314 -1.810 -10.591 0.205 1.00 0.00 O -ATOM 4946 N THR 315 -0.397 -11.050 -1.427 1.00 0.00 N -ATOM 4947 H THR 315 0.038 -11.836 -1.888 1.00 0.00 H -ATOM 4948 CA THR 315 0.034 -9.709 -1.823 1.00 0.00 C -ATOM 4949 HA THR 315 -0.457 -9.045 -1.112 1.00 0.00 H -ATOM 4950 CB THR 315 1.565 -9.594 -1.898 1.00 0.00 C -ATOM 4951 HB THR 315 1.976 -10.452 -2.433 1.00 0.00 H -ATOM 4952 CG2 THR 315 2.167 -8.318 -2.474 1.00 0.00 C -ATOM 4953 HG21 THR 315 1.781 -8.134 -3.476 1.00 0.00 H -ATOM 4954 HG22 THR 315 1.820 -7.454 -1.908 1.00 0.00 H -ATOM 4955 HG23 THR 315 3.255 -8.258 -2.461 1.00 0.00 H -ATOM 4956 OG1 THR 315 1.894 -9.583 -0.508 1.00 0.00 O -ATOM 4957 HG1 THR 315 1.883 -10.514 -0.272 1.00 0.00 H -ATOM 4958 C THR 315 -0.631 -9.242 -3.154 1.00 0.00 C -ATOM 4959 O THR 315 -0.332 -9.844 -4.214 1.00 0.00 O -ATOM 4960 N SER 316 -1.429 -8.139 -3.074 1.00 0.00 N -ATOM 4961 H SER 316 -1.662 -7.789 -2.157 1.00 0.00 H -ATOM 4962 CA SER 316 -1.830 -7.304 -4.210 1.00 0.00 C -ATOM 4963 HA SER 316 -1.760 -7.859 -5.146 1.00 0.00 H -ATOM 4964 CB SER 316 -3.247 -6.961 -4.011 1.00 0.00 C -ATOM 4965 HB2 SER 316 -3.789 -7.871 -3.751 1.00 0.00 H -ATOM 4966 HB3 SER 316 -3.261 -6.185 -3.247 1.00 0.00 H -ATOM 4967 OG SER 316 -3.756 -6.516 -5.256 1.00 0.00 O -ATOM 4968 HG SER 316 -4.599 -6.916 -5.478 1.00 0.00 H -ATOM 4969 C SER 316 -0.942 -5.988 -4.432 1.00 0.00 C -ATOM 4970 O SER 316 -0.419 -5.383 -3.478 1.00 0.00 O -ATOM 4971 N ILE 317 -0.872 -5.488 -5.669 1.00 0.00 N -ATOM 4972 H ILE 317 -1.303 -5.854 -6.507 1.00 0.00 H -ATOM 4973 CA ILE 317 -0.319 -4.192 -5.986 1.00 0.00 C -ATOM 4974 HA ILE 317 -0.039 -3.495 -5.196 1.00 0.00 H -ATOM 4975 CB ILE 317 0.970 -4.330 -6.768 1.00 0.00 C -ATOM 4976 HB ILE 317 0.835 -5.039 -7.584 1.00 0.00 H -ATOM 4977 CG2 ILE 317 1.512 -2.959 -7.292 1.00 0.00 C -ATOM 4978 HG21 ILE 317 0.812 -2.426 -7.934 1.00 0.00 H -ATOM 4979 HG22 ILE 317 1.616 -2.272 -6.452 1.00 0.00 H -ATOM 4980 HG23 ILE 317 2.429 -3.062 -7.870 1.00 0.00 H -ATOM 4981 CG1 ILE 317 2.170 -5.056 -5.938 1.00 0.00 C -ATOM 4982 HG12 ILE 317 2.430 -4.491 -5.042 1.00 0.00 H -ATOM 4983 HG13 ILE 317 1.767 -6.000 -5.572 1.00 0.00 H -ATOM 4984 CD1 ILE 317 3.393 -5.468 -6.750 1.00 0.00 C -ATOM 4985 HD11 ILE 317 2.962 -5.863 -7.669 1.00 0.00 H -ATOM 4986 HD12 ILE 317 4.031 -4.605 -6.940 1.00 0.00 H -ATOM 4987 HD13 ILE 317 4.015 -6.197 -6.232 1.00 0.00 H -ATOM 4988 C ILE 317 -1.315 -3.435 -6.774 1.00 0.00 C -ATOM 4989 O ILE 317 -1.685 -3.840 -7.895 1.00 0.00 O -ATOM 4990 N ILE 318 -1.821 -2.266 -6.246 1.00 0.00 N -ATOM 4991 H ILE 318 -1.715 -1.983 -5.283 1.00 0.00 H -ATOM 4992 CA ILE 318 -2.426 -1.283 -7.221 1.00 0.00 C -ATOM 4993 HA ILE 318 -2.873 -1.744 -8.103 1.00 0.00 H -ATOM 4994 CB ILE 318 -3.524 -0.400 -6.496 1.00 0.00 C -ATOM 4995 HB ILE 318 -3.069 0.105 -5.644 1.00 0.00 H -ATOM 4996 CG2 ILE 318 -4.048 0.655 -7.505 1.00 0.00 C -ATOM 4997 HG21 ILE 318 -4.397 0.055 -8.346 1.00 0.00 H -ATOM 4998 HG22 ILE 318 -4.889 1.257 -7.160 1.00 0.00 H -ATOM 4999 HG23 ILE 318 -3.259 1.257 -7.957 1.00 0.00 H -ATOM 5000 CG1 ILE 318 -4.693 -1.268 -5.903 1.00 0.00 C -ATOM 5001 HG12 ILE 318 -5.548 -1.099 -6.558 1.00 0.00 H -ATOM 5002 HG13 ILE 318 -4.350 -2.297 -5.796 1.00 0.00 H -ATOM 5003 CD1 ILE 318 -5.182 -0.788 -4.576 1.00 0.00 C -ATOM 5004 HD11 ILE 318 -4.325 -0.752 -3.903 1.00 0.00 H -ATOM 5005 HD12 ILE 318 -5.647 0.197 -4.549 1.00 0.00 H -ATOM 5006 HD13 ILE 318 -5.865 -1.576 -4.257 1.00 0.00 H -ATOM 5007 C ILE 318 -1.253 -0.421 -7.829 1.00 0.00 C -ATOM 5008 O ILE 318 -0.674 0.420 -7.107 1.00 0.00 O -ATOM 5009 N ALA 319 -1.002 -0.622 -9.067 1.00 0.00 N -ATOM 5010 H ALA 319 -1.383 -1.455 -9.492 1.00 0.00 H -ATOM 5011 CA ALA 319 -0.285 0.238 -10.008 1.00 0.00 C -ATOM 5012 HA ALA 319 0.712 0.559 -9.705 1.00 0.00 H -ATOM 5013 CB ALA 319 -0.077 -0.646 -11.216 1.00 0.00 C -ATOM 5014 HB1 ALA 319 0.260 -0.049 -12.063 1.00 0.00 H -ATOM 5015 HB2 ALA 319 0.764 -1.287 -10.950 1.00 0.00 H -ATOM 5016 HB3 ALA 319 -0.913 -1.265 -11.539 1.00 0.00 H -ATOM 5017 C ALA 319 -1.104 1.493 -10.313 1.00 0.00 C -ATOM 5018 O ALA 319 -1.953 1.569 -11.237 1.00 0.00 O -ATOM 5019 N THR 320 -0.897 2.519 -9.544 1.00 0.00 N -ATOM 5020 H THR 320 -0.208 2.450 -8.808 1.00 0.00 H -ATOM 5021 CA THR 320 -1.413 3.872 -9.837 1.00 0.00 C -ATOM 5022 HA THR 320 -2.423 3.910 -10.247 1.00 0.00 H -ATOM 5023 CB THR 320 -1.443 4.545 -8.429 1.00 0.00 C -ATOM 5024 HB THR 320 -1.928 5.517 -8.515 1.00 0.00 H -ATOM 5025 CG2 THR 320 -2.163 3.857 -7.338 1.00 0.00 C -ATOM 5026 HG21 THR 320 -3.173 3.614 -7.668 1.00 0.00 H -ATOM 5027 HG22 THR 320 -1.671 2.931 -7.038 1.00 0.00 H -ATOM 5028 HG23 THR 320 -2.167 4.546 -6.493 1.00 0.00 H -ATOM 5029 OG1 THR 320 -0.136 4.946 -8.011 1.00 0.00 O -ATOM 5030 HG1 THR 320 0.449 4.199 -8.161 1.00 0.00 H -ATOM 5031 C THR 320 -0.690 4.688 -10.968 1.00 0.00 C -ATOM 5032 O THR 320 0.555 4.794 -10.947 1.00 0.00 O -ATOM 5033 N ILE 321 -1.470 5.422 -11.804 1.00 0.00 N -ATOM 5034 H ILE 321 -2.465 5.546 -11.690 1.00 0.00 H -ATOM 5035 CA ILE 321 -0.874 6.110 -12.938 1.00 0.00 C -ATOM 5036 HA ILE 321 0.110 6.429 -12.592 1.00 0.00 H -ATOM 5037 CB ILE 321 -0.725 5.153 -14.220 1.00 0.00 C -ATOM 5038 HB ILE 321 -0.268 5.789 -14.978 1.00 0.00 H -ATOM 5039 CG2 ILE 321 0.129 3.892 -14.051 1.00 0.00 C -ATOM 5040 HG21 ILE 321 -0.320 3.118 -13.427 1.00 0.00 H -ATOM 5041 HG22 ILE 321 0.400 3.504 -15.033 1.00 0.00 H -ATOM 5042 HG23 ILE 321 1.029 4.294 -13.587 1.00 0.00 H -ATOM 5043 CG1 ILE 321 -2.173 4.875 -14.752 1.00 0.00 C -ATOM 5044 HG12 ILE 321 -2.690 4.266 -14.010 1.00 0.00 H -ATOM 5045 HG13 ILE 321 -2.647 5.841 -14.929 1.00 0.00 H -ATOM 5046 CD1 ILE 321 -2.221 4.000 -15.958 1.00 0.00 C -ATOM 5047 HD11 ILE 321 -3.209 3.949 -16.414 1.00 0.00 H -ATOM 5048 HD12 ILE 321 -1.635 4.452 -16.758 1.00 0.00 H -ATOM 5049 HD13 ILE 321 -1.934 2.957 -15.826 1.00 0.00 H -ATOM 5050 C ILE 321 -1.601 7.441 -13.233 1.00 0.00 C -ATOM 5051 O ILE 321 -2.748 7.651 -12.847 1.00 0.00 O -ATOM 5052 N SER 322 -0.831 8.374 -13.857 1.00 0.00 N -ATOM 5053 H SER 322 0.072 8.110 -14.223 1.00 0.00 H -ATOM 5054 CA SER 322 -1.371 9.668 -14.302 1.00 0.00 C -ATOM 5055 HA SER 322 -2.108 10.091 -13.619 1.00 0.00 H -ATOM 5056 CB SER 322 -0.215 10.665 -14.325 1.00 0.00 C -ATOM 5057 HB2 SER 322 0.276 10.626 -13.353 1.00 0.00 H -ATOM 5058 HB3 SER 322 0.479 10.374 -15.112 1.00 0.00 H -ATOM 5059 OG SER 322 -0.644 11.972 -14.770 1.00 0.00 O -ATOM 5060 HG SER 322 0.128 12.508 -14.958 1.00 0.00 H -ATOM 5061 C SER 322 -2.015 9.521 -15.738 1.00 0.00 C -ATOM 5062 O SER 322 -1.410 8.820 -16.536 1.00 0.00 O -ATOM 5063 N PRO 323 -3.141 10.208 -16.053 1.00 0.00 N -ATOM 5064 CD PRO 323 -3.808 11.154 -15.167 1.00 0.00 C -ATOM 5065 HD2 PRO 323 -3.192 11.853 -14.603 1.00 0.00 H -ATOM 5066 HD3 PRO 323 -4.314 10.550 -14.414 1.00 0.00 H -ATOM 5067 CG PRO 323 -4.730 12.016 -16.012 1.00 0.00 C -ATOM 5068 HG2 PRO 323 -4.276 12.901 -16.458 1.00 0.00 H -ATOM 5069 HG3 PRO 323 -5.581 12.316 -15.401 1.00 0.00 H -ATOM 5070 CB PRO 323 -5.100 11.158 -17.218 1.00 0.00 C -ATOM 5071 HB2 PRO 323 -5.305 11.647 -18.170 1.00 0.00 H -ATOM 5072 HB3 PRO 323 -5.933 10.491 -17.002 1.00 0.00 H -ATOM 5073 CA PRO 323 -3.736 10.367 -17.401 1.00 0.00 C -ATOM 5074 HA PRO 323 -3.775 9.340 -17.763 1.00 0.00 H -ATOM 5075 C PRO 323 -2.829 10.970 -18.424 1.00 0.00 C -ATOM 5076 O PRO 323 -2.961 10.734 -19.656 1.00 0.00 O -ATOM 5077 N ALA 324 -1.851 11.828 -18.017 1.00 0.00 N -ATOM 5078 H ALA 324 -1.867 12.005 -17.023 1.00 0.00 H -ATOM 5079 CA ALA 324 -1.318 12.846 -18.916 1.00 0.00 C -ATOM 5080 HA ALA 324 -2.044 13.036 -19.707 1.00 0.00 H -ATOM 5081 CB ALA 324 -1.378 14.082 -18.047 1.00 0.00 C -ATOM 5082 HB1 ALA 324 -1.068 14.917 -18.675 1.00 0.00 H -ATOM 5083 HB2 ALA 324 -2.415 14.237 -17.750 1.00 0.00 H -ATOM 5084 HB3 ALA 324 -0.754 13.912 -17.170 1.00 0.00 H -ATOM 5085 C ALA 324 0.026 12.546 -19.518 1.00 0.00 C -ATOM 5086 O ALA 324 0.825 11.753 -19.006 1.00 0.00 O -ATOM 5087 N SER 325 0.249 13.322 -20.560 1.00 0.00 N -ATOM 5088 H SER 325 -0.451 13.880 -21.027 1.00 0.00 H -ATOM 5089 CA SER 325 1.509 13.193 -21.375 1.00 0.00 C -ATOM 5090 HA SER 325 1.428 12.203 -21.823 1.00 0.00 H -ATOM 5091 CB SER 325 1.396 14.264 -22.478 1.00 0.00 C -ATOM 5092 HB2 SER 325 2.227 14.200 -23.179 1.00 0.00 H -ATOM 5093 HB3 SER 325 0.468 14.105 -23.028 1.00 0.00 H -ATOM 5094 OG SER 325 1.341 15.497 -21.817 1.00 0.00 O -ATOM 5095 HG SER 325 1.218 16.236 -22.418 1.00 0.00 H -ATOM 5096 C SER 325 2.905 13.407 -20.735 1.00 0.00 C -ATOM 5097 O SER 325 3.892 12.777 -21.058 1.00 0.00 O -ATOM 5098 N LEU 326 2.873 14.218 -19.678 1.00 0.00 N -ATOM 5099 H LEU 326 2.101 14.870 -19.674 1.00 0.00 H -ATOM 5100 CA LEU 326 4.016 14.557 -18.842 1.00 0.00 C -ATOM 5101 HA LEU 326 4.779 14.960 -19.507 1.00 0.00 H -ATOM 5102 CB LEU 326 3.727 15.598 -17.790 1.00 0.00 C -ATOM 5103 HB2 LEU 326 3.360 15.032 -16.933 1.00 0.00 H -ATOM 5104 HB3 LEU 326 4.723 15.990 -17.589 1.00 0.00 H -ATOM 5105 CG LEU 326 2.757 16.776 -18.159 1.00 0.00 C -ATOM 5106 HG LEU 326 1.803 16.350 -18.469 1.00 0.00 H -ATOM 5107 CD1 LEU 326 2.609 17.788 -17.035 1.00 0.00 C -ATOM 5108 HD11 LEU 326 3.542 18.322 -16.857 1.00 0.00 H -ATOM 5109 HD12 LEU 326 1.944 18.583 -17.373 1.00 0.00 H -ATOM 5110 HD13 LEU 326 2.220 17.241 -16.175 1.00 0.00 H -ATOM 5111 CD2 LEU 326 3.325 17.540 -19.311 1.00 0.00 C -ATOM 5112 HD21 LEU 326 3.297 16.918 -20.205 1.00 0.00 H -ATOM 5113 HD22 LEU 326 2.780 18.453 -19.547 1.00 0.00 H -ATOM 5114 HD23 LEU 326 4.336 17.836 -19.028 1.00 0.00 H -ATOM 5115 C LEU 326 4.637 13.381 -18.099 1.00 0.00 C -ATOM 5116 O LEU 326 5.737 13.510 -17.521 1.00 0.00 O -ATOM 5117 N ASN 327 3.894 12.332 -17.931 1.00 0.00 N -ATOM 5118 H ASN 327 2.949 12.302 -18.288 1.00 0.00 H -ATOM 5119 CA ASN 327 4.284 11.138 -17.125 1.00 0.00 C -ATOM 5120 HA ASN 327 5.255 11.148 -16.633 1.00 0.00 H -ATOM 5121 CB ASN 327 3.322 11.012 -15.892 1.00 0.00 C -ATOM 5122 HB2 ASN 327 2.369 10.655 -16.282 1.00 0.00 H -ATOM 5123 HB3 ASN 327 3.709 10.231 -15.238 1.00 0.00 H -ATOM 5124 CG ASN 327 2.969 12.368 -15.241 1.00 0.00 C -ATOM 5125 OD1 ASN 327 1.891 12.927 -15.454 1.00 0.00 O -ATOM 5126 ND2 ASN 327 3.875 12.934 -14.478 1.00 0.00 N -ATOM 5127 HD21 ASN 327 3.570 13.654 -13.838 1.00 0.00 H -ATOM 5128 HD22 ASN 327 4.730 12.434 -14.282 1.00 0.00 H -ATOM 5129 C ASN 327 4.399 9.930 -18.003 1.00 0.00 C -ATOM 5130 O ASN 327 4.453 8.855 -17.328 1.00 0.00 O -ATOM 5131 N LEU 328 4.441 9.993 -19.379 1.00 0.00 N -ATOM 5132 H LEU 328 4.509 10.879 -19.859 1.00 0.00 H -ATOM 5133 CA LEU 328 4.497 8.841 -20.301 1.00 0.00 C -ATOM 5134 HA LEU 328 3.608 8.224 -20.169 1.00 0.00 H -ATOM 5135 CB LEU 328 4.699 9.423 -21.778 1.00 0.00 C -ATOM 5136 HB2 LEU 328 3.839 10.040 -22.042 1.00 0.00 H -ATOM 5137 HB3 LEU 328 5.550 10.105 -21.789 1.00 0.00 H -ATOM 5138 CG LEU 328 5.056 8.464 -22.928 1.00 0.00 C -ATOM 5139 HG LEU 328 6.111 8.292 -22.717 1.00 0.00 H -ATOM 5140 CD1 LEU 328 4.215 7.207 -23.092 1.00 0.00 C -ATOM 5141 HD11 LEU 328 3.196 7.585 -23.003 1.00 0.00 H -ATOM 5142 HD12 LEU 328 4.446 6.721 -24.040 1.00 0.00 H -ATOM 5143 HD13 LEU 328 4.393 6.500 -22.282 1.00 0.00 H -ATOM 5144 CD2 LEU 328 5.102 9.142 -24.283 1.00 0.00 C -ATOM 5145 HD21 LEU 328 5.670 8.499 -24.956 1.00 0.00 H -ATOM 5146 HD22 LEU 328 4.086 9.222 -24.667 1.00 0.00 H -ATOM 5147 HD23 LEU 328 5.526 10.145 -24.223 1.00 0.00 H -ATOM 5148 C LEU 328 5.573 7.782 -20.038 1.00 0.00 C -ATOM 5149 O LEU 328 5.317 6.587 -19.955 1.00 0.00 O -ATOM 5150 N GLU 329 6.769 8.259 -19.679 1.00 0.00 N -ATOM 5151 H GLU 329 6.970 9.246 -19.745 1.00 0.00 H -ATOM 5152 CA GLU 329 7.830 7.327 -19.205 1.00 0.00 C -ATOM 5153 HA GLU 329 7.907 6.495 -19.906 1.00 0.00 H -ATOM 5154 CB GLU 329 9.226 8.034 -19.052 1.00 0.00 C -ATOM 5155 HB2 GLU 329 9.141 8.916 -18.419 1.00 0.00 H -ATOM 5156 HB3 GLU 329 9.971 7.368 -18.615 1.00 0.00 H -ATOM 5157 CG GLU 329 9.789 8.561 -20.447 1.00 0.00 C -ATOM 5158 HG2 GLU 329 9.123 9.323 -20.851 1.00 0.00 H -ATOM 5159 HG3 GLU 329 10.744 9.065 -20.301 1.00 0.00 H -ATOM 5160 CD GLU 329 9.933 7.476 -21.521 1.00 0.00 C -ATOM 5161 OE1 GLU 329 9.952 6.277 -21.129 1.00 0.00 O -ATOM 5162 OE2 GLU 329 10.356 7.852 -22.646 1.00 0.00 O -ATOM 5163 C GLU 329 7.564 6.680 -17.889 1.00 0.00 C -ATOM 5164 O GLU 329 7.815 5.491 -17.655 1.00 0.00 O -ATOM 5165 N GLU 330 6.905 7.322 -16.918 1.00 0.00 N -ATOM 5166 H GLU 330 6.444 8.204 -17.088 1.00 0.00 H -ATOM 5167 CA GLU 330 6.839 6.847 -15.563 1.00 0.00 C -ATOM 5168 HA GLU 330 7.683 6.175 -15.412 1.00 0.00 H -ATOM 5169 CB GLU 330 7.009 7.894 -14.513 1.00 0.00 C -ATOM 5170 HB2 GLU 330 6.372 8.737 -14.781 1.00 0.00 H -ATOM 5171 HB3 GLU 330 6.633 7.597 -13.534 1.00 0.00 H -ATOM 5172 CG GLU 330 8.461 8.461 -14.465 1.00 0.00 C -ATOM 5173 HG2 GLU 330 8.692 8.962 -15.405 1.00 0.00 H -ATOM 5174 HG3 GLU 330 8.479 9.219 -13.682 1.00 0.00 H -ATOM 5175 CD GLU 330 9.555 7.457 -14.151 1.00 0.00 C -ATOM 5176 OE1 GLU 330 9.298 6.290 -13.863 1.00 0.00 O -ATOM 5177 OE2 GLU 330 10.727 7.861 -14.294 1.00 0.00 O -ATOM 5178 C GLU 330 5.597 5.986 -15.408 1.00 0.00 C -ATOM 5179 O GLU 330 5.560 4.960 -14.715 1.00 0.00 O -ATOM 5180 N THR 331 4.519 6.267 -16.184 1.00 0.00 N -ATOM 5181 H THR 331 4.531 7.158 -16.660 1.00 0.00 H -ATOM 5182 CA THR 331 3.375 5.409 -16.345 1.00 0.00 C -ATOM 5183 HA THR 331 2.914 5.147 -15.394 1.00 0.00 H -ATOM 5184 CB THR 331 2.313 6.171 -17.188 1.00 0.00 C -ATOM 5185 HB THR 331 2.801 6.667 -18.028 1.00 0.00 H -ATOM 5186 CG2 THR 331 1.107 5.353 -17.623 1.00 0.00 C -ATOM 5187 HG21 THR 331 1.351 4.576 -18.348 1.00 0.00 H -ATOM 5188 HG22 THR 331 0.610 4.860 -16.787 1.00 0.00 H -ATOM 5189 HG23 THR 331 0.398 6.101 -17.978 1.00 0.00 H -ATOM 5190 OG1 THR 331 1.701 7.149 -16.293 1.00 0.00 O -ATOM 5191 HG1 THR 331 1.427 7.879 -16.853 1.00 0.00 H -ATOM 5192 C THR 331 3.778 4.088 -17.022 1.00 0.00 C -ATOM 5193 O THR 331 3.562 3.054 -16.443 1.00 0.00 O -ATOM 5194 N LEU 332 4.456 4.158 -18.125 1.00 0.00 N -ATOM 5195 H LEU 332 4.690 5.030 -18.576 1.00 0.00 H -ATOM 5196 CA LEU 332 4.901 2.949 -18.800 1.00 0.00 C -ATOM 5197 HA LEU 332 3.971 2.410 -18.976 1.00 0.00 H -ATOM 5198 CB LEU 332 5.562 3.279 -20.164 1.00 0.00 C -ATOM 5199 HB2 LEU 332 6.274 4.091 -20.026 1.00 0.00 H -ATOM 5200 HB3 LEU 332 6.189 2.476 -20.552 1.00 0.00 H -ATOM 5201 CG LEU 332 4.764 3.705 -21.398 1.00 0.00 C -ATOM 5202 HG LEU 332 4.305 4.675 -21.204 1.00 0.00 H -ATOM 5203 CD1 LEU 332 5.587 3.849 -22.685 1.00 0.00 C -ATOM 5204 HD11 LEU 332 5.006 4.247 -23.517 1.00 0.00 H -ATOM 5205 HD12 LEU 332 6.457 4.504 -22.648 1.00 0.00 H -ATOM 5206 HD13 LEU 332 6.022 2.853 -22.771 1.00 0.00 H -ATOM 5207 CD2 LEU 332 3.652 2.725 -21.743 1.00 0.00 C -ATOM 5208 HD21 LEU 332 4.076 1.787 -22.101 1.00 0.00 H -ATOM 5209 HD22 LEU 332 2.990 2.572 -20.891 1.00 0.00 H -ATOM 5210 HD23 LEU 332 3.129 3.183 -22.582 1.00 0.00 H -ATOM 5211 C LEU 332 5.947 2.070 -17.984 1.00 0.00 C -ATOM 5212 O LEU 332 5.895 0.850 -18.029 1.00 0.00 O -ATOM 5213 N SER 333 6.745 2.714 -17.187 1.00 0.00 N -ATOM 5214 H SER 333 6.749 3.723 -17.230 1.00 0.00 H -ATOM 5215 CA SER 333 7.649 2.110 -16.127 1.00 0.00 C -ATOM 5216 HA SER 333 8.290 1.327 -16.531 1.00 0.00 H -ATOM 5217 CB SER 333 8.515 3.176 -15.492 1.00 0.00 C -ATOM 5218 HB2 SER 333 9.135 3.662 -16.246 1.00 0.00 H -ATOM 5219 HB3 SER 333 7.900 3.910 -14.973 1.00 0.00 H -ATOM 5220 OG SER 333 9.402 2.714 -14.510 1.00 0.00 O -ATOM 5221 HG SER 333 10.052 2.162 -14.951 1.00 0.00 H -ATOM 5222 C SER 333 6.825 1.487 -14.970 1.00 0.00 C -ATOM 5223 O SER 333 7.136 0.368 -14.552 1.00 0.00 O -ATOM 5224 N THR 334 5.749 2.097 -14.440 1.00 0.00 N -ATOM 5225 H THR 334 5.420 2.903 -14.953 1.00 0.00 H -ATOM 5226 CA THR 334 4.744 1.503 -13.488 1.00 0.00 C -ATOM 5227 HA THR 334 5.373 1.190 -12.655 1.00 0.00 H -ATOM 5228 CB THR 334 3.822 2.592 -13.017 1.00 0.00 C -ATOM 5229 HB THR 334 3.446 3.254 -13.796 1.00 0.00 H -ATOM 5230 CG2 THR 334 2.661 2.056 -12.151 1.00 0.00 C -ATOM 5231 HG21 THR 334 1.731 1.946 -12.708 1.00 0.00 H -ATOM 5232 HG22 THR 334 2.902 1.185 -11.542 1.00 0.00 H -ATOM 5233 HG23 THR 334 2.402 2.887 -11.495 1.00 0.00 H -ATOM 5234 OG1 THR 334 4.594 3.464 -12.286 1.00 0.00 O -ATOM 5235 HG1 THR 334 5.461 3.188 -12.590 1.00 0.00 H -ATOM 5236 C THR 334 3.965 0.336 -14.066 1.00 0.00 C -ATOM 5237 O THR 334 3.733 -0.617 -13.374 1.00 0.00 O -ATOM 5238 N LEU 335 3.641 0.281 -15.374 1.00 0.00 N -ATOM 5239 H LEU 335 4.035 1.084 -15.843 1.00 0.00 H -ATOM 5240 CA LEU 335 2.996 -0.836 -16.097 1.00 0.00 C -ATOM 5241 HA LEU 335 2.242 -1.297 -15.459 1.00 0.00 H -ATOM 5242 CB LEU 335 2.254 -0.355 -17.325 1.00 0.00 C -ATOM 5243 HB2 LEU 335 2.936 0.145 -18.013 1.00 0.00 H -ATOM 5244 HB3 LEU 335 1.835 -1.216 -17.846 1.00 0.00 H -ATOM 5245 CG LEU 335 1.082 0.607 -17.058 1.00 0.00 C -ATOM 5246 HG LEU 335 1.306 1.422 -16.369 1.00 0.00 H -ATOM 5247 CD1 LEU 335 0.641 1.257 -18.370 1.00 0.00 C -ATOM 5248 HD11 LEU 335 0.053 2.165 -18.233 1.00 0.00 H -ATOM 5249 HD12 LEU 335 1.526 1.565 -18.927 1.00 0.00 H -ATOM 5250 HD13 LEU 335 -0.031 0.579 -18.896 1.00 0.00 H -ATOM 5251 CD2 LEU 335 -0.114 -0.051 -16.376 1.00 0.00 C -ATOM 5252 HD21 LEU 335 0.344 -0.352 -15.434 1.00 0.00 H -ATOM 5253 HD22 LEU 335 -0.932 0.637 -16.161 1.00 0.00 H -ATOM 5254 HD23 LEU 335 -0.602 -0.882 -16.887 1.00 0.00 H -ATOM 5255 C LEU 335 4.007 -1.973 -16.434 1.00 0.00 C -ATOM 5256 O LEU 335 3.633 -3.117 -16.493 1.00 0.00 O -ATOM 5257 N GLU 336 5.305 -1.691 -16.456 1.00 0.00 N -ATOM 5258 H GLU 336 5.610 -0.762 -16.200 1.00 0.00 H -ATOM 5259 CA GLU 336 6.339 -2.774 -16.667 1.00 0.00 C -ATOM 5260 HA GLU 336 6.004 -3.429 -17.470 1.00 0.00 H -ATOM 5261 CB GLU 336 7.645 -2.038 -17.126 1.00 0.00 C -ATOM 5262 HB2 GLU 336 7.434 -1.302 -17.902 1.00 0.00 H -ATOM 5263 HB3 GLU 336 8.148 -1.608 -16.260 1.00 0.00 H -ATOM 5264 CG GLU 336 8.675 -3.038 -17.694 1.00 0.00 C -ATOM 5265 HG2 GLU 336 9.685 -2.710 -17.451 1.00 0.00 H -ATOM 5266 HG3 GLU 336 8.450 -4.051 -17.363 1.00 0.00 H -ATOM 5267 CD GLU 336 8.615 -3.006 -19.225 1.00 0.00 C -ATOM 5268 OE1 GLU 336 9.124 -1.968 -19.751 1.00 0.00 O -ATOM 5269 OE2 GLU 336 8.002 -3.863 -19.813 1.00 0.00 O -ATOM 5270 C GLU 336 6.456 -3.609 -15.422 1.00 0.00 C -ATOM 5271 O GLU 336 6.514 -4.837 -15.464 1.00 0.00 O -ATOM 5272 N TYR 337 6.404 -2.889 -14.285 1.00 0.00 N -ATOM 5273 H TYR 337 6.311 -1.884 -14.329 1.00 0.00 H -ATOM 5274 CA TYR 337 6.588 -3.450 -12.988 1.00 0.00 C -ATOM 5275 HA TYR 337 7.407 -4.169 -12.998 1.00 0.00 H -ATOM 5276 CB TYR 337 6.778 -2.352 -11.919 1.00 0.00 C -ATOM 5277 HB2 TYR 337 7.660 -1.757 -12.151 1.00 0.00 H -ATOM 5278 HB3 TYR 337 5.890 -1.720 -11.883 1.00 0.00 H -ATOM 5279 CG TYR 337 6.978 -2.780 -10.501 1.00 0.00 C -ATOM 5280 CD1 TYR 337 8.185 -3.198 -10.074 1.00 0.00 C -ATOM 5281 HD1 TYR 337 9.048 -3.316 -10.713 1.00 0.00 H -ATOM 5282 CE1 TYR 337 8.418 -3.490 -8.713 1.00 0.00 C -ATOM 5283 HE1 TYR 337 9.422 -3.648 -8.349 1.00 0.00 H -ATOM 5284 CZ TYR 337 7.353 -3.414 -7.781 1.00 0.00 C -ATOM 5285 OH TYR 337 7.572 -3.727 -6.494 1.00 0.00 O -ATOM 5286 HH TYR 337 8.458 -3.544 -6.178 1.00 0.00 H -ATOM 5287 CE2 TYR 337 6.071 -3.021 -8.216 1.00 0.00 C -ATOM 5288 HE2 TYR 337 5.233 -2.989 -7.535 1.00 0.00 H -ATOM 5289 CD2 TYR 337 5.893 -2.630 -9.592 1.00 0.00 C -ATOM 5290 HD2 TYR 337 4.876 -2.435 -9.898 1.00 0.00 H -ATOM 5291 C TYR 337 5.404 -4.356 -12.551 1.00 0.00 C -ATOM 5292 O TYR 337 5.596 -5.493 -12.188 1.00 0.00 O -ATOM 5293 N ALA 338 4.235 -3.853 -12.885 1.00 0.00 N -ATOM 5294 H ALA 338 4.271 -2.857 -13.051 1.00 0.00 H -ATOM 5295 CA ALA 338 2.998 -4.706 -12.908 1.00 0.00 C -ATOM 5296 HA ALA 338 2.713 -4.810 -11.861 1.00 0.00 H -ATOM 5297 CB ALA 338 1.886 -3.935 -13.667 1.00 0.00 C -ATOM 5298 HB1 ALA 338 2.119 -4.123 -14.716 1.00 0.00 H -ATOM 5299 HB2 ALA 338 0.871 -4.152 -13.335 1.00 0.00 H -ATOM 5300 HB3 ALA 338 2.032 -2.865 -13.522 1.00 0.00 H -ATOM 5301 C ALA 338 3.213 -6.079 -13.498 1.00 0.00 C -ATOM 5302 O ALA 338 2.977 -6.992 -12.749 1.00 0.00 O -ATOM 5303 N HIE 339 3.615 -6.233 -14.757 1.00 0.00 N -ATOM 5304 H HIE 339 4.044 -5.460 -15.244 1.00 0.00 H -ATOM 5305 CA HIE 339 3.618 -7.544 -15.468 1.00 0.00 C -ATOM 5306 HA HIE 339 2.727 -8.156 -15.327 1.00 0.00 H -ATOM 5307 CB HIE 339 3.564 -7.223 -17.026 1.00 0.00 C -ATOM 5308 HB2 HIE 339 3.083 -8.071 -17.514 1.00 0.00 H -ATOM 5309 HB3 HIE 339 2.861 -6.398 -17.139 1.00 0.00 H -ATOM 5310 CG HIE 339 4.888 -6.963 -17.630 1.00 0.00 C -ATOM 5311 ND1 HIE 339 6.007 -7.758 -17.712 1.00 0.00 N -ATOM 5312 CE1 HIE 339 6.906 -7.135 -18.377 1.00 0.00 C -ATOM 5313 HE1 HIE 339 7.879 -7.536 -18.623 1.00 0.00 H -ATOM 5314 NE2 HIE 339 6.438 -5.951 -18.778 1.00 0.00 N -ATOM 5315 HE2 HIE 339 6.959 -5.219 -19.239 1.00 0.00 H -ATOM 5316 CD2 HIE 339 5.128 -5.831 -18.317 1.00 0.00 C -ATOM 5317 HD2 HIE 339 4.576 -4.907 -18.407 1.00 0.00 H -ATOM 5318 C HIE 339 4.723 -8.409 -15.023 1.00 0.00 C -ATOM 5319 O HIE 339 4.653 -9.556 -15.158 1.00 0.00 O -ATOM 5320 N ARG 340 5.740 -7.790 -14.395 1.00 0.00 N -ATOM 5321 H ARG 340 5.733 -6.784 -14.303 1.00 0.00 H -ATOM 5322 CA ARG 340 6.879 -8.516 -13.786 1.00 0.00 C -ATOM 5323 HA ARG 340 7.257 -9.327 -14.409 1.00 0.00 H -ATOM 5324 CB ARG 340 8.176 -7.628 -13.624 1.00 0.00 C -ATOM 5325 HB2 ARG 340 7.936 -6.754 -13.019 1.00 0.00 H -ATOM 5326 HB3 ARG 340 8.957 -8.177 -13.097 1.00 0.00 H -ATOM 5327 CG ARG 340 8.661 -7.185 -15.020 1.00 0.00 C -ATOM 5328 HG2 ARG 340 9.063 -8.029 -15.580 1.00 0.00 H -ATOM 5329 HG3 ARG 340 7.838 -6.795 -15.619 1.00 0.00 H -ATOM 5330 CD ARG 340 9.756 -6.065 -15.015 1.00 0.00 C -ATOM 5331 HD2 ARG 340 10.018 -5.504 -15.912 1.00 0.00 H -ATOM 5332 HD3 ARG 340 9.313 -5.289 -14.390 1.00 0.00 H -ATOM 5333 NE ARG 340 10.902 -6.585 -14.382 1.00 0.00 N -ATOM 5334 HE ARG 340 11.188 -7.513 -14.661 1.00 0.00 H -ATOM 5335 CZ ARG 340 11.581 -6.099 -13.352 1.00 0.00 C -ATOM 5336 NH1 ARG 340 11.154 -5.036 -12.688 1.00 0.00 N -ATOM 5337 HH11 ARG 340 10.358 -4.605 -13.137 1.00 0.00 H -ATOM 5338 HH12 ARG 340 11.821 -4.452 -12.206 1.00 0.00 H -ATOM 5339 NH2 ARG 340 12.574 -6.820 -12.863 1.00 0.00 N -ATOM 5340 HH21 ARG 340 12.777 -7.691 -13.333 1.00 0.00 H -ATOM 5341 HH22 ARG 340 13.201 -6.368 -12.213 1.00 0.00 H -ATOM 5342 C ARG 340 6.412 -9.114 -12.439 1.00 0.00 C -ATOM 5343 O ARG 340 6.569 -10.328 -12.360 1.00 0.00 O -ATOM 5344 N ALA 341 5.747 -8.337 -11.583 1.00 0.00 N -ATOM 5345 H ALA 341 5.501 -7.399 -11.869 1.00 0.00 H -ATOM 5346 CA ALA 341 5.163 -8.871 -10.319 1.00 0.00 C -ATOM 5347 HA ALA 341 5.846 -9.368 -9.630 1.00 0.00 H -ATOM 5348 CB ALA 341 4.660 -7.669 -9.527 1.00 0.00 C -ATOM 5349 HB1 ALA 341 5.440 -6.922 -9.378 1.00 0.00 H -ATOM 5350 HB2 ALA 341 3.767 -7.219 -9.959 1.00 0.00 H -ATOM 5351 HB3 ALA 341 4.352 -8.039 -8.549 1.00 0.00 H -ATOM 5352 C ALA 341 4.134 -9.936 -10.569 1.00 0.00 C -ATOM 5353 O ALA 341 4.043 -10.856 -9.802 1.00 0.00 O -ATOM 5354 N LYS 342 3.414 -9.946 -11.715 1.00 0.00 N -ATOM 5355 H LYS 342 3.558 -9.152 -12.324 1.00 0.00 H -ATOM 5356 CA LYS 342 2.457 -11.010 -12.028 1.00 0.00 C -ATOM 5357 HA LYS 342 1.815 -10.950 -11.148 1.00 0.00 H -ATOM 5358 CB LYS 342 1.591 -10.543 -13.227 1.00 0.00 C -ATOM 5359 HB2 LYS 342 2.245 -10.034 -13.936 1.00 0.00 H -ATOM 5360 HB3 LYS 342 1.162 -11.444 -13.666 1.00 0.00 H -ATOM 5361 CG LYS 342 0.359 -9.699 -13.015 1.00 0.00 C -ATOM 5362 HG2 LYS 342 0.699 -8.699 -12.749 1.00 0.00 H -ATOM 5363 HG3 LYS 342 -0.134 -9.616 -13.983 1.00 0.00 H -ATOM 5364 CD LYS 342 -0.558 -10.009 -11.899 1.00 0.00 C -ATOM 5365 HD2 LYS 342 -0.093 -9.888 -10.920 1.00 0.00 H -ATOM 5366 HD3 LYS 342 -1.400 -9.327 -12.020 1.00 0.00 H -ATOM 5367 CE LYS 342 -1.007 -11.418 -12.027 1.00 0.00 C -ATOM 5368 HE2 LYS 342 -1.498 -11.487 -12.998 1.00 0.00 H -ATOM 5369 HE3 LYS 342 -0.141 -12.080 -12.007 1.00 0.00 H -ATOM 5370 NZ LYS 342 -1.999 -11.712 -10.964 1.00 0.00 N -ATOM 5371 HZ1 LYS 342 -2.773 -11.072 -11.074 1.00 0.00 H -ATOM 5372 HZ2 LYS 342 -2.365 -12.652 -11.020 1.00 0.00 H -ATOM 5373 HZ3 LYS 342 -1.538 -11.655 -10.067 1.00 0.00 H -ATOM 5374 C LYS 342 3.019 -12.477 -12.166 1.00 0.00 C -ATOM 5375 O LYS 342 2.251 -13.434 -12.111 1.00 0.00 O -ATOM 5376 N ASN 343 4.349 -12.590 -12.336 1.00 0.00 N -ATOM 5377 H ASN 343 5.013 -11.829 -12.310 1.00 0.00 H -ATOM 5378 CA ASN 343 5.023 -13.964 -12.306 1.00 0.00 C -ATOM 5379 HA ASN 343 4.574 -14.707 -12.966 1.00 0.00 H -ATOM 5380 CB ASN 343 6.503 -13.794 -12.681 1.00 0.00 C -ATOM 5381 HB2 ASN 343 6.636 -13.452 -13.707 1.00 0.00 H -ATOM 5382 HB3 ASN 343 6.886 -13.073 -11.959 1.00 0.00 H -ATOM 5383 CG ASN 343 7.220 -15.091 -12.621 1.00 0.00 C -ATOM 5384 OD1 ASN 343 8.043 -15.251 -11.753 1.00 0.00 O -ATOM 5385 ND2 ASN 343 7.134 -15.917 -13.643 1.00 0.00 N -ATOM 5386 HD21 ASN 343 7.751 -16.718 -13.643 1.00 0.00 H -ATOM 5387 HD22 ASN 343 6.465 -15.711 -14.370 1.00 0.00 H -ATOM 5388 C ASN 343 5.054 -14.582 -10.907 1.00 0.00 C -ATOM 5389 O ASN 343 5.066 -15.809 -10.836 1.00 0.00 O -ATOM 5390 N ILE 344 5.087 -13.762 -9.861 1.00 0.00 N -ATOM 5391 H ILE 344 4.899 -12.771 -9.895 1.00 0.00 H -ATOM 5392 CA ILE 344 5.513 -14.168 -8.529 1.00 0.00 C -ATOM 5393 HA ILE 344 6.366 -14.839 -8.627 1.00 0.00 H -ATOM 5394 CB ILE 344 6.087 -13.020 -7.720 1.00 0.00 C -ATOM 5395 HB ILE 344 5.338 -12.231 -7.653 1.00 0.00 H -ATOM 5396 CG2 ILE 344 6.468 -13.454 -6.286 1.00 0.00 C -ATOM 5397 HG21 ILE 344 6.857 -12.623 -5.698 1.00 0.00 H -ATOM 5398 HG22 ILE 344 5.619 -13.696 -5.647 1.00 0.00 H -ATOM 5399 HG23 ILE 344 7.280 -14.179 -6.244 1.00 0.00 H -ATOM 5400 CG1 ILE 344 7.391 -12.494 -8.402 1.00 0.00 C -ATOM 5401 HG12 ILE 344 8.214 -13.197 -8.273 1.00 0.00 H -ATOM 5402 HG13 ILE 344 7.183 -12.295 -9.453 1.00 0.00 H -ATOM 5403 CD1 ILE 344 7.907 -11.187 -7.816 1.00 0.00 C -ATOM 5404 HD11 ILE 344 7.055 -10.517 -7.705 1.00 0.00 H -ATOM 5405 HD12 ILE 344 8.372 -11.463 -6.871 1.00 0.00 H -ATOM 5406 HD13 ILE 344 8.619 -10.672 -8.461 1.00 0.00 H -ATOM 5407 C ILE 344 4.414 -14.970 -7.734 1.00 0.00 C -ATOM 5408 O ILE 344 3.257 -14.598 -7.600 1.00 0.00 O -ATOM 5409 N LEU 345 4.706 -16.128 -7.145 1.00 0.00 N -ATOM 5410 H LEU 345 5.669 -16.432 -7.186 1.00 0.00 H -ATOM 5411 CA LEU 345 3.914 -16.845 -6.203 1.00 0.00 C -ATOM 5412 HA LEU 345 2.852 -16.595 -6.209 1.00 0.00 H -ATOM 5413 CB LEU 345 4.026 -18.360 -6.470 1.00 0.00 C -ATOM 5414 HB2 LEU 345 5.087 -18.603 -6.431 1.00 0.00 H -ATOM 5415 HB3 LEU 345 3.427 -18.790 -5.665 1.00 0.00 H -ATOM 5416 CG LEU 345 3.477 -18.890 -7.846 1.00 0.00 C -ATOM 5417 HG LEU 345 4.122 -18.577 -8.667 1.00 0.00 H -ATOM 5418 CD1 LEU 345 3.593 -20.411 -7.787 1.00 0.00 C -ATOM 5419 HD11 LEU 345 4.580 -20.765 -7.491 1.00 0.00 H -ATOM 5420 HD12 LEU 345 3.013 -20.801 -6.951 1.00 0.00 H -ATOM 5421 HD13 LEU 345 3.241 -20.948 -8.669 1.00 0.00 H -ATOM 5422 CD2 LEU 345 2.124 -18.506 -8.352 1.00 0.00 C -ATOM 5423 HD21 LEU 345 1.353 -18.648 -7.594 1.00 0.00 H -ATOM 5424 HD22 LEU 345 2.189 -17.464 -8.663 1.00 0.00 H -ATOM 5425 HD23 LEU 345 1.941 -19.126 -9.229 1.00 0.00 H -ATOM 5426 C LEU 345 4.326 -16.535 -4.718 1.00 0.00 C -ATOM 5427 O LEU 345 5.496 -16.408 -4.289 1.00 0.00 O -ATOM 5428 N ASN 346 3.312 -16.360 -3.857 1.00 0.00 N -ATOM 5429 H ASN 346 2.371 -16.296 -4.219 1.00 0.00 H -ATOM 5430 CA ASN 346 3.372 -16.469 -2.397 1.00 0.00 C -ATOM 5431 HA ASN 346 4.329 -16.071 -2.062 1.00 0.00 H -ATOM 5432 CB ASN 346 2.175 -15.662 -1.818 1.00 0.00 C -ATOM 5433 HB2 ASN 346 1.280 -16.013 -2.332 1.00 0.00 H -ATOM 5434 HB3 ASN 346 2.041 -16.008 -0.793 1.00 0.00 H -ATOM 5435 CG ASN 346 2.409 -14.163 -1.933 1.00 0.00 C -ATOM 5436 OD1 ASN 346 1.748 -13.474 -2.665 1.00 0.00 O -ATOM 5437 ND2 ASN 346 3.373 -13.658 -1.193 1.00 0.00 N -ATOM 5438 HD21 ASN 346 3.380 -12.649 -1.194 1.00 0.00 H -ATOM 5439 HD22 ASN 346 3.746 -14.287 -0.496 1.00 0.00 H -ATOM 5440 C ASN 346 3.320 -17.998 -2.091 1.00 0.00 C -ATOM 5441 O ASN 346 2.961 -18.839 -2.924 1.00 0.00 O -ATOM 5442 N LYS 347 3.608 -18.359 -0.792 1.00 0.00 N -ATOM 5443 H LYS 347 3.742 -17.585 -0.158 1.00 0.00 H -ATOM 5444 CA LYS 347 3.597 -19.706 -0.206 1.00 0.00 C -ATOM 5445 HA LYS 347 4.044 -20.408 -0.909 1.00 0.00 H -ATOM 5446 CB LYS 347 4.347 -19.785 1.131 1.00 0.00 C -ATOM 5447 HB2 LYS 347 3.767 -19.104 1.754 1.00 0.00 H -ATOM 5448 HB3 LYS 347 4.312 -20.811 1.499 1.00 0.00 H -ATOM 5449 CG LYS 347 5.812 -19.371 1.161 1.00 0.00 C -ATOM 5450 HG2 LYS 347 5.887 -18.325 0.864 1.00 0.00 H -ATOM 5451 HG3 LYS 347 6.175 -19.393 2.189 1.00 0.00 H -ATOM 5452 CD LYS 347 6.667 -20.308 0.263 1.00 0.00 C -ATOM 5453 HD2 LYS 347 6.624 -21.285 0.743 1.00 0.00 H -ATOM 5454 HD3 LYS 347 6.305 -20.250 -0.763 1.00 0.00 H -ATOM 5455 CE LYS 347 8.097 -19.771 0.303 1.00 0.00 C -ATOM 5456 HE2 LYS 347 8.155 -18.764 -0.108 1.00 0.00 H -ATOM 5457 HE3 LYS 347 8.415 -19.678 1.341 1.00 0.00 H -ATOM 5458 NZ LYS 347 9.038 -20.572 -0.411 1.00 0.00 N -ATOM 5459 HZ1 LYS 347 8.556 -21.294 -0.926 1.00 0.00 H -ATOM 5460 HZ2 LYS 347 9.641 -20.035 -1.020 1.00 0.00 H -ATOM 5461 HZ3 LYS 347 9.691 -21.076 0.173 1.00 0.00 H -ATOM 5462 C LYS 347 2.144 -20.165 -0.101 1.00 0.00 C -ATOM 5463 O LYS 347 1.279 -19.423 0.399 1.00 0.00 O -ATOM 5464 OXT LYS 347 1.819 -21.267 -0.495 1.00 0.00 O -TER 5465 LYS 347 -HETATM 5466 O1B ADP 348 0.156 9.488 -4.707 1.00 0.00 O -HETATM 5467 PB ADP 348 1.011 10.461 -3.979 1.00 0.00 P -HETATM 5468 O2B ADP 348 2.376 10.558 -4.480 1.00 0.00 O -HETATM 5469 O3B ADP 348 1.062 10.233 -2.536 1.00 0.00 O -HETATM 5470 O3A ADP 348 0.379 11.800 -4.171 1.00 0.00 O -HETATM 5471 PA ADP 348 -0.105 12.966 -3.348 1.00 0.00 P -HETATM 5472 O1A ADP 348 0.954 13.523 -2.625 1.00 0.00 O -HETATM 5473 O2A ADP 348 -1.247 12.436 -2.576 1.00 0.00 O -HETATM 5474 O5* ADP 348 -0.642 14.048 -4.377 1.00 0.00 O -HETATM 5475 C5* ADP 348 -1.360 13.708 -5.490 1.00 0.00 C -HETATM 5476 H50 ADP 348 -1.351 12.623 -5.600 1.00 0.00 H -HETATM 5477 H51 ADP 348 -0.983 14.235 -6.366 1.00 0.00 H -HETATM 5478 C4* ADP 348 -2.797 14.188 -5.341 1.00 0.00 C -HETATM 5479 H40 ADP 348 -2.834 15.265 -5.177 1.00 0.00 H -HETATM 5480 O4* ADP 348 -3.452 13.956 -6.596 1.00 0.00 O -HETATM 5481 C1* ADP 348 -4.807 13.861 -6.383 1.00 0.00 C -HETATM 5482 H10 ADP 348 -5.267 14.683 -6.931 1.00 0.00 H -HETATM 5483 N9 ADP 348 -5.250 12.447 -6.803 1.00 0.00 N -HETATM 5484 C8 ADP 348 -4.484 11.320 -7.025 1.00 0.00 C -HETATM 5485 H80 ADP 348 -3.409 11.251 -6.941 1.00 0.00 H -HETATM 5486 N7 ADP 348 -5.252 10.291 -7.383 1.00 0.00 N -HETATM 5487 C5 ADP 348 -6.540 10.827 -7.513 1.00 0.00 C -HETATM 5488 C6 ADP 348 -7.816 10.362 -7.920 1.00 0.00 C -HETATM 5489 N6 ADP 348 -8.195 9.110 -8.115 1.00 0.00 N -HETATM 5490 H60 ADP 348 -7.444 8.450 -7.976 1.00 0.00 H -HETATM 5491 H61 ADP 348 -9.144 8.851 -8.349 1.00 0.00 H -HETATM 5492 N1 ADP 348 -8.866 11.191 -7.963 1.00 0.00 N -HETATM 5493 C2 ADP 348 -8.706 12.450 -7.577 1.00 0.00 C -HETATM 5494 H2 ADP 348 -9.621 13.018 -7.480 1.00 0.00 H -HETATM 5495 N3 ADP 348 -7.573 12.944 -7.145 1.00 0.00 N -HETATM 5496 C4 ADP 348 -6.511 12.132 -7.142 1.00 0.00 C -HETATM 5497 C3* ADP 348 -3.702 13.592 -4.293 1.00 0.00 C -HETATM 5498 H30 ADP 348 -3.728 12.506 -4.387 1.00 0.00 H -HETATM 5499 O3* ADP 348 -3.385 14.018 -2.972 1.00 0.00 O -HETATM 5500 H3* ADP 348 -2.643 13.456 -2.738 1.00 0.00 H -HETATM 5501 C2* ADP 348 -5.094 13.926 -4.848 1.00 0.00 C -HETATM 5502 H20 ADP 348 -5.752 13.230 -4.326 1.00 0.00 H -HETATM 5503 O2* ADP 348 -5.521 15.245 -4.520 1.00 0.00 O -HETATM 5504 H2* ADP 348 -5.620 15.251 -3.565 1.00 0.00 H -HETATM 5505 MG MG 349 1.667 10.039 -0.745 1.00 0.00 Mg -HETATM 5506 O WAT 438 2.345 8.140 -1.256 1.00 0.00 O -HETATM 5507 H1 WAT 438 1.790 7.404 -0.996 1.00 0.00 H -HETATM 5508 H2 WAT 438 3.182 7.737 -1.490 1.00 0.00 H -HETATM 5509 O WAT 439 1.105 12.165 -0.369 1.00 0.00 O -HETATM 5510 H1 WAT 439 0.621 12.785 0.177 1.00 0.00 H -HETATM 5511 H2 WAT 439 1.350 12.670 -1.144 1.00 0.00 H -HETATM 5512 O WAT 440 21.037 -15.892 -9.831 1.00 0.00 O -HETATM 5513 H1 WAT 440 21.061 -16.490 -9.085 1.00 0.00 H -HETATM 5514 H2 WAT 440 21.945 -15.610 -9.940 1.00 0.00 H -HETATM 5515 O WAT 441 2.186 9.662 1.189 1.00 0.00 O -HETATM 5516 H1 WAT 441 2.718 8.877 1.320 1.00 0.00 H -HETATM 5517 H2 WAT 441 2.140 10.068 2.055 1.00 0.00 H -CONECT 5481 5480 5482 5483 5501 -CONECT 5493 5492 5494 5495 -CONECT 5501 5481 5497 5502 5503 -CONECT 5497 5478 5498 5499 5501 -CONECT 5496 5483 5487 5495 -CONECT 5478 5475 5479 5480 5497 -CONECT 5487 5486 5488 5496 -CONECT 5475 5474 5476 5477 5478 -CONECT 5488 5487 5489 5492 -CONECT 5484 5483 5485 5486 -CONECT 5482 5481 -CONECT 5494 5493 -CONECT 5504 5503 -CONECT 5502 5501 -CONECT 5500 5499 -CONECT 5498 5497 -CONECT 5479 5478 -CONECT 5476 5475 -CONECT 5477 5475 -CONECT 5490 5489 -CONECT 5491 5489 -CONECT 5485 5484 -CONECT 5492 5488 5493 -CONECT 5495 5493 5496 -CONECT 5489 5488 5490 5491 -CONECT 5486 5484 5487 -CONECT 5483 5481 5484 5496 -CONECT 5472 5471 -CONECT 5466 5467 -CONECT 5503 5501 5504 -CONECT 5473 5471 -CONECT 5468 5467 -CONECT 5499 5497 5500 -CONECT 5470 5467 5471 -CONECT 5469 5467 -CONECT 5480 5478 5481 -CONECT 5474 5471 5475 -CONECT 5471 5470 5472 5473 5474 -CONECT 5467 5466 5468 5469 5470 -CONECT 5507 5506 -CONECT 5508 5506 -CONECT 5506 5507 5508 -CONECT 5510 5509 -CONECT 5511 5509 -CONECT 5509 5510 5511 -CONECT 5513 5512 -CONECT 5514 5512 -CONECT 5512 5513 5514 -CONECT 5516 5515 -CONECT 5517 5515 -CONECT 5515 5516 5517 -END diff --git a/receptor/pdb_files/6o6f_A227V_H.pdb b/receptor/pdb_files/6o6f_A227V_H.pdb new file mode 100644 index 0000000..6f5fb51 --- /dev/null +++ b/receptor/pdb_files/6o6f_A227V_H.pdb @@ -0,0 +1,2435 @@ +HELIX 1 1 GLU 173 THR 191 1 19 +HELIX 2 2 GLY 203 ASN 223 1 21 +HELIX 3 3 GLU 225 LEU 235 1 11 +HELIX 4 4 GLU 240 SER 255 1 16 +HELIX 5 5 TRP 261 THR 280 1 20 +HELIX 6 6 GLU 284 THR 301 1 18 +HELIX 7 7 ARG 303 LYS 308 1 6 +HELIX 8 8 GLY 311 PHE 319 1 9 +ATOM 1 N SER 171 -23.840 -34.508 -6.167 1.00 0.00 N +ATOM 2 H1 SER 171 -24.073 -34.914 -5.272 1.00 0.00 H +ATOM 3 H2 SER 171 -23.979 -34.837 -5.236 1.00 0.00 H +ATOM 4 H3 SER 171 -23.978 -35.254 -6.813 1.00 0.00 H +ATOM 5 CA SER 171 -24.823 -33.425 -6.454 1.00 0.00 C +ATOM 6 HA SER 171 -25.412 -33.750 -7.212 1.00 0.00 H +ATOM 7 CB SER 171 -25.708 -33.194 -5.243 1.00 0.00 C +ATOM 8 HB2 SER 171 -26.374 -32.476 -5.458 1.00 0.00 H +ATOM 9 HB3 SER 171 -26.200 -34.043 -5.033 1.00 0.00 H +ATOM 10 OG SER 171 -24.971 -32.802 -4.100 1.00 0.00 O +ATOM 11 HG SER 171 -24.797 -31.818 -4.136 1.00 0.00 H +ATOM 12 C SER 171 -24.177 -32.110 -6.883 1.00 0.00 C +ATOM 13 O SER 171 -22.964 -31.912 -6.751 1.00 0.00 O +ATOM 14 N ASP 172 -25.017 -31.207 -7.377 1.00 0.00 N +ATOM 15 H ASP 172 -26.019 -31.507 -7.379 1.00 0.00 H +ATOM 16 CA ASP 172 -24.576 -29.909 -7.873 1.00 0.00 C +ATOM 17 HA ASP 172 -23.602 -30.008 -8.149 1.00 0.00 H +ATOM 18 CB ASP 172 -25.432 -29.532 -9.076 1.00 0.00 C +ATOM 19 HB2 ASP 172 -25.664 -30.370 -9.561 1.00 0.00 H +ATOM 20 HB3 ASP 172 -26.258 -29.091 -8.739 1.00 0.00 H +ATOM 21 CG ASP 172 -24.727 -28.599 -10.018 1.00 0.00 C +ATOM 22 OD1 ASP 172 -23.703 -27.997 -9.623 1.00 0.00 O +ATOM 23 OD2 ASP 172 -25.214 -28.470 -11.157 1.00 0.00 O +ATOM 24 C ASP 172 -24.625 -28.796 -6.824 1.00 0.00 C +ATOM 25 O ASP 172 -25.612 -28.057 -6.729 1.00 0.00 O +ATOM 26 N GLU 173 -23.548 -28.683 -6.049 1.00 0.00 N +ATOM 27 H GLU 173 -22.790 -29.365 -6.257 1.00 0.00 H +ATOM 28 CA GLU 173 -23.453 -27.676 -4.995 1.00 0.00 C +ATOM 29 HA GLU 173 -24.232 -27.772 -4.359 1.00 0.00 H +ATOM 30 CB GLU 173 -22.200 -27.947 -4.155 1.00 0.00 C +ATOM 31 HB2 GLU 173 -22.347 -28.794 -3.669 1.00 0.00 H +ATOM 32 HB3 GLU 173 -21.435 -28.012 -4.775 1.00 0.00 H +ATOM 33 CG GLU 173 -21.879 -26.877 -3.134 1.00 0.00 C +ATOM 34 HG2 GLU 173 -21.026 -27.114 -2.693 1.00 0.00 H +ATOM 35 HG3 GLU 173 -21.810 -26.008 -3.602 1.00 0.00 H +ATOM 36 CD GLU 173 -22.924 -26.721 -2.045 1.00 0.00 C +ATOM 37 OE1 GLU 173 -23.943 -27.446 -2.041 1.00 0.00 O +ATOM 38 OE2 GLU 173 -22.734 -25.830 -1.194 1.00 0.00 O +ATOM 39 C GLU 173 -23.443 -26.240 -5.559 1.00 0.00 C +ATOM 40 O GLU 173 -24.129 -25.350 -5.049 1.00 0.00 O +ATOM 41 N LEU 174 -22.675 -26.019 -6.620 1.00 0.00 N +ATOM 42 H LEU 174 -22.143 -26.835 -6.959 1.00 0.00 H +ATOM 43 CA LEU 174 -22.619 -24.699 -7.230 1.00 0.00 C +ATOM 44 HA LEU 174 -22.328 -24.032 -6.531 1.00 0.00 H +ATOM 45 CB LEU 174 -21.586 -24.661 -8.357 1.00 0.00 C +ATOM 46 HB2 LEU 174 -20.686 -24.796 -7.952 1.00 0.00 H +ATOM 47 HB3 LEU 174 -21.794 -25.401 -8.988 1.00 0.00 H +ATOM 48 CG LEU 174 -21.530 -23.367 -9.171 1.00 0.00 C +ATOM 49 HG LEU 174 -22.441 -23.160 -9.522 1.00 0.00 H +ATOM 50 CD1 LEU 174 -21.054 -22.201 -8.293 1.00 0.00 C +ATOM 51 HD11 LEU 174 -20.143 -22.406 -7.942 1.00 0.00 H +ATOM 52 HD12 LEU 174 -21.025 -21.368 -8.842 1.00 0.00 H +ATOM 53 HD13 LEU 174 -21.690 -22.082 -7.533 1.00 0.00 H +ATOM 54 CD2 LEU 174 -20.605 -23.568 -10.350 1.00 0.00 C +ATOM 55 HD21 LEU 174 -20.947 -24.313 -10.927 1.00 0.00 H +ATOM 56 HD22 LEU 174 -20.559 -22.727 -10.893 1.00 0.00 H +ATOM 57 HD23 LEU 174 -19.686 -23.800 -10.025 1.00 0.00 H +ATOM 58 C LEU 174 -23.982 -24.270 -7.762 1.00 0.00 C +ATOM 59 O LEU 174 -24.374 -23.103 -7.633 1.00 0.00 O +ATOM 60 N TYR 175 -24.715 -25.192 -8.372 1.00 0.00 N +ATOM 61 H TYR 175 -24.296 -26.118 -8.460 1.00 0.00 H +ATOM 62 CA TYR 175 -26.039 -24.830 -8.864 1.00 0.00 C +ATOM 63 HA TYR 175 -25.951 -24.004 -9.436 1.00 0.00 H +ATOM 64 CB TYR 175 -26.649 -25.942 -9.716 1.00 0.00 C +ATOM 65 HB2 TYR 175 -26.023 -26.152 -10.448 1.00 0.00 H +ATOM 66 HB3 TYR 175 -26.811 -26.724 -9.137 1.00 0.00 H +ATOM 67 CG TYR 175 -27.958 -25.506 -10.312 1.00 0.00 C +ATOM 68 CD1 TYR 175 -27.995 -24.770 -11.495 1.00 0.00 C +ATOM 69 HD1 TYR 175 -27.147 -24.606 -12.002 1.00 0.00 H +ATOM 70 CE1 TYR 175 -29.191 -24.255 -11.988 1.00 0.00 C +ATOM 71 HE1 TYR 175 -29.198 -23.731 -12.840 1.00 0.00 H +ATOM 72 CZ TYR 175 -30.369 -24.474 -11.292 1.00 0.00 C +ATOM 73 OH TYR 175 -31.551 -23.926 -11.754 1.00 0.00 O +ATOM 74 HH TYR 175 -31.551 -23.947 -12.751 1.00 0.00 H +ATOM 75 CE2 TYR 175 -30.358 -25.213 -10.119 1.00 0.00 C +ATOM 76 HE2 TYR 175 -31.208 -25.379 -9.621 1.00 0.00 H +ATOM 77 CD2 TYR 175 -29.155 -25.724 -9.637 1.00 0.00 C +ATOM 78 HD2 TYR 175 -29.154 -26.257 -8.793 1.00 0.00 H +ATOM 79 C TYR 175 -26.995 -24.507 -7.714 1.00 0.00 C +ATOM 80 O TYR 175 -27.704 -23.510 -7.775 1.00 0.00 O +ATOM 81 N ARG 176 -27.007 -25.346 -6.679 1.00 0.00 N +ATOM 82 H ARG 176 -26.357 -26.148 -6.760 1.00 0.00 H +ATOM 83 CA ARG 176 -27.880 -25.122 -5.538 1.00 0.00 C +ATOM 84 HA ARG 176 -28.838 -25.126 -5.855 1.00 0.00 H +ATOM 85 CB ARG 176 -27.703 -26.232 -4.499 1.00 0.00 C +ATOM 86 HB2 ARG 176 -27.919 -27.104 -4.934 1.00 0.00 H +ATOM 87 HB3 ARG 176 -26.751 -26.231 -4.201 1.00 0.00 H +ATOM 88 CG ARG 176 -28.582 -26.093 -3.263 1.00 0.00 C +ATOM 89 HG2 ARG 176 -28.651 -25.127 -3.013 1.00 0.00 H +ATOM 90 HG3 ARG 176 -29.494 -26.450 -3.465 1.00 0.00 H +ATOM 91 CD ARG 176 -28.029 -26.853 -2.073 1.00 0.00 C +ATOM 92 HD2 ARG 176 -28.698 -26.811 -1.338 1.00 0.00 H +ATOM 93 HD3 ARG 176 -27.879 -27.797 -2.350 1.00 0.00 H +ATOM 94 NE ARG 176 -26.768 -26.279 -1.611 1.00 0.00 N +ATOM 95 HE ARG 176 -25.931 -26.828 -1.727 1.00 0.00 H +ATOM 96 CZ ARG 176 -26.649 -25.079 -1.047 1.00 0.00 C +ATOM 97 NH1 ARG 176 -25.462 -24.636 -0.662 1.00 0.00 N +ATOM 98 HH11 ARG 176 -24.638 -25.179 -0.804 1.00 0.00 H +ATOM 99 HH12 ARG 176 -25.387 -23.734 -0.219 1.00 0.00 H +ATOM 100 NH2 ARG 176 -27.717 -24.321 -0.856 1.00 0.00 N +ATOM 101 HH21 ARG 176 -28.617 -24.651 -1.158 1.00 0.00 H +ATOM 102 HH22 ARG 176 -27.634 -23.430 -0.418 1.00 0.00 H +ATOM 103 C ARG 176 -27.593 -23.783 -4.878 1.00 0.00 C +ATOM 104 O ARG 176 -28.505 -23.016 -4.554 1.00 0.00 O +ATOM 105 N GLN 177 -26.313 -23.517 -4.660 1.00 0.00 N +ATOM 106 H GLN 177 -25.654 -24.258 -4.972 1.00 0.00 H +ATOM 107 CA GLN 177 -25.894 -22.281 -4.034 1.00 0.00 C +ATOM 108 HA GLN 177 -26.375 -22.196 -3.149 1.00 0.00 H +ATOM 109 CB GLN 177 -24.390 -22.315 -3.808 1.00 0.00 C +ATOM 110 HB2 GLN 177 -24.174 -23.066 -3.180 1.00 0.00 H +ATOM 111 HB3 GLN 177 -23.935 -22.483 -4.686 1.00 0.00 H +ATOM 112 CG GLN 177 -23.831 -21.036 -3.224 1.00 0.00 C +ATOM 113 HG2 GLN 177 -23.923 -20.309 -3.898 1.00 0.00 H +ATOM 114 HG3 GLN 177 -24.344 -20.808 -2.401 1.00 0.00 H +ATOM 115 CD GLN 177 -22.379 -21.189 -2.867 1.00 0.00 C +ATOM 116 OE1 GLN 177 -21.604 -21.751 -3.639 1.00 0.00 O +ATOM 117 NE2 GLN 177 -21.996 -20.691 -1.694 1.00 0.00 N +ATOM 118 HE21 GLN 177 -21.032 -20.769 -1.378 1.00 0.00 H +ATOM 119 HE22 GLN 177 -22.690 -20.224 -1.110 1.00 0.00 H +ATOM 120 C GLN 177 -26.268 -21.070 -4.879 1.00 0.00 C +ATOM 121 O GLN 177 -26.763 -20.074 -4.355 1.00 0.00 O +ATOM 122 N SER 178 -26.034 -21.158 -6.184 1.00 0.00 N +ATOM 123 H SER 178 -25.612 -22.049 -6.496 1.00 0.00 H +ATOM 124 CA SER 178 -26.362 -20.057 -7.081 1.00 0.00 C +ATOM 125 HA SER 178 -25.897 -19.228 -6.744 1.00 0.00 H +ATOM 126 CB SER 178 -25.888 -20.374 -8.504 1.00 0.00 C +ATOM 127 HB2 SER 178 -26.337 -21.208 -8.813 1.00 0.00 H +ATOM 128 HB3 SER 178 -26.132 -19.613 -9.099 1.00 0.00 H +ATOM 129 OG SER 178 -24.482 -20.562 -8.549 1.00 0.00 O +ATOM 130 HG SER 178 -24.258 -21.476 -8.214 1.00 0.00 H +ATOM 131 C SER 178 -27.863 -19.774 -7.098 1.00 0.00 C +ATOM 132 O SER 178 -28.285 -18.616 -7.152 1.00 0.00 O +ATOM 133 N LEU 179 -28.669 -20.829 -7.054 1.00 0.00 N +ATOM 134 H LEU 179 -28.201 -21.744 -7.001 1.00 0.00 H +ATOM 135 CA LEU 179 -30.117 -20.652 -7.082 1.00 0.00 C +ATOM 136 HA LEU 179 -30.355 -20.079 -7.882 1.00 0.00 H +ATOM 137 CB LEU 179 -30.823 -21.998 -7.275 1.00 0.00 C +ATOM 138 HB2 LEU 179 -30.510 -22.388 -8.129 1.00 0.00 H +ATOM 139 HB3 LEU 179 -30.592 -22.578 -6.509 1.00 0.00 H +ATOM 140 CG LEU 179 -32.355 -21.915 -7.344 1.00 0.00 C +ATOM 141 HG LEU 179 -32.701 -21.589 -6.466 1.00 0.00 H +ATOM 142 CD1 LEU 179 -32.793 -20.955 -8.449 1.00 0.00 C +ATOM 143 HD11 LEU 179 -32.446 -21.281 -9.328 1.00 0.00 H +ATOM 144 HD12 LEU 179 -33.791 -20.915 -8.477 1.00 0.00 H +ATOM 145 HD13 LEU 179 -32.427 -20.044 -8.261 1.00 0.00 H +ATOM 146 CD2 LEU 179 -32.923 -23.296 -7.579 1.00 0.00 C +ATOM 147 HD21 LEU 179 -32.657 -23.905 -6.828 1.00 0.00 H +ATOM 148 HD22 LEU 179 -33.923 -23.249 -7.625 1.00 0.00 H +ATOM 149 HD23 LEU 179 -32.572 -23.666 -8.442 1.00 0.00 H +ATOM 150 C LEU 179 -30.643 -19.964 -5.827 1.00 0.00 C +ATOM 151 O LEU 179 -31.515 -19.100 -5.916 1.00 0.00 O +ATOM 152 N GLU 180 -30.114 -20.332 -4.664 1.00 0.00 N +ATOM 153 H GLU 180 -29.384 -21.055 -4.720 1.00 0.00 H +ATOM 154 CA GLU 180 -30.573 -19.723 -3.431 1.00 0.00 C +ATOM 155 HA GLU 180 -31.571 -19.818 -3.350 1.00 0.00 H +ATOM 156 CB GLU 180 -29.980 -20.469 -2.231 1.00 0.00 C +ATOM 157 HB2 GLU 180 -30.326 -21.392 -2.254 1.00 0.00 H +ATOM 158 HB3 GLU 180 -28.999 -20.442 -2.318 1.00 0.00 H +ATOM 159 CG GLU 180 -30.342 -19.873 -0.882 1.00 0.00 C +ATOM 160 HG2 GLU 180 -29.648 -19.218 -0.637 1.00 0.00 H +ATOM 161 HG3 GLU 180 -31.231 -19.455 -0.955 1.00 0.00 H +ATOM 162 CD GLU 180 -30.412 -20.902 0.231 1.00 0.00 C +ATOM 163 OE1 GLU 180 -29.479 -21.732 0.342 1.00 0.00 O +ATOM 164 OE2 GLU 180 -31.405 -20.868 1.003 1.00 0.00 O +ATOM 165 C GLU 180 -30.206 -18.237 -3.394 1.00 0.00 C +ATOM 166 O GLU 180 -31.022 -17.410 -3.014 1.00 0.00 O +ATOM 167 N ILE 181 -28.991 -17.898 -3.817 1.00 0.00 N +ATOM 168 H ILE 181 -28.400 -18.686 -4.133 1.00 0.00 H +ATOM 169 CA ILE 181 -28.557 -16.506 -3.821 1.00 0.00 C +ATOM 170 HA ILE 181 -28.724 -16.153 -2.890 1.00 0.00 H +ATOM 171 CB ILE 181 -27.079 -16.406 -4.239 1.00 0.00 C +ATOM 172 HB ILE 181 -26.977 -16.860 -5.115 1.00 0.00 H +ATOM 173 CG2 ILE 181 -26.670 -14.946 -4.374 1.00 0.00 C +ATOM 174 HG21 ILE 181 -25.720 -14.892 -4.676 1.00 0.00 H +ATOM 175 HG22 ILE 181 -27.257 -14.496 -5.045 1.00 0.00 H +ATOM 176 HG23 ILE 181 -26.764 -14.490 -3.491 1.00 0.00 H +ATOM 177 CG1 ILE 181 -26.205 -17.135 -3.221 1.00 0.00 C +ATOM 178 HG12 ILE 181 -26.169 -16.593 -2.387 1.00 0.00 H +ATOM 179 HG13 ILE 181 -26.625 -18.016 -3.019 1.00 0.00 H +ATOM 180 CD1 ILE 181 -24.790 -17.375 -3.713 1.00 0.00 C +ATOM 181 HD11 ILE 181 -24.357 -16.498 -3.912 1.00 0.00 H +ATOM 182 HD12 ILE 181 -24.272 -17.853 -3.006 1.00 0.00 H +ATOM 183 HD13 ILE 181 -24.819 -17.931 -4.542 1.00 0.00 H +ATOM 184 C ILE 181 -29.390 -15.639 -4.768 1.00 0.00 C +ATOM 185 O ILE 181 -29.881 -14.570 -4.388 1.00 0.00 O +ATOM 186 N ILE 182 -29.538 -16.098 -6.006 1.00 0.00 N +ATOM 187 H ILE 182 -29.087 -17.009 -6.196 1.00 0.00 H +ATOM 188 CA ILE 182 -30.293 -15.344 -7.008 1.00 0.00 C +ATOM 189 HA ILE 182 -29.944 -14.397 -6.971 1.00 0.00 H +ATOM 190 CB ILE 182 -30.077 -15.948 -8.418 1.00 0.00 C +ATOM 191 HB ILE 182 -30.270 -16.917 -8.367 1.00 0.00 H +ATOM 192 CG2 ILE 182 -31.002 -15.272 -9.432 1.00 0.00 C +ATOM 193 HG21 ILE 182 -30.867 -15.687 -10.329 1.00 0.00 H +ATOM 194 HG22 ILE 182 -31.950 -15.393 -9.146 1.00 0.00 H +ATOM 195 HG23 ILE 182 -30.787 -14.299 -9.477 1.00 0.00 H +ATOM 196 CG1 ILE 182 -28.607 -15.776 -8.836 1.00 0.00 C +ATOM 197 HG12 ILE 182 -28.430 -14.805 -8.974 1.00 0.00 H +ATOM 198 HG13 ILE 182 -28.030 -16.107 -8.092 1.00 0.00 H +ATOM 199 CD1 ILE 182 -28.233 -16.529 -10.110 1.00 0.00 C +ATOM 200 HD11 ILE 182 -28.798 -16.197 -10.861 1.00 0.00 H +ATOM 201 HD12 ILE 182 -27.270 -16.367 -10.312 1.00 0.00 H +ATOM 202 HD13 ILE 182 -28.392 -17.503 -9.970 1.00 0.00 H +ATOM 203 C ILE 182 -31.792 -15.266 -6.690 1.00 0.00 C +ATOM 204 O ILE 182 -32.411 -14.222 -6.884 1.00 0.00 O +ATOM 205 N SER 183 -32.364 -16.364 -6.197 1.00 0.00 N +ATOM 206 H SER 183 -31.726 -17.177 -6.091 1.00 0.00 H +ATOM 207 CA SER 183 -33.785 -16.407 -5.836 1.00 0.00 C +ATOM 208 HA SER 183 -34.316 -16.106 -6.633 1.00 0.00 H +ATOM 209 CB SER 183 -34.195 -17.822 -5.410 1.00 0.00 C +ATOM 210 HB2 SER 183 -33.678 -18.068 -4.594 1.00 0.00 H +ATOM 211 HB3 SER 183 -35.171 -17.819 -5.206 1.00 0.00 H +ATOM 212 OG SER 183 -33.934 -18.750 -6.427 1.00 0.00 O +ATOM 213 HG SER 183 -32.968 -19.016 -6.406 1.00 0.00 H +ATOM 214 C SER 183 -34.077 -15.447 -4.686 1.00 0.00 C +ATOM 215 O SER 183 -35.054 -14.693 -4.717 1.00 0.00 O +ATOM 216 N ARG 184 -33.228 -15.485 -3.665 1.00 0.00 N +ATOM 217 H ARG 184 -32.460 -16.164 -3.751 1.00 0.00 H +ATOM 218 CA ARG 184 -33.417 -14.602 -2.522 1.00 0.00 C +ATOM 219 HA ARG 184 -34.340 -14.751 -2.143 1.00 0.00 H +ATOM 220 CB ARG 184 -32.406 -14.909 -1.415 1.00 0.00 C +ATOM 221 HB2 ARG 184 -31.495 -14.916 -1.821 1.00 0.00 H +ATOM 222 HB3 ARG 184 -32.467 -14.186 -0.731 1.00 0.00 H +ATOM 223 CG ARG 184 -32.626 -16.236 -0.722 1.00 0.00 C +ATOM 224 HG2 ARG 184 -33.580 -16.493 -0.787 1.00 0.00 H +ATOM 225 HG3 ARG 184 -32.043 -16.926 -1.128 1.00 0.00 H +ATOM 226 CD ARG 184 -32.264 -16.113 0.746 1.00 0.00 C +ATOM 227 HD2 ARG 184 -31.310 -15.829 0.808 1.00 0.00 H +ATOM 228 HD3 ARG 184 -32.853 -15.418 1.153 1.00 0.00 H +ATOM 229 NE ARG 184 -32.439 -17.372 1.459 1.00 0.00 N +ATOM 230 HE ARG 184 -32.645 -18.196 0.918 1.00 0.00 H +ATOM 231 CZ ARG 184 -32.344 -17.503 2.777 1.00 0.00 C +ATOM 232 NH1 ARG 184 -32.079 -16.447 3.533 1.00 0.00 N +ATOM 233 HH11 ARG 184 -31.967 -15.541 3.135 1.00 0.00 H +ATOM 234 HH12 ARG 184 -31.990 -16.561 4.531 1.00 0.00 H +ATOM 235 NH2 ARG 184 -32.508 -18.695 3.339 1.00 0.00 N +ATOM 236 HH21 ARG 184 -32.723 -19.488 2.764 1.00 0.00 H +ATOM 237 HH22 ARG 184 -32.420 -18.802 4.326 1.00 0.00 H +ATOM 238 C ARG 184 -33.290 -13.134 -2.923 1.00 0.00 C +ATOM 239 O ARG 184 -34.059 -12.283 -2.466 1.00 0.00 O +ATOM 240 N TYR 185 -32.320 -12.830 -3.777 1.00 0.00 N +ATOM 241 H TYR 185 -31.741 -13.617 -4.093 1.00 0.00 H +ATOM 242 CA TYR 185 -32.137 -11.452 -4.202 1.00 0.00 C +ATOM 243 HA TYR 185 -32.029 -10.877 -3.383 1.00 0.00 H +ATOM 244 CB TYR 185 -30.880 -11.310 -5.074 1.00 0.00 C +ATOM 245 HB2 TYR 185 -30.112 -11.686 -4.573 1.00 0.00 H +ATOM 246 HB3 TYR 185 -31.031 -11.809 -5.917 1.00 0.00 H +ATOM 247 CG TYR 185 -30.570 -9.871 -5.419 1.00 0.00 C +ATOM 248 CD1 TYR 185 -30.431 -8.910 -4.413 1.00 0.00 C +ATOM 249 HD1 TYR 185 -30.515 -9.183 -3.455 1.00 0.00 H +ATOM 250 CE1 TYR 185 -30.178 -7.574 -4.723 1.00 0.00 C +ATOM 251 HE1 TYR 185 -30.077 -6.899 -3.995 1.00 0.00 H +ATOM 252 CZ TYR 185 -30.066 -7.189 -6.058 1.00 0.00 C +ATOM 253 OH TYR 185 -29.845 -5.870 -6.376 1.00 0.00 O +ATOM 254 HH TYR 185 -29.842 -5.326 -5.538 1.00 0.00 H +ATOM 255 CE2 TYR 185 -30.197 -8.120 -7.069 1.00 0.00 C +ATOM 256 HE2 TYR 185 -30.117 -7.847 -8.025 1.00 0.00 H +ATOM 257 CD2 TYR 185 -30.445 -9.460 -6.746 1.00 0.00 C +ATOM 258 HD2 TYR 185 -30.532 -10.128 -7.480 1.00 0.00 H +ATOM 259 C TYR 185 -33.360 -10.955 -4.969 1.00 0.00 C +ATOM 260 O TYR 185 -33.872 -9.872 -4.690 1.00 0.00 O +ATOM 261 N LEU 186 -33.840 -11.739 -5.933 1.00 0.00 N +ATOM 262 H LEU 186 -33.347 -12.629 -6.071 1.00 0.00 H +ATOM 263 CA LEU 186 -35.002 -11.314 -6.721 1.00 0.00 C +ATOM 264 HA LEU 186 -34.796 -10.410 -7.129 1.00 0.00 H +ATOM 265 CB LEU 186 -35.257 -12.282 -7.881 1.00 0.00 C +ATOM 266 HB2 LEU 186 -34.873 -13.166 -7.630 1.00 0.00 H +ATOM 267 HB3 LEU 186 -36.241 -12.357 -8.005 1.00 0.00 H +ATOM 268 CG LEU 186 -34.654 -11.889 -9.231 1.00 0.00 C +ATOM 269 HG LEU 186 -35.038 -11.015 -9.515 1.00 0.00 H +ATOM 270 CD1 LEU 186 -33.146 -11.763 -9.099 1.00 0.00 C +ATOM 271 HD11 LEU 186 -32.760 -12.639 -8.806 1.00 0.00 H +ATOM 272 HD12 LEU 186 -32.752 -11.506 -9.982 1.00 0.00 H +ATOM 273 HD13 LEU 186 -32.926 -11.061 -8.421 1.00 0.00 H +ATOM 274 CD2 LEU 186 -35.024 -12.920 -10.294 1.00 0.00 C +ATOM 275 HD21 LEU 186 -36.019 -12.966 -10.380 1.00 0.00 H +ATOM 276 HD22 LEU 186 -34.624 -12.652 -11.170 1.00 0.00 H +ATOM 277 HD23 LEU 186 -34.670 -13.816 -10.025 1.00 0.00 H +ATOM 278 C LEU 186 -36.268 -11.184 -5.879 1.00 0.00 C +ATOM 279 O LEU 186 -37.076 -10.276 -6.093 1.00 0.00 O +ATOM 280 N ARG 187 -36.440 -12.076 -4.913 1.00 0.00 N +ATOM 281 H ARG 187 -35.706 -12.783 -4.821 1.00 0.00 H +ATOM 282 CA ARG 187 -37.615 -11.988 -4.085 1.00 0.00 C +ATOM 283 HA ARG 187 -38.439 -11.913 -4.678 1.00 0.00 H +ATOM 284 CB ARG 187 -37.800 -13.281 -3.308 1.00 0.00 C +ATOM 285 HB2 ARG 187 -37.759 -14.036 -3.941 1.00 0.00 H +ATOM 286 HB3 ARG 187 -37.094 -13.340 -2.623 1.00 0.00 H +ATOM 287 CG ARG 187 -39.143 -13.318 -2.610 1.00 0.00 C +ATOM 288 HG2 ARG 187 -39.139 -12.689 -1.827 1.00 0.00 H +ATOM 289 HG3 ARG 187 -39.867 -13.037 -3.247 1.00 0.00 H +ATOM 290 CD ARG 187 -39.527 -14.716 -2.071 1.00 0.00 C +ATOM 291 HD2 ARG 187 -39.428 -15.360 -2.826 1.00 0.00 H +ATOM 292 HD3 ARG 187 -38.879 -14.939 -1.346 1.00 0.00 H +ATOM 293 NE ARG 187 -40.880 -14.758 -1.558 1.00 0.00 N +ATOM 294 HE ARG 187 -41.022 -15.060 -0.606 1.00 0.00 H +ATOM 295 CZ ARG 187 -41.962 -14.422 -2.263 1.00 0.00 C +ATOM 296 NH1 ARG 187 -41.866 -14.026 -3.524 1.00 0.00 N +ATOM 297 HH11 ARG 187 -40.975 -13.992 -3.976 1.00 0.00 H +ATOM 298 HH12 ARG 187 -42.689 -13.760 -4.030 1.00 0.00 H +ATOM 299 NH2 ARG 187 -43.169 -14.421 -1.700 1.00 0.00 N +ATOM 300 HH21 ARG 187 -43.253 -14.698 -0.737 1.00 0.00 H +ATOM 301 HH22 ARG 187 -43.969 -14.154 -2.221 1.00 0.00 H +ATOM 302 C ARG 187 -37.607 -10.776 -3.138 1.00 0.00 C +ATOM 303 O ARG 187 -38.623 -10.082 -2.999 1.00 0.00 O +ATOM 304 N GLU 188 -36.486 -10.498 -2.479 1.00 0.00 N +ATOM 305 H GLU 188 -35.700 -11.122 -2.635 1.00 0.00 H +ATOM 306 CA GLU 188 -36.463 -9.332 -1.590 1.00 0.00 C +ATOM 307 HA GLU 188 -37.257 -9.366 -0.968 1.00 0.00 H +ATOM 308 CB GLU 188 -35.257 -9.375 -0.649 1.00 0.00 C +ATOM 309 HB2 GLU 188 -35.354 -8.607 -0.018 1.00 0.00 H +ATOM 310 HB3 GLU 188 -35.314 -10.234 -0.143 1.00 0.00 H +ATOM 311 CG GLU 188 -33.914 -9.293 -1.280 1.00 0.00 C +ATOM 312 HG2 GLU 188 -33.715 -10.144 -1.726 1.00 0.00 H +ATOM 313 HG3 GLU 188 -33.892 -8.530 -1.896 1.00 0.00 H +ATOM 314 CD GLU 188 -32.836 -9.065 -0.246 1.00 0.00 C +ATOM 315 OE1 GLU 188 -32.857 -9.773 0.778 1.00 0.00 O +ATOM 316 OE2 GLU 188 -31.959 -8.199 -0.446 1.00 0.00 O +ATOM 317 C GLU 188 -36.491 -8.010 -2.371 1.00 0.00 C +ATOM 318 O GLU 188 -36.955 -6.991 -1.860 1.00 0.00 O +ATOM 319 N GLN 189 -35.996 -8.024 -3.606 1.00 0.00 N +ATOM 320 H GLN 189 -35.603 -8.921 -3.916 1.00 0.00 H +ATOM 321 CA GLN 189 -36.035 -6.818 -4.421 1.00 0.00 C +ATOM 322 HA GLN 189 -35.710 -6.055 -3.868 1.00 0.00 H +ATOM 323 CB GLN 189 -35.194 -7.003 -5.691 1.00 0.00 C +ATOM 324 HB2 GLN 189 -35.385 -7.912 -6.070 1.00 0.00 H +ATOM 325 HB3 GLN 189 -35.471 -6.308 -6.361 1.00 0.00 H +ATOM 326 CG GLN 189 -33.694 -6.884 -5.479 1.00 0.00 C +ATOM 327 HG2 GLN 189 -33.455 -7.324 -4.617 1.00 0.00 H +ATOM 328 HG3 GLN 189 -33.226 -7.337 -6.234 1.00 0.00 H +ATOM 329 CD GLN 189 -33.241 -5.437 -5.425 1.00 0.00 C +ATOM 330 OE1 GLN 189 -33.468 -4.676 -6.366 1.00 0.00 O +ATOM 331 NE2 GLN 189 -32.601 -5.047 -4.324 1.00 0.00 N +ATOM 332 HE21 GLN 189 -32.259 -4.100 -4.226 1.00 0.00 H +ATOM 333 HE22 GLN 189 -32.462 -5.726 -3.575 1.00 0.00 H +ATOM 334 C GLN 189 -37.491 -6.535 -4.794 1.00 0.00 C +ATOM 335 O GLN 189 -37.945 -5.398 -4.771 1.00 0.00 O +ATOM 336 N ALA 190 -38.227 -7.591 -5.125 1.00 0.00 N +ATOM 337 H ALA 190 -37.734 -8.501 -5.082 1.00 0.00 H +ATOM 338 CA ALA 190 -39.628 -7.450 -5.517 1.00 0.00 C +ATOM 339 HA ALA 190 -39.696 -6.704 -6.210 1.00 0.00 H +ATOM 340 CB ALA 190 -40.105 -8.721 -6.222 1.00 0.00 C +ATOM 341 HB1 ALA 190 -39.426 -9.442 -6.098 1.00 0.00 H +ATOM 342 HB2 ALA 190 -40.976 -9.010 -5.829 1.00 0.00 H +ATOM 343 HB3 ALA 190 -40.222 -8.534 -7.196 1.00 0.00 H +ATOM 344 C ALA 190 -40.575 -7.118 -4.363 1.00 0.00 C +ATOM 345 O ALA 190 -41.540 -6.361 -4.534 1.00 0.00 O +ATOM 346 N THR 191 -40.291 -7.670 -3.188 1.00 0.00 N +ATOM 347 H THR 191 -39.428 -8.249 -3.176 1.00 0.00 H +ATOM 348 CA THR 191 -41.137 -7.467 -2.017 1.00 0.00 C +ATOM 349 HA THR 191 -42.084 -7.255 -2.340 1.00 0.00 H +ATOM 350 CB THR 191 -41.212 -8.756 -1.190 1.00 0.00 C +ATOM 351 HB THR 191 -41.899 -8.633 -0.445 1.00 0.00 H +ATOM 352 CG2 THR 191 -41.579 -9.934 -2.094 1.00 0.00 C +ATOM 353 HG21 THR 191 -40.796 -10.553 -2.174 1.00 0.00 H +ATOM 354 HG22 THR 191 -42.355 -10.430 -1.701 1.00 0.00 H +ATOM 355 HG23 THR 191 -41.828 -9.595 -3.003 1.00 0.00 H +ATOM 356 OG1 THR 191 -39.938 -9.010 -0.582 1.00 0.00 O +ATOM 357 HG1 THR 191 -39.291 -9.367 -1.264 1.00 0.00 H +ATOM 358 C THR 191 -40.690 -6.337 -1.095 1.00 0.00 C +ATOM 359 O THR 191 -41.528 -5.627 -0.535 1.00 0.00 O +ATOM 360 N GLY 192 -39.380 -6.175 -0.932 1.00 0.00 N +ATOM 361 H GLY 192 -38.786 -6.840 -1.450 1.00 0.00 H +ATOM 362 CA GLY 192 -38.866 -5.120 -0.073 1.00 0.00 C +ATOM 363 HA2 GLY 192 -38.083 -4.662 -0.540 1.00 0.00 H +ATOM 364 HA3 GLY 192 -39.585 -4.405 0.045 1.00 0.00 H +ATOM 365 C GLY 192 -38.419 -5.605 1.289 1.00 0.00 C +ATOM 366 O GLY 192 -38.015 -4.815 2.149 1.00 0.00 O +ATOM 367 N ALA 193 -38.481 -6.913 1.503 1.00 0.00 N +ATOM 368 H ALA 193 -38.812 -7.479 0.708 1.00 0.00 H +ATOM 369 CA ALA 193 -38.095 -7.481 2.800 1.00 0.00 C +ATOM 370 HA ALA 193 -37.816 -6.717 3.416 1.00 0.00 H +ATOM 371 CB ALA 193 -39.311 -8.131 3.428 1.00 0.00 C +ATOM 372 HB1 ALA 193 -39.671 -8.836 2.816 1.00 0.00 H +ATOM 373 HB2 ALA 193 -39.057 -8.551 4.300 1.00 0.00 H +ATOM 374 HB3 ALA 193 -40.018 -7.441 3.588 1.00 0.00 H +ATOM 375 C ALA 193 -36.941 -8.491 2.737 1.00 0.00 C +ATOM 376 O ALA 193 -36.797 -9.218 1.764 1.00 0.00 O +ATOM 377 N LYS 194 -36.137 -8.521 3.792 1.00 0.00 N +ATOM 378 H LYS 194 -36.399 -7.834 4.546 1.00 0.00 H +ATOM 379 CA LYS 194 -35.000 -9.414 3.905 1.00 0.00 C +ATOM 380 HA LYS 194 -34.637 -9.608 2.994 1.00 0.00 H +ATOM 381 CB LYS 194 -33.962 -8.782 4.828 1.00 0.00 C +ATOM 382 HB2 LYS 194 -34.314 -7.891 5.142 1.00 0.00 H +ATOM 383 HB3 LYS 194 -33.850 -9.376 5.637 1.00 0.00 H +ATOM 384 CG LYS 194 -32.552 -8.537 4.238 1.00 0.00 C +ATOM 385 HG2 LYS 194 -32.228 -9.382 3.836 1.00 0.00 H +ATOM 386 HG3 LYS 194 -32.614 -7.819 3.560 1.00 0.00 H +ATOM 387 CD LYS 194 -31.598 -8.106 5.345 1.00 0.00 C +ATOM 388 HD2 LYS 194 -30.683 -8.034 4.977 1.00 0.00 H +ATOM 389 HD3 LYS 194 -31.904 -7.246 5.723 1.00 0.00 H +ATOM 390 CE LYS 194 -31.578 -9.150 6.480 1.00 0.00 C +ATOM 391 HE2 LYS 194 -31.475 -8.660 7.367 1.00 0.00 H +ATOM 392 HE3 LYS 194 -32.485 -9.612 6.509 1.00 0.00 H +ATOM 393 NZ LYS 194 -30.502 -10.219 6.399 1.00 0.00 N +ATOM 394 HZ1 LYS 194 -29.673 -9.866 6.821 1.00 0.00 H +ATOM 395 HZ2 LYS 194 -30.821 -11.027 6.884 1.00 0.00 H +ATOM 396 HZ3 LYS 194 -30.339 -10.432 5.441 1.00 0.00 H +ATOM 397 C LYS 194 -35.461 -10.736 4.534 1.00 0.00 C +ATOM 398 O LYS 194 -36.205 -10.719 5.517 1.00 0.00 O +ATOM 399 N ASP 195 -35.042 -11.872 3.975 1.00 0.00 N +ATOM 400 H ASP 195 -34.456 -11.759 3.133 1.00 0.00 H +ATOM 401 CA ASP 195 -35.407 -13.175 4.543 1.00 0.00 C +ATOM 402 HA ASP 195 -36.292 -13.075 4.961 1.00 0.00 H +ATOM 403 CB ASP 195 -35.264 -14.296 3.512 1.00 0.00 C +ATOM 404 HB2 ASP 195 -35.753 -14.024 2.693 1.00 0.00 H +ATOM 405 HB3 ASP 195 -34.299 -14.418 3.323 1.00 0.00 H +ATOM 406 CG ASP 195 -35.836 -15.608 4.010 1.00 0.00 C +ATOM 407 OD1 ASP 195 -35.806 -15.841 5.242 1.00 0.00 O +ATOM 408 OD2 ASP 195 -36.306 -16.414 3.179 1.00 0.00 O +ATOM 409 C ASP 195 -34.400 -13.409 5.671 1.00 0.00 C +ATOM 410 O ASP 195 -33.192 -13.293 5.460 1.00 0.00 O +ATOM 411 N THR 196 -34.881 -13.764 6.859 1.00 0.00 N +ATOM 412 H THR 196 -35.908 -13.876 6.902 1.00 0.00 H +ATOM 413 CA THR 196 -33.995 -13.974 8.004 1.00 0.00 C +ATOM 414 HA THR 196 -33.160 -13.396 7.871 1.00 0.00 H +ATOM 415 CB THR 196 -34.663 -13.462 9.298 1.00 0.00 C +ATOM 416 HB THR 196 -34.741 -12.447 9.246 1.00 0.00 H +ATOM 417 CG2 THR 196 -36.039 -14.081 9.476 1.00 0.00 C +ATOM 418 HG21 THR 196 -36.744 -13.372 9.400 1.00 0.00 H +ATOM 419 HG22 THR 196 -36.195 -14.775 8.769 1.00 0.00 H +ATOM 420 HG23 THR 196 -36.105 -14.513 10.379 1.00 0.00 H +ATOM 421 OG1 THR 196 -33.838 -13.793 10.419 1.00 0.00 O +ATOM 422 HG1 THR 196 -33.244 -14.575 10.199 1.00 0.00 H +ATOM 423 C THR 196 -33.533 -15.420 8.225 1.00 0.00 C +ATOM 424 O THR 196 -32.717 -15.686 9.106 1.00 0.00 O +ATOM 425 N LYS 197 -34.047 -16.354 7.436 1.00 0.00 N +ATOM 426 H LYS 197 -34.728 -16.019 6.736 1.00 0.00 H +ATOM 427 CA LYS 197 -33.653 -17.761 7.574 1.00 0.00 C +ATOM 428 HA LYS 197 -33.695 -18.013 8.550 1.00 0.00 H +ATOM 429 CB LYS 197 -34.582 -18.672 6.768 1.00 0.00 C +ATOM 430 HB2 LYS 197 -34.700 -18.260 5.855 1.00 0.00 H +ATOM 431 HB3 LYS 197 -34.116 -19.560 6.652 1.00 0.00 H +ATOM 432 CG LYS 197 -35.945 -18.920 7.360 1.00 0.00 C +ATOM 433 HG2 LYS 197 -35.859 -19.468 8.180 1.00 0.00 H +ATOM 434 HG3 LYS 197 -36.390 -18.057 7.552 1.00 0.00 H +ATOM 435 CD LYS 197 -36.792 -19.691 6.345 1.00 0.00 C +ATOM 436 HD2 LYS 197 -36.349 -20.560 6.155 1.00 0.00 H +ATOM 437 HD3 LYS 197 -37.697 -19.837 6.728 1.00 0.00 H +ATOM 438 CE LYS 197 -36.937 -18.921 5.034 1.00 0.00 C +ATOM 439 HE2 LYS 197 -37.346 -18.024 5.233 1.00 0.00 H +ATOM 440 HE3 LYS 197 -36.021 -18.775 4.645 1.00 0.00 H +ATOM 441 NZ LYS 197 -37.781 -19.638 4.047 1.00 0.00 N +ATOM 442 HZ1 LYS 197 -37.836 -19.103 3.203 1.00 0.00 H +ATOM 443 HZ2 LYS 197 -37.377 -20.532 3.849 1.00 0.00 H +ATOM 444 HZ3 LYS 197 -38.700 -19.763 4.422 1.00 0.00 H +ATOM 445 C LYS 197 -32.235 -17.999 7.066 1.00 0.00 C +ATOM 446 O LYS 197 -31.797 -17.352 6.116 1.00 0.00 O +ATOM 447 N PRO 198 -31.498 -18.937 7.693 1.00 0.00 N +ATOM 448 CD PRO 198 -31.793 -19.679 8.933 1.00 0.00 C +ATOM 449 HD2 PRO 198 -32.731 -20.015 8.924 1.00 0.00 H +ATOM 450 HD3 PRO 198 -31.646 -19.099 9.731 1.00 0.00 H +ATOM 451 CG PRO 198 -30.801 -20.803 8.874 1.00 0.00 C +ATOM 452 HG2 PRO 198 -31.115 -21.527 8.265 1.00 0.00 H +ATOM 453 HG3 PRO 198 -30.624 -21.173 9.782 1.00 0.00 H +ATOM 454 CB PRO 198 -29.581 -20.144 8.326 1.00 0.00 C +ATOM 455 HB2 PRO 198 -28.955 -20.816 7.932 1.00 0.00 H +ATOM 456 HB3 PRO 198 -29.107 -19.620 9.032 1.00 0.00 H +ATOM 457 CA PRO 198 -30.132 -19.217 7.241 1.00 0.00 C +ATOM 458 HA PRO 198 -29.578 -18.369 7.242 1.00 0.00 H +ATOM 459 C PRO 198 -30.105 -19.878 5.874 1.00 0.00 C +ATOM 460 O PRO 198 -31.050 -20.558 5.479 1.00 0.00 O +ATOM 461 N MET 199 -29.018 -19.659 5.146 1.00 0.00 N +ATOM 462 H MET 199 -28.313 -19.040 5.584 1.00 0.00 H +ATOM 463 CA MET 199 -28.864 -20.261 3.834 1.00 0.00 C +ATOM 464 HA MET 199 -29.708 -20.131 3.324 1.00 0.00 H +ATOM 465 CB MET 199 -27.650 -19.656 3.126 1.00 0.00 C +ATOM 466 HB2 MET 199 -26.845 -19.720 3.736 1.00 0.00 H +ATOM 467 HB3 MET 199 -27.449 -20.196 2.295 1.00 0.00 H +ATOM 468 CG MET 199 -27.807 -18.184 2.705 1.00 0.00 C +ATOM 469 HG2 MET 199 -28.163 -17.663 3.515 1.00 0.00 H +ATOM 470 HG3 MET 199 -26.869 -17.806 2.530 1.00 0.00 H +ATOM 471 SD MET 199 -28.869 -17.976 1.279 1.00 0.00 S +ATOM 472 CE MET 199 -29.039 -16.192 1.184 1.00 0.00 C +ATOM 473 HE1 MET 199 -28.557 -15.769 1.952 1.00 0.00 H +ATOM 474 HE2 MET 199 -28.647 -15.864 0.324 1.00 0.00 H +ATOM 475 HE3 MET 199 -30.008 -15.946 1.223 1.00 0.00 H +ATOM 476 C MET 199 -28.659 -21.757 4.034 1.00 0.00 C +ATOM 477 O MET 199 -28.502 -22.222 5.167 1.00 0.00 O +ATOM 478 N GLY 200 -28.675 -22.519 2.944 1.00 0.00 N +ATOM 479 H GLY 200 -28.837 -22.025 2.059 1.00 0.00 H +ATOM 480 CA GLY 200 -28.471 -23.950 3.064 1.00 0.00 C +ATOM 481 HA2 GLY 200 -29.090 -24.324 3.751 1.00 0.00 H +ATOM 482 HA3 GLY 200 -28.639 -24.391 2.185 1.00 0.00 H +ATOM 483 C GLY 200 -27.036 -24.195 3.488 1.00 0.00 C +ATOM 484 O GLY 200 -26.294 -23.225 3.695 1.00 0.00 O +TER 485 GLY 200 +ATOM 486 N SER 202 -22.146 -24.130 3.748 1.00 0.00 N +ATOM 487 H SER 202 -22.234 -23.719 4.664 1.00 0.00 H +ATOM 488 CA SER 202 -22.622 -23.510 2.517 1.00 0.00 C +ATOM 489 HA SER 202 -21.830 -23.349 1.919 1.00 0.00 H +ATOM 490 CB SER 202 -23.636 -24.435 1.814 1.00 0.00 C +ATOM 491 HB2 SER 202 -24.414 -24.578 2.423 1.00 0.00 H +ATOM 492 HB3 SER 202 -23.943 -23.992 0.974 1.00 0.00 H +ATOM 493 OG SER 202 -23.074 -25.710 1.481 1.00 0.00 O +ATOM 494 HG SER 202 -22.978 -25.775 0.491 1.00 0.00 H +ATOM 495 C SER 202 -23.272 -22.153 2.804 1.00 0.00 C +ATOM 496 O SER 202 -23.310 -21.276 1.936 1.00 0.00 O +ATOM 497 N GLY 203 -23.777 -21.984 4.021 1.00 0.00 N +ATOM 498 H GLY 203 -23.655 -22.788 4.661 1.00 0.00 H +ATOM 499 CA GLY 203 -24.441 -20.751 4.383 1.00 0.00 C +ATOM 500 HA2 GLY 203 -25.256 -20.613 3.746 1.00 0.00 H +ATOM 501 HA3 GLY 203 -24.892 -20.877 5.315 1.00 0.00 H +ATOM 502 C GLY 203 -23.633 -19.469 4.412 1.00 0.00 C +ATOM 503 O GLY 203 -24.079 -18.443 3.888 1.00 0.00 O +ATOM 504 N ALA 204 -22.455 -19.505 5.029 1.00 0.00 N +ATOM 505 H ALA 204 -22.188 -20.427 5.414 1.00 0.00 H +ATOM 506 CA ALA 204 -21.620 -18.309 5.138 1.00 0.00 C +ATOM 507 HA ALA 204 -22.069 -17.664 5.793 1.00 0.00 H +ATOM 508 CB ALA 204 -20.295 -18.660 5.774 1.00 0.00 C +ATOM 509 HB1 ALA 204 -19.693 -19.083 5.094 1.00 0.00 H +ATOM 510 HB2 ALA 204 -19.858 -17.831 6.128 1.00 0.00 H +ATOM 511 HB3 ALA 204 -20.440 -19.302 6.529 1.00 0.00 H +ATOM 512 C ALA 204 -21.387 -17.579 3.827 1.00 0.00 C +ATOM 513 O ALA 204 -21.739 -16.404 3.713 1.00 0.00 O +ATOM 514 N THR 205 -20.775 -18.251 2.859 1.00 0.00 N +ATOM 515 H THR 205 -20.498 -19.217 3.100 1.00 0.00 H +ATOM 516 CA THR 205 -20.532 -17.633 1.568 1.00 0.00 C +ATOM 517 HA THR 205 -19.930 -16.829 1.705 1.00 0.00 H +ATOM 518 CB THR 205 -19.838 -18.600 0.603 1.00 0.00 C +ATOM 519 HB THR 205 -20.388 -19.459 0.541 1.00 0.00 H +ATOM 520 CG2 THR 205 -19.688 -17.969 -0.767 1.00 0.00 C +ATOM 521 HG21 THR 205 -18.922 -18.393 -1.258 1.00 0.00 H +ATOM 522 HG22 THR 205 -20.529 -18.100 -1.299 1.00 0.00 H +ATOM 523 HG23 THR 205 -19.511 -16.986 -0.674 1.00 0.00 H +ATOM 524 OG1 THR 205 -18.539 -18.940 1.106 1.00 0.00 O +ATOM 525 HG1 THR 205 -17.858 -18.903 0.367 1.00 0.00 H +ATOM 526 C THR 205 -21.813 -17.161 0.908 1.00 0.00 C +ATOM 527 O THR 205 -21.870 -16.049 0.377 1.00 0.00 O +ATOM 528 N SER 206 -22.849 -17.987 0.930 1.00 0.00 N +ATOM 529 H SER 206 -22.712 -18.880 1.388 1.00 0.00 H +ATOM 530 CA SER 206 -24.082 -17.545 0.301 1.00 0.00 C +ATOM 531 HA SER 206 -23.894 -17.344 -0.664 1.00 0.00 H +ATOM 532 CB SER 206 -25.163 -18.627 0.400 1.00 0.00 C +ATOM 533 HB2 SER 206 -25.271 -18.884 1.360 1.00 0.00 H +ATOM 534 HB3 SER 206 -26.023 -18.250 0.057 1.00 0.00 H +ATOM 535 OG SER 206 -24.833 -19.780 -0.352 1.00 0.00 O +ATOM 536 HG SER 206 -24.317 -20.416 0.221 1.00 0.00 H +ATOM 537 C SER 206 -24.580 -16.241 0.955 1.00 0.00 C +ATOM 538 O SER 206 -25.060 -15.346 0.260 1.00 0.00 O +ATOM 539 N ARG 207 -24.463 -16.128 2.280 1.00 0.00 N +ATOM 540 H ARG 207 -24.026 -16.932 2.753 1.00 0.00 H +ATOM 541 CA ARG 207 -24.935 -14.931 2.966 1.00 0.00 C +ATOM 542 HA ARG 207 -25.912 -14.791 2.736 1.00 0.00 H +ATOM 543 CB ARG 207 -24.870 -15.099 4.487 1.00 0.00 C +ATOM 544 HB2 ARG 207 -25.449 -15.865 4.741 1.00 0.00 H +ATOM 545 HB3 ARG 207 -23.926 -15.277 4.741 1.00 0.00 H +ATOM 546 CG ARG 207 -25.343 -13.873 5.257 1.00 0.00 C +ATOM 547 HG2 ARG 207 -24.726 -13.107 5.076 1.00 0.00 H +ATOM 548 HG3 ARG 207 -26.268 -13.633 4.965 1.00 0.00 H +ATOM 549 CD ARG 207 -25.374 -14.106 6.768 1.00 0.00 C +ATOM 550 HD2 ARG 207 -25.475 -13.222 7.213 1.00 0.00 H +ATOM 551 HD3 ARG 207 -26.156 -14.687 6.972 1.00 0.00 H +ATOM 552 NE ARG 207 -24.150 -14.753 7.248 1.00 0.00 N +ATOM 553 HE ARG 207 -23.369 -14.165 7.482 1.00 0.00 H +ATOM 554 CZ ARG 207 -24.008 -16.068 7.394 1.00 0.00 C +ATOM 555 NH1 ARG 207 -25.010 -16.887 7.093 1.00 0.00 N +ATOM 556 HH11 ARG 207 -25.871 -16.536 6.737 1.00 0.00 H +ATOM 557 HH12 ARG 207 -24.897 -17.879 7.226 1.00 0.00 H +ATOM 558 NH2 ARG 207 -22.882 -16.570 7.876 1.00 0.00 N +ATOM 559 HH21 ARG 207 -22.127 -15.951 8.113 1.00 0.00 H +ATOM 560 HH22 ARG 207 -22.779 -17.553 8.003 1.00 0.00 H +ATOM 561 C ARG 207 -24.159 -13.691 2.565 1.00 0.00 C +ATOM 562 O ARG 207 -24.739 -12.622 2.380 1.00 0.00 O +ATOM 563 N LYS 208 -22.847 -13.824 2.452 1.00 0.00 N +ATOM 564 H LYS 208 -22.477 -14.764 2.651 1.00 0.00 H +ATOM 565 CA LYS 208 -22.031 -12.689 2.070 1.00 0.00 C +ATOM 566 HA LYS 208 -22.285 -11.895 2.630 1.00 0.00 H +ATOM 567 CB LYS 208 -20.548 -12.995 2.327 1.00 0.00 C +ATOM 568 HB2 LYS 208 -20.249 -13.677 1.671 1.00 0.00 H +ATOM 569 HB3 LYS 208 -20.030 -12.155 2.219 1.00 0.00 H +ATOM 570 CG LYS 208 -20.272 -13.545 3.743 1.00 0.00 C +ATOM 571 HG2 LYS 208 -20.522 -12.847 4.412 1.00 0.00 H +ATOM 572 HG3 LYS 208 -20.829 -14.361 3.884 1.00 0.00 H +ATOM 573 CD LYS 208 -18.793 -13.913 3.941 1.00 0.00 C +ATOM 574 HD2 LYS 208 -18.726 -14.565 4.691 1.00 0.00 H +ATOM 575 HD3 LYS 208 -18.451 -14.319 3.099 1.00 0.00 H +ATOM 576 CE LYS 208 -17.930 -12.693 4.278 1.00 0.00 C +ATOM 577 HE2 LYS 208 -16.968 -12.964 4.247 1.00 0.00 H +ATOM 578 HE3 LYS 208 -18.098 -11.984 3.594 1.00 0.00 H +ATOM 579 NZ LYS 208 -18.254 -12.166 5.628 1.00 0.00 N +ATOM 580 HZ1 LYS 208 -18.502 -12.924 6.231 1.00 0.00 H +ATOM 581 HZ2 LYS 208 -17.457 -11.691 6.000 1.00 0.00 H +ATOM 582 HZ3 LYS 208 -19.022 -11.528 5.561 1.00 0.00 H +ATOM 583 C LYS 208 -22.269 -12.344 0.603 1.00 0.00 C +ATOM 584 O LYS 208 -22.216 -11.180 0.220 1.00 0.00 O +ATOM 585 N ALA 209 -22.535 -13.358 -0.219 1.00 0.00 N +ATOM 586 H ALA 209 -22.551 -14.292 0.224 1.00 0.00 H +ATOM 587 CA ALA 209 -22.784 -13.136 -1.649 1.00 0.00 C +ATOM 588 HA ALA 209 -22.020 -12.620 -2.033 1.00 0.00 H +ATOM 589 CB ALA 209 -22.907 -14.491 -2.387 1.00 0.00 C +ATOM 590 HB1 ALA 209 -23.859 -14.782 -2.368 1.00 0.00 H +ATOM 591 HB2 ALA 209 -22.604 -14.373 -3.328 1.00 0.00 H +ATOM 592 HB3 ALA 209 -22.335 -15.162 -1.925 1.00 0.00 H +ATOM 593 C ALA 209 -24.065 -12.313 -1.817 1.00 0.00 C +ATOM 594 O ALA 209 -24.118 -11.411 -2.654 1.00 0.00 O +ATOM 595 N LEU 210 -25.086 -12.614 -1.014 1.00 0.00 N +ATOM 596 H LEU 210 -24.914 -13.393 -0.359 1.00 0.00 H +ATOM 597 CA LEU 210 -26.340 -11.872 -1.086 1.00 0.00 C +ATOM 598 HA LEU 210 -26.663 -11.880 -2.037 1.00 0.00 H +ATOM 599 CB LEU 210 -27.393 -12.512 -0.177 1.00 0.00 C +ATOM 600 HB2 LEU 210 -27.535 -13.450 -0.489 1.00 0.00 H +ATOM 601 HB3 LEU 210 -27.031 -12.517 0.753 1.00 0.00 H +ATOM 602 CG LEU 210 -28.766 -11.836 -0.129 1.00 0.00 C +ATOM 603 HG LEU 210 -28.666 -10.918 0.234 1.00 0.00 H +ATOM 604 CD1 LEU 210 -29.339 -11.757 -1.551 1.00 0.00 C +ATOM 605 HD11 LEU 210 -29.430 -12.680 -1.919 1.00 0.00 H +ATOM 606 HD12 LEU 210 -30.234 -11.316 -1.520 1.00 0.00 H +ATOM 607 HD13 LEU 210 -28.720 -11.224 -2.125 1.00 0.00 H +ATOM 608 CD2 LEU 210 -29.717 -12.614 0.785 1.00 0.00 C +ATOM 609 HD21 LEU 210 -29.336 -12.644 1.708 1.00 0.00 H +ATOM 610 HD22 LEU 210 -30.605 -12.157 0.802 1.00 0.00 H +ATOM 611 HD23 LEU 210 -29.824 -13.544 0.435 1.00 0.00 H +ATOM 612 C LEU 210 -26.126 -10.426 -0.661 1.00 0.00 C +ATOM 613 O LEU 210 -26.672 -9.500 -1.267 1.00 0.00 O +ATOM 614 N GLU 211 -25.336 -10.239 0.392 1.00 0.00 N +ATOM 615 H GLU 211 -24.941 -11.106 0.802 1.00 0.00 H +ATOM 616 CA GLU 211 -25.060 -8.902 0.914 1.00 0.00 C +ATOM 617 HA GLU 211 -25.921 -8.451 1.161 1.00 0.00 H +ATOM 618 CB GLU 211 -24.248 -9.010 2.216 1.00 0.00 C +ATOM 619 HB2 GLU 211 -23.607 -9.734 2.109 1.00 0.00 H +ATOM 620 HB3 GLU 211 -23.845 -8.143 2.390 1.00 0.00 H +ATOM 621 CG GLU 211 -25.141 -9.355 3.414 1.00 0.00 C +ATOM 622 HG2 GLU 211 -25.576 -8.524 3.721 1.00 0.00 H +ATOM 623 HG3 GLU 211 -25.805 -10.024 3.121 1.00 0.00 H +ATOM 624 CD GLU 211 -24.396 -9.950 4.615 1.00 0.00 C +ATOM 625 OE1 GLU 211 -23.160 -10.134 4.545 1.00 0.00 O +ATOM 626 OE2 GLU 211 -25.066 -10.236 5.638 1.00 0.00 O +ATOM 627 C GLU 211 -24.331 -8.066 -0.137 1.00 0.00 C +ATOM 628 O GLU 211 -24.606 -6.878 -0.308 1.00 0.00 O +ATOM 629 N THR 212 -23.403 -8.695 -0.850 1.00 0.00 N +ATOM 630 H THR 212 -23.261 -9.693 -0.597 1.00 0.00 H +ATOM 631 CA THR 212 -22.652 -8.019 -1.903 1.00 0.00 C +ATOM 632 HA THR 212 -22.234 -7.197 -1.521 1.00 0.00 H +ATOM 633 CB THR 212 -21.593 -8.951 -2.489 1.00 0.00 C +ATOM 634 HB THR 212 -22.050 -9.782 -2.864 1.00 0.00 H +ATOM 635 CG2 THR 212 -20.804 -8.250 -3.592 1.00 0.00 C +ATOM 636 HG21 THR 212 -20.406 -8.932 -4.208 1.00 0.00 H +ATOM 637 HG22 THR 212 -21.413 -7.649 -4.113 1.00 0.00 H +ATOM 638 HG23 THR 212 -20.069 -7.704 -3.186 1.00 0.00 H +ATOM 639 OG1 THR 212 -20.707 -9.364 -1.445 1.00 0.00 O +ATOM 640 HG1 THR 212 -21.163 -10.025 -0.839 1.00 0.00 H +ATOM 641 C THR 212 -23.621 -7.598 -3.006 1.00 0.00 C +ATOM 642 O THR 212 -23.522 -6.497 -3.545 1.00 0.00 O +ATOM 643 N LEU 213 -24.557 -8.483 -3.353 1.00 0.00 N +ATOM 644 H LEU 213 -24.524 -9.381 -2.857 1.00 0.00 H +ATOM 645 CA LEU 213 -25.546 -8.147 -4.381 1.00 0.00 C +ATOM 646 HA LEU 213 -25.055 -7.882 -5.224 1.00 0.00 H +ATOM 647 CB LEU 213 -26.428 -9.358 -4.726 1.00 0.00 C +ATOM 648 HB2 LEU 213 -26.596 -9.861 -3.876 1.00 0.00 H +ATOM 649 HB3 LEU 213 -27.295 -9.008 -5.081 1.00 0.00 H +ATOM 650 CG LEU 213 -25.884 -10.357 -5.747 1.00 0.00 C +ATOM 651 HG LEU 213 -24.983 -10.658 -5.458 1.00 0.00 H +ATOM 652 CD1 LEU 213 -26.821 -11.552 -5.819 1.00 0.00 C +ATOM 653 HD11 LEU 213 -27.732 -11.247 -6.099 1.00 0.00 H +ATOM 654 HD12 LEU 213 -26.472 -12.212 -6.486 1.00 0.00 H +ATOM 655 HD13 LEU 213 -26.878 -11.987 -4.920 1.00 0.00 H +ATOM 656 CD2 LEU 213 -25.750 -9.692 -7.117 1.00 0.00 C +ATOM 657 HD21 LEU 213 -25.122 -8.917 -7.049 1.00 0.00 H +ATOM 658 HD22 LEU 213 -25.394 -10.356 -7.774 1.00 0.00 H +ATOM 659 HD23 LEU 213 -26.647 -9.371 -7.418 1.00 0.00 H +ATOM 660 C LEU 213 -26.448 -6.975 -3.966 1.00 0.00 C +ATOM 661 O LEU 213 -26.835 -6.171 -4.802 1.00 0.00 O +ATOM 662 N ARG 214 -26.796 -6.887 -2.684 1.00 0.00 N +ATOM 663 H ARG 214 -26.430 -7.627 -2.072 1.00 0.00 H +ATOM 664 CA ARG 214 -27.649 -5.788 -2.220 1.00 0.00 C +ATOM 665 HA ARG 214 -28.475 -5.762 -2.789 1.00 0.00 H +ATOM 666 CB ARG 214 -28.025 -5.958 -0.756 1.00 0.00 C +ATOM 667 HB2 ARG 214 -27.182 -6.127 -0.238 1.00 0.00 H +ATOM 668 HB3 ARG 214 -28.433 -5.097 -0.439 1.00 0.00 H +ATOM 669 CG ARG 214 -28.986 -7.069 -0.472 1.00 0.00 C +ATOM 670 HG2 ARG 214 -29.854 -6.889 -0.908 1.00 0.00 H +ATOM 671 HG3 ARG 214 -28.606 -7.932 -0.769 1.00 0.00 H +ATOM 672 CD ARG 214 -29.212 -7.141 1.020 1.00 0.00 C +ATOM 673 HD2 ARG 214 -28.324 -7.169 1.469 1.00 0.00 H +ATOM 674 HD3 ARG 214 -29.714 -6.327 1.299 1.00 0.00 H +ATOM 675 NE ARG 214 -29.974 -8.325 1.382 1.00 0.00 N +ATOM 676 HE ARG 214 -30.629 -8.690 0.709 1.00 0.00 H +ATOM 677 CZ ARG 214 -29.859 -8.952 2.541 1.00 0.00 C +ATOM 678 NH1 ARG 214 -29.010 -8.502 3.450 1.00 0.00 N +ATOM 679 HH11 ARG 214 -28.462 -7.685 3.296 1.00 0.00 H +ATOM 680 HH12 ARG 214 -28.912 -8.997 4.327 1.00 0.00 H +ATOM 681 NH2 ARG 214 -30.589 -10.032 2.782 1.00 0.00 N +ATOM 682 HH21 ARG 214 -31.240 -10.358 2.092 1.00 0.00 H +ATOM 683 HH22 ARG 214 -30.494 -10.521 3.648 1.00 0.00 H +ATOM 684 C ARG 214 -26.916 -4.468 -2.353 1.00 0.00 C +ATOM 685 O ARG 214 -27.527 -3.411 -2.529 1.00 0.00 O +ATOM 686 N ARG 215 -25.598 -4.531 -2.240 1.00 0.00 N +ATOM 687 H ARG 215 -25.218 -5.484 -2.074 1.00 0.00 H +ATOM 688 CA ARG 215 -24.772 -3.343 -2.344 1.00 0.00 C +ATOM 689 HA ARG 215 -25.251 -2.571 -1.903 1.00 0.00 H +ATOM 690 CB ARG 215 -23.456 -3.579 -1.595 1.00 0.00 C +ATOM 691 HB2 ARG 215 -23.668 -3.684 -0.620 1.00 0.00 H +ATOM 692 HB3 ARG 215 -23.054 -4.433 -1.934 1.00 0.00 H +ATOM 693 CG ARG 215 -22.404 -2.483 -1.729 1.00 0.00 C +ATOM 694 HG2 ARG 215 -21.960 -2.554 -2.610 1.00 0.00 H +ATOM 695 HG3 ARG 215 -22.830 -1.598 -1.612 1.00 0.00 H +ATOM 696 CD ARG 215 -21.336 -2.642 -0.644 1.00 0.00 C +ATOM 697 HD2 ARG 215 -20.586 -2.020 -0.858 1.00 0.00 H +ATOM 698 HD3 ARG 215 -21.748 -2.390 0.229 1.00 0.00 H +ATOM 699 NE ARG 215 -20.817 -4.012 -0.557 1.00 0.00 N +ATOM 700 HE ARG 215 -21.280 -4.645 0.082 1.00 0.00 H +ATOM 701 CZ ARG 215 -19.786 -4.485 -1.253 1.00 0.00 C +ATOM 702 NH1 ARG 215 -19.136 -3.710 -2.101 1.00 0.00 N +ATOM 703 HH11 ARG 215 -19.389 -2.752 -2.223 1.00 0.00 H +ATOM 704 HH12 ARG 215 -18.369 -4.086 -2.636 1.00 0.00 H +ATOM 705 NH2 ARG 215 -19.408 -5.743 -1.095 1.00 0.00 N +ATOM 706 HH21 ARG 215 -19.886 -6.331 -0.437 1.00 0.00 H +ATOM 707 HH22 ARG 215 -18.646 -6.112 -1.627 1.00 0.00 H +ATOM 708 C ARG 215 -24.504 -2.978 -3.798 1.00 0.00 C +ATOM 709 O ARG 215 -24.844 -1.875 -4.230 1.00 0.00 O +ATOM 710 N VAL 216 -23.937 -3.911 -4.560 1.00 0.00 N +ATOM 711 H VAL 216 -23.767 -4.818 -4.080 1.00 0.00 H +ATOM 712 CA VAL 216 -23.588 -3.665 -5.956 1.00 0.00 C +ATOM 713 HA VAL 216 -23.173 -2.734 -6.016 1.00 0.00 H +ATOM 714 CB VAL 216 -22.501 -4.669 -6.424 1.00 0.00 C +ATOM 715 HB VAL 216 -22.904 -5.579 -6.390 1.00 0.00 H +ATOM 716 CG1 VAL 216 -22.107 -4.403 -7.864 1.00 0.00 C +ATOM 717 HG11 VAL 216 -21.477 -5.115 -8.178 1.00 0.00 H +ATOM 718 HG12 VAL 216 -22.924 -4.406 -8.443 1.00 0.00 H +ATOM 719 HG13 VAL 216 -21.658 -3.511 -7.931 1.00 0.00 H +ATOM 720 CG2 VAL 216 -21.285 -4.550 -5.521 1.00 0.00 C +ATOM 721 HG21 VAL 216 -21.276 -5.314 -4.875 1.00 0.00 H +ATOM 722 HG22 VAL 216 -20.455 -4.572 -6.079 1.00 0.00 H +ATOM 723 HG23 VAL 216 -21.329 -3.686 -5.018 1.00 0.00 H +ATOM 724 C VAL 216 -24.770 -3.707 -6.922 1.00 0.00 C +ATOM 725 O VAL 216 -24.858 -2.883 -7.834 1.00 0.00 O +ATOM 726 N GLY 217 -25.667 -4.672 -6.741 1.00 0.00 N +ATOM 727 H GLY 217 -25.482 -5.307 -5.955 1.00 0.00 H +ATOM 728 CA GLY 217 -26.813 -4.773 -7.627 1.00 0.00 C +ATOM 729 HA2 GLY 217 -26.491 -4.980 -8.572 1.00 0.00 H +ATOM 730 HA3 GLY 217 -27.391 -5.563 -7.341 1.00 0.00 H +ATOM 731 C GLY 217 -27.671 -3.518 -7.660 1.00 0.00 C +ATOM 732 O GLY 217 -28.157 -3.111 -8.712 1.00 0.00 O +ATOM 733 N ASP 218 -27.863 -2.905 -6.500 1.00 0.00 N +ATOM 734 H ASP 218 -27.396 -3.356 -5.686 1.00 0.00 H +ATOM 735 CA ASP 218 -28.667 -1.695 -6.391 1.00 0.00 C +ATOM 736 HA ASP 218 -29.551 -1.881 -6.844 1.00 0.00 H +ATOM 737 CB ASP 218 -28.881 -1.366 -4.912 1.00 0.00 C +ATOM 738 HB2 ASP 218 -27.995 -1.323 -4.472 1.00 0.00 H +ATOM 739 HB3 ASP 218 -29.351 -0.498 -4.852 1.00 0.00 H +ATOM 740 CG ASP 218 -29.725 -2.426 -4.199 1.00 0.00 C +ATOM 741 OD1 ASP 218 -29.671 -3.617 -4.593 1.00 0.00 O +ATOM 742 OD2 ASP 218 -30.443 -2.080 -3.231 1.00 0.00 O +ATOM 743 C ASP 218 -28.031 -0.518 -7.125 1.00 0.00 C +ATOM 744 O ASP 218 -28.728 0.302 -7.718 1.00 0.00 O +ATOM 745 N GLY 219 -26.705 -0.442 -7.097 1.00 0.00 N +ATOM 746 H GLY 219 -26.229 -1.187 -6.572 1.00 0.00 H +ATOM 747 CA GLY 219 -26.027 0.643 -7.780 1.00 0.00 C +ATOM 748 HA2 GLY 219 -26.419 1.527 -7.483 1.00 0.00 H +ATOM 749 HA3 GLY 219 -25.048 0.643 -7.527 1.00 0.00 H +ATOM 750 C GLY 219 -26.152 0.524 -9.291 1.00 0.00 C +ATOM 751 O GLY 219 -26.279 1.531 -9.995 1.00 0.00 O +ATOM 752 N VAL 220 -26.126 -0.709 -9.786 1.00 0.00 N +ATOM 753 H VAL 220 -26.028 -1.462 -9.075 1.00 0.00 H +ATOM 754 CA VAL 220 -26.228 -0.966 -11.217 1.00 0.00 C +ATOM 755 HA VAL 220 -25.505 -0.431 -11.685 1.00 0.00 H +ATOM 756 CB VAL 220 -26.008 -2.470 -11.526 1.00 0.00 C +ATOM 757 HB VAL 220 -26.700 -2.979 -11.027 1.00 0.00 H +ATOM 758 CG1 VAL 220 -26.224 -2.738 -13.001 1.00 0.00 C +ATOM 759 HG11 VAL 220 -25.631 -3.488 -13.298 1.00 0.00 H +ATOM 760 HG12 VAL 220 -27.180 -2.990 -13.162 1.00 0.00 H +ATOM 761 HG13 VAL 220 -26.006 -1.916 -13.529 1.00 0.00 H +ATOM 762 CG2 VAL 220 -24.601 -2.884 -11.109 1.00 0.00 C +ATOM 763 HG21 VAL 220 -24.131 -2.097 -10.711 1.00 0.00 H +ATOM 764 HG22 VAL 220 -24.661 -3.618 -10.434 1.00 0.00 H +ATOM 765 HG23 VAL 220 -24.101 -3.205 -11.913 1.00 0.00 H +ATOM 766 C VAL 220 -27.572 -0.539 -11.796 1.00 0.00 C +ATOM 767 O VAL 220 -27.629 0.062 -12.865 1.00 0.00 O +ATOM 768 N GLN 221 -28.653 -0.860 -11.092 1.00 0.00 N +ATOM 769 H GLN 221 -28.465 -1.365 -10.207 1.00 0.00 H +ATOM 770 CA GLN 221 -29.991 -0.514 -11.556 1.00 0.00 C +ATOM 771 HA GLN 221 -30.109 -0.894 -12.482 1.00 0.00 H +ATOM 772 CB GLN 221 -31.044 -1.094 -10.606 1.00 0.00 C +ATOM 773 HB2 GLN 221 -30.895 -0.710 -9.689 1.00 0.00 H +ATOM 774 HB3 GLN 221 -31.955 -0.815 -10.928 1.00 0.00 H +ATOM 775 CG GLN 221 -31.032 -2.613 -10.488 1.00 0.00 C +ATOM 776 HG2 GLN 221 -31.214 -3.006 -11.385 1.00 0.00 H +ATOM 777 HG3 GLN 221 -30.136 -2.903 -10.163 1.00 0.00 H +ATOM 778 CD GLN 221 -32.088 -3.121 -9.514 1.00 0.00 C +ATOM 779 OE1 GLN 221 -31.765 -3.778 -8.530 1.00 0.00 O +ATOM 780 NE2 GLN 221 -33.352 -2.822 -9.790 1.00 0.00 N +ATOM 781 HE21 GLN 221 -34.106 -3.139 -9.194 1.00 0.00 H +ATOM 782 HE22 GLN 221 -33.552 -2.262 -10.620 1.00 0.00 H +ATOM 783 C GLN 221 -30.175 1.002 -11.652 1.00 0.00 C +ATOM 784 O GLN 221 -30.936 1.487 -12.489 1.00 0.00 O +ATOM 785 N ARG 222 -29.482 1.740 -10.785 1.00 0.00 N +ATOM 786 H ARG 222 -28.895 1.194 -10.123 1.00 0.00 H +ATOM 787 CA ARG 222 -29.554 3.198 -10.780 1.00 0.00 C +ATOM 788 HA ARG 222 -30.497 3.478 -10.985 1.00 0.00 H +ATOM 789 CB ARG 222 -29.146 3.743 -9.411 1.00 0.00 C +ATOM 790 HB2 ARG 222 -28.240 3.386 -9.190 1.00 0.00 H +ATOM 791 HB3 ARG 222 -29.110 4.739 -9.469 1.00 0.00 H +ATOM 792 CG ARG 222 -30.087 3.373 -8.273 1.00 0.00 C +ATOM 793 HG2 ARG 222 -30.510 2.489 -8.463 1.00 0.00 H +ATOM 794 HG3 ARG 222 -29.574 3.324 -7.418 1.00 0.00 H +ATOM 795 CD ARG 222 -31.205 4.401 -8.091 1.00 0.00 C +ATOM 796 HD2 ARG 222 -31.701 4.164 -7.261 1.00 0.00 H +ATOM 797 HD3 ARG 222 -30.779 5.296 -7.994 1.00 0.00 H +ATOM 798 NE ARG 222 -32.111 4.409 -9.220 1.00 0.00 N +ATOM 799 HE ARG 222 -32.021 3.673 -9.908 1.00 0.00 H +ATOM 800 CZ ARG 222 -33.062 5.320 -9.423 1.00 0.00 C +ATOM 801 NH1 ARG 222 -33.254 6.320 -8.557 1.00 0.00 N +ATOM 802 HH11 ARG 222 -32.669 6.405 -7.754 1.00 0.00 H +ATOM 803 HH12 ARG 222 -33.986 6.982 -8.719 1.00 0.00 H +ATOM 804 NH2 ARG 222 -33.795 5.265 -10.528 1.00 0.00 N +ATOM 805 HH21 ARG 222 -33.618 4.554 -11.211 1.00 0.00 H +ATOM 806 HH22 ARG 222 -34.523 5.933 -10.681 1.00 0.00 H +ATOM 807 C ARG 222 -28.630 3.781 -11.846 1.00 0.00 C +ATOM 808 O ARG 222 -29.035 4.643 -12.633 1.00 0.00 O +ATOM 809 N ASN 223 -27.386 3.304 -11.867 1.00 0.00 N +ATOM 810 H ASN 223 -27.178 2.587 -11.153 1.00 0.00 H +ATOM 811 CA ASN 223 -26.412 3.784 -12.845 1.00 0.00 C +ATOM 812 HA ASN 223 -26.346 4.788 -12.729 1.00 0.00 H +ATOM 813 CB ASN 223 -25.052 3.121 -12.625 1.00 0.00 C +ATOM 814 HB2 ASN 223 -25.205 2.158 -12.418 1.00 0.00 H +ATOM 815 HB3 ASN 223 -24.523 3.209 -13.466 1.00 0.00 H +ATOM 816 CG ASN 223 -24.284 3.747 -11.496 1.00 0.00 C +ATOM 817 OD1 ASN 223 -24.321 4.960 -11.310 1.00 0.00 O +ATOM 818 ND2 ASN 223 -23.569 2.929 -10.741 1.00 0.00 N +ATOM 819 HD21 ASN 223 -23.040 3.287 -9.970 1.00 0.00 H +ATOM 820 HD22 ASN 223 -23.554 1.946 -10.939 1.00 0.00 H +ATOM 821 C ASN 223 -26.845 3.528 -14.280 1.00 0.00 C +ATOM 822 O ASN 223 -26.482 4.267 -15.189 1.00 0.00 O +ATOM 823 N HIE 224 -27.626 2.479 -14.479 1.00 0.00 N +ATOM 824 H HIE 224 -27.882 1.952 -13.625 1.00 0.00 H +ATOM 825 CA HIE 224 -28.068 2.127 -15.810 1.00 0.00 C +ATOM 826 HA HIE 224 -27.697 2.802 -16.464 1.00 0.00 H +ATOM 827 CB HIE 224 -27.465 0.762 -16.162 1.00 0.00 C +ATOM 828 HB2 HIE 224 -27.749 0.092 -15.474 1.00 0.00 H +ATOM 829 HB3 HIE 224 -27.804 0.478 -17.060 1.00 0.00 H +ATOM 830 CG HIE 224 -25.966 0.787 -16.208 1.00 0.00 C +ATOM 831 ND1 HIE 224 -25.278 1.419 -17.219 1.00 0.00 N +ATOM 832 CE1 HIE 224 -23.982 1.395 -16.948 1.00 0.00 C +ATOM 833 HE1 HIE 224 -23.263 1.785 -17.515 1.00 0.00 H +ATOM 834 NE2 HIE 224 -23.808 0.766 -15.803 1.00 0.00 N +ATOM 835 HE2 HIE 224 -22.922 0.599 -15.348 1.00 0.00 H +ATOM 836 CD2 HIE 224 -25.033 0.367 -15.317 1.00 0.00 C +ATOM 837 HD2 HIE 224 -25.199 -0.133 -14.475 1.00 0.00 H +ATOM 838 C HIE 224 -29.589 2.151 -15.920 1.00 0.00 C +ATOM 839 O HIE 224 -30.184 1.417 -16.696 1.00 0.00 O +ATOM 840 N GLU 225 -30.198 3.056 -15.157 1.00 0.00 N +ATOM 841 H GLU 225 -29.545 3.640 -14.582 1.00 0.00 H +ATOM 842 CA GLU 225 -31.647 3.223 -15.122 1.00 0.00 C +ATOM 843 HA GLU 225 -32.064 2.437 -14.627 1.00 0.00 H +ATOM 844 CB GLU 225 -32.009 4.470 -14.313 1.00 0.00 C +ATOM 845 HB2 GLU 225 -31.779 4.294 -13.373 1.00 0.00 H +ATOM 846 HB3 GLU 225 -31.502 5.226 -14.684 1.00 0.00 H +ATOM 847 CG GLU 225 -33.485 4.834 -14.366 1.00 0.00 C +ATOM 848 HG2 GLU 225 -33.750 4.902 -15.307 1.00 0.00 H +ATOM 849 HG3 GLU 225 -33.989 4.148 -13.879 1.00 0.00 H +ATOM 850 CD GLU 225 -33.767 6.167 -13.709 1.00 0.00 C +ATOM 851 OE1 GLU 225 -34.384 6.172 -12.627 1.00 0.00 O +ATOM 852 OE2 GLU 225 -33.367 7.211 -14.275 1.00 0.00 O +ATOM 853 C GLU 225 -32.279 3.340 -16.501 1.00 0.00 C +ATOM 854 O GLU 225 -33.199 2.598 -16.844 1.00 0.00 O +ATOM 855 N THR 226 -31.799 4.295 -17.283 1.00 0.00 N +ATOM 856 H THR 226 -31.027 4.852 -16.875 1.00 0.00 H +ATOM 857 CA THR 226 -32.340 4.519 -18.614 1.00 0.00 C +ATOM 858 HA THR 226 -33.312 4.798 -18.524 1.00 0.00 H +ATOM 859 CB THR 226 -31.601 5.678 -19.321 1.00 0.00 C +ATOM 860 HB THR 226 -30.630 5.406 -19.466 1.00 0.00 H +ATOM 861 CG2 THR 226 -32.278 6.016 -20.645 1.00 0.00 C +ATOM 862 HG21 THR 226 -33.265 5.859 -20.570 1.00 0.00 H +ATOM 863 HG22 THR 226 -32.114 6.978 -20.873 1.00 0.00 H +ATOM 864 HG23 THR 226 -31.906 5.437 -21.373 1.00 0.00 H +ATOM 865 OG1 THR 226 -31.622 6.837 -18.478 1.00 0.00 O +ATOM 866 HG1 THR 226 -32.024 6.612 -17.584 1.00 0.00 H +ATOM 867 C THR 226 -32.285 3.274 -19.493 1.00 0.00 C +ATOM 868 O THR 226 -33.275 2.921 -20.132 1.00 0.00 O +ATOM 869 N VAL 227 -31.140 2.604 -19.535 1.00 0.00 N +ATOM 870 H VAL 227 -30.377 2.985 -18.965 1.00 0.00 H +ATOM 871 CA VAL 227 -31.030 1.404 -20.360 1.00 0.00 C +ATOM 872 HA VAL 227 -31.313 1.626 -21.299 1.00 0.00 H +ATOM 873 CB VAL 227 -29.587 0.923 -20.403 1.00 0.00 C +ATOM 874 HB VAL 227 -28.953 1.710 -20.812 1.00 0.00 H +ATOM 875 CG1 VAL 227 -29.123 0.580 -18.991 1.00 0.00 C +ATOM 876 HG11 VAL 227 -29.756 -0.207 -18.582 1.00 0.00 H +ATOM 877 HG12 VAL 227 -28.090 0.235 -19.022 1.00 0.00 H +ATOM 878 HG13 VAL 227 -29.192 1.466 -18.360 1.00 0.00 H +ATOM 879 CG2 VAL 227 -29.491 -0.317 -21.285 1.00 0.00 C +ATOM 880 HG21 VAL 227 -29.822 -0.073 -22.294 1.00 0.00 H +ATOM 881 HG22 VAL 227 -28.457 -0.662 -21.316 1.00 0.00 H +ATOM 882 HG23 VAL 227 -30.124 -1.105 -20.876 1.00 0.00 H +ATOM 883 C VAL 227 -31.946 0.291 -19.831 1.00 0.00 C +ATOM 884 O VAL 227 -32.558 -0.445 -20.607 1.00 0.00 O +ATOM 885 N PHE 228 -32.040 0.180 -18.508 1.00 0.00 N +ATOM 886 H PHE 228 -31.483 0.867 -17.970 1.00 0.00 H +ATOM 887 CA PHE 228 -32.875 -0.845 -17.894 1.00 0.00 C +ATOM 888 HA PHE 228 -32.609 -1.726 -18.303 1.00 0.00 H +ATOM 889 CB PHE 228 -32.657 -0.863 -16.376 1.00 0.00 C +ATOM 890 HB2 PHE 228 -32.453 0.057 -16.087 1.00 0.00 H +ATOM 891 HB3 PHE 228 -33.480 -1.206 -15.955 1.00 0.00 H +ATOM 892 CG PHE 228 -31.509 -1.751 -15.940 1.00 0.00 C +ATOM 893 CD1 PHE 228 -30.329 -1.796 -16.678 1.00 0.00 C +ATOM 894 HD1 PHE 228 -30.236 -1.239 -17.499 1.00 0.00 H +ATOM 895 CE1 PHE 228 -29.267 -2.610 -16.286 1.00 0.00 C +ATOM 896 HE1 PHE 228 -28.428 -2.631 -16.841 1.00 0.00 H +ATOM 897 CZ PHE 228 -29.369 -3.390 -15.134 1.00 0.00 C +ATOM 898 HZ PHE 228 -28.607 -3.965 -14.854 1.00 0.00 H +ATOM 899 CE2 PHE 228 -30.542 -3.356 -14.382 1.00 0.00 C +ATOM 900 HE2 PHE 228 -30.638 -3.918 -13.551 1.00 0.00 H +ATOM 901 CD2 PHE 228 -31.606 -2.531 -14.785 1.00 0.00 C +ATOM 902 HD2 PHE 228 -32.438 -2.504 -14.237 1.00 0.00 H +ATOM 903 C PHE 228 -34.346 -0.630 -18.234 1.00 0.00 C +ATOM 904 O PHE 228 -35.036 -1.576 -18.613 1.00 0.00 O +ATOM 905 N GLN 229 -34.822 0.609 -18.104 1.00 0.00 N +ATOM 906 H GLN 229 -34.143 1.306 -17.757 1.00 0.00 H +ATOM 907 CA GLN 229 -36.212 0.925 -18.437 1.00 0.00 C +ATOM 908 HA GLN 229 -36.802 0.315 -17.914 1.00 0.00 H +ATOM 909 CB GLN 229 -36.517 2.409 -18.220 1.00 0.00 C +ATOM 910 HB2 GLN 229 -35.962 2.948 -18.880 1.00 0.00 H +ATOM 911 HB3 GLN 229 -37.494 2.572 -18.458 1.00 0.00 H +ATOM 912 CG GLN 229 -36.275 2.978 -16.835 1.00 0.00 C +ATOM 913 HG2 GLN 229 -36.906 2.557 -16.194 1.00 0.00 H +ATOM 914 HG3 GLN 229 -35.335 2.800 -16.569 1.00 0.00 H +ATOM 915 CD GLN 229 -36.503 4.493 -16.807 1.00 0.00 C +ATOM 916 OE1 GLN 229 -37.320 4.990 -16.022 1.00 0.00 O +ATOM 917 NE2 GLN 229 -35.779 5.232 -17.659 1.00 0.00 N +ATOM 918 HE21 GLN 229 -35.892 6.229 -17.699 1.00 0.00 H +ATOM 919 HE22 GLN 229 -35.111 4.755 -18.263 1.00 0.00 H +ATOM 920 C GLN 229 -36.435 0.633 -19.922 1.00 0.00 C +ATOM 921 O GLN 229 -37.483 0.135 -20.321 1.00 0.00 O +ATOM 922 N GLY 230 -35.441 0.976 -20.732 1.00 0.00 N +ATOM 923 H GLY 230 -34.618 1.394 -20.266 1.00 0.00 H +ATOM 924 CA GLY 230 -35.540 0.763 -22.165 1.00 0.00 C +ATOM 925 HA2 GLY 230 -36.349 1.273 -22.524 1.00 0.00 H +ATOM 926 HA3 GLY 230 -34.723 1.173 -22.621 1.00 0.00 H +ATOM 927 C GLY 230 -35.654 -0.692 -22.564 1.00 0.00 C +ATOM 928 O GLY 230 -36.481 -1.049 -23.410 1.00 0.00 O +ATOM 929 N MET 231 -34.824 -1.535 -21.957 1.00 0.00 N +ATOM 930 H MET 231 -34.183 -1.102 -21.270 1.00 0.00 H +ATOM 931 CA MET 231 -34.844 -2.958 -22.262 1.00 0.00 C +ATOM 932 HA MET 231 -34.808 -3.069 -23.257 1.00 0.00 H +ATOM 933 CB MET 231 -33.647 -3.666 -21.615 1.00 0.00 C +ATOM 934 HB2 MET 231 -32.797 -3.241 -21.947 1.00 0.00 H +ATOM 935 HB3 MET 231 -33.695 -3.543 -20.617 1.00 0.00 H +ATOM 936 CG MET 231 -33.583 -5.163 -21.911 1.00 0.00 C +ATOM 937 HG2 MET 231 -32.788 -5.561 -21.399 1.00 0.00 H +ATOM 938 HG3 MET 231 -34.416 -5.610 -21.511 1.00 0.00 H +ATOM 939 SD MET 231 -33.450 -5.539 -23.685 1.00 0.00 S +ATOM 940 CE MET 231 -32.706 -7.161 -23.630 1.00 0.00 C +ATOM 941 HE1 MET 231 -32.654 -7.541 -24.556 1.00 0.00 H +ATOM 942 HE2 MET 231 -31.782 -7.097 -23.248 1.00 0.00 H +ATOM 943 HE3 MET 231 -33.259 -7.768 -23.055 1.00 0.00 H +ATOM 944 C MET 231 -36.150 -3.574 -21.767 1.00 0.00 C +ATOM 945 O MET 231 -36.762 -4.372 -22.472 1.00 0.00 O +ATOM 946 N LEU 232 -36.589 -3.202 -20.565 1.00 0.00 N +ATOM 947 H LEU 232 -36.000 -2.524 -20.067 1.00 0.00 H +ATOM 948 CA LEU 232 -37.835 -3.753 -20.035 1.00 0.00 C +ATOM 949 HA LEU 232 -37.737 -4.753 -19.955 1.00 0.00 H +ATOM 950 CB LEU 232 -38.108 -3.214 -18.619 1.00 0.00 C +ATOM 951 HB2 LEU 232 -37.344 -3.478 -18.041 1.00 0.00 H +ATOM 952 HB3 LEU 232 -38.178 -2.226 -18.678 1.00 0.00 H +ATOM 953 CG LEU 232 -39.392 -3.726 -17.941 1.00 0.00 C +ATOM 954 HG LEU 232 -40.171 -3.491 -18.518 1.00 0.00 H +ATOM 955 CD1 LEU 232 -39.318 -5.224 -17.761 1.00 0.00 C +ATOM 956 HD11 LEU 232 -38.530 -5.459 -17.188 1.00 0.00 H +ATOM 957 HD12 LEU 232 -40.155 -5.555 -17.320 1.00 0.00 H +ATOM 958 HD13 LEU 232 -39.220 -5.669 -18.653 1.00 0.00 H +ATOM 959 CD2 LEU 232 -39.595 -3.050 -16.608 1.00 0.00 C +ATOM 960 HD21 LEU 232 -39.673 -2.058 -16.737 1.00 0.00 H +ATOM 961 HD22 LEU 232 -40.434 -3.391 -16.176 1.00 0.00 H +ATOM 962 HD23 LEU 232 -38.816 -3.241 -16.006 1.00 0.00 H +ATOM 963 C LEU 232 -39.024 -3.463 -20.965 1.00 0.00 C +ATOM 964 O LEU 232 -39.825 -4.358 -21.258 1.00 0.00 O +ATOM 965 N ARG 233 -39.128 -2.222 -21.441 1.00 0.00 N +ATOM 966 H ARG 233 -38.392 -1.567 -21.116 1.00 0.00 H +ATOM 967 CA ARG 233 -40.209 -1.829 -22.355 1.00 0.00 C +ATOM 968 HA ARG 233 -41.088 -1.993 -21.902 1.00 0.00 H +ATOM 969 CB ARG 233 -40.090 -0.339 -22.721 1.00 0.00 C +ATOM 970 HB2 ARG 233 -40.217 0.195 -21.889 1.00 0.00 H +ATOM 971 HB3 ARG 233 -39.178 -0.183 -23.090 1.00 0.00 H +ATOM 972 CG ARG 233 -41.106 0.149 -23.754 1.00 0.00 C +ATOM 973 HG2 ARG 233 -40.816 -0.134 -24.658 1.00 0.00 H +ATOM 974 HG3 ARG 233 -41.999 -0.219 -23.534 1.00 0.00 H +ATOM 975 CD ARG 233 -41.191 1.664 -23.727 1.00 0.00 C +ATOM 976 HD2 ARG 233 -40.826 1.981 -22.864 1.00 0.00 H +ATOM 977 HD3 ARG 233 -40.667 2.018 -24.489 1.00 0.00 H +ATOM 978 NE ARG 233 -42.583 2.097 -23.853 1.00 0.00 N +ATOM 979 HE ARG 233 -43.096 2.270 -22.997 1.00 0.00 H +ATOM 980 CZ ARG 233 -43.223 2.280 -25.000 1.00 0.00 C +ATOM 981 NH1 ARG 233 -42.604 2.085 -26.154 1.00 0.00 N +ATOM 982 HH11 ARG 233 -41.655 1.779 -26.184 1.00 0.00 H +ATOM 983 HH12 ARG 233 -43.096 2.246 -27.018 1.00 0.00 H +ATOM 984 NH2 ARG 233 -44.495 2.646 -24.990 1.00 0.00 N +ATOM 985 HH21 ARG 233 -44.976 2.765 -24.118 1.00 0.00 H +ATOM 986 HH22 ARG 233 -44.981 2.804 -25.850 1.00 0.00 H +ATOM 987 C ARG 233 -40.147 -2.669 -23.628 1.00 0.00 C +ATOM 988 O ARG 233 -41.156 -3.186 -24.111 1.00 0.00 O +ATOM 989 N LYS 234 -38.945 -2.788 -24.172 1.00 0.00 N +ATOM 990 H LYS 234 -38.187 -2.283 -23.661 1.00 0.00 H +ATOM 991 CA LYS 234 -38.717 -3.558 -25.377 1.00 0.00 C +ATOM 992 HA LYS 234 -39.224 -3.132 -26.142 1.00 0.00 H +ATOM 993 CB LYS 234 -37.226 -3.516 -25.701 1.00 0.00 C +ATOM 994 HB2 LYS 234 -36.952 -2.545 -25.764 1.00 0.00 H +ATOM 995 HB3 LYS 234 -36.730 -3.924 -24.920 1.00 0.00 H +ATOM 996 CG LYS 234 -36.794 -4.215 -26.958 1.00 0.00 C +ATOM 997 HG2 LYS 234 -36.765 -5.192 -26.806 1.00 0.00 H +ATOM 998 HG3 LYS 234 -37.406 -3.984 -27.699 1.00 0.00 H +ATOM 999 CD LYS 234 -35.391 -3.735 -27.315 1.00 0.00 C +ATOM 1000 HD2 LYS 234 -35.458 -3.070 -28.053 1.00 0.00 H +ATOM 1001 HD3 LYS 234 -34.980 -3.316 -26.511 1.00 0.00 H +ATOM 1002 CE LYS 234 -34.497 -4.881 -27.774 1.00 0.00 C +ATOM 1003 HE2 LYS 234 -34.432 -5.562 -27.035 1.00 0.00 H +ATOM 1004 HE3 LYS 234 -34.916 -5.324 -28.576 1.00 0.00 H +ATOM 1005 NZ LYS 234 -33.104 -4.438 -28.144 1.00 0.00 N +ATOM 1006 HZ1 LYS 234 -32.517 -4.519 -27.343 1.00 0.00 H +ATOM 1007 HZ2 LYS 234 -32.765 -5.022 -28.877 1.00 0.00 H +ATOM 1008 HZ3 LYS 234 -33.138 -3.490 -28.449 1.00 0.00 H +ATOM 1009 C LYS 234 -39.192 -4.997 -25.225 1.00 0.00 C +ATOM 1010 O LYS 234 -39.803 -5.550 -26.143 1.00 0.00 O +ATOM 1011 N LEU 235 -38.898 -5.594 -24.072 1.00 0.00 N +ATOM 1012 H LEU 235 -38.370 -4.992 -23.399 1.00 0.00 H +ATOM 1013 CA LEU 235 -39.280 -6.971 -23.774 1.00 0.00 C +ATOM 1014 HA LEU 235 -38.951 -7.565 -24.526 1.00 0.00 H +ATOM 1015 CB LEU 235 -38.581 -7.431 -22.494 1.00 0.00 C +ATOM 1016 HB2 LEU 235 -38.735 -6.749 -21.799 1.00 0.00 H +ATOM 1017 HB3 LEU 235 -38.953 -8.307 -22.239 1.00 0.00 H +ATOM 1018 CG LEU 235 -37.066 -7.599 -22.646 1.00 0.00 C +ATOM 1019 HG LEU 235 -36.686 -6.758 -23.029 1.00 0.00 H +ATOM 1020 CD1 LEU 235 -36.429 -7.880 -21.301 1.00 0.00 C +ATOM 1021 HD11 LEU 235 -36.811 -8.721 -20.915 1.00 0.00 H +ATOM 1022 HD12 LEU 235 -35.439 -7.988 -21.412 1.00 0.00 H +ATOM 1023 HD13 LEU 235 -36.610 -7.119 -20.676 1.00 0.00 H +ATOM 1024 CD2 LEU 235 -36.785 -8.737 -23.619 1.00 0.00 C +ATOM 1025 HD21 LEU 235 -37.190 -8.524 -24.508 1.00 0.00 H +ATOM 1026 HD22 LEU 235 -35.796 -8.851 -23.722 1.00 0.00 H +ATOM 1027 HD23 LEU 235 -37.183 -9.584 -23.266 1.00 0.00 H +ATOM 1028 C LEU 235 -40.790 -7.151 -23.649 1.00 0.00 C +ATOM 1029 O LEU 235 -41.312 -8.244 -23.864 1.00 0.00 O +ATOM 1030 N ASP 236 -41.479 -6.078 -23.281 1.00 0.00 N +ATOM 1031 H ASP 236 -40.897 -5.237 -23.078 1.00 0.00 H +ATOM 1032 CA ASP 236 -42.930 -6.089 -23.174 1.00 0.00 C +ATOM 1033 HA ASP 236 -43.198 -5.284 -22.612 1.00 0.00 H +ATOM 1034 CB ASP 236 -43.512 -5.955 -24.582 1.00 0.00 C +ATOM 1035 HB2 ASP 236 -43.130 -5.134 -24.994 1.00 0.00 H +ATOM 1036 HB3 ASP 236 -43.244 -6.759 -25.102 1.00 0.00 H +ATOM 1037 CG ASP 236 -45.020 -5.848 -24.587 1.00 0.00 C +ATOM 1038 OD1 ASP 236 -45.614 -5.551 -23.527 1.00 0.00 O +ATOM 1039 OD2 ASP 236 -45.595 -6.052 -25.673 1.00 0.00 O +ATOM 1040 C ASP 236 -43.492 -7.326 -22.464 1.00 0.00 C +ATOM 1041 O ASP 236 -44.227 -8.124 -23.049 1.00 0.00 O +ATOM 1042 N ILE 237 -43.153 -7.458 -21.184 1.00 0.00 N +ATOM 1043 H ILE 237 -42.562 -6.680 -20.813 1.00 0.00 H +ATOM 1044 CA ILE 237 -43.573 -8.593 -20.373 1.00 0.00 C +ATOM 1045 HA ILE 237 -43.630 -9.385 -21.002 1.00 0.00 H +ATOM 1046 CB ILE 237 -42.572 -8.834 -19.239 1.00 0.00 C +ATOM 1047 HB ILE 237 -42.634 -8.076 -18.604 1.00 0.00 H +ATOM 1048 CG2 ILE 237 -42.882 -10.158 -18.555 1.00 0.00 C +ATOM 1049 HG21 ILE 237 -42.233 -10.309 -17.812 1.00 0.00 H +ATOM 1050 HG22 ILE 237 -43.810 -10.134 -18.186 1.00 0.00 H +ATOM 1051 HG23 ILE 237 -42.808 -10.901 -19.218 1.00 0.00 H +ATOM 1052 CG1 ILE 237 -41.151 -8.856 -19.811 1.00 0.00 C +ATOM 1053 HG12 ILE 237 -41.034 -9.703 -20.330 1.00 0.00 H +ATOM 1054 HG13 ILE 237 -41.058 -8.085 -20.443 1.00 0.00 H +ATOM 1055 CD1 ILE 237 -40.061 -8.763 -18.768 1.00 0.00 C +ATOM 1056 HD11 ILE 237 -40.136 -9.536 -18.139 1.00 0.00 H +ATOM 1057 HD12 ILE 237 -39.169 -8.784 -19.217 1.00 0.00 H +ATOM 1058 HD13 ILE 237 -40.160 -7.908 -18.260 1.00 0.00 H +ATOM 1059 C ILE 237 -44.960 -8.419 -19.768 1.00 0.00 C +ATOM 1060 O ILE 237 -45.183 -7.546 -18.917 1.00 0.00 O +ATOM 1061 N LYS 238 -45.884 -9.273 -20.199 1.00 0.00 N +ATOM 1062 H LYS 238 -45.540 -9.973 -20.889 1.00 0.00 H +ATOM 1063 CA LYS 238 -47.262 -9.218 -19.732 1.00 0.00 C +ATOM 1064 HA LYS 238 -47.355 -8.439 -19.081 1.00 0.00 H +ATOM 1065 CB LYS 238 -48.179 -8.957 -20.924 1.00 0.00 C +ATOM 1066 HB2 LYS 238 -48.145 -9.754 -21.526 1.00 0.00 H +ATOM 1067 HB3 LYS 238 -49.111 -8.837 -20.582 1.00 0.00 H +ATOM 1068 CG LYS 238 -47.810 -7.728 -21.741 1.00 0.00 C +ATOM 1069 HG2 LYS 238 -48.003 -6.906 -21.206 1.00 0.00 H +ATOM 1070 HG3 LYS 238 -46.837 -7.760 -21.966 1.00 0.00 H +ATOM 1071 CD LYS 238 -48.610 -7.654 -23.052 1.00 0.00 C +ATOM 1072 HD2 LYS 238 -49.480 -8.117 -22.922 1.00 0.00 H +ATOM 1073 HD3 LYS 238 -48.756 -6.699 -23.285 1.00 0.00 H +ATOM 1074 CE LYS 238 -47.874 -8.330 -24.227 1.00 0.00 C +ATOM 1075 HE2 LYS 238 -48.518 -8.438 -24.988 1.00 0.00 H +ATOM 1076 HE3 LYS 238 -47.121 -7.735 -24.517 1.00 0.00 H +ATOM 1077 NZ LYS 238 -47.318 -9.681 -23.860 1.00 0.00 N +ATOM 1078 HZ1 LYS 238 -47.680 -10.361 -24.492 1.00 0.00 H +ATOM 1079 HZ2 LYS 238 -46.324 -9.649 -23.925 1.00 0.00 H +ATOM 1080 HZ3 LYS 238 -47.593 -9.900 -22.927 1.00 0.00 H +ATOM 1081 C LYS 238 -47.726 -10.489 -19.030 1.00 0.00 C +ATOM 1082 O LYS 238 -48.572 -10.441 -18.132 1.00 0.00 O +ATOM 1083 N ASN 239 -47.178 -11.625 -19.441 1.00 0.00 N +ATOM 1084 H ASN 239 -46.461 -11.534 -20.173 1.00 0.00 H +ATOM 1085 CA ASN 239 -47.600 -12.889 -18.861 1.00 0.00 C +ATOM 1086 HA ASN 239 -47.917 -12.691 -17.910 1.00 0.00 H +ATOM 1087 CB ASN 239 -48.744 -13.446 -19.706 1.00 0.00 C +ATOM 1088 HB2 ASN 239 -48.927 -14.379 -19.418 1.00 0.00 H +ATOM 1089 HB3 ASN 239 -49.546 -12.875 -19.570 1.00 0.00 H +ATOM 1090 CG ASN 239 -48.407 -13.458 -21.193 1.00 0.00 C +ATOM 1091 OD1 ASN 239 -47.492 -14.166 -21.637 1.00 0.00 O +ATOM 1092 ND2 ASN 239 -49.138 -12.669 -21.970 1.00 0.00 N +ATOM 1093 HD21 ASN 239 -48.969 -12.636 -22.955 1.00 0.00 H +ATOM 1094 HD22 ASN 239 -49.861 -12.103 -21.569 1.00 0.00 H +ATOM 1095 C ASN 239 -46.506 -13.939 -18.750 1.00 0.00 C +ATOM 1096 O ASN 239 -45.313 -13.666 -18.947 1.00 0.00 O +ATOM 1097 N GLU 240 -46.952 -15.156 -18.459 1.00 0.00 N +ATOM 1098 H GLU 240 -48.000 -15.208 -18.353 1.00 0.00 H +ATOM 1099 CA GLU 240 -46.091 -16.315 -18.299 1.00 0.00 C +ATOM 1100 HA GLU 240 -45.426 -16.146 -17.552 1.00 0.00 H +ATOM 1101 CB GLU 240 -46.957 -17.490 -17.848 1.00 0.00 C +ATOM 1102 HB2 GLU 240 -47.330 -17.258 -16.955 1.00 0.00 H +ATOM 1103 HB3 GLU 240 -47.690 -17.591 -18.512 1.00 0.00 H +ATOM 1104 CG GLU 240 -46.262 -18.822 -17.724 1.00 0.00 C +ATOM 1105 HG2 GLU 240 -46.068 -19.159 -18.621 1.00 0.00 H +ATOM 1106 HG3 GLU 240 -45.463 -18.710 -17.173 1.00 0.00 H +ATOM 1107 CD GLU 240 -47.151 -19.838 -17.037 1.00 0.00 C +ATOM 1108 OE1 GLU 240 -48.271 -20.067 -17.540 1.00 0.00 O +ATOM 1109 OE2 GLU 240 -46.731 -20.397 -15.997 1.00 0.00 O +ATOM 1110 C GLU 240 -45.330 -16.660 -19.577 1.00 0.00 C +ATOM 1111 O GLU 240 -44.142 -16.980 -19.526 1.00 0.00 O +ATOM 1112 N ASP 241 -46.003 -16.593 -20.721 1.00 0.00 N +ATOM 1113 H ASP 241 -46.986 -16.316 -20.645 1.00 0.00 H +ATOM 1114 CA ASP 241 -45.327 -16.906 -21.970 1.00 0.00 C +ATOM 1115 HA ASP 241 -44.904 -17.812 -21.866 1.00 0.00 H +ATOM 1116 CB ASP 241 -46.316 -16.953 -23.145 1.00 0.00 C +ATOM 1117 HB2 ASP 241 -46.894 -16.152 -23.094 1.00 0.00 H +ATOM 1118 HB3 ASP 241 -45.796 -16.967 -23.985 1.00 0.00 H +ATOM 1119 CG ASP 241 -47.208 -18.199 -23.103 1.00 0.00 C +ATOM 1120 OD1 ASP 241 -46.773 -19.234 -22.538 1.00 0.00 O +ATOM 1121 OD2 ASP 241 -48.335 -18.158 -23.643 1.00 0.00 O +ATOM 1122 C ASP 241 -44.188 -15.913 -22.229 1.00 0.00 C +ATOM 1123 O ASP 241 -43.108 -16.313 -22.680 1.00 0.00 O +ATOM 1124 N ASP 242 -44.404 -14.628 -21.944 1.00 0.00 N +ATOM 1125 H ASP 242 -45.338 -14.393 -21.607 1.00 0.00 H +ATOM 1126 CA ASP 242 -43.319 -13.655 -22.126 1.00 0.00 C +ATOM 1127 HA ASP 242 -42.953 -13.790 -23.048 1.00 0.00 H +ATOM 1128 CB ASP 242 -43.792 -12.217 -21.884 1.00 0.00 C +ATOM 1129 HB2 ASP 242 -44.008 -12.126 -20.917 1.00 0.00 H +ATOM 1130 HB3 ASP 242 -43.047 -11.606 -22.130 1.00 0.00 H +ATOM 1131 CG ASP 242 -45.015 -11.852 -22.695 1.00 0.00 C +ATOM 1132 OD1 ASP 242 -45.044 -12.127 -23.907 1.00 0.00 O +ATOM 1133 OD2 ASP 242 -45.950 -11.279 -22.106 1.00 0.00 O +ATOM 1134 C ASP 242 -42.181 -13.949 -21.144 1.00 0.00 C +ATOM 1135 O ASP 242 -41.015 -13.758 -21.470 1.00 0.00 O +ATOM 1136 N VAL 243 -42.505 -14.396 -19.934 1.00 0.00 N +ATOM 1137 H VAL 243 -43.506 -14.513 -19.754 1.00 0.00 H +ATOM 1138 CA VAL 243 -41.453 -14.684 -18.965 1.00 0.00 C +ATOM 1139 HA VAL 243 -40.864 -13.877 -18.892 1.00 0.00 H +ATOM 1140 CB VAL 243 -42.030 -15.023 -17.558 1.00 0.00 C +ATOM 1141 HB VAL 243 -42.661 -15.780 -17.672 1.00 0.00 H +ATOM 1142 CG1 VAL 243 -40.915 -15.500 -16.632 1.00 0.00 C +ATOM 1143 HG11 VAL 243 -40.495 -16.322 -17.014 1.00 0.00 H +ATOM 1144 HG12 VAL 243 -40.225 -14.782 -16.546 1.00 0.00 H +ATOM 1145 HG13 VAL 243 -41.297 -15.707 -15.732 1.00 0.00 H +ATOM 1146 CG2 VAL 243 -42.699 -13.795 -16.959 1.00 0.00 C +ATOM 1147 HG21 VAL 243 -43.686 -13.851 -17.107 1.00 0.00 H +ATOM 1148 HG22 VAL 243 -42.507 -13.760 -15.978 1.00 0.00 H +ATOM 1149 HG23 VAL 243 -42.339 -12.974 -17.402 1.00 0.00 H +ATOM 1150 C VAL 243 -40.604 -15.844 -19.465 1.00 0.00 C +ATOM 1151 O VAL 243 -39.394 -15.845 -19.300 1.00 0.00 O +ATOM 1152 N LYS 244 -41.241 -16.828 -20.091 1.00 0.00 N +ATOM 1153 H LYS 244 -42.262 -16.706 -20.180 1.00 0.00 H +ATOM 1154 CA LYS 244 -40.512 -17.979 -20.600 1.00 0.00 C +ATOM 1155 HA LYS 244 -39.925 -18.344 -19.871 1.00 0.00 H +ATOM 1156 CB LYS 244 -41.491 -19.072 -21.035 1.00 0.00 C +ATOM 1157 HB2 LYS 244 -42.115 -18.680 -21.705 1.00 0.00 H +ATOM 1158 HB3 LYS 244 -40.966 -19.811 -21.449 1.00 0.00 H +ATOM 1159 CG LYS 244 -42.307 -19.641 -19.892 1.00 0.00 C +ATOM 1160 HG2 LYS 244 -41.711 -19.784 -19.101 1.00 0.00 H +ATOM 1161 HG3 LYS 244 -43.032 -18.997 -19.652 1.00 0.00 H +ATOM 1162 CD LYS 244 -42.940 -20.971 -20.274 1.00 0.00 C +ATOM 1163 HD2 LYS 244 -43.713 -20.800 -20.869 1.00 0.00 H +ATOM 1164 HD3 LYS 244 -42.261 -21.534 -20.723 1.00 0.00 H +ATOM 1165 CE LYS 244 -43.432 -21.698 -19.032 1.00 0.00 C +ATOM 1166 HE2 LYS 244 -42.715 -21.672 -18.334 1.00 0.00 H +ATOM 1167 HE3 LYS 244 -44.248 -21.234 -18.684 1.00 0.00 H +ATOM 1168 NZ LYS 244 -43.770 -23.120 -19.332 1.00 0.00 N +ATOM 1169 HZ1 LYS 244 -44.005 -23.589 -18.482 1.00 0.00 H +ATOM 1170 HZ2 LYS 244 -44.548 -23.149 -19.958 1.00 0.00 H +ATOM 1171 HZ3 LYS 244 -42.981 -23.564 -19.755 1.00 0.00 H +ATOM 1172 C LYS 244 -39.634 -17.566 -21.772 1.00 0.00 C +ATOM 1173 O LYS 244 -38.559 -18.126 -21.990 1.00 0.00 O +ATOM 1174 N SER 245 -40.084 -16.571 -22.522 1.00 0.00 N +ATOM 1175 H SER 245 -40.986 -16.165 -22.226 1.00 0.00 H +ATOM 1176 CA SER 245 -39.327 -16.110 -23.679 1.00 0.00 C +ATOM 1177 HA SER 245 -39.098 -16.917 -24.247 1.00 0.00 H +ATOM 1178 CB SER 245 -40.176 -15.146 -24.509 1.00 0.00 C +ATOM 1179 HB2 SER 245 -39.747 -15.025 -25.399 1.00 0.00 H +ATOM 1180 HB3 SER 245 -41.087 -15.533 -24.617 1.00 0.00 H +ATOM 1181 OG SER 245 -40.283 -13.886 -23.872 1.00 0.00 O +ATOM 1182 HG SER 245 -40.573 -14.015 -22.924 1.00 0.00 H +ATOM 1183 C SER 245 -38.014 -15.430 -23.290 1.00 0.00 C +ATOM 1184 O SER 245 -37.148 -15.217 -24.137 1.00 0.00 O +ATOM 1185 N LEU 246 -37.859 -15.104 -22.010 1.00 0.00 N +ATOM 1186 H LEU 246 -38.642 -15.366 -21.390 1.00 0.00 H +ATOM 1187 CA LEU 246 -36.651 -14.423 -21.551 1.00 0.00 C +ATOM 1188 HA LEU 246 -36.510 -13.595 -22.137 1.00 0.00 H +ATOM 1189 CB LEU 246 -36.860 -13.871 -20.137 1.00 0.00 C +ATOM 1190 HB2 LEU 246 -37.135 -14.618 -19.557 1.00 0.00 H +ATOM 1191 HB3 LEU 246 -36.015 -13.464 -19.841 1.00 0.00 H +ATOM 1192 CG LEU 246 -37.946 -12.798 -20.057 1.00 0.00 C +ATOM 1193 HG LEU 246 -38.782 -13.150 -20.467 1.00 0.00 H +ATOM 1194 CD1 LEU 246 -38.209 -12.441 -18.599 1.00 0.00 C +ATOM 1195 HD11 LEU 246 -37.368 -12.093 -18.184 1.00 0.00 H +ATOM 1196 HD12 LEU 246 -38.920 -11.739 -18.551 1.00 0.00 H +ATOM 1197 HD13 LEU 246 -38.512 -13.256 -18.106 1.00 0.00 H +ATOM 1198 CD2 LEU 246 -37.526 -11.581 -20.857 1.00 0.00 C +ATOM 1199 HD21 LEU 246 -37.387 -11.838 -21.815 1.00 0.00 H +ATOM 1200 HD22 LEU 246 -38.239 -10.879 -20.803 1.00 0.00 H +ATOM 1201 HD23 LEU 246 -36.671 -11.212 -20.487 1.00 0.00 H +ATOM 1202 C LEU 246 -35.376 -15.259 -21.598 1.00 0.00 C +ATOM 1203 O LEU 246 -34.285 -14.711 -21.756 1.00 0.00 O +ATOM 1204 N SER 247 -35.501 -16.575 -21.463 1.00 0.00 N +ATOM 1205 H SER 247 -36.463 -16.918 -21.330 1.00 0.00 H +ATOM 1206 CA SER 247 -34.326 -17.438 -21.507 1.00 0.00 C +ATOM 1207 HA SER 247 -33.723 -17.189 -20.738 1.00 0.00 H +ATOM 1208 CB SER 247 -34.731 -18.912 -21.372 1.00 0.00 C +ATOM 1209 HB2 SER 247 -35.345 -19.144 -22.121 1.00 0.00 H +ATOM 1210 HB3 SER 247 -33.909 -19.473 -21.418 1.00 0.00 H +ATOM 1211 OG SER 247 -35.389 -19.155 -20.141 1.00 0.00 O +ATOM 1212 HG SER 247 -35.365 -18.328 -19.581 1.00 0.00 H +ATOM 1213 C SER 247 -33.530 -17.243 -22.802 1.00 0.00 C +ATOM 1214 O SER 247 -32.311 -17.108 -22.768 1.00 0.00 O +ATOM 1215 N ARG 248 -34.227 -17.231 -23.938 1.00 0.00 N +ATOM 1216 H ARG 248 -35.254 -17.356 -23.817 1.00 0.00 H +ATOM 1217 CA ARG 248 -33.593 -17.055 -25.249 1.00 0.00 C +ATOM 1218 HA ARG 248 -32.956 -17.818 -25.404 1.00 0.00 H +ATOM 1219 CB ARG 248 -34.660 -17.078 -26.367 1.00 0.00 C +ATOM 1220 HB2 ARG 248 -35.156 -17.940 -26.306 1.00 0.00 H +ATOM 1221 HB3 ARG 248 -35.284 -16.315 -26.218 1.00 0.00 H +ATOM 1222 CG ARG 248 -34.111 -16.956 -27.809 1.00 0.00 C +ATOM 1223 HG2 ARG 248 -33.851 -16.014 -27.980 1.00 0.00 H +ATOM 1224 HG3 ARG 248 -33.332 -17.561 -27.913 1.00 0.00 H +ATOM 1225 CD ARG 248 -35.170 -17.358 -28.856 1.00 0.00 C +ATOM 1226 HD2 ARG 248 -35.648 -18.160 -28.508 1.00 0.00 H +ATOM 1227 HD3 ARG 248 -35.805 -16.595 -28.949 1.00 0.00 H +ATOM 1228 NE ARG 248 -34.584 -17.668 -30.165 1.00 0.00 N +ATOM 1229 HE ARG 248 -34.342 -18.638 -30.345 1.00 0.00 H +ATOM 1230 CZ ARG 248 -34.344 -16.789 -31.132 1.00 0.00 C +ATOM 1231 NH1 ARG 248 -34.645 -15.504 -30.966 1.00 0.00 N +ATOM 1232 HH11 ARG 248 -35.035 -15.178 -30.109 1.00 0.00 H +ATOM 1233 HH12 ARG 248 -34.475 -14.854 -31.714 1.00 0.00 H +ATOM 1234 NH2 ARG 248 -33.783 -17.199 -32.267 1.00 0.00 N +ATOM 1235 HH21 ARG 248 -33.528 -18.161 -32.377 1.00 0.00 H +ATOM 1236 HH22 ARG 248 -33.616 -16.549 -33.006 1.00 0.00 H +ATOM 1237 C ARG 248 -32.810 -15.746 -25.304 1.00 0.00 C +ATOM 1238 O ARG 248 -31.688 -15.699 -25.813 1.00 0.00 O +ATOM 1239 N VAL 249 -33.405 -14.683 -24.773 1.00 0.00 N +ATOM 1240 H VAL 249 -34.342 -14.858 -24.373 1.00 0.00 H +ATOM 1241 CA VAL 249 -32.753 -13.381 -24.773 1.00 0.00 C +ATOM 1242 HA VAL 249 -32.458 -13.175 -25.719 1.00 0.00 H +ATOM 1243 CB VAL 249 -33.716 -12.262 -24.314 1.00 0.00 C +ATOM 1244 HB VAL 249 -33.921 -12.417 -23.357 1.00 0.00 H +ATOM 1245 CG1 VAL 249 -33.018 -10.911 -24.410 1.00 0.00 C +ATOM 1246 HG11 VAL 249 -32.036 -11.033 -24.272 1.00 0.00 H +ATOM 1247 HG12 VAL 249 -33.181 -10.515 -25.313 1.00 0.00 H +ATOM 1248 HG13 VAL 249 -33.380 -10.298 -23.708 1.00 0.00 H +ATOM 1249 CG2 VAL 249 -34.972 -12.268 -25.166 1.00 0.00 C +ATOM 1250 HG21 VAL 249 -34.718 -12.223 -26.133 1.00 0.00 H +ATOM 1251 HG22 VAL 249 -35.486 -13.109 -24.994 1.00 0.00 H +ATOM 1252 HG23 VAL 249 -35.537 -11.476 -24.931 1.00 0.00 H +ATOM 1253 C VAL 249 -31.510 -13.350 -23.882 1.00 0.00 C +ATOM 1254 O VAL 249 -30.495 -12.756 -24.245 1.00 0.00 O +ATOM 1255 N MET 250 -31.575 -13.993 -22.717 1.00 0.00 N +ATOM 1256 H MET 250 -32.471 -14.450 -22.509 1.00 0.00 H +ATOM 1257 CA MET 250 -30.413 -14.021 -21.817 1.00 0.00 C +ATOM 1258 HA MET 250 -30.108 -13.073 -21.675 1.00 0.00 H +ATOM 1259 CB MET 250 -30.767 -14.652 -20.462 1.00 0.00 C +ATOM 1260 HB2 MET 250 -31.159 -15.570 -20.623 1.00 0.00 H +ATOM 1261 HB3 MET 250 -29.917 -14.770 -19.927 1.00 0.00 H +ATOM 1262 CG MET 250 -31.756 -13.851 -19.619 1.00 0.00 C +ATOM 1263 HG2 MET 250 -31.425 -12.878 -19.564 1.00 0.00 H +ATOM 1264 HG3 MET 250 -32.651 -13.799 -20.124 1.00 0.00 H +ATOM 1265 SD MET 250 -32.022 -14.522 -17.935 1.00 0.00 S +ATOM 1266 CE MET 250 -33.303 -15.728 -18.230 1.00 0.00 C +ATOM 1267 HE1 MET 250 -33.057 -16.597 -17.796 1.00 0.00 H +ATOM 1268 HE2 MET 250 -34.170 -15.403 -17.847 1.00 0.00 H +ATOM 1269 HE3 MET 250 -33.413 -15.872 -19.216 1.00 0.00 H +ATOM 1270 C MET 250 -29.254 -14.805 -22.431 1.00 0.00 C +ATOM 1271 O MET 250 -28.099 -14.462 -22.220 1.00 0.00 O +ATOM 1272 N ILE 251 -29.562 -15.866 -23.169 1.00 0.00 N +ATOM 1273 H ILE 251 -30.571 -16.073 -23.244 1.00 0.00 H +ATOM 1274 CA ILE 251 -28.520 -16.659 -23.813 1.00 0.00 C +ATOM 1275 HA ILE 251 -27.814 -16.802 -23.131 1.00 0.00 H +ATOM 1276 CB ILE 251 -29.122 -17.962 -24.439 1.00 0.00 C +ATOM 1277 HB ILE 251 -29.942 -17.701 -24.933 1.00 0.00 H +ATOM 1278 CG2 ILE 251 -28.130 -18.591 -25.407 1.00 0.00 C +ATOM 1279 HG21 ILE 251 -28.544 -19.393 -25.834 1.00 0.00 H +ATOM 1280 HG22 ILE 251 -27.886 -17.928 -26.113 1.00 0.00 H +ATOM 1281 HG23 ILE 251 -27.308 -18.865 -24.911 1.00 0.00 H +ATOM 1282 CG1 ILE 251 -29.514 -18.960 -23.343 1.00 0.00 C +ATOM 1283 HG12 ILE 251 -30.052 -18.475 -22.652 1.00 0.00 H +ATOM 1284 HG13 ILE 251 -30.096 -19.664 -23.755 1.00 0.00 H +ATOM 1285 CD1 ILE 251 -28.341 -19.644 -22.658 1.00 0.00 C +ATOM 1286 HD11 ILE 251 -27.763 -18.952 -22.230 1.00 0.00 H +ATOM 1287 HD12 ILE 251 -28.688 -20.272 -21.964 1.00 0.00 H +ATOM 1288 HD13 ILE 251 -27.814 -20.150 -23.338 1.00 0.00 H +ATOM 1289 C ILE 251 -27.899 -15.796 -24.909 1.00 0.00 C +ATOM 1290 O ILE 251 -26.686 -15.713 -25.061 1.00 0.00 O +ATOM 1291 N HIE 252 -28.766 -15.125 -25.655 1.00 0.00 N +ATOM 1292 H HIE 252 -29.766 -15.260 -25.388 1.00 0.00 H +ATOM 1293 CA HIE 252 -28.349 -14.265 -26.763 1.00 0.00 C +ATOM 1294 HA HIE 252 -27.828 -14.831 -27.425 1.00 0.00 H +ATOM 1295 CB HIE 252 -29.595 -13.708 -27.470 1.00 0.00 C +ATOM 1296 HB2 HIE 252 -30.203 -14.475 -27.706 1.00 0.00 H +ATOM 1297 HB3 HIE 252 -30.083 -13.101 -26.832 1.00 0.00 H +ATOM 1298 CG HIE 252 -29.293 -12.942 -28.716 1.00 0.00 C +ATOM 1299 ND1 HIE 252 -28.674 -11.718 -28.707 1.00 0.00 N +ATOM 1300 CE1 HIE 252 -28.569 -11.272 -29.952 1.00 0.00 C +ATOM 1301 HE1 HIE 252 -28.162 -10.408 -30.226 1.00 0.00 H +ATOM 1302 NE2 HIE 252 -29.099 -12.171 -30.756 1.00 0.00 N +ATOM 1303 HE2 HIE 252 -29.160 -12.100 -31.762 1.00 0.00 H +ATOM 1304 CD2 HIE 252 -29.559 -13.231 -30.011 1.00 0.00 C +ATOM 1305 HD2 HIE 252 -30.002 -14.049 -30.359 1.00 0.00 H +ATOM 1306 C HIE 252 -27.455 -13.107 -26.323 1.00 0.00 C +ATOM 1307 O HIE 252 -26.403 -12.851 -26.914 1.00 0.00 O +ATOM 1308 N VAL 253 -27.868 -12.431 -25.260 1.00 0.00 N +ATOM 1309 H VAL 253 -28.738 -12.802 -24.820 1.00 0.00 H +ATOM 1310 CA VAL 253 -27.155 -11.263 -24.755 1.00 0.00 C +ATOM 1311 HA VAL 253 -26.718 -10.791 -25.553 1.00 0.00 H +ATOM 1312 CB VAL 253 -28.172 -10.255 -24.143 1.00 0.00 C +ATOM 1313 HB VAL 253 -28.626 -10.716 -23.390 1.00 0.00 H +ATOM 1314 CG1 VAL 253 -27.444 -9.054 -23.567 1.00 0.00 C +ATOM 1315 HG11 VAL 253 -26.951 -8.579 -24.296 1.00 0.00 H +ATOM 1316 HG12 VAL 253 -28.105 -8.428 -23.152 1.00 0.00 H +ATOM 1317 HG13 VAL 253 -26.793 -9.358 -22.870 1.00 0.00 H +ATOM 1318 CG2 VAL 253 -29.170 -9.822 -25.214 1.00 0.00 C +ATOM 1319 HG21 VAL 253 -29.979 -10.407 -25.164 1.00 0.00 H +ATOM 1320 HG22 VAL 253 -29.430 -8.871 -25.054 1.00 0.00 H +ATOM 1321 HG23 VAL 253 -28.744 -9.910 -26.113 1.00 0.00 H +ATOM 1322 C VAL 253 -26.048 -11.549 -23.730 1.00 0.00 C +ATOM 1323 O VAL 253 -24.956 -10.985 -23.811 1.00 0.00 O +ATOM 1324 N PHE 254 -26.328 -12.408 -22.759 1.00 0.00 N +ATOM 1325 H PHE 254 -27.266 -12.822 -22.785 1.00 0.00 H +ATOM 1326 CA PHE 254 -25.325 -12.707 -21.744 1.00 0.00 C +ATOM 1327 HA PHE 254 -24.774 -11.854 -21.612 1.00 0.00 H +ATOM 1328 CB PHE 254 -25.989 -13.057 -20.407 1.00 0.00 C +ATOM 1329 HB2 PHE 254 -26.372 -12.229 -20.033 1.00 0.00 H +ATOM 1330 HB3 PHE 254 -26.683 -13.735 -20.582 1.00 0.00 H +ATOM 1331 CG PHE 254 -25.029 -13.626 -19.389 1.00 0.00 C +ATOM 1332 CD1 PHE 254 -24.147 -12.797 -18.690 1.00 0.00 C +ATOM 1333 HD1 PHE 254 -24.181 -11.814 -18.825 1.00 0.00 H +ATOM 1334 CE1 PHE 254 -23.221 -13.337 -17.803 1.00 0.00 C +ATOM 1335 HE1 PHE 254 -22.601 -12.726 -17.299 1.00 0.00 H +ATOM 1336 CZ PHE 254 -23.155 -14.716 -17.618 1.00 0.00 C +ATOM 1337 HZ PHE 254 -22.481 -15.100 -16.991 1.00 0.00 H +ATOM 1338 CE2 PHE 254 -24.029 -15.548 -18.308 1.00 0.00 C +ATOM 1339 HE2 PHE 254 -23.994 -16.551 -18.171 1.00 0.00 H +ATOM 1340 CD2 PHE 254 -24.952 -15.006 -19.189 1.00 0.00 C +ATOM 1341 HD2 PHE 254 -25.574 -15.609 -19.690 1.00 0.00 H +ATOM 1342 C PHE 254 -24.328 -13.814 -22.100 1.00 0.00 C +ATOM 1343 O PHE 254 -23.119 -13.620 -22.006 1.00 0.00 O +ATOM 1344 N SER 255 -24.824 -14.984 -22.489 1.00 0.00 N +ATOM 1345 H SER 255 -25.846 -15.043 -22.539 1.00 0.00 H +ATOM 1346 CA SER 255 -23.919 -16.088 -22.814 1.00 0.00 C +ATOM 1347 HA SER 255 -23.308 -16.236 -22.009 1.00 0.00 H +ATOM 1348 CB SER 255 -24.706 -17.379 -23.015 1.00 0.00 C +ATOM 1349 HB2 SER 255 -25.312 -17.270 -23.792 1.00 0.00 H +ATOM 1350 HB3 SER 255 -24.070 -18.125 -23.165 1.00 0.00 H +ATOM 1351 OG SER 255 -25.481 -17.658 -21.860 1.00 0.00 O +ATOM 1352 HG SER 255 -26.173 -16.947 -21.744 1.00 0.00 H +ATOM 1353 C SER 255 -23.028 -15.853 -24.033 1.00 0.00 C +ATOM 1354 O SER 255 -21.872 -16.284 -24.046 1.00 0.00 O +ATOM 1355 N ASP 256 -23.562 -15.187 -25.054 1.00 0.00 N +ATOM 1356 H ASP 256 -24.538 -14.876 -24.914 1.00 0.00 H +ATOM 1357 CA ASP 256 -22.796 -14.929 -26.274 1.00 0.00 C +ATOM 1358 HA ASP 256 -22.166 -15.700 -26.396 1.00 0.00 H +ATOM 1359 CB ASP 256 -23.747 -14.753 -27.466 1.00 0.00 C +ATOM 1360 HB2 ASP 256 -24.491 -15.403 -27.360 1.00 0.00 H +ATOM 1361 HB3 ASP 256 -24.092 -13.822 -27.446 1.00 0.00 H +ATOM 1362 CG ASP 256 -23.067 -14.997 -28.796 1.00 0.00 C +ATOM 1363 OD1 ASP 256 -21.899 -15.441 -28.789 1.00 0.00 O +ATOM 1364 OD2 ASP 256 -23.705 -14.759 -29.840 1.00 0.00 O +ATOM 1365 C ASP 256 -21.950 -13.679 -26.100 1.00 0.00 C +ATOM 1366 O ASP 256 -22.237 -12.639 -26.691 1.00 0.00 O +ATOM 1367 N GLY 257 -20.903 -13.787 -25.291 1.00 0.00 N +ATOM 1368 H GLY 257 -20.767 -14.718 -24.867 1.00 0.00 H +ATOM 1369 CA GLY 257 -20.035 -12.647 -25.048 1.00 0.00 C +ATOM 1370 HA2 GLY 257 -19.568 -12.390 -25.896 1.00 0.00 H +ATOM 1371 HA3 GLY 257 -20.579 -11.870 -24.726 1.00 0.00 H +ATOM 1372 C GLY 257 -18.999 -13.009 -23.992 1.00 0.00 C +ATOM 1373 O GLY 257 -19.096 -14.059 -23.348 1.00 0.00 O +ATOM 1374 N VAL 258 -18.008 -12.147 -23.794 1.00 0.00 N +ATOM 1375 H VAL 258 -18.029 -11.305 -24.384 1.00 0.00 H +ATOM 1376 CA VAL 258 -16.993 -12.427 -22.800 1.00 0.00 C +ATOM 1377 HA VAL 258 -16.642 -13.351 -22.958 1.00 0.00 H +ATOM 1378 CB VAL 258 -15.803 -11.420 -22.883 1.00 0.00 C +ATOM 1379 HB VAL 258 -16.082 -10.596 -22.417 1.00 0.00 H +ATOM 1380 CG1 VAL 258 -14.611 -11.992 -22.117 1.00 0.00 C +ATOM 1381 HG11 VAL 258 -14.588 -12.984 -22.234 1.00 0.00 H +ATOM 1382 HG12 VAL 258 -13.767 -11.593 -22.472 1.00 0.00 H +ATOM 1383 HG13 VAL 258 -14.704 -11.771 -21.147 1.00 0.00 H +ATOM 1384 CG2 VAL 258 -15.418 -11.159 -24.334 1.00 0.00 C +ATOM 1385 HG21 VAL 258 -14.941 -11.959 -24.697 1.00 0.00 H +ATOM 1386 HG22 VAL 258 -16.245 -10.989 -24.869 1.00 0.00 H +ATOM 1387 HG23 VAL 258 -14.819 -10.360 -24.377 1.00 0.00 H +ATOM 1388 C VAL 258 -17.632 -12.393 -21.429 1.00 0.00 C +ATOM 1389 O VAL 258 -18.617 -11.691 -21.193 1.00 0.00 O +ATOM 1390 N THR 259 -17.055 -13.166 -20.524 1.00 0.00 N +ATOM 1391 H THR 259 -16.219 -13.685 -20.861 1.00 0.00 H +ATOM 1392 CA THR 259 -17.570 -13.262 -19.175 1.00 0.00 C +ATOM 1393 HA THR 259 -18.481 -12.817 -19.143 1.00 0.00 H +ATOM 1394 CB THR 259 -17.698 -14.742 -18.757 1.00 0.00 C +ATOM 1395 HB THR 259 -16.764 -15.138 -18.663 1.00 0.00 H +ATOM 1396 CG2 THR 259 -18.450 -14.851 -17.455 1.00 0.00 C +ATOM 1397 HG21 THR 259 -19.421 -14.635 -17.596 1.00 0.00 H +ATOM 1398 HG22 THR 259 -18.377 -15.784 -17.089 1.00 0.00 H +ATOM 1399 HG23 THR 259 -18.072 -14.209 -16.781 1.00 0.00 H +ATOM 1400 OG1 THR 259 -18.391 -15.469 -19.785 1.00 0.00 O +ATOM 1401 HG1 THR 259 -18.425 -14.928 -20.631 1.00 0.00 H +ATOM 1402 C THR 259 -16.670 -12.569 -18.162 1.00 0.00 C +ATOM 1403 O THR 259 -15.458 -12.745 -18.180 1.00 0.00 O +ATOM 1404 N ASN 260 -17.278 -11.789 -17.279 1.00 0.00 N +ATOM 1405 H ASN 260 -18.307 -11.683 -17.432 1.00 0.00 H +ATOM 1406 CA ASN 260 -16.568 -11.135 -16.186 1.00 0.00 C +ATOM 1407 HA ASN 260 -15.902 -11.776 -15.842 1.00 0.00 H +ATOM 1408 CB ASN 260 -15.905 -9.805 -16.602 1.00 0.00 C +ATOM 1409 HB2 ASN 260 -15.574 -9.352 -15.775 1.00 0.00 H +ATOM 1410 HB3 ASN 260 -15.133 -10.018 -17.200 1.00 0.00 H +ATOM 1411 CG ASN 260 -16.841 -8.858 -17.334 1.00 0.00 C +ATOM 1412 OD1 ASN 260 -17.905 -8.490 -16.837 1.00 0.00 O +ATOM 1413 ND2 ASN 260 -16.428 -8.445 -18.529 1.00 0.00 N +ATOM 1414 HD21 ASN 260 -16.996 -7.815 -19.063 1.00 0.00 H +ATOM 1415 HD22 ASN 260 -15.555 -8.760 -18.898 1.00 0.00 H +ATOM 1416 C ASN 260 -17.607 -10.938 -15.098 1.00 0.00 C +ATOM 1417 O ASN 260 -18.800 -11.075 -15.362 1.00 0.00 O +ATOM 1418 N TRP 261 -17.170 -10.647 -13.877 1.00 0.00 N +ATOM 1419 H TRP 261 -16.152 -10.550 -13.781 1.00 0.00 H +ATOM 1420 CA TRP 261 -18.117 -10.488 -12.788 1.00 0.00 C +ATOM 1421 HA TRP 261 -18.642 -11.351 -12.705 1.00 0.00 H +ATOM 1422 CB TRP 261 -17.375 -10.282 -11.458 1.00 0.00 C +ATOM 1423 HB2 TRP 261 -16.612 -9.673 -11.604 1.00 0.00 H +ATOM 1424 HB3 TRP 261 -18.005 -9.923 -10.788 1.00 0.00 H +ATOM 1425 CG TRP 261 -16.810 -11.573 -10.890 1.00 0.00 C +ATOM 1426 CD1 TRP 261 -15.501 -11.850 -10.618 1.00 0.00 C +ATOM 1427 HD1 TRP 261 -14.739 -11.221 -10.750 1.00 0.00 H +ATOM 1428 NE1 TRP 261 -15.379 -13.137 -10.129 1.00 0.00 N +ATOM 1429 HE1 TRP 261 -14.522 -13.574 -9.861 1.00 0.00 H +ATOM 1430 CE2 TRP 261 -16.620 -13.712 -10.073 1.00 0.00 C +ATOM 1431 CZ2 TRP 261 -17.006 -14.995 -9.651 1.00 0.00 C +ATOM 1432 HZ2 TRP 261 -16.315 -15.646 -9.327 1.00 0.00 H +ATOM 1433 CH2 TRP 261 -18.340 -15.306 -9.703 1.00 0.00 C +ATOM 1434 HH2 TRP 261 -18.655 -16.207 -9.405 1.00 0.00 H +ATOM 1435 CZ3 TRP 261 -19.289 -14.382 -10.169 1.00 0.00 C +ATOM 1436 HZ3 TRP 261 -20.249 -14.631 -10.204 1.00 0.00 H +ATOM 1437 CE3 TRP 261 -18.906 -13.105 -10.590 1.00 0.00 C +ATOM 1438 HE3 TRP 261 -19.592 -12.461 -10.911 1.00 0.00 H +ATOM 1439 CD2 TRP 261 -17.549 -12.761 -10.547 1.00 0.00 C +ATOM 1440 C TRP 261 -19.123 -9.367 -13.037 1.00 0.00 C +ATOM 1441 O TRP 261 -20.273 -9.459 -12.611 1.00 0.00 O +ATOM 1442 N GLY 262 -18.696 -8.325 -13.748 1.00 0.00 N +ATOM 1443 H GLY 262 -17.715 -8.379 -14.061 1.00 0.00 H +ATOM 1444 CA GLY 262 -19.586 -7.214 -14.037 1.00 0.00 C +ATOM 1445 HA2 GLY 262 -19.918 -6.812 -13.169 1.00 0.00 H +ATOM 1446 HA3 GLY 262 -19.075 -6.492 -14.529 1.00 0.00 H +ATOM 1447 C GLY 262 -20.780 -7.641 -14.877 1.00 0.00 C +ATOM 1448 O GLY 262 -21.913 -7.225 -14.620 1.00 0.00 O +ATOM 1449 N ARG 263 -20.539 -8.488 -15.875 1.00 0.00 N +ATOM 1450 H ARG 263 -19.560 -8.777 -15.986 1.00 0.00 H +ATOM 1451 CA ARG 263 -21.633 -8.947 -16.729 1.00 0.00 C +ATOM 1452 HA ARG 263 -22.156 -8.144 -17.044 1.00 0.00 H +ATOM 1453 CB ARG 263 -21.092 -9.657 -17.976 1.00 0.00 C +ATOM 1454 HB2 ARG 263 -20.407 -10.313 -17.688 1.00 0.00 H +ATOM 1455 HB3 ARG 263 -21.848 -10.112 -18.428 1.00 0.00 H +ATOM 1456 CG ARG 263 -20.444 -8.706 -18.979 1.00 0.00 C +ATOM 1457 HG2 ARG 263 -21.127 -8.065 -19.323 1.00 0.00 H +ATOM 1458 HG3 ARG 263 -19.704 -8.205 -18.535 1.00 0.00 H +ATOM 1459 CD ARG 263 -19.846 -9.447 -20.189 1.00 0.00 C +ATOM 1460 HD2 ARG 263 -19.412 -8.769 -20.774 1.00 0.00 H +ATOM 1461 HD3 ARG 263 -19.170 -10.090 -19.844 1.00 0.00 H +ATOM 1462 NE ARG 263 -20.865 -10.172 -20.953 1.00 0.00 N +ATOM 1463 HE ARG 263 -20.922 -11.166 -20.833 1.00 0.00 H +ATOM 1464 CZ ARG 263 -21.712 -9.588 -21.790 1.00 0.00 C +ATOM 1465 NH1 ARG 263 -21.642 -8.290 -21.971 1.00 0.00 N +ATOM 1466 HH11 ARG 263 -20.961 -7.721 -21.518 1.00 0.00 H +ATOM 1467 HH12 ARG 263 -22.304 -7.837 -22.598 1.00 0.00 H +ATOM 1468 NH2 ARG 263 -22.642 -10.290 -22.413 1.00 0.00 N +ATOM 1469 HH21 ARG 263 -22.690 -11.284 -22.261 1.00 0.00 H +ATOM 1470 HH22 ARG 263 -23.288 -9.848 -23.027 1.00 0.00 H +ATOM 1471 C ARG 263 -22.575 -9.876 -15.974 1.00 0.00 C +ATOM 1472 O ARG 263 -23.756 -9.949 -16.291 1.00 0.00 O +ATOM 1473 N ILE 264 -22.050 -10.595 -14.985 1.00 0.00 N +ATOM 1474 H ILE 264 -21.039 -10.459 -14.830 1.00 0.00 H +ATOM 1475 CA ILE 264 -22.880 -11.500 -14.199 1.00 0.00 C +ATOM 1476 HA ILE 264 -23.483 -11.964 -14.843 1.00 0.00 H +ATOM 1477 CB ILE 264 -21.985 -12.465 -13.384 1.00 0.00 C +ATOM 1478 HB ILE 264 -21.293 -11.928 -12.933 1.00 0.00 H +ATOM 1479 CG2 ILE 264 -22.805 -13.230 -12.339 1.00 0.00 C +ATOM 1480 HG21 ILE 264 -22.199 -13.828 -11.821 1.00 0.00 H +ATOM 1481 HG22 ILE 264 -23.242 -12.579 -11.724 1.00 0.00 H +ATOM 1482 HG23 ILE 264 -23.500 -13.774 -12.802 1.00 0.00 H +ATOM 1483 CG1 ILE 264 -21.291 -13.423 -14.357 1.00 0.00 C +ATOM 1484 HG12 ILE 264 -21.995 -13.994 -14.788 1.00 0.00 H +ATOM 1485 HG13 ILE 264 -20.858 -12.872 -15.076 1.00 0.00 H +ATOM 1486 CD1 ILE 264 -20.253 -14.307 -13.729 1.00 0.00 C +ATOM 1487 HD11 ILE 264 -20.676 -14.873 -13.020 1.00 0.00 H +ATOM 1488 HD12 ILE 264 -19.848 -14.900 -14.427 1.00 0.00 H +ATOM 1489 HD13 ILE 264 -19.535 -13.744 -13.317 1.00 0.00 H +ATOM 1490 C ILE 264 -23.782 -10.670 -13.282 1.00 0.00 C +ATOM 1491 O ILE 264 -24.956 -10.986 -13.084 1.00 0.00 O +ATOM 1492 N VAL 265 -23.231 -9.590 -12.741 1.00 0.00 N +ATOM 1493 H VAL 265 -22.236 -9.436 -12.982 1.00 0.00 H +ATOM 1494 CA VAL 265 -23.999 -8.703 -11.874 1.00 0.00 C +ATOM 1495 HA VAL 265 -24.442 -9.254 -11.169 1.00 0.00 H +ATOM 1496 CB VAL 265 -23.098 -7.632 -11.234 1.00 0.00 C +ATOM 1497 HB VAL 265 -22.575 -7.203 -11.962 1.00 0.00 H +ATOM 1498 CG1 VAL 265 -23.949 -6.547 -10.596 1.00 0.00 C +ATOM 1499 HG11 VAL 265 -23.364 -5.926 -10.073 1.00 0.00 H +ATOM 1500 HG12 VAL 265 -24.425 -6.032 -11.309 1.00 0.00 H +ATOM 1501 HG13 VAL 265 -24.621 -6.965 -9.984 1.00 0.00 H +ATOM 1502 CG2 VAL 265 -22.187 -8.274 -10.192 1.00 0.00 C +ATOM 1503 HG21 VAL 265 -22.288 -9.267 -10.235 1.00 0.00 H +ATOM 1504 HG22 VAL 265 -21.239 -8.022 -10.385 1.00 0.00 H +ATOM 1505 HG23 VAL 265 -22.446 -7.947 -9.284 1.00 0.00 H +ATOM 1506 C VAL 265 -25.106 -8.024 -12.699 1.00 0.00 C +ATOM 1507 O VAL 265 -26.230 -7.866 -12.228 1.00 0.00 O +ATOM 1508 N THR 266 -24.797 -7.645 -13.937 1.00 0.00 N +ATOM 1509 H THR 266 -23.827 -7.828 -14.227 1.00 0.00 H +ATOM 1510 CA THR 266 -25.802 -7.015 -14.791 1.00 0.00 C +ATOM 1511 HA THR 266 -26.195 -6.237 -14.302 1.00 0.00 H +ATOM 1512 CB THR 266 -25.192 -6.544 -16.125 1.00 0.00 C +ATOM 1513 HB THR 266 -24.752 -7.338 -16.584 1.00 0.00 H +ATOM 1514 CG2 THR 266 -26.275 -5.935 -17.034 1.00 0.00 C +ATOM 1515 HG21 THR 266 -27.172 -6.277 -16.755 1.00 0.00 H +ATOM 1516 HG22 THR 266 -26.255 -4.939 -16.951 1.00 0.00 H +ATOM 1517 HG23 THR 266 -26.097 -6.196 -17.982 1.00 0.00 H +ATOM 1518 OG1 THR 266 -24.177 -5.563 -15.857 1.00 0.00 O +ATOM 1519 HG1 THR 266 -23.376 -5.998 -15.434 1.00 0.00 H +ATOM 1520 C THR 266 -26.919 -8.016 -15.079 1.00 0.00 C +ATOM 1521 O THR 266 -28.102 -7.673 -15.065 1.00 0.00 O +ATOM 1522 N LEU 267 -26.537 -9.259 -15.345 1.00 0.00 N +ATOM 1523 H LEU 267 -25.512 -9.412 -15.348 1.00 0.00 H +ATOM 1524 CA LEU 267 -27.511 -10.311 -15.610 1.00 0.00 C +ATOM 1525 HA LEU 267 -28.040 -10.063 -16.429 1.00 0.00 H +ATOM 1526 CB LEU 267 -26.791 -11.643 -15.839 1.00 0.00 C +ATOM 1527 HB2 LEU 267 -26.350 -11.603 -16.734 1.00 0.00 H +ATOM 1528 HB3 LEU 267 -26.101 -11.745 -15.126 1.00 0.00 H +ATOM 1529 CG LEU 267 -27.658 -12.908 -15.817 1.00 0.00 C +ATOM 1530 HG LEU 267 -28.287 -12.856 -15.047 1.00 0.00 H +ATOM 1531 CD1 LEU 267 -28.450 -13.011 -17.114 1.00 0.00 C +ATOM 1532 HD11 LEU 267 -27.818 -13.056 -17.888 1.00 0.00 H +ATOM 1533 HD12 LEU 267 -29.014 -13.837 -17.096 1.00 0.00 H +ATOM 1534 HD13 LEU 267 -29.038 -12.208 -17.210 1.00 0.00 H +ATOM 1535 CD2 LEU 267 -26.769 -14.138 -15.637 1.00 0.00 C +ATOM 1536 HD21 LEU 267 -26.269 -14.062 -14.775 1.00 0.00 H +ATOM 1537 HD22 LEU 267 -27.339 -14.959 -15.623 1.00 0.00 H +ATOM 1538 HD23 LEU 267 -26.121 -14.192 -16.396 1.00 0.00 H +ATOM 1539 C LEU 267 -28.486 -10.466 -14.440 1.00 0.00 C +ATOM 1540 O LEU 267 -29.704 -10.525 -14.630 1.00 0.00 O +ATOM 1541 N ILE 268 -27.937 -10.531 -13.232 1.00 0.00 N +ATOM 1542 H ILE 268 -26.899 -10.447 -13.221 1.00 0.00 H +ATOM 1543 CA ILE 268 -28.737 -10.707 -12.023 1.00 0.00 C +ATOM 1544 HA ILE 268 -29.429 -11.406 -12.241 1.00 0.00 H +ATOM 1545 CB ILE 268 -27.836 -11.130 -10.830 1.00 0.00 C +ATOM 1546 HB ILE 268 -27.096 -10.477 -10.765 1.00 0.00 H +ATOM 1547 CG2 ILE 268 -28.635 -11.125 -9.524 1.00 0.00 C +ATOM 1548 HG21 ILE 268 -28.031 -11.365 -8.768 1.00 0.00 H +ATOM 1549 HG22 ILE 268 -29.015 -10.215 -9.374 1.00 0.00 H +ATOM 1550 HG23 ILE 268 -29.374 -11.791 -9.588 1.00 0.00 H +ATOM 1551 CG1 ILE 268 -27.232 -12.514 -11.101 1.00 0.00 C +ATOM 1552 HG12 ILE 268 -27.963 -13.193 -11.050 1.00 0.00 H +ATOM 1553 HG13 ILE 268 -26.860 -12.516 -12.029 1.00 0.00 H +ATOM 1554 CD1 ILE 268 -26.127 -12.908 -10.135 1.00 0.00 C +ATOM 1555 HD11 ILE 268 -26.492 -12.921 -9.206 1.00 0.00 H +ATOM 1556 HD12 ILE 268 -25.788 -13.815 -10.377 1.00 0.00 H +ATOM 1557 HD13 ILE 268 -25.385 -12.243 -10.197 1.00 0.00 H +ATOM 1558 C ILE 268 -29.503 -9.437 -11.658 1.00 0.00 C +ATOM 1559 O ILE 268 -30.666 -9.494 -11.258 1.00 0.00 O +ATOM 1560 N SER 269 -28.850 -8.293 -11.829 1.00 0.00 N +ATOM 1561 H SER 269 -27.887 -8.395 -12.209 1.00 0.00 H +ATOM 1562 CA SER 269 -29.452 -7.007 -11.504 1.00 0.00 C +ATOM 1563 HA SER 269 -29.763 -7.043 -10.539 1.00 0.00 H +ATOM 1564 CB SER 269 -28.413 -5.898 -11.641 1.00 0.00 C +ATOM 1565 HB2 SER 269 -28.046 -5.913 -12.562 1.00 0.00 H +ATOM 1566 HB3 SER 269 -28.846 -5.026 -11.449 1.00 0.00 H +ATOM 1567 OG SER 269 -27.359 -6.104 -10.719 1.00 0.00 O +ATOM 1568 HG SER 269 -26.715 -6.772 -11.091 1.00 0.00 H +ATOM 1569 C SER 269 -30.657 -6.687 -12.371 1.00 0.00 C +ATOM 1570 O SER 269 -31.663 -6.161 -11.887 1.00 0.00 O +ATOM 1571 N PHE 270 -30.554 -6.970 -13.660 1.00 0.00 N +ATOM 1572 H PHE 270 -29.662 -7.363 -13.966 1.00 0.00 H +ATOM 1573 CA PHE 270 -31.685 -6.709 -14.524 1.00 0.00 C +ATOM 1574 HA PHE 270 -32.057 -5.822 -14.269 1.00 0.00 H +ATOM 1575 CB PHE 270 -31.292 -6.802 -16.000 1.00 0.00 C +ATOM 1576 HB2 PHE 270 -30.548 -6.174 -16.155 1.00 0.00 H +ATOM 1577 HB3 PHE 270 -31.029 -7.734 -16.185 1.00 0.00 H +ATOM 1578 CG PHE 270 -32.412 -6.439 -16.935 1.00 0.00 C +ATOM 1579 CD1 PHE 270 -32.845 -5.119 -17.043 1.00 0.00 C +ATOM 1580 HD1 PHE 270 -32.389 -4.402 -16.529 1.00 0.00 H +ATOM 1581 CE1 PHE 270 -33.919 -4.787 -17.873 1.00 0.00 C +ATOM 1582 HE1 PHE 270 -34.218 -3.831 -17.935 1.00 0.00 H +ATOM 1583 CZ PHE 270 -34.560 -5.781 -18.600 1.00 0.00 C +ATOM 1584 HZ PHE 270 -35.328 -5.548 -19.194 1.00 0.00 H +ATOM 1585 CE2 PHE 270 -34.130 -7.102 -18.499 1.00 0.00 C +ATOM 1586 HE2 PHE 270 -34.593 -7.831 -19.025 1.00 0.00 H +ATOM 1587 CD2 PHE 270 -33.062 -7.419 -17.670 1.00 0.00 C +ATOM 1588 HD2 PHE 270 -32.756 -8.372 -17.603 1.00 0.00 H +ATOM 1589 C PHE 270 -32.759 -7.742 -14.201 1.00 0.00 C +ATOM 1590 O PHE 270 -33.948 -7.482 -14.363 1.00 0.00 O +ATOM 1591 N GLY 271 -32.330 -8.919 -13.752 1.00 0.00 N +ATOM 1592 H GLY 271 -31.308 -9.025 -13.696 1.00 0.00 H +ATOM 1593 CA GLY 271 -33.283 -9.951 -13.379 1.00 0.00 C +ATOM 1594 HA2 GLY 271 -33.873 -10.163 -14.156 1.00 0.00 H +ATOM 1595 HA3 GLY 271 -32.796 -10.774 -13.093 1.00 0.00 H +ATOM 1596 C GLY 271 -34.130 -9.437 -12.226 1.00 0.00 C +ATOM 1597 O GLY 271 -35.335 -9.677 -12.173 1.00 0.00 O +ATOM 1598 N ALA 272 -33.489 -8.730 -11.298 1.00 0.00 N +ATOM 1599 H ALA 272 -32.467 -8.624 -11.461 1.00 0.00 H +ATOM 1600 CA ALA 272 -34.182 -8.156 -10.149 1.00 0.00 C +ATOM 1601 HA ALA 272 -34.733 -8.872 -9.712 1.00 0.00 H +ATOM 1602 CB ALA 272 -33.182 -7.617 -9.146 1.00 0.00 C +ATOM 1603 HB1 ALA 272 -32.392 -8.229 -9.095 1.00 0.00 H +ATOM 1604 HB2 ALA 272 -32.876 -6.707 -9.430 1.00 0.00 H +ATOM 1605 HB3 ALA 272 -33.610 -7.555 -8.243 1.00 0.00 H +ATOM 1606 C ALA 272 -35.109 -7.037 -10.606 1.00 0.00 C +ATOM 1607 O ALA 272 -36.184 -6.845 -10.039 1.00 0.00 O +ATOM 1608 N PHE 273 -34.682 -6.304 -11.634 1.00 0.00 N +ATOM 1609 H PHE 273 -33.748 -6.581 -12.004 1.00 0.00 H +ATOM 1610 CA PHE 273 -35.467 -5.203 -12.191 1.00 0.00 C +ATOM 1611 HA PHE 273 -35.743 -4.625 -11.428 1.00 0.00 H +ATOM 1612 CB PHE 273 -34.648 -4.478 -13.270 1.00 0.00 C +ATOM 1613 HB2 PHE 273 -33.740 -4.323 -12.905 1.00 0.00 H +ATOM 1614 HB3 PHE 273 -34.614 -5.066 -14.067 1.00 0.00 H +ATOM 1615 CG PHE 273 -35.212 -3.149 -13.695 1.00 0.00 C +ATOM 1616 CD1 PHE 273 -35.122 -2.036 -12.863 1.00 0.00 C +ATOM 1617 HD1 PHE 273 -34.711 -2.117 -11.963 1.00 0.00 H +ATOM 1618 CE1 PHE 273 -35.607 -0.788 -13.281 1.00 0.00 C +ATOM 1619 HE1 PHE 273 -35.534 -0.000 -12.666 1.00 0.00 H +ATOM 1620 CZ PHE 273 -36.184 -0.659 -14.540 1.00 0.00 C +ATOM 1621 HZ PHE 273 -36.527 0.227 -14.843 1.00 0.00 H +ATOM 1622 CE2 PHE 273 -36.279 -1.772 -15.373 1.00 0.00 C +ATOM 1623 HE2 PHE 273 -36.701 -1.687 -16.289 1.00 0.00 H +ATOM 1624 CD2 PHE 273 -35.796 -3.002 -14.947 1.00 0.00 C +ATOM 1625 HD2 PHE 273 -35.869 -3.797 -15.553 1.00 0.00 H +ATOM 1626 C PHE 273 -36.748 -5.778 -12.794 1.00 0.00 C +ATOM 1627 O PHE 273 -37.816 -5.187 -12.683 1.00 0.00 O +ATOM 1628 N VAL 274 -36.633 -6.931 -13.447 1.00 0.00 N +ATOM 1629 H VAL 274 -35.676 -7.316 -13.494 1.00 0.00 H +ATOM 1630 CA VAL 274 -37.798 -7.571 -14.039 1.00 0.00 C +ATOM 1631 HA VAL 274 -38.326 -6.879 -14.527 1.00 0.00 H +ATOM 1632 CB VAL 274 -37.387 -8.720 -14.996 1.00 0.00 C +ATOM 1633 HB VAL 274 -36.832 -9.358 -14.475 1.00 0.00 H +ATOM 1634 CG1 VAL 274 -38.619 -9.480 -15.471 1.00 0.00 C +ATOM 1635 HG11 VAL 274 -38.340 -10.211 -16.093 1.00 0.00 H +ATOM 1636 HG12 VAL 274 -39.091 -9.875 -14.683 1.00 0.00 H +ATOM 1637 HG13 VAL 274 -39.234 -8.853 -15.948 1.00 0.00 H +ATOM 1638 CG2 VAL 274 -36.637 -8.154 -16.194 1.00 0.00 C +ATOM 1639 HG21 VAL 274 -36.840 -7.179 -16.279 1.00 0.00 H +ATOM 1640 HG22 VAL 274 -35.655 -8.283 -16.059 1.00 0.00 H +ATOM 1641 HG23 VAL 274 -36.929 -8.632 -17.022 1.00 0.00 H +ATOM 1642 C VAL 274 -38.679 -8.128 -12.918 1.00 0.00 C +ATOM 1643 O VAL 274 -39.900 -8.053 -12.989 1.00 0.00 O +ATOM 1644 N ALA 275 -38.051 -8.685 -11.885 1.00 0.00 N +ATOM 1645 H ALA 275 -37.017 -8.693 -11.956 1.00 0.00 H +ATOM 1646 CA ALA 275 -38.788 -9.234 -10.754 1.00 0.00 C +ATOM 1647 HA ALA 275 -39.379 -9.977 -11.078 1.00 0.00 H +ATOM 1648 CB ALA 275 -37.819 -9.798 -9.703 1.00 0.00 C +ATOM 1649 HB1 ALA 275 -38.106 -9.494 -8.798 1.00 0.00 H +ATOM 1650 HB2 ALA 275 -37.834 -10.794 -9.746 1.00 0.00 H +ATOM 1651 HB3 ALA 275 -36.899 -9.465 -9.895 1.00 0.00 H +ATOM 1652 C ALA 275 -39.671 -8.149 -10.132 1.00 0.00 C +ATOM 1653 O ALA 275 -40.813 -8.413 -9.743 1.00 0.00 O +ATOM 1654 N LYS 276 -39.140 -6.933 -10.027 1.00 0.00 N +ATOM 1655 H LYS 276 -38.168 -6.846 -10.365 1.00 0.00 H +ATOM 1656 CA LYS 276 -39.909 -5.821 -9.467 1.00 0.00 C +ATOM 1657 HA LYS 276 -40.239 -6.082 -8.559 1.00 0.00 H +ATOM 1658 CB LYS 276 -39.056 -4.558 -9.365 1.00 0.00 C +ATOM 1659 HB2 LYS 276 -38.563 -4.446 -10.230 1.00 0.00 H +ATOM 1660 HB3 LYS 276 -39.672 -3.778 -9.236 1.00 0.00 H +ATOM 1661 CG LYS 276 -38.051 -4.567 -8.238 1.00 0.00 C +ATOM 1662 HG2 LYS 276 -38.533 -4.481 -7.367 1.00 0.00 H +ATOM 1663 HG3 LYS 276 -37.542 -5.425 -8.258 1.00 0.00 H +ATOM 1664 CD LYS 276 -37.085 -3.417 -8.382 1.00 0.00 C +ATOM 1665 HD2 LYS 276 -36.546 -3.546 -9.210 1.00 0.00 H +ATOM 1666 HD3 LYS 276 -37.597 -2.565 -8.435 1.00 0.00 H +ATOM 1667 CE LYS 276 -36.143 -3.341 -7.200 1.00 0.00 C +ATOM 1668 HE2 LYS 276 -36.662 -3.100 -6.384 1.00 0.00 H +ATOM 1669 HE3 LYS 276 -35.705 -4.228 -7.074 1.00 0.00 H +ATOM 1670 NZ LYS 276 -35.107 -2.311 -7.446 1.00 0.00 N +ATOM 1671 HZ1 LYS 276 -35.246 -1.905 -8.350 1.00 0.00 H +ATOM 1672 HZ2 LYS 276 -35.172 -1.597 -6.748 1.00 0.00 H +ATOM 1673 HZ3 LYS 276 -34.200 -2.732 -7.407 1.00 0.00 H +ATOM 1674 C LYS 276 -41.100 -5.536 -10.363 1.00 0.00 C +ATOM 1675 O LYS 276 -42.215 -5.319 -9.885 1.00 0.00 O +ATOM 1676 N HIE 277 -40.853 -5.525 -11.670 1.00 0.00 N +ATOM 1677 H HIE 277 -39.863 -5.706 -11.927 1.00 0.00 H +ATOM 1678 CA HIE 277 -41.905 -5.277 -12.645 1.00 0.00 C +ATOM 1679 HA HIE 277 -42.322 -4.384 -12.449 1.00 0.00 H +ATOM 1680 CB HIE 277 -41.314 -5.289 -14.054 1.00 0.00 C +ATOM 1681 HB2 HIE 277 -40.784 -4.446 -14.194 1.00 0.00 H +ATOM 1682 HB3 HIE 277 -40.693 -6.075 -14.141 1.00 0.00 H +ATOM 1683 CG HIE 277 -42.344 -5.382 -15.135 1.00 0.00 C +ATOM 1684 ND1 HIE 277 -43.132 -4.316 -15.507 1.00 0.00 N +ATOM 1685 CE1 HIE 277 -43.967 -4.701 -16.457 1.00 0.00 C +ATOM 1686 HE1 HIE 277 -44.647 -4.126 -16.903 1.00 0.00 H +ATOM 1687 NE2 HIE 277 -43.748 -5.977 -16.712 1.00 0.00 N +ATOM 1688 HE2 HIE 277 -44.239 -6.529 -17.389 1.00 0.00 H +ATOM 1689 CD2 HIE 277 -42.735 -6.427 -15.899 1.00 0.00 C +ATOM 1690 HD2 HIE 277 -42.362 -7.350 -15.878 1.00 0.00 H +ATOM 1691 C HIE 277 -43.002 -6.344 -12.545 1.00 0.00 C +ATOM 1692 O HIE 277 -44.191 -6.039 -12.682 1.00 0.00 O +ATOM 1693 N LEU 278 -42.592 -7.592 -12.312 1.00 0.00 N +ATOM 1694 H LEU 278 -41.560 -7.698 -12.221 1.00 0.00 H +ATOM 1695 CA LEU 278 -43.526 -8.711 -12.196 1.00 0.00 C +ATOM 1696 HA LEU 278 -44.096 -8.740 -13.030 1.00 0.00 H +ATOM 1697 CB LEU 278 -42.762 -10.033 -12.087 1.00 0.00 C +ATOM 1698 HB2 LEU 278 -42.036 -9.911 -11.434 1.00 0.00 H +ATOM 1699 HB3 LEU 278 -43.398 -10.730 -11.812 1.00 0.00 H +ATOM 1700 CG LEU 278 -42.133 -10.470 -13.405 1.00 0.00 C +ATOM 1701 HG LEU 278 -41.482 -9.772 -13.703 1.00 0.00 H +ATOM 1702 CD1 LEU 278 -41.411 -11.794 -13.236 1.00 0.00 C +ATOM 1703 HD11 LEU 278 -42.060 -12.496 -12.939 1.00 0.00 H +ATOM 1704 HD12 LEU 278 -41.003 -12.069 -14.108 1.00 0.00 H +ATOM 1705 HD13 LEU 278 -40.689 -11.698 -12.549 1.00 0.00 H +ATOM 1706 CD2 LEU 278 -43.222 -10.602 -14.452 1.00 0.00 C +ATOM 1707 HD21 LEU 278 -43.681 -9.720 -14.575 1.00 0.00 H +ATOM 1708 HD22 LEU 278 -42.819 -10.889 -15.323 1.00 0.00 H +ATOM 1709 HD23 LEU 278 -43.893 -11.285 -14.157 1.00 0.00 H +ATOM 1710 C LEU 278 -44.450 -8.569 -10.989 1.00 0.00 C +ATOM 1711 O LEU 278 -45.623 -8.954 -11.051 1.00 0.00 O +ATOM 1712 N LYS 279 -43.920 -8.030 -9.896 1.00 0.00 N +ATOM 1713 H LYS 279 -42.923 -7.764 -9.975 1.00 0.00 H +ATOM 1714 CA LYS 279 -44.715 -7.840 -8.686 1.00 0.00 C +ATOM 1715 HA LYS 279 -45.225 -8.680 -8.498 1.00 0.00 H +ATOM 1716 CB LYS 279 -43.805 -7.482 -7.512 1.00 0.00 C +ATOM 1717 HB2 LYS 279 -43.176 -8.246 -7.362 1.00 0.00 H +ATOM 1718 HB3 LYS 279 -43.279 -6.667 -7.764 1.00 0.00 H +ATOM 1719 CG LYS 279 -44.532 -7.200 -6.214 1.00 0.00 C +ATOM 1720 HG2 LYS 279 -43.874 -6.876 -5.534 1.00 0.00 H +ATOM 1721 HG3 LYS 279 -45.224 -6.497 -6.372 1.00 0.00 H +ATOM 1722 CD LYS 279 -45.207 -8.448 -5.691 1.00 0.00 C +ATOM 1723 HD2 LYS 279 -45.969 -8.688 -6.296 1.00 0.00 H +ATOM 1724 HD3 LYS 279 -44.546 -9.201 -5.681 1.00 0.00 H +ATOM 1725 CE LYS 279 -45.763 -8.288 -4.271 1.00 0.00 C +ATOM 1726 HE2 LYS 279 -46.090 -9.184 -3.949 1.00 0.00 H +ATOM 1727 HE3 LYS 279 -45.018 -7.987 -3.664 1.00 0.00 H +ATOM 1728 NZ LYS 279 -46.892 -7.298 -4.182 1.00 0.00 N +ATOM 1729 HZ1 LYS 279 -47.093 -6.953 -5.096 1.00 0.00 H +ATOM 1730 HZ2 LYS 279 -47.694 -7.755 -3.806 1.00 0.00 H +ATOM 1731 HZ3 LYS 279 -46.618 -6.547 -3.586 1.00 0.00 H +ATOM 1732 C LYS 279 -45.696 -6.706 -8.913 1.00 0.00 C +ATOM 1733 O LYS 279 -46.876 -6.795 -8.559 1.00 0.00 O +ATOM 1734 N THR 280 -45.177 -5.634 -9.503 1.00 0.00 N +ATOM 1735 H THR 280 -44.158 -5.730 -9.741 1.00 0.00 H +ATOM 1736 CA THR 280 -45.943 -4.432 -9.797 1.00 0.00 C +ATOM 1737 HA THR 280 -46.245 -4.020 -8.924 1.00 0.00 H +ATOM 1738 CB THR 280 -45.039 -3.414 -10.528 1.00 0.00 C +ATOM 1739 HB THR 280 -44.638 -3.862 -11.348 1.00 0.00 H +ATOM 1740 CG2 THR 280 -45.819 -2.186 -10.931 1.00 0.00 C +ATOM 1741 HG21 THR 280 -46.797 -2.404 -10.999 1.00 0.00 H +ATOM 1742 HG22 THR 280 -45.696 -1.459 -10.249 1.00 0.00 H +ATOM 1743 HG23 THR 280 -45.500 -1.850 -11.822 1.00 0.00 H +ATOM 1744 OG1 THR 280 -43.962 -3.031 -9.655 1.00 0.00 O +ATOM 1745 HG1 THR 280 -43.250 -3.740 -9.651 1.00 0.00 H +ATOM 1746 C THR 280 -47.187 -4.732 -10.634 1.00 0.00 C +ATOM 1747 O THR 280 -48.260 -4.173 -10.379 1.00 0.00 O +ATOM 1748 N ILE 281 -47.040 -5.618 -11.619 1.00 0.00 N +ATOM 1749 H ILE 281 -46.090 -6.016 -11.711 1.00 0.00 H +ATOM 1750 CA ILE 281 -48.158 -5.979 -12.487 1.00 0.00 C +ATOM 1751 HA ILE 281 -48.818 -5.212 -12.429 1.00 0.00 H +ATOM 1752 CB ILE 281 -47.723 -6.197 -13.963 1.00 0.00 C +ATOM 1753 HB ILE 281 -48.546 -6.348 -14.500 1.00 0.00 H +ATOM 1754 CG2 ILE 281 -46.986 -4.959 -14.477 1.00 0.00 C +ATOM 1755 HG21 ILE 281 -46.747 -5.092 -15.436 1.00 0.00 H +ATOM 1756 HG22 ILE 281 -47.578 -4.162 -14.387 1.00 0.00 H +ATOM 1757 HG23 ILE 281 -46.156 -4.823 -13.941 1.00 0.00 H +ATOM 1758 CG1 ILE 281 -46.832 -7.434 -14.092 1.00 0.00 C +ATOM 1759 HG12 ILE 281 -45.954 -7.234 -13.667 1.00 0.00 H +ATOM 1760 HG13 ILE 281 -47.268 -8.183 -13.599 1.00 0.00 H +ATOM 1761 CD1 ILE 281 -46.609 -7.851 -15.520 1.00 0.00 C +ATOM 1762 HD11 ILE 281 -46.168 -7.106 -16.022 1.00 0.00 H +ATOM 1763 HD12 ILE 281 -46.022 -8.661 -15.545 1.00 0.00 H +ATOM 1764 HD13 ILE 281 -47.488 -8.065 -15.948 1.00 0.00 H +ATOM 1765 C ILE 281 -48.899 -7.226 -12.028 1.00 0.00 C +ATOM 1766 O ILE 281 -49.607 -7.858 -12.817 1.00 0.00 O +ATOM 1767 N ASN 282 -48.731 -7.578 -10.754 1.00 0.00 N +ATOM 1768 H ASN 282 -48.101 -6.948 -10.211 1.00 0.00 H +ATOM 1769 CA ASN 282 -49.380 -8.755 -10.167 1.00 0.00 C +ATOM 1770 HA ASN 282 -49.008 -8.849 -9.211 1.00 0.00 H +ATOM 1771 CB ASN 282 -50.877 -8.523 -9.987 1.00 0.00 C +ATOM 1772 HB2 ASN 282 -51.158 -7.797 -10.605 1.00 0.00 H +ATOM 1773 HB3 ASN 282 -51.352 -9.369 -10.204 1.00 0.00 H +ATOM 1774 CG ASN 282 -51.208 -8.122 -8.579 1.00 0.00 C +ATOM 1775 OD1 ASN 282 -51.177 -6.936 -8.252 1.00 0.00 O +ATOM 1776 ND2 ASN 282 -51.493 -9.099 -7.724 1.00 0.00 N +ATOM 1777 HD21 ASN 282 -51.725 -8.889 -6.778 1.00 0.00 H +ATOM 1778 HD22 ASN 282 -51.472 -10.051 -8.039 1.00 0.00 H +ATOM 1779 C ASN 282 -49.157 -10.096 -10.859 1.00 0.00 C +ATOM 1780 O ASN 282 -50.109 -10.831 -11.162 1.00 0.00 O +ATOM 1781 N GLN 283 -47.888 -10.398 -11.128 1.00 0.00 N +ATOM 1782 H GLN 283 -47.203 -9.656 -10.878 1.00 0.00 H +ATOM 1783 CA GLN 283 -47.501 -11.677 -11.728 1.00 0.00 C +ATOM 1784 HA GLN 283 -48.270 -12.287 -11.668 1.00 0.00 H +ATOM 1785 CB GLN 283 -46.992 -11.472 -13.156 1.00 0.00 C +ATOM 1786 HB2 GLN 283 -46.424 -10.653 -13.183 1.00 0.00 H +ATOM 1787 HB3 GLN 283 -46.453 -12.268 -13.425 1.00 0.00 H +ATOM 1788 CG GLN 283 -48.118 -11.299 -14.177 1.00 0.00 C +ATOM 1789 HG2 GLN 283 -48.852 -10.767 -13.754 1.00 0.00 H +ATOM 1790 HG3 GLN 283 -47.758 -10.800 -14.966 1.00 0.00 H +ATOM 1791 CD GLN 283 -48.696 -12.621 -14.661 1.00 0.00 C +ATOM 1792 OE1 GLN 283 -48.563 -13.663 -14.011 1.00 0.00 O +ATOM 1793 NE2 GLN 283 -49.364 -12.576 -15.803 1.00 0.00 N +ATOM 1794 HE21 GLN 283 -49.771 -13.424 -16.202 1.00 0.00 H +ATOM 1795 HE22 GLN 283 -49.470 -11.685 -16.282 1.00 0.00 H +ATOM 1796 C GLN 283 -46.402 -12.207 -10.825 1.00 0.00 C +ATOM 1797 O GLN 283 -45.402 -12.743 -11.289 1.00 0.00 O +ATOM 1798 N GLU 284 -46.614 -12.047 -9.522 1.00 0.00 N +ATOM 1799 H GLU 284 -47.524 -11.591 -9.286 1.00 0.00 H +ATOM 1800 CA GLU 284 -45.653 -12.474 -8.508 1.00 0.00 C +ATOM 1801 HA GLU 284 -44.825 -11.868 -8.554 1.00 0.00 H +ATOM 1802 CB GLU 284 -46.227 -12.220 -7.116 1.00 0.00 C +ATOM 1803 HB2 GLU 284 -46.836 -11.454 -7.181 1.00 0.00 H +ATOM 1804 HB3 GLU 284 -46.681 -13.040 -6.827 1.00 0.00 H +ATOM 1805 CG GLU 284 -45.167 -11.889 -6.099 1.00 0.00 C +ATOM 1806 HG2 GLU 284 -44.517 -12.628 -6.074 1.00 0.00 H +ATOM 1807 HG3 GLU 284 -44.746 -11.036 -6.351 1.00 0.00 H +ATOM 1808 CD GLU 284 -45.729 -11.727 -4.711 1.00 0.00 C +ATOM 1809 OE1 GLU 284 -46.883 -11.254 -4.595 1.00 0.00 O +ATOM 1810 OE2 GLU 284 -45.005 -12.055 -3.750 1.00 0.00 O +ATOM 1811 C GLU 284 -45.204 -13.933 -8.594 1.00 0.00 C +ATOM 1812 O GLU 284 -44.051 -14.254 -8.288 1.00 0.00 O +ATOM 1813 N SER 285 -46.099 -14.826 -9.001 1.00 0.00 N +ATOM 1814 H SER 285 -47.022 -14.453 -9.249 1.00 0.00 H +ATOM 1815 CA SER 285 -45.736 -16.237 -9.071 1.00 0.00 C +ATOM 1816 HA SER 285 -45.328 -16.499 -8.178 1.00 0.00 H +ATOM 1817 CB SER 285 -46.978 -17.107 -9.289 1.00 0.00 C +ATOM 1818 HB2 SER 285 -46.721 -18.065 -9.180 1.00 0.00 H +ATOM 1819 HB3 SER 285 -47.664 -16.861 -8.607 1.00 0.00 H +ATOM 1820 OG SER 285 -47.529 -16.922 -10.583 1.00 0.00 O +ATOM 1821 HG SER 285 -48.009 -16.047 -10.618 1.00 0.00 H +ATOM 1822 C SER 285 -44.711 -16.547 -10.158 1.00 0.00 C +ATOM 1823 O SER 285 -44.196 -17.662 -10.224 1.00 0.00 O +ATOM 1824 N CYS 286 -44.415 -15.567 -11.006 1.00 0.00 N +ATOM 1825 H CYS 286 -44.905 -14.674 -10.836 1.00 0.00 H +ATOM 1826 CA CYS 286 -43.460 -15.778 -12.088 1.00 0.00 C +ATOM 1827 HA CYS 286 -43.531 -16.747 -12.387 1.00 0.00 H +ATOM 1828 CB CYS 286 -43.816 -14.888 -13.282 1.00 0.00 C +ATOM 1829 HB2 CYS 286 -43.878 -13.941 -12.951 1.00 0.00 H +ATOM 1830 HB3 CYS 286 -43.062 -14.947 -13.944 1.00 0.00 H +ATOM 1831 SG CYS 286 -45.353 -15.297 -14.132 1.00 0.00 S +ATOM 1832 HG CYS 286 -45.691 -14.491 -14.619 1.00 0.00 H +ATOM 1833 C CYS 286 -42.018 -15.518 -11.677 1.00 0.00 C +ATOM 1834 O CYS 286 -41.087 -15.868 -12.400 1.00 0.00 O +ATOM 1835 N ILE 287 -41.841 -14.909 -10.510 1.00 0.00 N +ATOM 1836 H ILE 287 -42.715 -14.693 -9.994 1.00 0.00 H +ATOM 1837 CA ILE 287 -40.513 -14.583 -10.019 1.00 0.00 C +ATOM 1838 HA ILE 287 -40.056 -14.056 -10.766 1.00 0.00 H +ATOM 1839 CB ILE 287 -40.600 -13.656 -8.774 1.00 0.00 C +ATOM 1840 HB ILE 287 -41.148 -14.114 -8.094 1.00 0.00 H +ATOM 1841 CG2 ILE 287 -39.195 -13.338 -8.249 1.00 0.00 C +ATOM 1842 HG21 ILE 287 -39.270 -12.748 -7.449 1.00 0.00 H +ATOM 1843 HG22 ILE 287 -38.738 -14.188 -7.999 1.00 0.00 H +ATOM 1844 HG23 ILE 287 -38.676 -12.874 -8.962 1.00 0.00 H +ATOM 1845 CG1 ILE 287 -41.317 -12.348 -9.164 1.00 0.00 C +ATOM 1846 HG12 ILE 287 -40.728 -11.846 -9.800 1.00 0.00 H +ATOM 1847 HG13 ILE 287 -42.162 -12.590 -9.647 1.00 0.00 H +ATOM 1848 CD1 ILE 287 -41.672 -11.434 -7.997 1.00 0.00 C +ATOM 1849 HD11 ILE 287 -40.835 -11.174 -7.521 1.00 0.00 H +ATOM 1850 HD12 ILE 287 -42.129 -10.620 -8.348 1.00 0.00 H +ATOM 1851 HD13 ILE 287 -42.279 -11.922 -7.374 1.00 0.00 H +ATOM 1852 C ILE 287 -39.618 -15.775 -9.723 1.00 0.00 C +ATOM 1853 O ILE 287 -38.500 -15.831 -10.211 1.00 0.00 O +ATOM 1854 N GLU 288 -40.099 -16.733 -8.941 1.00 0.00 N +ATOM 1855 H GLU 288 -41.052 -16.591 -8.590 1.00 0.00 H +ATOM 1856 CA GLU 288 -39.275 -17.902 -8.630 1.00 0.00 C +ATOM 1857 HA GLU 288 -38.451 -17.615 -8.134 1.00 0.00 H +ATOM 1858 CB GLU 288 -40.025 -18.823 -7.677 1.00 0.00 C +ATOM 1859 HB2 GLU 288 -40.347 -18.280 -6.921 1.00 0.00 H +ATOM 1860 HB3 GLU 288 -40.765 -19.239 -8.175 1.00 0.00 H +ATOM 1861 CG GLU 288 -39.173 -19.947 -7.101 1.00 0.00 C +ATOM 1862 HG2 GLU 288 -39.013 -20.608 -7.809 1.00 0.00 H +ATOM 1863 HG3 GLU 288 -38.341 -19.560 -6.753 1.00 0.00 H +ATOM 1864 CD GLU 288 -39.856 -20.673 -5.944 1.00 0.00 C +ATOM 1865 OE1 GLU 288 -39.451 -20.469 -4.775 1.00 0.00 O +ATOM 1866 OE2 GLU 288 -40.804 -21.433 -6.218 1.00 0.00 O +ATOM 1867 C GLU 288 -38.859 -18.634 -9.919 1.00 0.00 C +ATOM 1868 O GLU 288 -37.709 -19.041 -10.060 1.00 0.00 O +ATOM 1869 N PRO 289 -39.785 -18.801 -10.879 1.00 0.00 N +ATOM 1870 CD PRO 289 -41.247 -18.648 -10.751 1.00 0.00 C +ATOM 1871 HD2 PRO 289 -41.522 -17.719 -10.984 1.00 0.00 H +ATOM 1872 HD3 PRO 289 -41.541 -18.866 -9.823 1.00 0.00 H +ATOM 1873 CG PRO 289 -41.764 -19.645 -11.745 1.00 0.00 C +ATOM 1874 HG2 PRO 289 -42.678 -19.407 -12.055 1.00 0.00 H +ATOM 1875 HG3 PRO 289 -41.753 -20.566 -11.372 1.00 0.00 H +ATOM 1876 CB PRO 289 -40.780 -19.528 -12.878 1.00 0.00 C +ATOM 1877 HB2 PRO 289 -40.935 -18.694 -13.394 1.00 0.00 H +ATOM 1878 HB3 PRO 289 -40.829 -20.321 -13.472 1.00 0.00 H +ATOM 1879 CA PRO 289 -39.443 -19.476 -12.140 1.00 0.00 C +ATOM 1880 HA PRO 289 -39.121 -20.408 -11.970 1.00 0.00 H +ATOM 1881 C PRO 289 -38.387 -18.666 -12.901 1.00 0.00 C +ATOM 1882 O PRO 289 -37.498 -19.231 -13.534 1.00 0.00 O +ATOM 1883 N LEU 290 -38.485 -17.340 -12.828 1.00 0.00 N +ATOM 1884 H LEU 290 -39.281 -16.987 -12.273 1.00 0.00 H +ATOM 1885 CA LEU 290 -37.515 -16.476 -13.500 1.00 0.00 C +ATOM 1886 HA LEU 290 -37.463 -16.744 -14.466 1.00 0.00 H +ATOM 1887 CB LEU 290 -37.923 -15.009 -13.387 1.00 0.00 C +ATOM 1888 HB2 LEU 290 -38.773 -14.889 -13.868 1.00 0.00 H +ATOM 1889 HB3 LEU 290 -37.998 -14.783 -12.434 1.00 0.00 H +ATOM 1890 CG LEU 290 -36.903 -14.052 -14.009 1.00 0.00 C +ATOM 1891 HG LEU 290 -36.003 -14.241 -13.620 1.00 0.00 H +ATOM 1892 CD1 LEU 290 -36.856 -14.244 -15.514 1.00 0.00 C +ATOM 1893 HD11 LEU 290 -37.759 -14.059 -15.905 1.00 0.00 H +ATOM 1894 HD12 LEU 290 -36.187 -13.615 -15.913 1.00 0.00 H +ATOM 1895 HD13 LEU 290 -36.591 -15.186 -15.725 1.00 0.00 H +ATOM 1896 CD2 LEU 290 -37.269 -12.634 -13.665 1.00 0.00 C +ATOM 1897 HD21 LEU 290 -37.271 -12.512 -12.669 1.00 0.00 H +ATOM 1898 HD22 LEU 290 -36.604 -12.000 -14.070 1.00 0.00 H +ATOM 1899 HD23 LEU 290 -38.182 -12.419 -14.021 1.00 0.00 H +ATOM 1900 C LEU 290 -36.131 -16.644 -12.878 1.00 0.00 C +ATOM 1901 O LEU 290 -35.124 -16.698 -13.586 1.00 0.00 O +ATOM 1902 N ALA 291 -36.087 -16.709 -11.550 1.00 0.00 N +ATOM 1903 H ALA 291 -37.001 -16.638 -11.075 1.00 0.00 H +ATOM 1904 CA ALA 291 -34.817 -16.870 -10.849 1.00 0.00 C +ATOM 1905 HA ALA 291 -34.208 -16.116 -11.104 1.00 0.00 H +ATOM 1906 CB ALA 291 -35.032 -16.836 -9.329 1.00 0.00 C +ATOM 1907 HB1 ALA 291 -35.841 -16.289 -9.125 1.00 0.00 H +ATOM 1908 HB2 ALA 291 -35.161 -17.767 -8.996 1.00 0.00 H +ATOM 1909 HB3 ALA 291 -34.231 -16.430 -8.894 1.00 0.00 H +ATOM 1910 C ALA 291 -34.166 -18.185 -11.261 1.00 0.00 C +ATOM 1911 O ALA 291 -32.949 -18.275 -11.381 1.00 0.00 O +ATOM 1912 N GLU 292 -34.989 -19.204 -11.477 1.00 0.00 N +ATOM 1913 H GLU 292 -35.994 -18.993 -11.330 1.00 0.00 H +ATOM 1914 CA GLU 292 -34.487 -20.500 -11.887 1.00 0.00 C +ATOM 1915 HA GLU 292 -33.766 -20.804 -11.261 1.00 0.00 H +ATOM 1916 CB GLU 292 -35.612 -21.538 -11.847 1.00 0.00 C +ATOM 1917 HB2 GLU 292 -36.072 -21.445 -10.981 1.00 0.00 H +ATOM 1918 HB3 GLU 292 -36.212 -21.357 -12.606 1.00 0.00 H +ATOM 1919 CG GLU 292 -35.134 -22.972 -11.966 1.00 0.00 C +ATOM 1920 HG2 GLU 292 -34.917 -23.149 -12.905 1.00 0.00 H +ATOM 1921 HG3 GLU 292 -34.367 -23.095 -11.369 1.00 0.00 H +ATOM 1922 CD GLU 292 -36.204 -23.960 -11.547 1.00 0.00 C +ATOM 1923 OE1 GLU 292 -36.975 -23.633 -10.618 1.00 0.00 O +ATOM 1924 OE2 GLU 292 -36.262 -25.059 -12.129 1.00 0.00 O +ATOM 1925 C GLU 292 -33.919 -20.405 -13.302 1.00 0.00 C +ATOM 1926 O GLU 292 -32.898 -21.015 -13.600 1.00 0.00 O +ATOM 1927 N SER 293 -34.587 -19.641 -14.168 1.00 0.00 N +ATOM 1928 H SER 293 -35.438 -19.189 -13.786 1.00 0.00 H +ATOM 1929 CA SER 293 -34.133 -19.468 -15.552 1.00 0.00 C +ATOM 1930 HA SER 293 -34.007 -20.383 -15.953 1.00 0.00 H +ATOM 1931 CB SER 293 -35.161 -18.677 -16.365 1.00 0.00 C +ATOM 1932 HB2 SER 293 -35.388 -17.844 -15.872 1.00 0.00 H +ATOM 1933 HB3 SER 293 -34.768 -18.458 -17.252 1.00 0.00 H +ATOM 1934 OG SER 293 -36.342 -19.437 -16.558 1.00 0.00 O +ATOM 1935 HG SER 293 -36.848 -19.490 -15.698 1.00 0.00 H +ATOM 1936 C SER 293 -32.793 -18.743 -15.604 1.00 0.00 C +ATOM 1937 O SER 293 -31.915 -19.092 -16.394 1.00 0.00 O +ATOM 1938 N ILE 294 -32.644 -17.729 -14.760 1.00 0.00 N +ATOM 1939 H ILE 294 -33.460 -17.532 -14.158 1.00 0.00 H +ATOM 1940 CA ILE 294 -31.398 -16.965 -14.712 1.00 0.00 C +ATOM 1941 HA ILE 294 -31.183 -16.718 -15.657 1.00 0.00 H +ATOM 1942 CB ILE 294 -31.517 -15.748 -13.765 1.00 0.00 C +ATOM 1943 HB ILE 294 -31.826 -16.078 -12.882 1.00 0.00 H +ATOM 1944 CG2 ILE 294 -30.166 -15.058 -13.630 1.00 0.00 C +ATOM 1945 HG21 ILE 294 -30.246 -14.291 -12.996 1.00 0.00 H +ATOM 1946 HG22 ILE 294 -29.493 -15.709 -13.283 1.00 0.00 H +ATOM 1947 HG23 ILE 294 -29.873 -14.722 -14.523 1.00 0.00 H +ATOM 1948 CG1 ILE 294 -32.565 -14.763 -14.298 1.00 0.00 C +ATOM 1949 HG12 ILE 294 -32.268 -14.440 -15.194 1.00 0.00 H +ATOM 1950 HG13 ILE 294 -33.429 -15.253 -14.404 1.00 0.00 H +ATOM 1951 CD1 ILE 294 -32.797 -13.561 -13.395 1.00 0.00 C +ATOM 1952 HD11 ILE 294 -31.941 -13.059 -13.292 1.00 0.00 H +ATOM 1953 HD12 ILE 294 -33.488 -12.971 -13.807 1.00 0.00 H +ATOM 1954 HD13 ILE 294 -33.112 -13.878 -12.503 1.00 0.00 H +ATOM 1955 C ILE 294 -30.263 -17.863 -14.226 1.00 0.00 C +ATOM 1956 O ILE 294 -29.157 -17.838 -14.768 1.00 0.00 O +ATOM 1957 N THR 295 -30.545 -18.657 -13.198 1.00 0.00 N +ATOM 1958 H THR 295 -31.511 -18.575 -12.833 1.00 0.00 H +ATOM 1959 CA THR 295 -29.547 -19.564 -12.648 1.00 0.00 C +ATOM 1960 HA THR 295 -28.737 -19.030 -12.387 1.00 0.00 H +ATOM 1961 CB THR 295 -30.079 -20.312 -11.406 1.00 0.00 C +ATOM 1962 HB THR 295 -30.869 -20.891 -11.687 1.00 0.00 H +ATOM 1963 CG2 THR 295 -28.976 -21.162 -10.787 1.00 0.00 C +ATOM 1964 HG21 THR 295 -28.350 -20.578 -10.266 1.00 0.00 H +ATOM 1965 HG22 THR 295 -29.378 -21.844 -10.172 1.00 0.00 H +ATOM 1966 HG23 THR 295 -28.464 -21.631 -11.509 1.00 0.00 H +ATOM 1967 OG1 THR 295 -30.539 -19.361 -10.441 1.00 0.00 O +ATOM 1968 HG1 THR 295 -31.401 -18.941 -10.746 1.00 0.00 H +ATOM 1969 C THR 295 -29.129 -20.588 -13.697 1.00 0.00 C +ATOM 1970 O THR 295 -27.951 -20.909 -13.808 1.00 0.00 O +ATOM 1971 N ASP 296 -30.092 -21.093 -14.469 1.00 0.00 N +ATOM 1972 H ASP 296 -31.041 -20.749 -14.276 1.00 0.00 H +ATOM 1973 CA ASP 296 -29.769 -22.070 -15.510 1.00 0.00 C +ATOM 1974 HA ASP 296 -29.272 -22.822 -15.064 1.00 0.00 H +ATOM 1975 CB ASP 296 -31.028 -22.577 -16.218 1.00 0.00 C +ATOM 1976 HB2 ASP 296 -31.595 -21.788 -16.432 1.00 0.00 H +ATOM 1977 HB3 ASP 296 -30.744 -23.035 -17.054 1.00 0.00 H +ATOM 1978 CG ASP 296 -31.823 -23.540 -15.375 1.00 0.00 C +ATOM 1979 OD1 ASP 296 -31.238 -24.168 -14.466 1.00 0.00 O +ATOM 1980 OD2 ASP 296 -33.035 -23.683 -15.635 1.00 0.00 O +ATOM 1981 C ASP 296 -28.836 -21.464 -16.544 1.00 0.00 C +ATOM 1982 O ASP 296 -27.879 -22.103 -16.968 1.00 0.00 O +ATOM 1983 N VAL 297 -29.112 -20.227 -16.948 1.00 0.00 N +ATOM 1984 H VAL 297 -29.944 -19.797 -16.515 1.00 0.00 H +ATOM 1985 CA VAL 297 -28.271 -19.561 -17.936 1.00 0.00 C +ATOM 1986 HA VAL 297 -28.191 -20.165 -18.739 1.00 0.00 H +ATOM 1987 CB VAL 297 -28.898 -18.220 -18.388 1.00 0.00 C +ATOM 1988 HB VAL 297 -29.063 -17.675 -17.576 1.00 0.00 H +ATOM 1989 CG1 VAL 297 -27.904 -17.436 -19.256 1.00 0.00 C +ATOM 1990 HG11 VAL 297 -28.385 -16.690 -19.711 1.00 0.00 H +ATOM 1991 HG12 VAL 297 -27.181 -17.068 -18.675 1.00 0.00 H +ATOM 1992 HG13 VAL 297 -27.510 -18.049 -19.937 1.00 0.00 H +ATOM 1993 CG2 VAL 297 -30.184 -18.490 -19.161 1.00 0.00 C +ATOM 1994 HG21 VAL 297 -30.804 -19.028 -18.590 1.00 0.00 H +ATOM 1995 HG22 VAL 297 -30.614 -17.620 -19.399 1.00 0.00 H +ATOM 1996 HG23 VAL 297 -29.966 -18.998 -19.994 1.00 0.00 H +ATOM 1997 C VAL 297 -26.868 -19.315 -17.393 1.00 0.00 C +ATOM 1998 O VAL 297 -25.877 -19.574 -18.071 1.00 0.00 O +ATOM 1999 N LEU 298 -26.787 -18.828 -16.159 1.00 0.00 N +ATOM 2000 H LEU 298 -27.691 -18.665 -15.687 1.00 0.00 H +ATOM 2001 CA LEU 298 -25.487 -18.551 -15.537 1.00 0.00 C +ATOM 2002 HA LEU 298 -24.962 -17.940 -16.154 1.00 0.00 H +ATOM 2003 CB LEU 298 -25.674 -17.814 -14.206 1.00 0.00 C +ATOM 2004 HB2 LEU 298 -26.062 -16.920 -14.406 1.00 0.00 H +ATOM 2005 HB3 LEU 298 -26.299 -18.348 -13.649 1.00 0.00 H +ATOM 2006 CG LEU 298 -24.404 -17.591 -13.390 1.00 0.00 C +ATOM 2007 HG LEU 298 -23.978 -18.472 -13.199 1.00 0.00 H +ATOM 2008 CD1 LEU 298 -23.426 -16.719 -14.175 1.00 0.00 C +ATOM 2009 HD11 LEU 298 -23.852 -15.836 -14.370 1.00 0.00 H +ATOM 2010 HD12 LEU 298 -22.598 -16.579 -13.633 1.00 0.00 H +ATOM 2011 HD13 LEU 298 -23.191 -17.174 -15.033 1.00 0.00 H +ATOM 2012 CD2 LEU 298 -24.747 -16.911 -12.069 1.00 0.00 C +ATOM 2013 HD21 LEU 298 -25.375 -17.490 -11.549 1.00 0.00 H +ATOM 2014 HD22 LEU 298 -23.910 -16.769 -11.540 1.00 0.00 H +ATOM 2015 HD23 LEU 298 -25.181 -16.028 -12.251 1.00 0.00 H +ATOM 2016 C LEU 298 -24.646 -19.810 -15.285 1.00 0.00 C +ATOM 2017 O LEU 298 -23.514 -19.923 -15.764 1.00 0.00 O +ATOM 2018 N VAL 299 -25.210 -20.758 -14.545 1.00 0.00 N +ATOM 2019 H VAL 299 -26.179 -20.563 -14.244 1.00 0.00 H +ATOM 2020 CA VAL 299 -24.480 -21.965 -14.208 1.00 0.00 C +ATOM 2021 HA VAL 299 -23.540 -21.688 -13.894 1.00 0.00 H +ATOM 2022 CB VAL 299 -25.121 -22.663 -12.966 1.00 0.00 C +ATOM 2023 HB VAL 299 -26.039 -22.940 -13.228 1.00 0.00 H +ATOM 2024 CG1 VAL 299 -24.354 -23.921 -12.597 1.00 0.00 C +ATOM 2025 HG11 VAL 299 -24.502 -24.133 -11.630 1.00 0.00 H +ATOM 2026 HG12 VAL 299 -24.675 -24.686 -13.157 1.00 0.00 H +ATOM 2027 HG13 VAL 299 -23.377 -23.778 -12.759 1.00 0.00 H +ATOM 2028 CG2 VAL 299 -25.133 -21.702 -11.781 1.00 0.00 C +ATOM 2029 HG21 VAL 299 -25.080 -20.763 -12.119 1.00 0.00 H +ATOM 2030 HG22 VAL 299 -25.979 -21.828 -11.265 1.00 0.00 H +ATOM 2031 HG23 VAL 299 -24.348 -21.895 -11.194 1.00 0.00 H +ATOM 2032 C VAL 299 -24.305 -22.980 -15.332 1.00 0.00 C +ATOM 2033 O VAL 299 -23.236 -23.584 -15.445 1.00 0.00 O +ATOM 2034 N ARG 300 -25.322 -23.160 -16.172 1.00 0.00 N +ATOM 2035 H ARG 300 -26.144 -22.561 -16.006 1.00 0.00 H +ATOM 2036 CA ARG 300 -25.236 -24.151 -17.242 1.00 0.00 C +ATOM 2037 HA ARG 300 -24.816 -25.000 -16.861 1.00 0.00 H +ATOM 2038 CB ARG 300 -26.636 -24.560 -17.707 1.00 0.00 C +ATOM 2039 HB2 ARG 300 -27.022 -23.808 -18.242 1.00 0.00 H +ATOM 2040 HB3 ARG 300 -26.551 -25.370 -18.287 1.00 0.00 H +ATOM 2041 CG ARG 300 -27.633 -24.894 -16.588 1.00 0.00 C +ATOM 2042 HG2 ARG 300 -27.621 -24.150 -15.906 1.00 0.00 H +ATOM 2043 HG3 ARG 300 -28.562 -24.940 -16.981 1.00 0.00 H +ATOM 2044 CD ARG 300 -27.369 -26.208 -15.855 1.00 0.00 C +ATOM 2045 HD2 ARG 300 -27.318 -26.931 -16.523 1.00 0.00 H +ATOM 2046 HD3 ARG 300 -26.528 -26.116 -15.348 1.00 0.00 H +ATOM 2047 NE ARG 300 -28.473 -26.492 -14.916 1.00 0.00 N +ATOM 2048 HE ARG 300 -29.244 -25.837 -14.901 1.00 0.00 H +ATOM 2049 CZ ARG 300 -28.533 -27.537 -14.093 1.00 0.00 C +ATOM 2050 NH1 ARG 300 -27.546 -28.413 -14.078 1.00 0.00 N +ATOM 2051 HH11 ARG 300 -26.740 -28.308 -14.653 1.00 0.00 H +ATOM 2052 HH12 ARG 300 -27.604 -29.218 -13.465 1.00 0.00 H +ATOM 2053 NH2 ARG 300 -29.593 -27.723 -13.305 1.00 0.00 N +ATOM 2054 HH21 ARG 300 -30.337 -27.049 -13.330 1.00 0.00 H +ATOM 2055 HH22 ARG 300 -29.643 -28.511 -12.706 1.00 0.00 H +ATOM 2056 C ARG 300 -24.416 -23.705 -18.443 1.00 0.00 C +ATOM 2057 O ARG 300 -23.952 -24.554 -19.191 1.00 0.00 O +ATOM 2058 N THR 301 -24.238 -22.398 -18.647 1.00 0.00 N +ATOM 2059 H THR 301 -24.694 -21.774 -17.981 1.00 0.00 H +ATOM 2060 CA THR 301 -23.423 -21.951 -19.781 1.00 0.00 C +ATOM 2061 HA THR 301 -23.268 -22.748 -20.395 1.00 0.00 H +ATOM 2062 CB THR 301 -24.154 -20.889 -20.679 1.00 0.00 C +ATOM 2063 HB THR 301 -23.608 -20.770 -21.533 1.00 0.00 H +ATOM 2064 CG2 THR 301 -25.556 -21.360 -21.005 1.00 0.00 C +ATOM 2065 HG21 THR 301 -25.521 -22.100 -21.682 1.00 0.00 H +ATOM 2066 HG22 THR 301 -26.006 -21.699 -20.175 1.00 0.00 H +ATOM 2067 HG23 THR 301 -26.095 -20.601 -21.380 1.00 0.00 H +ATOM 2068 OG1 THR 301 -24.228 -19.629 -20.004 1.00 0.00 O +ATOM 2069 HG1 THR 301 -24.915 -19.664 -19.270 1.00 0.00 H +ATOM 2070 C THR 301 -22.053 -21.387 -19.382 1.00 0.00 C +ATOM 2071 O THR 301 -21.204 -21.174 -20.242 1.00 0.00 O +ATOM 2072 N LYS 302 -21.823 -21.154 -18.093 1.00 0.00 N +ATOM 2073 H LYS 302 -22.586 -21.387 -17.452 1.00 0.00 H +ATOM 2074 CA LYS 302 -20.535 -20.595 -17.674 1.00 0.00 C +ATOM 2075 HA LYS 302 -19.895 -20.627 -18.471 1.00 0.00 H +ATOM 2076 CB LYS 302 -20.686 -19.101 -17.320 1.00 0.00 C +ATOM 2077 HB2 LYS 302 -21.279 -19.036 -16.517 1.00 0.00 H +ATOM 2078 HB3 LYS 302 -19.778 -18.749 -17.091 1.00 0.00 H +ATOM 2079 CG LYS 302 -21.274 -18.240 -18.425 1.00 0.00 C +ATOM 2080 HG2 LYS 302 -22.184 -18.595 -18.668 1.00 0.00 H +ATOM 2081 HG3 LYS 302 -21.379 -17.298 -18.087 1.00 0.00 H +ATOM 2082 CD LYS 302 -20.412 -18.213 -19.681 1.00 0.00 C +ATOM 2083 HD2 LYS 302 -19.526 -17.824 -19.459 1.00 0.00 H +ATOM 2084 HD3 LYS 302 -20.313 -19.137 -20.028 1.00 0.00 H +ATOM 2085 CE LYS 302 -21.052 -17.352 -20.782 1.00 0.00 C +ATOM 2086 HE2 LYS 302 -21.978 -17.698 -20.960 1.00 0.00 H +ATOM 2087 HE3 LYS 302 -21.119 -16.406 -20.450 1.00 0.00 H +ATOM 2088 NZ LYS 302 -20.267 -17.370 -22.056 1.00 0.00 N +ATOM 2089 HZ1 LYS 302 -19.328 -17.089 -21.866 1.00 0.00 H +ATOM 2090 HZ2 LYS 302 -20.274 -18.295 -22.432 1.00 0.00 H +ATOM 2091 HZ3 LYS 302 -20.684 -16.738 -22.707 1.00 0.00 H +ATOM 2092 C LYS 302 -19.875 -21.312 -16.498 1.00 0.00 C +ATOM 2093 O LYS 302 -19.105 -20.698 -15.763 1.00 0.00 O +ATOM 2094 N ARG 303 -20.147 -22.604 -16.328 1.00 0.00 N +ATOM 2095 H ARG 303 -20.771 -23.023 -17.027 1.00 0.00 H +ATOM 2096 CA ARG 303 -19.568 -23.337 -15.200 1.00 0.00 C +ATOM 2097 HA ARG 303 -19.917 -22.926 -14.337 1.00 0.00 H +ATOM 2098 CB ARG 303 -20.039 -24.794 -15.180 1.00 0.00 C +ATOM 2099 HB2 ARG 303 -21.023 -24.809 -15.259 1.00 0.00 H +ATOM 2100 HB3 ARG 303 -19.609 -25.276 -15.927 1.00 0.00 H +ATOM 2101 CG ARG 303 -19.662 -25.522 -13.875 1.00 0.00 C +ATOM 2102 HG2 ARG 303 -18.674 -25.478 -13.754 1.00 0.00 H +ATOM 2103 HG3 ARG 303 -20.121 -25.075 -13.112 1.00 0.00 H +ATOM 2104 CD ARG 303 -20.081 -26.981 -13.901 1.00 0.00 C +ATOM 2105 HD2 ARG 303 -19.638 -27.418 -14.690 1.00 0.00 H +ATOM 2106 HD3 ARG 303 -19.741 -27.417 -13.060 1.00 0.00 H +ATOM 2107 NE ARG 303 -21.528 -27.189 -13.993 1.00 0.00 N +ATOM 2108 HE ARG 303 -21.924 -27.307 -14.916 1.00 0.00 H +ATOM 2109 CZ ARG 303 -22.358 -27.234 -12.956 1.00 0.00 C +ATOM 2110 NH1 ARG 303 -21.903 -27.077 -11.718 1.00 0.00 N +ATOM 2111 HH11 ARG 303 -20.936 -26.903 -11.548 1.00 0.00 H +ATOM 2112 HH12 ARG 303 -22.540 -27.133 -10.943 1.00 0.00 H +ATOM 2113 NH2 ARG 303 -23.646 -27.480 -13.158 1.00 0.00 N +ATOM 2114 HH21 ARG 303 -23.990 -27.611 -14.090 1.00 0.00 H +ATOM 2115 HH22 ARG 303 -24.275 -27.534 -12.383 1.00 0.00 H +ATOM 2116 C ARG 303 -18.046 -23.309 -15.169 1.00 0.00 C +ATOM 2117 O ARG 303 -17.450 -23.016 -14.134 1.00 0.00 O +ATOM 2118 N ASP 304 -17.408 -23.618 -16.294 1.00 0.00 N +ATOM 2119 H ASP 304 -18.010 -23.844 -17.098 1.00 0.00 H +ATOM 2120 CA ASP 304 -15.945 -23.624 -16.343 1.00 0.00 C +ATOM 2121 HA ASP 304 -15.632 -24.350 -15.719 1.00 0.00 H +ATOM 2122 CB ASP 304 -15.438 -23.869 -17.767 1.00 0.00 C +ATOM 2123 HB2 ASP 304 -15.813 -23.158 -18.351 1.00 0.00 H +ATOM 2124 HB3 ASP 304 -14.446 -23.818 -17.752 1.00 0.00 H +ATOM 2125 CG ASP 304 -15.852 -25.219 -18.310 1.00 0.00 C +ATOM 2126 OD1 ASP 304 -15.508 -26.250 -17.690 1.00 0.00 O +ATOM 2127 OD2 ASP 304 -16.522 -25.239 -19.364 1.00 0.00 O +ATOM 2128 C ASP 304 -15.375 -22.313 -15.830 1.00 0.00 C +ATOM 2129 O ASP 304 -14.464 -22.313 -15.010 1.00 0.00 O +ATOM 2130 N TRP 305 -15.908 -21.198 -16.320 1.00 0.00 N +ATOM 2131 H TRP 305 -16.665 -21.343 -17.015 1.00 0.00 H +ATOM 2132 CA TRP 305 -15.447 -19.875 -15.898 1.00 0.00 C +ATOM 2133 HA TRP 305 -14.455 -19.833 -16.050 1.00 0.00 H +ATOM 2134 CB TRP 305 -16.178 -18.769 -16.674 1.00 0.00 C +ATOM 2135 HB2 TRP 305 -16.129 -18.965 -17.644 1.00 0.00 H +ATOM 2136 HB3 TRP 305 -17.119 -18.723 -16.367 1.00 0.00 H +ATOM 2137 CG TRP 305 -15.583 -17.381 -16.476 1.00 0.00 C +ATOM 2138 CD1 TRP 305 -14.605 -16.794 -17.230 1.00 0.00 C +ATOM 2139 HD1 TRP 305 -14.170 -17.210 -18.028 1.00 0.00 H +ATOM 2140 NE1 TRP 305 -14.305 -15.549 -16.734 1.00 0.00 N +ATOM 2141 HE1 TRP 305 -13.624 -14.921 -17.112 1.00 0.00 H +ATOM 2142 CE2 TRP 305 -15.087 -15.304 -15.639 1.00 0.00 C +ATOM 2143 CZ2 TRP 305 -15.143 -14.180 -14.801 1.00 0.00 C +ATOM 2144 HZ2 TRP 305 -14.543 -13.394 -14.973 1.00 0.00 H +ATOM 2145 CH2 TRP 305 -16.036 -14.206 -13.758 1.00 0.00 C +ATOM 2146 HH2 TRP 305 -16.103 -13.426 -13.138 1.00 0.00 H +ATOM 2147 CZ3 TRP 305 -16.871 -15.317 -13.538 1.00 0.00 C +ATOM 2148 HZ3 TRP 305 -17.511 -15.313 -12.780 1.00 0.00 H +ATOM 2149 CE3 TRP 305 -16.817 -16.438 -14.373 1.00 0.00 C +ATOM 2150 HE3 TRP 305 -17.412 -17.214 -14.203 1.00 0.00 H +ATOM 2151 CD2 TRP 305 -15.912 -16.433 -15.442 1.00 0.00 C +ATOM 2152 C TRP 305 -15.692 -19.669 -14.402 1.00 0.00 C +ATOM 2153 O TRP 305 -14.809 -19.222 -13.675 1.00 0.00 O +ATOM 2154 N LEU 306 -16.897 -19.995 -13.943 1.00 0.00 N +ATOM 2155 H LEU 306 -17.551 -20.370 -14.647 1.00 0.00 H +ATOM 2156 CA LEU 306 -17.230 -19.819 -12.533 1.00 0.00 C +ATOM 2157 HA LEU 306 -17.155 -18.836 -12.307 1.00 0.00 H +ATOM 2158 CB LEU 306 -18.679 -20.241 -12.273 1.00 0.00 C +ATOM 2159 HB2 LEU 306 -18.811 -21.132 -12.666 1.00 0.00 H +ATOM 2160 HB3 LEU 306 -18.829 -20.232 -11.303 1.00 0.00 H +ATOM 2161 CG LEU 306 -19.695 -19.297 -12.911 1.00 0.00 C +ATOM 2162 HG LEU 306 -19.384 -19.058 -13.830 1.00 0.00 H +ATOM 2163 CD1 LEU 306 -21.053 -19.967 -12.993 1.00 0.00 C +ATOM 2164 HD11 LEU 306 -21.366 -20.209 -12.073 1.00 0.00 H +ATOM 2165 HD12 LEU 306 -21.713 -19.341 -13.412 1.00 0.00 H +ATOM 2166 HD13 LEU 306 -20.986 -20.797 -13.548 1.00 0.00 H +ATOM 2167 CD2 LEU 306 -19.769 -18.011 -12.098 1.00 0.00 C +ATOM 2168 HD21 LEU 306 -18.869 -17.573 -12.083 1.00 0.00 H +ATOM 2169 HD22 LEU 306 -20.434 -17.391 -12.514 1.00 0.00 H +ATOM 2170 HD23 LEU 306 -20.052 -18.223 -11.162 1.00 0.00 H +ATOM 2171 C LEU 306 -16.291 -20.594 -11.618 1.00 0.00 C +ATOM 2172 O LEU 306 -15.801 -20.061 -10.624 1.00 0.00 O +ATOM 2173 N VAL 307 -16.037 -21.850 -11.955 1.00 0.00 N +ATOM 2174 H VAL 307 -16.500 -22.182 -12.814 1.00 0.00 H +ATOM 2175 CA VAL 307 -15.155 -22.673 -11.136 1.00 0.00 C +ATOM 2176 HA VAL 307 -15.501 -22.661 -10.192 1.00 0.00 H +ATOM 2177 CB VAL 307 -15.143 -24.141 -11.644 1.00 0.00 C +ATOM 2178 HB VAL 307 -14.859 -24.122 -12.597 1.00 0.00 H +ATOM 2179 CG1 VAL 307 -14.119 -24.965 -10.883 1.00 0.00 C +ATOM 2180 HG11 VAL 307 -14.459 -25.899 -10.766 1.00 0.00 H +ATOM 2181 HG12 VAL 307 -13.259 -24.987 -11.394 1.00 0.00 H +ATOM 2182 HG13 VAL 307 -13.960 -24.556 -9.984 1.00 0.00 H +ATOM 2183 CG2 VAL 307 -16.537 -24.742 -11.481 1.00 0.00 C +ATOM 2184 HG21 VAL 307 -16.594 -25.201 -10.595 1.00 0.00 H +ATOM 2185 HG22 VAL 307 -17.216 -24.011 -11.528 1.00 0.00 H +ATOM 2186 HG23 VAL 307 -16.697 -25.401 -12.215 1.00 0.00 H +ATOM 2187 C VAL 307 -13.741 -22.099 -11.125 1.00 0.00 C +ATOM 2188 O VAL 307 -13.110 -21.996 -10.069 1.00 0.00 O +ATOM 2189 N LYS 308 -13.249 -21.704 -12.293 1.00 0.00 N +ATOM 2190 H LYS 308 -13.872 -21.830 -13.103 1.00 0.00 H +ATOM 2191 CA LYS 308 -11.906 -21.133 -12.378 1.00 0.00 C +ATOM 2192 HA LYS 308 -11.246 -21.792 -12.001 1.00 0.00 H +ATOM 2193 CB LYS 308 -11.521 -20.884 -13.844 1.00 0.00 C +ATOM 2194 HB2 LYS 308 -11.676 -21.725 -14.353 1.00 0.00 H +ATOM 2195 HB3 LYS 308 -12.102 -20.157 -14.198 1.00 0.00 H +ATOM 2196 CG LYS 308 -10.063 -20.470 -14.035 1.00 0.00 C +ATOM 2197 HG2 LYS 308 -9.967 -19.500 -13.791 1.00 0.00 H +ATOM 2198 HG3 LYS 308 -9.487 -21.017 -13.421 1.00 0.00 H +ATOM 2199 CD LYS 308 -9.578 -20.665 -15.467 1.00 0.00 C +ATOM 2200 HD2 LYS 308 -9.666 -21.617 -15.710 1.00 0.00 H +ATOM 2201 HD3 LYS 308 -10.102 -20.084 -16.067 1.00 0.00 H +ATOM 2202 CE LYS 308 -8.105 -20.270 -15.570 1.00 0.00 C +ATOM 2203 HE2 LYS 308 -7.729 -20.632 -16.413 1.00 0.00 H +ATOM 2204 HE3 LYS 308 -8.031 -19.281 -15.549 1.00 0.00 H +ATOM 2205 NZ LYS 308 -7.345 -20.845 -14.406 1.00 0.00 N +ATOM 2206 HZ1 LYS 308 -6.403 -21.012 -14.685 1.00 0.00 H +ATOM 2207 HZ2 LYS 308 -7.367 -20.193 -13.652 1.00 0.00 H +ATOM 2208 HZ3 LYS 308 -7.775 -21.701 -14.130 1.00 0.00 H +ATOM 2209 C LYS 308 -11.812 -19.834 -11.569 1.00 0.00 C +ATOM 2210 O LYS 308 -10.761 -19.522 -11.011 1.00 0.00 O +ATOM 2211 N GLN 309 -12.916 -19.093 -11.480 1.00 0.00 N +ATOM 2212 H GLN 309 -13.738 -19.468 -11.979 1.00 0.00 H +ATOM 2213 CA GLN 309 -12.922 -17.846 -10.722 1.00 0.00 C +ATOM 2214 HA GLN 309 -11.984 -17.463 -10.743 1.00 0.00 H +ATOM 2215 CB GLN 309 -13.872 -16.832 -11.364 1.00 0.00 C +ATOM 2216 HB2 GLN 309 -14.777 -17.254 -11.456 1.00 0.00 H +ATOM 2217 HB3 GLN 309 -13.944 -16.033 -10.761 1.00 0.00 H +ATOM 2218 CG GLN 309 -13.433 -16.350 -12.736 1.00 0.00 C +ATOM 2219 HG2 GLN 309 -13.461 -17.122 -13.371 1.00 0.00 H +ATOM 2220 HG3 GLN 309 -14.067 -15.641 -13.045 1.00 0.00 H +ATOM 2221 CD GLN 309 -12.032 -15.779 -12.731 1.00 0.00 C +ATOM 2222 OE1 GLN 309 -11.704 -14.917 -11.908 1.00 0.00 O +ATOM 2223 NE2 GLN 309 -11.196 -16.252 -13.647 1.00 0.00 N +ATOM 2224 HE21 GLN 309 -10.241 -15.906 -13.714 1.00 0.00 H +ATOM 2225 HE22 GLN 309 -11.525 -16.973 -14.288 1.00 0.00 H +ATOM 2226 C GLN 309 -13.304 -18.048 -9.253 1.00 0.00 C +ATOM 2227 O GLN 309 -13.660 -17.099 -8.564 1.00 0.00 O +ATOM 2228 N ARG 310 -13.260 -19.298 -8.798 1.00 0.00 N +ATOM 2229 H ARG 310 -12.992 -20.009 -9.518 1.00 0.00 H +ATOM 2230 CA ARG 310 -13.561 -19.655 -7.407 1.00 0.00 C +ATOM 2231 HA ARG 310 -13.294 -20.640 -7.265 1.00 0.00 H +ATOM 2232 CB ARG 310 -12.605 -18.913 -6.455 1.00 0.00 C +ATOM 2233 HB2 ARG 310 -12.560 -17.965 -6.736 1.00 0.00 H +ATOM 2234 HB3 ARG 310 -12.956 -18.996 -5.534 1.00 0.00 H +ATOM 2235 CG ARG 310 -11.176 -19.478 -6.468 1.00 0.00 C +ATOM 2236 HG2 ARG 310 -11.160 -20.344 -5.969 1.00 0.00 H +ATOM 2237 HG3 ARG 310 -10.892 -19.632 -7.414 1.00 0.00 H +ATOM 2238 CD ARG 310 -10.153 -18.538 -5.816 1.00 0.00 C +ATOM 2239 HD2 ARG 310 -9.293 -19.041 -5.725 1.00 0.00 H +ATOM 2240 HD3 ARG 310 -10.021 -17.760 -6.432 1.00 0.00 H +ATOM 2241 NE ARG 310 -10.570 -18.050 -4.501 1.00 0.00 N +ATOM 2242 HE ARG 310 -10.736 -17.054 -4.406 1.00 0.00 H +ATOM 2243 CZ ARG 310 -10.749 -18.806 -3.424 1.00 0.00 C +ATOM 2244 NH1 ARG 310 -10.551 -20.116 -3.478 1.00 0.00 N +ATOM 2245 HH11 ARG 310 -10.245 -20.553 -4.321 1.00 0.00 H +ATOM 2246 HH12 ARG 310 -10.709 -20.678 -2.659 1.00 0.00 H +ATOM 2247 NH2 ARG 310 -11.135 -18.238 -2.288 1.00 0.00 N +ATOM 2248 HH21 ARG 310 -11.270 -17.247 -2.242 1.00 0.00 H +ATOM 2249 HH22 ARG 310 -11.291 -18.800 -1.475 1.00 0.00 H +ATOM 2250 C ARG 310 -15.009 -19.484 -6.950 1.00 0.00 C +ATOM 2251 O ARG 310 -15.268 -19.281 -5.769 1.00 0.00 O +ATOM 2252 N GLY 311 -15.940 -19.577 -7.895 1.00 0.00 N +ATOM 2253 H GLY 311 -15.578 -19.721 -8.854 1.00 0.00 H +ATOM 2254 CA GLY 311 -17.353 -19.479 -7.568 1.00 0.00 C +ATOM 2255 HA2 GLY 311 -17.898 -19.492 -8.441 1.00 0.00 H +ATOM 2256 HA3 GLY 311 -17.638 -20.331 -7.066 1.00 0.00 H +ATOM 2257 C GLY 311 -17.759 -18.269 -6.753 1.00 0.00 C +ATOM 2258 O GLY 311 -17.192 -17.194 -6.911 1.00 0.00 O +ATOM 2259 N TRP 312 -18.734 -18.445 -5.866 1.00 0.00 N +ATOM 2260 H TRP 312 -19.110 -19.405 -5.810 1.00 0.00 H +ATOM 2261 CA TRP 312 -19.204 -17.337 -5.056 1.00 0.00 C +ATOM 2262 HA TRP 312 -19.419 -16.563 -5.681 1.00 0.00 H +ATOM 2263 CB TRP 312 -20.528 -17.714 -4.385 1.00 0.00 C +ATOM 2264 HB2 TRP 312 -20.415 -18.561 -3.904 1.00 0.00 H +ATOM 2265 HB3 TRP 312 -20.812 -16.981 -3.798 1.00 0.00 H +ATOM 2266 CG TRP 312 -21.611 -17.918 -5.408 1.00 0.00 C +ATOM 2267 CD1 TRP 312 -22.114 -19.110 -5.855 1.00 0.00 C +ATOM 2268 HD1 TRP 312 -21.844 -20.009 -5.517 1.00 0.00 H +ATOM 2269 NE1 TRP 312 -23.050 -18.891 -6.843 1.00 0.00 N +ATOM 2270 HE1 TRP 312 -23.559 -19.598 -7.327 1.00 0.00 H +ATOM 2271 CE2 TRP 312 -23.165 -17.541 -7.050 1.00 0.00 C +ATOM 2272 CZ2 TRP 312 -23.979 -16.829 -7.943 1.00 0.00 C +ATOM 2273 HZ2 TRP 312 -24.602 -17.321 -8.557 1.00 0.00 H +ATOM 2274 CH2 TRP 312 -23.884 -15.462 -7.937 1.00 0.00 C +ATOM 2275 HH2 TRP 312 -24.446 -14.917 -8.558 1.00 0.00 H +ATOM 2276 CZ3 TRP 312 -23.001 -14.790 -7.064 1.00 0.00 C +ATOM 2277 HZ3 TRP 312 -22.953 -13.799 -7.082 1.00 0.00 H +ATOM 2278 CE3 TRP 312 -22.194 -15.496 -6.178 1.00 0.00 C +ATOM 2279 HE3 TRP 312 -21.575 -15.010 -5.568 1.00 0.00 H +ATOM 2280 CD2 TRP 312 -22.273 -16.895 -6.162 1.00 0.00 C +ATOM 2281 C TRP 312 -18.173 -16.830 -4.049 1.00 0.00 C +ATOM 2282 O TRP 312 -18.248 -15.684 -3.600 1.00 0.00 O +ATOM 2283 N ASP 313 -17.200 -17.662 -3.693 1.00 0.00 N +ATOM 2284 H ASP 313 -17.237 -18.598 -4.090 1.00 0.00 H +ATOM 2285 CA ASP 313 -16.167 -17.185 -2.776 1.00 0.00 C +ATOM 2286 HA ASP 313 -16.623 -16.709 -2.041 1.00 0.00 H +ATOM 2287 CB ASP 313 -15.235 -18.307 -2.338 1.00 0.00 C +ATOM 2288 HB2 ASP 313 -14.914 -18.779 -3.151 1.00 0.00 H +ATOM 2289 HB3 ASP 313 -14.473 -17.903 -1.846 1.00 0.00 H +ATOM 2290 CG ASP 313 -15.921 -19.311 -1.433 1.00 0.00 C +ATOM 2291 OD1 ASP 313 -16.655 -18.880 -0.517 1.00 0.00 O +ATOM 2292 OD2 ASP 313 -15.721 -20.525 -1.634 1.00 0.00 O +ATOM 2293 C ASP 313 -15.376 -16.151 -3.561 1.00 0.00 C +ATOM 2294 O ASP 313 -14.967 -15.123 -3.014 1.00 0.00 O +ATOM 2295 N GLY 314 -15.181 -16.427 -4.850 1.00 0.00 N +ATOM 2296 H GLY 314 -15.578 -17.322 -5.173 1.00 0.00 H +ATOM 2297 CA GLY 314 -14.453 -15.501 -5.703 1.00 0.00 C +ATOM 2298 HA2 GLY 314 -13.563 -15.285 -5.285 1.00 0.00 H +ATOM 2299 HA3 GLY 314 -14.285 -15.929 -6.599 1.00 0.00 H +ATOM 2300 C GLY 314 -15.239 -14.212 -5.902 1.00 0.00 C +ATOM 2301 O GLY 314 -14.670 -13.125 -5.933 1.00 0.00 O +ATOM 2302 N PHE 315 -16.550 -14.349 -6.055 1.00 0.00 N +ATOM 2303 H PHE 315 -16.884 -15.342 -6.033 1.00 0.00 H +ATOM 2304 CA PHE 315 -17.450 -13.216 -6.238 1.00 0.00 C +ATOM 2305 HA PHE 315 -17.134 -12.716 -7.046 1.00 0.00 H +ATOM 2306 CB PHE 315 -18.892 -13.727 -6.340 1.00 0.00 C +ATOM 2307 HB2 PHE 315 -18.956 -14.288 -7.155 1.00 0.00 H +ATOM 2308 HB3 PHE 315 -19.080 -14.264 -5.527 1.00 0.00 H +ATOM 2309 CG PHE 315 -19.936 -12.648 -6.435 1.00 0.00 C +ATOM 2310 CD1 PHE 315 -20.142 -11.951 -7.624 1.00 0.00 C +ATOM 2311 HD1 PHE 315 -19.563 -12.131 -8.412 1.00 0.00 H +ATOM 2312 CE1 PHE 315 -21.157 -10.998 -7.728 1.00 0.00 C +ATOM 2313 HE1 PHE 315 -21.297 -10.515 -8.595 1.00 0.00 H +ATOM 2314 CZ PHE 315 -21.963 -10.728 -6.626 1.00 0.00 C +ATOM 2315 HZ PHE 315 -22.686 -10.044 -6.694 1.00 0.00 H +ATOM 2316 CE2 PHE 315 -21.756 -11.415 -5.433 1.00 0.00 C +ATOM 2317 HE2 PHE 315 -22.341 -11.225 -4.628 1.00 0.00 H +ATOM 2318 CD2 PHE 315 -20.746 -12.361 -5.342 1.00 0.00 C +ATOM 2319 HD2 PHE 315 -20.598 -12.845 -4.478 1.00 0.00 H +ATOM 2320 C PHE 315 -17.323 -12.260 -5.052 1.00 0.00 C +ATOM 2321 O PHE 315 -17.168 -11.053 -5.223 1.00 0.00 O +ATOM 2322 N VAL 316 -17.398 -12.819 -3.850 1.00 0.00 N +ATOM 2323 H VAL 316 -17.527 -13.853 -3.859 1.00 0.00 H +ATOM 2324 CA VAL 316 -17.305 -12.036 -2.627 1.00 0.00 C +ATOM 2325 HA VAL 316 -18.019 -11.319 -2.655 1.00 0.00 H +ATOM 2326 CB VAL 316 -17.572 -12.943 -1.391 1.00 0.00 C +ATOM 2327 HB VAL 316 -16.970 -13.732 -1.470 1.00 0.00 H +ATOM 2328 CG1 VAL 316 -17.214 -12.225 -0.108 1.00 0.00 C +ATOM 2329 HG11 VAL 316 -16.431 -12.675 0.324 1.00 0.00 H +ATOM 2330 HG12 VAL 316 -16.978 -11.273 -0.308 1.00 0.00 H +ATOM 2331 HG13 VAL 316 -17.993 -12.246 0.520 1.00 0.00 H +ATOM 2332 CG2 VAL 316 -19.034 -13.352 -1.366 1.00 0.00 C +ATOM 2333 HG21 VAL 316 -19.224 -13.853 -0.521 1.00 0.00 H +ATOM 2334 HG22 VAL 316 -19.608 -12.534 -1.407 1.00 0.00 H +ATOM 2335 HG23 VAL 316 -19.228 -13.938 -2.153 1.00 0.00 H +ATOM 2336 C VAL 316 -15.951 -11.338 -2.486 1.00 0.00 C +ATOM 2337 O VAL 316 -15.879 -10.180 -2.059 1.00 0.00 O +ATOM 2338 N GLU 317 -14.883 -12.042 -2.854 1.00 0.00 N +ATOM 2339 H GLU 317 -15.092 -13.000 -3.199 1.00 0.00 H +ATOM 2340 CA GLU 317 -13.536 -11.493 -2.772 1.00 0.00 C +ATOM 2341 HA GLU 317 -13.370 -11.138 -1.844 1.00 0.00 H +ATOM 2342 CB GLU 317 -12.481 -12.571 -3.051 1.00 0.00 C +ATOM 2343 HB2 GLU 317 -12.613 -12.880 -3.983 1.00 0.00 H +ATOM 2344 HB3 GLU 317 -11.592 -12.152 -2.938 1.00 0.00 H +ATOM 2345 CG GLU 317 -12.538 -13.785 -2.149 1.00 0.00 C +ATOM 2346 HG2 GLU 317 -12.380 -13.497 -1.226 1.00 0.00 H +ATOM 2347 HG3 GLU 317 -13.405 -14.225 -2.268 1.00 0.00 H +ATOM 2348 CD GLU 317 -11.460 -14.806 -2.497 1.00 0.00 C +ATOM 2349 OE1 GLU 317 -11.286 -15.099 -3.704 1.00 0.00 O +ATOM 2350 OE2 GLU 317 -10.791 -15.314 -1.570 1.00 0.00 O +ATOM 2351 C GLU 317 -13.347 -10.373 -3.785 1.00 0.00 C +ATOM 2352 O GLU 317 -12.708 -9.370 -3.488 1.00 0.00 O +ATOM 2353 N PHE 318 -13.903 -10.554 -4.982 1.00 0.00 N +ATOM 2354 H PHE 318 -14.429 -11.445 -5.085 1.00 0.00 H +ATOM 2355 CA PHE 318 -13.772 -9.570 -6.046 1.00 0.00 C +ATOM 2356 HA PHE 318 -12.782 -9.417 -6.185 1.00 0.00 H +ATOM 2357 CB PHE 318 -14.452 -10.090 -7.317 1.00 0.00 C +ATOM 2358 HB2 PHE 318 -14.103 -10.997 -7.496 1.00 0.00 H +ATOM 2359 HB3 PHE 318 -15.427 -10.104 -7.153 1.00 0.00 H +ATOM 2360 CG PHE 318 -14.196 -9.244 -8.532 1.00 0.00 C +ATOM 2361 CD1 PHE 318 -12.948 -9.247 -9.151 1.00 0.00 C +ATOM 2362 HD1 PHE 318 -12.214 -9.809 -8.785 1.00 0.00 H +ATOM 2363 CE1 PHE 318 -12.711 -8.470 -10.285 1.00 0.00 C +ATOM 2364 HE1 PHE 318 -11.806 -8.485 -10.717 1.00 0.00 H +ATOM 2365 CZ PHE 318 -13.733 -7.679 -10.806 1.00 0.00 C +ATOM 2366 HZ PHE 318 -13.569 -7.123 -11.616 1.00 0.00 H +ATOM 2367 CE2 PHE 318 -14.986 -7.671 -10.188 1.00 0.00 C +ATOM 2368 HE2 PHE 318 -15.731 -7.098 -10.559 1.00 0.00 H +ATOM 2369 CD2 PHE 318 -15.206 -8.450 -9.061 1.00 0.00 C +ATOM 2370 HD2 PHE 318 -16.107 -8.441 -8.622 1.00 0.00 H +ATOM 2371 C PHE 318 -14.374 -8.229 -5.662 1.00 0.00 C +ATOM 2372 O PHE 318 -13.821 -7.177 -5.980 1.00 0.00 O +ATOM 2373 N PHE 319 -15.495 -8.275 -4.950 1.00 0.00 N +ATOM 2374 H PHE 319 -15.820 -9.231 -4.708 1.00 0.00 H +ATOM 2375 CA PHE 319 -16.196 -7.061 -4.551 1.00 0.00 C +ATOM 2376 HA PHE 319 -15.856 -6.310 -5.159 1.00 0.00 H +ATOM 2377 CB PHE 319 -17.685 -7.247 -4.792 1.00 0.00 C +ATOM 2378 HB2 PHE 319 -17.942 -8.144 -4.459 1.00 0.00 H +ATOM 2379 HB3 PHE 319 -18.168 -6.534 -4.303 1.00 0.00 H +ATOM 2380 CG PHE 319 -18.090 -7.163 -6.243 1.00 0.00 C +ATOM 2381 CD1 PHE 319 -18.040 -5.950 -6.913 1.00 0.00 C +ATOM 2382 HD1 PHE 319 -17.728 -5.131 -6.441 1.00 0.00 H +ATOM 2383 CE1 PHE 319 -18.422 -5.856 -8.254 1.00 0.00 C +ATOM 2384 HE1 PHE 319 -18.436 -4.956 -8.701 1.00 0.00 H +ATOM 2385 CZ PHE 319 -18.780 -7.001 -8.956 1.00 0.00 C +ATOM 2386 HZ PHE 319 -19.001 -6.942 -9.925 1.00 0.00 H +ATOM 2387 CE2 PHE 319 -18.824 -8.218 -8.294 1.00 0.00 C +ATOM 2388 HE2 PHE 319 -19.135 -9.053 -8.780 1.00 0.00 H +ATOM 2389 CD2 PHE 319 -18.445 -8.302 -6.964 1.00 0.00 C +ATOM 2390 HD2 PHE 319 -18.424 -9.195 -6.510 1.00 0.00 H +ATOM 2391 C PHE 319 -15.959 -6.591 -3.113 1.00 0.00 C +ATOM 2392 O PHE 319 -16.508 -5.563 -2.702 1.00 0.00 O +ATOM 2393 N HIE 320 -15.142 -7.327 -2.360 1.00 0.00 N +ATOM 2394 H HIE 320 -14.746 -8.163 -2.844 1.00 0.00 H +ATOM 2395 CA HIE 320 -14.827 -6.989 -0.970 1.00 0.00 C +ATOM 2396 HA HIE 320 -15.658 -7.155 -0.409 1.00 0.00 H +ATOM 2397 CB HIE 320 -13.721 -7.908 -0.459 1.00 0.00 C +ATOM 2398 HB2 HIE 320 -14.045 -8.860 -0.483 1.00 0.00 H +ATOM 2399 HB3 HIE 320 -12.921 -7.827 -1.063 1.00 0.00 H +ATOM 2400 CG HIE 320 -13.281 -7.599 0.943 1.00 0.00 C +ATOM 2401 ND1 HIE 320 -12.082 -7.001 1.233 1.00 0.00 N +ATOM 2402 CE1 HIE 320 -11.992 -6.810 2.544 1.00 0.00 C +ATOM 2403 HE1 HIE 320 -11.224 -6.395 3.018 1.00 0.00 H +ATOM 2404 NE2 HIE 320 -13.094 -7.268 3.099 1.00 0.00 N +ATOM 2405 HE2 HIE 320 -13.305 -7.253 4.087 1.00 0.00 H +ATOM 2406 CD2 HIE 320 -13.922 -7.773 2.122 1.00 0.00 C +ATOM 2407 HD2 HIE 320 -14.814 -8.185 2.260 1.00 0.00 H +ATOM 2408 C HIE 320 -14.408 -5.537 -0.782 1.00 0.00 C +ATOM 2409 O HIE 320 -13.615 -5.004 -1.559 1.00 0.00 O +ATOM 2410 N VAL 321 -14.952 -4.910 0.258 1.00 0.00 N +ATOM 2411 H VAL 321 -15.604 -5.489 0.824 1.00 0.00 H +ATOM 2412 CA VAL 321 -14.645 -3.513 0.566 1.00 0.00 C +ATOM 2413 HA VAL 321 -14.327 -3.069 -0.278 1.00 0.00 H +ATOM 2414 CB VAL 321 -15.896 -2.762 1.098 1.00 0.00 C +ATOM 2415 HB VAL 321 -15.663 -1.800 1.156 1.00 0.00 H +ATOM 2416 CG1 VAL 321 -17.041 -2.889 0.101 1.00 0.00 C +ATOM 2417 HG11 VAL 321 -16.676 -2.876 -0.829 1.00 0.00 H +ATOM 2418 HG12 VAL 321 -17.525 -3.750 0.257 1.00 0.00 H +ATOM 2419 HG13 VAL 321 -17.674 -2.125 0.221 1.00 0.00 H +ATOM 2420 CG2 VAL 321 -16.310 -3.320 2.445 1.00 0.00 C +ATOM 2421 HG21 VAL 321 -16.918 -4.103 2.309 1.00 0.00 H +ATOM 2422 HG22 VAL 321 -15.496 -3.613 2.949 1.00 0.00 H +ATOM 2423 HG23 VAL 321 -16.789 -2.612 2.966 1.00 0.00 H +ATOM 2424 C VAL 321 -13.520 -3.423 1.597 1.00 0.00 C +ATOM 2425 O VAL 321 -12.468 -2.832 1.254 1.00 0.00 O +ATOM 2426 OXT VAL 321 -13.431 -3.824 2.731 1.00 0.00 O +END diff --git a/receptor/pdb_files/6o6f_K234R_H.pdb b/receptor/pdb_files/6o6f_K234R_H.pdb new file mode 100644 index 0000000..367d940 --- /dev/null +++ b/receptor/pdb_files/6o6f_K234R_H.pdb @@ -0,0 +1,2431 @@ +HELIX 1 1 GLU 173 THR 191 1 19 +HELIX 2 2 GLY 203 ASN 223 1 21 +HELIX 3 3 GLU 225 LEU 235 1 11 +HELIX 4 4 GLU 240 SER 255 1 16 +HELIX 5 5 TRP 261 THR 280 1 20 +HELIX 6 6 GLU 284 THR 301 1 18 +HELIX 7 7 ARG 303 LYS 308 1 6 +HELIX 8 8 GLY 311 PHE 319 1 9 +ATOM 1 N SER 171 -23.840 -34.508 -6.167 1.00 0.00 N +ATOM 2 H1 SER 171 -24.073 -34.914 -5.272 1.00 0.00 H +ATOM 3 H2 SER 171 -23.979 -34.837 -5.236 1.00 0.00 H +ATOM 4 H3 SER 171 -23.978 -35.254 -6.813 1.00 0.00 H +ATOM 5 CA SER 171 -24.823 -33.425 -6.454 1.00 0.00 C +ATOM 6 HA SER 171 -25.412 -33.750 -7.212 1.00 0.00 H +ATOM 7 CB SER 171 -25.708 -33.194 -5.243 1.00 0.00 C +ATOM 8 HB2 SER 171 -26.374 -32.476 -5.458 1.00 0.00 H +ATOM 9 HB3 SER 171 -26.200 -34.043 -5.033 1.00 0.00 H +ATOM 10 OG SER 171 -24.971 -32.802 -4.100 1.00 0.00 O +ATOM 11 HG SER 171 -24.797 -31.818 -4.136 1.00 0.00 H +ATOM 12 C SER 171 -24.177 -32.110 -6.883 1.00 0.00 C +ATOM 13 O SER 171 -22.964 -31.912 -6.751 1.00 0.00 O +ATOM 14 N ASP 172 -25.017 -31.207 -7.377 1.00 0.00 N +ATOM 15 H ASP 172 -26.019 -31.507 -7.379 1.00 0.00 H +ATOM 16 CA ASP 172 -24.576 -29.909 -7.873 1.00 0.00 C +ATOM 17 HA ASP 172 -23.602 -30.008 -8.149 1.00 0.00 H +ATOM 18 CB ASP 172 -25.432 -29.532 -9.076 1.00 0.00 C +ATOM 19 HB2 ASP 172 -25.664 -30.370 -9.561 1.00 0.00 H +ATOM 20 HB3 ASP 172 -26.258 -29.091 -8.739 1.00 0.00 H +ATOM 21 CG ASP 172 -24.727 -28.599 -10.018 1.00 0.00 C +ATOM 22 OD1 ASP 172 -23.703 -27.997 -9.623 1.00 0.00 O +ATOM 23 OD2 ASP 172 -25.214 -28.470 -11.157 1.00 0.00 O +ATOM 24 C ASP 172 -24.625 -28.796 -6.824 1.00 0.00 C +ATOM 25 O ASP 172 -25.612 -28.057 -6.729 1.00 0.00 O +ATOM 26 N GLU 173 -23.548 -28.683 -6.049 1.00 0.00 N +ATOM 27 H GLU 173 -22.790 -29.365 -6.257 1.00 0.00 H +ATOM 28 CA GLU 173 -23.453 -27.676 -4.995 1.00 0.00 C +ATOM 29 HA GLU 173 -24.232 -27.772 -4.359 1.00 0.00 H +ATOM 30 CB GLU 173 -22.200 -27.947 -4.155 1.00 0.00 C +ATOM 31 HB2 GLU 173 -22.347 -28.794 -3.669 1.00 0.00 H +ATOM 32 HB3 GLU 173 -21.435 -28.012 -4.775 1.00 0.00 H +ATOM 33 CG GLU 173 -21.879 -26.877 -3.134 1.00 0.00 C +ATOM 34 HG2 GLU 173 -21.026 -27.114 -2.693 1.00 0.00 H +ATOM 35 HG3 GLU 173 -21.810 -26.008 -3.602 1.00 0.00 H +ATOM 36 CD GLU 173 -22.924 -26.721 -2.045 1.00 0.00 C +ATOM 37 OE1 GLU 173 -23.943 -27.446 -2.041 1.00 0.00 O +ATOM 38 OE2 GLU 173 -22.734 -25.830 -1.194 1.00 0.00 O +ATOM 39 C GLU 173 -23.443 -26.240 -5.559 1.00 0.00 C +ATOM 40 O GLU 173 -24.129 -25.350 -5.049 1.00 0.00 O +ATOM 41 N LEU 174 -22.675 -26.019 -6.620 1.00 0.00 N +ATOM 42 H LEU 174 -22.143 -26.835 -6.959 1.00 0.00 H +ATOM 43 CA LEU 174 -22.619 -24.699 -7.230 1.00 0.00 C +ATOM 44 HA LEU 174 -22.328 -24.032 -6.531 1.00 0.00 H +ATOM 45 CB LEU 174 -21.586 -24.661 -8.357 1.00 0.00 C +ATOM 46 HB2 LEU 174 -20.686 -24.796 -7.952 1.00 0.00 H +ATOM 47 HB3 LEU 174 -21.794 -25.401 -8.988 1.00 0.00 H +ATOM 48 CG LEU 174 -21.530 -23.367 -9.171 1.00 0.00 C +ATOM 49 HG LEU 174 -22.441 -23.160 -9.522 1.00 0.00 H +ATOM 50 CD1 LEU 174 -21.054 -22.201 -8.293 1.00 0.00 C +ATOM 51 HD11 LEU 174 -20.143 -22.406 -7.942 1.00 0.00 H +ATOM 52 HD12 LEU 174 -21.025 -21.368 -8.842 1.00 0.00 H +ATOM 53 HD13 LEU 174 -21.690 -22.082 -7.533 1.00 0.00 H +ATOM 54 CD2 LEU 174 -20.605 -23.568 -10.350 1.00 0.00 C +ATOM 55 HD21 LEU 174 -20.947 -24.313 -10.927 1.00 0.00 H +ATOM 56 HD22 LEU 174 -20.559 -22.727 -10.893 1.00 0.00 H +ATOM 57 HD23 LEU 174 -19.686 -23.800 -10.025 1.00 0.00 H +ATOM 58 C LEU 174 -23.982 -24.270 -7.762 1.00 0.00 C +ATOM 59 O LEU 174 -24.374 -23.103 -7.633 1.00 0.00 O +ATOM 60 N TYR 175 -24.715 -25.192 -8.372 1.00 0.00 N +ATOM 61 H TYR 175 -24.296 -26.118 -8.460 1.00 0.00 H +ATOM 62 CA TYR 175 -26.039 -24.830 -8.864 1.00 0.00 C +ATOM 63 HA TYR 175 -25.951 -24.004 -9.436 1.00 0.00 H +ATOM 64 CB TYR 175 -26.649 -25.942 -9.716 1.00 0.00 C +ATOM 65 HB2 TYR 175 -26.023 -26.152 -10.448 1.00 0.00 H +ATOM 66 HB3 TYR 175 -26.811 -26.724 -9.137 1.00 0.00 H +ATOM 67 CG TYR 175 -27.958 -25.506 -10.312 1.00 0.00 C +ATOM 68 CD1 TYR 175 -27.995 -24.770 -11.495 1.00 0.00 C +ATOM 69 HD1 TYR 175 -27.147 -24.606 -12.002 1.00 0.00 H +ATOM 70 CE1 TYR 175 -29.191 -24.255 -11.988 1.00 0.00 C +ATOM 71 HE1 TYR 175 -29.198 -23.731 -12.840 1.00 0.00 H +ATOM 72 CZ TYR 175 -30.369 -24.474 -11.292 1.00 0.00 C +ATOM 73 OH TYR 175 -31.551 -23.926 -11.754 1.00 0.00 O +ATOM 74 HH TYR 175 -31.551 -23.947 -12.751 1.00 0.00 H +ATOM 75 CE2 TYR 175 -30.358 -25.213 -10.119 1.00 0.00 C +ATOM 76 HE2 TYR 175 -31.208 -25.379 -9.621 1.00 0.00 H +ATOM 77 CD2 TYR 175 -29.155 -25.724 -9.637 1.00 0.00 C +ATOM 78 HD2 TYR 175 -29.154 -26.257 -8.793 1.00 0.00 H +ATOM 79 C TYR 175 -26.995 -24.507 -7.714 1.00 0.00 C +ATOM 80 O TYR 175 -27.704 -23.510 -7.775 1.00 0.00 O +ATOM 81 N ARG 176 -27.007 -25.346 -6.679 1.00 0.00 N +ATOM 82 H ARG 176 -26.357 -26.148 -6.760 1.00 0.00 H +ATOM 83 CA ARG 176 -27.880 -25.122 -5.538 1.00 0.00 C +ATOM 84 HA ARG 176 -28.838 -25.126 -5.855 1.00 0.00 H +ATOM 85 CB ARG 176 -27.703 -26.232 -4.499 1.00 0.00 C +ATOM 86 HB2 ARG 176 -27.919 -27.104 -4.934 1.00 0.00 H +ATOM 87 HB3 ARG 176 -26.751 -26.231 -4.201 1.00 0.00 H +ATOM 88 CG ARG 176 -28.582 -26.093 -3.263 1.00 0.00 C +ATOM 89 HG2 ARG 176 -28.651 -25.127 -3.013 1.00 0.00 H +ATOM 90 HG3 ARG 176 -29.494 -26.450 -3.465 1.00 0.00 H +ATOM 91 CD ARG 176 -28.029 -26.853 -2.073 1.00 0.00 C +ATOM 92 HD2 ARG 176 -28.698 -26.811 -1.338 1.00 0.00 H +ATOM 93 HD3 ARG 176 -27.879 -27.797 -2.350 1.00 0.00 H +ATOM 94 NE ARG 176 -26.768 -26.279 -1.611 1.00 0.00 N +ATOM 95 HE ARG 176 -25.931 -26.828 -1.727 1.00 0.00 H +ATOM 96 CZ ARG 176 -26.649 -25.079 -1.047 1.00 0.00 C +ATOM 97 NH1 ARG 176 -25.462 -24.636 -0.662 1.00 0.00 N +ATOM 98 HH11 ARG 176 -24.638 -25.179 -0.804 1.00 0.00 H +ATOM 99 HH12 ARG 176 -25.387 -23.734 -0.219 1.00 0.00 H +ATOM 100 NH2 ARG 176 -27.717 -24.321 -0.856 1.00 0.00 N +ATOM 101 HH21 ARG 176 -28.617 -24.651 -1.158 1.00 0.00 H +ATOM 102 HH22 ARG 176 -27.634 -23.430 -0.418 1.00 0.00 H +ATOM 103 C ARG 176 -27.593 -23.783 -4.878 1.00 0.00 C +ATOM 104 O ARG 176 -28.505 -23.016 -4.554 1.00 0.00 O +ATOM 105 N GLN 177 -26.313 -23.517 -4.660 1.00 0.00 N +ATOM 106 H GLN 177 -25.654 -24.258 -4.972 1.00 0.00 H +ATOM 107 CA GLN 177 -25.894 -22.281 -4.034 1.00 0.00 C +ATOM 108 HA GLN 177 -26.375 -22.196 -3.149 1.00 0.00 H +ATOM 109 CB GLN 177 -24.390 -22.315 -3.808 1.00 0.00 C +ATOM 110 HB2 GLN 177 -24.174 -23.066 -3.180 1.00 0.00 H +ATOM 111 HB3 GLN 177 -23.935 -22.483 -4.686 1.00 0.00 H +ATOM 112 CG GLN 177 -23.831 -21.036 -3.224 1.00 0.00 C +ATOM 113 HG2 GLN 177 -23.923 -20.309 -3.898 1.00 0.00 H +ATOM 114 HG3 GLN 177 -24.344 -20.808 -2.401 1.00 0.00 H +ATOM 115 CD GLN 177 -22.379 -21.189 -2.867 1.00 0.00 C +ATOM 116 OE1 GLN 177 -21.604 -21.751 -3.639 1.00 0.00 O +ATOM 117 NE2 GLN 177 -21.996 -20.691 -1.694 1.00 0.00 N +ATOM 118 HE21 GLN 177 -21.032 -20.769 -1.378 1.00 0.00 H +ATOM 119 HE22 GLN 177 -22.690 -20.224 -1.110 1.00 0.00 H +ATOM 120 C GLN 177 -26.268 -21.070 -4.879 1.00 0.00 C +ATOM 121 O GLN 177 -26.763 -20.074 -4.355 1.00 0.00 O +ATOM 122 N SER 178 -26.034 -21.158 -6.184 1.00 0.00 N +ATOM 123 H SER 178 -25.612 -22.049 -6.496 1.00 0.00 H +ATOM 124 CA SER 178 -26.362 -20.057 -7.081 1.00 0.00 C +ATOM 125 HA SER 178 -25.897 -19.228 -6.744 1.00 0.00 H +ATOM 126 CB SER 178 -25.888 -20.374 -8.504 1.00 0.00 C +ATOM 127 HB2 SER 178 -26.337 -21.208 -8.813 1.00 0.00 H +ATOM 128 HB3 SER 178 -26.132 -19.613 -9.099 1.00 0.00 H +ATOM 129 OG SER 178 -24.482 -20.562 -8.549 1.00 0.00 O +ATOM 130 HG SER 178 -24.258 -21.476 -8.214 1.00 0.00 H +ATOM 131 C SER 178 -27.863 -19.774 -7.098 1.00 0.00 C +ATOM 132 O SER 178 -28.285 -18.616 -7.152 1.00 0.00 O +ATOM 133 N LEU 179 -28.669 -20.829 -7.054 1.00 0.00 N +ATOM 134 H LEU 179 -28.201 -21.744 -7.001 1.00 0.00 H +ATOM 135 CA LEU 179 -30.117 -20.652 -7.082 1.00 0.00 C +ATOM 136 HA LEU 179 -30.355 -20.079 -7.882 1.00 0.00 H +ATOM 137 CB LEU 179 -30.823 -21.998 -7.275 1.00 0.00 C +ATOM 138 HB2 LEU 179 -30.510 -22.388 -8.129 1.00 0.00 H +ATOM 139 HB3 LEU 179 -30.592 -22.578 -6.509 1.00 0.00 H +ATOM 140 CG LEU 179 -32.355 -21.915 -7.344 1.00 0.00 C +ATOM 141 HG LEU 179 -32.701 -21.589 -6.466 1.00 0.00 H +ATOM 142 CD1 LEU 179 -32.793 -20.955 -8.449 1.00 0.00 C +ATOM 143 HD11 LEU 179 -32.446 -21.281 -9.328 1.00 0.00 H +ATOM 144 HD12 LEU 179 -33.791 -20.915 -8.477 1.00 0.00 H +ATOM 145 HD13 LEU 179 -32.427 -20.044 -8.261 1.00 0.00 H +ATOM 146 CD2 LEU 179 -32.923 -23.296 -7.579 1.00 0.00 C +ATOM 147 HD21 LEU 179 -32.657 -23.905 -6.828 1.00 0.00 H +ATOM 148 HD22 LEU 179 -33.923 -23.249 -7.625 1.00 0.00 H +ATOM 149 HD23 LEU 179 -32.572 -23.666 -8.442 1.00 0.00 H +ATOM 150 C LEU 179 -30.643 -19.964 -5.827 1.00 0.00 C +ATOM 151 O LEU 179 -31.515 -19.100 -5.916 1.00 0.00 O +ATOM 152 N GLU 180 -30.114 -20.332 -4.664 1.00 0.00 N +ATOM 153 H GLU 180 -29.384 -21.055 -4.720 1.00 0.00 H +ATOM 154 CA GLU 180 -30.573 -19.723 -3.431 1.00 0.00 C +ATOM 155 HA GLU 180 -31.571 -19.818 -3.350 1.00 0.00 H +ATOM 156 CB GLU 180 -29.980 -20.469 -2.231 1.00 0.00 C +ATOM 157 HB2 GLU 180 -30.326 -21.392 -2.254 1.00 0.00 H +ATOM 158 HB3 GLU 180 -28.999 -20.442 -2.318 1.00 0.00 H +ATOM 159 CG GLU 180 -30.342 -19.873 -0.882 1.00 0.00 C +ATOM 160 HG2 GLU 180 -29.648 -19.218 -0.637 1.00 0.00 H +ATOM 161 HG3 GLU 180 -31.231 -19.455 -0.955 1.00 0.00 H +ATOM 162 CD GLU 180 -30.412 -20.902 0.231 1.00 0.00 C +ATOM 163 OE1 GLU 180 -29.479 -21.732 0.342 1.00 0.00 O +ATOM 164 OE2 GLU 180 -31.405 -20.868 1.003 1.00 0.00 O +ATOM 165 C GLU 180 -30.206 -18.237 -3.394 1.00 0.00 C +ATOM 166 O GLU 180 -31.022 -17.410 -3.014 1.00 0.00 O +ATOM 167 N ILE 181 -28.991 -17.898 -3.817 1.00 0.00 N +ATOM 168 H ILE 181 -28.400 -18.686 -4.133 1.00 0.00 H +ATOM 169 CA ILE 181 -28.557 -16.506 -3.821 1.00 0.00 C +ATOM 170 HA ILE 181 -28.724 -16.153 -2.890 1.00 0.00 H +ATOM 171 CB ILE 181 -27.079 -16.406 -4.239 1.00 0.00 C +ATOM 172 HB ILE 181 -26.977 -16.860 -5.115 1.00 0.00 H +ATOM 173 CG2 ILE 181 -26.670 -14.946 -4.374 1.00 0.00 C +ATOM 174 HG21 ILE 181 -25.720 -14.892 -4.676 1.00 0.00 H +ATOM 175 HG22 ILE 181 -27.257 -14.496 -5.045 1.00 0.00 H +ATOM 176 HG23 ILE 181 -26.764 -14.490 -3.491 1.00 0.00 H +ATOM 177 CG1 ILE 181 -26.205 -17.135 -3.221 1.00 0.00 C +ATOM 178 HG12 ILE 181 -26.169 -16.593 -2.387 1.00 0.00 H +ATOM 179 HG13 ILE 181 -26.625 -18.016 -3.019 1.00 0.00 H +ATOM 180 CD1 ILE 181 -24.790 -17.375 -3.713 1.00 0.00 C +ATOM 181 HD11 ILE 181 -24.357 -16.498 -3.912 1.00 0.00 H +ATOM 182 HD12 ILE 181 -24.272 -17.853 -3.006 1.00 0.00 H +ATOM 183 HD13 ILE 181 -24.819 -17.931 -4.542 1.00 0.00 H +ATOM 184 C ILE 181 -29.390 -15.639 -4.768 1.00 0.00 C +ATOM 185 O ILE 181 -29.881 -14.570 -4.388 1.00 0.00 O +ATOM 186 N ILE 182 -29.538 -16.098 -6.006 1.00 0.00 N +ATOM 187 H ILE 182 -29.087 -17.009 -6.196 1.00 0.00 H +ATOM 188 CA ILE 182 -30.293 -15.344 -7.008 1.00 0.00 C +ATOM 189 HA ILE 182 -29.944 -14.397 -6.971 1.00 0.00 H +ATOM 190 CB ILE 182 -30.077 -15.948 -8.418 1.00 0.00 C +ATOM 191 HB ILE 182 -30.270 -16.917 -8.367 1.00 0.00 H +ATOM 192 CG2 ILE 182 -31.002 -15.272 -9.432 1.00 0.00 C +ATOM 193 HG21 ILE 182 -30.867 -15.687 -10.329 1.00 0.00 H +ATOM 194 HG22 ILE 182 -31.950 -15.393 -9.146 1.00 0.00 H +ATOM 195 HG23 ILE 182 -30.787 -14.299 -9.477 1.00 0.00 H +ATOM 196 CG1 ILE 182 -28.607 -15.776 -8.836 1.00 0.00 C +ATOM 197 HG12 ILE 182 -28.430 -14.805 -8.974 1.00 0.00 H +ATOM 198 HG13 ILE 182 -28.030 -16.107 -8.092 1.00 0.00 H +ATOM 199 CD1 ILE 182 -28.233 -16.529 -10.110 1.00 0.00 C +ATOM 200 HD11 ILE 182 -28.798 -16.197 -10.861 1.00 0.00 H +ATOM 201 HD12 ILE 182 -27.270 -16.367 -10.312 1.00 0.00 H +ATOM 202 HD13 ILE 182 -28.392 -17.503 -9.970 1.00 0.00 H +ATOM 203 C ILE 182 -31.792 -15.266 -6.690 1.00 0.00 C +ATOM 204 O ILE 182 -32.411 -14.222 -6.884 1.00 0.00 O +ATOM 205 N SER 183 -32.364 -16.364 -6.197 1.00 0.00 N +ATOM 206 H SER 183 -31.726 -17.177 -6.091 1.00 0.00 H +ATOM 207 CA SER 183 -33.785 -16.407 -5.836 1.00 0.00 C +ATOM 208 HA SER 183 -34.316 -16.106 -6.633 1.00 0.00 H +ATOM 209 CB SER 183 -34.195 -17.822 -5.410 1.00 0.00 C +ATOM 210 HB2 SER 183 -33.678 -18.068 -4.594 1.00 0.00 H +ATOM 211 HB3 SER 183 -35.171 -17.819 -5.206 1.00 0.00 H +ATOM 212 OG SER 183 -33.934 -18.750 -6.427 1.00 0.00 O +ATOM 213 HG SER 183 -32.968 -19.016 -6.406 1.00 0.00 H +ATOM 214 C SER 183 -34.077 -15.447 -4.686 1.00 0.00 C +ATOM 215 O SER 183 -35.054 -14.693 -4.717 1.00 0.00 O +ATOM 216 N ARG 184 -33.228 -15.485 -3.665 1.00 0.00 N +ATOM 217 H ARG 184 -32.460 -16.164 -3.751 1.00 0.00 H +ATOM 218 CA ARG 184 -33.417 -14.602 -2.522 1.00 0.00 C +ATOM 219 HA ARG 184 -34.340 -14.751 -2.143 1.00 0.00 H +ATOM 220 CB ARG 184 -32.406 -14.909 -1.415 1.00 0.00 C +ATOM 221 HB2 ARG 184 -31.495 -14.916 -1.821 1.00 0.00 H +ATOM 222 HB3 ARG 184 -32.467 -14.186 -0.731 1.00 0.00 H +ATOM 223 CG ARG 184 -32.626 -16.236 -0.722 1.00 0.00 C +ATOM 224 HG2 ARG 184 -33.580 -16.493 -0.787 1.00 0.00 H +ATOM 225 HG3 ARG 184 -32.043 -16.926 -1.128 1.00 0.00 H +ATOM 226 CD ARG 184 -32.264 -16.113 0.746 1.00 0.00 C +ATOM 227 HD2 ARG 184 -31.310 -15.829 0.808 1.00 0.00 H +ATOM 228 HD3 ARG 184 -32.853 -15.418 1.153 1.00 0.00 H +ATOM 229 NE ARG 184 -32.439 -17.372 1.459 1.00 0.00 N +ATOM 230 HE ARG 184 -32.645 -18.196 0.918 1.00 0.00 H +ATOM 231 CZ ARG 184 -32.344 -17.503 2.777 1.00 0.00 C +ATOM 232 NH1 ARG 184 -32.079 -16.447 3.533 1.00 0.00 N +ATOM 233 HH11 ARG 184 -31.967 -15.541 3.135 1.00 0.00 H +ATOM 234 HH12 ARG 184 -31.990 -16.561 4.531 1.00 0.00 H +ATOM 235 NH2 ARG 184 -32.508 -18.695 3.339 1.00 0.00 N +ATOM 236 HH21 ARG 184 -32.723 -19.488 2.764 1.00 0.00 H +ATOM 237 HH22 ARG 184 -32.420 -18.802 4.326 1.00 0.00 H +ATOM 238 C ARG 184 -33.290 -13.134 -2.923 1.00 0.00 C +ATOM 239 O ARG 184 -34.059 -12.283 -2.466 1.00 0.00 O +ATOM 240 N TYR 185 -32.320 -12.830 -3.777 1.00 0.00 N +ATOM 241 H TYR 185 -31.741 -13.617 -4.093 1.00 0.00 H +ATOM 242 CA TYR 185 -32.137 -11.452 -4.202 1.00 0.00 C +ATOM 243 HA TYR 185 -32.029 -10.877 -3.383 1.00 0.00 H +ATOM 244 CB TYR 185 -30.880 -11.310 -5.074 1.00 0.00 C +ATOM 245 HB2 TYR 185 -30.112 -11.686 -4.573 1.00 0.00 H +ATOM 246 HB3 TYR 185 -31.031 -11.809 -5.917 1.00 0.00 H +ATOM 247 CG TYR 185 -30.570 -9.871 -5.419 1.00 0.00 C +ATOM 248 CD1 TYR 185 -30.431 -8.910 -4.413 1.00 0.00 C +ATOM 249 HD1 TYR 185 -30.515 -9.183 -3.455 1.00 0.00 H +ATOM 250 CE1 TYR 185 -30.178 -7.574 -4.723 1.00 0.00 C +ATOM 251 HE1 TYR 185 -30.077 -6.899 -3.995 1.00 0.00 H +ATOM 252 CZ TYR 185 -30.066 -7.189 -6.058 1.00 0.00 C +ATOM 253 OH TYR 185 -29.845 -5.870 -6.376 1.00 0.00 O +ATOM 254 HH TYR 185 -29.842 -5.326 -5.538 1.00 0.00 H +ATOM 255 CE2 TYR 185 -30.197 -8.120 -7.069 1.00 0.00 C +ATOM 256 HE2 TYR 185 -30.117 -7.847 -8.025 1.00 0.00 H +ATOM 257 CD2 TYR 185 -30.445 -9.460 -6.746 1.00 0.00 C +ATOM 258 HD2 TYR 185 -30.532 -10.128 -7.480 1.00 0.00 H +ATOM 259 C TYR 185 -33.360 -10.955 -4.969 1.00 0.00 C +ATOM 260 O TYR 185 -33.872 -9.872 -4.690 1.00 0.00 O +ATOM 261 N LEU 186 -33.840 -11.739 -5.933 1.00 0.00 N +ATOM 262 H LEU 186 -33.347 -12.629 -6.071 1.00 0.00 H +ATOM 263 CA LEU 186 -35.002 -11.314 -6.721 1.00 0.00 C +ATOM 264 HA LEU 186 -34.796 -10.410 -7.129 1.00 0.00 H +ATOM 265 CB LEU 186 -35.257 -12.282 -7.881 1.00 0.00 C +ATOM 266 HB2 LEU 186 -34.873 -13.166 -7.630 1.00 0.00 H +ATOM 267 HB3 LEU 186 -36.241 -12.357 -8.005 1.00 0.00 H +ATOM 268 CG LEU 186 -34.654 -11.889 -9.231 1.00 0.00 C +ATOM 269 HG LEU 186 -35.038 -11.015 -9.515 1.00 0.00 H +ATOM 270 CD1 LEU 186 -33.146 -11.763 -9.099 1.00 0.00 C +ATOM 271 HD11 LEU 186 -32.760 -12.639 -8.806 1.00 0.00 H +ATOM 272 HD12 LEU 186 -32.752 -11.506 -9.982 1.00 0.00 H +ATOM 273 HD13 LEU 186 -32.926 -11.061 -8.421 1.00 0.00 H +ATOM 274 CD2 LEU 186 -35.024 -12.920 -10.294 1.00 0.00 C +ATOM 275 HD21 LEU 186 -36.019 -12.966 -10.380 1.00 0.00 H +ATOM 276 HD22 LEU 186 -34.624 -12.652 -11.170 1.00 0.00 H +ATOM 277 HD23 LEU 186 -34.670 -13.816 -10.025 1.00 0.00 H +ATOM 278 C LEU 186 -36.268 -11.184 -5.879 1.00 0.00 C +ATOM 279 O LEU 186 -37.076 -10.276 -6.093 1.00 0.00 O +ATOM 280 N ARG 187 -36.440 -12.076 -4.913 1.00 0.00 N +ATOM 281 H ARG 187 -35.706 -12.783 -4.821 1.00 0.00 H +ATOM 282 CA ARG 187 -37.615 -11.988 -4.085 1.00 0.00 C +ATOM 283 HA ARG 187 -38.439 -11.913 -4.678 1.00 0.00 H +ATOM 284 CB ARG 187 -37.800 -13.281 -3.308 1.00 0.00 C +ATOM 285 HB2 ARG 187 -37.759 -14.036 -3.941 1.00 0.00 H +ATOM 286 HB3 ARG 187 -37.094 -13.340 -2.623 1.00 0.00 H +ATOM 287 CG ARG 187 -39.143 -13.318 -2.610 1.00 0.00 C +ATOM 288 HG2 ARG 187 -39.139 -12.689 -1.827 1.00 0.00 H +ATOM 289 HG3 ARG 187 -39.867 -13.037 -3.247 1.00 0.00 H +ATOM 290 CD ARG 187 -39.527 -14.716 -2.071 1.00 0.00 C +ATOM 291 HD2 ARG 187 -39.428 -15.360 -2.826 1.00 0.00 H +ATOM 292 HD3 ARG 187 -38.879 -14.939 -1.346 1.00 0.00 H +ATOM 293 NE ARG 187 -40.880 -14.758 -1.558 1.00 0.00 N +ATOM 294 HE ARG 187 -41.022 -15.060 -0.606 1.00 0.00 H +ATOM 295 CZ ARG 187 -41.962 -14.422 -2.263 1.00 0.00 C +ATOM 296 NH1 ARG 187 -41.866 -14.026 -3.524 1.00 0.00 N +ATOM 297 HH11 ARG 187 -40.975 -13.992 -3.976 1.00 0.00 H +ATOM 298 HH12 ARG 187 -42.689 -13.760 -4.030 1.00 0.00 H +ATOM 299 NH2 ARG 187 -43.169 -14.421 -1.700 1.00 0.00 N +ATOM 300 HH21 ARG 187 -43.253 -14.698 -0.737 1.00 0.00 H +ATOM 301 HH22 ARG 187 -43.969 -14.154 -2.221 1.00 0.00 H +ATOM 302 C ARG 187 -37.607 -10.776 -3.138 1.00 0.00 C +ATOM 303 O ARG 187 -38.623 -10.082 -2.999 1.00 0.00 O +ATOM 304 N GLU 188 -36.486 -10.498 -2.479 1.00 0.00 N +ATOM 305 H GLU 188 -35.700 -11.122 -2.635 1.00 0.00 H +ATOM 306 CA GLU 188 -36.463 -9.332 -1.590 1.00 0.00 C +ATOM 307 HA GLU 188 -37.257 -9.366 -0.968 1.00 0.00 H +ATOM 308 CB GLU 188 -35.257 -9.375 -0.649 1.00 0.00 C +ATOM 309 HB2 GLU 188 -35.354 -8.607 -0.018 1.00 0.00 H +ATOM 310 HB3 GLU 188 -35.314 -10.234 -0.143 1.00 0.00 H +ATOM 311 CG GLU 188 -33.914 -9.293 -1.280 1.00 0.00 C +ATOM 312 HG2 GLU 188 -33.715 -10.144 -1.726 1.00 0.00 H +ATOM 313 HG3 GLU 188 -33.892 -8.530 -1.896 1.00 0.00 H +ATOM 314 CD GLU 188 -32.836 -9.065 -0.246 1.00 0.00 C +ATOM 315 OE1 GLU 188 -32.857 -9.773 0.778 1.00 0.00 O +ATOM 316 OE2 GLU 188 -31.959 -8.199 -0.446 1.00 0.00 O +ATOM 317 C GLU 188 -36.491 -8.010 -2.371 1.00 0.00 C +ATOM 318 O GLU 188 -36.955 -6.991 -1.860 1.00 0.00 O +ATOM 319 N GLN 189 -35.996 -8.024 -3.606 1.00 0.00 N +ATOM 320 H GLN 189 -35.603 -8.921 -3.916 1.00 0.00 H +ATOM 321 CA GLN 189 -36.035 -6.818 -4.421 1.00 0.00 C +ATOM 322 HA GLN 189 -35.710 -6.055 -3.868 1.00 0.00 H +ATOM 323 CB GLN 189 -35.194 -7.003 -5.691 1.00 0.00 C +ATOM 324 HB2 GLN 189 -35.385 -7.912 -6.070 1.00 0.00 H +ATOM 325 HB3 GLN 189 -35.471 -6.308 -6.361 1.00 0.00 H +ATOM 326 CG GLN 189 -33.694 -6.884 -5.479 1.00 0.00 C +ATOM 327 HG2 GLN 189 -33.455 -7.324 -4.617 1.00 0.00 H +ATOM 328 HG3 GLN 189 -33.226 -7.337 -6.234 1.00 0.00 H +ATOM 329 CD GLN 189 -33.241 -5.437 -5.425 1.00 0.00 C +ATOM 330 OE1 GLN 189 -33.468 -4.676 -6.366 1.00 0.00 O +ATOM 331 NE2 GLN 189 -32.601 -5.047 -4.324 1.00 0.00 N +ATOM 332 HE21 GLN 189 -32.259 -4.100 -4.226 1.00 0.00 H +ATOM 333 HE22 GLN 189 -32.462 -5.726 -3.575 1.00 0.00 H +ATOM 334 C GLN 189 -37.491 -6.535 -4.794 1.00 0.00 C +ATOM 335 O GLN 189 -37.945 -5.398 -4.771 1.00 0.00 O +ATOM 336 N ALA 190 -38.227 -7.591 -5.125 1.00 0.00 N +ATOM 337 H ALA 190 -37.734 -8.501 -5.082 1.00 0.00 H +ATOM 338 CA ALA 190 -39.628 -7.450 -5.517 1.00 0.00 C +ATOM 339 HA ALA 190 -39.696 -6.704 -6.210 1.00 0.00 H +ATOM 340 CB ALA 190 -40.105 -8.721 -6.222 1.00 0.00 C +ATOM 341 HB1 ALA 190 -39.426 -9.442 -6.098 1.00 0.00 H +ATOM 342 HB2 ALA 190 -40.976 -9.010 -5.829 1.00 0.00 H +ATOM 343 HB3 ALA 190 -40.222 -8.534 -7.196 1.00 0.00 H +ATOM 344 C ALA 190 -40.575 -7.118 -4.363 1.00 0.00 C +ATOM 345 O ALA 190 -41.540 -6.361 -4.534 1.00 0.00 O +ATOM 346 N THR 191 -40.291 -7.670 -3.188 1.00 0.00 N +ATOM 347 H THR 191 -39.428 -8.249 -3.176 1.00 0.00 H +ATOM 348 CA THR 191 -41.137 -7.467 -2.017 1.00 0.00 C +ATOM 349 HA THR 191 -42.084 -7.255 -2.340 1.00 0.00 H +ATOM 350 CB THR 191 -41.212 -8.756 -1.190 1.00 0.00 C +ATOM 351 HB THR 191 -41.899 -8.633 -0.445 1.00 0.00 H +ATOM 352 CG2 THR 191 -41.579 -9.934 -2.094 1.00 0.00 C +ATOM 353 HG21 THR 191 -40.796 -10.553 -2.174 1.00 0.00 H +ATOM 354 HG22 THR 191 -42.355 -10.430 -1.701 1.00 0.00 H +ATOM 355 HG23 THR 191 -41.828 -9.595 -3.003 1.00 0.00 H +ATOM 356 OG1 THR 191 -39.938 -9.010 -0.582 1.00 0.00 O +ATOM 357 HG1 THR 191 -39.291 -9.367 -1.264 1.00 0.00 H +ATOM 358 C THR 191 -40.690 -6.337 -1.095 1.00 0.00 C +ATOM 359 O THR 191 -41.528 -5.627 -0.535 1.00 0.00 O +ATOM 360 N GLY 192 -39.380 -6.175 -0.932 1.00 0.00 N +ATOM 361 H GLY 192 -38.786 -6.840 -1.450 1.00 0.00 H +ATOM 362 CA GLY 192 -38.866 -5.120 -0.073 1.00 0.00 C +ATOM 363 HA2 GLY 192 -38.083 -4.662 -0.540 1.00 0.00 H +ATOM 364 HA3 GLY 192 -39.585 -4.405 0.045 1.00 0.00 H +ATOM 365 C GLY 192 -38.419 -5.605 1.289 1.00 0.00 C +ATOM 366 O GLY 192 -38.015 -4.815 2.149 1.00 0.00 O +ATOM 367 N ALA 193 -38.481 -6.913 1.503 1.00 0.00 N +ATOM 368 H ALA 193 -38.812 -7.479 0.708 1.00 0.00 H +ATOM 369 CA ALA 193 -38.095 -7.481 2.800 1.00 0.00 C +ATOM 370 HA ALA 193 -37.816 -6.717 3.416 1.00 0.00 H +ATOM 371 CB ALA 193 -39.311 -8.131 3.428 1.00 0.00 C +ATOM 372 HB1 ALA 193 -39.671 -8.836 2.816 1.00 0.00 H +ATOM 373 HB2 ALA 193 -39.057 -8.551 4.300 1.00 0.00 H +ATOM 374 HB3 ALA 193 -40.018 -7.441 3.588 1.00 0.00 H +ATOM 375 C ALA 193 -36.941 -8.491 2.737 1.00 0.00 C +ATOM 376 O ALA 193 -36.797 -9.218 1.764 1.00 0.00 O +ATOM 377 N LYS 194 -36.137 -8.521 3.792 1.00 0.00 N +ATOM 378 H LYS 194 -36.399 -7.834 4.546 1.00 0.00 H +ATOM 379 CA LYS 194 -35.000 -9.414 3.905 1.00 0.00 C +ATOM 380 HA LYS 194 -34.637 -9.608 2.994 1.00 0.00 H +ATOM 381 CB LYS 194 -33.962 -8.782 4.828 1.00 0.00 C +ATOM 382 HB2 LYS 194 -34.314 -7.891 5.142 1.00 0.00 H +ATOM 383 HB3 LYS 194 -33.850 -9.376 5.637 1.00 0.00 H +ATOM 384 CG LYS 194 -32.552 -8.537 4.238 1.00 0.00 C +ATOM 385 HG2 LYS 194 -32.228 -9.382 3.836 1.00 0.00 H +ATOM 386 HG3 LYS 194 -32.614 -7.819 3.560 1.00 0.00 H +ATOM 387 CD LYS 194 -31.598 -8.106 5.345 1.00 0.00 C +ATOM 388 HD2 LYS 194 -30.683 -8.034 4.977 1.00 0.00 H +ATOM 389 HD3 LYS 194 -31.904 -7.246 5.723 1.00 0.00 H +ATOM 390 CE LYS 194 -31.578 -9.150 6.480 1.00 0.00 C +ATOM 391 HE2 LYS 194 -31.475 -8.660 7.367 1.00 0.00 H +ATOM 392 HE3 LYS 194 -32.485 -9.612 6.509 1.00 0.00 H +ATOM 393 NZ LYS 194 -30.502 -10.219 6.399 1.00 0.00 N +ATOM 394 HZ1 LYS 194 -29.673 -9.866 6.821 1.00 0.00 H +ATOM 395 HZ2 LYS 194 -30.821 -11.027 6.884 1.00 0.00 H +ATOM 396 HZ3 LYS 194 -30.339 -10.432 5.441 1.00 0.00 H +ATOM 397 C LYS 194 -35.461 -10.736 4.534 1.00 0.00 C +ATOM 398 O LYS 194 -36.205 -10.719 5.517 1.00 0.00 O +ATOM 399 N ASP 195 -35.042 -11.872 3.975 1.00 0.00 N +ATOM 400 H ASP 195 -34.456 -11.759 3.133 1.00 0.00 H +ATOM 401 CA ASP 195 -35.407 -13.175 4.543 1.00 0.00 C +ATOM 402 HA ASP 195 -36.292 -13.075 4.961 1.00 0.00 H +ATOM 403 CB ASP 195 -35.264 -14.296 3.512 1.00 0.00 C +ATOM 404 HB2 ASP 195 -35.753 -14.024 2.693 1.00 0.00 H +ATOM 405 HB3 ASP 195 -34.299 -14.418 3.323 1.00 0.00 H +ATOM 406 CG ASP 195 -35.836 -15.608 4.010 1.00 0.00 C +ATOM 407 OD1 ASP 195 -35.806 -15.841 5.242 1.00 0.00 O +ATOM 408 OD2 ASP 195 -36.306 -16.414 3.179 1.00 0.00 O +ATOM 409 C ASP 195 -34.400 -13.409 5.671 1.00 0.00 C +ATOM 410 O ASP 195 -33.192 -13.293 5.460 1.00 0.00 O +ATOM 411 N THR 196 -34.881 -13.764 6.859 1.00 0.00 N +ATOM 412 H THR 196 -35.908 -13.876 6.902 1.00 0.00 H +ATOM 413 CA THR 196 -33.995 -13.974 8.004 1.00 0.00 C +ATOM 414 HA THR 196 -33.160 -13.396 7.871 1.00 0.00 H +ATOM 415 CB THR 196 -34.663 -13.462 9.298 1.00 0.00 C +ATOM 416 HB THR 196 -34.741 -12.447 9.246 1.00 0.00 H +ATOM 417 CG2 THR 196 -36.039 -14.081 9.476 1.00 0.00 C +ATOM 418 HG21 THR 196 -36.744 -13.372 9.400 1.00 0.00 H +ATOM 419 HG22 THR 196 -36.195 -14.775 8.769 1.00 0.00 H +ATOM 420 HG23 THR 196 -36.105 -14.513 10.379 1.00 0.00 H +ATOM 421 OG1 THR 196 -33.838 -13.793 10.419 1.00 0.00 O +ATOM 422 HG1 THR 196 -33.244 -14.575 10.199 1.00 0.00 H +ATOM 423 C THR 196 -33.533 -15.420 8.225 1.00 0.00 C +ATOM 424 O THR 196 -32.717 -15.686 9.106 1.00 0.00 O +ATOM 425 N LYS 197 -34.047 -16.354 7.436 1.00 0.00 N +ATOM 426 H LYS 197 -34.728 -16.019 6.736 1.00 0.00 H +ATOM 427 CA LYS 197 -33.653 -17.761 7.574 1.00 0.00 C +ATOM 428 HA LYS 197 -33.695 -18.013 8.550 1.00 0.00 H +ATOM 429 CB LYS 197 -34.582 -18.672 6.768 1.00 0.00 C +ATOM 430 HB2 LYS 197 -34.700 -18.260 5.855 1.00 0.00 H +ATOM 431 HB3 LYS 197 -34.116 -19.560 6.652 1.00 0.00 H +ATOM 432 CG LYS 197 -35.945 -18.920 7.360 1.00 0.00 C +ATOM 433 HG2 LYS 197 -35.859 -19.468 8.180 1.00 0.00 H +ATOM 434 HG3 LYS 197 -36.390 -18.057 7.552 1.00 0.00 H +ATOM 435 CD LYS 197 -36.792 -19.691 6.345 1.00 0.00 C +ATOM 436 HD2 LYS 197 -36.349 -20.560 6.155 1.00 0.00 H +ATOM 437 HD3 LYS 197 -37.697 -19.837 6.728 1.00 0.00 H +ATOM 438 CE LYS 197 -36.937 -18.921 5.034 1.00 0.00 C +ATOM 439 HE2 LYS 197 -37.346 -18.024 5.233 1.00 0.00 H +ATOM 440 HE3 LYS 197 -36.021 -18.775 4.645 1.00 0.00 H +ATOM 441 NZ LYS 197 -37.781 -19.638 4.047 1.00 0.00 N +ATOM 442 HZ1 LYS 197 -37.836 -19.103 3.203 1.00 0.00 H +ATOM 443 HZ2 LYS 197 -37.377 -20.532 3.849 1.00 0.00 H +ATOM 444 HZ3 LYS 197 -38.700 -19.763 4.422 1.00 0.00 H +ATOM 445 C LYS 197 -32.235 -17.999 7.066 1.00 0.00 C +ATOM 446 O LYS 197 -31.797 -17.352 6.116 1.00 0.00 O +ATOM 447 N PRO 198 -31.498 -18.937 7.693 1.00 0.00 N +ATOM 448 CD PRO 198 -31.793 -19.679 8.933 1.00 0.00 C +ATOM 449 HD2 PRO 198 -32.731 -20.015 8.924 1.00 0.00 H +ATOM 450 HD3 PRO 198 -31.646 -19.099 9.731 1.00 0.00 H +ATOM 451 CG PRO 198 -30.801 -20.803 8.874 1.00 0.00 C +ATOM 452 HG2 PRO 198 -31.115 -21.527 8.265 1.00 0.00 H +ATOM 453 HG3 PRO 198 -30.624 -21.173 9.782 1.00 0.00 H +ATOM 454 CB PRO 198 -29.581 -20.144 8.326 1.00 0.00 C +ATOM 455 HB2 PRO 198 -28.955 -20.816 7.932 1.00 0.00 H +ATOM 456 HB3 PRO 198 -29.107 -19.620 9.032 1.00 0.00 H +ATOM 457 CA PRO 198 -30.132 -19.217 7.241 1.00 0.00 C +ATOM 458 HA PRO 198 -29.578 -18.369 7.242 1.00 0.00 H +ATOM 459 C PRO 198 -30.105 -19.878 5.874 1.00 0.00 C +ATOM 460 O PRO 198 -31.050 -20.558 5.479 1.00 0.00 O +ATOM 461 N MET 199 -29.018 -19.659 5.146 1.00 0.00 N +ATOM 462 H MET 199 -28.313 -19.040 5.584 1.00 0.00 H +ATOM 463 CA MET 199 -28.864 -20.261 3.834 1.00 0.00 C +ATOM 464 HA MET 199 -29.708 -20.131 3.324 1.00 0.00 H +ATOM 465 CB MET 199 -27.650 -19.656 3.126 1.00 0.00 C +ATOM 466 HB2 MET 199 -26.845 -19.720 3.736 1.00 0.00 H +ATOM 467 HB3 MET 199 -27.449 -20.196 2.295 1.00 0.00 H +ATOM 468 CG MET 199 -27.807 -18.184 2.705 1.00 0.00 C +ATOM 469 HG2 MET 199 -28.163 -17.663 3.515 1.00 0.00 H +ATOM 470 HG3 MET 199 -26.869 -17.806 2.530 1.00 0.00 H +ATOM 471 SD MET 199 -28.869 -17.976 1.279 1.00 0.00 S +ATOM 472 CE MET 199 -29.039 -16.192 1.184 1.00 0.00 C +ATOM 473 HE1 MET 199 -28.557 -15.769 1.952 1.00 0.00 H +ATOM 474 HE2 MET 199 -28.647 -15.864 0.324 1.00 0.00 H +ATOM 475 HE3 MET 199 -30.008 -15.946 1.223 1.00 0.00 H +ATOM 476 C MET 199 -28.659 -21.757 4.034 1.00 0.00 C +ATOM 477 O MET 199 -28.502 -22.222 5.167 1.00 0.00 O +ATOM 478 N GLY 200 -28.675 -22.519 2.944 1.00 0.00 N +ATOM 479 H GLY 200 -28.837 -22.025 2.059 1.00 0.00 H +ATOM 480 CA GLY 200 -28.471 -23.950 3.064 1.00 0.00 C +ATOM 481 HA2 GLY 200 -29.090 -24.324 3.751 1.00 0.00 H +ATOM 482 HA3 GLY 200 -28.639 -24.391 2.185 1.00 0.00 H +ATOM 483 C GLY 200 -27.036 -24.195 3.488 1.00 0.00 C +ATOM 484 O GLY 200 -26.294 -23.225 3.695 1.00 0.00 O +TER 485 GLY 200 +ATOM 486 N SER 202 -22.146 -24.130 3.748 1.00 0.00 N +ATOM 487 H SER 202 -22.234 -23.719 4.664 1.00 0.00 H +ATOM 488 CA SER 202 -22.622 -23.510 2.517 1.00 0.00 C +ATOM 489 HA SER 202 -21.830 -23.349 1.919 1.00 0.00 H +ATOM 490 CB SER 202 -23.636 -24.435 1.814 1.00 0.00 C +ATOM 491 HB2 SER 202 -24.414 -24.578 2.423 1.00 0.00 H +ATOM 492 HB3 SER 202 -23.943 -23.992 0.974 1.00 0.00 H +ATOM 493 OG SER 202 -23.074 -25.710 1.481 1.00 0.00 O +ATOM 494 HG SER 202 -22.978 -25.775 0.491 1.00 0.00 H +ATOM 495 C SER 202 -23.272 -22.153 2.804 1.00 0.00 C +ATOM 496 O SER 202 -23.310 -21.276 1.936 1.00 0.00 O +ATOM 497 N GLY 203 -23.777 -21.984 4.021 1.00 0.00 N +ATOM 498 H GLY 203 -23.655 -22.788 4.661 1.00 0.00 H +ATOM 499 CA GLY 203 -24.441 -20.751 4.383 1.00 0.00 C +ATOM 500 HA2 GLY 203 -25.256 -20.613 3.746 1.00 0.00 H +ATOM 501 HA3 GLY 203 -24.892 -20.877 5.315 1.00 0.00 H +ATOM 502 C GLY 203 -23.633 -19.469 4.412 1.00 0.00 C +ATOM 503 O GLY 203 -24.079 -18.443 3.888 1.00 0.00 O +ATOM 504 N ALA 204 -22.455 -19.505 5.029 1.00 0.00 N +ATOM 505 H ALA 204 -22.188 -20.427 5.414 1.00 0.00 H +ATOM 506 CA ALA 204 -21.620 -18.309 5.138 1.00 0.00 C +ATOM 507 HA ALA 204 -22.069 -17.664 5.793 1.00 0.00 H +ATOM 508 CB ALA 204 -20.295 -18.660 5.774 1.00 0.00 C +ATOM 509 HB1 ALA 204 -19.693 -19.083 5.094 1.00 0.00 H +ATOM 510 HB2 ALA 204 -19.858 -17.831 6.128 1.00 0.00 H +ATOM 511 HB3 ALA 204 -20.440 -19.302 6.529 1.00 0.00 H +ATOM 512 C ALA 204 -21.387 -17.579 3.827 1.00 0.00 C +ATOM 513 O ALA 204 -21.739 -16.404 3.713 1.00 0.00 O +ATOM 514 N THR 205 -20.775 -18.251 2.859 1.00 0.00 N +ATOM 515 H THR 205 -20.498 -19.217 3.100 1.00 0.00 H +ATOM 516 CA THR 205 -20.532 -17.633 1.568 1.00 0.00 C +ATOM 517 HA THR 205 -19.930 -16.829 1.705 1.00 0.00 H +ATOM 518 CB THR 205 -19.838 -18.600 0.603 1.00 0.00 C +ATOM 519 HB THR 205 -20.388 -19.459 0.541 1.00 0.00 H +ATOM 520 CG2 THR 205 -19.688 -17.969 -0.767 1.00 0.00 C +ATOM 521 HG21 THR 205 -18.922 -18.393 -1.258 1.00 0.00 H +ATOM 522 HG22 THR 205 -20.529 -18.100 -1.299 1.00 0.00 H +ATOM 523 HG23 THR 205 -19.511 -16.986 -0.674 1.00 0.00 H +ATOM 524 OG1 THR 205 -18.539 -18.940 1.106 1.00 0.00 O +ATOM 525 HG1 THR 205 -17.858 -18.903 0.367 1.00 0.00 H +ATOM 526 C THR 205 -21.813 -17.161 0.908 1.00 0.00 C +ATOM 527 O THR 205 -21.870 -16.049 0.377 1.00 0.00 O +ATOM 528 N SER 206 -22.849 -17.987 0.930 1.00 0.00 N +ATOM 529 H SER 206 -22.712 -18.880 1.388 1.00 0.00 H +ATOM 530 CA SER 206 -24.082 -17.545 0.301 1.00 0.00 C +ATOM 531 HA SER 206 -23.894 -17.344 -0.664 1.00 0.00 H +ATOM 532 CB SER 206 -25.163 -18.627 0.400 1.00 0.00 C +ATOM 533 HB2 SER 206 -25.271 -18.884 1.360 1.00 0.00 H +ATOM 534 HB3 SER 206 -26.023 -18.250 0.057 1.00 0.00 H +ATOM 535 OG SER 206 -24.833 -19.780 -0.352 1.00 0.00 O +ATOM 536 HG SER 206 -24.317 -20.416 0.221 1.00 0.00 H +ATOM 537 C SER 206 -24.580 -16.241 0.955 1.00 0.00 C +ATOM 538 O SER 206 -25.060 -15.346 0.260 1.00 0.00 O +ATOM 539 N ARG 207 -24.463 -16.128 2.280 1.00 0.00 N +ATOM 540 H ARG 207 -24.026 -16.932 2.753 1.00 0.00 H +ATOM 541 CA ARG 207 -24.935 -14.931 2.966 1.00 0.00 C +ATOM 542 HA ARG 207 -25.912 -14.791 2.736 1.00 0.00 H +ATOM 543 CB ARG 207 -24.870 -15.099 4.487 1.00 0.00 C +ATOM 544 HB2 ARG 207 -25.449 -15.865 4.741 1.00 0.00 H +ATOM 545 HB3 ARG 207 -23.926 -15.277 4.741 1.00 0.00 H +ATOM 546 CG ARG 207 -25.343 -13.873 5.257 1.00 0.00 C +ATOM 547 HG2 ARG 207 -24.726 -13.107 5.076 1.00 0.00 H +ATOM 548 HG3 ARG 207 -26.268 -13.633 4.965 1.00 0.00 H +ATOM 549 CD ARG 207 -25.374 -14.106 6.768 1.00 0.00 C +ATOM 550 HD2 ARG 207 -25.475 -13.222 7.213 1.00 0.00 H +ATOM 551 HD3 ARG 207 -26.156 -14.687 6.972 1.00 0.00 H +ATOM 552 NE ARG 207 -24.150 -14.753 7.248 1.00 0.00 N +ATOM 553 HE ARG 207 -23.369 -14.165 7.482 1.00 0.00 H +ATOM 554 CZ ARG 207 -24.008 -16.068 7.394 1.00 0.00 C +ATOM 555 NH1 ARG 207 -25.010 -16.887 7.093 1.00 0.00 N +ATOM 556 HH11 ARG 207 -25.871 -16.536 6.737 1.00 0.00 H +ATOM 557 HH12 ARG 207 -24.897 -17.879 7.226 1.00 0.00 H +ATOM 558 NH2 ARG 207 -22.882 -16.570 7.876 1.00 0.00 N +ATOM 559 HH21 ARG 207 -22.127 -15.951 8.113 1.00 0.00 H +ATOM 560 HH22 ARG 207 -22.779 -17.553 8.003 1.00 0.00 H +ATOM 561 C ARG 207 -24.159 -13.691 2.565 1.00 0.00 C +ATOM 562 O ARG 207 -24.739 -12.622 2.380 1.00 0.00 O +ATOM 563 N LYS 208 -22.847 -13.824 2.452 1.00 0.00 N +ATOM 564 H LYS 208 -22.477 -14.764 2.651 1.00 0.00 H +ATOM 565 CA LYS 208 -22.031 -12.689 2.070 1.00 0.00 C +ATOM 566 HA LYS 208 -22.285 -11.895 2.630 1.00 0.00 H +ATOM 567 CB LYS 208 -20.548 -12.995 2.327 1.00 0.00 C +ATOM 568 HB2 LYS 208 -20.249 -13.677 1.671 1.00 0.00 H +ATOM 569 HB3 LYS 208 -20.030 -12.155 2.219 1.00 0.00 H +ATOM 570 CG LYS 208 -20.272 -13.545 3.743 1.00 0.00 C +ATOM 571 HG2 LYS 208 -20.522 -12.847 4.412 1.00 0.00 H +ATOM 572 HG3 LYS 208 -20.829 -14.361 3.884 1.00 0.00 H +ATOM 573 CD LYS 208 -18.793 -13.913 3.941 1.00 0.00 C +ATOM 574 HD2 LYS 208 -18.726 -14.565 4.691 1.00 0.00 H +ATOM 575 HD3 LYS 208 -18.451 -14.319 3.099 1.00 0.00 H +ATOM 576 CE LYS 208 -17.930 -12.693 4.278 1.00 0.00 C +ATOM 577 HE2 LYS 208 -16.968 -12.964 4.247 1.00 0.00 H +ATOM 578 HE3 LYS 208 -18.098 -11.984 3.594 1.00 0.00 H +ATOM 579 NZ LYS 208 -18.254 -12.166 5.628 1.00 0.00 N +ATOM 580 HZ1 LYS 208 -18.502 -12.924 6.231 1.00 0.00 H +ATOM 581 HZ2 LYS 208 -17.457 -11.691 6.000 1.00 0.00 H +ATOM 582 HZ3 LYS 208 -19.022 -11.528 5.561 1.00 0.00 H +ATOM 583 C LYS 208 -22.269 -12.344 0.603 1.00 0.00 C +ATOM 584 O LYS 208 -22.216 -11.180 0.220 1.00 0.00 O +ATOM 585 N ALA 209 -22.535 -13.358 -0.219 1.00 0.00 N +ATOM 586 H ALA 209 -22.551 -14.292 0.224 1.00 0.00 H +ATOM 587 CA ALA 209 -22.784 -13.136 -1.649 1.00 0.00 C +ATOM 588 HA ALA 209 -22.020 -12.620 -2.033 1.00 0.00 H +ATOM 589 CB ALA 209 -22.907 -14.491 -2.387 1.00 0.00 C +ATOM 590 HB1 ALA 209 -23.859 -14.782 -2.368 1.00 0.00 H +ATOM 591 HB2 ALA 209 -22.604 -14.373 -3.328 1.00 0.00 H +ATOM 592 HB3 ALA 209 -22.335 -15.162 -1.925 1.00 0.00 H +ATOM 593 C ALA 209 -24.065 -12.313 -1.817 1.00 0.00 C +ATOM 594 O ALA 209 -24.118 -11.411 -2.654 1.00 0.00 O +ATOM 595 N LEU 210 -25.086 -12.614 -1.014 1.00 0.00 N +ATOM 596 H LEU 210 -24.914 -13.393 -0.359 1.00 0.00 H +ATOM 597 CA LEU 210 -26.340 -11.872 -1.086 1.00 0.00 C +ATOM 598 HA LEU 210 -26.663 -11.880 -2.037 1.00 0.00 H +ATOM 599 CB LEU 210 -27.393 -12.512 -0.177 1.00 0.00 C +ATOM 600 HB2 LEU 210 -27.535 -13.450 -0.489 1.00 0.00 H +ATOM 601 HB3 LEU 210 -27.031 -12.517 0.753 1.00 0.00 H +ATOM 602 CG LEU 210 -28.766 -11.836 -0.129 1.00 0.00 C +ATOM 603 HG LEU 210 -28.666 -10.918 0.234 1.00 0.00 H +ATOM 604 CD1 LEU 210 -29.339 -11.757 -1.551 1.00 0.00 C +ATOM 605 HD11 LEU 210 -29.430 -12.680 -1.919 1.00 0.00 H +ATOM 606 HD12 LEU 210 -30.234 -11.316 -1.520 1.00 0.00 H +ATOM 607 HD13 LEU 210 -28.720 -11.224 -2.125 1.00 0.00 H +ATOM 608 CD2 LEU 210 -29.717 -12.614 0.785 1.00 0.00 C +ATOM 609 HD21 LEU 210 -29.336 -12.644 1.708 1.00 0.00 H +ATOM 610 HD22 LEU 210 -30.605 -12.157 0.802 1.00 0.00 H +ATOM 611 HD23 LEU 210 -29.824 -13.544 0.435 1.00 0.00 H +ATOM 612 C LEU 210 -26.126 -10.426 -0.661 1.00 0.00 C +ATOM 613 O LEU 210 -26.672 -9.500 -1.267 1.00 0.00 O +ATOM 614 N GLU 211 -25.336 -10.239 0.392 1.00 0.00 N +ATOM 615 H GLU 211 -24.941 -11.106 0.802 1.00 0.00 H +ATOM 616 CA GLU 211 -25.060 -8.902 0.914 1.00 0.00 C +ATOM 617 HA GLU 211 -25.921 -8.451 1.161 1.00 0.00 H +ATOM 618 CB GLU 211 -24.248 -9.010 2.216 1.00 0.00 C +ATOM 619 HB2 GLU 211 -23.607 -9.734 2.109 1.00 0.00 H +ATOM 620 HB3 GLU 211 -23.845 -8.143 2.390 1.00 0.00 H +ATOM 621 CG GLU 211 -25.141 -9.355 3.414 1.00 0.00 C +ATOM 622 HG2 GLU 211 -25.576 -8.524 3.721 1.00 0.00 H +ATOM 623 HG3 GLU 211 -25.805 -10.024 3.121 1.00 0.00 H +ATOM 624 CD GLU 211 -24.396 -9.950 4.615 1.00 0.00 C +ATOM 625 OE1 GLU 211 -23.160 -10.134 4.545 1.00 0.00 O +ATOM 626 OE2 GLU 211 -25.066 -10.236 5.638 1.00 0.00 O +ATOM 627 C GLU 211 -24.331 -8.066 -0.137 1.00 0.00 C +ATOM 628 O GLU 211 -24.606 -6.878 -0.308 1.00 0.00 O +ATOM 629 N THR 212 -23.403 -8.695 -0.850 1.00 0.00 N +ATOM 630 H THR 212 -23.261 -9.693 -0.597 1.00 0.00 H +ATOM 631 CA THR 212 -22.652 -8.019 -1.903 1.00 0.00 C +ATOM 632 HA THR 212 -22.234 -7.197 -1.521 1.00 0.00 H +ATOM 633 CB THR 212 -21.593 -8.951 -2.489 1.00 0.00 C +ATOM 634 HB THR 212 -22.050 -9.782 -2.864 1.00 0.00 H +ATOM 635 CG2 THR 212 -20.804 -8.250 -3.592 1.00 0.00 C +ATOM 636 HG21 THR 212 -20.406 -8.932 -4.208 1.00 0.00 H +ATOM 637 HG22 THR 212 -21.413 -7.649 -4.113 1.00 0.00 H +ATOM 638 HG23 THR 212 -20.069 -7.704 -3.186 1.00 0.00 H +ATOM 639 OG1 THR 212 -20.707 -9.364 -1.445 1.00 0.00 O +ATOM 640 HG1 THR 212 -21.163 -10.025 -0.839 1.00 0.00 H +ATOM 641 C THR 212 -23.621 -7.598 -3.006 1.00 0.00 C +ATOM 642 O THR 212 -23.522 -6.497 -3.545 1.00 0.00 O +ATOM 643 N LEU 213 -24.557 -8.483 -3.353 1.00 0.00 N +ATOM 644 H LEU 213 -24.524 -9.381 -2.857 1.00 0.00 H +ATOM 645 CA LEU 213 -25.546 -8.147 -4.381 1.00 0.00 C +ATOM 646 HA LEU 213 -25.055 -7.882 -5.224 1.00 0.00 H +ATOM 647 CB LEU 213 -26.428 -9.358 -4.726 1.00 0.00 C +ATOM 648 HB2 LEU 213 -26.596 -9.861 -3.876 1.00 0.00 H +ATOM 649 HB3 LEU 213 -27.295 -9.008 -5.081 1.00 0.00 H +ATOM 650 CG LEU 213 -25.884 -10.357 -5.747 1.00 0.00 C +ATOM 651 HG LEU 213 -24.983 -10.658 -5.458 1.00 0.00 H +ATOM 652 CD1 LEU 213 -26.821 -11.552 -5.819 1.00 0.00 C +ATOM 653 HD11 LEU 213 -27.732 -11.247 -6.099 1.00 0.00 H +ATOM 654 HD12 LEU 213 -26.472 -12.212 -6.486 1.00 0.00 H +ATOM 655 HD13 LEU 213 -26.878 -11.987 -4.920 1.00 0.00 H +ATOM 656 CD2 LEU 213 -25.750 -9.692 -7.117 1.00 0.00 C +ATOM 657 HD21 LEU 213 -25.122 -8.917 -7.049 1.00 0.00 H +ATOM 658 HD22 LEU 213 -25.394 -10.356 -7.774 1.00 0.00 H +ATOM 659 HD23 LEU 213 -26.647 -9.371 -7.418 1.00 0.00 H +ATOM 660 C LEU 213 -26.448 -6.975 -3.966 1.00 0.00 C +ATOM 661 O LEU 213 -26.835 -6.171 -4.802 1.00 0.00 O +ATOM 662 N ARG 214 -26.796 -6.887 -2.684 1.00 0.00 N +ATOM 663 H ARG 214 -26.430 -7.627 -2.072 1.00 0.00 H +ATOM 664 CA ARG 214 -27.649 -5.788 -2.220 1.00 0.00 C +ATOM 665 HA ARG 214 -28.475 -5.762 -2.789 1.00 0.00 H +ATOM 666 CB ARG 214 -28.025 -5.958 -0.756 1.00 0.00 C +ATOM 667 HB2 ARG 214 -27.182 -6.127 -0.238 1.00 0.00 H +ATOM 668 HB3 ARG 214 -28.433 -5.097 -0.439 1.00 0.00 H +ATOM 669 CG ARG 214 -28.986 -7.069 -0.472 1.00 0.00 C +ATOM 670 HG2 ARG 214 -29.854 -6.889 -0.908 1.00 0.00 H +ATOM 671 HG3 ARG 214 -28.606 -7.932 -0.769 1.00 0.00 H +ATOM 672 CD ARG 214 -29.212 -7.141 1.020 1.00 0.00 C +ATOM 673 HD2 ARG 214 -28.324 -7.169 1.469 1.00 0.00 H +ATOM 674 HD3 ARG 214 -29.714 -6.327 1.299 1.00 0.00 H +ATOM 675 NE ARG 214 -29.974 -8.325 1.382 1.00 0.00 N +ATOM 676 HE ARG 214 -30.629 -8.690 0.709 1.00 0.00 H +ATOM 677 CZ ARG 214 -29.859 -8.952 2.541 1.00 0.00 C +ATOM 678 NH1 ARG 214 -29.010 -8.502 3.450 1.00 0.00 N +ATOM 679 HH11 ARG 214 -28.462 -7.685 3.296 1.00 0.00 H +ATOM 680 HH12 ARG 214 -28.912 -8.997 4.327 1.00 0.00 H +ATOM 681 NH2 ARG 214 -30.589 -10.032 2.782 1.00 0.00 N +ATOM 682 HH21 ARG 214 -31.240 -10.358 2.092 1.00 0.00 H +ATOM 683 HH22 ARG 214 -30.494 -10.521 3.648 1.00 0.00 H +ATOM 684 C ARG 214 -26.916 -4.468 -2.353 1.00 0.00 C +ATOM 685 O ARG 214 -27.527 -3.411 -2.529 1.00 0.00 O +ATOM 686 N ARG 215 -25.598 -4.531 -2.240 1.00 0.00 N +ATOM 687 H ARG 215 -25.218 -5.484 -2.074 1.00 0.00 H +ATOM 688 CA ARG 215 -24.772 -3.343 -2.344 1.00 0.00 C +ATOM 689 HA ARG 215 -25.251 -2.571 -1.903 1.00 0.00 H +ATOM 690 CB ARG 215 -23.456 -3.579 -1.595 1.00 0.00 C +ATOM 691 HB2 ARG 215 -23.668 -3.684 -0.620 1.00 0.00 H +ATOM 692 HB3 ARG 215 -23.054 -4.433 -1.934 1.00 0.00 H +ATOM 693 CG ARG 215 -22.404 -2.483 -1.729 1.00 0.00 C +ATOM 694 HG2 ARG 215 -21.960 -2.554 -2.610 1.00 0.00 H +ATOM 695 HG3 ARG 215 -22.830 -1.598 -1.612 1.00 0.00 H +ATOM 696 CD ARG 215 -21.336 -2.642 -0.644 1.00 0.00 C +ATOM 697 HD2 ARG 215 -20.586 -2.020 -0.858 1.00 0.00 H +ATOM 698 HD3 ARG 215 -21.748 -2.390 0.229 1.00 0.00 H +ATOM 699 NE ARG 215 -20.817 -4.012 -0.557 1.00 0.00 N +ATOM 700 HE ARG 215 -21.280 -4.645 0.082 1.00 0.00 H +ATOM 701 CZ ARG 215 -19.786 -4.485 -1.253 1.00 0.00 C +ATOM 702 NH1 ARG 215 -19.136 -3.710 -2.101 1.00 0.00 N +ATOM 703 HH11 ARG 215 -19.389 -2.752 -2.223 1.00 0.00 H +ATOM 704 HH12 ARG 215 -18.369 -4.086 -2.636 1.00 0.00 H +ATOM 705 NH2 ARG 215 -19.408 -5.743 -1.095 1.00 0.00 N +ATOM 706 HH21 ARG 215 -19.886 -6.331 -0.437 1.00 0.00 H +ATOM 707 HH22 ARG 215 -18.646 -6.112 -1.627 1.00 0.00 H +ATOM 708 C ARG 215 -24.504 -2.978 -3.798 1.00 0.00 C +ATOM 709 O ARG 215 -24.844 -1.875 -4.230 1.00 0.00 O +ATOM 710 N VAL 216 -23.937 -3.911 -4.560 1.00 0.00 N +ATOM 711 H VAL 216 -23.767 -4.818 -4.080 1.00 0.00 H +ATOM 712 CA VAL 216 -23.588 -3.665 -5.956 1.00 0.00 C +ATOM 713 HA VAL 216 -23.173 -2.734 -6.016 1.00 0.00 H +ATOM 714 CB VAL 216 -22.501 -4.669 -6.424 1.00 0.00 C +ATOM 715 HB VAL 216 -22.904 -5.579 -6.390 1.00 0.00 H +ATOM 716 CG1 VAL 216 -22.107 -4.403 -7.864 1.00 0.00 C +ATOM 717 HG11 VAL 216 -21.477 -5.115 -8.178 1.00 0.00 H +ATOM 718 HG12 VAL 216 -22.924 -4.406 -8.443 1.00 0.00 H +ATOM 719 HG13 VAL 216 -21.658 -3.511 -7.931 1.00 0.00 H +ATOM 720 CG2 VAL 216 -21.285 -4.550 -5.521 1.00 0.00 C +ATOM 721 HG21 VAL 216 -21.276 -5.314 -4.875 1.00 0.00 H +ATOM 722 HG22 VAL 216 -20.455 -4.572 -6.079 1.00 0.00 H +ATOM 723 HG23 VAL 216 -21.329 -3.686 -5.018 1.00 0.00 H +ATOM 724 C VAL 216 -24.770 -3.707 -6.922 1.00 0.00 C +ATOM 725 O VAL 216 -24.858 -2.883 -7.834 1.00 0.00 O +ATOM 726 N GLY 217 -25.667 -4.672 -6.741 1.00 0.00 N +ATOM 727 H GLY 217 -25.482 -5.307 -5.955 1.00 0.00 H +ATOM 728 CA GLY 217 -26.813 -4.773 -7.627 1.00 0.00 C +ATOM 729 HA2 GLY 217 -26.491 -4.980 -8.572 1.00 0.00 H +ATOM 730 HA3 GLY 217 -27.391 -5.563 -7.341 1.00 0.00 H +ATOM 731 C GLY 217 -27.671 -3.518 -7.660 1.00 0.00 C +ATOM 732 O GLY 217 -28.157 -3.111 -8.712 1.00 0.00 O +ATOM 733 N ASP 218 -27.863 -2.905 -6.500 1.00 0.00 N +ATOM 734 H ASP 218 -27.396 -3.356 -5.686 1.00 0.00 H +ATOM 735 CA ASP 218 -28.667 -1.695 -6.391 1.00 0.00 C +ATOM 736 HA ASP 218 -29.551 -1.881 -6.844 1.00 0.00 H +ATOM 737 CB ASP 218 -28.881 -1.366 -4.912 1.00 0.00 C +ATOM 738 HB2 ASP 218 -27.995 -1.323 -4.472 1.00 0.00 H +ATOM 739 HB3 ASP 218 -29.351 -0.498 -4.852 1.00 0.00 H +ATOM 740 CG ASP 218 -29.725 -2.426 -4.199 1.00 0.00 C +ATOM 741 OD1 ASP 218 -29.671 -3.617 -4.593 1.00 0.00 O +ATOM 742 OD2 ASP 218 -30.443 -2.080 -3.231 1.00 0.00 O +ATOM 743 C ASP 218 -28.031 -0.518 -7.125 1.00 0.00 C +ATOM 744 O ASP 218 -28.728 0.302 -7.718 1.00 0.00 O +ATOM 745 N GLY 219 -26.705 -0.442 -7.097 1.00 0.00 N +ATOM 746 H GLY 219 -26.229 -1.187 -6.572 1.00 0.00 H +ATOM 747 CA GLY 219 -26.027 0.643 -7.780 1.00 0.00 C +ATOM 748 HA2 GLY 219 -26.419 1.527 -7.483 1.00 0.00 H +ATOM 749 HA3 GLY 219 -25.048 0.643 -7.527 1.00 0.00 H +ATOM 750 C GLY 219 -26.152 0.524 -9.291 1.00 0.00 C +ATOM 751 O GLY 219 -26.279 1.531 -9.995 1.00 0.00 O +ATOM 752 N VAL 220 -26.126 -0.709 -9.786 1.00 0.00 N +ATOM 753 H VAL 220 -26.028 -1.462 -9.075 1.00 0.00 H +ATOM 754 CA VAL 220 -26.228 -0.966 -11.217 1.00 0.00 C +ATOM 755 HA VAL 220 -25.505 -0.431 -11.685 1.00 0.00 H +ATOM 756 CB VAL 220 -26.008 -2.470 -11.526 1.00 0.00 C +ATOM 757 HB VAL 220 -26.700 -2.979 -11.027 1.00 0.00 H +ATOM 758 CG1 VAL 220 -26.224 -2.738 -13.001 1.00 0.00 C +ATOM 759 HG11 VAL 220 -25.631 -3.488 -13.298 1.00 0.00 H +ATOM 760 HG12 VAL 220 -27.180 -2.990 -13.162 1.00 0.00 H +ATOM 761 HG13 VAL 220 -26.006 -1.916 -13.529 1.00 0.00 H +ATOM 762 CG2 VAL 220 -24.601 -2.884 -11.109 1.00 0.00 C +ATOM 763 HG21 VAL 220 -24.131 -2.097 -10.711 1.00 0.00 H +ATOM 764 HG22 VAL 220 -24.661 -3.618 -10.434 1.00 0.00 H +ATOM 765 HG23 VAL 220 -24.101 -3.205 -11.913 1.00 0.00 H +ATOM 766 C VAL 220 -27.572 -0.539 -11.796 1.00 0.00 C +ATOM 767 O VAL 220 -27.629 0.062 -12.865 1.00 0.00 O +ATOM 768 N GLN 221 -28.653 -0.860 -11.092 1.00 0.00 N +ATOM 769 H GLN 221 -28.465 -1.365 -10.207 1.00 0.00 H +ATOM 770 CA GLN 221 -29.991 -0.514 -11.556 1.00 0.00 C +ATOM 771 HA GLN 221 -30.109 -0.894 -12.482 1.00 0.00 H +ATOM 772 CB GLN 221 -31.044 -1.094 -10.606 1.00 0.00 C +ATOM 773 HB2 GLN 221 -30.895 -0.710 -9.689 1.00 0.00 H +ATOM 774 HB3 GLN 221 -31.955 -0.815 -10.928 1.00 0.00 H +ATOM 775 CG GLN 221 -31.032 -2.613 -10.488 1.00 0.00 C +ATOM 776 HG2 GLN 221 -31.214 -3.006 -11.385 1.00 0.00 H +ATOM 777 HG3 GLN 221 -30.136 -2.903 -10.163 1.00 0.00 H +ATOM 778 CD GLN 221 -32.088 -3.121 -9.514 1.00 0.00 C +ATOM 779 OE1 GLN 221 -31.765 -3.778 -8.530 1.00 0.00 O +ATOM 780 NE2 GLN 221 -33.352 -2.822 -9.790 1.00 0.00 N +ATOM 781 HE21 GLN 221 -34.106 -3.139 -9.194 1.00 0.00 H +ATOM 782 HE22 GLN 221 -33.552 -2.262 -10.620 1.00 0.00 H +ATOM 783 C GLN 221 -30.175 1.002 -11.652 1.00 0.00 C +ATOM 784 O GLN 221 -30.936 1.487 -12.489 1.00 0.00 O +ATOM 785 N ARG 222 -29.482 1.740 -10.785 1.00 0.00 N +ATOM 786 H ARG 222 -28.895 1.194 -10.123 1.00 0.00 H +ATOM 787 CA ARG 222 -29.554 3.198 -10.780 1.00 0.00 C +ATOM 788 HA ARG 222 -30.497 3.478 -10.985 1.00 0.00 H +ATOM 789 CB ARG 222 -29.146 3.743 -9.411 1.00 0.00 C +ATOM 790 HB2 ARG 222 -28.240 3.386 -9.190 1.00 0.00 H +ATOM 791 HB3 ARG 222 -29.110 4.739 -9.469 1.00 0.00 H +ATOM 792 CG ARG 222 -30.087 3.373 -8.273 1.00 0.00 C +ATOM 793 HG2 ARG 222 -30.510 2.489 -8.463 1.00 0.00 H +ATOM 794 HG3 ARG 222 -29.574 3.324 -7.418 1.00 0.00 H +ATOM 795 CD ARG 222 -31.205 4.401 -8.091 1.00 0.00 C +ATOM 796 HD2 ARG 222 -31.701 4.164 -7.261 1.00 0.00 H +ATOM 797 HD3 ARG 222 -30.779 5.296 -7.994 1.00 0.00 H +ATOM 798 NE ARG 222 -32.111 4.409 -9.220 1.00 0.00 N +ATOM 799 HE ARG 222 -32.021 3.673 -9.908 1.00 0.00 H +ATOM 800 CZ ARG 222 -33.062 5.320 -9.423 1.00 0.00 C +ATOM 801 NH1 ARG 222 -33.254 6.320 -8.557 1.00 0.00 N +ATOM 802 HH11 ARG 222 -32.669 6.405 -7.754 1.00 0.00 H +ATOM 803 HH12 ARG 222 -33.986 6.982 -8.719 1.00 0.00 H +ATOM 804 NH2 ARG 222 -33.795 5.265 -10.528 1.00 0.00 N +ATOM 805 HH21 ARG 222 -33.618 4.554 -11.211 1.00 0.00 H +ATOM 806 HH22 ARG 222 -34.523 5.933 -10.681 1.00 0.00 H +ATOM 807 C ARG 222 -28.630 3.781 -11.846 1.00 0.00 C +ATOM 808 O ARG 222 -29.035 4.643 -12.633 1.00 0.00 O +ATOM 809 N ASN 223 -27.386 3.304 -11.867 1.00 0.00 N +ATOM 810 H ASN 223 -27.178 2.587 -11.153 1.00 0.00 H +ATOM 811 CA ASN 223 -26.412 3.784 -12.845 1.00 0.00 C +ATOM 812 HA ASN 223 -26.346 4.788 -12.729 1.00 0.00 H +ATOM 813 CB ASN 223 -25.052 3.121 -12.625 1.00 0.00 C +ATOM 814 HB2 ASN 223 -25.205 2.158 -12.418 1.00 0.00 H +ATOM 815 HB3 ASN 223 -24.523 3.209 -13.466 1.00 0.00 H +ATOM 816 CG ASN 223 -24.284 3.747 -11.496 1.00 0.00 C +ATOM 817 OD1 ASN 223 -24.321 4.960 -11.310 1.00 0.00 O +ATOM 818 ND2 ASN 223 -23.569 2.929 -10.741 1.00 0.00 N +ATOM 819 HD21 ASN 223 -23.040 3.287 -9.970 1.00 0.00 H +ATOM 820 HD22 ASN 223 -23.554 1.946 -10.939 1.00 0.00 H +ATOM 821 C ASN 223 -26.845 3.528 -14.280 1.00 0.00 C +ATOM 822 O ASN 223 -26.482 4.267 -15.189 1.00 0.00 O +ATOM 823 N HIE 224 -27.626 2.479 -14.479 1.00 0.00 N +ATOM 824 H HIE 224 -27.882 1.952 -13.625 1.00 0.00 H +ATOM 825 CA HIE 224 -28.068 2.127 -15.810 1.00 0.00 C +ATOM 826 HA HIE 224 -27.697 2.802 -16.464 1.00 0.00 H +ATOM 827 CB HIE 224 -27.465 0.762 -16.162 1.00 0.00 C +ATOM 828 HB2 HIE 224 -27.749 0.092 -15.474 1.00 0.00 H +ATOM 829 HB3 HIE 224 -27.804 0.478 -17.060 1.00 0.00 H +ATOM 830 CG HIE 224 -25.966 0.787 -16.208 1.00 0.00 C +ATOM 831 ND1 HIE 224 -25.278 1.419 -17.219 1.00 0.00 N +ATOM 832 CE1 HIE 224 -23.982 1.395 -16.948 1.00 0.00 C +ATOM 833 HE1 HIE 224 -23.263 1.785 -17.515 1.00 0.00 H +ATOM 834 NE2 HIE 224 -23.808 0.766 -15.803 1.00 0.00 N +ATOM 835 HE2 HIE 224 -22.922 0.599 -15.348 1.00 0.00 H +ATOM 836 CD2 HIE 224 -25.033 0.367 -15.317 1.00 0.00 C +ATOM 837 HD2 HIE 224 -25.199 -0.133 -14.475 1.00 0.00 H +ATOM 838 C HIE 224 -29.589 2.151 -15.920 1.00 0.00 C +ATOM 839 O HIE 224 -30.184 1.417 -16.696 1.00 0.00 O +ATOM 840 N GLU 225 -30.198 3.056 -15.157 1.00 0.00 N +ATOM 841 H GLU 225 -29.545 3.640 -14.582 1.00 0.00 H +ATOM 842 CA GLU 225 -31.647 3.223 -15.122 1.00 0.00 C +ATOM 843 HA GLU 225 -32.064 2.437 -14.627 1.00 0.00 H +ATOM 844 CB GLU 225 -32.009 4.470 -14.313 1.00 0.00 C +ATOM 845 HB2 GLU 225 -31.779 4.294 -13.373 1.00 0.00 H +ATOM 846 HB3 GLU 225 -31.502 5.226 -14.684 1.00 0.00 H +ATOM 847 CG GLU 225 -33.485 4.834 -14.366 1.00 0.00 C +ATOM 848 HG2 GLU 225 -33.750 4.902 -15.307 1.00 0.00 H +ATOM 849 HG3 GLU 225 -33.989 4.148 -13.879 1.00 0.00 H +ATOM 850 CD GLU 225 -33.767 6.167 -13.709 1.00 0.00 C +ATOM 851 OE1 GLU 225 -34.384 6.172 -12.627 1.00 0.00 O +ATOM 852 OE2 GLU 225 -33.367 7.211 -14.275 1.00 0.00 O +ATOM 853 C GLU 225 -32.279 3.340 -16.501 1.00 0.00 C +ATOM 854 O GLU 225 -33.199 2.598 -16.844 1.00 0.00 O +ATOM 855 N THR 226 -31.799 4.295 -17.283 1.00 0.00 N +ATOM 856 H THR 226 -31.027 4.852 -16.875 1.00 0.00 H +ATOM 857 CA THR 226 -32.340 4.519 -18.614 1.00 0.00 C +ATOM 858 HA THR 226 -33.312 4.798 -18.524 1.00 0.00 H +ATOM 859 CB THR 226 -31.601 5.678 -19.321 1.00 0.00 C +ATOM 860 HB THR 226 -30.630 5.406 -19.466 1.00 0.00 H +ATOM 861 CG2 THR 226 -32.278 6.016 -20.645 1.00 0.00 C +ATOM 862 HG21 THR 226 -33.265 5.859 -20.570 1.00 0.00 H +ATOM 863 HG22 THR 226 -32.114 6.978 -20.873 1.00 0.00 H +ATOM 864 HG23 THR 226 -31.906 5.437 -21.373 1.00 0.00 H +ATOM 865 OG1 THR 226 -31.622 6.837 -18.478 1.00 0.00 O +ATOM 866 HG1 THR 226 -32.024 6.612 -17.584 1.00 0.00 H +ATOM 867 C THR 226 -32.285 3.274 -19.493 1.00 0.00 C +ATOM 868 O THR 226 -33.275 2.921 -20.132 1.00 0.00 O +ATOM 869 N ALA 227 -31.140 2.604 -19.535 1.00 0.00 N +ATOM 870 H ALA 227 -30.377 2.985 -18.965 1.00 0.00 H +ATOM 871 CA ALA 227 -31.030 1.404 -20.360 1.00 0.00 C +ATOM 872 HA ALA 227 -31.313 1.626 -21.299 1.00 0.00 H +ATOM 873 CB ALA 227 -29.587 0.923 -20.403 1.00 0.00 C +ATOM 874 HB1 ALA 227 -29.545 0.033 -20.856 1.00 0.00 H +ATOM 875 HB2 ALA 227 -29.030 1.580 -20.910 1.00 0.00 H +ATOM 876 HB3 ALA 227 -29.235 0.839 -19.471 1.00 0.00 H +ATOM 877 C ALA 227 -31.946 0.291 -19.831 1.00 0.00 C +ATOM 878 O ALA 227 -32.558 -0.445 -20.607 1.00 0.00 O +ATOM 879 N PHE 228 -32.040 0.180 -18.508 1.00 0.00 N +ATOM 880 H PHE 228 -31.483 0.867 -17.970 1.00 0.00 H +ATOM 881 CA PHE 228 -32.875 -0.845 -17.894 1.00 0.00 C +ATOM 882 HA PHE 228 -32.609 -1.726 -18.303 1.00 0.00 H +ATOM 883 CB PHE 228 -32.657 -0.863 -16.376 1.00 0.00 C +ATOM 884 HB2 PHE 228 -32.453 0.057 -16.087 1.00 0.00 H +ATOM 885 HB3 PHE 228 -33.480 -1.206 -15.955 1.00 0.00 H +ATOM 886 CG PHE 228 -31.509 -1.751 -15.940 1.00 0.00 C +ATOM 887 CD1 PHE 228 -30.329 -1.796 -16.678 1.00 0.00 C +ATOM 888 HD1 PHE 228 -30.236 -1.239 -17.499 1.00 0.00 H +ATOM 889 CE1 PHE 228 -29.267 -2.610 -16.286 1.00 0.00 C +ATOM 890 HE1 PHE 228 -28.428 -2.631 -16.841 1.00 0.00 H +ATOM 891 CZ PHE 228 -29.369 -3.390 -15.134 1.00 0.00 C +ATOM 892 HZ PHE 228 -28.607 -3.965 -14.854 1.00 0.00 H +ATOM 893 CE2 PHE 228 -30.542 -3.356 -14.382 1.00 0.00 C +ATOM 894 HE2 PHE 228 -30.638 -3.918 -13.551 1.00 0.00 H +ATOM 895 CD2 PHE 228 -31.606 -2.531 -14.785 1.00 0.00 C +ATOM 896 HD2 PHE 228 -32.438 -2.504 -14.237 1.00 0.00 H +ATOM 897 C PHE 228 -34.346 -0.630 -18.234 1.00 0.00 C +ATOM 898 O PHE 228 -35.036 -1.576 -18.613 1.00 0.00 O +ATOM 899 N GLN 229 -34.822 0.609 -18.104 1.00 0.00 N +ATOM 900 H GLN 229 -34.143 1.306 -17.757 1.00 0.00 H +ATOM 901 CA GLN 229 -36.212 0.925 -18.437 1.00 0.00 C +ATOM 902 HA GLN 229 -36.802 0.315 -17.914 1.00 0.00 H +ATOM 903 CB GLN 229 -36.517 2.409 -18.220 1.00 0.00 C +ATOM 904 HB2 GLN 229 -35.962 2.948 -18.880 1.00 0.00 H +ATOM 905 HB3 GLN 229 -37.494 2.572 -18.458 1.00 0.00 H +ATOM 906 CG GLN 229 -36.275 2.978 -16.835 1.00 0.00 C +ATOM 907 HG2 GLN 229 -36.906 2.557 -16.194 1.00 0.00 H +ATOM 908 HG3 GLN 229 -35.335 2.800 -16.569 1.00 0.00 H +ATOM 909 CD GLN 229 -36.503 4.493 -16.807 1.00 0.00 C +ATOM 910 OE1 GLN 229 -37.320 4.990 -16.022 1.00 0.00 O +ATOM 911 NE2 GLN 229 -35.779 5.232 -17.659 1.00 0.00 N +ATOM 912 HE21 GLN 229 -35.892 6.229 -17.699 1.00 0.00 H +ATOM 913 HE22 GLN 229 -35.111 4.755 -18.263 1.00 0.00 H +ATOM 914 C GLN 229 -36.435 0.633 -19.922 1.00 0.00 C +ATOM 915 O GLN 229 -37.483 0.135 -20.321 1.00 0.00 O +ATOM 916 N GLY 230 -35.441 0.976 -20.732 1.00 0.00 N +ATOM 917 H GLY 230 -34.618 1.394 -20.266 1.00 0.00 H +ATOM 918 CA GLY 230 -35.540 0.763 -22.165 1.00 0.00 C +ATOM 919 HA2 GLY 230 -36.349 1.273 -22.524 1.00 0.00 H +ATOM 920 HA3 GLY 230 -34.723 1.173 -22.621 1.00 0.00 H +ATOM 921 C GLY 230 -35.654 -0.692 -22.564 1.00 0.00 C +ATOM 922 O GLY 230 -36.481 -1.049 -23.410 1.00 0.00 O +ATOM 923 N MET 231 -34.824 -1.535 -21.957 1.00 0.00 N +ATOM 924 H MET 231 -34.183 -1.102 -21.270 1.00 0.00 H +ATOM 925 CA MET 231 -34.844 -2.958 -22.262 1.00 0.00 C +ATOM 926 HA MET 231 -34.808 -3.069 -23.257 1.00 0.00 H +ATOM 927 CB MET 231 -33.647 -3.666 -21.615 1.00 0.00 C +ATOM 928 HB2 MET 231 -32.797 -3.241 -21.947 1.00 0.00 H +ATOM 929 HB3 MET 231 -33.695 -3.543 -20.617 1.00 0.00 H +ATOM 930 CG MET 231 -33.583 -5.163 -21.911 1.00 0.00 C +ATOM 931 HG2 MET 231 -32.788 -5.561 -21.399 1.00 0.00 H +ATOM 932 HG3 MET 231 -34.416 -5.610 -21.511 1.00 0.00 H +ATOM 933 SD MET 231 -33.450 -5.539 -23.685 1.00 0.00 S +ATOM 934 CE MET 231 -32.706 -7.161 -23.630 1.00 0.00 C +ATOM 935 HE1 MET 231 -32.654 -7.541 -24.556 1.00 0.00 H +ATOM 936 HE2 MET 231 -31.782 -7.097 -23.248 1.00 0.00 H +ATOM 937 HE3 MET 231 -33.259 -7.768 -23.055 1.00 0.00 H +ATOM 938 C MET 231 -36.150 -3.574 -21.767 1.00 0.00 C +ATOM 939 O MET 231 -36.762 -4.372 -22.472 1.00 0.00 O +ATOM 940 N LEU 232 -36.589 -3.202 -20.565 1.00 0.00 N +ATOM 941 H LEU 232 -36.000 -2.524 -20.067 1.00 0.00 H +ATOM 942 CA LEU 232 -37.835 -3.753 -20.035 1.00 0.00 C +ATOM 943 HA LEU 232 -37.737 -4.753 -19.955 1.00 0.00 H +ATOM 944 CB LEU 232 -38.108 -3.214 -18.619 1.00 0.00 C +ATOM 945 HB2 LEU 232 -37.344 -3.478 -18.041 1.00 0.00 H +ATOM 946 HB3 LEU 232 -38.178 -2.226 -18.678 1.00 0.00 H +ATOM 947 CG LEU 232 -39.392 -3.726 -17.941 1.00 0.00 C +ATOM 948 HG LEU 232 -40.171 -3.491 -18.518 1.00 0.00 H +ATOM 949 CD1 LEU 232 -39.318 -5.224 -17.761 1.00 0.00 C +ATOM 950 HD11 LEU 232 -38.530 -5.459 -17.188 1.00 0.00 H +ATOM 951 HD12 LEU 232 -40.155 -5.555 -17.320 1.00 0.00 H +ATOM 952 HD13 LEU 232 -39.220 -5.669 -18.653 1.00 0.00 H +ATOM 953 CD2 LEU 232 -39.595 -3.050 -16.608 1.00 0.00 C +ATOM 954 HD21 LEU 232 -39.673 -2.058 -16.737 1.00 0.00 H +ATOM 955 HD22 LEU 232 -40.434 -3.391 -16.176 1.00 0.00 H +ATOM 956 HD23 LEU 232 -38.816 -3.241 -16.006 1.00 0.00 H +ATOM 957 C LEU 232 -39.024 -3.463 -20.965 1.00 0.00 C +ATOM 958 O LEU 232 -39.825 -4.358 -21.258 1.00 0.00 O +ATOM 959 N ARG 233 -39.128 -2.222 -21.441 1.00 0.00 N +ATOM 960 H ARG 233 -38.392 -1.567 -21.116 1.00 0.00 H +ATOM 961 CA ARG 233 -40.209 -1.829 -22.355 1.00 0.00 C +ATOM 962 HA ARG 233 -41.088 -1.993 -21.902 1.00 0.00 H +ATOM 963 CB ARG 233 -40.090 -0.339 -22.721 1.00 0.00 C +ATOM 964 HB2 ARG 233 -40.217 0.195 -21.889 1.00 0.00 H +ATOM 965 HB3 ARG 233 -39.178 -0.183 -23.090 1.00 0.00 H +ATOM 966 CG ARG 233 -41.106 0.149 -23.754 1.00 0.00 C +ATOM 967 HG2 ARG 233 -40.816 -0.134 -24.658 1.00 0.00 H +ATOM 968 HG3 ARG 233 -41.999 -0.219 -23.534 1.00 0.00 H +ATOM 969 CD ARG 233 -41.191 1.664 -23.727 1.00 0.00 C +ATOM 970 HD2 ARG 233 -40.826 1.981 -22.864 1.00 0.00 H +ATOM 971 HD3 ARG 233 -40.667 2.018 -24.489 1.00 0.00 H +ATOM 972 NE ARG 233 -42.583 2.097 -23.853 1.00 0.00 N +ATOM 973 HE ARG 233 -43.096 2.270 -22.997 1.00 0.00 H +ATOM 974 CZ ARG 233 -43.223 2.280 -25.000 1.00 0.00 C +ATOM 975 NH1 ARG 233 -42.604 2.085 -26.154 1.00 0.00 N +ATOM 976 HH11 ARG 233 -41.655 1.779 -26.184 1.00 0.00 H +ATOM 977 HH12 ARG 233 -43.096 2.246 -27.018 1.00 0.00 H +ATOM 978 NH2 ARG 233 -44.495 2.646 -24.990 1.00 0.00 N +ATOM 979 HH21 ARG 233 -44.976 2.765 -24.118 1.00 0.00 H +ATOM 980 HH22 ARG 233 -44.981 2.804 -25.850 1.00 0.00 H +ATOM 981 C ARG 233 -40.147 -2.669 -23.628 1.00 0.00 C +ATOM 982 O ARG 233 -41.156 -3.186 -24.111 1.00 0.00 O +ATOM 983 N ARG 234 -38.945 -2.788 -24.172 1.00 0.00 N +ATOM 984 H ARG 234 -38.161 -2.304 -23.758 1.00 0.00 H +ATOM 985 CA ARG 234 -38.717 -3.558 -25.377 1.00 0.00 C +ATOM 986 HA ARG 234 -39.267 -3.121 -26.210 1.00 0.00 H +ATOM 987 CB ARG 234 -37.226 -3.516 -25.701 1.00 0.00 C +ATOM 988 HB2 ARG 234 -36.913 -2.481 -25.840 1.00 0.00 H +ATOM 989 HB3 ARG 234 -36.663 -3.958 -24.880 1.00 0.00 H +ATOM 990 CG ARG 234 -36.961 -4.303 -26.980 1.00 0.00 C +ATOM 991 HG2 ARG 234 -37.274 -5.338 -26.842 1.00 0.00 H +ATOM 992 HG3 ARG 234 -37.524 -3.861 -27.802 1.00 0.00 H +ATOM 993 CD ARG 234 -35.472 -4.261 -27.304 1.00 0.00 C +ATOM 994 HD2 ARG 234 -35.159 -3.226 -27.443 1.00 0.00 H +ATOM 995 HD3 ARG 234 -34.908 -4.703 -26.483 1.00 0.00 H +ATOM 996 NE ARG 234 -35.177 -5.016 -28.542 1.00 0.00 N +ATOM 997 HE ARG 234 -35.941 -5.462 -29.029 1.00 0.00 H +ATOM 998 CZ ARG 234 -33.950 -5.134 -29.044 1.00 0.00 C +ATOM 999 NH1 ARG 234 -32.894 -4.576 -28.460 1.00 0.00 N +ATOM 1000 HH11 ARG 234 -33.012 -4.043 -27.610 1.00 0.00 H +ATOM 1001 HH12 ARG 234 -31.977 -4.687 -28.870 1.00 0.00 H +ATOM 1002 NH2 ARG 234 -33.799 -5.836 -30.163 1.00 0.00 N +ATOM 1003 HH21 ARG 234 -34.603 -6.259 -30.604 1.00 0.00 H +ATOM 1004 HH22 ARG 234 -32.879 -5.943 -30.568 1.00 0.00 H +ATOM 1005 C ARG 234 -39.192 -4.997 -25.225 1.00 0.00 C +ATOM 1006 O ARG 234 -39.803 -5.550 -26.143 1.00 0.00 O +ATOM 1007 N LEU 235 -38.898 -5.594 -24.072 1.00 0.00 N +ATOM 1008 H LEU 235 -38.370 -4.992 -23.399 1.00 0.00 H +ATOM 1009 CA LEU 235 -39.280 -6.971 -23.774 1.00 0.00 C +ATOM 1010 HA LEU 235 -38.951 -7.565 -24.526 1.00 0.00 H +ATOM 1011 CB LEU 235 -38.581 -7.431 -22.494 1.00 0.00 C +ATOM 1012 HB2 LEU 235 -38.735 -6.749 -21.799 1.00 0.00 H +ATOM 1013 HB3 LEU 235 -38.953 -8.307 -22.239 1.00 0.00 H +ATOM 1014 CG LEU 235 -37.066 -7.599 -22.646 1.00 0.00 C +ATOM 1015 HG LEU 235 -36.686 -6.758 -23.029 1.00 0.00 H +ATOM 1016 CD1 LEU 235 -36.429 -7.880 -21.301 1.00 0.00 C +ATOM 1017 HD11 LEU 235 -36.811 -8.721 -20.915 1.00 0.00 H +ATOM 1018 HD12 LEU 235 -35.439 -7.988 -21.412 1.00 0.00 H +ATOM 1019 HD13 LEU 235 -36.610 -7.119 -20.676 1.00 0.00 H +ATOM 1020 CD2 LEU 235 -36.785 -8.737 -23.619 1.00 0.00 C +ATOM 1021 HD21 LEU 235 -37.190 -8.524 -24.508 1.00 0.00 H +ATOM 1022 HD22 LEU 235 -35.796 -8.851 -23.722 1.00 0.00 H +ATOM 1023 HD23 LEU 235 -37.183 -9.584 -23.266 1.00 0.00 H +ATOM 1024 C LEU 235 -40.790 -7.151 -23.649 1.00 0.00 C +ATOM 1025 O LEU 235 -41.312 -8.244 -23.864 1.00 0.00 O +ATOM 1026 N ASP 236 -41.479 -6.078 -23.281 1.00 0.00 N +ATOM 1027 H ASP 236 -40.897 -5.237 -23.078 1.00 0.00 H +ATOM 1028 CA ASP 236 -42.930 -6.089 -23.174 1.00 0.00 C +ATOM 1029 HA ASP 236 -43.198 -5.284 -22.612 1.00 0.00 H +ATOM 1030 CB ASP 236 -43.512 -5.955 -24.582 1.00 0.00 C +ATOM 1031 HB2 ASP 236 -43.130 -5.134 -24.994 1.00 0.00 H +ATOM 1032 HB3 ASP 236 -43.244 -6.759 -25.102 1.00 0.00 H +ATOM 1033 CG ASP 236 -45.020 -5.848 -24.587 1.00 0.00 C +ATOM 1034 OD1 ASP 236 -45.614 -5.551 -23.527 1.00 0.00 O +ATOM 1035 OD2 ASP 236 -45.595 -6.052 -25.673 1.00 0.00 O +ATOM 1036 C ASP 236 -43.492 -7.326 -22.464 1.00 0.00 C +ATOM 1037 O ASP 236 -44.227 -8.124 -23.049 1.00 0.00 O +ATOM 1038 N ILE 237 -43.153 -7.458 -21.184 1.00 0.00 N +ATOM 1039 H ILE 237 -42.562 -6.680 -20.813 1.00 0.00 H +ATOM 1040 CA ILE 237 -43.573 -8.593 -20.373 1.00 0.00 C +ATOM 1041 HA ILE 237 -43.630 -9.385 -21.002 1.00 0.00 H +ATOM 1042 CB ILE 237 -42.572 -8.834 -19.239 1.00 0.00 C +ATOM 1043 HB ILE 237 -42.634 -8.076 -18.604 1.00 0.00 H +ATOM 1044 CG2 ILE 237 -42.882 -10.158 -18.555 1.00 0.00 C +ATOM 1045 HG21 ILE 237 -42.233 -10.309 -17.812 1.00 0.00 H +ATOM 1046 HG22 ILE 237 -43.810 -10.134 -18.186 1.00 0.00 H +ATOM 1047 HG23 ILE 237 -42.808 -10.901 -19.218 1.00 0.00 H +ATOM 1048 CG1 ILE 237 -41.151 -8.856 -19.811 1.00 0.00 C +ATOM 1049 HG12 ILE 237 -41.034 -9.703 -20.330 1.00 0.00 H +ATOM 1050 HG13 ILE 237 -41.058 -8.085 -20.443 1.00 0.00 H +ATOM 1051 CD1 ILE 237 -40.061 -8.763 -18.768 1.00 0.00 C +ATOM 1052 HD11 ILE 237 -40.136 -9.536 -18.139 1.00 0.00 H +ATOM 1053 HD12 ILE 237 -39.169 -8.784 -19.217 1.00 0.00 H +ATOM 1054 HD13 ILE 237 -40.160 -7.908 -18.260 1.00 0.00 H +ATOM 1055 C ILE 237 -44.960 -8.419 -19.768 1.00 0.00 C +ATOM 1056 O ILE 237 -45.183 -7.546 -18.917 1.00 0.00 O +ATOM 1057 N LYS 238 -45.884 -9.273 -20.199 1.00 0.00 N +ATOM 1058 H LYS 238 -45.540 -9.973 -20.889 1.00 0.00 H +ATOM 1059 CA LYS 238 -47.262 -9.218 -19.732 1.00 0.00 C +ATOM 1060 HA LYS 238 -47.355 -8.439 -19.081 1.00 0.00 H +ATOM 1061 CB LYS 238 -48.179 -8.957 -20.924 1.00 0.00 C +ATOM 1062 HB2 LYS 238 -48.145 -9.754 -21.526 1.00 0.00 H +ATOM 1063 HB3 LYS 238 -49.111 -8.837 -20.582 1.00 0.00 H +ATOM 1064 CG LYS 238 -47.810 -7.728 -21.741 1.00 0.00 C +ATOM 1065 HG2 LYS 238 -48.003 -6.906 -21.206 1.00 0.00 H +ATOM 1066 HG3 LYS 238 -46.837 -7.760 -21.966 1.00 0.00 H +ATOM 1067 CD LYS 238 -48.610 -7.654 -23.052 1.00 0.00 C +ATOM 1068 HD2 LYS 238 -49.480 -8.117 -22.922 1.00 0.00 H +ATOM 1069 HD3 LYS 238 -48.756 -6.699 -23.285 1.00 0.00 H +ATOM 1070 CE LYS 238 -47.874 -8.330 -24.227 1.00 0.00 C +ATOM 1071 HE2 LYS 238 -48.518 -8.438 -24.988 1.00 0.00 H +ATOM 1072 HE3 LYS 238 -47.121 -7.735 -24.517 1.00 0.00 H +ATOM 1073 NZ LYS 238 -47.318 -9.681 -23.860 1.00 0.00 N +ATOM 1074 HZ1 LYS 238 -47.680 -10.361 -24.492 1.00 0.00 H +ATOM 1075 HZ2 LYS 238 -46.324 -9.649 -23.925 1.00 0.00 H +ATOM 1076 HZ3 LYS 238 -47.593 -9.900 -22.927 1.00 0.00 H +ATOM 1077 C LYS 238 -47.726 -10.489 -19.030 1.00 0.00 C +ATOM 1078 O LYS 238 -48.572 -10.441 -18.132 1.00 0.00 O +ATOM 1079 N ASN 239 -47.178 -11.625 -19.441 1.00 0.00 N +ATOM 1080 H ASN 239 -46.461 -11.534 -20.173 1.00 0.00 H +ATOM 1081 CA ASN 239 -47.600 -12.889 -18.861 1.00 0.00 C +ATOM 1082 HA ASN 239 -47.917 -12.691 -17.910 1.00 0.00 H +ATOM 1083 CB ASN 239 -48.744 -13.446 -19.706 1.00 0.00 C +ATOM 1084 HB2 ASN 239 -48.927 -14.379 -19.418 1.00 0.00 H +ATOM 1085 HB3 ASN 239 -49.546 -12.875 -19.570 1.00 0.00 H +ATOM 1086 CG ASN 239 -48.407 -13.458 -21.193 1.00 0.00 C +ATOM 1087 OD1 ASN 239 -47.492 -14.166 -21.637 1.00 0.00 O +ATOM 1088 ND2 ASN 239 -49.138 -12.669 -21.970 1.00 0.00 N +ATOM 1089 HD21 ASN 239 -48.969 -12.636 -22.955 1.00 0.00 H +ATOM 1090 HD22 ASN 239 -49.861 -12.103 -21.569 1.00 0.00 H +ATOM 1091 C ASN 239 -46.506 -13.939 -18.750 1.00 0.00 C +ATOM 1092 O ASN 239 -45.313 -13.666 -18.947 1.00 0.00 O +ATOM 1093 N GLU 240 -46.952 -15.156 -18.459 1.00 0.00 N +ATOM 1094 H GLU 240 -48.000 -15.208 -18.353 1.00 0.00 H +ATOM 1095 CA GLU 240 -46.091 -16.315 -18.299 1.00 0.00 C +ATOM 1096 HA GLU 240 -45.426 -16.146 -17.552 1.00 0.00 H +ATOM 1097 CB GLU 240 -46.957 -17.490 -17.848 1.00 0.00 C +ATOM 1098 HB2 GLU 240 -47.330 -17.258 -16.955 1.00 0.00 H +ATOM 1099 HB3 GLU 240 -47.690 -17.591 -18.512 1.00 0.00 H +ATOM 1100 CG GLU 240 -46.262 -18.822 -17.724 1.00 0.00 C +ATOM 1101 HG2 GLU 240 -46.068 -19.159 -18.621 1.00 0.00 H +ATOM 1102 HG3 GLU 240 -45.463 -18.710 -17.173 1.00 0.00 H +ATOM 1103 CD GLU 240 -47.151 -19.838 -17.037 1.00 0.00 C +ATOM 1104 OE1 GLU 240 -48.271 -20.067 -17.540 1.00 0.00 O +ATOM 1105 OE2 GLU 240 -46.731 -20.397 -15.997 1.00 0.00 O +ATOM 1106 C GLU 240 -45.330 -16.660 -19.577 1.00 0.00 C +ATOM 1107 O GLU 240 -44.142 -16.980 -19.526 1.00 0.00 O +ATOM 1108 N ASP 241 -46.003 -16.593 -20.721 1.00 0.00 N +ATOM 1109 H ASP 241 -46.986 -16.316 -20.645 1.00 0.00 H +ATOM 1110 CA ASP 241 -45.327 -16.906 -21.970 1.00 0.00 C +ATOM 1111 HA ASP 241 -44.904 -17.812 -21.866 1.00 0.00 H +ATOM 1112 CB ASP 241 -46.316 -16.953 -23.145 1.00 0.00 C +ATOM 1113 HB2 ASP 241 -46.894 -16.152 -23.094 1.00 0.00 H +ATOM 1114 HB3 ASP 241 -45.796 -16.967 -23.985 1.00 0.00 H +ATOM 1115 CG ASP 241 -47.208 -18.199 -23.103 1.00 0.00 C +ATOM 1116 OD1 ASP 241 -46.773 -19.234 -22.538 1.00 0.00 O +ATOM 1117 OD2 ASP 241 -48.335 -18.158 -23.643 1.00 0.00 O +ATOM 1118 C ASP 241 -44.188 -15.913 -22.229 1.00 0.00 C +ATOM 1119 O ASP 241 -43.108 -16.313 -22.680 1.00 0.00 O +ATOM 1120 N ASP 242 -44.404 -14.628 -21.944 1.00 0.00 N +ATOM 1121 H ASP 242 -45.338 -14.393 -21.607 1.00 0.00 H +ATOM 1122 CA ASP 242 -43.319 -13.655 -22.126 1.00 0.00 C +ATOM 1123 HA ASP 242 -42.953 -13.790 -23.048 1.00 0.00 H +ATOM 1124 CB ASP 242 -43.792 -12.217 -21.884 1.00 0.00 C +ATOM 1125 HB2 ASP 242 -44.008 -12.126 -20.917 1.00 0.00 H +ATOM 1126 HB3 ASP 242 -43.047 -11.606 -22.130 1.00 0.00 H +ATOM 1127 CG ASP 242 -45.015 -11.852 -22.695 1.00 0.00 C +ATOM 1128 OD1 ASP 242 -45.044 -12.127 -23.907 1.00 0.00 O +ATOM 1129 OD2 ASP 242 -45.950 -11.279 -22.106 1.00 0.00 O +ATOM 1130 C ASP 242 -42.181 -13.949 -21.144 1.00 0.00 C +ATOM 1131 O ASP 242 -41.015 -13.758 -21.470 1.00 0.00 O +ATOM 1132 N VAL 243 -42.505 -14.396 -19.934 1.00 0.00 N +ATOM 1133 H VAL 243 -43.506 -14.513 -19.754 1.00 0.00 H +ATOM 1134 CA VAL 243 -41.453 -14.684 -18.965 1.00 0.00 C +ATOM 1135 HA VAL 243 -40.864 -13.877 -18.892 1.00 0.00 H +ATOM 1136 CB VAL 243 -42.030 -15.023 -17.558 1.00 0.00 C +ATOM 1137 HB VAL 243 -42.661 -15.780 -17.672 1.00 0.00 H +ATOM 1138 CG1 VAL 243 -40.915 -15.500 -16.632 1.00 0.00 C +ATOM 1139 HG11 VAL 243 -40.495 -16.322 -17.014 1.00 0.00 H +ATOM 1140 HG12 VAL 243 -40.225 -14.782 -16.546 1.00 0.00 H +ATOM 1141 HG13 VAL 243 -41.297 -15.707 -15.732 1.00 0.00 H +ATOM 1142 CG2 VAL 243 -42.699 -13.795 -16.959 1.00 0.00 C +ATOM 1143 HG21 VAL 243 -43.686 -13.851 -17.107 1.00 0.00 H +ATOM 1144 HG22 VAL 243 -42.507 -13.760 -15.978 1.00 0.00 H +ATOM 1145 HG23 VAL 243 -42.339 -12.974 -17.402 1.00 0.00 H +ATOM 1146 C VAL 243 -40.604 -15.844 -19.465 1.00 0.00 C +ATOM 1147 O VAL 243 -39.394 -15.845 -19.300 1.00 0.00 O +ATOM 1148 N LYS 244 -41.241 -16.828 -20.091 1.00 0.00 N +ATOM 1149 H LYS 244 -42.262 -16.706 -20.180 1.00 0.00 H +ATOM 1150 CA LYS 244 -40.512 -17.979 -20.600 1.00 0.00 C +ATOM 1151 HA LYS 244 -39.925 -18.344 -19.871 1.00 0.00 H +ATOM 1152 CB LYS 244 -41.491 -19.072 -21.035 1.00 0.00 C +ATOM 1153 HB2 LYS 244 -42.115 -18.680 -21.705 1.00 0.00 H +ATOM 1154 HB3 LYS 244 -40.966 -19.811 -21.449 1.00 0.00 H +ATOM 1155 CG LYS 244 -42.307 -19.641 -19.892 1.00 0.00 C +ATOM 1156 HG2 LYS 244 -41.711 -19.784 -19.101 1.00 0.00 H +ATOM 1157 HG3 LYS 244 -43.032 -18.997 -19.652 1.00 0.00 H +ATOM 1158 CD LYS 244 -42.940 -20.971 -20.274 1.00 0.00 C +ATOM 1159 HD2 LYS 244 -43.713 -20.800 -20.869 1.00 0.00 H +ATOM 1160 HD3 LYS 244 -42.261 -21.534 -20.723 1.00 0.00 H +ATOM 1161 CE LYS 244 -43.432 -21.698 -19.032 1.00 0.00 C +ATOM 1162 HE2 LYS 244 -42.715 -21.672 -18.334 1.00 0.00 H +ATOM 1163 HE3 LYS 244 -44.248 -21.234 -18.684 1.00 0.00 H +ATOM 1164 NZ LYS 244 -43.770 -23.120 -19.332 1.00 0.00 N +ATOM 1165 HZ1 LYS 244 -44.005 -23.589 -18.482 1.00 0.00 H +ATOM 1166 HZ2 LYS 244 -44.548 -23.149 -19.958 1.00 0.00 H +ATOM 1167 HZ3 LYS 244 -42.981 -23.564 -19.755 1.00 0.00 H +ATOM 1168 C LYS 244 -39.634 -17.566 -21.772 1.00 0.00 C +ATOM 1169 O LYS 244 -38.559 -18.126 -21.990 1.00 0.00 O +ATOM 1170 N SER 245 -40.084 -16.571 -22.522 1.00 0.00 N +ATOM 1171 H SER 245 -40.986 -16.165 -22.226 1.00 0.00 H +ATOM 1172 CA SER 245 -39.327 -16.110 -23.679 1.00 0.00 C +ATOM 1173 HA SER 245 -39.098 -16.917 -24.247 1.00 0.00 H +ATOM 1174 CB SER 245 -40.176 -15.146 -24.509 1.00 0.00 C +ATOM 1175 HB2 SER 245 -39.747 -15.025 -25.399 1.00 0.00 H +ATOM 1176 HB3 SER 245 -41.087 -15.533 -24.617 1.00 0.00 H +ATOM 1177 OG SER 245 -40.283 -13.886 -23.872 1.00 0.00 O +ATOM 1178 HG SER 245 -40.573 -14.015 -22.924 1.00 0.00 H +ATOM 1179 C SER 245 -38.014 -15.430 -23.290 1.00 0.00 C +ATOM 1180 O SER 245 -37.148 -15.217 -24.137 1.00 0.00 O +ATOM 1181 N LEU 246 -37.859 -15.104 -22.010 1.00 0.00 N +ATOM 1182 H LEU 246 -38.642 -15.366 -21.390 1.00 0.00 H +ATOM 1183 CA LEU 246 -36.651 -14.423 -21.551 1.00 0.00 C +ATOM 1184 HA LEU 246 -36.510 -13.595 -22.137 1.00 0.00 H +ATOM 1185 CB LEU 246 -36.860 -13.871 -20.137 1.00 0.00 C +ATOM 1186 HB2 LEU 246 -37.135 -14.618 -19.557 1.00 0.00 H +ATOM 1187 HB3 LEU 246 -36.015 -13.464 -19.841 1.00 0.00 H +ATOM 1188 CG LEU 246 -37.946 -12.798 -20.057 1.00 0.00 C +ATOM 1189 HG LEU 246 -38.782 -13.150 -20.467 1.00 0.00 H +ATOM 1190 CD1 LEU 246 -38.209 -12.441 -18.599 1.00 0.00 C +ATOM 1191 HD11 LEU 246 -37.368 -12.093 -18.184 1.00 0.00 H +ATOM 1192 HD12 LEU 246 -38.920 -11.739 -18.551 1.00 0.00 H +ATOM 1193 HD13 LEU 246 -38.512 -13.256 -18.106 1.00 0.00 H +ATOM 1194 CD2 LEU 246 -37.526 -11.581 -20.857 1.00 0.00 C +ATOM 1195 HD21 LEU 246 -37.387 -11.838 -21.815 1.00 0.00 H +ATOM 1196 HD22 LEU 246 -38.239 -10.879 -20.803 1.00 0.00 H +ATOM 1197 HD23 LEU 246 -36.671 -11.212 -20.487 1.00 0.00 H +ATOM 1198 C LEU 246 -35.376 -15.259 -21.598 1.00 0.00 C +ATOM 1199 O LEU 246 -34.285 -14.711 -21.756 1.00 0.00 O +ATOM 1200 N SER 247 -35.501 -16.575 -21.463 1.00 0.00 N +ATOM 1201 H SER 247 -36.463 -16.918 -21.330 1.00 0.00 H +ATOM 1202 CA SER 247 -34.326 -17.438 -21.507 1.00 0.00 C +ATOM 1203 HA SER 247 -33.723 -17.189 -20.738 1.00 0.00 H +ATOM 1204 CB SER 247 -34.731 -18.912 -21.372 1.00 0.00 C +ATOM 1205 HB2 SER 247 -35.345 -19.144 -22.121 1.00 0.00 H +ATOM 1206 HB3 SER 247 -33.909 -19.473 -21.418 1.00 0.00 H +ATOM 1207 OG SER 247 -35.389 -19.155 -20.141 1.00 0.00 O +ATOM 1208 HG SER 247 -35.365 -18.328 -19.581 1.00 0.00 H +ATOM 1209 C SER 247 -33.530 -17.243 -22.802 1.00 0.00 C +ATOM 1210 O SER 247 -32.311 -17.108 -22.768 1.00 0.00 O +ATOM 1211 N ARG 248 -34.227 -17.231 -23.938 1.00 0.00 N +ATOM 1212 H ARG 248 -35.254 -17.356 -23.817 1.00 0.00 H +ATOM 1213 CA ARG 248 -33.593 -17.055 -25.249 1.00 0.00 C +ATOM 1214 HA ARG 248 -32.956 -17.818 -25.404 1.00 0.00 H +ATOM 1215 CB ARG 248 -34.660 -17.078 -26.367 1.00 0.00 C +ATOM 1216 HB2 ARG 248 -35.156 -17.940 -26.306 1.00 0.00 H +ATOM 1217 HB3 ARG 248 -35.284 -16.315 -26.218 1.00 0.00 H +ATOM 1218 CG ARG 248 -34.111 -16.956 -27.809 1.00 0.00 C +ATOM 1219 HG2 ARG 248 -33.851 -16.014 -27.980 1.00 0.00 H +ATOM 1220 HG3 ARG 248 -33.332 -17.561 -27.913 1.00 0.00 H +ATOM 1221 CD ARG 248 -35.170 -17.358 -28.856 1.00 0.00 C +ATOM 1222 HD2 ARG 248 -35.648 -18.160 -28.508 1.00 0.00 H +ATOM 1223 HD3 ARG 248 -35.805 -16.595 -28.949 1.00 0.00 H +ATOM 1224 NE ARG 248 -34.584 -17.668 -30.165 1.00 0.00 N +ATOM 1225 HE ARG 248 -34.342 -18.638 -30.345 1.00 0.00 H +ATOM 1226 CZ ARG 248 -34.344 -16.789 -31.132 1.00 0.00 C +ATOM 1227 NH1 ARG 248 -34.645 -15.504 -30.966 1.00 0.00 N +ATOM 1228 HH11 ARG 248 -35.035 -15.178 -30.109 1.00 0.00 H +ATOM 1229 HH12 ARG 248 -34.475 -14.854 -31.714 1.00 0.00 H +ATOM 1230 NH2 ARG 248 -33.783 -17.199 -32.267 1.00 0.00 N +ATOM 1231 HH21 ARG 248 -33.528 -18.161 -32.377 1.00 0.00 H +ATOM 1232 HH22 ARG 248 -33.616 -16.549 -33.006 1.00 0.00 H +ATOM 1233 C ARG 248 -32.810 -15.746 -25.304 1.00 0.00 C +ATOM 1234 O ARG 248 -31.688 -15.699 -25.813 1.00 0.00 O +ATOM 1235 N VAL 249 -33.405 -14.683 -24.773 1.00 0.00 N +ATOM 1236 H VAL 249 -34.342 -14.858 -24.373 1.00 0.00 H +ATOM 1237 CA VAL 249 -32.753 -13.381 -24.773 1.00 0.00 C +ATOM 1238 HA VAL 249 -32.458 -13.175 -25.719 1.00 0.00 H +ATOM 1239 CB VAL 249 -33.716 -12.262 -24.314 1.00 0.00 C +ATOM 1240 HB VAL 249 -33.921 -12.417 -23.357 1.00 0.00 H +ATOM 1241 CG1 VAL 249 -33.018 -10.911 -24.410 1.00 0.00 C +ATOM 1242 HG11 VAL 249 -32.036 -11.033 -24.272 1.00 0.00 H +ATOM 1243 HG12 VAL 249 -33.181 -10.515 -25.313 1.00 0.00 H +ATOM 1244 HG13 VAL 249 -33.380 -10.298 -23.708 1.00 0.00 H +ATOM 1245 CG2 VAL 249 -34.972 -12.268 -25.166 1.00 0.00 C +ATOM 1246 HG21 VAL 249 -34.718 -12.223 -26.133 1.00 0.00 H +ATOM 1247 HG22 VAL 249 -35.486 -13.109 -24.994 1.00 0.00 H +ATOM 1248 HG23 VAL 249 -35.537 -11.476 -24.931 1.00 0.00 H +ATOM 1249 C VAL 249 -31.510 -13.350 -23.882 1.00 0.00 C +ATOM 1250 O VAL 249 -30.495 -12.756 -24.245 1.00 0.00 O +ATOM 1251 N MET 250 -31.575 -13.993 -22.717 1.00 0.00 N +ATOM 1252 H MET 250 -32.471 -14.450 -22.509 1.00 0.00 H +ATOM 1253 CA MET 250 -30.413 -14.021 -21.817 1.00 0.00 C +ATOM 1254 HA MET 250 -30.108 -13.073 -21.675 1.00 0.00 H +ATOM 1255 CB MET 250 -30.767 -14.652 -20.462 1.00 0.00 C +ATOM 1256 HB2 MET 250 -31.159 -15.570 -20.623 1.00 0.00 H +ATOM 1257 HB3 MET 250 -29.917 -14.770 -19.927 1.00 0.00 H +ATOM 1258 CG MET 250 -31.756 -13.851 -19.619 1.00 0.00 C +ATOM 1259 HG2 MET 250 -31.425 -12.878 -19.564 1.00 0.00 H +ATOM 1260 HG3 MET 250 -32.651 -13.799 -20.124 1.00 0.00 H +ATOM 1261 SD MET 250 -32.022 -14.522 -17.935 1.00 0.00 S +ATOM 1262 CE MET 250 -33.303 -15.728 -18.230 1.00 0.00 C +ATOM 1263 HE1 MET 250 -33.057 -16.597 -17.796 1.00 0.00 H +ATOM 1264 HE2 MET 250 -34.170 -15.403 -17.847 1.00 0.00 H +ATOM 1265 HE3 MET 250 -33.413 -15.872 -19.216 1.00 0.00 H +ATOM 1266 C MET 250 -29.254 -14.805 -22.431 1.00 0.00 C +ATOM 1267 O MET 250 -28.099 -14.462 -22.220 1.00 0.00 O +ATOM 1268 N ILE 251 -29.562 -15.866 -23.169 1.00 0.00 N +ATOM 1269 H ILE 251 -30.571 -16.073 -23.244 1.00 0.00 H +ATOM 1270 CA ILE 251 -28.520 -16.659 -23.813 1.00 0.00 C +ATOM 1271 HA ILE 251 -27.814 -16.802 -23.131 1.00 0.00 H +ATOM 1272 CB ILE 251 -29.122 -17.962 -24.439 1.00 0.00 C +ATOM 1273 HB ILE 251 -29.942 -17.701 -24.933 1.00 0.00 H +ATOM 1274 CG2 ILE 251 -28.130 -18.591 -25.407 1.00 0.00 C +ATOM 1275 HG21 ILE 251 -28.544 -19.393 -25.834 1.00 0.00 H +ATOM 1276 HG22 ILE 251 -27.886 -17.928 -26.113 1.00 0.00 H +ATOM 1277 HG23 ILE 251 -27.308 -18.865 -24.911 1.00 0.00 H +ATOM 1278 CG1 ILE 251 -29.514 -18.960 -23.343 1.00 0.00 C +ATOM 1279 HG12 ILE 251 -30.052 -18.475 -22.652 1.00 0.00 H +ATOM 1280 HG13 ILE 251 -30.096 -19.664 -23.755 1.00 0.00 H +ATOM 1281 CD1 ILE 251 -28.341 -19.644 -22.658 1.00 0.00 C +ATOM 1282 HD11 ILE 251 -27.763 -18.952 -22.230 1.00 0.00 H +ATOM 1283 HD12 ILE 251 -28.688 -20.272 -21.964 1.00 0.00 H +ATOM 1284 HD13 ILE 251 -27.814 -20.150 -23.338 1.00 0.00 H +ATOM 1285 C ILE 251 -27.899 -15.796 -24.909 1.00 0.00 C +ATOM 1286 O ILE 251 -26.686 -15.713 -25.061 1.00 0.00 O +ATOM 1287 N HIE 252 -28.766 -15.125 -25.655 1.00 0.00 N +ATOM 1288 H HIE 252 -29.766 -15.260 -25.388 1.00 0.00 H +ATOM 1289 CA HIE 252 -28.349 -14.265 -26.763 1.00 0.00 C +ATOM 1290 HA HIE 252 -27.828 -14.831 -27.425 1.00 0.00 H +ATOM 1291 CB HIE 252 -29.595 -13.708 -27.470 1.00 0.00 C +ATOM 1292 HB2 HIE 252 -30.203 -14.475 -27.706 1.00 0.00 H +ATOM 1293 HB3 HIE 252 -30.083 -13.101 -26.832 1.00 0.00 H +ATOM 1294 CG HIE 252 -29.293 -12.942 -28.716 1.00 0.00 C +ATOM 1295 ND1 HIE 252 -28.674 -11.718 -28.707 1.00 0.00 N +ATOM 1296 CE1 HIE 252 -28.569 -11.272 -29.952 1.00 0.00 C +ATOM 1297 HE1 HIE 252 -28.162 -10.408 -30.226 1.00 0.00 H +ATOM 1298 NE2 HIE 252 -29.099 -12.171 -30.756 1.00 0.00 N +ATOM 1299 HE2 HIE 252 -29.160 -12.100 -31.762 1.00 0.00 H +ATOM 1300 CD2 HIE 252 -29.559 -13.231 -30.011 1.00 0.00 C +ATOM 1301 HD2 HIE 252 -30.002 -14.049 -30.359 1.00 0.00 H +ATOM 1302 C HIE 252 -27.455 -13.107 -26.323 1.00 0.00 C +ATOM 1303 O HIE 252 -26.403 -12.851 -26.914 1.00 0.00 O +ATOM 1304 N VAL 253 -27.868 -12.431 -25.260 1.00 0.00 N +ATOM 1305 H VAL 253 -28.738 -12.802 -24.820 1.00 0.00 H +ATOM 1306 CA VAL 253 -27.155 -11.263 -24.755 1.00 0.00 C +ATOM 1307 HA VAL 253 -26.718 -10.791 -25.553 1.00 0.00 H +ATOM 1308 CB VAL 253 -28.172 -10.255 -24.143 1.00 0.00 C +ATOM 1309 HB VAL 253 -28.626 -10.716 -23.390 1.00 0.00 H +ATOM 1310 CG1 VAL 253 -27.444 -9.054 -23.567 1.00 0.00 C +ATOM 1311 HG11 VAL 253 -26.951 -8.579 -24.296 1.00 0.00 H +ATOM 1312 HG12 VAL 253 -28.105 -8.428 -23.152 1.00 0.00 H +ATOM 1313 HG13 VAL 253 -26.793 -9.358 -22.870 1.00 0.00 H +ATOM 1314 CG2 VAL 253 -29.170 -9.822 -25.214 1.00 0.00 C +ATOM 1315 HG21 VAL 253 -29.979 -10.407 -25.164 1.00 0.00 H +ATOM 1316 HG22 VAL 253 -29.430 -8.871 -25.054 1.00 0.00 H +ATOM 1317 HG23 VAL 253 -28.744 -9.910 -26.113 1.00 0.00 H +ATOM 1318 C VAL 253 -26.048 -11.549 -23.730 1.00 0.00 C +ATOM 1319 O VAL 253 -24.956 -10.985 -23.811 1.00 0.00 O +ATOM 1320 N PHE 254 -26.328 -12.408 -22.759 1.00 0.00 N +ATOM 1321 H PHE 254 -27.266 -12.822 -22.785 1.00 0.00 H +ATOM 1322 CA PHE 254 -25.325 -12.707 -21.744 1.00 0.00 C +ATOM 1323 HA PHE 254 -24.774 -11.854 -21.612 1.00 0.00 H +ATOM 1324 CB PHE 254 -25.989 -13.057 -20.407 1.00 0.00 C +ATOM 1325 HB2 PHE 254 -26.372 -12.229 -20.033 1.00 0.00 H +ATOM 1326 HB3 PHE 254 -26.683 -13.735 -20.582 1.00 0.00 H +ATOM 1327 CG PHE 254 -25.029 -13.626 -19.389 1.00 0.00 C +ATOM 1328 CD1 PHE 254 -24.147 -12.797 -18.690 1.00 0.00 C +ATOM 1329 HD1 PHE 254 -24.181 -11.814 -18.825 1.00 0.00 H +ATOM 1330 CE1 PHE 254 -23.221 -13.337 -17.803 1.00 0.00 C +ATOM 1331 HE1 PHE 254 -22.601 -12.726 -17.299 1.00 0.00 H +ATOM 1332 CZ PHE 254 -23.155 -14.716 -17.618 1.00 0.00 C +ATOM 1333 HZ PHE 254 -22.481 -15.100 -16.991 1.00 0.00 H +ATOM 1334 CE2 PHE 254 -24.029 -15.548 -18.308 1.00 0.00 C +ATOM 1335 HE2 PHE 254 -23.994 -16.551 -18.171 1.00 0.00 H +ATOM 1336 CD2 PHE 254 -24.952 -15.006 -19.189 1.00 0.00 C +ATOM 1337 HD2 PHE 254 -25.574 -15.609 -19.690 1.00 0.00 H +ATOM 1338 C PHE 254 -24.328 -13.814 -22.100 1.00 0.00 C +ATOM 1339 O PHE 254 -23.119 -13.620 -22.006 1.00 0.00 O +ATOM 1340 N SER 255 -24.824 -14.984 -22.489 1.00 0.00 N +ATOM 1341 H SER 255 -25.846 -15.043 -22.539 1.00 0.00 H +ATOM 1342 CA SER 255 -23.919 -16.088 -22.814 1.00 0.00 C +ATOM 1343 HA SER 255 -23.308 -16.236 -22.009 1.00 0.00 H +ATOM 1344 CB SER 255 -24.706 -17.379 -23.015 1.00 0.00 C +ATOM 1345 HB2 SER 255 -25.312 -17.270 -23.792 1.00 0.00 H +ATOM 1346 HB3 SER 255 -24.070 -18.125 -23.165 1.00 0.00 H +ATOM 1347 OG SER 255 -25.481 -17.658 -21.860 1.00 0.00 O +ATOM 1348 HG SER 255 -26.173 -16.947 -21.744 1.00 0.00 H +ATOM 1349 C SER 255 -23.028 -15.853 -24.033 1.00 0.00 C +ATOM 1350 O SER 255 -21.872 -16.284 -24.046 1.00 0.00 O +ATOM 1351 N ASP 256 -23.562 -15.187 -25.054 1.00 0.00 N +ATOM 1352 H ASP 256 -24.538 -14.876 -24.914 1.00 0.00 H +ATOM 1353 CA ASP 256 -22.796 -14.929 -26.274 1.00 0.00 C +ATOM 1354 HA ASP 256 -22.166 -15.700 -26.396 1.00 0.00 H +ATOM 1355 CB ASP 256 -23.747 -14.753 -27.466 1.00 0.00 C +ATOM 1356 HB2 ASP 256 -24.491 -15.403 -27.360 1.00 0.00 H +ATOM 1357 HB3 ASP 256 -24.092 -13.822 -27.446 1.00 0.00 H +ATOM 1358 CG ASP 256 -23.067 -14.997 -28.796 1.00 0.00 C +ATOM 1359 OD1 ASP 256 -21.899 -15.441 -28.789 1.00 0.00 O +ATOM 1360 OD2 ASP 256 -23.705 -14.759 -29.840 1.00 0.00 O +ATOM 1361 C ASP 256 -21.950 -13.679 -26.100 1.00 0.00 C +ATOM 1362 O ASP 256 -22.237 -12.639 -26.691 1.00 0.00 O +ATOM 1363 N GLY 257 -20.903 -13.787 -25.291 1.00 0.00 N +ATOM 1364 H GLY 257 -20.767 -14.718 -24.867 1.00 0.00 H +ATOM 1365 CA GLY 257 -20.035 -12.647 -25.048 1.00 0.00 C +ATOM 1366 HA2 GLY 257 -19.568 -12.390 -25.896 1.00 0.00 H +ATOM 1367 HA3 GLY 257 -20.579 -11.870 -24.726 1.00 0.00 H +ATOM 1368 C GLY 257 -18.999 -13.009 -23.992 1.00 0.00 C +ATOM 1369 O GLY 257 -19.096 -14.059 -23.348 1.00 0.00 O +ATOM 1370 N VAL 258 -18.008 -12.147 -23.794 1.00 0.00 N +ATOM 1371 H VAL 258 -18.029 -11.305 -24.384 1.00 0.00 H +ATOM 1372 CA VAL 258 -16.993 -12.427 -22.800 1.00 0.00 C +ATOM 1373 HA VAL 258 -16.642 -13.351 -22.958 1.00 0.00 H +ATOM 1374 CB VAL 258 -15.803 -11.420 -22.883 1.00 0.00 C +ATOM 1375 HB VAL 258 -16.082 -10.596 -22.417 1.00 0.00 H +ATOM 1376 CG1 VAL 258 -14.611 -11.992 -22.117 1.00 0.00 C +ATOM 1377 HG11 VAL 258 -14.588 -12.984 -22.234 1.00 0.00 H +ATOM 1378 HG12 VAL 258 -13.767 -11.593 -22.472 1.00 0.00 H +ATOM 1379 HG13 VAL 258 -14.704 -11.771 -21.147 1.00 0.00 H +ATOM 1380 CG2 VAL 258 -15.418 -11.159 -24.334 1.00 0.00 C +ATOM 1381 HG21 VAL 258 -14.941 -11.959 -24.697 1.00 0.00 H +ATOM 1382 HG22 VAL 258 -16.245 -10.989 -24.869 1.00 0.00 H +ATOM 1383 HG23 VAL 258 -14.819 -10.360 -24.377 1.00 0.00 H +ATOM 1384 C VAL 258 -17.632 -12.393 -21.429 1.00 0.00 C +ATOM 1385 O VAL 258 -18.617 -11.691 -21.193 1.00 0.00 O +ATOM 1386 N THR 259 -17.055 -13.166 -20.524 1.00 0.00 N +ATOM 1387 H THR 259 -16.219 -13.685 -20.861 1.00 0.00 H +ATOM 1388 CA THR 259 -17.570 -13.262 -19.175 1.00 0.00 C +ATOM 1389 HA THR 259 -18.481 -12.817 -19.143 1.00 0.00 H +ATOM 1390 CB THR 259 -17.698 -14.742 -18.757 1.00 0.00 C +ATOM 1391 HB THR 259 -16.764 -15.138 -18.663 1.00 0.00 H +ATOM 1392 CG2 THR 259 -18.450 -14.851 -17.455 1.00 0.00 C +ATOM 1393 HG21 THR 259 -19.421 -14.635 -17.596 1.00 0.00 H +ATOM 1394 HG22 THR 259 -18.377 -15.784 -17.089 1.00 0.00 H +ATOM 1395 HG23 THR 259 -18.072 -14.209 -16.781 1.00 0.00 H +ATOM 1396 OG1 THR 259 -18.391 -15.469 -19.785 1.00 0.00 O +ATOM 1397 HG1 THR 259 -18.425 -14.928 -20.631 1.00 0.00 H +ATOM 1398 C THR 259 -16.670 -12.569 -18.162 1.00 0.00 C +ATOM 1399 O THR 259 -15.458 -12.745 -18.180 1.00 0.00 O +ATOM 1400 N ASN 260 -17.278 -11.789 -17.279 1.00 0.00 N +ATOM 1401 H ASN 260 -18.307 -11.683 -17.432 1.00 0.00 H +ATOM 1402 CA ASN 260 -16.568 -11.135 -16.186 1.00 0.00 C +ATOM 1403 HA ASN 260 -15.902 -11.776 -15.842 1.00 0.00 H +ATOM 1404 CB ASN 260 -15.905 -9.805 -16.602 1.00 0.00 C +ATOM 1405 HB2 ASN 260 -15.574 -9.352 -15.775 1.00 0.00 H +ATOM 1406 HB3 ASN 260 -15.133 -10.018 -17.200 1.00 0.00 H +ATOM 1407 CG ASN 260 -16.841 -8.858 -17.334 1.00 0.00 C +ATOM 1408 OD1 ASN 260 -17.905 -8.490 -16.837 1.00 0.00 O +ATOM 1409 ND2 ASN 260 -16.428 -8.445 -18.529 1.00 0.00 N +ATOM 1410 HD21 ASN 260 -16.996 -7.815 -19.063 1.00 0.00 H +ATOM 1411 HD22 ASN 260 -15.555 -8.760 -18.898 1.00 0.00 H +ATOM 1412 C ASN 260 -17.607 -10.938 -15.098 1.00 0.00 C +ATOM 1413 O ASN 260 -18.800 -11.075 -15.362 1.00 0.00 O +ATOM 1414 N TRP 261 -17.170 -10.647 -13.877 1.00 0.00 N +ATOM 1415 H TRP 261 -16.152 -10.550 -13.781 1.00 0.00 H +ATOM 1416 CA TRP 261 -18.117 -10.488 -12.788 1.00 0.00 C +ATOM 1417 HA TRP 261 -18.642 -11.351 -12.705 1.00 0.00 H +ATOM 1418 CB TRP 261 -17.375 -10.282 -11.458 1.00 0.00 C +ATOM 1419 HB2 TRP 261 -16.612 -9.673 -11.604 1.00 0.00 H +ATOM 1420 HB3 TRP 261 -18.005 -9.923 -10.788 1.00 0.00 H +ATOM 1421 CG TRP 261 -16.810 -11.573 -10.890 1.00 0.00 C +ATOM 1422 CD1 TRP 261 -15.501 -11.850 -10.618 1.00 0.00 C +ATOM 1423 HD1 TRP 261 -14.739 -11.221 -10.750 1.00 0.00 H +ATOM 1424 NE1 TRP 261 -15.379 -13.137 -10.129 1.00 0.00 N +ATOM 1425 HE1 TRP 261 -14.522 -13.574 -9.861 1.00 0.00 H +ATOM 1426 CE2 TRP 261 -16.620 -13.712 -10.073 1.00 0.00 C +ATOM 1427 CZ2 TRP 261 -17.006 -14.995 -9.651 1.00 0.00 C +ATOM 1428 HZ2 TRP 261 -16.315 -15.646 -9.327 1.00 0.00 H +ATOM 1429 CH2 TRP 261 -18.340 -15.306 -9.703 1.00 0.00 C +ATOM 1430 HH2 TRP 261 -18.655 -16.207 -9.405 1.00 0.00 H +ATOM 1431 CZ3 TRP 261 -19.289 -14.382 -10.169 1.00 0.00 C +ATOM 1432 HZ3 TRP 261 -20.249 -14.631 -10.204 1.00 0.00 H +ATOM 1433 CE3 TRP 261 -18.906 -13.105 -10.590 1.00 0.00 C +ATOM 1434 HE3 TRP 261 -19.592 -12.461 -10.911 1.00 0.00 H +ATOM 1435 CD2 TRP 261 -17.549 -12.761 -10.547 1.00 0.00 C +ATOM 1436 C TRP 261 -19.123 -9.367 -13.037 1.00 0.00 C +ATOM 1437 O TRP 261 -20.273 -9.459 -12.611 1.00 0.00 O +ATOM 1438 N GLY 262 -18.696 -8.325 -13.748 1.00 0.00 N +ATOM 1439 H GLY 262 -17.715 -8.379 -14.061 1.00 0.00 H +ATOM 1440 CA GLY 262 -19.586 -7.214 -14.037 1.00 0.00 C +ATOM 1441 HA2 GLY 262 -19.918 -6.812 -13.169 1.00 0.00 H +ATOM 1442 HA3 GLY 262 -19.075 -6.492 -14.529 1.00 0.00 H +ATOM 1443 C GLY 262 -20.780 -7.641 -14.877 1.00 0.00 C +ATOM 1444 O GLY 262 -21.913 -7.225 -14.620 1.00 0.00 O +ATOM 1445 N ARG 263 -20.539 -8.488 -15.875 1.00 0.00 N +ATOM 1446 H ARG 263 -19.560 -8.777 -15.986 1.00 0.00 H +ATOM 1447 CA ARG 263 -21.633 -8.947 -16.729 1.00 0.00 C +ATOM 1448 HA ARG 263 -22.156 -8.144 -17.044 1.00 0.00 H +ATOM 1449 CB ARG 263 -21.092 -9.657 -17.976 1.00 0.00 C +ATOM 1450 HB2 ARG 263 -20.407 -10.313 -17.688 1.00 0.00 H +ATOM 1451 HB3 ARG 263 -21.848 -10.112 -18.428 1.00 0.00 H +ATOM 1452 CG ARG 263 -20.444 -8.706 -18.979 1.00 0.00 C +ATOM 1453 HG2 ARG 263 -21.127 -8.065 -19.323 1.00 0.00 H +ATOM 1454 HG3 ARG 263 -19.704 -8.205 -18.535 1.00 0.00 H +ATOM 1455 CD ARG 263 -19.846 -9.447 -20.189 1.00 0.00 C +ATOM 1456 HD2 ARG 263 -19.412 -8.769 -20.774 1.00 0.00 H +ATOM 1457 HD3 ARG 263 -19.170 -10.090 -19.844 1.00 0.00 H +ATOM 1458 NE ARG 263 -20.865 -10.172 -20.953 1.00 0.00 N +ATOM 1459 HE ARG 263 -20.922 -11.166 -20.833 1.00 0.00 H +ATOM 1460 CZ ARG 263 -21.712 -9.588 -21.790 1.00 0.00 C +ATOM 1461 NH1 ARG 263 -21.642 -8.290 -21.971 1.00 0.00 N +ATOM 1462 HH11 ARG 263 -20.961 -7.721 -21.518 1.00 0.00 H +ATOM 1463 HH12 ARG 263 -22.304 -7.837 -22.598 1.00 0.00 H +ATOM 1464 NH2 ARG 263 -22.642 -10.290 -22.413 1.00 0.00 N +ATOM 1465 HH21 ARG 263 -22.690 -11.284 -22.261 1.00 0.00 H +ATOM 1466 HH22 ARG 263 -23.288 -9.848 -23.027 1.00 0.00 H +ATOM 1467 C ARG 263 -22.575 -9.876 -15.974 1.00 0.00 C +ATOM 1468 O ARG 263 -23.756 -9.949 -16.291 1.00 0.00 O +ATOM 1469 N ILE 264 -22.050 -10.595 -14.985 1.00 0.00 N +ATOM 1470 H ILE 264 -21.039 -10.459 -14.830 1.00 0.00 H +ATOM 1471 CA ILE 264 -22.880 -11.500 -14.199 1.00 0.00 C +ATOM 1472 HA ILE 264 -23.483 -11.964 -14.843 1.00 0.00 H +ATOM 1473 CB ILE 264 -21.985 -12.465 -13.384 1.00 0.00 C +ATOM 1474 HB ILE 264 -21.293 -11.928 -12.933 1.00 0.00 H +ATOM 1475 CG2 ILE 264 -22.805 -13.230 -12.339 1.00 0.00 C +ATOM 1476 HG21 ILE 264 -22.199 -13.828 -11.821 1.00 0.00 H +ATOM 1477 HG22 ILE 264 -23.242 -12.579 -11.724 1.00 0.00 H +ATOM 1478 HG23 ILE 264 -23.500 -13.774 -12.802 1.00 0.00 H +ATOM 1479 CG1 ILE 264 -21.291 -13.423 -14.357 1.00 0.00 C +ATOM 1480 HG12 ILE 264 -21.995 -13.994 -14.788 1.00 0.00 H +ATOM 1481 HG13 ILE 264 -20.858 -12.872 -15.076 1.00 0.00 H +ATOM 1482 CD1 ILE 264 -20.253 -14.307 -13.729 1.00 0.00 C +ATOM 1483 HD11 ILE 264 -20.676 -14.873 -13.020 1.00 0.00 H +ATOM 1484 HD12 ILE 264 -19.848 -14.900 -14.427 1.00 0.00 H +ATOM 1485 HD13 ILE 264 -19.535 -13.744 -13.317 1.00 0.00 H +ATOM 1486 C ILE 264 -23.782 -10.670 -13.282 1.00 0.00 C +ATOM 1487 O ILE 264 -24.956 -10.986 -13.084 1.00 0.00 O +ATOM 1488 N VAL 265 -23.231 -9.590 -12.741 1.00 0.00 N +ATOM 1489 H VAL 265 -22.236 -9.436 -12.982 1.00 0.00 H +ATOM 1490 CA VAL 265 -23.999 -8.703 -11.874 1.00 0.00 C +ATOM 1491 HA VAL 265 -24.442 -9.254 -11.169 1.00 0.00 H +ATOM 1492 CB VAL 265 -23.098 -7.632 -11.234 1.00 0.00 C +ATOM 1493 HB VAL 265 -22.575 -7.203 -11.962 1.00 0.00 H +ATOM 1494 CG1 VAL 265 -23.949 -6.547 -10.596 1.00 0.00 C +ATOM 1495 HG11 VAL 265 -23.364 -5.926 -10.073 1.00 0.00 H +ATOM 1496 HG12 VAL 265 -24.425 -6.032 -11.309 1.00 0.00 H +ATOM 1497 HG13 VAL 265 -24.621 -6.965 -9.984 1.00 0.00 H +ATOM 1498 CG2 VAL 265 -22.187 -8.274 -10.192 1.00 0.00 C +ATOM 1499 HG21 VAL 265 -22.288 -9.267 -10.235 1.00 0.00 H +ATOM 1500 HG22 VAL 265 -21.239 -8.022 -10.385 1.00 0.00 H +ATOM 1501 HG23 VAL 265 -22.446 -7.947 -9.284 1.00 0.00 H +ATOM 1502 C VAL 265 -25.106 -8.024 -12.699 1.00 0.00 C +ATOM 1503 O VAL 265 -26.230 -7.866 -12.228 1.00 0.00 O +ATOM 1504 N THR 266 -24.797 -7.645 -13.937 1.00 0.00 N +ATOM 1505 H THR 266 -23.827 -7.828 -14.227 1.00 0.00 H +ATOM 1506 CA THR 266 -25.802 -7.015 -14.791 1.00 0.00 C +ATOM 1507 HA THR 266 -26.195 -6.237 -14.302 1.00 0.00 H +ATOM 1508 CB THR 266 -25.192 -6.544 -16.125 1.00 0.00 C +ATOM 1509 HB THR 266 -24.752 -7.338 -16.584 1.00 0.00 H +ATOM 1510 CG2 THR 266 -26.275 -5.935 -17.034 1.00 0.00 C +ATOM 1511 HG21 THR 266 -27.172 -6.277 -16.755 1.00 0.00 H +ATOM 1512 HG22 THR 266 -26.255 -4.939 -16.951 1.00 0.00 H +ATOM 1513 HG23 THR 266 -26.097 -6.196 -17.982 1.00 0.00 H +ATOM 1514 OG1 THR 266 -24.177 -5.563 -15.857 1.00 0.00 O +ATOM 1515 HG1 THR 266 -23.376 -5.998 -15.434 1.00 0.00 H +ATOM 1516 C THR 266 -26.919 -8.016 -15.079 1.00 0.00 C +ATOM 1517 O THR 266 -28.102 -7.673 -15.065 1.00 0.00 O +ATOM 1518 N LEU 267 -26.537 -9.259 -15.345 1.00 0.00 N +ATOM 1519 H LEU 267 -25.512 -9.412 -15.348 1.00 0.00 H +ATOM 1520 CA LEU 267 -27.511 -10.311 -15.610 1.00 0.00 C +ATOM 1521 HA LEU 267 -28.040 -10.063 -16.429 1.00 0.00 H +ATOM 1522 CB LEU 267 -26.791 -11.643 -15.839 1.00 0.00 C +ATOM 1523 HB2 LEU 267 -26.350 -11.603 -16.734 1.00 0.00 H +ATOM 1524 HB3 LEU 267 -26.101 -11.745 -15.126 1.00 0.00 H +ATOM 1525 CG LEU 267 -27.658 -12.908 -15.817 1.00 0.00 C +ATOM 1526 HG LEU 267 -28.287 -12.856 -15.047 1.00 0.00 H +ATOM 1527 CD1 LEU 267 -28.450 -13.011 -17.114 1.00 0.00 C +ATOM 1528 HD11 LEU 267 -27.818 -13.056 -17.888 1.00 0.00 H +ATOM 1529 HD12 LEU 267 -29.014 -13.837 -17.096 1.00 0.00 H +ATOM 1530 HD13 LEU 267 -29.038 -12.208 -17.210 1.00 0.00 H +ATOM 1531 CD2 LEU 267 -26.769 -14.138 -15.637 1.00 0.00 C +ATOM 1532 HD21 LEU 267 -26.269 -14.062 -14.775 1.00 0.00 H +ATOM 1533 HD22 LEU 267 -27.339 -14.959 -15.623 1.00 0.00 H +ATOM 1534 HD23 LEU 267 -26.121 -14.192 -16.396 1.00 0.00 H +ATOM 1535 C LEU 267 -28.486 -10.466 -14.440 1.00 0.00 C +ATOM 1536 O LEU 267 -29.704 -10.525 -14.630 1.00 0.00 O +ATOM 1537 N ILE 268 -27.937 -10.531 -13.232 1.00 0.00 N +ATOM 1538 H ILE 268 -26.899 -10.447 -13.221 1.00 0.00 H +ATOM 1539 CA ILE 268 -28.737 -10.707 -12.023 1.00 0.00 C +ATOM 1540 HA ILE 268 -29.429 -11.406 -12.241 1.00 0.00 H +ATOM 1541 CB ILE 268 -27.836 -11.130 -10.830 1.00 0.00 C +ATOM 1542 HB ILE 268 -27.096 -10.477 -10.765 1.00 0.00 H +ATOM 1543 CG2 ILE 268 -28.635 -11.125 -9.524 1.00 0.00 C +ATOM 1544 HG21 ILE 268 -28.031 -11.365 -8.768 1.00 0.00 H +ATOM 1545 HG22 ILE 268 -29.015 -10.215 -9.374 1.00 0.00 H +ATOM 1546 HG23 ILE 268 -29.374 -11.791 -9.588 1.00 0.00 H +ATOM 1547 CG1 ILE 268 -27.232 -12.514 -11.101 1.00 0.00 C +ATOM 1548 HG12 ILE 268 -27.963 -13.193 -11.050 1.00 0.00 H +ATOM 1549 HG13 ILE 268 -26.860 -12.516 -12.029 1.00 0.00 H +ATOM 1550 CD1 ILE 268 -26.127 -12.908 -10.135 1.00 0.00 C +ATOM 1551 HD11 ILE 268 -26.492 -12.921 -9.206 1.00 0.00 H +ATOM 1552 HD12 ILE 268 -25.788 -13.815 -10.377 1.00 0.00 H +ATOM 1553 HD13 ILE 268 -25.385 -12.243 -10.197 1.00 0.00 H +ATOM 1554 C ILE 268 -29.503 -9.437 -11.658 1.00 0.00 C +ATOM 1555 O ILE 268 -30.666 -9.494 -11.258 1.00 0.00 O +ATOM 1556 N SER 269 -28.850 -8.293 -11.829 1.00 0.00 N +ATOM 1557 H SER 269 -27.887 -8.395 -12.209 1.00 0.00 H +ATOM 1558 CA SER 269 -29.452 -7.007 -11.504 1.00 0.00 C +ATOM 1559 HA SER 269 -29.763 -7.043 -10.539 1.00 0.00 H +ATOM 1560 CB SER 269 -28.413 -5.898 -11.641 1.00 0.00 C +ATOM 1561 HB2 SER 269 -28.046 -5.913 -12.562 1.00 0.00 H +ATOM 1562 HB3 SER 269 -28.846 -5.026 -11.449 1.00 0.00 H +ATOM 1563 OG SER 269 -27.359 -6.104 -10.719 1.00 0.00 O +ATOM 1564 HG SER 269 -26.715 -6.772 -11.091 1.00 0.00 H +ATOM 1565 C SER 269 -30.657 -6.687 -12.371 1.00 0.00 C +ATOM 1566 O SER 269 -31.663 -6.161 -11.887 1.00 0.00 O +ATOM 1567 N PHE 270 -30.554 -6.970 -13.660 1.00 0.00 N +ATOM 1568 H PHE 270 -29.662 -7.363 -13.966 1.00 0.00 H +ATOM 1569 CA PHE 270 -31.685 -6.709 -14.524 1.00 0.00 C +ATOM 1570 HA PHE 270 -32.057 -5.822 -14.269 1.00 0.00 H +ATOM 1571 CB PHE 270 -31.292 -6.802 -16.000 1.00 0.00 C +ATOM 1572 HB2 PHE 270 -30.548 -6.174 -16.155 1.00 0.00 H +ATOM 1573 HB3 PHE 270 -31.029 -7.734 -16.185 1.00 0.00 H +ATOM 1574 CG PHE 270 -32.412 -6.439 -16.935 1.00 0.00 C +ATOM 1575 CD1 PHE 270 -32.845 -5.119 -17.043 1.00 0.00 C +ATOM 1576 HD1 PHE 270 -32.389 -4.402 -16.529 1.00 0.00 H +ATOM 1577 CE1 PHE 270 -33.919 -4.787 -17.873 1.00 0.00 C +ATOM 1578 HE1 PHE 270 -34.218 -3.831 -17.935 1.00 0.00 H +ATOM 1579 CZ PHE 270 -34.560 -5.781 -18.600 1.00 0.00 C +ATOM 1580 HZ PHE 270 -35.328 -5.548 -19.194 1.00 0.00 H +ATOM 1581 CE2 PHE 270 -34.130 -7.102 -18.499 1.00 0.00 C +ATOM 1582 HE2 PHE 270 -34.593 -7.831 -19.025 1.00 0.00 H +ATOM 1583 CD2 PHE 270 -33.062 -7.419 -17.670 1.00 0.00 C +ATOM 1584 HD2 PHE 270 -32.756 -8.372 -17.603 1.00 0.00 H +ATOM 1585 C PHE 270 -32.759 -7.742 -14.201 1.00 0.00 C +ATOM 1586 O PHE 270 -33.948 -7.482 -14.363 1.00 0.00 O +ATOM 1587 N GLY 271 -32.330 -8.919 -13.752 1.00 0.00 N +ATOM 1588 H GLY 271 -31.308 -9.025 -13.696 1.00 0.00 H +ATOM 1589 CA GLY 271 -33.283 -9.951 -13.379 1.00 0.00 C +ATOM 1590 HA2 GLY 271 -33.873 -10.163 -14.156 1.00 0.00 H +ATOM 1591 HA3 GLY 271 -32.796 -10.774 -13.093 1.00 0.00 H +ATOM 1592 C GLY 271 -34.130 -9.437 -12.226 1.00 0.00 C +ATOM 1593 O GLY 271 -35.335 -9.677 -12.173 1.00 0.00 O +ATOM 1594 N ALA 272 -33.489 -8.730 -11.298 1.00 0.00 N +ATOM 1595 H ALA 272 -32.467 -8.624 -11.461 1.00 0.00 H +ATOM 1596 CA ALA 272 -34.182 -8.156 -10.149 1.00 0.00 C +ATOM 1597 HA ALA 272 -34.733 -8.872 -9.712 1.00 0.00 H +ATOM 1598 CB ALA 272 -33.182 -7.617 -9.146 1.00 0.00 C +ATOM 1599 HB1 ALA 272 -32.392 -8.229 -9.095 1.00 0.00 H +ATOM 1600 HB2 ALA 272 -32.876 -6.707 -9.430 1.00 0.00 H +ATOM 1601 HB3 ALA 272 -33.610 -7.555 -8.243 1.00 0.00 H +ATOM 1602 C ALA 272 -35.109 -7.037 -10.606 1.00 0.00 C +ATOM 1603 O ALA 272 -36.184 -6.845 -10.039 1.00 0.00 O +ATOM 1604 N PHE 273 -34.682 -6.304 -11.634 1.00 0.00 N +ATOM 1605 H PHE 273 -33.748 -6.581 -12.004 1.00 0.00 H +ATOM 1606 CA PHE 273 -35.467 -5.203 -12.191 1.00 0.00 C +ATOM 1607 HA PHE 273 -35.743 -4.625 -11.428 1.00 0.00 H +ATOM 1608 CB PHE 273 -34.648 -4.478 -13.270 1.00 0.00 C +ATOM 1609 HB2 PHE 273 -33.740 -4.323 -12.905 1.00 0.00 H +ATOM 1610 HB3 PHE 273 -34.614 -5.066 -14.067 1.00 0.00 H +ATOM 1611 CG PHE 273 -35.212 -3.149 -13.695 1.00 0.00 C +ATOM 1612 CD1 PHE 273 -35.122 -2.036 -12.863 1.00 0.00 C +ATOM 1613 HD1 PHE 273 -34.711 -2.117 -11.963 1.00 0.00 H +ATOM 1614 CE1 PHE 273 -35.607 -0.788 -13.281 1.00 0.00 C +ATOM 1615 HE1 PHE 273 -35.534 -0.000 -12.666 1.00 0.00 H +ATOM 1616 CZ PHE 273 -36.184 -0.659 -14.540 1.00 0.00 C +ATOM 1617 HZ PHE 273 -36.527 0.227 -14.843 1.00 0.00 H +ATOM 1618 CE2 PHE 273 -36.279 -1.772 -15.373 1.00 0.00 C +ATOM 1619 HE2 PHE 273 -36.701 -1.687 -16.289 1.00 0.00 H +ATOM 1620 CD2 PHE 273 -35.796 -3.002 -14.947 1.00 0.00 C +ATOM 1621 HD2 PHE 273 -35.869 -3.797 -15.553 1.00 0.00 H +ATOM 1622 C PHE 273 -36.748 -5.778 -12.794 1.00 0.00 C +ATOM 1623 O PHE 273 -37.816 -5.187 -12.683 1.00 0.00 O +ATOM 1624 N VAL 274 -36.633 -6.931 -13.447 1.00 0.00 N +ATOM 1625 H VAL 274 -35.676 -7.316 -13.494 1.00 0.00 H +ATOM 1626 CA VAL 274 -37.798 -7.571 -14.039 1.00 0.00 C +ATOM 1627 HA VAL 274 -38.326 -6.879 -14.527 1.00 0.00 H +ATOM 1628 CB VAL 274 -37.387 -8.720 -14.996 1.00 0.00 C +ATOM 1629 HB VAL 274 -36.832 -9.358 -14.475 1.00 0.00 H +ATOM 1630 CG1 VAL 274 -38.619 -9.480 -15.471 1.00 0.00 C +ATOM 1631 HG11 VAL 274 -38.340 -10.211 -16.093 1.00 0.00 H +ATOM 1632 HG12 VAL 274 -39.091 -9.875 -14.683 1.00 0.00 H +ATOM 1633 HG13 VAL 274 -39.234 -8.853 -15.948 1.00 0.00 H +ATOM 1634 CG2 VAL 274 -36.637 -8.154 -16.194 1.00 0.00 C +ATOM 1635 HG21 VAL 274 -36.840 -7.179 -16.279 1.00 0.00 H +ATOM 1636 HG22 VAL 274 -35.655 -8.283 -16.059 1.00 0.00 H +ATOM 1637 HG23 VAL 274 -36.929 -8.632 -17.022 1.00 0.00 H +ATOM 1638 C VAL 274 -38.679 -8.128 -12.918 1.00 0.00 C +ATOM 1639 O VAL 274 -39.900 -8.053 -12.989 1.00 0.00 O +ATOM 1640 N ALA 275 -38.051 -8.685 -11.885 1.00 0.00 N +ATOM 1641 H ALA 275 -37.017 -8.693 -11.956 1.00 0.00 H +ATOM 1642 CA ALA 275 -38.788 -9.234 -10.754 1.00 0.00 C +ATOM 1643 HA ALA 275 -39.379 -9.977 -11.078 1.00 0.00 H +ATOM 1644 CB ALA 275 -37.819 -9.798 -9.703 1.00 0.00 C +ATOM 1645 HB1 ALA 275 -38.106 -9.494 -8.798 1.00 0.00 H +ATOM 1646 HB2 ALA 275 -37.834 -10.794 -9.746 1.00 0.00 H +ATOM 1647 HB3 ALA 275 -36.899 -9.465 -9.895 1.00 0.00 H +ATOM 1648 C ALA 275 -39.671 -8.149 -10.132 1.00 0.00 C +ATOM 1649 O ALA 275 -40.813 -8.413 -9.743 1.00 0.00 O +ATOM 1650 N LYS 276 -39.140 -6.933 -10.027 1.00 0.00 N +ATOM 1651 H LYS 276 -38.168 -6.846 -10.365 1.00 0.00 H +ATOM 1652 CA LYS 276 -39.909 -5.821 -9.467 1.00 0.00 C +ATOM 1653 HA LYS 276 -40.239 -6.082 -8.559 1.00 0.00 H +ATOM 1654 CB LYS 276 -39.056 -4.558 -9.365 1.00 0.00 C +ATOM 1655 HB2 LYS 276 -38.563 -4.446 -10.230 1.00 0.00 H +ATOM 1656 HB3 LYS 276 -39.672 -3.778 -9.236 1.00 0.00 H +ATOM 1657 CG LYS 276 -38.051 -4.567 -8.238 1.00 0.00 C +ATOM 1658 HG2 LYS 276 -38.533 -4.481 -7.367 1.00 0.00 H +ATOM 1659 HG3 LYS 276 -37.542 -5.425 -8.258 1.00 0.00 H +ATOM 1660 CD LYS 276 -37.085 -3.417 -8.382 1.00 0.00 C +ATOM 1661 HD2 LYS 276 -36.546 -3.546 -9.210 1.00 0.00 H +ATOM 1662 HD3 LYS 276 -37.597 -2.565 -8.435 1.00 0.00 H +ATOM 1663 CE LYS 276 -36.143 -3.341 -7.200 1.00 0.00 C +ATOM 1664 HE2 LYS 276 -36.662 -3.100 -6.384 1.00 0.00 H +ATOM 1665 HE3 LYS 276 -35.705 -4.228 -7.074 1.00 0.00 H +ATOM 1666 NZ LYS 276 -35.107 -2.311 -7.446 1.00 0.00 N +ATOM 1667 HZ1 LYS 276 -35.246 -1.905 -8.350 1.00 0.00 H +ATOM 1668 HZ2 LYS 276 -35.172 -1.597 -6.748 1.00 0.00 H +ATOM 1669 HZ3 LYS 276 -34.200 -2.732 -7.407 1.00 0.00 H +ATOM 1670 C LYS 276 -41.100 -5.536 -10.363 1.00 0.00 C +ATOM 1671 O LYS 276 -42.215 -5.319 -9.885 1.00 0.00 O +ATOM 1672 N HIE 277 -40.853 -5.525 -11.670 1.00 0.00 N +ATOM 1673 H HIE 277 -39.863 -5.706 -11.927 1.00 0.00 H +ATOM 1674 CA HIE 277 -41.905 -5.277 -12.645 1.00 0.00 C +ATOM 1675 HA HIE 277 -42.322 -4.384 -12.449 1.00 0.00 H +ATOM 1676 CB HIE 277 -41.314 -5.289 -14.054 1.00 0.00 C +ATOM 1677 HB2 HIE 277 -40.784 -4.446 -14.194 1.00 0.00 H +ATOM 1678 HB3 HIE 277 -40.693 -6.075 -14.141 1.00 0.00 H +ATOM 1679 CG HIE 277 -42.344 -5.382 -15.135 1.00 0.00 C +ATOM 1680 ND1 HIE 277 -43.132 -4.316 -15.507 1.00 0.00 N +ATOM 1681 CE1 HIE 277 -43.967 -4.701 -16.457 1.00 0.00 C +ATOM 1682 HE1 HIE 277 -44.647 -4.126 -16.903 1.00 0.00 H +ATOM 1683 NE2 HIE 277 -43.748 -5.977 -16.712 1.00 0.00 N +ATOM 1684 HE2 HIE 277 -44.239 -6.529 -17.389 1.00 0.00 H +ATOM 1685 CD2 HIE 277 -42.735 -6.427 -15.899 1.00 0.00 C +ATOM 1686 HD2 HIE 277 -42.362 -7.350 -15.878 1.00 0.00 H +ATOM 1687 C HIE 277 -43.002 -6.344 -12.545 1.00 0.00 C +ATOM 1688 O HIE 277 -44.191 -6.039 -12.682 1.00 0.00 O +ATOM 1689 N LEU 278 -42.592 -7.592 -12.312 1.00 0.00 N +ATOM 1690 H LEU 278 -41.560 -7.698 -12.221 1.00 0.00 H +ATOM 1691 CA LEU 278 -43.526 -8.711 -12.196 1.00 0.00 C +ATOM 1692 HA LEU 278 -44.096 -8.740 -13.030 1.00 0.00 H +ATOM 1693 CB LEU 278 -42.762 -10.033 -12.087 1.00 0.00 C +ATOM 1694 HB2 LEU 278 -42.036 -9.911 -11.434 1.00 0.00 H +ATOM 1695 HB3 LEU 278 -43.398 -10.730 -11.812 1.00 0.00 H +ATOM 1696 CG LEU 278 -42.133 -10.470 -13.405 1.00 0.00 C +ATOM 1697 HG LEU 278 -41.482 -9.772 -13.703 1.00 0.00 H +ATOM 1698 CD1 LEU 278 -41.411 -11.794 -13.236 1.00 0.00 C +ATOM 1699 HD11 LEU 278 -42.060 -12.496 -12.939 1.00 0.00 H +ATOM 1700 HD12 LEU 278 -41.003 -12.069 -14.108 1.00 0.00 H +ATOM 1701 HD13 LEU 278 -40.689 -11.698 -12.549 1.00 0.00 H +ATOM 1702 CD2 LEU 278 -43.222 -10.602 -14.452 1.00 0.00 C +ATOM 1703 HD21 LEU 278 -43.681 -9.720 -14.575 1.00 0.00 H +ATOM 1704 HD22 LEU 278 -42.819 -10.889 -15.323 1.00 0.00 H +ATOM 1705 HD23 LEU 278 -43.893 -11.285 -14.157 1.00 0.00 H +ATOM 1706 C LEU 278 -44.450 -8.569 -10.989 1.00 0.00 C +ATOM 1707 O LEU 278 -45.623 -8.954 -11.051 1.00 0.00 O +ATOM 1708 N LYS 279 -43.920 -8.030 -9.896 1.00 0.00 N +ATOM 1709 H LYS 279 -42.923 -7.764 -9.975 1.00 0.00 H +ATOM 1710 CA LYS 279 -44.715 -7.840 -8.686 1.00 0.00 C +ATOM 1711 HA LYS 279 -45.225 -8.680 -8.498 1.00 0.00 H +ATOM 1712 CB LYS 279 -43.805 -7.482 -7.512 1.00 0.00 C +ATOM 1713 HB2 LYS 279 -43.176 -8.246 -7.362 1.00 0.00 H +ATOM 1714 HB3 LYS 279 -43.279 -6.667 -7.764 1.00 0.00 H +ATOM 1715 CG LYS 279 -44.532 -7.200 -6.214 1.00 0.00 C +ATOM 1716 HG2 LYS 279 -43.874 -6.876 -5.534 1.00 0.00 H +ATOM 1717 HG3 LYS 279 -45.224 -6.497 -6.372 1.00 0.00 H +ATOM 1718 CD LYS 279 -45.207 -8.448 -5.691 1.00 0.00 C +ATOM 1719 HD2 LYS 279 -45.969 -8.688 -6.296 1.00 0.00 H +ATOM 1720 HD3 LYS 279 -44.546 -9.201 -5.681 1.00 0.00 H +ATOM 1721 CE LYS 279 -45.763 -8.288 -4.271 1.00 0.00 C +ATOM 1722 HE2 LYS 279 -46.090 -9.184 -3.949 1.00 0.00 H +ATOM 1723 HE3 LYS 279 -45.018 -7.987 -3.664 1.00 0.00 H +ATOM 1724 NZ LYS 279 -46.892 -7.298 -4.182 1.00 0.00 N +ATOM 1725 HZ1 LYS 279 -47.093 -6.953 -5.096 1.00 0.00 H +ATOM 1726 HZ2 LYS 279 -47.694 -7.755 -3.806 1.00 0.00 H +ATOM 1727 HZ3 LYS 279 -46.618 -6.547 -3.586 1.00 0.00 H +ATOM 1728 C LYS 279 -45.696 -6.706 -8.913 1.00 0.00 C +ATOM 1729 O LYS 279 -46.876 -6.795 -8.559 1.00 0.00 O +ATOM 1730 N THR 280 -45.177 -5.634 -9.503 1.00 0.00 N +ATOM 1731 H THR 280 -44.158 -5.730 -9.741 1.00 0.00 H +ATOM 1732 CA THR 280 -45.943 -4.432 -9.797 1.00 0.00 C +ATOM 1733 HA THR 280 -46.245 -4.020 -8.924 1.00 0.00 H +ATOM 1734 CB THR 280 -45.039 -3.414 -10.528 1.00 0.00 C +ATOM 1735 HB THR 280 -44.638 -3.862 -11.348 1.00 0.00 H +ATOM 1736 CG2 THR 280 -45.819 -2.186 -10.931 1.00 0.00 C +ATOM 1737 HG21 THR 280 -46.797 -2.404 -10.999 1.00 0.00 H +ATOM 1738 HG22 THR 280 -45.696 -1.459 -10.249 1.00 0.00 H +ATOM 1739 HG23 THR 280 -45.500 -1.850 -11.822 1.00 0.00 H +ATOM 1740 OG1 THR 280 -43.962 -3.031 -9.655 1.00 0.00 O +ATOM 1741 HG1 THR 280 -43.250 -3.740 -9.651 1.00 0.00 H +ATOM 1742 C THR 280 -47.187 -4.732 -10.634 1.00 0.00 C +ATOM 1743 O THR 280 -48.260 -4.173 -10.379 1.00 0.00 O +ATOM 1744 N ILE 281 -47.040 -5.618 -11.619 1.00 0.00 N +ATOM 1745 H ILE 281 -46.090 -6.016 -11.711 1.00 0.00 H +ATOM 1746 CA ILE 281 -48.158 -5.979 -12.487 1.00 0.00 C +ATOM 1747 HA ILE 281 -48.818 -5.212 -12.429 1.00 0.00 H +ATOM 1748 CB ILE 281 -47.723 -6.197 -13.963 1.00 0.00 C +ATOM 1749 HB ILE 281 -48.546 -6.348 -14.500 1.00 0.00 H +ATOM 1750 CG2 ILE 281 -46.986 -4.959 -14.477 1.00 0.00 C +ATOM 1751 HG21 ILE 281 -46.747 -5.092 -15.436 1.00 0.00 H +ATOM 1752 HG22 ILE 281 -47.578 -4.162 -14.387 1.00 0.00 H +ATOM 1753 HG23 ILE 281 -46.156 -4.823 -13.941 1.00 0.00 H +ATOM 1754 CG1 ILE 281 -46.832 -7.434 -14.092 1.00 0.00 C +ATOM 1755 HG12 ILE 281 -45.954 -7.234 -13.667 1.00 0.00 H +ATOM 1756 HG13 ILE 281 -47.268 -8.183 -13.599 1.00 0.00 H +ATOM 1757 CD1 ILE 281 -46.609 -7.851 -15.520 1.00 0.00 C +ATOM 1758 HD11 ILE 281 -46.168 -7.106 -16.022 1.00 0.00 H +ATOM 1759 HD12 ILE 281 -46.022 -8.661 -15.545 1.00 0.00 H +ATOM 1760 HD13 ILE 281 -47.488 -8.065 -15.948 1.00 0.00 H +ATOM 1761 C ILE 281 -48.899 -7.226 -12.028 1.00 0.00 C +ATOM 1762 O ILE 281 -49.607 -7.858 -12.817 1.00 0.00 O +ATOM 1763 N ASN 282 -48.731 -7.578 -10.754 1.00 0.00 N +ATOM 1764 H ASN 282 -48.101 -6.948 -10.211 1.00 0.00 H +ATOM 1765 CA ASN 282 -49.380 -8.755 -10.167 1.00 0.00 C +ATOM 1766 HA ASN 282 -49.008 -8.849 -9.211 1.00 0.00 H +ATOM 1767 CB ASN 282 -50.877 -8.523 -9.987 1.00 0.00 C +ATOM 1768 HB2 ASN 282 -51.158 -7.797 -10.605 1.00 0.00 H +ATOM 1769 HB3 ASN 282 -51.352 -9.369 -10.204 1.00 0.00 H +ATOM 1770 CG ASN 282 -51.208 -8.122 -8.579 1.00 0.00 C +ATOM 1771 OD1 ASN 282 -51.177 -6.936 -8.252 1.00 0.00 O +ATOM 1772 ND2 ASN 282 -51.493 -9.099 -7.724 1.00 0.00 N +ATOM 1773 HD21 ASN 282 -51.725 -8.889 -6.778 1.00 0.00 H +ATOM 1774 HD22 ASN 282 -51.472 -10.051 -8.039 1.00 0.00 H +ATOM 1775 C ASN 282 -49.157 -10.096 -10.859 1.00 0.00 C +ATOM 1776 O ASN 282 -50.109 -10.831 -11.162 1.00 0.00 O +ATOM 1777 N GLN 283 -47.888 -10.398 -11.128 1.00 0.00 N +ATOM 1778 H GLN 283 -47.203 -9.656 -10.878 1.00 0.00 H +ATOM 1779 CA GLN 283 -47.501 -11.677 -11.728 1.00 0.00 C +ATOM 1780 HA GLN 283 -48.270 -12.287 -11.668 1.00 0.00 H +ATOM 1781 CB GLN 283 -46.992 -11.472 -13.156 1.00 0.00 C +ATOM 1782 HB2 GLN 283 -46.424 -10.653 -13.183 1.00 0.00 H +ATOM 1783 HB3 GLN 283 -46.453 -12.268 -13.425 1.00 0.00 H +ATOM 1784 CG GLN 283 -48.118 -11.299 -14.177 1.00 0.00 C +ATOM 1785 HG2 GLN 283 -48.852 -10.767 -13.754 1.00 0.00 H +ATOM 1786 HG3 GLN 283 -47.758 -10.800 -14.966 1.00 0.00 H +ATOM 1787 CD GLN 283 -48.696 -12.621 -14.661 1.00 0.00 C +ATOM 1788 OE1 GLN 283 -48.563 -13.663 -14.011 1.00 0.00 O +ATOM 1789 NE2 GLN 283 -49.364 -12.576 -15.803 1.00 0.00 N +ATOM 1790 HE21 GLN 283 -49.771 -13.424 -16.202 1.00 0.00 H +ATOM 1791 HE22 GLN 283 -49.470 -11.685 -16.282 1.00 0.00 H +ATOM 1792 C GLN 283 -46.402 -12.207 -10.825 1.00 0.00 C +ATOM 1793 O GLN 283 -45.402 -12.743 -11.289 1.00 0.00 O +ATOM 1794 N GLU 284 -46.614 -12.047 -9.522 1.00 0.00 N +ATOM 1795 H GLU 284 -47.524 -11.591 -9.286 1.00 0.00 H +ATOM 1796 CA GLU 284 -45.653 -12.474 -8.508 1.00 0.00 C +ATOM 1797 HA GLU 284 -44.825 -11.868 -8.554 1.00 0.00 H +ATOM 1798 CB GLU 284 -46.227 -12.220 -7.116 1.00 0.00 C +ATOM 1799 HB2 GLU 284 -46.836 -11.454 -7.181 1.00 0.00 H +ATOM 1800 HB3 GLU 284 -46.681 -13.040 -6.827 1.00 0.00 H +ATOM 1801 CG GLU 284 -45.167 -11.889 -6.099 1.00 0.00 C +ATOM 1802 HG2 GLU 284 -44.517 -12.628 -6.074 1.00 0.00 H +ATOM 1803 HG3 GLU 284 -44.746 -11.036 -6.351 1.00 0.00 H +ATOM 1804 CD GLU 284 -45.729 -11.727 -4.711 1.00 0.00 C +ATOM 1805 OE1 GLU 284 -46.883 -11.254 -4.595 1.00 0.00 O +ATOM 1806 OE2 GLU 284 -45.005 -12.055 -3.750 1.00 0.00 O +ATOM 1807 C GLU 284 -45.204 -13.933 -8.594 1.00 0.00 C +ATOM 1808 O GLU 284 -44.051 -14.254 -8.288 1.00 0.00 O +ATOM 1809 N SER 285 -46.099 -14.826 -9.001 1.00 0.00 N +ATOM 1810 H SER 285 -47.022 -14.453 -9.249 1.00 0.00 H +ATOM 1811 CA SER 285 -45.736 -16.237 -9.071 1.00 0.00 C +ATOM 1812 HA SER 285 -45.328 -16.499 -8.178 1.00 0.00 H +ATOM 1813 CB SER 285 -46.978 -17.107 -9.289 1.00 0.00 C +ATOM 1814 HB2 SER 285 -46.721 -18.065 -9.180 1.00 0.00 H +ATOM 1815 HB3 SER 285 -47.664 -16.861 -8.607 1.00 0.00 H +ATOM 1816 OG SER 285 -47.529 -16.922 -10.583 1.00 0.00 O +ATOM 1817 HG SER 285 -48.009 -16.047 -10.618 1.00 0.00 H +ATOM 1818 C SER 285 -44.711 -16.547 -10.158 1.00 0.00 C +ATOM 1819 O SER 285 -44.196 -17.662 -10.224 1.00 0.00 O +ATOM 1820 N CYS 286 -44.415 -15.567 -11.006 1.00 0.00 N +ATOM 1821 H CYS 286 -44.905 -14.674 -10.836 1.00 0.00 H +ATOM 1822 CA CYS 286 -43.460 -15.778 -12.088 1.00 0.00 C +ATOM 1823 HA CYS 286 -43.531 -16.747 -12.387 1.00 0.00 H +ATOM 1824 CB CYS 286 -43.816 -14.888 -13.282 1.00 0.00 C +ATOM 1825 HB2 CYS 286 -43.878 -13.941 -12.951 1.00 0.00 H +ATOM 1826 HB3 CYS 286 -43.062 -14.947 -13.944 1.00 0.00 H +ATOM 1827 SG CYS 286 -45.353 -15.297 -14.132 1.00 0.00 S +ATOM 1828 HG CYS 286 -45.691 -14.491 -14.619 1.00 0.00 H +ATOM 1829 C CYS 286 -42.018 -15.518 -11.677 1.00 0.00 C +ATOM 1830 O CYS 286 -41.087 -15.868 -12.400 1.00 0.00 O +ATOM 1831 N ILE 287 -41.841 -14.909 -10.510 1.00 0.00 N +ATOM 1832 H ILE 287 -42.715 -14.693 -9.994 1.00 0.00 H +ATOM 1833 CA ILE 287 -40.513 -14.583 -10.019 1.00 0.00 C +ATOM 1834 HA ILE 287 -40.056 -14.056 -10.766 1.00 0.00 H +ATOM 1835 CB ILE 287 -40.600 -13.656 -8.774 1.00 0.00 C +ATOM 1836 HB ILE 287 -41.148 -14.114 -8.094 1.00 0.00 H +ATOM 1837 CG2 ILE 287 -39.195 -13.338 -8.249 1.00 0.00 C +ATOM 1838 HG21 ILE 287 -39.270 -12.748 -7.449 1.00 0.00 H +ATOM 1839 HG22 ILE 287 -38.738 -14.188 -7.999 1.00 0.00 H +ATOM 1840 HG23 ILE 287 -38.676 -12.874 -8.962 1.00 0.00 H +ATOM 1841 CG1 ILE 287 -41.317 -12.348 -9.164 1.00 0.00 C +ATOM 1842 HG12 ILE 287 -40.728 -11.846 -9.800 1.00 0.00 H +ATOM 1843 HG13 ILE 287 -42.162 -12.590 -9.647 1.00 0.00 H +ATOM 1844 CD1 ILE 287 -41.672 -11.434 -7.997 1.00 0.00 C +ATOM 1845 HD11 ILE 287 -40.835 -11.174 -7.521 1.00 0.00 H +ATOM 1846 HD12 ILE 287 -42.129 -10.620 -8.348 1.00 0.00 H +ATOM 1847 HD13 ILE 287 -42.279 -11.922 -7.374 1.00 0.00 H +ATOM 1848 C ILE 287 -39.618 -15.775 -9.723 1.00 0.00 C +ATOM 1849 O ILE 287 -38.500 -15.831 -10.211 1.00 0.00 O +ATOM 1850 N GLU 288 -40.099 -16.733 -8.941 1.00 0.00 N +ATOM 1851 H GLU 288 -41.052 -16.591 -8.590 1.00 0.00 H +ATOM 1852 CA GLU 288 -39.275 -17.902 -8.630 1.00 0.00 C +ATOM 1853 HA GLU 288 -38.451 -17.615 -8.134 1.00 0.00 H +ATOM 1854 CB GLU 288 -40.025 -18.823 -7.677 1.00 0.00 C +ATOM 1855 HB2 GLU 288 -40.347 -18.280 -6.921 1.00 0.00 H +ATOM 1856 HB3 GLU 288 -40.765 -19.239 -8.175 1.00 0.00 H +ATOM 1857 CG GLU 288 -39.173 -19.947 -7.101 1.00 0.00 C +ATOM 1858 HG2 GLU 288 -39.013 -20.608 -7.809 1.00 0.00 H +ATOM 1859 HG3 GLU 288 -38.341 -19.560 -6.753 1.00 0.00 H +ATOM 1860 CD GLU 288 -39.856 -20.673 -5.944 1.00 0.00 C +ATOM 1861 OE1 GLU 288 -39.451 -20.469 -4.775 1.00 0.00 O +ATOM 1862 OE2 GLU 288 -40.804 -21.433 -6.218 1.00 0.00 O +ATOM 1863 C GLU 288 -38.859 -18.634 -9.919 1.00 0.00 C +ATOM 1864 O GLU 288 -37.709 -19.041 -10.060 1.00 0.00 O +ATOM 1865 N PRO 289 -39.785 -18.801 -10.879 1.00 0.00 N +ATOM 1866 CD PRO 289 -41.247 -18.648 -10.751 1.00 0.00 C +ATOM 1867 HD2 PRO 289 -41.522 -17.719 -10.984 1.00 0.00 H +ATOM 1868 HD3 PRO 289 -41.541 -18.866 -9.823 1.00 0.00 H +ATOM 1869 CG PRO 289 -41.764 -19.645 -11.745 1.00 0.00 C +ATOM 1870 HG2 PRO 289 -42.678 -19.407 -12.055 1.00 0.00 H +ATOM 1871 HG3 PRO 289 -41.753 -20.566 -11.372 1.00 0.00 H +ATOM 1872 CB PRO 289 -40.780 -19.528 -12.878 1.00 0.00 C +ATOM 1873 HB2 PRO 289 -40.935 -18.694 -13.394 1.00 0.00 H +ATOM 1874 HB3 PRO 289 -40.829 -20.321 -13.472 1.00 0.00 H +ATOM 1875 CA PRO 289 -39.443 -19.476 -12.140 1.00 0.00 C +ATOM 1876 HA PRO 289 -39.121 -20.408 -11.970 1.00 0.00 H +ATOM 1877 C PRO 289 -38.387 -18.666 -12.901 1.00 0.00 C +ATOM 1878 O PRO 289 -37.498 -19.231 -13.534 1.00 0.00 O +ATOM 1879 N LEU 290 -38.485 -17.340 -12.828 1.00 0.00 N +ATOM 1880 H LEU 290 -39.281 -16.987 -12.273 1.00 0.00 H +ATOM 1881 CA LEU 290 -37.515 -16.476 -13.500 1.00 0.00 C +ATOM 1882 HA LEU 290 -37.463 -16.744 -14.466 1.00 0.00 H +ATOM 1883 CB LEU 290 -37.923 -15.009 -13.387 1.00 0.00 C +ATOM 1884 HB2 LEU 290 -38.773 -14.889 -13.868 1.00 0.00 H +ATOM 1885 HB3 LEU 290 -37.998 -14.783 -12.434 1.00 0.00 H +ATOM 1886 CG LEU 290 -36.903 -14.052 -14.009 1.00 0.00 C +ATOM 1887 HG LEU 290 -36.003 -14.241 -13.620 1.00 0.00 H +ATOM 1888 CD1 LEU 290 -36.856 -14.244 -15.514 1.00 0.00 C +ATOM 1889 HD11 LEU 290 -37.759 -14.059 -15.905 1.00 0.00 H +ATOM 1890 HD12 LEU 290 -36.187 -13.615 -15.913 1.00 0.00 H +ATOM 1891 HD13 LEU 290 -36.591 -15.186 -15.725 1.00 0.00 H +ATOM 1892 CD2 LEU 290 -37.269 -12.634 -13.665 1.00 0.00 C +ATOM 1893 HD21 LEU 290 -37.271 -12.512 -12.669 1.00 0.00 H +ATOM 1894 HD22 LEU 290 -36.604 -12.000 -14.070 1.00 0.00 H +ATOM 1895 HD23 LEU 290 -38.182 -12.419 -14.021 1.00 0.00 H +ATOM 1896 C LEU 290 -36.131 -16.644 -12.878 1.00 0.00 C +ATOM 1897 O LEU 290 -35.124 -16.698 -13.586 1.00 0.00 O +ATOM 1898 N ALA 291 -36.087 -16.709 -11.550 1.00 0.00 N +ATOM 1899 H ALA 291 -37.001 -16.638 -11.075 1.00 0.00 H +ATOM 1900 CA ALA 291 -34.817 -16.870 -10.849 1.00 0.00 C +ATOM 1901 HA ALA 291 -34.208 -16.116 -11.104 1.00 0.00 H +ATOM 1902 CB ALA 291 -35.032 -16.836 -9.329 1.00 0.00 C +ATOM 1903 HB1 ALA 291 -35.841 -16.289 -9.125 1.00 0.00 H +ATOM 1904 HB2 ALA 291 -35.161 -17.767 -8.996 1.00 0.00 H +ATOM 1905 HB3 ALA 291 -34.231 -16.430 -8.894 1.00 0.00 H +ATOM 1906 C ALA 291 -34.166 -18.185 -11.261 1.00 0.00 C +ATOM 1907 O ALA 291 -32.949 -18.275 -11.381 1.00 0.00 O +ATOM 1908 N GLU 292 -34.989 -19.204 -11.477 1.00 0.00 N +ATOM 1909 H GLU 292 -35.994 -18.993 -11.330 1.00 0.00 H +ATOM 1910 CA GLU 292 -34.487 -20.500 -11.887 1.00 0.00 C +ATOM 1911 HA GLU 292 -33.766 -20.804 -11.261 1.00 0.00 H +ATOM 1912 CB GLU 292 -35.612 -21.538 -11.847 1.00 0.00 C +ATOM 1913 HB2 GLU 292 -36.072 -21.445 -10.981 1.00 0.00 H +ATOM 1914 HB3 GLU 292 -36.212 -21.357 -12.606 1.00 0.00 H +ATOM 1915 CG GLU 292 -35.134 -22.972 -11.966 1.00 0.00 C +ATOM 1916 HG2 GLU 292 -34.917 -23.149 -12.905 1.00 0.00 H +ATOM 1917 HG3 GLU 292 -34.367 -23.095 -11.369 1.00 0.00 H +ATOM 1918 CD GLU 292 -36.204 -23.960 -11.547 1.00 0.00 C +ATOM 1919 OE1 GLU 292 -36.975 -23.633 -10.618 1.00 0.00 O +ATOM 1920 OE2 GLU 292 -36.262 -25.059 -12.129 1.00 0.00 O +ATOM 1921 C GLU 292 -33.919 -20.405 -13.302 1.00 0.00 C +ATOM 1922 O GLU 292 -32.898 -21.015 -13.600 1.00 0.00 O +ATOM 1923 N SER 293 -34.587 -19.641 -14.168 1.00 0.00 N +ATOM 1924 H SER 293 -35.438 -19.189 -13.786 1.00 0.00 H +ATOM 1925 CA SER 293 -34.133 -19.468 -15.552 1.00 0.00 C +ATOM 1926 HA SER 293 -34.007 -20.383 -15.953 1.00 0.00 H +ATOM 1927 CB SER 293 -35.161 -18.677 -16.365 1.00 0.00 C +ATOM 1928 HB2 SER 293 -35.388 -17.844 -15.872 1.00 0.00 H +ATOM 1929 HB3 SER 293 -34.768 -18.458 -17.252 1.00 0.00 H +ATOM 1930 OG SER 293 -36.342 -19.437 -16.558 1.00 0.00 O +ATOM 1931 HG SER 293 -36.848 -19.490 -15.698 1.00 0.00 H +ATOM 1932 C SER 293 -32.793 -18.743 -15.604 1.00 0.00 C +ATOM 1933 O SER 293 -31.915 -19.092 -16.394 1.00 0.00 O +ATOM 1934 N ILE 294 -32.644 -17.729 -14.760 1.00 0.00 N +ATOM 1935 H ILE 294 -33.460 -17.532 -14.158 1.00 0.00 H +ATOM 1936 CA ILE 294 -31.398 -16.965 -14.712 1.00 0.00 C +ATOM 1937 HA ILE 294 -31.183 -16.718 -15.657 1.00 0.00 H +ATOM 1938 CB ILE 294 -31.517 -15.748 -13.765 1.00 0.00 C +ATOM 1939 HB ILE 294 -31.826 -16.078 -12.882 1.00 0.00 H +ATOM 1940 CG2 ILE 294 -30.166 -15.058 -13.630 1.00 0.00 C +ATOM 1941 HG21 ILE 294 -30.246 -14.291 -12.996 1.00 0.00 H +ATOM 1942 HG22 ILE 294 -29.493 -15.709 -13.283 1.00 0.00 H +ATOM 1943 HG23 ILE 294 -29.873 -14.722 -14.523 1.00 0.00 H +ATOM 1944 CG1 ILE 294 -32.565 -14.763 -14.298 1.00 0.00 C +ATOM 1945 HG12 ILE 294 -32.268 -14.440 -15.194 1.00 0.00 H +ATOM 1946 HG13 ILE 294 -33.429 -15.253 -14.404 1.00 0.00 H +ATOM 1947 CD1 ILE 294 -32.797 -13.561 -13.395 1.00 0.00 C +ATOM 1948 HD11 ILE 294 -31.941 -13.059 -13.292 1.00 0.00 H +ATOM 1949 HD12 ILE 294 -33.488 -12.971 -13.807 1.00 0.00 H +ATOM 1950 HD13 ILE 294 -33.112 -13.878 -12.503 1.00 0.00 H +ATOM 1951 C ILE 294 -30.263 -17.863 -14.226 1.00 0.00 C +ATOM 1952 O ILE 294 -29.157 -17.838 -14.768 1.00 0.00 O +ATOM 1953 N THR 295 -30.545 -18.657 -13.198 1.00 0.00 N +ATOM 1954 H THR 295 -31.511 -18.575 -12.833 1.00 0.00 H +ATOM 1955 CA THR 295 -29.547 -19.564 -12.648 1.00 0.00 C +ATOM 1956 HA THR 295 -28.737 -19.030 -12.387 1.00 0.00 H +ATOM 1957 CB THR 295 -30.079 -20.312 -11.406 1.00 0.00 C +ATOM 1958 HB THR 295 -30.869 -20.891 -11.687 1.00 0.00 H +ATOM 1959 CG2 THR 295 -28.976 -21.162 -10.787 1.00 0.00 C +ATOM 1960 HG21 THR 295 -28.350 -20.578 -10.266 1.00 0.00 H +ATOM 1961 HG22 THR 295 -29.378 -21.844 -10.172 1.00 0.00 H +ATOM 1962 HG23 THR 295 -28.464 -21.631 -11.509 1.00 0.00 H +ATOM 1963 OG1 THR 295 -30.539 -19.361 -10.441 1.00 0.00 O +ATOM 1964 HG1 THR 295 -31.401 -18.941 -10.746 1.00 0.00 H +ATOM 1965 C THR 295 -29.129 -20.588 -13.697 1.00 0.00 C +ATOM 1966 O THR 295 -27.951 -20.909 -13.808 1.00 0.00 O +ATOM 1967 N ASP 296 -30.092 -21.093 -14.469 1.00 0.00 N +ATOM 1968 H ASP 296 -31.041 -20.749 -14.276 1.00 0.00 H +ATOM 1969 CA ASP 296 -29.769 -22.070 -15.510 1.00 0.00 C +ATOM 1970 HA ASP 296 -29.272 -22.822 -15.064 1.00 0.00 H +ATOM 1971 CB ASP 296 -31.028 -22.577 -16.218 1.00 0.00 C +ATOM 1972 HB2 ASP 296 -31.595 -21.788 -16.432 1.00 0.00 H +ATOM 1973 HB3 ASP 296 -30.744 -23.035 -17.054 1.00 0.00 H +ATOM 1974 CG ASP 296 -31.823 -23.540 -15.375 1.00 0.00 C +ATOM 1975 OD1 ASP 296 -31.238 -24.168 -14.466 1.00 0.00 O +ATOM 1976 OD2 ASP 296 -33.035 -23.683 -15.635 1.00 0.00 O +ATOM 1977 C ASP 296 -28.836 -21.464 -16.544 1.00 0.00 C +ATOM 1978 O ASP 296 -27.879 -22.103 -16.968 1.00 0.00 O +ATOM 1979 N VAL 297 -29.112 -20.227 -16.948 1.00 0.00 N +ATOM 1980 H VAL 297 -29.944 -19.797 -16.515 1.00 0.00 H +ATOM 1981 CA VAL 297 -28.271 -19.561 -17.936 1.00 0.00 C +ATOM 1982 HA VAL 297 -28.191 -20.165 -18.739 1.00 0.00 H +ATOM 1983 CB VAL 297 -28.898 -18.220 -18.388 1.00 0.00 C +ATOM 1984 HB VAL 297 -29.063 -17.675 -17.576 1.00 0.00 H +ATOM 1985 CG1 VAL 297 -27.904 -17.436 -19.256 1.00 0.00 C +ATOM 1986 HG11 VAL 297 -28.385 -16.690 -19.711 1.00 0.00 H +ATOM 1987 HG12 VAL 297 -27.181 -17.068 -18.675 1.00 0.00 H +ATOM 1988 HG13 VAL 297 -27.510 -18.049 -19.937 1.00 0.00 H +ATOM 1989 CG2 VAL 297 -30.184 -18.490 -19.161 1.00 0.00 C +ATOM 1990 HG21 VAL 297 -30.804 -19.028 -18.590 1.00 0.00 H +ATOM 1991 HG22 VAL 297 -30.614 -17.620 -19.399 1.00 0.00 H +ATOM 1992 HG23 VAL 297 -29.966 -18.998 -19.994 1.00 0.00 H +ATOM 1993 C VAL 297 -26.868 -19.315 -17.393 1.00 0.00 C +ATOM 1994 O VAL 297 -25.877 -19.574 -18.071 1.00 0.00 O +ATOM 1995 N LEU 298 -26.787 -18.828 -16.159 1.00 0.00 N +ATOM 1996 H LEU 298 -27.691 -18.665 -15.687 1.00 0.00 H +ATOM 1997 CA LEU 298 -25.487 -18.551 -15.537 1.00 0.00 C +ATOM 1998 HA LEU 298 -24.962 -17.940 -16.154 1.00 0.00 H +ATOM 1999 CB LEU 298 -25.674 -17.814 -14.206 1.00 0.00 C +ATOM 2000 HB2 LEU 298 -26.062 -16.920 -14.406 1.00 0.00 H +ATOM 2001 HB3 LEU 298 -26.299 -18.348 -13.649 1.00 0.00 H +ATOM 2002 CG LEU 298 -24.404 -17.591 -13.390 1.00 0.00 C +ATOM 2003 HG LEU 298 -23.978 -18.472 -13.199 1.00 0.00 H +ATOM 2004 CD1 LEU 298 -23.426 -16.719 -14.175 1.00 0.00 C +ATOM 2005 HD11 LEU 298 -23.852 -15.836 -14.370 1.00 0.00 H +ATOM 2006 HD12 LEU 298 -22.598 -16.579 -13.633 1.00 0.00 H +ATOM 2007 HD13 LEU 298 -23.191 -17.174 -15.033 1.00 0.00 H +ATOM 2008 CD2 LEU 298 -24.747 -16.911 -12.069 1.00 0.00 C +ATOM 2009 HD21 LEU 298 -25.375 -17.490 -11.549 1.00 0.00 H +ATOM 2010 HD22 LEU 298 -23.910 -16.769 -11.540 1.00 0.00 H +ATOM 2011 HD23 LEU 298 -25.181 -16.028 -12.251 1.00 0.00 H +ATOM 2012 C LEU 298 -24.646 -19.810 -15.285 1.00 0.00 C +ATOM 2013 O LEU 298 -23.514 -19.923 -15.764 1.00 0.00 O +ATOM 2014 N VAL 299 -25.210 -20.758 -14.545 1.00 0.00 N +ATOM 2015 H VAL 299 -26.179 -20.563 -14.244 1.00 0.00 H +ATOM 2016 CA VAL 299 -24.480 -21.965 -14.208 1.00 0.00 C +ATOM 2017 HA VAL 299 -23.540 -21.688 -13.894 1.00 0.00 H +ATOM 2018 CB VAL 299 -25.121 -22.663 -12.966 1.00 0.00 C +ATOM 2019 HB VAL 299 -26.039 -22.940 -13.228 1.00 0.00 H +ATOM 2020 CG1 VAL 299 -24.354 -23.921 -12.597 1.00 0.00 C +ATOM 2021 HG11 VAL 299 -24.502 -24.133 -11.630 1.00 0.00 H +ATOM 2022 HG12 VAL 299 -24.675 -24.686 -13.157 1.00 0.00 H +ATOM 2023 HG13 VAL 299 -23.377 -23.778 -12.759 1.00 0.00 H +ATOM 2024 CG2 VAL 299 -25.133 -21.702 -11.781 1.00 0.00 C +ATOM 2025 HG21 VAL 299 -25.080 -20.763 -12.119 1.00 0.00 H +ATOM 2026 HG22 VAL 299 -25.979 -21.828 -11.265 1.00 0.00 H +ATOM 2027 HG23 VAL 299 -24.348 -21.895 -11.194 1.00 0.00 H +ATOM 2028 C VAL 299 -24.305 -22.980 -15.332 1.00 0.00 C +ATOM 2029 O VAL 299 -23.236 -23.584 -15.445 1.00 0.00 O +ATOM 2030 N ARG 300 -25.322 -23.160 -16.172 1.00 0.00 N +ATOM 2031 H ARG 300 -26.144 -22.561 -16.006 1.00 0.00 H +ATOM 2032 CA ARG 300 -25.236 -24.151 -17.242 1.00 0.00 C +ATOM 2033 HA ARG 300 -24.816 -25.000 -16.861 1.00 0.00 H +ATOM 2034 CB ARG 300 -26.636 -24.560 -17.707 1.00 0.00 C +ATOM 2035 HB2 ARG 300 -27.022 -23.808 -18.242 1.00 0.00 H +ATOM 2036 HB3 ARG 300 -26.551 -25.370 -18.287 1.00 0.00 H +ATOM 2037 CG ARG 300 -27.633 -24.894 -16.588 1.00 0.00 C +ATOM 2038 HG2 ARG 300 -27.621 -24.150 -15.906 1.00 0.00 H +ATOM 2039 HG3 ARG 300 -28.562 -24.940 -16.981 1.00 0.00 H +ATOM 2040 CD ARG 300 -27.369 -26.208 -15.855 1.00 0.00 C +ATOM 2041 HD2 ARG 300 -27.318 -26.931 -16.523 1.00 0.00 H +ATOM 2042 HD3 ARG 300 -26.528 -26.116 -15.348 1.00 0.00 H +ATOM 2043 NE ARG 300 -28.473 -26.492 -14.916 1.00 0.00 N +ATOM 2044 HE ARG 300 -29.244 -25.837 -14.901 1.00 0.00 H +ATOM 2045 CZ ARG 300 -28.533 -27.537 -14.093 1.00 0.00 C +ATOM 2046 NH1 ARG 300 -27.546 -28.413 -14.078 1.00 0.00 N +ATOM 2047 HH11 ARG 300 -26.740 -28.308 -14.653 1.00 0.00 H +ATOM 2048 HH12 ARG 300 -27.604 -29.218 -13.465 1.00 0.00 H +ATOM 2049 NH2 ARG 300 -29.593 -27.723 -13.305 1.00 0.00 N +ATOM 2050 HH21 ARG 300 -30.337 -27.049 -13.330 1.00 0.00 H +ATOM 2051 HH22 ARG 300 -29.643 -28.511 -12.706 1.00 0.00 H +ATOM 2052 C ARG 300 -24.416 -23.705 -18.443 1.00 0.00 C +ATOM 2053 O ARG 300 -23.952 -24.554 -19.191 1.00 0.00 O +ATOM 2054 N THR 301 -24.238 -22.398 -18.647 1.00 0.00 N +ATOM 2055 H THR 301 -24.694 -21.774 -17.981 1.00 0.00 H +ATOM 2056 CA THR 301 -23.423 -21.951 -19.781 1.00 0.00 C +ATOM 2057 HA THR 301 -23.268 -22.748 -20.395 1.00 0.00 H +ATOM 2058 CB THR 301 -24.154 -20.889 -20.679 1.00 0.00 C +ATOM 2059 HB THR 301 -23.608 -20.770 -21.533 1.00 0.00 H +ATOM 2060 CG2 THR 301 -25.556 -21.360 -21.005 1.00 0.00 C +ATOM 2061 HG21 THR 301 -25.521 -22.100 -21.682 1.00 0.00 H +ATOM 2062 HG22 THR 301 -26.006 -21.699 -20.175 1.00 0.00 H +ATOM 2063 HG23 THR 301 -26.095 -20.601 -21.380 1.00 0.00 H +ATOM 2064 OG1 THR 301 -24.228 -19.629 -20.004 1.00 0.00 O +ATOM 2065 HG1 THR 301 -24.915 -19.664 -19.270 1.00 0.00 H +ATOM 2066 C THR 301 -22.053 -21.387 -19.382 1.00 0.00 C +ATOM 2067 O THR 301 -21.204 -21.174 -20.242 1.00 0.00 O +ATOM 2068 N LYS 302 -21.823 -21.154 -18.093 1.00 0.00 N +ATOM 2069 H LYS 302 -22.586 -21.387 -17.452 1.00 0.00 H +ATOM 2070 CA LYS 302 -20.535 -20.595 -17.674 1.00 0.00 C +ATOM 2071 HA LYS 302 -19.895 -20.627 -18.471 1.00 0.00 H +ATOM 2072 CB LYS 302 -20.686 -19.101 -17.320 1.00 0.00 C +ATOM 2073 HB2 LYS 302 -21.279 -19.036 -16.517 1.00 0.00 H +ATOM 2074 HB3 LYS 302 -19.778 -18.749 -17.091 1.00 0.00 H +ATOM 2075 CG LYS 302 -21.274 -18.240 -18.425 1.00 0.00 C +ATOM 2076 HG2 LYS 302 -22.184 -18.595 -18.668 1.00 0.00 H +ATOM 2077 HG3 LYS 302 -21.379 -17.298 -18.087 1.00 0.00 H +ATOM 2078 CD LYS 302 -20.412 -18.213 -19.681 1.00 0.00 C +ATOM 2079 HD2 LYS 302 -19.526 -17.824 -19.459 1.00 0.00 H +ATOM 2080 HD3 LYS 302 -20.313 -19.137 -20.028 1.00 0.00 H +ATOM 2081 CE LYS 302 -21.052 -17.352 -20.782 1.00 0.00 C +ATOM 2082 HE2 LYS 302 -21.978 -17.698 -20.960 1.00 0.00 H +ATOM 2083 HE3 LYS 302 -21.119 -16.406 -20.450 1.00 0.00 H +ATOM 2084 NZ LYS 302 -20.267 -17.370 -22.056 1.00 0.00 N +ATOM 2085 HZ1 LYS 302 -19.328 -17.089 -21.866 1.00 0.00 H +ATOM 2086 HZ2 LYS 302 -20.274 -18.295 -22.432 1.00 0.00 H +ATOM 2087 HZ3 LYS 302 -20.684 -16.738 -22.707 1.00 0.00 H +ATOM 2088 C LYS 302 -19.875 -21.312 -16.498 1.00 0.00 C +ATOM 2089 O LYS 302 -19.105 -20.698 -15.763 1.00 0.00 O +ATOM 2090 N ARG 303 -20.147 -22.604 -16.328 1.00 0.00 N +ATOM 2091 H ARG 303 -20.771 -23.023 -17.027 1.00 0.00 H +ATOM 2092 CA ARG 303 -19.568 -23.337 -15.200 1.00 0.00 C +ATOM 2093 HA ARG 303 -19.917 -22.926 -14.337 1.00 0.00 H +ATOM 2094 CB ARG 303 -20.039 -24.794 -15.180 1.00 0.00 C +ATOM 2095 HB2 ARG 303 -21.023 -24.809 -15.259 1.00 0.00 H +ATOM 2096 HB3 ARG 303 -19.609 -25.276 -15.927 1.00 0.00 H +ATOM 2097 CG ARG 303 -19.662 -25.522 -13.875 1.00 0.00 C +ATOM 2098 HG2 ARG 303 -18.674 -25.478 -13.754 1.00 0.00 H +ATOM 2099 HG3 ARG 303 -20.121 -25.075 -13.112 1.00 0.00 H +ATOM 2100 CD ARG 303 -20.081 -26.981 -13.901 1.00 0.00 C +ATOM 2101 HD2 ARG 303 -19.638 -27.418 -14.690 1.00 0.00 H +ATOM 2102 HD3 ARG 303 -19.741 -27.417 -13.060 1.00 0.00 H +ATOM 2103 NE ARG 303 -21.528 -27.189 -13.993 1.00 0.00 N +ATOM 2104 HE ARG 303 -21.924 -27.307 -14.916 1.00 0.00 H +ATOM 2105 CZ ARG 303 -22.358 -27.234 -12.956 1.00 0.00 C +ATOM 2106 NH1 ARG 303 -21.903 -27.077 -11.718 1.00 0.00 N +ATOM 2107 HH11 ARG 303 -20.936 -26.903 -11.548 1.00 0.00 H +ATOM 2108 HH12 ARG 303 -22.540 -27.133 -10.943 1.00 0.00 H +ATOM 2109 NH2 ARG 303 -23.646 -27.480 -13.158 1.00 0.00 N +ATOM 2110 HH21 ARG 303 -23.990 -27.611 -14.090 1.00 0.00 H +ATOM 2111 HH22 ARG 303 -24.275 -27.534 -12.383 1.00 0.00 H +ATOM 2112 C ARG 303 -18.046 -23.309 -15.169 1.00 0.00 C +ATOM 2113 O ARG 303 -17.450 -23.016 -14.134 1.00 0.00 O +ATOM 2114 N ASP 304 -17.408 -23.618 -16.294 1.00 0.00 N +ATOM 2115 H ASP 304 -18.010 -23.844 -17.098 1.00 0.00 H +ATOM 2116 CA ASP 304 -15.945 -23.624 -16.343 1.00 0.00 C +ATOM 2117 HA ASP 304 -15.632 -24.350 -15.719 1.00 0.00 H +ATOM 2118 CB ASP 304 -15.438 -23.869 -17.767 1.00 0.00 C +ATOM 2119 HB2 ASP 304 -15.813 -23.158 -18.351 1.00 0.00 H +ATOM 2120 HB3 ASP 304 -14.446 -23.818 -17.752 1.00 0.00 H +ATOM 2121 CG ASP 304 -15.852 -25.219 -18.310 1.00 0.00 C +ATOM 2122 OD1 ASP 304 -15.508 -26.250 -17.690 1.00 0.00 O +ATOM 2123 OD2 ASP 304 -16.522 -25.239 -19.364 1.00 0.00 O +ATOM 2124 C ASP 304 -15.375 -22.313 -15.830 1.00 0.00 C +ATOM 2125 O ASP 304 -14.464 -22.313 -15.010 1.00 0.00 O +ATOM 2126 N TRP 305 -15.908 -21.198 -16.320 1.00 0.00 N +ATOM 2127 H TRP 305 -16.665 -21.343 -17.015 1.00 0.00 H +ATOM 2128 CA TRP 305 -15.447 -19.875 -15.898 1.00 0.00 C +ATOM 2129 HA TRP 305 -14.455 -19.833 -16.050 1.00 0.00 H +ATOM 2130 CB TRP 305 -16.178 -18.769 -16.674 1.00 0.00 C +ATOM 2131 HB2 TRP 305 -16.129 -18.965 -17.644 1.00 0.00 H +ATOM 2132 HB3 TRP 305 -17.119 -18.723 -16.367 1.00 0.00 H +ATOM 2133 CG TRP 305 -15.583 -17.381 -16.476 1.00 0.00 C +ATOM 2134 CD1 TRP 305 -14.605 -16.794 -17.230 1.00 0.00 C +ATOM 2135 HD1 TRP 305 -14.170 -17.210 -18.028 1.00 0.00 H +ATOM 2136 NE1 TRP 305 -14.305 -15.549 -16.734 1.00 0.00 N +ATOM 2137 HE1 TRP 305 -13.624 -14.921 -17.112 1.00 0.00 H +ATOM 2138 CE2 TRP 305 -15.087 -15.304 -15.639 1.00 0.00 C +ATOM 2139 CZ2 TRP 305 -15.143 -14.180 -14.801 1.00 0.00 C +ATOM 2140 HZ2 TRP 305 -14.543 -13.394 -14.973 1.00 0.00 H +ATOM 2141 CH2 TRP 305 -16.036 -14.206 -13.758 1.00 0.00 C +ATOM 2142 HH2 TRP 305 -16.103 -13.426 -13.138 1.00 0.00 H +ATOM 2143 CZ3 TRP 305 -16.871 -15.317 -13.538 1.00 0.00 C +ATOM 2144 HZ3 TRP 305 -17.511 -15.313 -12.780 1.00 0.00 H +ATOM 2145 CE3 TRP 305 -16.817 -16.438 -14.373 1.00 0.00 C +ATOM 2146 HE3 TRP 305 -17.412 -17.214 -14.203 1.00 0.00 H +ATOM 2147 CD2 TRP 305 -15.912 -16.433 -15.442 1.00 0.00 C +ATOM 2148 C TRP 305 -15.692 -19.669 -14.402 1.00 0.00 C +ATOM 2149 O TRP 305 -14.809 -19.222 -13.675 1.00 0.00 O +ATOM 2150 N LEU 306 -16.897 -19.995 -13.943 1.00 0.00 N +ATOM 2151 H LEU 306 -17.551 -20.370 -14.647 1.00 0.00 H +ATOM 2152 CA LEU 306 -17.230 -19.819 -12.533 1.00 0.00 C +ATOM 2153 HA LEU 306 -17.155 -18.836 -12.307 1.00 0.00 H +ATOM 2154 CB LEU 306 -18.679 -20.241 -12.273 1.00 0.00 C +ATOM 2155 HB2 LEU 306 -18.811 -21.132 -12.666 1.00 0.00 H +ATOM 2156 HB3 LEU 306 -18.829 -20.232 -11.303 1.00 0.00 H +ATOM 2157 CG LEU 306 -19.695 -19.297 -12.911 1.00 0.00 C +ATOM 2158 HG LEU 306 -19.384 -19.058 -13.830 1.00 0.00 H +ATOM 2159 CD1 LEU 306 -21.053 -19.967 -12.993 1.00 0.00 C +ATOM 2160 HD11 LEU 306 -21.366 -20.209 -12.073 1.00 0.00 H +ATOM 2161 HD12 LEU 306 -21.713 -19.341 -13.412 1.00 0.00 H +ATOM 2162 HD13 LEU 306 -20.986 -20.797 -13.548 1.00 0.00 H +ATOM 2163 CD2 LEU 306 -19.769 -18.011 -12.098 1.00 0.00 C +ATOM 2164 HD21 LEU 306 -18.869 -17.573 -12.083 1.00 0.00 H +ATOM 2165 HD22 LEU 306 -20.434 -17.391 -12.514 1.00 0.00 H +ATOM 2166 HD23 LEU 306 -20.052 -18.223 -11.162 1.00 0.00 H +ATOM 2167 C LEU 306 -16.291 -20.594 -11.618 1.00 0.00 C +ATOM 2168 O LEU 306 -15.801 -20.061 -10.624 1.00 0.00 O +ATOM 2169 N VAL 307 -16.037 -21.850 -11.955 1.00 0.00 N +ATOM 2170 H VAL 307 -16.500 -22.182 -12.814 1.00 0.00 H +ATOM 2171 CA VAL 307 -15.155 -22.673 -11.136 1.00 0.00 C +ATOM 2172 HA VAL 307 -15.501 -22.661 -10.192 1.00 0.00 H +ATOM 2173 CB VAL 307 -15.143 -24.141 -11.644 1.00 0.00 C +ATOM 2174 HB VAL 307 -14.859 -24.122 -12.597 1.00 0.00 H +ATOM 2175 CG1 VAL 307 -14.119 -24.965 -10.883 1.00 0.00 C +ATOM 2176 HG11 VAL 307 -14.459 -25.899 -10.766 1.00 0.00 H +ATOM 2177 HG12 VAL 307 -13.259 -24.987 -11.394 1.00 0.00 H +ATOM 2178 HG13 VAL 307 -13.960 -24.556 -9.984 1.00 0.00 H +ATOM 2179 CG2 VAL 307 -16.537 -24.742 -11.481 1.00 0.00 C +ATOM 2180 HG21 VAL 307 -16.594 -25.201 -10.595 1.00 0.00 H +ATOM 2181 HG22 VAL 307 -17.216 -24.011 -11.528 1.00 0.00 H +ATOM 2182 HG23 VAL 307 -16.697 -25.401 -12.215 1.00 0.00 H +ATOM 2183 C VAL 307 -13.741 -22.099 -11.125 1.00 0.00 C +ATOM 2184 O VAL 307 -13.110 -21.996 -10.069 1.00 0.00 O +ATOM 2185 N LYS 308 -13.249 -21.704 -12.293 1.00 0.00 N +ATOM 2186 H LYS 308 -13.872 -21.830 -13.103 1.00 0.00 H +ATOM 2187 CA LYS 308 -11.906 -21.133 -12.378 1.00 0.00 C +ATOM 2188 HA LYS 308 -11.246 -21.792 -12.001 1.00 0.00 H +ATOM 2189 CB LYS 308 -11.521 -20.884 -13.844 1.00 0.00 C +ATOM 2190 HB2 LYS 308 -11.676 -21.725 -14.353 1.00 0.00 H +ATOM 2191 HB3 LYS 308 -12.102 -20.157 -14.198 1.00 0.00 H +ATOM 2192 CG LYS 308 -10.063 -20.470 -14.035 1.00 0.00 C +ATOM 2193 HG2 LYS 308 -9.967 -19.500 -13.791 1.00 0.00 H +ATOM 2194 HG3 LYS 308 -9.487 -21.017 -13.421 1.00 0.00 H +ATOM 2195 CD LYS 308 -9.578 -20.665 -15.467 1.00 0.00 C +ATOM 2196 HD2 LYS 308 -9.666 -21.617 -15.710 1.00 0.00 H +ATOM 2197 HD3 LYS 308 -10.102 -20.084 -16.067 1.00 0.00 H +ATOM 2198 CE LYS 308 -8.105 -20.270 -15.570 1.00 0.00 C +ATOM 2199 HE2 LYS 308 -7.729 -20.632 -16.413 1.00 0.00 H +ATOM 2200 HE3 LYS 308 -8.031 -19.281 -15.549 1.00 0.00 H +ATOM 2201 NZ LYS 308 -7.345 -20.845 -14.406 1.00 0.00 N +ATOM 2202 HZ1 LYS 308 -6.403 -21.012 -14.685 1.00 0.00 H +ATOM 2203 HZ2 LYS 308 -7.367 -20.193 -13.652 1.00 0.00 H +ATOM 2204 HZ3 LYS 308 -7.775 -21.701 -14.130 1.00 0.00 H +ATOM 2205 C LYS 308 -11.812 -19.834 -11.569 1.00 0.00 C +ATOM 2206 O LYS 308 -10.761 -19.522 -11.011 1.00 0.00 O +ATOM 2207 N GLN 309 -12.916 -19.093 -11.480 1.00 0.00 N +ATOM 2208 H GLN 309 -13.738 -19.468 -11.979 1.00 0.00 H +ATOM 2209 CA GLN 309 -12.922 -17.846 -10.722 1.00 0.00 C +ATOM 2210 HA GLN 309 -11.984 -17.463 -10.743 1.00 0.00 H +ATOM 2211 CB GLN 309 -13.872 -16.832 -11.364 1.00 0.00 C +ATOM 2212 HB2 GLN 309 -14.777 -17.254 -11.456 1.00 0.00 H +ATOM 2213 HB3 GLN 309 -13.944 -16.033 -10.761 1.00 0.00 H +ATOM 2214 CG GLN 309 -13.433 -16.350 -12.736 1.00 0.00 C +ATOM 2215 HG2 GLN 309 -13.461 -17.122 -13.371 1.00 0.00 H +ATOM 2216 HG3 GLN 309 -14.067 -15.641 -13.045 1.00 0.00 H +ATOM 2217 CD GLN 309 -12.032 -15.779 -12.731 1.00 0.00 C +ATOM 2218 OE1 GLN 309 -11.704 -14.917 -11.908 1.00 0.00 O +ATOM 2219 NE2 GLN 309 -11.196 -16.252 -13.647 1.00 0.00 N +ATOM 2220 HE21 GLN 309 -10.241 -15.906 -13.714 1.00 0.00 H +ATOM 2221 HE22 GLN 309 -11.525 -16.973 -14.288 1.00 0.00 H +ATOM 2222 C GLN 309 -13.304 -18.048 -9.253 1.00 0.00 C +ATOM 2223 O GLN 309 -13.660 -17.099 -8.564 1.00 0.00 O +ATOM 2224 N ARG 310 -13.260 -19.298 -8.798 1.00 0.00 N +ATOM 2225 H ARG 310 -12.992 -20.009 -9.518 1.00 0.00 H +ATOM 2226 CA ARG 310 -13.561 -19.655 -7.407 1.00 0.00 C +ATOM 2227 HA ARG 310 -13.294 -20.640 -7.265 1.00 0.00 H +ATOM 2228 CB ARG 310 -12.605 -18.913 -6.455 1.00 0.00 C +ATOM 2229 HB2 ARG 310 -12.560 -17.965 -6.736 1.00 0.00 H +ATOM 2230 HB3 ARG 310 -12.956 -18.996 -5.534 1.00 0.00 H +ATOM 2231 CG ARG 310 -11.176 -19.478 -6.468 1.00 0.00 C +ATOM 2232 HG2 ARG 310 -11.160 -20.344 -5.969 1.00 0.00 H +ATOM 2233 HG3 ARG 310 -10.892 -19.632 -7.414 1.00 0.00 H +ATOM 2234 CD ARG 310 -10.153 -18.538 -5.816 1.00 0.00 C +ATOM 2235 HD2 ARG 310 -9.293 -19.041 -5.725 1.00 0.00 H +ATOM 2236 HD3 ARG 310 -10.021 -17.760 -6.432 1.00 0.00 H +ATOM 2237 NE ARG 310 -10.570 -18.050 -4.501 1.00 0.00 N +ATOM 2238 HE ARG 310 -10.736 -17.054 -4.406 1.00 0.00 H +ATOM 2239 CZ ARG 310 -10.749 -18.806 -3.424 1.00 0.00 C +ATOM 2240 NH1 ARG 310 -10.551 -20.116 -3.478 1.00 0.00 N +ATOM 2241 HH11 ARG 310 -10.245 -20.553 -4.321 1.00 0.00 H +ATOM 2242 HH12 ARG 310 -10.709 -20.678 -2.659 1.00 0.00 H +ATOM 2243 NH2 ARG 310 -11.135 -18.238 -2.288 1.00 0.00 N +ATOM 2244 HH21 ARG 310 -11.270 -17.247 -2.242 1.00 0.00 H +ATOM 2245 HH22 ARG 310 -11.291 -18.800 -1.475 1.00 0.00 H +ATOM 2246 C ARG 310 -15.009 -19.484 -6.950 1.00 0.00 C +ATOM 2247 O ARG 310 -15.268 -19.281 -5.769 1.00 0.00 O +ATOM 2248 N GLY 311 -15.940 -19.577 -7.895 1.00 0.00 N +ATOM 2249 H GLY 311 -15.578 -19.721 -8.854 1.00 0.00 H +ATOM 2250 CA GLY 311 -17.353 -19.479 -7.568 1.00 0.00 C +ATOM 2251 HA2 GLY 311 -17.898 -19.492 -8.441 1.00 0.00 H +ATOM 2252 HA3 GLY 311 -17.638 -20.331 -7.066 1.00 0.00 H +ATOM 2253 C GLY 311 -17.759 -18.269 -6.753 1.00 0.00 C +ATOM 2254 O GLY 311 -17.192 -17.194 -6.911 1.00 0.00 O +ATOM 2255 N TRP 312 -18.734 -18.445 -5.866 1.00 0.00 N +ATOM 2256 H TRP 312 -19.110 -19.405 -5.810 1.00 0.00 H +ATOM 2257 CA TRP 312 -19.204 -17.337 -5.056 1.00 0.00 C +ATOM 2258 HA TRP 312 -19.419 -16.563 -5.681 1.00 0.00 H +ATOM 2259 CB TRP 312 -20.528 -17.714 -4.385 1.00 0.00 C +ATOM 2260 HB2 TRP 312 -20.415 -18.561 -3.904 1.00 0.00 H +ATOM 2261 HB3 TRP 312 -20.812 -16.981 -3.798 1.00 0.00 H +ATOM 2262 CG TRP 312 -21.611 -17.918 -5.408 1.00 0.00 C +ATOM 2263 CD1 TRP 312 -22.114 -19.110 -5.855 1.00 0.00 C +ATOM 2264 HD1 TRP 312 -21.844 -20.009 -5.517 1.00 0.00 H +ATOM 2265 NE1 TRP 312 -23.050 -18.891 -6.843 1.00 0.00 N +ATOM 2266 HE1 TRP 312 -23.559 -19.598 -7.327 1.00 0.00 H +ATOM 2267 CE2 TRP 312 -23.165 -17.541 -7.050 1.00 0.00 C +ATOM 2268 CZ2 TRP 312 -23.979 -16.829 -7.943 1.00 0.00 C +ATOM 2269 HZ2 TRP 312 -24.602 -17.321 -8.557 1.00 0.00 H +ATOM 2270 CH2 TRP 312 -23.884 -15.462 -7.937 1.00 0.00 C +ATOM 2271 HH2 TRP 312 -24.446 -14.917 -8.558 1.00 0.00 H +ATOM 2272 CZ3 TRP 312 -23.001 -14.790 -7.064 1.00 0.00 C +ATOM 2273 HZ3 TRP 312 -22.953 -13.799 -7.082 1.00 0.00 H +ATOM 2274 CE3 TRP 312 -22.194 -15.496 -6.178 1.00 0.00 C +ATOM 2275 HE3 TRP 312 -21.575 -15.010 -5.568 1.00 0.00 H +ATOM 2276 CD2 TRP 312 -22.273 -16.895 -6.162 1.00 0.00 C +ATOM 2277 C TRP 312 -18.173 -16.830 -4.049 1.00 0.00 C +ATOM 2278 O TRP 312 -18.248 -15.684 -3.600 1.00 0.00 O +ATOM 2279 N ASP 313 -17.200 -17.662 -3.693 1.00 0.00 N +ATOM 2280 H ASP 313 -17.237 -18.598 -4.090 1.00 0.00 H +ATOM 2281 CA ASP 313 -16.167 -17.185 -2.776 1.00 0.00 C +ATOM 2282 HA ASP 313 -16.623 -16.709 -2.041 1.00 0.00 H +ATOM 2283 CB ASP 313 -15.235 -18.307 -2.338 1.00 0.00 C +ATOM 2284 HB2 ASP 313 -14.914 -18.779 -3.151 1.00 0.00 H +ATOM 2285 HB3 ASP 313 -14.473 -17.903 -1.846 1.00 0.00 H +ATOM 2286 CG ASP 313 -15.921 -19.311 -1.433 1.00 0.00 C +ATOM 2287 OD1 ASP 313 -16.655 -18.880 -0.517 1.00 0.00 O +ATOM 2288 OD2 ASP 313 -15.721 -20.525 -1.634 1.00 0.00 O +ATOM 2289 C ASP 313 -15.376 -16.151 -3.561 1.00 0.00 C +ATOM 2290 O ASP 313 -14.967 -15.123 -3.014 1.00 0.00 O +ATOM 2291 N GLY 314 -15.181 -16.427 -4.850 1.00 0.00 N +ATOM 2292 H GLY 314 -15.578 -17.322 -5.173 1.00 0.00 H +ATOM 2293 CA GLY 314 -14.453 -15.501 -5.703 1.00 0.00 C +ATOM 2294 HA2 GLY 314 -13.563 -15.285 -5.285 1.00 0.00 H +ATOM 2295 HA3 GLY 314 -14.285 -15.929 -6.599 1.00 0.00 H +ATOM 2296 C GLY 314 -15.239 -14.212 -5.902 1.00 0.00 C +ATOM 2297 O GLY 314 -14.670 -13.125 -5.933 1.00 0.00 O +ATOM 2298 N PHE 315 -16.550 -14.349 -6.055 1.00 0.00 N +ATOM 2299 H PHE 315 -16.884 -15.342 -6.033 1.00 0.00 H +ATOM 2300 CA PHE 315 -17.450 -13.216 -6.238 1.00 0.00 C +ATOM 2301 HA PHE 315 -17.134 -12.716 -7.046 1.00 0.00 H +ATOM 2302 CB PHE 315 -18.892 -13.727 -6.340 1.00 0.00 C +ATOM 2303 HB2 PHE 315 -18.956 -14.288 -7.155 1.00 0.00 H +ATOM 2304 HB3 PHE 315 -19.080 -14.264 -5.527 1.00 0.00 H +ATOM 2305 CG PHE 315 -19.936 -12.648 -6.435 1.00 0.00 C +ATOM 2306 CD1 PHE 315 -20.142 -11.951 -7.624 1.00 0.00 C +ATOM 2307 HD1 PHE 315 -19.563 -12.131 -8.412 1.00 0.00 H +ATOM 2308 CE1 PHE 315 -21.157 -10.998 -7.728 1.00 0.00 C +ATOM 2309 HE1 PHE 315 -21.297 -10.515 -8.595 1.00 0.00 H +ATOM 2310 CZ PHE 315 -21.963 -10.728 -6.626 1.00 0.00 C +ATOM 2311 HZ PHE 315 -22.686 -10.044 -6.694 1.00 0.00 H +ATOM 2312 CE2 PHE 315 -21.756 -11.415 -5.433 1.00 0.00 C +ATOM 2313 HE2 PHE 315 -22.341 -11.225 -4.628 1.00 0.00 H +ATOM 2314 CD2 PHE 315 -20.746 -12.361 -5.342 1.00 0.00 C +ATOM 2315 HD2 PHE 315 -20.598 -12.845 -4.478 1.00 0.00 H +ATOM 2316 C PHE 315 -17.323 -12.260 -5.052 1.00 0.00 C +ATOM 2317 O PHE 315 -17.168 -11.053 -5.223 1.00 0.00 O +ATOM 2318 N VAL 316 -17.398 -12.819 -3.850 1.00 0.00 N +ATOM 2319 H VAL 316 -17.527 -13.853 -3.859 1.00 0.00 H +ATOM 2320 CA VAL 316 -17.305 -12.036 -2.627 1.00 0.00 C +ATOM 2321 HA VAL 316 -18.019 -11.319 -2.655 1.00 0.00 H +ATOM 2322 CB VAL 316 -17.572 -12.943 -1.391 1.00 0.00 C +ATOM 2323 HB VAL 316 -16.970 -13.732 -1.470 1.00 0.00 H +ATOM 2324 CG1 VAL 316 -17.214 -12.225 -0.108 1.00 0.00 C +ATOM 2325 HG11 VAL 316 -16.431 -12.675 0.324 1.00 0.00 H +ATOM 2326 HG12 VAL 316 -16.978 -11.273 -0.308 1.00 0.00 H +ATOM 2327 HG13 VAL 316 -17.993 -12.246 0.520 1.00 0.00 H +ATOM 2328 CG2 VAL 316 -19.034 -13.352 -1.366 1.00 0.00 C +ATOM 2329 HG21 VAL 316 -19.224 -13.853 -0.521 1.00 0.00 H +ATOM 2330 HG22 VAL 316 -19.608 -12.534 -1.407 1.00 0.00 H +ATOM 2331 HG23 VAL 316 -19.228 -13.938 -2.153 1.00 0.00 H +ATOM 2332 C VAL 316 -15.951 -11.338 -2.486 1.00 0.00 C +ATOM 2333 O VAL 316 -15.879 -10.180 -2.059 1.00 0.00 O +ATOM 2334 N GLU 317 -14.883 -12.042 -2.854 1.00 0.00 N +ATOM 2335 H GLU 317 -15.092 -13.000 -3.199 1.00 0.00 H +ATOM 2336 CA GLU 317 -13.536 -11.493 -2.772 1.00 0.00 C +ATOM 2337 HA GLU 317 -13.370 -11.138 -1.844 1.00 0.00 H +ATOM 2338 CB GLU 317 -12.481 -12.571 -3.051 1.00 0.00 C +ATOM 2339 HB2 GLU 317 -12.613 -12.880 -3.983 1.00 0.00 H +ATOM 2340 HB3 GLU 317 -11.592 -12.152 -2.938 1.00 0.00 H +ATOM 2341 CG GLU 317 -12.538 -13.785 -2.149 1.00 0.00 C +ATOM 2342 HG2 GLU 317 -12.380 -13.497 -1.226 1.00 0.00 H +ATOM 2343 HG3 GLU 317 -13.405 -14.225 -2.268 1.00 0.00 H +ATOM 2344 CD GLU 317 -11.460 -14.806 -2.497 1.00 0.00 C +ATOM 2345 OE1 GLU 317 -11.286 -15.099 -3.704 1.00 0.00 O +ATOM 2346 OE2 GLU 317 -10.791 -15.314 -1.570 1.00 0.00 O +ATOM 2347 C GLU 317 -13.347 -10.373 -3.785 1.00 0.00 C +ATOM 2348 O GLU 317 -12.708 -9.370 -3.488 1.00 0.00 O +ATOM 2349 N PHE 318 -13.903 -10.554 -4.982 1.00 0.00 N +ATOM 2350 H PHE 318 -14.429 -11.445 -5.085 1.00 0.00 H +ATOM 2351 CA PHE 318 -13.772 -9.570 -6.046 1.00 0.00 C +ATOM 2352 HA PHE 318 -12.782 -9.417 -6.185 1.00 0.00 H +ATOM 2353 CB PHE 318 -14.452 -10.090 -7.317 1.00 0.00 C +ATOM 2354 HB2 PHE 318 -14.103 -10.997 -7.496 1.00 0.00 H +ATOM 2355 HB3 PHE 318 -15.427 -10.104 -7.153 1.00 0.00 H +ATOM 2356 CG PHE 318 -14.196 -9.244 -8.532 1.00 0.00 C +ATOM 2357 CD1 PHE 318 -12.948 -9.247 -9.151 1.00 0.00 C +ATOM 2358 HD1 PHE 318 -12.214 -9.809 -8.785 1.00 0.00 H +ATOM 2359 CE1 PHE 318 -12.711 -8.470 -10.285 1.00 0.00 C +ATOM 2360 HE1 PHE 318 -11.806 -8.485 -10.717 1.00 0.00 H +ATOM 2361 CZ PHE 318 -13.733 -7.679 -10.806 1.00 0.00 C +ATOM 2362 HZ PHE 318 -13.569 -7.123 -11.616 1.00 0.00 H +ATOM 2363 CE2 PHE 318 -14.986 -7.671 -10.188 1.00 0.00 C +ATOM 2364 HE2 PHE 318 -15.731 -7.098 -10.559 1.00 0.00 H +ATOM 2365 CD2 PHE 318 -15.206 -8.450 -9.061 1.00 0.00 C +ATOM 2366 HD2 PHE 318 -16.107 -8.441 -8.622 1.00 0.00 H +ATOM 2367 C PHE 318 -14.374 -8.229 -5.662 1.00 0.00 C +ATOM 2368 O PHE 318 -13.821 -7.177 -5.980 1.00 0.00 O +ATOM 2369 N PHE 319 -15.495 -8.275 -4.950 1.00 0.00 N +ATOM 2370 H PHE 319 -15.820 -9.231 -4.708 1.00 0.00 H +ATOM 2371 CA PHE 319 -16.196 -7.061 -4.551 1.00 0.00 C +ATOM 2372 HA PHE 319 -15.856 -6.310 -5.159 1.00 0.00 H +ATOM 2373 CB PHE 319 -17.685 -7.247 -4.792 1.00 0.00 C +ATOM 2374 HB2 PHE 319 -17.942 -8.144 -4.459 1.00 0.00 H +ATOM 2375 HB3 PHE 319 -18.168 -6.534 -4.303 1.00 0.00 H +ATOM 2376 CG PHE 319 -18.090 -7.163 -6.243 1.00 0.00 C +ATOM 2377 CD1 PHE 319 -18.040 -5.950 -6.913 1.00 0.00 C +ATOM 2378 HD1 PHE 319 -17.728 -5.131 -6.441 1.00 0.00 H +ATOM 2379 CE1 PHE 319 -18.422 -5.856 -8.254 1.00 0.00 C +ATOM 2380 HE1 PHE 319 -18.436 -4.956 -8.701 1.00 0.00 H +ATOM 2381 CZ PHE 319 -18.780 -7.001 -8.956 1.00 0.00 C +ATOM 2382 HZ PHE 319 -19.001 -6.942 -9.925 1.00 0.00 H +ATOM 2383 CE2 PHE 319 -18.824 -8.218 -8.294 1.00 0.00 C +ATOM 2384 HE2 PHE 319 -19.135 -9.053 -8.780 1.00 0.00 H +ATOM 2385 CD2 PHE 319 -18.445 -8.302 -6.964 1.00 0.00 C +ATOM 2386 HD2 PHE 319 -18.424 -9.195 -6.510 1.00 0.00 H +ATOM 2387 C PHE 319 -15.959 -6.591 -3.113 1.00 0.00 C +ATOM 2388 O PHE 319 -16.508 -5.563 -2.702 1.00 0.00 O +ATOM 2389 N HIE 320 -15.142 -7.327 -2.360 1.00 0.00 N +ATOM 2390 H HIE 320 -14.746 -8.163 -2.844 1.00 0.00 H +ATOM 2391 CA HIE 320 -14.827 -6.989 -0.970 1.00 0.00 C +ATOM 2392 HA HIE 320 -15.658 -7.155 -0.409 1.00 0.00 H +ATOM 2393 CB HIE 320 -13.721 -7.908 -0.459 1.00 0.00 C +ATOM 2394 HB2 HIE 320 -14.045 -8.860 -0.483 1.00 0.00 H +ATOM 2395 HB3 HIE 320 -12.921 -7.827 -1.063 1.00 0.00 H +ATOM 2396 CG HIE 320 -13.281 -7.599 0.943 1.00 0.00 C +ATOM 2397 ND1 HIE 320 -12.082 -7.001 1.233 1.00 0.00 N +ATOM 2398 CE1 HIE 320 -11.992 -6.810 2.544 1.00 0.00 C +ATOM 2399 HE1 HIE 320 -11.224 -6.395 3.018 1.00 0.00 H +ATOM 2400 NE2 HIE 320 -13.094 -7.268 3.099 1.00 0.00 N +ATOM 2401 HE2 HIE 320 -13.305 -7.253 4.087 1.00 0.00 H +ATOM 2402 CD2 HIE 320 -13.922 -7.773 2.122 1.00 0.00 C +ATOM 2403 HD2 HIE 320 -14.814 -8.185 2.260 1.00 0.00 H +ATOM 2404 C HIE 320 -14.408 -5.537 -0.782 1.00 0.00 C +ATOM 2405 O HIE 320 -13.615 -5.004 -1.559 1.00 0.00 O +ATOM 2406 N VAL 321 -14.952 -4.910 0.258 1.00 0.00 N +ATOM 2407 H VAL 321 -15.604 -5.489 0.824 1.00 0.00 H +ATOM 2408 CA VAL 321 -14.645 -3.513 0.566 1.00 0.00 C +ATOM 2409 HA VAL 321 -14.327 -3.069 -0.278 1.00 0.00 H +ATOM 2410 CB VAL 321 -15.896 -2.762 1.098 1.00 0.00 C +ATOM 2411 HB VAL 321 -15.663 -1.800 1.156 1.00 0.00 H +ATOM 2412 CG1 VAL 321 -17.041 -2.889 0.101 1.00 0.00 C +ATOM 2413 HG11 VAL 321 -16.676 -2.876 -0.829 1.00 0.00 H +ATOM 2414 HG12 VAL 321 -17.525 -3.750 0.257 1.00 0.00 H +ATOM 2415 HG13 VAL 321 -17.674 -2.125 0.221 1.00 0.00 H +ATOM 2416 CG2 VAL 321 -16.310 -3.320 2.445 1.00 0.00 C +ATOM 2417 HG21 VAL 321 -16.918 -4.103 2.309 1.00 0.00 H +ATOM 2418 HG22 VAL 321 -15.496 -3.613 2.949 1.00 0.00 H +ATOM 2419 HG23 VAL 321 -16.789 -2.612 2.966 1.00 0.00 H +ATOM 2420 C VAL 321 -13.520 -3.423 1.597 1.00 0.00 C +ATOM 2421 O VAL 321 -12.468 -2.832 1.254 1.00 0.00 O +ATOM 2422 OXT VAL 321 -13.431 -3.824 2.731 1.00 0.00 O +END diff --git a/receptor/pdb_files/6o6f_M231L_H.pdb b/receptor/pdb_files/6o6f_M231L_H.pdb new file mode 100644 index 0000000..ebc3548 --- /dev/null +++ b/receptor/pdb_files/6o6f_M231L_H.pdb @@ -0,0 +1,2431 @@ +HELIX 1 1 GLU 173 THR 191 1 19 +HELIX 2 2 GLY 203 ASN 223 1 21 +HELIX 3 3 GLU 225 LEU 235 1 11 +HELIX 4 4 GLU 240 SER 255 1 16 +HELIX 5 5 TRP 261 THR 280 1 20 +HELIX 6 6 GLU 284 THR 301 1 18 +HELIX 7 7 ARG 303 LYS 308 1 6 +HELIX 8 8 GLY 311 PHE 319 1 9 +ATOM 1 N SER 171 -23.840 -34.508 -6.167 1.00 0.00 N +ATOM 2 H1 SER 171 -24.073 -34.914 -5.272 1.00 0.00 H +ATOM 3 H2 SER 171 -23.979 -34.837 -5.236 1.00 0.00 H +ATOM 4 H3 SER 171 -23.978 -35.254 -6.813 1.00 0.00 H +ATOM 5 CA SER 171 -24.823 -33.425 -6.454 1.00 0.00 C +ATOM 6 HA SER 171 -25.412 -33.750 -7.212 1.00 0.00 H +ATOM 7 CB SER 171 -25.708 -33.194 -5.243 1.00 0.00 C +ATOM 8 HB2 SER 171 -26.374 -32.476 -5.458 1.00 0.00 H +ATOM 9 HB3 SER 171 -26.200 -34.043 -5.033 1.00 0.00 H +ATOM 10 OG SER 171 -24.971 -32.802 -4.100 1.00 0.00 O +ATOM 11 HG SER 171 -24.797 -31.818 -4.136 1.00 0.00 H +ATOM 12 C SER 171 -24.177 -32.110 -6.883 1.00 0.00 C +ATOM 13 O SER 171 -22.964 -31.912 -6.751 1.00 0.00 O +ATOM 14 N ASP 172 -25.017 -31.207 -7.377 1.00 0.00 N +ATOM 15 H ASP 172 -26.019 -31.507 -7.379 1.00 0.00 H +ATOM 16 CA ASP 172 -24.576 -29.909 -7.873 1.00 0.00 C +ATOM 17 HA ASP 172 -23.602 -30.008 -8.149 1.00 0.00 H +ATOM 18 CB ASP 172 -25.432 -29.532 -9.076 1.00 0.00 C +ATOM 19 HB2 ASP 172 -25.664 -30.370 -9.561 1.00 0.00 H +ATOM 20 HB3 ASP 172 -26.258 -29.091 -8.739 1.00 0.00 H +ATOM 21 CG ASP 172 -24.727 -28.599 -10.018 1.00 0.00 C +ATOM 22 OD1 ASP 172 -23.703 -27.997 -9.623 1.00 0.00 O +ATOM 23 OD2 ASP 172 -25.214 -28.470 -11.157 1.00 0.00 O +ATOM 24 C ASP 172 -24.625 -28.796 -6.824 1.00 0.00 C +ATOM 25 O ASP 172 -25.612 -28.057 -6.729 1.00 0.00 O +ATOM 26 N GLU 173 -23.548 -28.683 -6.049 1.00 0.00 N +ATOM 27 H GLU 173 -22.790 -29.365 -6.257 1.00 0.00 H +ATOM 28 CA GLU 173 -23.453 -27.676 -4.995 1.00 0.00 C +ATOM 29 HA GLU 173 -24.232 -27.772 -4.359 1.00 0.00 H +ATOM 30 CB GLU 173 -22.200 -27.947 -4.155 1.00 0.00 C +ATOM 31 HB2 GLU 173 -22.347 -28.794 -3.669 1.00 0.00 H +ATOM 32 HB3 GLU 173 -21.435 -28.012 -4.775 1.00 0.00 H +ATOM 33 CG GLU 173 -21.879 -26.877 -3.134 1.00 0.00 C +ATOM 34 HG2 GLU 173 -21.026 -27.114 -2.693 1.00 0.00 H +ATOM 35 HG3 GLU 173 -21.810 -26.008 -3.602 1.00 0.00 H +ATOM 36 CD GLU 173 -22.924 -26.721 -2.045 1.00 0.00 C +ATOM 37 OE1 GLU 173 -23.943 -27.446 -2.041 1.00 0.00 O +ATOM 38 OE2 GLU 173 -22.734 -25.830 -1.194 1.00 0.00 O +ATOM 39 C GLU 173 -23.443 -26.240 -5.559 1.00 0.00 C +ATOM 40 O GLU 173 -24.129 -25.350 -5.049 1.00 0.00 O +ATOM 41 N LEU 174 -22.675 -26.019 -6.620 1.00 0.00 N +ATOM 42 H LEU 174 -22.143 -26.835 -6.959 1.00 0.00 H +ATOM 43 CA LEU 174 -22.619 -24.699 -7.230 1.00 0.00 C +ATOM 44 HA LEU 174 -22.328 -24.032 -6.531 1.00 0.00 H +ATOM 45 CB LEU 174 -21.586 -24.661 -8.357 1.00 0.00 C +ATOM 46 HB2 LEU 174 -20.686 -24.796 -7.952 1.00 0.00 H +ATOM 47 HB3 LEU 174 -21.794 -25.401 -8.988 1.00 0.00 H +ATOM 48 CG LEU 174 -21.530 -23.367 -9.171 1.00 0.00 C +ATOM 49 HG LEU 174 -22.441 -23.160 -9.522 1.00 0.00 H +ATOM 50 CD1 LEU 174 -21.054 -22.201 -8.293 1.00 0.00 C +ATOM 51 HD11 LEU 174 -20.143 -22.406 -7.942 1.00 0.00 H +ATOM 52 HD12 LEU 174 -21.025 -21.368 -8.842 1.00 0.00 H +ATOM 53 HD13 LEU 174 -21.690 -22.082 -7.533 1.00 0.00 H +ATOM 54 CD2 LEU 174 -20.605 -23.568 -10.350 1.00 0.00 C +ATOM 55 HD21 LEU 174 -20.947 -24.313 -10.927 1.00 0.00 H +ATOM 56 HD22 LEU 174 -20.559 -22.727 -10.893 1.00 0.00 H +ATOM 57 HD23 LEU 174 -19.686 -23.800 -10.025 1.00 0.00 H +ATOM 58 C LEU 174 -23.982 -24.270 -7.762 1.00 0.00 C +ATOM 59 O LEU 174 -24.374 -23.103 -7.633 1.00 0.00 O +ATOM 60 N TYR 175 -24.715 -25.192 -8.372 1.00 0.00 N +ATOM 61 H TYR 175 -24.296 -26.118 -8.460 1.00 0.00 H +ATOM 62 CA TYR 175 -26.039 -24.830 -8.864 1.00 0.00 C +ATOM 63 HA TYR 175 -25.951 -24.004 -9.436 1.00 0.00 H +ATOM 64 CB TYR 175 -26.649 -25.942 -9.716 1.00 0.00 C +ATOM 65 HB2 TYR 175 -26.023 -26.152 -10.448 1.00 0.00 H +ATOM 66 HB3 TYR 175 -26.811 -26.724 -9.137 1.00 0.00 H +ATOM 67 CG TYR 175 -27.958 -25.506 -10.312 1.00 0.00 C +ATOM 68 CD1 TYR 175 -27.995 -24.770 -11.495 1.00 0.00 C +ATOM 69 HD1 TYR 175 -27.147 -24.606 -12.002 1.00 0.00 H +ATOM 70 CE1 TYR 175 -29.191 -24.255 -11.988 1.00 0.00 C +ATOM 71 HE1 TYR 175 -29.198 -23.731 -12.840 1.00 0.00 H +ATOM 72 CZ TYR 175 -30.369 -24.474 -11.292 1.00 0.00 C +ATOM 73 OH TYR 175 -31.551 -23.926 -11.754 1.00 0.00 O +ATOM 74 HH TYR 175 -31.551 -23.947 -12.751 1.00 0.00 H +ATOM 75 CE2 TYR 175 -30.358 -25.213 -10.119 1.00 0.00 C +ATOM 76 HE2 TYR 175 -31.208 -25.379 -9.621 1.00 0.00 H +ATOM 77 CD2 TYR 175 -29.155 -25.724 -9.637 1.00 0.00 C +ATOM 78 HD2 TYR 175 -29.154 -26.257 -8.793 1.00 0.00 H +ATOM 79 C TYR 175 -26.995 -24.507 -7.714 1.00 0.00 C +ATOM 80 O TYR 175 -27.704 -23.510 -7.775 1.00 0.00 O +ATOM 81 N ARG 176 -27.007 -25.346 -6.679 1.00 0.00 N +ATOM 82 H ARG 176 -26.357 -26.148 -6.760 1.00 0.00 H +ATOM 83 CA ARG 176 -27.880 -25.122 -5.538 1.00 0.00 C +ATOM 84 HA ARG 176 -28.838 -25.126 -5.855 1.00 0.00 H +ATOM 85 CB ARG 176 -27.703 -26.232 -4.499 1.00 0.00 C +ATOM 86 HB2 ARG 176 -27.919 -27.104 -4.934 1.00 0.00 H +ATOM 87 HB3 ARG 176 -26.751 -26.231 -4.201 1.00 0.00 H +ATOM 88 CG ARG 176 -28.582 -26.093 -3.263 1.00 0.00 C +ATOM 89 HG2 ARG 176 -28.651 -25.127 -3.013 1.00 0.00 H +ATOM 90 HG3 ARG 176 -29.494 -26.450 -3.465 1.00 0.00 H +ATOM 91 CD ARG 176 -28.029 -26.853 -2.073 1.00 0.00 C +ATOM 92 HD2 ARG 176 -28.698 -26.811 -1.338 1.00 0.00 H +ATOM 93 HD3 ARG 176 -27.879 -27.797 -2.350 1.00 0.00 H +ATOM 94 NE ARG 176 -26.768 -26.279 -1.611 1.00 0.00 N +ATOM 95 HE ARG 176 -25.931 -26.828 -1.727 1.00 0.00 H +ATOM 96 CZ ARG 176 -26.649 -25.079 -1.047 1.00 0.00 C +ATOM 97 NH1 ARG 176 -25.462 -24.636 -0.662 1.00 0.00 N +ATOM 98 HH11 ARG 176 -24.638 -25.179 -0.804 1.00 0.00 H +ATOM 99 HH12 ARG 176 -25.387 -23.734 -0.219 1.00 0.00 H +ATOM 100 NH2 ARG 176 -27.717 -24.321 -0.856 1.00 0.00 N +ATOM 101 HH21 ARG 176 -28.617 -24.651 -1.158 1.00 0.00 H +ATOM 102 HH22 ARG 176 -27.634 -23.430 -0.418 1.00 0.00 H +ATOM 103 C ARG 176 -27.593 -23.783 -4.878 1.00 0.00 C +ATOM 104 O ARG 176 -28.505 -23.016 -4.554 1.00 0.00 O +ATOM 105 N GLN 177 -26.313 -23.517 -4.660 1.00 0.00 N +ATOM 106 H GLN 177 -25.654 -24.258 -4.972 1.00 0.00 H +ATOM 107 CA GLN 177 -25.894 -22.281 -4.034 1.00 0.00 C +ATOM 108 HA GLN 177 -26.375 -22.196 -3.149 1.00 0.00 H +ATOM 109 CB GLN 177 -24.390 -22.315 -3.808 1.00 0.00 C +ATOM 110 HB2 GLN 177 -24.174 -23.066 -3.180 1.00 0.00 H +ATOM 111 HB3 GLN 177 -23.935 -22.483 -4.686 1.00 0.00 H +ATOM 112 CG GLN 177 -23.831 -21.036 -3.224 1.00 0.00 C +ATOM 113 HG2 GLN 177 -23.923 -20.309 -3.898 1.00 0.00 H +ATOM 114 HG3 GLN 177 -24.344 -20.808 -2.401 1.00 0.00 H +ATOM 115 CD GLN 177 -22.379 -21.189 -2.867 1.00 0.00 C +ATOM 116 OE1 GLN 177 -21.604 -21.751 -3.639 1.00 0.00 O +ATOM 117 NE2 GLN 177 -21.996 -20.691 -1.694 1.00 0.00 N +ATOM 118 HE21 GLN 177 -21.032 -20.769 -1.378 1.00 0.00 H +ATOM 119 HE22 GLN 177 -22.690 -20.224 -1.110 1.00 0.00 H +ATOM 120 C GLN 177 -26.268 -21.070 -4.879 1.00 0.00 C +ATOM 121 O GLN 177 -26.763 -20.074 -4.355 1.00 0.00 O +ATOM 122 N SER 178 -26.034 -21.158 -6.184 1.00 0.00 N +ATOM 123 H SER 178 -25.612 -22.049 -6.496 1.00 0.00 H +ATOM 124 CA SER 178 -26.362 -20.057 -7.081 1.00 0.00 C +ATOM 125 HA SER 178 -25.897 -19.228 -6.744 1.00 0.00 H +ATOM 126 CB SER 178 -25.888 -20.374 -8.504 1.00 0.00 C +ATOM 127 HB2 SER 178 -26.337 -21.208 -8.813 1.00 0.00 H +ATOM 128 HB3 SER 178 -26.132 -19.613 -9.099 1.00 0.00 H +ATOM 129 OG SER 178 -24.482 -20.562 -8.549 1.00 0.00 O +ATOM 130 HG SER 178 -24.258 -21.476 -8.214 1.00 0.00 H +ATOM 131 C SER 178 -27.863 -19.774 -7.098 1.00 0.00 C +ATOM 132 O SER 178 -28.285 -18.616 -7.152 1.00 0.00 O +ATOM 133 N LEU 179 -28.669 -20.829 -7.054 1.00 0.00 N +ATOM 134 H LEU 179 -28.201 -21.744 -7.001 1.00 0.00 H +ATOM 135 CA LEU 179 -30.117 -20.652 -7.082 1.00 0.00 C +ATOM 136 HA LEU 179 -30.355 -20.079 -7.882 1.00 0.00 H +ATOM 137 CB LEU 179 -30.823 -21.998 -7.275 1.00 0.00 C +ATOM 138 HB2 LEU 179 -30.510 -22.388 -8.129 1.00 0.00 H +ATOM 139 HB3 LEU 179 -30.592 -22.578 -6.509 1.00 0.00 H +ATOM 140 CG LEU 179 -32.355 -21.915 -7.344 1.00 0.00 C +ATOM 141 HG LEU 179 -32.701 -21.589 -6.466 1.00 0.00 H +ATOM 142 CD1 LEU 179 -32.793 -20.955 -8.449 1.00 0.00 C +ATOM 143 HD11 LEU 179 -32.446 -21.281 -9.328 1.00 0.00 H +ATOM 144 HD12 LEU 179 -33.791 -20.915 -8.477 1.00 0.00 H +ATOM 145 HD13 LEU 179 -32.427 -20.044 -8.261 1.00 0.00 H +ATOM 146 CD2 LEU 179 -32.923 -23.296 -7.579 1.00 0.00 C +ATOM 147 HD21 LEU 179 -32.657 -23.905 -6.828 1.00 0.00 H +ATOM 148 HD22 LEU 179 -33.923 -23.249 -7.625 1.00 0.00 H +ATOM 149 HD23 LEU 179 -32.572 -23.666 -8.442 1.00 0.00 H +ATOM 150 C LEU 179 -30.643 -19.964 -5.827 1.00 0.00 C +ATOM 151 O LEU 179 -31.515 -19.100 -5.916 1.00 0.00 O +ATOM 152 N GLU 180 -30.114 -20.332 -4.664 1.00 0.00 N +ATOM 153 H GLU 180 -29.384 -21.055 -4.720 1.00 0.00 H +ATOM 154 CA GLU 180 -30.573 -19.723 -3.431 1.00 0.00 C +ATOM 155 HA GLU 180 -31.571 -19.818 -3.350 1.00 0.00 H +ATOM 156 CB GLU 180 -29.980 -20.469 -2.231 1.00 0.00 C +ATOM 157 HB2 GLU 180 -30.326 -21.392 -2.254 1.00 0.00 H +ATOM 158 HB3 GLU 180 -28.999 -20.442 -2.318 1.00 0.00 H +ATOM 159 CG GLU 180 -30.342 -19.873 -0.882 1.00 0.00 C +ATOM 160 HG2 GLU 180 -29.648 -19.218 -0.637 1.00 0.00 H +ATOM 161 HG3 GLU 180 -31.231 -19.455 -0.955 1.00 0.00 H +ATOM 162 CD GLU 180 -30.412 -20.902 0.231 1.00 0.00 C +ATOM 163 OE1 GLU 180 -29.479 -21.732 0.342 1.00 0.00 O +ATOM 164 OE2 GLU 180 -31.405 -20.868 1.003 1.00 0.00 O +ATOM 165 C GLU 180 -30.206 -18.237 -3.394 1.00 0.00 C +ATOM 166 O GLU 180 -31.022 -17.410 -3.014 1.00 0.00 O +ATOM 167 N ILE 181 -28.991 -17.898 -3.817 1.00 0.00 N +ATOM 168 H ILE 181 -28.400 -18.686 -4.133 1.00 0.00 H +ATOM 169 CA ILE 181 -28.557 -16.506 -3.821 1.00 0.00 C +ATOM 170 HA ILE 181 -28.724 -16.153 -2.890 1.00 0.00 H +ATOM 171 CB ILE 181 -27.079 -16.406 -4.239 1.00 0.00 C +ATOM 172 HB ILE 181 -26.977 -16.860 -5.115 1.00 0.00 H +ATOM 173 CG2 ILE 181 -26.670 -14.946 -4.374 1.00 0.00 C +ATOM 174 HG21 ILE 181 -25.720 -14.892 -4.676 1.00 0.00 H +ATOM 175 HG22 ILE 181 -27.257 -14.496 -5.045 1.00 0.00 H +ATOM 176 HG23 ILE 181 -26.764 -14.490 -3.491 1.00 0.00 H +ATOM 177 CG1 ILE 181 -26.205 -17.135 -3.221 1.00 0.00 C +ATOM 178 HG12 ILE 181 -26.169 -16.593 -2.387 1.00 0.00 H +ATOM 179 HG13 ILE 181 -26.625 -18.016 -3.019 1.00 0.00 H +ATOM 180 CD1 ILE 181 -24.790 -17.375 -3.713 1.00 0.00 C +ATOM 181 HD11 ILE 181 -24.357 -16.498 -3.912 1.00 0.00 H +ATOM 182 HD12 ILE 181 -24.272 -17.853 -3.006 1.00 0.00 H +ATOM 183 HD13 ILE 181 -24.819 -17.931 -4.542 1.00 0.00 H +ATOM 184 C ILE 181 -29.390 -15.639 -4.768 1.00 0.00 C +ATOM 185 O ILE 181 -29.881 -14.570 -4.388 1.00 0.00 O +ATOM 186 N ILE 182 -29.538 -16.098 -6.006 1.00 0.00 N +ATOM 187 H ILE 182 -29.087 -17.009 -6.196 1.00 0.00 H +ATOM 188 CA ILE 182 -30.293 -15.344 -7.008 1.00 0.00 C +ATOM 189 HA ILE 182 -29.944 -14.397 -6.971 1.00 0.00 H +ATOM 190 CB ILE 182 -30.077 -15.948 -8.418 1.00 0.00 C +ATOM 191 HB ILE 182 -30.270 -16.917 -8.367 1.00 0.00 H +ATOM 192 CG2 ILE 182 -31.002 -15.272 -9.432 1.00 0.00 C +ATOM 193 HG21 ILE 182 -30.867 -15.687 -10.329 1.00 0.00 H +ATOM 194 HG22 ILE 182 -31.950 -15.393 -9.146 1.00 0.00 H +ATOM 195 HG23 ILE 182 -30.787 -14.299 -9.477 1.00 0.00 H +ATOM 196 CG1 ILE 182 -28.607 -15.776 -8.836 1.00 0.00 C +ATOM 197 HG12 ILE 182 -28.430 -14.805 -8.974 1.00 0.00 H +ATOM 198 HG13 ILE 182 -28.030 -16.107 -8.092 1.00 0.00 H +ATOM 199 CD1 ILE 182 -28.233 -16.529 -10.110 1.00 0.00 C +ATOM 200 HD11 ILE 182 -28.798 -16.197 -10.861 1.00 0.00 H +ATOM 201 HD12 ILE 182 -27.270 -16.367 -10.312 1.00 0.00 H +ATOM 202 HD13 ILE 182 -28.392 -17.503 -9.970 1.00 0.00 H +ATOM 203 C ILE 182 -31.792 -15.266 -6.690 1.00 0.00 C +ATOM 204 O ILE 182 -32.411 -14.222 -6.884 1.00 0.00 O +ATOM 205 N SER 183 -32.364 -16.364 -6.197 1.00 0.00 N +ATOM 206 H SER 183 -31.726 -17.177 -6.091 1.00 0.00 H +ATOM 207 CA SER 183 -33.785 -16.407 -5.836 1.00 0.00 C +ATOM 208 HA SER 183 -34.316 -16.106 -6.633 1.00 0.00 H +ATOM 209 CB SER 183 -34.195 -17.822 -5.410 1.00 0.00 C +ATOM 210 HB2 SER 183 -33.678 -18.068 -4.594 1.00 0.00 H +ATOM 211 HB3 SER 183 -35.171 -17.819 -5.206 1.00 0.00 H +ATOM 212 OG SER 183 -33.934 -18.750 -6.427 1.00 0.00 O +ATOM 213 HG SER 183 -32.968 -19.016 -6.406 1.00 0.00 H +ATOM 214 C SER 183 -34.077 -15.447 -4.686 1.00 0.00 C +ATOM 215 O SER 183 -35.054 -14.693 -4.717 1.00 0.00 O +ATOM 216 N ARG 184 -33.228 -15.485 -3.665 1.00 0.00 N +ATOM 217 H ARG 184 -32.460 -16.164 -3.751 1.00 0.00 H +ATOM 218 CA ARG 184 -33.417 -14.602 -2.522 1.00 0.00 C +ATOM 219 HA ARG 184 -34.340 -14.751 -2.143 1.00 0.00 H +ATOM 220 CB ARG 184 -32.406 -14.909 -1.415 1.00 0.00 C +ATOM 221 HB2 ARG 184 -31.495 -14.916 -1.821 1.00 0.00 H +ATOM 222 HB3 ARG 184 -32.467 -14.186 -0.731 1.00 0.00 H +ATOM 223 CG ARG 184 -32.626 -16.236 -0.722 1.00 0.00 C +ATOM 224 HG2 ARG 184 -33.580 -16.493 -0.787 1.00 0.00 H +ATOM 225 HG3 ARG 184 -32.043 -16.926 -1.128 1.00 0.00 H +ATOM 226 CD ARG 184 -32.264 -16.113 0.746 1.00 0.00 C +ATOM 227 HD2 ARG 184 -31.310 -15.829 0.808 1.00 0.00 H +ATOM 228 HD3 ARG 184 -32.853 -15.418 1.153 1.00 0.00 H +ATOM 229 NE ARG 184 -32.439 -17.372 1.459 1.00 0.00 N +ATOM 230 HE ARG 184 -32.645 -18.196 0.918 1.00 0.00 H +ATOM 231 CZ ARG 184 -32.344 -17.503 2.777 1.00 0.00 C +ATOM 232 NH1 ARG 184 -32.079 -16.447 3.533 1.00 0.00 N +ATOM 233 HH11 ARG 184 -31.967 -15.541 3.135 1.00 0.00 H +ATOM 234 HH12 ARG 184 -31.990 -16.561 4.531 1.00 0.00 H +ATOM 235 NH2 ARG 184 -32.508 -18.695 3.339 1.00 0.00 N +ATOM 236 HH21 ARG 184 -32.723 -19.488 2.764 1.00 0.00 H +ATOM 237 HH22 ARG 184 -32.420 -18.802 4.326 1.00 0.00 H +ATOM 238 C ARG 184 -33.290 -13.134 -2.923 1.00 0.00 C +ATOM 239 O ARG 184 -34.059 -12.283 -2.466 1.00 0.00 O +ATOM 240 N TYR 185 -32.320 -12.830 -3.777 1.00 0.00 N +ATOM 241 H TYR 185 -31.741 -13.617 -4.093 1.00 0.00 H +ATOM 242 CA TYR 185 -32.137 -11.452 -4.202 1.00 0.00 C +ATOM 243 HA TYR 185 -32.029 -10.877 -3.383 1.00 0.00 H +ATOM 244 CB TYR 185 -30.880 -11.310 -5.074 1.00 0.00 C +ATOM 245 HB2 TYR 185 -30.112 -11.686 -4.573 1.00 0.00 H +ATOM 246 HB3 TYR 185 -31.031 -11.809 -5.917 1.00 0.00 H +ATOM 247 CG TYR 185 -30.570 -9.871 -5.419 1.00 0.00 C +ATOM 248 CD1 TYR 185 -30.431 -8.910 -4.413 1.00 0.00 C +ATOM 249 HD1 TYR 185 -30.515 -9.183 -3.455 1.00 0.00 H +ATOM 250 CE1 TYR 185 -30.178 -7.574 -4.723 1.00 0.00 C +ATOM 251 HE1 TYR 185 -30.077 -6.899 -3.995 1.00 0.00 H +ATOM 252 CZ TYR 185 -30.066 -7.189 -6.058 1.00 0.00 C +ATOM 253 OH TYR 185 -29.845 -5.870 -6.376 1.00 0.00 O +ATOM 254 HH TYR 185 -29.842 -5.326 -5.538 1.00 0.00 H +ATOM 255 CE2 TYR 185 -30.197 -8.120 -7.069 1.00 0.00 C +ATOM 256 HE2 TYR 185 -30.117 -7.847 -8.025 1.00 0.00 H +ATOM 257 CD2 TYR 185 -30.445 -9.460 -6.746 1.00 0.00 C +ATOM 258 HD2 TYR 185 -30.532 -10.128 -7.480 1.00 0.00 H +ATOM 259 C TYR 185 -33.360 -10.955 -4.969 1.00 0.00 C +ATOM 260 O TYR 185 -33.872 -9.872 -4.690 1.00 0.00 O +ATOM 261 N LEU 186 -33.840 -11.739 -5.933 1.00 0.00 N +ATOM 262 H LEU 186 -33.347 -12.629 -6.071 1.00 0.00 H +ATOM 263 CA LEU 186 -35.002 -11.314 -6.721 1.00 0.00 C +ATOM 264 HA LEU 186 -34.796 -10.410 -7.129 1.00 0.00 H +ATOM 265 CB LEU 186 -35.257 -12.282 -7.881 1.00 0.00 C +ATOM 266 HB2 LEU 186 -34.873 -13.166 -7.630 1.00 0.00 H +ATOM 267 HB3 LEU 186 -36.241 -12.357 -8.005 1.00 0.00 H +ATOM 268 CG LEU 186 -34.654 -11.889 -9.231 1.00 0.00 C +ATOM 269 HG LEU 186 -35.038 -11.015 -9.515 1.00 0.00 H +ATOM 270 CD1 LEU 186 -33.146 -11.763 -9.099 1.00 0.00 C +ATOM 271 HD11 LEU 186 -32.760 -12.639 -8.806 1.00 0.00 H +ATOM 272 HD12 LEU 186 -32.752 -11.506 -9.982 1.00 0.00 H +ATOM 273 HD13 LEU 186 -32.926 -11.061 -8.421 1.00 0.00 H +ATOM 274 CD2 LEU 186 -35.024 -12.920 -10.294 1.00 0.00 C +ATOM 275 HD21 LEU 186 -36.019 -12.966 -10.380 1.00 0.00 H +ATOM 276 HD22 LEU 186 -34.624 -12.652 -11.170 1.00 0.00 H +ATOM 277 HD23 LEU 186 -34.670 -13.816 -10.025 1.00 0.00 H +ATOM 278 C LEU 186 -36.268 -11.184 -5.879 1.00 0.00 C +ATOM 279 O LEU 186 -37.076 -10.276 -6.093 1.00 0.00 O +ATOM 280 N ARG 187 -36.440 -12.076 -4.913 1.00 0.00 N +ATOM 281 H ARG 187 -35.706 -12.783 -4.821 1.00 0.00 H +ATOM 282 CA ARG 187 -37.615 -11.988 -4.085 1.00 0.00 C +ATOM 283 HA ARG 187 -38.439 -11.913 -4.678 1.00 0.00 H +ATOM 284 CB ARG 187 -37.800 -13.281 -3.308 1.00 0.00 C +ATOM 285 HB2 ARG 187 -37.759 -14.036 -3.941 1.00 0.00 H +ATOM 286 HB3 ARG 187 -37.094 -13.340 -2.623 1.00 0.00 H +ATOM 287 CG ARG 187 -39.143 -13.318 -2.610 1.00 0.00 C +ATOM 288 HG2 ARG 187 -39.139 -12.689 -1.827 1.00 0.00 H +ATOM 289 HG3 ARG 187 -39.867 -13.037 -3.247 1.00 0.00 H +ATOM 290 CD ARG 187 -39.527 -14.716 -2.071 1.00 0.00 C +ATOM 291 HD2 ARG 187 -39.428 -15.360 -2.826 1.00 0.00 H +ATOM 292 HD3 ARG 187 -38.879 -14.939 -1.346 1.00 0.00 H +ATOM 293 NE ARG 187 -40.880 -14.758 -1.558 1.00 0.00 N +ATOM 294 HE ARG 187 -41.022 -15.060 -0.606 1.00 0.00 H +ATOM 295 CZ ARG 187 -41.962 -14.422 -2.263 1.00 0.00 C +ATOM 296 NH1 ARG 187 -41.866 -14.026 -3.524 1.00 0.00 N +ATOM 297 HH11 ARG 187 -40.975 -13.992 -3.976 1.00 0.00 H +ATOM 298 HH12 ARG 187 -42.689 -13.760 -4.030 1.00 0.00 H +ATOM 299 NH2 ARG 187 -43.169 -14.421 -1.700 1.00 0.00 N +ATOM 300 HH21 ARG 187 -43.253 -14.698 -0.737 1.00 0.00 H +ATOM 301 HH22 ARG 187 -43.969 -14.154 -2.221 1.00 0.00 H +ATOM 302 C ARG 187 -37.607 -10.776 -3.138 1.00 0.00 C +ATOM 303 O ARG 187 -38.623 -10.082 -2.999 1.00 0.00 O +ATOM 304 N GLU 188 -36.486 -10.498 -2.479 1.00 0.00 N +ATOM 305 H GLU 188 -35.700 -11.122 -2.635 1.00 0.00 H +ATOM 306 CA GLU 188 -36.463 -9.332 -1.590 1.00 0.00 C +ATOM 307 HA GLU 188 -37.257 -9.366 -0.968 1.00 0.00 H +ATOM 308 CB GLU 188 -35.257 -9.375 -0.649 1.00 0.00 C +ATOM 309 HB2 GLU 188 -35.354 -8.607 -0.018 1.00 0.00 H +ATOM 310 HB3 GLU 188 -35.314 -10.234 -0.143 1.00 0.00 H +ATOM 311 CG GLU 188 -33.914 -9.293 -1.280 1.00 0.00 C +ATOM 312 HG2 GLU 188 -33.715 -10.144 -1.726 1.00 0.00 H +ATOM 313 HG3 GLU 188 -33.892 -8.530 -1.896 1.00 0.00 H +ATOM 314 CD GLU 188 -32.836 -9.065 -0.246 1.00 0.00 C +ATOM 315 OE1 GLU 188 -32.857 -9.773 0.778 1.00 0.00 O +ATOM 316 OE2 GLU 188 -31.959 -8.199 -0.446 1.00 0.00 O +ATOM 317 C GLU 188 -36.491 -8.010 -2.371 1.00 0.00 C +ATOM 318 O GLU 188 -36.955 -6.991 -1.860 1.00 0.00 O +ATOM 319 N GLN 189 -35.996 -8.024 -3.606 1.00 0.00 N +ATOM 320 H GLN 189 -35.603 -8.921 -3.916 1.00 0.00 H +ATOM 321 CA GLN 189 -36.035 -6.818 -4.421 1.00 0.00 C +ATOM 322 HA GLN 189 -35.710 -6.055 -3.868 1.00 0.00 H +ATOM 323 CB GLN 189 -35.194 -7.003 -5.691 1.00 0.00 C +ATOM 324 HB2 GLN 189 -35.385 -7.912 -6.070 1.00 0.00 H +ATOM 325 HB3 GLN 189 -35.471 -6.308 -6.361 1.00 0.00 H +ATOM 326 CG GLN 189 -33.694 -6.884 -5.479 1.00 0.00 C +ATOM 327 HG2 GLN 189 -33.455 -7.324 -4.617 1.00 0.00 H +ATOM 328 HG3 GLN 189 -33.226 -7.337 -6.234 1.00 0.00 H +ATOM 329 CD GLN 189 -33.241 -5.437 -5.425 1.00 0.00 C +ATOM 330 OE1 GLN 189 -33.468 -4.676 -6.366 1.00 0.00 O +ATOM 331 NE2 GLN 189 -32.601 -5.047 -4.324 1.00 0.00 N +ATOM 332 HE21 GLN 189 -32.259 -4.100 -4.226 1.00 0.00 H +ATOM 333 HE22 GLN 189 -32.462 -5.726 -3.575 1.00 0.00 H +ATOM 334 C GLN 189 -37.491 -6.535 -4.794 1.00 0.00 C +ATOM 335 O GLN 189 -37.945 -5.398 -4.771 1.00 0.00 O +ATOM 336 N ALA 190 -38.227 -7.591 -5.125 1.00 0.00 N +ATOM 337 H ALA 190 -37.734 -8.501 -5.082 1.00 0.00 H +ATOM 338 CA ALA 190 -39.628 -7.450 -5.517 1.00 0.00 C +ATOM 339 HA ALA 190 -39.696 -6.704 -6.210 1.00 0.00 H +ATOM 340 CB ALA 190 -40.105 -8.721 -6.222 1.00 0.00 C +ATOM 341 HB1 ALA 190 -39.426 -9.442 -6.098 1.00 0.00 H +ATOM 342 HB2 ALA 190 -40.976 -9.010 -5.829 1.00 0.00 H +ATOM 343 HB3 ALA 190 -40.222 -8.534 -7.196 1.00 0.00 H +ATOM 344 C ALA 190 -40.575 -7.118 -4.363 1.00 0.00 C +ATOM 345 O ALA 190 -41.540 -6.361 -4.534 1.00 0.00 O +ATOM 346 N THR 191 -40.291 -7.670 -3.188 1.00 0.00 N +ATOM 347 H THR 191 -39.428 -8.249 -3.176 1.00 0.00 H +ATOM 348 CA THR 191 -41.137 -7.467 -2.017 1.00 0.00 C +ATOM 349 HA THR 191 -42.084 -7.255 -2.340 1.00 0.00 H +ATOM 350 CB THR 191 -41.212 -8.756 -1.190 1.00 0.00 C +ATOM 351 HB THR 191 -41.899 -8.633 -0.445 1.00 0.00 H +ATOM 352 CG2 THR 191 -41.579 -9.934 -2.094 1.00 0.00 C +ATOM 353 HG21 THR 191 -40.796 -10.553 -2.174 1.00 0.00 H +ATOM 354 HG22 THR 191 -42.355 -10.430 -1.701 1.00 0.00 H +ATOM 355 HG23 THR 191 -41.828 -9.595 -3.003 1.00 0.00 H +ATOM 356 OG1 THR 191 -39.938 -9.010 -0.582 1.00 0.00 O +ATOM 357 HG1 THR 191 -39.291 -9.367 -1.264 1.00 0.00 H +ATOM 358 C THR 191 -40.690 -6.337 -1.095 1.00 0.00 C +ATOM 359 O THR 191 -41.528 -5.627 -0.535 1.00 0.00 O +ATOM 360 N GLY 192 -39.380 -6.175 -0.932 1.00 0.00 N +ATOM 361 H GLY 192 -38.786 -6.840 -1.450 1.00 0.00 H +ATOM 362 CA GLY 192 -38.866 -5.120 -0.073 1.00 0.00 C +ATOM 363 HA2 GLY 192 -38.083 -4.662 -0.540 1.00 0.00 H +ATOM 364 HA3 GLY 192 -39.585 -4.405 0.045 1.00 0.00 H +ATOM 365 C GLY 192 -38.419 -5.605 1.289 1.00 0.00 C +ATOM 366 O GLY 192 -38.015 -4.815 2.149 1.00 0.00 O +ATOM 367 N ALA 193 -38.481 -6.913 1.503 1.00 0.00 N +ATOM 368 H ALA 193 -38.812 -7.479 0.708 1.00 0.00 H +ATOM 369 CA ALA 193 -38.095 -7.481 2.800 1.00 0.00 C +ATOM 370 HA ALA 193 -37.816 -6.717 3.416 1.00 0.00 H +ATOM 371 CB ALA 193 -39.311 -8.131 3.428 1.00 0.00 C +ATOM 372 HB1 ALA 193 -39.671 -8.836 2.816 1.00 0.00 H +ATOM 373 HB2 ALA 193 -39.057 -8.551 4.300 1.00 0.00 H +ATOM 374 HB3 ALA 193 -40.018 -7.441 3.588 1.00 0.00 H +ATOM 375 C ALA 193 -36.941 -8.491 2.737 1.00 0.00 C +ATOM 376 O ALA 193 -36.797 -9.218 1.764 1.00 0.00 O +ATOM 377 N LYS 194 -36.137 -8.521 3.792 1.00 0.00 N +ATOM 378 H LYS 194 -36.399 -7.834 4.546 1.00 0.00 H +ATOM 379 CA LYS 194 -35.000 -9.414 3.905 1.00 0.00 C +ATOM 380 HA LYS 194 -34.637 -9.608 2.994 1.00 0.00 H +ATOM 381 CB LYS 194 -33.962 -8.782 4.828 1.00 0.00 C +ATOM 382 HB2 LYS 194 -34.314 -7.891 5.142 1.00 0.00 H +ATOM 383 HB3 LYS 194 -33.850 -9.376 5.637 1.00 0.00 H +ATOM 384 CG LYS 194 -32.552 -8.537 4.238 1.00 0.00 C +ATOM 385 HG2 LYS 194 -32.228 -9.382 3.836 1.00 0.00 H +ATOM 386 HG3 LYS 194 -32.614 -7.819 3.560 1.00 0.00 H +ATOM 387 CD LYS 194 -31.598 -8.106 5.345 1.00 0.00 C +ATOM 388 HD2 LYS 194 -30.683 -8.034 4.977 1.00 0.00 H +ATOM 389 HD3 LYS 194 -31.904 -7.246 5.723 1.00 0.00 H +ATOM 390 CE LYS 194 -31.578 -9.150 6.480 1.00 0.00 C +ATOM 391 HE2 LYS 194 -31.475 -8.660 7.367 1.00 0.00 H +ATOM 392 HE3 LYS 194 -32.485 -9.612 6.509 1.00 0.00 H +ATOM 393 NZ LYS 194 -30.502 -10.219 6.399 1.00 0.00 N +ATOM 394 HZ1 LYS 194 -29.673 -9.866 6.821 1.00 0.00 H +ATOM 395 HZ2 LYS 194 -30.821 -11.027 6.884 1.00 0.00 H +ATOM 396 HZ3 LYS 194 -30.339 -10.432 5.441 1.00 0.00 H +ATOM 397 C LYS 194 -35.461 -10.736 4.534 1.00 0.00 C +ATOM 398 O LYS 194 -36.205 -10.719 5.517 1.00 0.00 O +ATOM 399 N ASP 195 -35.042 -11.872 3.975 1.00 0.00 N +ATOM 400 H ASP 195 -34.456 -11.759 3.133 1.00 0.00 H +ATOM 401 CA ASP 195 -35.407 -13.175 4.543 1.00 0.00 C +ATOM 402 HA ASP 195 -36.292 -13.075 4.961 1.00 0.00 H +ATOM 403 CB ASP 195 -35.264 -14.296 3.512 1.00 0.00 C +ATOM 404 HB2 ASP 195 -35.753 -14.024 2.693 1.00 0.00 H +ATOM 405 HB3 ASP 195 -34.299 -14.418 3.323 1.00 0.00 H +ATOM 406 CG ASP 195 -35.836 -15.608 4.010 1.00 0.00 C +ATOM 407 OD1 ASP 195 -35.806 -15.841 5.242 1.00 0.00 O +ATOM 408 OD2 ASP 195 -36.306 -16.414 3.179 1.00 0.00 O +ATOM 409 C ASP 195 -34.400 -13.409 5.671 1.00 0.00 C +ATOM 410 O ASP 195 -33.192 -13.293 5.460 1.00 0.00 O +ATOM 411 N THR 196 -34.881 -13.764 6.859 1.00 0.00 N +ATOM 412 H THR 196 -35.908 -13.876 6.902 1.00 0.00 H +ATOM 413 CA THR 196 -33.995 -13.974 8.004 1.00 0.00 C +ATOM 414 HA THR 196 -33.160 -13.396 7.871 1.00 0.00 H +ATOM 415 CB THR 196 -34.663 -13.462 9.298 1.00 0.00 C +ATOM 416 HB THR 196 -34.741 -12.447 9.246 1.00 0.00 H +ATOM 417 CG2 THR 196 -36.039 -14.081 9.476 1.00 0.00 C +ATOM 418 HG21 THR 196 -36.744 -13.372 9.400 1.00 0.00 H +ATOM 419 HG22 THR 196 -36.195 -14.775 8.769 1.00 0.00 H +ATOM 420 HG23 THR 196 -36.105 -14.513 10.379 1.00 0.00 H +ATOM 421 OG1 THR 196 -33.838 -13.793 10.419 1.00 0.00 O +ATOM 422 HG1 THR 196 -33.244 -14.575 10.199 1.00 0.00 H +ATOM 423 C THR 196 -33.533 -15.420 8.225 1.00 0.00 C +ATOM 424 O THR 196 -32.717 -15.686 9.106 1.00 0.00 O +ATOM 425 N LYS 197 -34.047 -16.354 7.436 1.00 0.00 N +ATOM 426 H LYS 197 -34.728 -16.019 6.736 1.00 0.00 H +ATOM 427 CA LYS 197 -33.653 -17.761 7.574 1.00 0.00 C +ATOM 428 HA LYS 197 -33.695 -18.013 8.550 1.00 0.00 H +ATOM 429 CB LYS 197 -34.582 -18.672 6.768 1.00 0.00 C +ATOM 430 HB2 LYS 197 -34.700 -18.260 5.855 1.00 0.00 H +ATOM 431 HB3 LYS 197 -34.116 -19.560 6.652 1.00 0.00 H +ATOM 432 CG LYS 197 -35.945 -18.920 7.360 1.00 0.00 C +ATOM 433 HG2 LYS 197 -35.859 -19.468 8.180 1.00 0.00 H +ATOM 434 HG3 LYS 197 -36.390 -18.057 7.552 1.00 0.00 H +ATOM 435 CD LYS 197 -36.792 -19.691 6.345 1.00 0.00 C +ATOM 436 HD2 LYS 197 -36.349 -20.560 6.155 1.00 0.00 H +ATOM 437 HD3 LYS 197 -37.697 -19.837 6.728 1.00 0.00 H +ATOM 438 CE LYS 197 -36.937 -18.921 5.034 1.00 0.00 C +ATOM 439 HE2 LYS 197 -37.346 -18.024 5.233 1.00 0.00 H +ATOM 440 HE3 LYS 197 -36.021 -18.775 4.645 1.00 0.00 H +ATOM 441 NZ LYS 197 -37.781 -19.638 4.047 1.00 0.00 N +ATOM 442 HZ1 LYS 197 -37.836 -19.103 3.203 1.00 0.00 H +ATOM 443 HZ2 LYS 197 -37.377 -20.532 3.849 1.00 0.00 H +ATOM 444 HZ3 LYS 197 -38.700 -19.763 4.422 1.00 0.00 H +ATOM 445 C LYS 197 -32.235 -17.999 7.066 1.00 0.00 C +ATOM 446 O LYS 197 -31.797 -17.352 6.116 1.00 0.00 O +ATOM 447 N PRO 198 -31.498 -18.937 7.693 1.00 0.00 N +ATOM 448 CD PRO 198 -31.793 -19.679 8.933 1.00 0.00 C +ATOM 449 HD2 PRO 198 -32.731 -20.015 8.924 1.00 0.00 H +ATOM 450 HD3 PRO 198 -31.646 -19.099 9.731 1.00 0.00 H +ATOM 451 CG PRO 198 -30.801 -20.803 8.874 1.00 0.00 C +ATOM 452 HG2 PRO 198 -31.115 -21.527 8.265 1.00 0.00 H +ATOM 453 HG3 PRO 198 -30.624 -21.173 9.782 1.00 0.00 H +ATOM 454 CB PRO 198 -29.581 -20.144 8.326 1.00 0.00 C +ATOM 455 HB2 PRO 198 -28.955 -20.816 7.932 1.00 0.00 H +ATOM 456 HB3 PRO 198 -29.107 -19.620 9.032 1.00 0.00 H +ATOM 457 CA PRO 198 -30.132 -19.217 7.241 1.00 0.00 C +ATOM 458 HA PRO 198 -29.578 -18.369 7.242 1.00 0.00 H +ATOM 459 C PRO 198 -30.105 -19.878 5.874 1.00 0.00 C +ATOM 460 O PRO 198 -31.050 -20.558 5.479 1.00 0.00 O +ATOM 461 N MET 199 -29.018 -19.659 5.146 1.00 0.00 N +ATOM 462 H MET 199 -28.313 -19.040 5.584 1.00 0.00 H +ATOM 463 CA MET 199 -28.864 -20.261 3.834 1.00 0.00 C +ATOM 464 HA MET 199 -29.708 -20.131 3.324 1.00 0.00 H +ATOM 465 CB MET 199 -27.650 -19.656 3.126 1.00 0.00 C +ATOM 466 HB2 MET 199 -26.845 -19.720 3.736 1.00 0.00 H +ATOM 467 HB3 MET 199 -27.449 -20.196 2.295 1.00 0.00 H +ATOM 468 CG MET 199 -27.807 -18.184 2.705 1.00 0.00 C +ATOM 469 HG2 MET 199 -28.163 -17.663 3.515 1.00 0.00 H +ATOM 470 HG3 MET 199 -26.869 -17.806 2.530 1.00 0.00 H +ATOM 471 SD MET 199 -28.869 -17.976 1.279 1.00 0.00 S +ATOM 472 CE MET 199 -29.039 -16.192 1.184 1.00 0.00 C +ATOM 473 HE1 MET 199 -28.557 -15.769 1.952 1.00 0.00 H +ATOM 474 HE2 MET 199 -28.647 -15.864 0.324 1.00 0.00 H +ATOM 475 HE3 MET 199 -30.008 -15.946 1.223 1.00 0.00 H +ATOM 476 C MET 199 -28.659 -21.757 4.034 1.00 0.00 C +ATOM 477 O MET 199 -28.502 -22.222 5.167 1.00 0.00 O +ATOM 478 N GLY 200 -28.675 -22.519 2.944 1.00 0.00 N +ATOM 479 H GLY 200 -28.837 -22.025 2.059 1.00 0.00 H +ATOM 480 CA GLY 200 -28.471 -23.950 3.064 1.00 0.00 C +ATOM 481 HA2 GLY 200 -29.090 -24.324 3.751 1.00 0.00 H +ATOM 482 HA3 GLY 200 -28.639 -24.391 2.185 1.00 0.00 H +ATOM 483 C GLY 200 -27.036 -24.195 3.488 1.00 0.00 C +ATOM 484 O GLY 200 -26.294 -23.225 3.695 1.00 0.00 O +TER 485 GLY 200 +ATOM 486 N SER 202 -22.146 -24.130 3.748 1.00 0.00 N +ATOM 487 H SER 202 -22.234 -23.719 4.664 1.00 0.00 H +ATOM 488 CA SER 202 -22.622 -23.510 2.517 1.00 0.00 C +ATOM 489 HA SER 202 -21.830 -23.349 1.919 1.00 0.00 H +ATOM 490 CB SER 202 -23.636 -24.435 1.814 1.00 0.00 C +ATOM 491 HB2 SER 202 -24.414 -24.578 2.423 1.00 0.00 H +ATOM 492 HB3 SER 202 -23.943 -23.992 0.974 1.00 0.00 H +ATOM 493 OG SER 202 -23.074 -25.710 1.481 1.00 0.00 O +ATOM 494 HG SER 202 -22.978 -25.775 0.491 1.00 0.00 H +ATOM 495 C SER 202 -23.272 -22.153 2.804 1.00 0.00 C +ATOM 496 O SER 202 -23.310 -21.276 1.936 1.00 0.00 O +ATOM 497 N GLY 203 -23.777 -21.984 4.021 1.00 0.00 N +ATOM 498 H GLY 203 -23.655 -22.788 4.661 1.00 0.00 H +ATOM 499 CA GLY 203 -24.441 -20.751 4.383 1.00 0.00 C +ATOM 500 HA2 GLY 203 -25.256 -20.613 3.746 1.00 0.00 H +ATOM 501 HA3 GLY 203 -24.892 -20.877 5.315 1.00 0.00 H +ATOM 502 C GLY 203 -23.633 -19.469 4.412 1.00 0.00 C +ATOM 503 O GLY 203 -24.079 -18.443 3.888 1.00 0.00 O +ATOM 504 N ALA 204 -22.455 -19.505 5.029 1.00 0.00 N +ATOM 505 H ALA 204 -22.188 -20.427 5.414 1.00 0.00 H +ATOM 506 CA ALA 204 -21.620 -18.309 5.138 1.00 0.00 C +ATOM 507 HA ALA 204 -22.069 -17.664 5.793 1.00 0.00 H +ATOM 508 CB ALA 204 -20.295 -18.660 5.774 1.00 0.00 C +ATOM 509 HB1 ALA 204 -19.693 -19.083 5.094 1.00 0.00 H +ATOM 510 HB2 ALA 204 -19.858 -17.831 6.128 1.00 0.00 H +ATOM 511 HB3 ALA 204 -20.440 -19.302 6.529 1.00 0.00 H +ATOM 512 C ALA 204 -21.387 -17.579 3.827 1.00 0.00 C +ATOM 513 O ALA 204 -21.739 -16.404 3.713 1.00 0.00 O +ATOM 514 N THR 205 -20.775 -18.251 2.859 1.00 0.00 N +ATOM 515 H THR 205 -20.498 -19.217 3.100 1.00 0.00 H +ATOM 516 CA THR 205 -20.532 -17.633 1.568 1.00 0.00 C +ATOM 517 HA THR 205 -19.930 -16.829 1.705 1.00 0.00 H +ATOM 518 CB THR 205 -19.838 -18.600 0.603 1.00 0.00 C +ATOM 519 HB THR 205 -20.388 -19.459 0.541 1.00 0.00 H +ATOM 520 CG2 THR 205 -19.688 -17.969 -0.767 1.00 0.00 C +ATOM 521 HG21 THR 205 -18.922 -18.393 -1.258 1.00 0.00 H +ATOM 522 HG22 THR 205 -20.529 -18.100 -1.299 1.00 0.00 H +ATOM 523 HG23 THR 205 -19.511 -16.986 -0.674 1.00 0.00 H +ATOM 524 OG1 THR 205 -18.539 -18.940 1.106 1.00 0.00 O +ATOM 525 HG1 THR 205 -17.858 -18.903 0.367 1.00 0.00 H +ATOM 526 C THR 205 -21.813 -17.161 0.908 1.00 0.00 C +ATOM 527 O THR 205 -21.870 -16.049 0.377 1.00 0.00 O +ATOM 528 N SER 206 -22.849 -17.987 0.930 1.00 0.00 N +ATOM 529 H SER 206 -22.712 -18.880 1.388 1.00 0.00 H +ATOM 530 CA SER 206 -24.082 -17.545 0.301 1.00 0.00 C +ATOM 531 HA SER 206 -23.894 -17.344 -0.664 1.00 0.00 H +ATOM 532 CB SER 206 -25.163 -18.627 0.400 1.00 0.00 C +ATOM 533 HB2 SER 206 -25.271 -18.884 1.360 1.00 0.00 H +ATOM 534 HB3 SER 206 -26.023 -18.250 0.057 1.00 0.00 H +ATOM 535 OG SER 206 -24.833 -19.780 -0.352 1.00 0.00 O +ATOM 536 HG SER 206 -24.317 -20.416 0.221 1.00 0.00 H +ATOM 537 C SER 206 -24.580 -16.241 0.955 1.00 0.00 C +ATOM 538 O SER 206 -25.060 -15.346 0.260 1.00 0.00 O +ATOM 539 N ARG 207 -24.463 -16.128 2.280 1.00 0.00 N +ATOM 540 H ARG 207 -24.026 -16.932 2.753 1.00 0.00 H +ATOM 541 CA ARG 207 -24.935 -14.931 2.966 1.00 0.00 C +ATOM 542 HA ARG 207 -25.912 -14.791 2.736 1.00 0.00 H +ATOM 543 CB ARG 207 -24.870 -15.099 4.487 1.00 0.00 C +ATOM 544 HB2 ARG 207 -25.449 -15.865 4.741 1.00 0.00 H +ATOM 545 HB3 ARG 207 -23.926 -15.277 4.741 1.00 0.00 H +ATOM 546 CG ARG 207 -25.343 -13.873 5.257 1.00 0.00 C +ATOM 547 HG2 ARG 207 -24.726 -13.107 5.076 1.00 0.00 H +ATOM 548 HG3 ARG 207 -26.268 -13.633 4.965 1.00 0.00 H +ATOM 549 CD ARG 207 -25.374 -14.106 6.768 1.00 0.00 C +ATOM 550 HD2 ARG 207 -25.475 -13.222 7.213 1.00 0.00 H +ATOM 551 HD3 ARG 207 -26.156 -14.687 6.972 1.00 0.00 H +ATOM 552 NE ARG 207 -24.150 -14.753 7.248 1.00 0.00 N +ATOM 553 HE ARG 207 -23.369 -14.165 7.482 1.00 0.00 H +ATOM 554 CZ ARG 207 -24.008 -16.068 7.394 1.00 0.00 C +ATOM 555 NH1 ARG 207 -25.010 -16.887 7.093 1.00 0.00 N +ATOM 556 HH11 ARG 207 -25.871 -16.536 6.737 1.00 0.00 H +ATOM 557 HH12 ARG 207 -24.897 -17.879 7.226 1.00 0.00 H +ATOM 558 NH2 ARG 207 -22.882 -16.570 7.876 1.00 0.00 N +ATOM 559 HH21 ARG 207 -22.127 -15.951 8.113 1.00 0.00 H +ATOM 560 HH22 ARG 207 -22.779 -17.553 8.003 1.00 0.00 H +ATOM 561 C ARG 207 -24.159 -13.691 2.565 1.00 0.00 C +ATOM 562 O ARG 207 -24.739 -12.622 2.380 1.00 0.00 O +ATOM 563 N LYS 208 -22.847 -13.824 2.452 1.00 0.00 N +ATOM 564 H LYS 208 -22.477 -14.764 2.651 1.00 0.00 H +ATOM 565 CA LYS 208 -22.031 -12.689 2.070 1.00 0.00 C +ATOM 566 HA LYS 208 -22.285 -11.895 2.630 1.00 0.00 H +ATOM 567 CB LYS 208 -20.548 -12.995 2.327 1.00 0.00 C +ATOM 568 HB2 LYS 208 -20.249 -13.677 1.671 1.00 0.00 H +ATOM 569 HB3 LYS 208 -20.030 -12.155 2.219 1.00 0.00 H +ATOM 570 CG LYS 208 -20.272 -13.545 3.743 1.00 0.00 C +ATOM 571 HG2 LYS 208 -20.522 -12.847 4.412 1.00 0.00 H +ATOM 572 HG3 LYS 208 -20.829 -14.361 3.884 1.00 0.00 H +ATOM 573 CD LYS 208 -18.793 -13.913 3.941 1.00 0.00 C +ATOM 574 HD2 LYS 208 -18.726 -14.565 4.691 1.00 0.00 H +ATOM 575 HD3 LYS 208 -18.451 -14.319 3.099 1.00 0.00 H +ATOM 576 CE LYS 208 -17.930 -12.693 4.278 1.00 0.00 C +ATOM 577 HE2 LYS 208 -16.968 -12.964 4.247 1.00 0.00 H +ATOM 578 HE3 LYS 208 -18.098 -11.984 3.594 1.00 0.00 H +ATOM 579 NZ LYS 208 -18.254 -12.166 5.628 1.00 0.00 N +ATOM 580 HZ1 LYS 208 -18.502 -12.924 6.231 1.00 0.00 H +ATOM 581 HZ2 LYS 208 -17.457 -11.691 6.000 1.00 0.00 H +ATOM 582 HZ3 LYS 208 -19.022 -11.528 5.561 1.00 0.00 H +ATOM 583 C LYS 208 -22.269 -12.344 0.603 1.00 0.00 C +ATOM 584 O LYS 208 -22.216 -11.180 0.220 1.00 0.00 O +ATOM 585 N ALA 209 -22.535 -13.358 -0.219 1.00 0.00 N +ATOM 586 H ALA 209 -22.551 -14.292 0.224 1.00 0.00 H +ATOM 587 CA ALA 209 -22.784 -13.136 -1.649 1.00 0.00 C +ATOM 588 HA ALA 209 -22.020 -12.620 -2.033 1.00 0.00 H +ATOM 589 CB ALA 209 -22.907 -14.491 -2.387 1.00 0.00 C +ATOM 590 HB1 ALA 209 -23.859 -14.782 -2.368 1.00 0.00 H +ATOM 591 HB2 ALA 209 -22.604 -14.373 -3.328 1.00 0.00 H +ATOM 592 HB3 ALA 209 -22.335 -15.162 -1.925 1.00 0.00 H +ATOM 593 C ALA 209 -24.065 -12.313 -1.817 1.00 0.00 C +ATOM 594 O ALA 209 -24.118 -11.411 -2.654 1.00 0.00 O +ATOM 595 N LEU 210 -25.086 -12.614 -1.014 1.00 0.00 N +ATOM 596 H LEU 210 -24.914 -13.393 -0.359 1.00 0.00 H +ATOM 597 CA LEU 210 -26.340 -11.872 -1.086 1.00 0.00 C +ATOM 598 HA LEU 210 -26.663 -11.880 -2.037 1.00 0.00 H +ATOM 599 CB LEU 210 -27.393 -12.512 -0.177 1.00 0.00 C +ATOM 600 HB2 LEU 210 -27.535 -13.450 -0.489 1.00 0.00 H +ATOM 601 HB3 LEU 210 -27.031 -12.517 0.753 1.00 0.00 H +ATOM 602 CG LEU 210 -28.766 -11.836 -0.129 1.00 0.00 C +ATOM 603 HG LEU 210 -28.666 -10.918 0.234 1.00 0.00 H +ATOM 604 CD1 LEU 210 -29.339 -11.757 -1.551 1.00 0.00 C +ATOM 605 HD11 LEU 210 -29.430 -12.680 -1.919 1.00 0.00 H +ATOM 606 HD12 LEU 210 -30.234 -11.316 -1.520 1.00 0.00 H +ATOM 607 HD13 LEU 210 -28.720 -11.224 -2.125 1.00 0.00 H +ATOM 608 CD2 LEU 210 -29.717 -12.614 0.785 1.00 0.00 C +ATOM 609 HD21 LEU 210 -29.336 -12.644 1.708 1.00 0.00 H +ATOM 610 HD22 LEU 210 -30.605 -12.157 0.802 1.00 0.00 H +ATOM 611 HD23 LEU 210 -29.824 -13.544 0.435 1.00 0.00 H +ATOM 612 C LEU 210 -26.126 -10.426 -0.661 1.00 0.00 C +ATOM 613 O LEU 210 -26.672 -9.500 -1.267 1.00 0.00 O +ATOM 614 N GLU 211 -25.336 -10.239 0.392 1.00 0.00 N +ATOM 615 H GLU 211 -24.941 -11.106 0.802 1.00 0.00 H +ATOM 616 CA GLU 211 -25.060 -8.902 0.914 1.00 0.00 C +ATOM 617 HA GLU 211 -25.921 -8.451 1.161 1.00 0.00 H +ATOM 618 CB GLU 211 -24.248 -9.010 2.216 1.00 0.00 C +ATOM 619 HB2 GLU 211 -23.607 -9.734 2.109 1.00 0.00 H +ATOM 620 HB3 GLU 211 -23.845 -8.143 2.390 1.00 0.00 H +ATOM 621 CG GLU 211 -25.141 -9.355 3.414 1.00 0.00 C +ATOM 622 HG2 GLU 211 -25.576 -8.524 3.721 1.00 0.00 H +ATOM 623 HG3 GLU 211 -25.805 -10.024 3.121 1.00 0.00 H +ATOM 624 CD GLU 211 -24.396 -9.950 4.615 1.00 0.00 C +ATOM 625 OE1 GLU 211 -23.160 -10.134 4.545 1.00 0.00 O +ATOM 626 OE2 GLU 211 -25.066 -10.236 5.638 1.00 0.00 O +ATOM 627 C GLU 211 -24.331 -8.066 -0.137 1.00 0.00 C +ATOM 628 O GLU 211 -24.606 -6.878 -0.308 1.00 0.00 O +ATOM 629 N THR 212 -23.403 -8.695 -0.850 1.00 0.00 N +ATOM 630 H THR 212 -23.261 -9.693 -0.597 1.00 0.00 H +ATOM 631 CA THR 212 -22.652 -8.019 -1.903 1.00 0.00 C +ATOM 632 HA THR 212 -22.234 -7.197 -1.521 1.00 0.00 H +ATOM 633 CB THR 212 -21.593 -8.951 -2.489 1.00 0.00 C +ATOM 634 HB THR 212 -22.050 -9.782 -2.864 1.00 0.00 H +ATOM 635 CG2 THR 212 -20.804 -8.250 -3.592 1.00 0.00 C +ATOM 636 HG21 THR 212 -20.406 -8.932 -4.208 1.00 0.00 H +ATOM 637 HG22 THR 212 -21.413 -7.649 -4.113 1.00 0.00 H +ATOM 638 HG23 THR 212 -20.069 -7.704 -3.186 1.00 0.00 H +ATOM 639 OG1 THR 212 -20.707 -9.364 -1.445 1.00 0.00 O +ATOM 640 HG1 THR 212 -21.163 -10.025 -0.839 1.00 0.00 H +ATOM 641 C THR 212 -23.621 -7.598 -3.006 1.00 0.00 C +ATOM 642 O THR 212 -23.522 -6.497 -3.545 1.00 0.00 O +ATOM 643 N LEU 213 -24.557 -8.483 -3.353 1.00 0.00 N +ATOM 644 H LEU 213 -24.524 -9.381 -2.857 1.00 0.00 H +ATOM 645 CA LEU 213 -25.546 -8.147 -4.381 1.00 0.00 C +ATOM 646 HA LEU 213 -25.055 -7.882 -5.224 1.00 0.00 H +ATOM 647 CB LEU 213 -26.428 -9.358 -4.726 1.00 0.00 C +ATOM 648 HB2 LEU 213 -26.596 -9.861 -3.876 1.00 0.00 H +ATOM 649 HB3 LEU 213 -27.295 -9.008 -5.081 1.00 0.00 H +ATOM 650 CG LEU 213 -25.884 -10.357 -5.747 1.00 0.00 C +ATOM 651 HG LEU 213 -24.983 -10.658 -5.458 1.00 0.00 H +ATOM 652 CD1 LEU 213 -26.821 -11.552 -5.819 1.00 0.00 C +ATOM 653 HD11 LEU 213 -27.732 -11.247 -6.099 1.00 0.00 H +ATOM 654 HD12 LEU 213 -26.472 -12.212 -6.486 1.00 0.00 H +ATOM 655 HD13 LEU 213 -26.878 -11.987 -4.920 1.00 0.00 H +ATOM 656 CD2 LEU 213 -25.750 -9.692 -7.117 1.00 0.00 C +ATOM 657 HD21 LEU 213 -25.122 -8.917 -7.049 1.00 0.00 H +ATOM 658 HD22 LEU 213 -25.394 -10.356 -7.774 1.00 0.00 H +ATOM 659 HD23 LEU 213 -26.647 -9.371 -7.418 1.00 0.00 H +ATOM 660 C LEU 213 -26.448 -6.975 -3.966 1.00 0.00 C +ATOM 661 O LEU 213 -26.835 -6.171 -4.802 1.00 0.00 O +ATOM 662 N ARG 214 -26.796 -6.887 -2.684 1.00 0.00 N +ATOM 663 H ARG 214 -26.430 -7.627 -2.072 1.00 0.00 H +ATOM 664 CA ARG 214 -27.649 -5.788 -2.220 1.00 0.00 C +ATOM 665 HA ARG 214 -28.475 -5.762 -2.789 1.00 0.00 H +ATOM 666 CB ARG 214 -28.025 -5.958 -0.756 1.00 0.00 C +ATOM 667 HB2 ARG 214 -27.182 -6.127 -0.238 1.00 0.00 H +ATOM 668 HB3 ARG 214 -28.433 -5.097 -0.439 1.00 0.00 H +ATOM 669 CG ARG 214 -28.986 -7.069 -0.472 1.00 0.00 C +ATOM 670 HG2 ARG 214 -29.854 -6.889 -0.908 1.00 0.00 H +ATOM 671 HG3 ARG 214 -28.606 -7.932 -0.769 1.00 0.00 H +ATOM 672 CD ARG 214 -29.212 -7.141 1.020 1.00 0.00 C +ATOM 673 HD2 ARG 214 -28.324 -7.169 1.469 1.00 0.00 H +ATOM 674 HD3 ARG 214 -29.714 -6.327 1.299 1.00 0.00 H +ATOM 675 NE ARG 214 -29.974 -8.325 1.382 1.00 0.00 N +ATOM 676 HE ARG 214 -30.629 -8.690 0.709 1.00 0.00 H +ATOM 677 CZ ARG 214 -29.859 -8.952 2.541 1.00 0.00 C +ATOM 678 NH1 ARG 214 -29.010 -8.502 3.450 1.00 0.00 N +ATOM 679 HH11 ARG 214 -28.462 -7.685 3.296 1.00 0.00 H +ATOM 680 HH12 ARG 214 -28.912 -8.997 4.327 1.00 0.00 H +ATOM 681 NH2 ARG 214 -30.589 -10.032 2.782 1.00 0.00 N +ATOM 682 HH21 ARG 214 -31.240 -10.358 2.092 1.00 0.00 H +ATOM 683 HH22 ARG 214 -30.494 -10.521 3.648 1.00 0.00 H +ATOM 684 C ARG 214 -26.916 -4.468 -2.353 1.00 0.00 C +ATOM 685 O ARG 214 -27.527 -3.411 -2.529 1.00 0.00 O +ATOM 686 N ARG 215 -25.598 -4.531 -2.240 1.00 0.00 N +ATOM 687 H ARG 215 -25.218 -5.484 -2.074 1.00 0.00 H +ATOM 688 CA ARG 215 -24.772 -3.343 -2.344 1.00 0.00 C +ATOM 689 HA ARG 215 -25.251 -2.571 -1.903 1.00 0.00 H +ATOM 690 CB ARG 215 -23.456 -3.579 -1.595 1.00 0.00 C +ATOM 691 HB2 ARG 215 -23.668 -3.684 -0.620 1.00 0.00 H +ATOM 692 HB3 ARG 215 -23.054 -4.433 -1.934 1.00 0.00 H +ATOM 693 CG ARG 215 -22.404 -2.483 -1.729 1.00 0.00 C +ATOM 694 HG2 ARG 215 -21.960 -2.554 -2.610 1.00 0.00 H +ATOM 695 HG3 ARG 215 -22.830 -1.598 -1.612 1.00 0.00 H +ATOM 696 CD ARG 215 -21.336 -2.642 -0.644 1.00 0.00 C +ATOM 697 HD2 ARG 215 -20.586 -2.020 -0.858 1.00 0.00 H +ATOM 698 HD3 ARG 215 -21.748 -2.390 0.229 1.00 0.00 H +ATOM 699 NE ARG 215 -20.817 -4.012 -0.557 1.00 0.00 N +ATOM 700 HE ARG 215 -21.280 -4.645 0.082 1.00 0.00 H +ATOM 701 CZ ARG 215 -19.786 -4.485 -1.253 1.00 0.00 C +ATOM 702 NH1 ARG 215 -19.136 -3.710 -2.101 1.00 0.00 N +ATOM 703 HH11 ARG 215 -19.389 -2.752 -2.223 1.00 0.00 H +ATOM 704 HH12 ARG 215 -18.369 -4.086 -2.636 1.00 0.00 H +ATOM 705 NH2 ARG 215 -19.408 -5.743 -1.095 1.00 0.00 N +ATOM 706 HH21 ARG 215 -19.886 -6.331 -0.437 1.00 0.00 H +ATOM 707 HH22 ARG 215 -18.646 -6.112 -1.627 1.00 0.00 H +ATOM 708 C ARG 215 -24.504 -2.978 -3.798 1.00 0.00 C +ATOM 709 O ARG 215 -24.844 -1.875 -4.230 1.00 0.00 O +ATOM 710 N VAL 216 -23.937 -3.911 -4.560 1.00 0.00 N +ATOM 711 H VAL 216 -23.767 -4.818 -4.080 1.00 0.00 H +ATOM 712 CA VAL 216 -23.588 -3.665 -5.956 1.00 0.00 C +ATOM 713 HA VAL 216 -23.173 -2.734 -6.016 1.00 0.00 H +ATOM 714 CB VAL 216 -22.501 -4.669 -6.424 1.00 0.00 C +ATOM 715 HB VAL 216 -22.904 -5.579 -6.390 1.00 0.00 H +ATOM 716 CG1 VAL 216 -22.107 -4.403 -7.864 1.00 0.00 C +ATOM 717 HG11 VAL 216 -21.477 -5.115 -8.178 1.00 0.00 H +ATOM 718 HG12 VAL 216 -22.924 -4.406 -8.443 1.00 0.00 H +ATOM 719 HG13 VAL 216 -21.658 -3.511 -7.931 1.00 0.00 H +ATOM 720 CG2 VAL 216 -21.285 -4.550 -5.521 1.00 0.00 C +ATOM 721 HG21 VAL 216 -21.276 -5.314 -4.875 1.00 0.00 H +ATOM 722 HG22 VAL 216 -20.455 -4.572 -6.079 1.00 0.00 H +ATOM 723 HG23 VAL 216 -21.329 -3.686 -5.018 1.00 0.00 H +ATOM 724 C VAL 216 -24.770 -3.707 -6.922 1.00 0.00 C +ATOM 725 O VAL 216 -24.858 -2.883 -7.834 1.00 0.00 O +ATOM 726 N GLY 217 -25.667 -4.672 -6.741 1.00 0.00 N +ATOM 727 H GLY 217 -25.482 -5.307 -5.955 1.00 0.00 H +ATOM 728 CA GLY 217 -26.813 -4.773 -7.627 1.00 0.00 C +ATOM 729 HA2 GLY 217 -26.491 -4.980 -8.572 1.00 0.00 H +ATOM 730 HA3 GLY 217 -27.391 -5.563 -7.341 1.00 0.00 H +ATOM 731 C GLY 217 -27.671 -3.518 -7.660 1.00 0.00 C +ATOM 732 O GLY 217 -28.157 -3.111 -8.712 1.00 0.00 O +ATOM 733 N ASP 218 -27.863 -2.905 -6.500 1.00 0.00 N +ATOM 734 H ASP 218 -27.396 -3.356 -5.686 1.00 0.00 H +ATOM 735 CA ASP 218 -28.667 -1.695 -6.391 1.00 0.00 C +ATOM 736 HA ASP 218 -29.551 -1.881 -6.844 1.00 0.00 H +ATOM 737 CB ASP 218 -28.881 -1.366 -4.912 1.00 0.00 C +ATOM 738 HB2 ASP 218 -27.995 -1.323 -4.472 1.00 0.00 H +ATOM 739 HB3 ASP 218 -29.351 -0.498 -4.852 1.00 0.00 H +ATOM 740 CG ASP 218 -29.725 -2.426 -4.199 1.00 0.00 C +ATOM 741 OD1 ASP 218 -29.671 -3.617 -4.593 1.00 0.00 O +ATOM 742 OD2 ASP 218 -30.443 -2.080 -3.231 1.00 0.00 O +ATOM 743 C ASP 218 -28.031 -0.518 -7.125 1.00 0.00 C +ATOM 744 O ASP 218 -28.728 0.302 -7.718 1.00 0.00 O +ATOM 745 N GLY 219 -26.705 -0.442 -7.097 1.00 0.00 N +ATOM 746 H GLY 219 -26.229 -1.187 -6.572 1.00 0.00 H +ATOM 747 CA GLY 219 -26.027 0.643 -7.780 1.00 0.00 C +ATOM 748 HA2 GLY 219 -26.419 1.527 -7.483 1.00 0.00 H +ATOM 749 HA3 GLY 219 -25.048 0.643 -7.527 1.00 0.00 H +ATOM 750 C GLY 219 -26.152 0.524 -9.291 1.00 0.00 C +ATOM 751 O GLY 219 -26.279 1.531 -9.995 1.00 0.00 O +ATOM 752 N VAL 220 -26.126 -0.709 -9.786 1.00 0.00 N +ATOM 753 H VAL 220 -26.028 -1.462 -9.075 1.00 0.00 H +ATOM 754 CA VAL 220 -26.228 -0.966 -11.217 1.00 0.00 C +ATOM 755 HA VAL 220 -25.505 -0.431 -11.685 1.00 0.00 H +ATOM 756 CB VAL 220 -26.008 -2.470 -11.526 1.00 0.00 C +ATOM 757 HB VAL 220 -26.700 -2.979 -11.027 1.00 0.00 H +ATOM 758 CG1 VAL 220 -26.224 -2.738 -13.001 1.00 0.00 C +ATOM 759 HG11 VAL 220 -25.631 -3.488 -13.298 1.00 0.00 H +ATOM 760 HG12 VAL 220 -27.180 -2.990 -13.162 1.00 0.00 H +ATOM 761 HG13 VAL 220 -26.006 -1.916 -13.529 1.00 0.00 H +ATOM 762 CG2 VAL 220 -24.601 -2.884 -11.109 1.00 0.00 C +ATOM 763 HG21 VAL 220 -24.131 -2.097 -10.711 1.00 0.00 H +ATOM 764 HG22 VAL 220 -24.661 -3.618 -10.434 1.00 0.00 H +ATOM 765 HG23 VAL 220 -24.101 -3.205 -11.913 1.00 0.00 H +ATOM 766 C VAL 220 -27.572 -0.539 -11.796 1.00 0.00 C +ATOM 767 O VAL 220 -27.629 0.062 -12.865 1.00 0.00 O +ATOM 768 N GLN 221 -28.653 -0.860 -11.092 1.00 0.00 N +ATOM 769 H GLN 221 -28.465 -1.365 -10.207 1.00 0.00 H +ATOM 770 CA GLN 221 -29.991 -0.514 -11.556 1.00 0.00 C +ATOM 771 HA GLN 221 -30.109 -0.894 -12.482 1.00 0.00 H +ATOM 772 CB GLN 221 -31.044 -1.094 -10.606 1.00 0.00 C +ATOM 773 HB2 GLN 221 -30.895 -0.710 -9.689 1.00 0.00 H +ATOM 774 HB3 GLN 221 -31.955 -0.815 -10.928 1.00 0.00 H +ATOM 775 CG GLN 221 -31.032 -2.613 -10.488 1.00 0.00 C +ATOM 776 HG2 GLN 221 -31.214 -3.006 -11.385 1.00 0.00 H +ATOM 777 HG3 GLN 221 -30.136 -2.903 -10.163 1.00 0.00 H +ATOM 778 CD GLN 221 -32.088 -3.121 -9.514 1.00 0.00 C +ATOM 779 OE1 GLN 221 -31.765 -3.778 -8.530 1.00 0.00 O +ATOM 780 NE2 GLN 221 -33.352 -2.822 -9.790 1.00 0.00 N +ATOM 781 HE21 GLN 221 -34.106 -3.139 -9.194 1.00 0.00 H +ATOM 782 HE22 GLN 221 -33.552 -2.262 -10.620 1.00 0.00 H +ATOM 783 C GLN 221 -30.175 1.002 -11.652 1.00 0.00 C +ATOM 784 O GLN 221 -30.936 1.487 -12.489 1.00 0.00 O +ATOM 785 N ARG 222 -29.482 1.740 -10.785 1.00 0.00 N +ATOM 786 H ARG 222 -28.895 1.194 -10.123 1.00 0.00 H +ATOM 787 CA ARG 222 -29.554 3.198 -10.780 1.00 0.00 C +ATOM 788 HA ARG 222 -30.497 3.478 -10.985 1.00 0.00 H +ATOM 789 CB ARG 222 -29.146 3.743 -9.411 1.00 0.00 C +ATOM 790 HB2 ARG 222 -28.240 3.386 -9.190 1.00 0.00 H +ATOM 791 HB3 ARG 222 -29.110 4.739 -9.469 1.00 0.00 H +ATOM 792 CG ARG 222 -30.087 3.373 -8.273 1.00 0.00 C +ATOM 793 HG2 ARG 222 -30.510 2.489 -8.463 1.00 0.00 H +ATOM 794 HG3 ARG 222 -29.574 3.324 -7.418 1.00 0.00 H +ATOM 795 CD ARG 222 -31.205 4.401 -8.091 1.00 0.00 C +ATOM 796 HD2 ARG 222 -31.701 4.164 -7.261 1.00 0.00 H +ATOM 797 HD3 ARG 222 -30.779 5.296 -7.994 1.00 0.00 H +ATOM 798 NE ARG 222 -32.111 4.409 -9.220 1.00 0.00 N +ATOM 799 HE ARG 222 -32.021 3.673 -9.908 1.00 0.00 H +ATOM 800 CZ ARG 222 -33.062 5.320 -9.423 1.00 0.00 C +ATOM 801 NH1 ARG 222 -33.254 6.320 -8.557 1.00 0.00 N +ATOM 802 HH11 ARG 222 -32.669 6.405 -7.754 1.00 0.00 H +ATOM 803 HH12 ARG 222 -33.986 6.982 -8.719 1.00 0.00 H +ATOM 804 NH2 ARG 222 -33.795 5.265 -10.528 1.00 0.00 N +ATOM 805 HH21 ARG 222 -33.618 4.554 -11.211 1.00 0.00 H +ATOM 806 HH22 ARG 222 -34.523 5.933 -10.681 1.00 0.00 H +ATOM 807 C ARG 222 -28.630 3.781 -11.846 1.00 0.00 C +ATOM 808 O ARG 222 -29.035 4.643 -12.633 1.00 0.00 O +ATOM 809 N ASN 223 -27.386 3.304 -11.867 1.00 0.00 N +ATOM 810 H ASN 223 -27.178 2.587 -11.153 1.00 0.00 H +ATOM 811 CA ASN 223 -26.412 3.784 -12.845 1.00 0.00 C +ATOM 812 HA ASN 223 -26.346 4.788 -12.729 1.00 0.00 H +ATOM 813 CB ASN 223 -25.052 3.121 -12.625 1.00 0.00 C +ATOM 814 HB2 ASN 223 -25.205 2.158 -12.418 1.00 0.00 H +ATOM 815 HB3 ASN 223 -24.523 3.209 -13.466 1.00 0.00 H +ATOM 816 CG ASN 223 -24.284 3.747 -11.496 1.00 0.00 C +ATOM 817 OD1 ASN 223 -24.321 4.960 -11.310 1.00 0.00 O +ATOM 818 ND2 ASN 223 -23.569 2.929 -10.741 1.00 0.00 N +ATOM 819 HD21 ASN 223 -23.040 3.287 -9.970 1.00 0.00 H +ATOM 820 HD22 ASN 223 -23.554 1.946 -10.939 1.00 0.00 H +ATOM 821 C ASN 223 -26.845 3.528 -14.280 1.00 0.00 C +ATOM 822 O ASN 223 -26.482 4.267 -15.189 1.00 0.00 O +ATOM 823 N HIE 224 -27.626 2.479 -14.479 1.00 0.00 N +ATOM 824 H HIE 224 -27.882 1.952 -13.625 1.00 0.00 H +ATOM 825 CA HIE 224 -28.068 2.127 -15.810 1.00 0.00 C +ATOM 826 HA HIE 224 -27.697 2.802 -16.464 1.00 0.00 H +ATOM 827 CB HIE 224 -27.465 0.762 -16.162 1.00 0.00 C +ATOM 828 HB2 HIE 224 -27.749 0.092 -15.474 1.00 0.00 H +ATOM 829 HB3 HIE 224 -27.804 0.478 -17.060 1.00 0.00 H +ATOM 830 CG HIE 224 -25.966 0.787 -16.208 1.00 0.00 C +ATOM 831 ND1 HIE 224 -25.278 1.419 -17.219 1.00 0.00 N +ATOM 832 CE1 HIE 224 -23.982 1.395 -16.948 1.00 0.00 C +ATOM 833 HE1 HIE 224 -23.263 1.785 -17.515 1.00 0.00 H +ATOM 834 NE2 HIE 224 -23.808 0.766 -15.803 1.00 0.00 N +ATOM 835 HE2 HIE 224 -22.922 0.599 -15.348 1.00 0.00 H +ATOM 836 CD2 HIE 224 -25.033 0.367 -15.317 1.00 0.00 C +ATOM 837 HD2 HIE 224 -25.199 -0.133 -14.475 1.00 0.00 H +ATOM 838 C HIE 224 -29.589 2.151 -15.920 1.00 0.00 C +ATOM 839 O HIE 224 -30.184 1.417 -16.696 1.00 0.00 O +ATOM 840 N GLU 225 -30.198 3.056 -15.157 1.00 0.00 N +ATOM 841 H GLU 225 -29.545 3.640 -14.582 1.00 0.00 H +ATOM 842 CA GLU 225 -31.647 3.223 -15.122 1.00 0.00 C +ATOM 843 HA GLU 225 -32.064 2.437 -14.627 1.00 0.00 H +ATOM 844 CB GLU 225 -32.009 4.470 -14.313 1.00 0.00 C +ATOM 845 HB2 GLU 225 -31.779 4.294 -13.373 1.00 0.00 H +ATOM 846 HB3 GLU 225 -31.502 5.226 -14.684 1.00 0.00 H +ATOM 847 CG GLU 225 -33.485 4.834 -14.366 1.00 0.00 C +ATOM 848 HG2 GLU 225 -33.750 4.902 -15.307 1.00 0.00 H +ATOM 849 HG3 GLU 225 -33.989 4.148 -13.879 1.00 0.00 H +ATOM 850 CD GLU 225 -33.767 6.167 -13.709 1.00 0.00 C +ATOM 851 OE1 GLU 225 -34.384 6.172 -12.627 1.00 0.00 O +ATOM 852 OE2 GLU 225 -33.367 7.211 -14.275 1.00 0.00 O +ATOM 853 C GLU 225 -32.279 3.340 -16.501 1.00 0.00 C +ATOM 854 O GLU 225 -33.199 2.598 -16.844 1.00 0.00 O +ATOM 855 N THR 226 -31.799 4.295 -17.283 1.00 0.00 N +ATOM 856 H THR 226 -31.027 4.852 -16.875 1.00 0.00 H +ATOM 857 CA THR 226 -32.340 4.519 -18.614 1.00 0.00 C +ATOM 858 HA THR 226 -33.312 4.798 -18.524 1.00 0.00 H +ATOM 859 CB THR 226 -31.601 5.678 -19.321 1.00 0.00 C +ATOM 860 HB THR 226 -30.630 5.406 -19.466 1.00 0.00 H +ATOM 861 CG2 THR 226 -32.278 6.016 -20.645 1.00 0.00 C +ATOM 862 HG21 THR 226 -33.265 5.859 -20.570 1.00 0.00 H +ATOM 863 HG22 THR 226 -32.114 6.978 -20.873 1.00 0.00 H +ATOM 864 HG23 THR 226 -31.906 5.437 -21.373 1.00 0.00 H +ATOM 865 OG1 THR 226 -31.622 6.837 -18.478 1.00 0.00 O +ATOM 866 HG1 THR 226 -32.024 6.612 -17.584 1.00 0.00 H +ATOM 867 C THR 226 -32.285 3.274 -19.493 1.00 0.00 C +ATOM 868 O THR 226 -33.275 2.921 -20.132 1.00 0.00 O +ATOM 869 N ALA 227 -31.140 2.604 -19.535 1.00 0.00 N +ATOM 870 H ALA 227 -30.377 2.985 -18.965 1.00 0.00 H +ATOM 871 CA ALA 227 -31.030 1.404 -20.360 1.00 0.00 C +ATOM 872 HA ALA 227 -31.313 1.626 -21.299 1.00 0.00 H +ATOM 873 CB ALA 227 -29.587 0.923 -20.403 1.00 0.00 C +ATOM 874 HB1 ALA 227 -29.545 0.033 -20.856 1.00 0.00 H +ATOM 875 HB2 ALA 227 -29.030 1.580 -20.910 1.00 0.00 H +ATOM 876 HB3 ALA 227 -29.235 0.839 -19.471 1.00 0.00 H +ATOM 877 C ALA 227 -31.946 0.291 -19.831 1.00 0.00 C +ATOM 878 O ALA 227 -32.558 -0.445 -20.607 1.00 0.00 O +ATOM 879 N PHE 228 -32.040 0.180 -18.508 1.00 0.00 N +ATOM 880 H PHE 228 -31.483 0.867 -17.970 1.00 0.00 H +ATOM 881 CA PHE 228 -32.875 -0.845 -17.894 1.00 0.00 C +ATOM 882 HA PHE 228 -32.609 -1.726 -18.303 1.00 0.00 H +ATOM 883 CB PHE 228 -32.657 -0.863 -16.376 1.00 0.00 C +ATOM 884 HB2 PHE 228 -32.453 0.057 -16.087 1.00 0.00 H +ATOM 885 HB3 PHE 228 -33.480 -1.206 -15.955 1.00 0.00 H +ATOM 886 CG PHE 228 -31.509 -1.751 -15.940 1.00 0.00 C +ATOM 887 CD1 PHE 228 -30.329 -1.796 -16.678 1.00 0.00 C +ATOM 888 HD1 PHE 228 -30.236 -1.239 -17.499 1.00 0.00 H +ATOM 889 CE1 PHE 228 -29.267 -2.610 -16.286 1.00 0.00 C +ATOM 890 HE1 PHE 228 -28.428 -2.631 -16.841 1.00 0.00 H +ATOM 891 CZ PHE 228 -29.369 -3.390 -15.134 1.00 0.00 C +ATOM 892 HZ PHE 228 -28.607 -3.965 -14.854 1.00 0.00 H +ATOM 893 CE2 PHE 228 -30.542 -3.356 -14.382 1.00 0.00 C +ATOM 894 HE2 PHE 228 -30.638 -3.918 -13.551 1.00 0.00 H +ATOM 895 CD2 PHE 228 -31.606 -2.531 -14.785 1.00 0.00 C +ATOM 896 HD2 PHE 228 -32.438 -2.504 -14.237 1.00 0.00 H +ATOM 897 C PHE 228 -34.346 -0.630 -18.234 1.00 0.00 C +ATOM 898 O PHE 228 -35.036 -1.576 -18.613 1.00 0.00 O +ATOM 899 N GLN 229 -34.822 0.609 -18.104 1.00 0.00 N +ATOM 900 H GLN 229 -34.143 1.306 -17.757 1.00 0.00 H +ATOM 901 CA GLN 229 -36.212 0.925 -18.437 1.00 0.00 C +ATOM 902 HA GLN 229 -36.802 0.315 -17.914 1.00 0.00 H +ATOM 903 CB GLN 229 -36.517 2.409 -18.220 1.00 0.00 C +ATOM 904 HB2 GLN 229 -35.962 2.948 -18.880 1.00 0.00 H +ATOM 905 HB3 GLN 229 -37.494 2.572 -18.458 1.00 0.00 H +ATOM 906 CG GLN 229 -36.275 2.978 -16.835 1.00 0.00 C +ATOM 907 HG2 GLN 229 -36.906 2.557 -16.194 1.00 0.00 H +ATOM 908 HG3 GLN 229 -35.335 2.800 -16.569 1.00 0.00 H +ATOM 909 CD GLN 229 -36.503 4.493 -16.807 1.00 0.00 C +ATOM 910 OE1 GLN 229 -37.320 4.990 -16.022 1.00 0.00 O +ATOM 911 NE2 GLN 229 -35.779 5.232 -17.659 1.00 0.00 N +ATOM 912 HE21 GLN 229 -35.892 6.229 -17.699 1.00 0.00 H +ATOM 913 HE22 GLN 229 -35.111 4.755 -18.263 1.00 0.00 H +ATOM 914 C GLN 229 -36.435 0.633 -19.922 1.00 0.00 C +ATOM 915 O GLN 229 -37.483 0.135 -20.321 1.00 0.00 O +ATOM 916 N GLY 230 -35.441 0.976 -20.732 1.00 0.00 N +ATOM 917 H GLY 230 -34.618 1.394 -20.266 1.00 0.00 H +ATOM 918 CA GLY 230 -35.540 0.763 -22.165 1.00 0.00 C +ATOM 919 HA2 GLY 230 -36.349 1.273 -22.524 1.00 0.00 H +ATOM 920 HA3 GLY 230 -34.723 1.173 -22.621 1.00 0.00 H +ATOM 921 C GLY 230 -35.654 -0.692 -22.564 1.00 0.00 C +ATOM 922 O GLY 230 -36.481 -1.049 -23.410 1.00 0.00 O +ATOM 923 N LEU 231 -34.824 -1.535 -21.957 1.00 0.00 N +ATOM 924 H LEU 231 -34.144 -1.198 -21.291 1.00 0.00 H +ATOM 925 CA LEU 231 -34.844 -2.958 -22.262 1.00 0.00 C +ATOM 926 HA LEU 231 -34.797 -3.110 -23.340 1.00 0.00 H +ATOM 927 CB LEU 231 -33.647 -3.666 -21.615 1.00 0.00 C +ATOM 928 HB2 LEU 231 -32.721 -3.241 -22.002 1.00 0.00 H +ATOM 929 HB3 LEU 231 -33.685 -3.531 -20.534 1.00 0.00 H +ATOM 930 CG LEU 231 -33.699 -5.154 -21.943 1.00 0.00 C +ATOM 931 HG LEU 231 -34.625 -5.580 -21.556 1.00 0.00 H +ATOM 932 CD1 LEU 231 -33.645 -5.344 -23.455 1.00 0.00 C +ATOM 933 HD11 LEU 231 -32.719 -4.919 -23.842 1.00 0.00 H +ATOM 934 HD12 LEU 231 -33.683 -6.408 -23.689 1.00 0.00 H +ATOM 935 HD13 LEU 231 -34.496 -4.841 -23.915 1.00 0.00 H +ATOM 936 CD2 LEU 231 -32.509 -5.858 -21.299 1.00 0.00 C +ATOM 937 HD21 LEU 231 -32.547 -5.723 -20.218 1.00 0.00 H +ATOM 938 HD22 LEU 231 -32.546 -6.922 -21.533 1.00 0.00 H +ATOM 939 HD23 LEU 231 -31.583 -5.434 -21.686 1.00 0.00 H +ATOM 940 C LEU 231 -36.150 -3.574 -21.767 1.00 0.00 C +ATOM 941 O LEU 231 -36.762 -4.372 -22.472 1.00 0.00 O +ATOM 942 N LEU 232 -36.589 -3.202 -20.565 1.00 0.00 N +ATOM 943 H LEU 232 -36.000 -2.524 -20.067 1.00 0.00 H +ATOM 944 CA LEU 232 -37.835 -3.753 -20.035 1.00 0.00 C +ATOM 945 HA LEU 232 -37.737 -4.753 -19.955 1.00 0.00 H +ATOM 946 CB LEU 232 -38.108 -3.214 -18.619 1.00 0.00 C +ATOM 947 HB2 LEU 232 -37.344 -3.478 -18.041 1.00 0.00 H +ATOM 948 HB3 LEU 232 -38.178 -2.226 -18.678 1.00 0.00 H +ATOM 949 CG LEU 232 -39.392 -3.726 -17.941 1.00 0.00 C +ATOM 950 HG LEU 232 -40.171 -3.491 -18.518 1.00 0.00 H +ATOM 951 CD1 LEU 232 -39.318 -5.224 -17.761 1.00 0.00 C +ATOM 952 HD11 LEU 232 -38.530 -5.459 -17.188 1.00 0.00 H +ATOM 953 HD12 LEU 232 -40.155 -5.555 -17.320 1.00 0.00 H +ATOM 954 HD13 LEU 232 -39.220 -5.669 -18.653 1.00 0.00 H +ATOM 955 CD2 LEU 232 -39.595 -3.050 -16.608 1.00 0.00 C +ATOM 956 HD21 LEU 232 -39.673 -2.058 -16.737 1.00 0.00 H +ATOM 957 HD22 LEU 232 -40.434 -3.391 -16.176 1.00 0.00 H +ATOM 958 HD23 LEU 232 -38.816 -3.241 -16.006 1.00 0.00 H +ATOM 959 C LEU 232 -39.024 -3.463 -20.965 1.00 0.00 C +ATOM 960 O LEU 232 -39.825 -4.358 -21.258 1.00 0.00 O +ATOM 961 N ARG 233 -39.128 -2.222 -21.441 1.00 0.00 N +ATOM 962 H ARG 233 -38.392 -1.567 -21.116 1.00 0.00 H +ATOM 963 CA ARG 233 -40.209 -1.829 -22.355 1.00 0.00 C +ATOM 964 HA ARG 233 -41.088 -1.993 -21.902 1.00 0.00 H +ATOM 965 CB ARG 233 -40.090 -0.339 -22.721 1.00 0.00 C +ATOM 966 HB2 ARG 233 -40.217 0.195 -21.889 1.00 0.00 H +ATOM 967 HB3 ARG 233 -39.178 -0.183 -23.090 1.00 0.00 H +ATOM 968 CG ARG 233 -41.106 0.149 -23.754 1.00 0.00 C +ATOM 969 HG2 ARG 233 -40.816 -0.134 -24.658 1.00 0.00 H +ATOM 970 HG3 ARG 233 -41.999 -0.219 -23.534 1.00 0.00 H +ATOM 971 CD ARG 233 -41.191 1.664 -23.727 1.00 0.00 C +ATOM 972 HD2 ARG 233 -40.826 1.981 -22.864 1.00 0.00 H +ATOM 973 HD3 ARG 233 -40.667 2.018 -24.489 1.00 0.00 H +ATOM 974 NE ARG 233 -42.583 2.097 -23.853 1.00 0.00 N +ATOM 975 HE ARG 233 -43.096 2.270 -22.997 1.00 0.00 H +ATOM 976 CZ ARG 233 -43.223 2.280 -25.000 1.00 0.00 C +ATOM 977 NH1 ARG 233 -42.604 2.085 -26.154 1.00 0.00 N +ATOM 978 HH11 ARG 233 -41.655 1.779 -26.184 1.00 0.00 H +ATOM 979 HH12 ARG 233 -43.096 2.246 -27.018 1.00 0.00 H +ATOM 980 NH2 ARG 233 -44.495 2.646 -24.990 1.00 0.00 N +ATOM 981 HH21 ARG 233 -44.976 2.765 -24.118 1.00 0.00 H +ATOM 982 HH22 ARG 233 -44.981 2.804 -25.850 1.00 0.00 H +ATOM 983 C ARG 233 -40.147 -2.669 -23.628 1.00 0.00 C +ATOM 984 O ARG 233 -41.156 -3.186 -24.111 1.00 0.00 O +ATOM 985 N LYS 234 -38.945 -2.788 -24.172 1.00 0.00 N +ATOM 986 H LYS 234 -38.187 -2.283 -23.661 1.00 0.00 H +ATOM 987 CA LYS 234 -38.717 -3.558 -25.377 1.00 0.00 C +ATOM 988 HA LYS 234 -39.224 -3.132 -26.142 1.00 0.00 H +ATOM 989 CB LYS 234 -37.226 -3.516 -25.701 1.00 0.00 C +ATOM 990 HB2 LYS 234 -36.952 -2.545 -25.764 1.00 0.00 H +ATOM 991 HB3 LYS 234 -36.730 -3.924 -24.920 1.00 0.00 H +ATOM 992 CG LYS 234 -36.794 -4.215 -26.958 1.00 0.00 C +ATOM 993 HG2 LYS 234 -36.765 -5.192 -26.806 1.00 0.00 H +ATOM 994 HG3 LYS 234 -37.406 -3.984 -27.699 1.00 0.00 H +ATOM 995 CD LYS 234 -35.391 -3.735 -27.315 1.00 0.00 C +ATOM 996 HD2 LYS 234 -35.458 -3.070 -28.053 1.00 0.00 H +ATOM 997 HD3 LYS 234 -34.980 -3.316 -26.511 1.00 0.00 H +ATOM 998 CE LYS 234 -34.497 -4.881 -27.774 1.00 0.00 C +ATOM 999 HE2 LYS 234 -34.432 -5.562 -27.035 1.00 0.00 H +ATOM 1000 HE3 LYS 234 -34.916 -5.324 -28.576 1.00 0.00 H +ATOM 1001 NZ LYS 234 -33.104 -4.438 -28.144 1.00 0.00 N +ATOM 1002 HZ1 LYS 234 -32.517 -4.519 -27.343 1.00 0.00 H +ATOM 1003 HZ2 LYS 234 -32.765 -5.022 -28.877 1.00 0.00 H +ATOM 1004 HZ3 LYS 234 -33.138 -3.490 -28.449 1.00 0.00 H +ATOM 1005 C LYS 234 -39.192 -4.997 -25.225 1.00 0.00 C +ATOM 1006 O LYS 234 -39.803 -5.550 -26.143 1.00 0.00 O +ATOM 1007 N LEU 235 -38.898 -5.594 -24.072 1.00 0.00 N +ATOM 1008 H LEU 235 -38.370 -4.992 -23.399 1.00 0.00 H +ATOM 1009 CA LEU 235 -39.280 -6.971 -23.774 1.00 0.00 C +ATOM 1010 HA LEU 235 -38.951 -7.565 -24.526 1.00 0.00 H +ATOM 1011 CB LEU 235 -38.581 -7.431 -22.494 1.00 0.00 C +ATOM 1012 HB2 LEU 235 -38.735 -6.749 -21.799 1.00 0.00 H +ATOM 1013 HB3 LEU 235 -38.953 -8.307 -22.239 1.00 0.00 H +ATOM 1014 CG LEU 235 -37.066 -7.599 -22.646 1.00 0.00 C +ATOM 1015 HG LEU 235 -36.686 -6.758 -23.029 1.00 0.00 H +ATOM 1016 CD1 LEU 235 -36.429 -7.880 -21.301 1.00 0.00 C +ATOM 1017 HD11 LEU 235 -36.811 -8.721 -20.915 1.00 0.00 H +ATOM 1018 HD12 LEU 235 -35.439 -7.988 -21.412 1.00 0.00 H +ATOM 1019 HD13 LEU 235 -36.610 -7.119 -20.676 1.00 0.00 H +ATOM 1020 CD2 LEU 235 -36.785 -8.737 -23.619 1.00 0.00 C +ATOM 1021 HD21 LEU 235 -37.190 -8.524 -24.508 1.00 0.00 H +ATOM 1022 HD22 LEU 235 -35.796 -8.851 -23.722 1.00 0.00 H +ATOM 1023 HD23 LEU 235 -37.183 -9.584 -23.266 1.00 0.00 H +ATOM 1024 C LEU 235 -40.790 -7.151 -23.649 1.00 0.00 C +ATOM 1025 O LEU 235 -41.312 -8.244 -23.864 1.00 0.00 O +ATOM 1026 N ASP 236 -41.479 -6.078 -23.281 1.00 0.00 N +ATOM 1027 H ASP 236 -40.897 -5.237 -23.078 1.00 0.00 H +ATOM 1028 CA ASP 236 -42.930 -6.089 -23.174 1.00 0.00 C +ATOM 1029 HA ASP 236 -43.198 -5.284 -22.612 1.00 0.00 H +ATOM 1030 CB ASP 236 -43.512 -5.955 -24.582 1.00 0.00 C +ATOM 1031 HB2 ASP 236 -43.130 -5.134 -24.994 1.00 0.00 H +ATOM 1032 HB3 ASP 236 -43.244 -6.759 -25.102 1.00 0.00 H +ATOM 1033 CG ASP 236 -45.020 -5.848 -24.587 1.00 0.00 C +ATOM 1034 OD1 ASP 236 -45.614 -5.551 -23.527 1.00 0.00 O +ATOM 1035 OD2 ASP 236 -45.595 -6.052 -25.673 1.00 0.00 O +ATOM 1036 C ASP 236 -43.492 -7.326 -22.464 1.00 0.00 C +ATOM 1037 O ASP 236 -44.227 -8.124 -23.049 1.00 0.00 O +ATOM 1038 N ILE 237 -43.153 -7.458 -21.184 1.00 0.00 N +ATOM 1039 H ILE 237 -42.562 -6.680 -20.813 1.00 0.00 H +ATOM 1040 CA ILE 237 -43.573 -8.593 -20.373 1.00 0.00 C +ATOM 1041 HA ILE 237 -43.630 -9.385 -21.002 1.00 0.00 H +ATOM 1042 CB ILE 237 -42.572 -8.834 -19.239 1.00 0.00 C +ATOM 1043 HB ILE 237 -42.634 -8.076 -18.604 1.00 0.00 H +ATOM 1044 CG2 ILE 237 -42.882 -10.158 -18.555 1.00 0.00 C +ATOM 1045 HG21 ILE 237 -42.233 -10.309 -17.812 1.00 0.00 H +ATOM 1046 HG22 ILE 237 -43.810 -10.134 -18.186 1.00 0.00 H +ATOM 1047 HG23 ILE 237 -42.808 -10.901 -19.218 1.00 0.00 H +ATOM 1048 CG1 ILE 237 -41.151 -8.856 -19.811 1.00 0.00 C +ATOM 1049 HG12 ILE 237 -41.034 -9.703 -20.330 1.00 0.00 H +ATOM 1050 HG13 ILE 237 -41.058 -8.085 -20.443 1.00 0.00 H +ATOM 1051 CD1 ILE 237 -40.061 -8.763 -18.768 1.00 0.00 C +ATOM 1052 HD11 ILE 237 -40.136 -9.536 -18.139 1.00 0.00 H +ATOM 1053 HD12 ILE 237 -39.169 -8.784 -19.217 1.00 0.00 H +ATOM 1054 HD13 ILE 237 -40.160 -7.908 -18.260 1.00 0.00 H +ATOM 1055 C ILE 237 -44.960 -8.419 -19.768 1.00 0.00 C +ATOM 1056 O ILE 237 -45.183 -7.546 -18.917 1.00 0.00 O +ATOM 1057 N LYS 238 -45.884 -9.273 -20.199 1.00 0.00 N +ATOM 1058 H LYS 238 -45.540 -9.973 -20.889 1.00 0.00 H +ATOM 1059 CA LYS 238 -47.262 -9.218 -19.732 1.00 0.00 C +ATOM 1060 HA LYS 238 -47.355 -8.439 -19.081 1.00 0.00 H +ATOM 1061 CB LYS 238 -48.179 -8.957 -20.924 1.00 0.00 C +ATOM 1062 HB2 LYS 238 -48.145 -9.754 -21.526 1.00 0.00 H +ATOM 1063 HB3 LYS 238 -49.111 -8.837 -20.582 1.00 0.00 H +ATOM 1064 CG LYS 238 -47.810 -7.728 -21.741 1.00 0.00 C +ATOM 1065 HG2 LYS 238 -48.003 -6.906 -21.206 1.00 0.00 H +ATOM 1066 HG3 LYS 238 -46.837 -7.760 -21.966 1.00 0.00 H +ATOM 1067 CD LYS 238 -48.610 -7.654 -23.052 1.00 0.00 C +ATOM 1068 HD2 LYS 238 -49.480 -8.117 -22.922 1.00 0.00 H +ATOM 1069 HD3 LYS 238 -48.756 -6.699 -23.285 1.00 0.00 H +ATOM 1070 CE LYS 238 -47.874 -8.330 -24.227 1.00 0.00 C +ATOM 1071 HE2 LYS 238 -48.518 -8.438 -24.988 1.00 0.00 H +ATOM 1072 HE3 LYS 238 -47.121 -7.735 -24.517 1.00 0.00 H +ATOM 1073 NZ LYS 238 -47.318 -9.681 -23.860 1.00 0.00 N +ATOM 1074 HZ1 LYS 238 -47.680 -10.361 -24.492 1.00 0.00 H +ATOM 1075 HZ2 LYS 238 -46.324 -9.649 -23.925 1.00 0.00 H +ATOM 1076 HZ3 LYS 238 -47.593 -9.900 -22.927 1.00 0.00 H +ATOM 1077 C LYS 238 -47.726 -10.489 -19.030 1.00 0.00 C +ATOM 1078 O LYS 238 -48.572 -10.441 -18.132 1.00 0.00 O +ATOM 1079 N ASN 239 -47.178 -11.625 -19.441 1.00 0.00 N +ATOM 1080 H ASN 239 -46.461 -11.534 -20.173 1.00 0.00 H +ATOM 1081 CA ASN 239 -47.600 -12.889 -18.861 1.00 0.00 C +ATOM 1082 HA ASN 239 -47.917 -12.691 -17.910 1.00 0.00 H +ATOM 1083 CB ASN 239 -48.744 -13.446 -19.706 1.00 0.00 C +ATOM 1084 HB2 ASN 239 -48.927 -14.379 -19.418 1.00 0.00 H +ATOM 1085 HB3 ASN 239 -49.546 -12.875 -19.570 1.00 0.00 H +ATOM 1086 CG ASN 239 -48.407 -13.458 -21.193 1.00 0.00 C +ATOM 1087 OD1 ASN 239 -47.492 -14.166 -21.637 1.00 0.00 O +ATOM 1088 ND2 ASN 239 -49.138 -12.669 -21.970 1.00 0.00 N +ATOM 1089 HD21 ASN 239 -48.969 -12.636 -22.955 1.00 0.00 H +ATOM 1090 HD22 ASN 239 -49.861 -12.103 -21.569 1.00 0.00 H +ATOM 1091 C ASN 239 -46.506 -13.939 -18.750 1.00 0.00 C +ATOM 1092 O ASN 239 -45.313 -13.666 -18.947 1.00 0.00 O +ATOM 1093 N GLU 240 -46.952 -15.156 -18.459 1.00 0.00 N +ATOM 1094 H GLU 240 -48.000 -15.208 -18.353 1.00 0.00 H +ATOM 1095 CA GLU 240 -46.091 -16.315 -18.299 1.00 0.00 C +ATOM 1096 HA GLU 240 -45.426 -16.146 -17.552 1.00 0.00 H +ATOM 1097 CB GLU 240 -46.957 -17.490 -17.848 1.00 0.00 C +ATOM 1098 HB2 GLU 240 -47.330 -17.258 -16.955 1.00 0.00 H +ATOM 1099 HB3 GLU 240 -47.690 -17.591 -18.512 1.00 0.00 H +ATOM 1100 CG GLU 240 -46.262 -18.822 -17.724 1.00 0.00 C +ATOM 1101 HG2 GLU 240 -46.068 -19.159 -18.621 1.00 0.00 H +ATOM 1102 HG3 GLU 240 -45.463 -18.710 -17.173 1.00 0.00 H +ATOM 1103 CD GLU 240 -47.151 -19.838 -17.037 1.00 0.00 C +ATOM 1104 OE1 GLU 240 -48.271 -20.067 -17.540 1.00 0.00 O +ATOM 1105 OE2 GLU 240 -46.731 -20.397 -15.997 1.00 0.00 O +ATOM 1106 C GLU 240 -45.330 -16.660 -19.577 1.00 0.00 C +ATOM 1107 O GLU 240 -44.142 -16.980 -19.526 1.00 0.00 O +ATOM 1108 N ASP 241 -46.003 -16.593 -20.721 1.00 0.00 N +ATOM 1109 H ASP 241 -46.986 -16.316 -20.645 1.00 0.00 H +ATOM 1110 CA ASP 241 -45.327 -16.906 -21.970 1.00 0.00 C +ATOM 1111 HA ASP 241 -44.904 -17.812 -21.866 1.00 0.00 H +ATOM 1112 CB ASP 241 -46.316 -16.953 -23.145 1.00 0.00 C +ATOM 1113 HB2 ASP 241 -46.894 -16.152 -23.094 1.00 0.00 H +ATOM 1114 HB3 ASP 241 -45.796 -16.967 -23.985 1.00 0.00 H +ATOM 1115 CG ASP 241 -47.208 -18.199 -23.103 1.00 0.00 C +ATOM 1116 OD1 ASP 241 -46.773 -19.234 -22.538 1.00 0.00 O +ATOM 1117 OD2 ASP 241 -48.335 -18.158 -23.643 1.00 0.00 O +ATOM 1118 C ASP 241 -44.188 -15.913 -22.229 1.00 0.00 C +ATOM 1119 O ASP 241 -43.108 -16.313 -22.680 1.00 0.00 O +ATOM 1120 N ASP 242 -44.404 -14.628 -21.944 1.00 0.00 N +ATOM 1121 H ASP 242 -45.338 -14.393 -21.607 1.00 0.00 H +ATOM 1122 CA ASP 242 -43.319 -13.655 -22.126 1.00 0.00 C +ATOM 1123 HA ASP 242 -42.953 -13.790 -23.048 1.00 0.00 H +ATOM 1124 CB ASP 242 -43.792 -12.217 -21.884 1.00 0.00 C +ATOM 1125 HB2 ASP 242 -44.008 -12.126 -20.917 1.00 0.00 H +ATOM 1126 HB3 ASP 242 -43.047 -11.606 -22.130 1.00 0.00 H +ATOM 1127 CG ASP 242 -45.015 -11.852 -22.695 1.00 0.00 C +ATOM 1128 OD1 ASP 242 -45.044 -12.127 -23.907 1.00 0.00 O +ATOM 1129 OD2 ASP 242 -45.950 -11.279 -22.106 1.00 0.00 O +ATOM 1130 C ASP 242 -42.181 -13.949 -21.144 1.00 0.00 C +ATOM 1131 O ASP 242 -41.015 -13.758 -21.470 1.00 0.00 O +ATOM 1132 N VAL 243 -42.505 -14.396 -19.934 1.00 0.00 N +ATOM 1133 H VAL 243 -43.506 -14.513 -19.754 1.00 0.00 H +ATOM 1134 CA VAL 243 -41.453 -14.684 -18.965 1.00 0.00 C +ATOM 1135 HA VAL 243 -40.864 -13.877 -18.892 1.00 0.00 H +ATOM 1136 CB VAL 243 -42.030 -15.023 -17.558 1.00 0.00 C +ATOM 1137 HB VAL 243 -42.661 -15.780 -17.672 1.00 0.00 H +ATOM 1138 CG1 VAL 243 -40.915 -15.500 -16.632 1.00 0.00 C +ATOM 1139 HG11 VAL 243 -40.495 -16.322 -17.014 1.00 0.00 H +ATOM 1140 HG12 VAL 243 -40.225 -14.782 -16.546 1.00 0.00 H +ATOM 1141 HG13 VAL 243 -41.297 -15.707 -15.732 1.00 0.00 H +ATOM 1142 CG2 VAL 243 -42.699 -13.795 -16.959 1.00 0.00 C +ATOM 1143 HG21 VAL 243 -43.686 -13.851 -17.107 1.00 0.00 H +ATOM 1144 HG22 VAL 243 -42.507 -13.760 -15.978 1.00 0.00 H +ATOM 1145 HG23 VAL 243 -42.339 -12.974 -17.402 1.00 0.00 H +ATOM 1146 C VAL 243 -40.604 -15.844 -19.465 1.00 0.00 C +ATOM 1147 O VAL 243 -39.394 -15.845 -19.300 1.00 0.00 O +ATOM 1148 N LYS 244 -41.241 -16.828 -20.091 1.00 0.00 N +ATOM 1149 H LYS 244 -42.262 -16.706 -20.180 1.00 0.00 H +ATOM 1150 CA LYS 244 -40.512 -17.979 -20.600 1.00 0.00 C +ATOM 1151 HA LYS 244 -39.925 -18.344 -19.871 1.00 0.00 H +ATOM 1152 CB LYS 244 -41.491 -19.072 -21.035 1.00 0.00 C +ATOM 1153 HB2 LYS 244 -42.115 -18.680 -21.705 1.00 0.00 H +ATOM 1154 HB3 LYS 244 -40.966 -19.811 -21.449 1.00 0.00 H +ATOM 1155 CG LYS 244 -42.307 -19.641 -19.892 1.00 0.00 C +ATOM 1156 HG2 LYS 244 -41.711 -19.784 -19.101 1.00 0.00 H +ATOM 1157 HG3 LYS 244 -43.032 -18.997 -19.652 1.00 0.00 H +ATOM 1158 CD LYS 244 -42.940 -20.971 -20.274 1.00 0.00 C +ATOM 1159 HD2 LYS 244 -43.713 -20.800 -20.869 1.00 0.00 H +ATOM 1160 HD3 LYS 244 -42.261 -21.534 -20.723 1.00 0.00 H +ATOM 1161 CE LYS 244 -43.432 -21.698 -19.032 1.00 0.00 C +ATOM 1162 HE2 LYS 244 -42.715 -21.672 -18.334 1.00 0.00 H +ATOM 1163 HE3 LYS 244 -44.248 -21.234 -18.684 1.00 0.00 H +ATOM 1164 NZ LYS 244 -43.770 -23.120 -19.332 1.00 0.00 N +ATOM 1165 HZ1 LYS 244 -44.005 -23.589 -18.482 1.00 0.00 H +ATOM 1166 HZ2 LYS 244 -44.548 -23.149 -19.958 1.00 0.00 H +ATOM 1167 HZ3 LYS 244 -42.981 -23.564 -19.755 1.00 0.00 H +ATOM 1168 C LYS 244 -39.634 -17.566 -21.772 1.00 0.00 C +ATOM 1169 O LYS 244 -38.559 -18.126 -21.990 1.00 0.00 O +ATOM 1170 N SER 245 -40.084 -16.571 -22.522 1.00 0.00 N +ATOM 1171 H SER 245 -40.986 -16.165 -22.226 1.00 0.00 H +ATOM 1172 CA SER 245 -39.327 -16.110 -23.679 1.00 0.00 C +ATOM 1173 HA SER 245 -39.098 -16.917 -24.247 1.00 0.00 H +ATOM 1174 CB SER 245 -40.176 -15.146 -24.509 1.00 0.00 C +ATOM 1175 HB2 SER 245 -39.747 -15.025 -25.399 1.00 0.00 H +ATOM 1176 HB3 SER 245 -41.087 -15.533 -24.617 1.00 0.00 H +ATOM 1177 OG SER 245 -40.283 -13.886 -23.872 1.00 0.00 O +ATOM 1178 HG SER 245 -40.573 -14.015 -22.924 1.00 0.00 H +ATOM 1179 C SER 245 -38.014 -15.430 -23.290 1.00 0.00 C +ATOM 1180 O SER 245 -37.148 -15.217 -24.137 1.00 0.00 O +ATOM 1181 N LEU 246 -37.859 -15.104 -22.010 1.00 0.00 N +ATOM 1182 H LEU 246 -38.642 -15.366 -21.390 1.00 0.00 H +ATOM 1183 CA LEU 246 -36.651 -14.423 -21.551 1.00 0.00 C +ATOM 1184 HA LEU 246 -36.510 -13.595 -22.137 1.00 0.00 H +ATOM 1185 CB LEU 246 -36.860 -13.871 -20.137 1.00 0.00 C +ATOM 1186 HB2 LEU 246 -37.135 -14.618 -19.557 1.00 0.00 H +ATOM 1187 HB3 LEU 246 -36.015 -13.464 -19.841 1.00 0.00 H +ATOM 1188 CG LEU 246 -37.946 -12.798 -20.057 1.00 0.00 C +ATOM 1189 HG LEU 246 -38.782 -13.150 -20.467 1.00 0.00 H +ATOM 1190 CD1 LEU 246 -38.209 -12.441 -18.599 1.00 0.00 C +ATOM 1191 HD11 LEU 246 -37.368 -12.093 -18.184 1.00 0.00 H +ATOM 1192 HD12 LEU 246 -38.920 -11.739 -18.551 1.00 0.00 H +ATOM 1193 HD13 LEU 246 -38.512 -13.256 -18.106 1.00 0.00 H +ATOM 1194 CD2 LEU 246 -37.526 -11.581 -20.857 1.00 0.00 C +ATOM 1195 HD21 LEU 246 -37.387 -11.838 -21.815 1.00 0.00 H +ATOM 1196 HD22 LEU 246 -38.239 -10.879 -20.803 1.00 0.00 H +ATOM 1197 HD23 LEU 246 -36.671 -11.212 -20.487 1.00 0.00 H +ATOM 1198 C LEU 246 -35.376 -15.259 -21.598 1.00 0.00 C +ATOM 1199 O LEU 246 -34.285 -14.711 -21.756 1.00 0.00 O +ATOM 1200 N SER 247 -35.501 -16.575 -21.463 1.00 0.00 N +ATOM 1201 H SER 247 -36.463 -16.918 -21.330 1.00 0.00 H +ATOM 1202 CA SER 247 -34.326 -17.438 -21.507 1.00 0.00 C +ATOM 1203 HA SER 247 -33.723 -17.189 -20.738 1.00 0.00 H +ATOM 1204 CB SER 247 -34.731 -18.912 -21.372 1.00 0.00 C +ATOM 1205 HB2 SER 247 -35.345 -19.144 -22.121 1.00 0.00 H +ATOM 1206 HB3 SER 247 -33.909 -19.473 -21.418 1.00 0.00 H +ATOM 1207 OG SER 247 -35.389 -19.155 -20.141 1.00 0.00 O +ATOM 1208 HG SER 247 -35.365 -18.328 -19.581 1.00 0.00 H +ATOM 1209 C SER 247 -33.530 -17.243 -22.802 1.00 0.00 C +ATOM 1210 O SER 247 -32.311 -17.108 -22.768 1.00 0.00 O +ATOM 1211 N ARG 248 -34.227 -17.231 -23.938 1.00 0.00 N +ATOM 1212 H ARG 248 -35.254 -17.356 -23.817 1.00 0.00 H +ATOM 1213 CA ARG 248 -33.593 -17.055 -25.249 1.00 0.00 C +ATOM 1214 HA ARG 248 -32.956 -17.818 -25.404 1.00 0.00 H +ATOM 1215 CB ARG 248 -34.660 -17.078 -26.367 1.00 0.00 C +ATOM 1216 HB2 ARG 248 -35.156 -17.940 -26.306 1.00 0.00 H +ATOM 1217 HB3 ARG 248 -35.284 -16.315 -26.218 1.00 0.00 H +ATOM 1218 CG ARG 248 -34.111 -16.956 -27.809 1.00 0.00 C +ATOM 1219 HG2 ARG 248 -33.851 -16.014 -27.980 1.00 0.00 H +ATOM 1220 HG3 ARG 248 -33.332 -17.561 -27.913 1.00 0.00 H +ATOM 1221 CD ARG 248 -35.170 -17.358 -28.856 1.00 0.00 C +ATOM 1222 HD2 ARG 248 -35.648 -18.160 -28.508 1.00 0.00 H +ATOM 1223 HD3 ARG 248 -35.805 -16.595 -28.949 1.00 0.00 H +ATOM 1224 NE ARG 248 -34.584 -17.668 -30.165 1.00 0.00 N +ATOM 1225 HE ARG 248 -34.342 -18.638 -30.345 1.00 0.00 H +ATOM 1226 CZ ARG 248 -34.344 -16.789 -31.132 1.00 0.00 C +ATOM 1227 NH1 ARG 248 -34.645 -15.504 -30.966 1.00 0.00 N +ATOM 1228 HH11 ARG 248 -35.035 -15.178 -30.109 1.00 0.00 H +ATOM 1229 HH12 ARG 248 -34.475 -14.854 -31.714 1.00 0.00 H +ATOM 1230 NH2 ARG 248 -33.783 -17.199 -32.267 1.00 0.00 N +ATOM 1231 HH21 ARG 248 -33.528 -18.161 -32.377 1.00 0.00 H +ATOM 1232 HH22 ARG 248 -33.616 -16.549 -33.006 1.00 0.00 H +ATOM 1233 C ARG 248 -32.810 -15.746 -25.304 1.00 0.00 C +ATOM 1234 O ARG 248 -31.688 -15.699 -25.813 1.00 0.00 O +ATOM 1235 N VAL 249 -33.405 -14.683 -24.773 1.00 0.00 N +ATOM 1236 H VAL 249 -34.342 -14.858 -24.373 1.00 0.00 H +ATOM 1237 CA VAL 249 -32.753 -13.381 -24.773 1.00 0.00 C +ATOM 1238 HA VAL 249 -32.458 -13.175 -25.719 1.00 0.00 H +ATOM 1239 CB VAL 249 -33.716 -12.262 -24.314 1.00 0.00 C +ATOM 1240 HB VAL 249 -33.921 -12.417 -23.357 1.00 0.00 H +ATOM 1241 CG1 VAL 249 -33.018 -10.911 -24.410 1.00 0.00 C +ATOM 1242 HG11 VAL 249 -32.036 -11.033 -24.272 1.00 0.00 H +ATOM 1243 HG12 VAL 249 -33.181 -10.515 -25.313 1.00 0.00 H +ATOM 1244 HG13 VAL 249 -33.380 -10.298 -23.708 1.00 0.00 H +ATOM 1245 CG2 VAL 249 -34.972 -12.268 -25.166 1.00 0.00 C +ATOM 1246 HG21 VAL 249 -34.718 -12.223 -26.133 1.00 0.00 H +ATOM 1247 HG22 VAL 249 -35.486 -13.109 -24.994 1.00 0.00 H +ATOM 1248 HG23 VAL 249 -35.537 -11.476 -24.931 1.00 0.00 H +ATOM 1249 C VAL 249 -31.510 -13.350 -23.882 1.00 0.00 C +ATOM 1250 O VAL 249 -30.495 -12.756 -24.245 1.00 0.00 O +ATOM 1251 N MET 250 -31.575 -13.993 -22.717 1.00 0.00 N +ATOM 1252 H MET 250 -32.471 -14.450 -22.509 1.00 0.00 H +ATOM 1253 CA MET 250 -30.413 -14.021 -21.817 1.00 0.00 C +ATOM 1254 HA MET 250 -30.108 -13.073 -21.675 1.00 0.00 H +ATOM 1255 CB MET 250 -30.767 -14.652 -20.462 1.00 0.00 C +ATOM 1256 HB2 MET 250 -31.159 -15.570 -20.623 1.00 0.00 H +ATOM 1257 HB3 MET 250 -29.917 -14.770 -19.927 1.00 0.00 H +ATOM 1258 CG MET 250 -31.756 -13.851 -19.619 1.00 0.00 C +ATOM 1259 HG2 MET 250 -31.425 -12.878 -19.564 1.00 0.00 H +ATOM 1260 HG3 MET 250 -32.651 -13.799 -20.124 1.00 0.00 H +ATOM 1261 SD MET 250 -32.022 -14.522 -17.935 1.00 0.00 S +ATOM 1262 CE MET 250 -33.303 -15.728 -18.230 1.00 0.00 C +ATOM 1263 HE1 MET 250 -33.057 -16.597 -17.796 1.00 0.00 H +ATOM 1264 HE2 MET 250 -34.170 -15.403 -17.847 1.00 0.00 H +ATOM 1265 HE3 MET 250 -33.413 -15.872 -19.216 1.00 0.00 H +ATOM 1266 C MET 250 -29.254 -14.805 -22.431 1.00 0.00 C +ATOM 1267 O MET 250 -28.099 -14.462 -22.220 1.00 0.00 O +ATOM 1268 N ILE 251 -29.562 -15.866 -23.169 1.00 0.00 N +ATOM 1269 H ILE 251 -30.571 -16.073 -23.244 1.00 0.00 H +ATOM 1270 CA ILE 251 -28.520 -16.659 -23.813 1.00 0.00 C +ATOM 1271 HA ILE 251 -27.814 -16.802 -23.131 1.00 0.00 H +ATOM 1272 CB ILE 251 -29.122 -17.962 -24.439 1.00 0.00 C +ATOM 1273 HB ILE 251 -29.942 -17.701 -24.933 1.00 0.00 H +ATOM 1274 CG2 ILE 251 -28.130 -18.591 -25.407 1.00 0.00 C +ATOM 1275 HG21 ILE 251 -28.544 -19.393 -25.834 1.00 0.00 H +ATOM 1276 HG22 ILE 251 -27.886 -17.928 -26.113 1.00 0.00 H +ATOM 1277 HG23 ILE 251 -27.308 -18.865 -24.911 1.00 0.00 H +ATOM 1278 CG1 ILE 251 -29.514 -18.960 -23.343 1.00 0.00 C +ATOM 1279 HG12 ILE 251 -30.052 -18.475 -22.652 1.00 0.00 H +ATOM 1280 HG13 ILE 251 -30.096 -19.664 -23.755 1.00 0.00 H +ATOM 1281 CD1 ILE 251 -28.341 -19.644 -22.658 1.00 0.00 C +ATOM 1282 HD11 ILE 251 -27.763 -18.952 -22.230 1.00 0.00 H +ATOM 1283 HD12 ILE 251 -28.688 -20.272 -21.964 1.00 0.00 H +ATOM 1284 HD13 ILE 251 -27.814 -20.150 -23.338 1.00 0.00 H +ATOM 1285 C ILE 251 -27.899 -15.796 -24.909 1.00 0.00 C +ATOM 1286 O ILE 251 -26.686 -15.713 -25.061 1.00 0.00 O +ATOM 1287 N HIE 252 -28.766 -15.125 -25.655 1.00 0.00 N +ATOM 1288 H HIE 252 -29.766 -15.260 -25.388 1.00 0.00 H +ATOM 1289 CA HIE 252 -28.349 -14.265 -26.763 1.00 0.00 C +ATOM 1290 HA HIE 252 -27.828 -14.831 -27.425 1.00 0.00 H +ATOM 1291 CB HIE 252 -29.595 -13.708 -27.470 1.00 0.00 C +ATOM 1292 HB2 HIE 252 -30.203 -14.475 -27.706 1.00 0.00 H +ATOM 1293 HB3 HIE 252 -30.083 -13.101 -26.832 1.00 0.00 H +ATOM 1294 CG HIE 252 -29.293 -12.942 -28.716 1.00 0.00 C +ATOM 1295 ND1 HIE 252 -28.674 -11.718 -28.707 1.00 0.00 N +ATOM 1296 CE1 HIE 252 -28.569 -11.272 -29.952 1.00 0.00 C +ATOM 1297 HE1 HIE 252 -28.162 -10.408 -30.226 1.00 0.00 H +ATOM 1298 NE2 HIE 252 -29.099 -12.171 -30.756 1.00 0.00 N +ATOM 1299 HE2 HIE 252 -29.160 -12.100 -31.762 1.00 0.00 H +ATOM 1300 CD2 HIE 252 -29.559 -13.231 -30.011 1.00 0.00 C +ATOM 1301 HD2 HIE 252 -30.002 -14.049 -30.359 1.00 0.00 H +ATOM 1302 C HIE 252 -27.455 -13.107 -26.323 1.00 0.00 C +ATOM 1303 O HIE 252 -26.403 -12.851 -26.914 1.00 0.00 O +ATOM 1304 N VAL 253 -27.868 -12.431 -25.260 1.00 0.00 N +ATOM 1305 H VAL 253 -28.738 -12.802 -24.820 1.00 0.00 H +ATOM 1306 CA VAL 253 -27.155 -11.263 -24.755 1.00 0.00 C +ATOM 1307 HA VAL 253 -26.718 -10.791 -25.553 1.00 0.00 H +ATOM 1308 CB VAL 253 -28.172 -10.255 -24.143 1.00 0.00 C +ATOM 1309 HB VAL 253 -28.626 -10.716 -23.390 1.00 0.00 H +ATOM 1310 CG1 VAL 253 -27.444 -9.054 -23.567 1.00 0.00 C +ATOM 1311 HG11 VAL 253 -26.951 -8.579 -24.296 1.00 0.00 H +ATOM 1312 HG12 VAL 253 -28.105 -8.428 -23.152 1.00 0.00 H +ATOM 1313 HG13 VAL 253 -26.793 -9.358 -22.870 1.00 0.00 H +ATOM 1314 CG2 VAL 253 -29.170 -9.822 -25.214 1.00 0.00 C +ATOM 1315 HG21 VAL 253 -29.979 -10.407 -25.164 1.00 0.00 H +ATOM 1316 HG22 VAL 253 -29.430 -8.871 -25.054 1.00 0.00 H +ATOM 1317 HG23 VAL 253 -28.744 -9.910 -26.113 1.00 0.00 H +ATOM 1318 C VAL 253 -26.048 -11.549 -23.730 1.00 0.00 C +ATOM 1319 O VAL 253 -24.956 -10.985 -23.811 1.00 0.00 O +ATOM 1320 N PHE 254 -26.328 -12.408 -22.759 1.00 0.00 N +ATOM 1321 H PHE 254 -27.266 -12.822 -22.785 1.00 0.00 H +ATOM 1322 CA PHE 254 -25.325 -12.707 -21.744 1.00 0.00 C +ATOM 1323 HA PHE 254 -24.774 -11.854 -21.612 1.00 0.00 H +ATOM 1324 CB PHE 254 -25.989 -13.057 -20.407 1.00 0.00 C +ATOM 1325 HB2 PHE 254 -26.372 -12.229 -20.033 1.00 0.00 H +ATOM 1326 HB3 PHE 254 -26.683 -13.735 -20.582 1.00 0.00 H +ATOM 1327 CG PHE 254 -25.029 -13.626 -19.389 1.00 0.00 C +ATOM 1328 CD1 PHE 254 -24.147 -12.797 -18.690 1.00 0.00 C +ATOM 1329 HD1 PHE 254 -24.181 -11.814 -18.825 1.00 0.00 H +ATOM 1330 CE1 PHE 254 -23.221 -13.337 -17.803 1.00 0.00 C +ATOM 1331 HE1 PHE 254 -22.601 -12.726 -17.299 1.00 0.00 H +ATOM 1332 CZ PHE 254 -23.155 -14.716 -17.618 1.00 0.00 C +ATOM 1333 HZ PHE 254 -22.481 -15.100 -16.991 1.00 0.00 H +ATOM 1334 CE2 PHE 254 -24.029 -15.548 -18.308 1.00 0.00 C +ATOM 1335 HE2 PHE 254 -23.994 -16.551 -18.171 1.00 0.00 H +ATOM 1336 CD2 PHE 254 -24.952 -15.006 -19.189 1.00 0.00 C +ATOM 1337 HD2 PHE 254 -25.574 -15.609 -19.690 1.00 0.00 H +ATOM 1338 C PHE 254 -24.328 -13.814 -22.100 1.00 0.00 C +ATOM 1339 O PHE 254 -23.119 -13.620 -22.006 1.00 0.00 O +ATOM 1340 N SER 255 -24.824 -14.984 -22.489 1.00 0.00 N +ATOM 1341 H SER 255 -25.846 -15.043 -22.539 1.00 0.00 H +ATOM 1342 CA SER 255 -23.919 -16.088 -22.814 1.00 0.00 C +ATOM 1343 HA SER 255 -23.308 -16.236 -22.009 1.00 0.00 H +ATOM 1344 CB SER 255 -24.706 -17.379 -23.015 1.00 0.00 C +ATOM 1345 HB2 SER 255 -25.312 -17.270 -23.792 1.00 0.00 H +ATOM 1346 HB3 SER 255 -24.070 -18.125 -23.165 1.00 0.00 H +ATOM 1347 OG SER 255 -25.481 -17.658 -21.860 1.00 0.00 O +ATOM 1348 HG SER 255 -26.173 -16.947 -21.744 1.00 0.00 H +ATOM 1349 C SER 255 -23.028 -15.853 -24.033 1.00 0.00 C +ATOM 1350 O SER 255 -21.872 -16.284 -24.046 1.00 0.00 O +ATOM 1351 N ASP 256 -23.562 -15.187 -25.054 1.00 0.00 N +ATOM 1352 H ASP 256 -24.538 -14.876 -24.914 1.00 0.00 H +ATOM 1353 CA ASP 256 -22.796 -14.929 -26.274 1.00 0.00 C +ATOM 1354 HA ASP 256 -22.166 -15.700 -26.396 1.00 0.00 H +ATOM 1355 CB ASP 256 -23.747 -14.753 -27.466 1.00 0.00 C +ATOM 1356 HB2 ASP 256 -24.491 -15.403 -27.360 1.00 0.00 H +ATOM 1357 HB3 ASP 256 -24.092 -13.822 -27.446 1.00 0.00 H +ATOM 1358 CG ASP 256 -23.067 -14.997 -28.796 1.00 0.00 C +ATOM 1359 OD1 ASP 256 -21.899 -15.441 -28.789 1.00 0.00 O +ATOM 1360 OD2 ASP 256 -23.705 -14.759 -29.840 1.00 0.00 O +ATOM 1361 C ASP 256 -21.950 -13.679 -26.100 1.00 0.00 C +ATOM 1362 O ASP 256 -22.237 -12.639 -26.691 1.00 0.00 O +ATOM 1363 N GLY 257 -20.903 -13.787 -25.291 1.00 0.00 N +ATOM 1364 H GLY 257 -20.767 -14.718 -24.867 1.00 0.00 H +ATOM 1365 CA GLY 257 -20.035 -12.647 -25.048 1.00 0.00 C +ATOM 1366 HA2 GLY 257 -19.568 -12.390 -25.896 1.00 0.00 H +ATOM 1367 HA3 GLY 257 -20.579 -11.870 -24.726 1.00 0.00 H +ATOM 1368 C GLY 257 -18.999 -13.009 -23.992 1.00 0.00 C +ATOM 1369 O GLY 257 -19.096 -14.059 -23.348 1.00 0.00 O +ATOM 1370 N VAL 258 -18.008 -12.147 -23.794 1.00 0.00 N +ATOM 1371 H VAL 258 -18.029 -11.305 -24.384 1.00 0.00 H +ATOM 1372 CA VAL 258 -16.993 -12.427 -22.800 1.00 0.00 C +ATOM 1373 HA VAL 258 -16.642 -13.351 -22.958 1.00 0.00 H +ATOM 1374 CB VAL 258 -15.803 -11.420 -22.883 1.00 0.00 C +ATOM 1375 HB VAL 258 -16.082 -10.596 -22.417 1.00 0.00 H +ATOM 1376 CG1 VAL 258 -14.611 -11.992 -22.117 1.00 0.00 C +ATOM 1377 HG11 VAL 258 -14.588 -12.984 -22.234 1.00 0.00 H +ATOM 1378 HG12 VAL 258 -13.767 -11.593 -22.472 1.00 0.00 H +ATOM 1379 HG13 VAL 258 -14.704 -11.771 -21.147 1.00 0.00 H +ATOM 1380 CG2 VAL 258 -15.418 -11.159 -24.334 1.00 0.00 C +ATOM 1381 HG21 VAL 258 -14.941 -11.959 -24.697 1.00 0.00 H +ATOM 1382 HG22 VAL 258 -16.245 -10.989 -24.869 1.00 0.00 H +ATOM 1383 HG23 VAL 258 -14.819 -10.360 -24.377 1.00 0.00 H +ATOM 1384 C VAL 258 -17.632 -12.393 -21.429 1.00 0.00 C +ATOM 1385 O VAL 258 -18.617 -11.691 -21.193 1.00 0.00 O +ATOM 1386 N THR 259 -17.055 -13.166 -20.524 1.00 0.00 N +ATOM 1387 H THR 259 -16.219 -13.685 -20.861 1.00 0.00 H +ATOM 1388 CA THR 259 -17.570 -13.262 -19.175 1.00 0.00 C +ATOM 1389 HA THR 259 -18.481 -12.817 -19.143 1.00 0.00 H +ATOM 1390 CB THR 259 -17.698 -14.742 -18.757 1.00 0.00 C +ATOM 1391 HB THR 259 -16.764 -15.138 -18.663 1.00 0.00 H +ATOM 1392 CG2 THR 259 -18.450 -14.851 -17.455 1.00 0.00 C +ATOM 1393 HG21 THR 259 -19.421 -14.635 -17.596 1.00 0.00 H +ATOM 1394 HG22 THR 259 -18.377 -15.784 -17.089 1.00 0.00 H +ATOM 1395 HG23 THR 259 -18.072 -14.209 -16.781 1.00 0.00 H +ATOM 1396 OG1 THR 259 -18.391 -15.469 -19.785 1.00 0.00 O +ATOM 1397 HG1 THR 259 -18.425 -14.928 -20.631 1.00 0.00 H +ATOM 1398 C THR 259 -16.670 -12.569 -18.162 1.00 0.00 C +ATOM 1399 O THR 259 -15.458 -12.745 -18.180 1.00 0.00 O +ATOM 1400 N ASN 260 -17.278 -11.789 -17.279 1.00 0.00 N +ATOM 1401 H ASN 260 -18.307 -11.683 -17.432 1.00 0.00 H +ATOM 1402 CA ASN 260 -16.568 -11.135 -16.186 1.00 0.00 C +ATOM 1403 HA ASN 260 -15.902 -11.776 -15.842 1.00 0.00 H +ATOM 1404 CB ASN 260 -15.905 -9.805 -16.602 1.00 0.00 C +ATOM 1405 HB2 ASN 260 -15.574 -9.352 -15.775 1.00 0.00 H +ATOM 1406 HB3 ASN 260 -15.133 -10.018 -17.200 1.00 0.00 H +ATOM 1407 CG ASN 260 -16.841 -8.858 -17.334 1.00 0.00 C +ATOM 1408 OD1 ASN 260 -17.905 -8.490 -16.837 1.00 0.00 O +ATOM 1409 ND2 ASN 260 -16.428 -8.445 -18.529 1.00 0.00 N +ATOM 1410 HD21 ASN 260 -16.996 -7.815 -19.063 1.00 0.00 H +ATOM 1411 HD22 ASN 260 -15.555 -8.760 -18.898 1.00 0.00 H +ATOM 1412 C ASN 260 -17.607 -10.938 -15.098 1.00 0.00 C +ATOM 1413 O ASN 260 -18.800 -11.075 -15.362 1.00 0.00 O +ATOM 1414 N TRP 261 -17.170 -10.647 -13.877 1.00 0.00 N +ATOM 1415 H TRP 261 -16.152 -10.550 -13.781 1.00 0.00 H +ATOM 1416 CA TRP 261 -18.117 -10.488 -12.788 1.00 0.00 C +ATOM 1417 HA TRP 261 -18.642 -11.351 -12.705 1.00 0.00 H +ATOM 1418 CB TRP 261 -17.375 -10.282 -11.458 1.00 0.00 C +ATOM 1419 HB2 TRP 261 -16.612 -9.673 -11.604 1.00 0.00 H +ATOM 1420 HB3 TRP 261 -18.005 -9.923 -10.788 1.00 0.00 H +ATOM 1421 CG TRP 261 -16.810 -11.573 -10.890 1.00 0.00 C +ATOM 1422 CD1 TRP 261 -15.501 -11.850 -10.618 1.00 0.00 C +ATOM 1423 HD1 TRP 261 -14.739 -11.221 -10.750 1.00 0.00 H +ATOM 1424 NE1 TRP 261 -15.379 -13.137 -10.129 1.00 0.00 N +ATOM 1425 HE1 TRP 261 -14.522 -13.574 -9.861 1.00 0.00 H +ATOM 1426 CE2 TRP 261 -16.620 -13.712 -10.073 1.00 0.00 C +ATOM 1427 CZ2 TRP 261 -17.006 -14.995 -9.651 1.00 0.00 C +ATOM 1428 HZ2 TRP 261 -16.315 -15.646 -9.327 1.00 0.00 H +ATOM 1429 CH2 TRP 261 -18.340 -15.306 -9.703 1.00 0.00 C +ATOM 1430 HH2 TRP 261 -18.655 -16.207 -9.405 1.00 0.00 H +ATOM 1431 CZ3 TRP 261 -19.289 -14.382 -10.169 1.00 0.00 C +ATOM 1432 HZ3 TRP 261 -20.249 -14.631 -10.204 1.00 0.00 H +ATOM 1433 CE3 TRP 261 -18.906 -13.105 -10.590 1.00 0.00 C +ATOM 1434 HE3 TRP 261 -19.592 -12.461 -10.911 1.00 0.00 H +ATOM 1435 CD2 TRP 261 -17.549 -12.761 -10.547 1.00 0.00 C +ATOM 1436 C TRP 261 -19.123 -9.367 -13.037 1.00 0.00 C +ATOM 1437 O TRP 261 -20.273 -9.459 -12.611 1.00 0.00 O +ATOM 1438 N GLY 262 -18.696 -8.325 -13.748 1.00 0.00 N +ATOM 1439 H GLY 262 -17.715 -8.379 -14.061 1.00 0.00 H +ATOM 1440 CA GLY 262 -19.586 -7.214 -14.037 1.00 0.00 C +ATOM 1441 HA2 GLY 262 -19.918 -6.812 -13.169 1.00 0.00 H +ATOM 1442 HA3 GLY 262 -19.075 -6.492 -14.529 1.00 0.00 H +ATOM 1443 C GLY 262 -20.780 -7.641 -14.877 1.00 0.00 C +ATOM 1444 O GLY 262 -21.913 -7.225 -14.620 1.00 0.00 O +ATOM 1445 N ARG 263 -20.539 -8.488 -15.875 1.00 0.00 N +ATOM 1446 H ARG 263 -19.560 -8.777 -15.986 1.00 0.00 H +ATOM 1447 CA ARG 263 -21.633 -8.947 -16.729 1.00 0.00 C +ATOM 1448 HA ARG 263 -22.156 -8.144 -17.044 1.00 0.00 H +ATOM 1449 CB ARG 263 -21.092 -9.657 -17.976 1.00 0.00 C +ATOM 1450 HB2 ARG 263 -20.407 -10.313 -17.688 1.00 0.00 H +ATOM 1451 HB3 ARG 263 -21.848 -10.112 -18.428 1.00 0.00 H +ATOM 1452 CG ARG 263 -20.444 -8.706 -18.979 1.00 0.00 C +ATOM 1453 HG2 ARG 263 -21.127 -8.065 -19.323 1.00 0.00 H +ATOM 1454 HG3 ARG 263 -19.704 -8.205 -18.535 1.00 0.00 H +ATOM 1455 CD ARG 263 -19.846 -9.447 -20.189 1.00 0.00 C +ATOM 1456 HD2 ARG 263 -19.412 -8.769 -20.774 1.00 0.00 H +ATOM 1457 HD3 ARG 263 -19.170 -10.090 -19.844 1.00 0.00 H +ATOM 1458 NE ARG 263 -20.865 -10.172 -20.953 1.00 0.00 N +ATOM 1459 HE ARG 263 -20.922 -11.166 -20.833 1.00 0.00 H +ATOM 1460 CZ ARG 263 -21.712 -9.588 -21.790 1.00 0.00 C +ATOM 1461 NH1 ARG 263 -21.642 -8.290 -21.971 1.00 0.00 N +ATOM 1462 HH11 ARG 263 -20.961 -7.721 -21.518 1.00 0.00 H +ATOM 1463 HH12 ARG 263 -22.304 -7.837 -22.598 1.00 0.00 H +ATOM 1464 NH2 ARG 263 -22.642 -10.290 -22.413 1.00 0.00 N +ATOM 1465 HH21 ARG 263 -22.690 -11.284 -22.261 1.00 0.00 H +ATOM 1466 HH22 ARG 263 -23.288 -9.848 -23.027 1.00 0.00 H +ATOM 1467 C ARG 263 -22.575 -9.876 -15.974 1.00 0.00 C +ATOM 1468 O ARG 263 -23.756 -9.949 -16.291 1.00 0.00 O +ATOM 1469 N ILE 264 -22.050 -10.595 -14.985 1.00 0.00 N +ATOM 1470 H ILE 264 -21.039 -10.459 -14.830 1.00 0.00 H +ATOM 1471 CA ILE 264 -22.880 -11.500 -14.199 1.00 0.00 C +ATOM 1472 HA ILE 264 -23.483 -11.964 -14.843 1.00 0.00 H +ATOM 1473 CB ILE 264 -21.985 -12.465 -13.384 1.00 0.00 C +ATOM 1474 HB ILE 264 -21.293 -11.928 -12.933 1.00 0.00 H +ATOM 1475 CG2 ILE 264 -22.805 -13.230 -12.339 1.00 0.00 C +ATOM 1476 HG21 ILE 264 -22.199 -13.828 -11.821 1.00 0.00 H +ATOM 1477 HG22 ILE 264 -23.242 -12.579 -11.724 1.00 0.00 H +ATOM 1478 HG23 ILE 264 -23.500 -13.774 -12.802 1.00 0.00 H +ATOM 1479 CG1 ILE 264 -21.291 -13.423 -14.357 1.00 0.00 C +ATOM 1480 HG12 ILE 264 -21.995 -13.994 -14.788 1.00 0.00 H +ATOM 1481 HG13 ILE 264 -20.858 -12.872 -15.076 1.00 0.00 H +ATOM 1482 CD1 ILE 264 -20.253 -14.307 -13.729 1.00 0.00 C +ATOM 1483 HD11 ILE 264 -20.676 -14.873 -13.020 1.00 0.00 H +ATOM 1484 HD12 ILE 264 -19.848 -14.900 -14.427 1.00 0.00 H +ATOM 1485 HD13 ILE 264 -19.535 -13.744 -13.317 1.00 0.00 H +ATOM 1486 C ILE 264 -23.782 -10.670 -13.282 1.00 0.00 C +ATOM 1487 O ILE 264 -24.956 -10.986 -13.084 1.00 0.00 O +ATOM 1488 N VAL 265 -23.231 -9.590 -12.741 1.00 0.00 N +ATOM 1489 H VAL 265 -22.236 -9.436 -12.982 1.00 0.00 H +ATOM 1490 CA VAL 265 -23.999 -8.703 -11.874 1.00 0.00 C +ATOM 1491 HA VAL 265 -24.442 -9.254 -11.169 1.00 0.00 H +ATOM 1492 CB VAL 265 -23.098 -7.632 -11.234 1.00 0.00 C +ATOM 1493 HB VAL 265 -22.575 -7.203 -11.962 1.00 0.00 H +ATOM 1494 CG1 VAL 265 -23.949 -6.547 -10.596 1.00 0.00 C +ATOM 1495 HG11 VAL 265 -23.364 -5.926 -10.073 1.00 0.00 H +ATOM 1496 HG12 VAL 265 -24.425 -6.032 -11.309 1.00 0.00 H +ATOM 1497 HG13 VAL 265 -24.621 -6.965 -9.984 1.00 0.00 H +ATOM 1498 CG2 VAL 265 -22.187 -8.274 -10.192 1.00 0.00 C +ATOM 1499 HG21 VAL 265 -22.288 -9.267 -10.235 1.00 0.00 H +ATOM 1500 HG22 VAL 265 -21.239 -8.022 -10.385 1.00 0.00 H +ATOM 1501 HG23 VAL 265 -22.446 -7.947 -9.284 1.00 0.00 H +ATOM 1502 C VAL 265 -25.106 -8.024 -12.699 1.00 0.00 C +ATOM 1503 O VAL 265 -26.230 -7.866 -12.228 1.00 0.00 O +ATOM 1504 N THR 266 -24.797 -7.645 -13.937 1.00 0.00 N +ATOM 1505 H THR 266 -23.827 -7.828 -14.227 1.00 0.00 H +ATOM 1506 CA THR 266 -25.802 -7.015 -14.791 1.00 0.00 C +ATOM 1507 HA THR 266 -26.195 -6.237 -14.302 1.00 0.00 H +ATOM 1508 CB THR 266 -25.192 -6.544 -16.125 1.00 0.00 C +ATOM 1509 HB THR 266 -24.752 -7.338 -16.584 1.00 0.00 H +ATOM 1510 CG2 THR 266 -26.275 -5.935 -17.034 1.00 0.00 C +ATOM 1511 HG21 THR 266 -27.172 -6.277 -16.755 1.00 0.00 H +ATOM 1512 HG22 THR 266 -26.255 -4.939 -16.951 1.00 0.00 H +ATOM 1513 HG23 THR 266 -26.097 -6.196 -17.982 1.00 0.00 H +ATOM 1514 OG1 THR 266 -24.177 -5.563 -15.857 1.00 0.00 O +ATOM 1515 HG1 THR 266 -23.376 -5.998 -15.434 1.00 0.00 H +ATOM 1516 C THR 266 -26.919 -8.016 -15.079 1.00 0.00 C +ATOM 1517 O THR 266 -28.102 -7.673 -15.065 1.00 0.00 O +ATOM 1518 N LEU 267 -26.537 -9.259 -15.345 1.00 0.00 N +ATOM 1519 H LEU 267 -25.512 -9.412 -15.348 1.00 0.00 H +ATOM 1520 CA LEU 267 -27.511 -10.311 -15.610 1.00 0.00 C +ATOM 1521 HA LEU 267 -28.040 -10.063 -16.429 1.00 0.00 H +ATOM 1522 CB LEU 267 -26.791 -11.643 -15.839 1.00 0.00 C +ATOM 1523 HB2 LEU 267 -26.350 -11.603 -16.734 1.00 0.00 H +ATOM 1524 HB3 LEU 267 -26.101 -11.745 -15.126 1.00 0.00 H +ATOM 1525 CG LEU 267 -27.658 -12.908 -15.817 1.00 0.00 C +ATOM 1526 HG LEU 267 -28.287 -12.856 -15.047 1.00 0.00 H +ATOM 1527 CD1 LEU 267 -28.450 -13.011 -17.114 1.00 0.00 C +ATOM 1528 HD11 LEU 267 -27.818 -13.056 -17.888 1.00 0.00 H +ATOM 1529 HD12 LEU 267 -29.014 -13.837 -17.096 1.00 0.00 H +ATOM 1530 HD13 LEU 267 -29.038 -12.208 -17.210 1.00 0.00 H +ATOM 1531 CD2 LEU 267 -26.769 -14.138 -15.637 1.00 0.00 C +ATOM 1532 HD21 LEU 267 -26.269 -14.062 -14.775 1.00 0.00 H +ATOM 1533 HD22 LEU 267 -27.339 -14.959 -15.623 1.00 0.00 H +ATOM 1534 HD23 LEU 267 -26.121 -14.192 -16.396 1.00 0.00 H +ATOM 1535 C LEU 267 -28.486 -10.466 -14.440 1.00 0.00 C +ATOM 1536 O LEU 267 -29.704 -10.525 -14.630 1.00 0.00 O +ATOM 1537 N ILE 268 -27.937 -10.531 -13.232 1.00 0.00 N +ATOM 1538 H ILE 268 -26.899 -10.447 -13.221 1.00 0.00 H +ATOM 1539 CA ILE 268 -28.737 -10.707 -12.023 1.00 0.00 C +ATOM 1540 HA ILE 268 -29.429 -11.406 -12.241 1.00 0.00 H +ATOM 1541 CB ILE 268 -27.836 -11.130 -10.830 1.00 0.00 C +ATOM 1542 HB ILE 268 -27.096 -10.477 -10.765 1.00 0.00 H +ATOM 1543 CG2 ILE 268 -28.635 -11.125 -9.524 1.00 0.00 C +ATOM 1544 HG21 ILE 268 -28.031 -11.365 -8.768 1.00 0.00 H +ATOM 1545 HG22 ILE 268 -29.015 -10.215 -9.374 1.00 0.00 H +ATOM 1546 HG23 ILE 268 -29.374 -11.791 -9.588 1.00 0.00 H +ATOM 1547 CG1 ILE 268 -27.232 -12.514 -11.101 1.00 0.00 C +ATOM 1548 HG12 ILE 268 -27.963 -13.193 -11.050 1.00 0.00 H +ATOM 1549 HG13 ILE 268 -26.860 -12.516 -12.029 1.00 0.00 H +ATOM 1550 CD1 ILE 268 -26.127 -12.908 -10.135 1.00 0.00 C +ATOM 1551 HD11 ILE 268 -26.492 -12.921 -9.206 1.00 0.00 H +ATOM 1552 HD12 ILE 268 -25.788 -13.815 -10.377 1.00 0.00 H +ATOM 1553 HD13 ILE 268 -25.385 -12.243 -10.197 1.00 0.00 H +ATOM 1554 C ILE 268 -29.503 -9.437 -11.658 1.00 0.00 C +ATOM 1555 O ILE 268 -30.666 -9.494 -11.258 1.00 0.00 O +ATOM 1556 N SER 269 -28.850 -8.293 -11.829 1.00 0.00 N +ATOM 1557 H SER 269 -27.887 -8.395 -12.209 1.00 0.00 H +ATOM 1558 CA SER 269 -29.452 -7.007 -11.504 1.00 0.00 C +ATOM 1559 HA SER 269 -29.763 -7.043 -10.539 1.00 0.00 H +ATOM 1560 CB SER 269 -28.413 -5.898 -11.641 1.00 0.00 C +ATOM 1561 HB2 SER 269 -28.046 -5.913 -12.562 1.00 0.00 H +ATOM 1562 HB3 SER 269 -28.846 -5.026 -11.449 1.00 0.00 H +ATOM 1563 OG SER 269 -27.359 -6.104 -10.719 1.00 0.00 O +ATOM 1564 HG SER 269 -26.715 -6.772 -11.091 1.00 0.00 H +ATOM 1565 C SER 269 -30.657 -6.687 -12.371 1.00 0.00 C +ATOM 1566 O SER 269 -31.663 -6.161 -11.887 1.00 0.00 O +ATOM 1567 N PHE 270 -30.554 -6.970 -13.660 1.00 0.00 N +ATOM 1568 H PHE 270 -29.662 -7.363 -13.966 1.00 0.00 H +ATOM 1569 CA PHE 270 -31.685 -6.709 -14.524 1.00 0.00 C +ATOM 1570 HA PHE 270 -32.057 -5.822 -14.269 1.00 0.00 H +ATOM 1571 CB PHE 270 -31.292 -6.802 -16.000 1.00 0.00 C +ATOM 1572 HB2 PHE 270 -30.548 -6.174 -16.155 1.00 0.00 H +ATOM 1573 HB3 PHE 270 -31.029 -7.734 -16.185 1.00 0.00 H +ATOM 1574 CG PHE 270 -32.412 -6.439 -16.935 1.00 0.00 C +ATOM 1575 CD1 PHE 270 -32.845 -5.119 -17.043 1.00 0.00 C +ATOM 1576 HD1 PHE 270 -32.389 -4.402 -16.529 1.00 0.00 H +ATOM 1577 CE1 PHE 270 -33.919 -4.787 -17.873 1.00 0.00 C +ATOM 1578 HE1 PHE 270 -34.218 -3.831 -17.935 1.00 0.00 H +ATOM 1579 CZ PHE 270 -34.560 -5.781 -18.600 1.00 0.00 C +ATOM 1580 HZ PHE 270 -35.328 -5.548 -19.194 1.00 0.00 H +ATOM 1581 CE2 PHE 270 -34.130 -7.102 -18.499 1.00 0.00 C +ATOM 1582 HE2 PHE 270 -34.593 -7.831 -19.025 1.00 0.00 H +ATOM 1583 CD2 PHE 270 -33.062 -7.419 -17.670 1.00 0.00 C +ATOM 1584 HD2 PHE 270 -32.756 -8.372 -17.603 1.00 0.00 H +ATOM 1585 C PHE 270 -32.759 -7.742 -14.201 1.00 0.00 C +ATOM 1586 O PHE 270 -33.948 -7.482 -14.363 1.00 0.00 O +ATOM 1587 N GLY 271 -32.330 -8.919 -13.752 1.00 0.00 N +ATOM 1588 H GLY 271 -31.308 -9.025 -13.696 1.00 0.00 H +ATOM 1589 CA GLY 271 -33.283 -9.951 -13.379 1.00 0.00 C +ATOM 1590 HA2 GLY 271 -33.873 -10.163 -14.156 1.00 0.00 H +ATOM 1591 HA3 GLY 271 -32.796 -10.774 -13.093 1.00 0.00 H +ATOM 1592 C GLY 271 -34.130 -9.437 -12.226 1.00 0.00 C +ATOM 1593 O GLY 271 -35.335 -9.677 -12.173 1.00 0.00 O +ATOM 1594 N ALA 272 -33.489 -8.730 -11.298 1.00 0.00 N +ATOM 1595 H ALA 272 -32.467 -8.624 -11.461 1.00 0.00 H +ATOM 1596 CA ALA 272 -34.182 -8.156 -10.149 1.00 0.00 C +ATOM 1597 HA ALA 272 -34.733 -8.872 -9.712 1.00 0.00 H +ATOM 1598 CB ALA 272 -33.182 -7.617 -9.146 1.00 0.00 C +ATOM 1599 HB1 ALA 272 -32.392 -8.229 -9.095 1.00 0.00 H +ATOM 1600 HB2 ALA 272 -32.876 -6.707 -9.430 1.00 0.00 H +ATOM 1601 HB3 ALA 272 -33.610 -7.555 -8.243 1.00 0.00 H +ATOM 1602 C ALA 272 -35.109 -7.037 -10.606 1.00 0.00 C +ATOM 1603 O ALA 272 -36.184 -6.845 -10.039 1.00 0.00 O +ATOM 1604 N PHE 273 -34.682 -6.304 -11.634 1.00 0.00 N +ATOM 1605 H PHE 273 -33.748 -6.581 -12.004 1.00 0.00 H +ATOM 1606 CA PHE 273 -35.467 -5.203 -12.191 1.00 0.00 C +ATOM 1607 HA PHE 273 -35.743 -4.625 -11.428 1.00 0.00 H +ATOM 1608 CB PHE 273 -34.648 -4.478 -13.270 1.00 0.00 C +ATOM 1609 HB2 PHE 273 -33.740 -4.323 -12.905 1.00 0.00 H +ATOM 1610 HB3 PHE 273 -34.614 -5.066 -14.067 1.00 0.00 H +ATOM 1611 CG PHE 273 -35.212 -3.149 -13.695 1.00 0.00 C +ATOM 1612 CD1 PHE 273 -35.122 -2.036 -12.863 1.00 0.00 C +ATOM 1613 HD1 PHE 273 -34.711 -2.117 -11.963 1.00 0.00 H +ATOM 1614 CE1 PHE 273 -35.607 -0.788 -13.281 1.00 0.00 C +ATOM 1615 HE1 PHE 273 -35.534 -0.000 -12.666 1.00 0.00 H +ATOM 1616 CZ PHE 273 -36.184 -0.659 -14.540 1.00 0.00 C +ATOM 1617 HZ PHE 273 -36.527 0.227 -14.843 1.00 0.00 H +ATOM 1618 CE2 PHE 273 -36.279 -1.772 -15.373 1.00 0.00 C +ATOM 1619 HE2 PHE 273 -36.701 -1.687 -16.289 1.00 0.00 H +ATOM 1620 CD2 PHE 273 -35.796 -3.002 -14.947 1.00 0.00 C +ATOM 1621 HD2 PHE 273 -35.869 -3.797 -15.553 1.00 0.00 H +ATOM 1622 C PHE 273 -36.748 -5.778 -12.794 1.00 0.00 C +ATOM 1623 O PHE 273 -37.816 -5.187 -12.683 1.00 0.00 O +ATOM 1624 N VAL 274 -36.633 -6.931 -13.447 1.00 0.00 N +ATOM 1625 H VAL 274 -35.676 -7.316 -13.494 1.00 0.00 H +ATOM 1626 CA VAL 274 -37.798 -7.571 -14.039 1.00 0.00 C +ATOM 1627 HA VAL 274 -38.326 -6.879 -14.527 1.00 0.00 H +ATOM 1628 CB VAL 274 -37.387 -8.720 -14.996 1.00 0.00 C +ATOM 1629 HB VAL 274 -36.832 -9.358 -14.475 1.00 0.00 H +ATOM 1630 CG1 VAL 274 -38.619 -9.480 -15.471 1.00 0.00 C +ATOM 1631 HG11 VAL 274 -38.340 -10.211 -16.093 1.00 0.00 H +ATOM 1632 HG12 VAL 274 -39.091 -9.875 -14.683 1.00 0.00 H +ATOM 1633 HG13 VAL 274 -39.234 -8.853 -15.948 1.00 0.00 H +ATOM 1634 CG2 VAL 274 -36.637 -8.154 -16.194 1.00 0.00 C +ATOM 1635 HG21 VAL 274 -36.840 -7.179 -16.279 1.00 0.00 H +ATOM 1636 HG22 VAL 274 -35.655 -8.283 -16.059 1.00 0.00 H +ATOM 1637 HG23 VAL 274 -36.929 -8.632 -17.022 1.00 0.00 H +ATOM 1638 C VAL 274 -38.679 -8.128 -12.918 1.00 0.00 C +ATOM 1639 O VAL 274 -39.900 -8.053 -12.989 1.00 0.00 O +ATOM 1640 N ALA 275 -38.051 -8.685 -11.885 1.00 0.00 N +ATOM 1641 H ALA 275 -37.017 -8.693 -11.956 1.00 0.00 H +ATOM 1642 CA ALA 275 -38.788 -9.234 -10.754 1.00 0.00 C +ATOM 1643 HA ALA 275 -39.379 -9.977 -11.078 1.00 0.00 H +ATOM 1644 CB ALA 275 -37.819 -9.798 -9.703 1.00 0.00 C +ATOM 1645 HB1 ALA 275 -38.106 -9.494 -8.798 1.00 0.00 H +ATOM 1646 HB2 ALA 275 -37.834 -10.794 -9.746 1.00 0.00 H +ATOM 1647 HB3 ALA 275 -36.899 -9.465 -9.895 1.00 0.00 H +ATOM 1648 C ALA 275 -39.671 -8.149 -10.132 1.00 0.00 C +ATOM 1649 O ALA 275 -40.813 -8.413 -9.743 1.00 0.00 O +ATOM 1650 N LYS 276 -39.140 -6.933 -10.027 1.00 0.00 N +ATOM 1651 H LYS 276 -38.168 -6.846 -10.365 1.00 0.00 H +ATOM 1652 CA LYS 276 -39.909 -5.821 -9.467 1.00 0.00 C +ATOM 1653 HA LYS 276 -40.239 -6.082 -8.559 1.00 0.00 H +ATOM 1654 CB LYS 276 -39.056 -4.558 -9.365 1.00 0.00 C +ATOM 1655 HB2 LYS 276 -38.563 -4.446 -10.230 1.00 0.00 H +ATOM 1656 HB3 LYS 276 -39.672 -3.778 -9.236 1.00 0.00 H +ATOM 1657 CG LYS 276 -38.051 -4.567 -8.238 1.00 0.00 C +ATOM 1658 HG2 LYS 276 -38.533 -4.481 -7.367 1.00 0.00 H +ATOM 1659 HG3 LYS 276 -37.542 -5.425 -8.258 1.00 0.00 H +ATOM 1660 CD LYS 276 -37.085 -3.417 -8.382 1.00 0.00 C +ATOM 1661 HD2 LYS 276 -36.546 -3.546 -9.210 1.00 0.00 H +ATOM 1662 HD3 LYS 276 -37.597 -2.565 -8.435 1.00 0.00 H +ATOM 1663 CE LYS 276 -36.143 -3.341 -7.200 1.00 0.00 C +ATOM 1664 HE2 LYS 276 -36.662 -3.100 -6.384 1.00 0.00 H +ATOM 1665 HE3 LYS 276 -35.705 -4.228 -7.074 1.00 0.00 H +ATOM 1666 NZ LYS 276 -35.107 -2.311 -7.446 1.00 0.00 N +ATOM 1667 HZ1 LYS 276 -35.246 -1.905 -8.350 1.00 0.00 H +ATOM 1668 HZ2 LYS 276 -35.172 -1.597 -6.748 1.00 0.00 H +ATOM 1669 HZ3 LYS 276 -34.200 -2.732 -7.407 1.00 0.00 H +ATOM 1670 C LYS 276 -41.100 -5.536 -10.363 1.00 0.00 C +ATOM 1671 O LYS 276 -42.215 -5.319 -9.885 1.00 0.00 O +ATOM 1672 N HIE 277 -40.853 -5.525 -11.670 1.00 0.00 N +ATOM 1673 H HIE 277 -39.863 -5.706 -11.927 1.00 0.00 H +ATOM 1674 CA HIE 277 -41.905 -5.277 -12.645 1.00 0.00 C +ATOM 1675 HA HIE 277 -42.322 -4.384 -12.449 1.00 0.00 H +ATOM 1676 CB HIE 277 -41.314 -5.289 -14.054 1.00 0.00 C +ATOM 1677 HB2 HIE 277 -40.784 -4.446 -14.194 1.00 0.00 H +ATOM 1678 HB3 HIE 277 -40.693 -6.075 -14.141 1.00 0.00 H +ATOM 1679 CG HIE 277 -42.344 -5.382 -15.135 1.00 0.00 C +ATOM 1680 ND1 HIE 277 -43.132 -4.316 -15.507 1.00 0.00 N +ATOM 1681 CE1 HIE 277 -43.967 -4.701 -16.457 1.00 0.00 C +ATOM 1682 HE1 HIE 277 -44.647 -4.126 -16.903 1.00 0.00 H +ATOM 1683 NE2 HIE 277 -43.748 -5.977 -16.712 1.00 0.00 N +ATOM 1684 HE2 HIE 277 -44.239 -6.529 -17.389 1.00 0.00 H +ATOM 1685 CD2 HIE 277 -42.735 -6.427 -15.899 1.00 0.00 C +ATOM 1686 HD2 HIE 277 -42.362 -7.350 -15.878 1.00 0.00 H +ATOM 1687 C HIE 277 -43.002 -6.344 -12.545 1.00 0.00 C +ATOM 1688 O HIE 277 -44.191 -6.039 -12.682 1.00 0.00 O +ATOM 1689 N LEU 278 -42.592 -7.592 -12.312 1.00 0.00 N +ATOM 1690 H LEU 278 -41.560 -7.698 -12.221 1.00 0.00 H +ATOM 1691 CA LEU 278 -43.526 -8.711 -12.196 1.00 0.00 C +ATOM 1692 HA LEU 278 -44.096 -8.740 -13.030 1.00 0.00 H +ATOM 1693 CB LEU 278 -42.762 -10.033 -12.087 1.00 0.00 C +ATOM 1694 HB2 LEU 278 -42.036 -9.911 -11.434 1.00 0.00 H +ATOM 1695 HB3 LEU 278 -43.398 -10.730 -11.812 1.00 0.00 H +ATOM 1696 CG LEU 278 -42.133 -10.470 -13.405 1.00 0.00 C +ATOM 1697 HG LEU 278 -41.482 -9.772 -13.703 1.00 0.00 H +ATOM 1698 CD1 LEU 278 -41.411 -11.794 -13.236 1.00 0.00 C +ATOM 1699 HD11 LEU 278 -42.060 -12.496 -12.939 1.00 0.00 H +ATOM 1700 HD12 LEU 278 -41.003 -12.069 -14.108 1.00 0.00 H +ATOM 1701 HD13 LEU 278 -40.689 -11.698 -12.549 1.00 0.00 H +ATOM 1702 CD2 LEU 278 -43.222 -10.602 -14.452 1.00 0.00 C +ATOM 1703 HD21 LEU 278 -43.681 -9.720 -14.575 1.00 0.00 H +ATOM 1704 HD22 LEU 278 -42.819 -10.889 -15.323 1.00 0.00 H +ATOM 1705 HD23 LEU 278 -43.893 -11.285 -14.157 1.00 0.00 H +ATOM 1706 C LEU 278 -44.450 -8.569 -10.989 1.00 0.00 C +ATOM 1707 O LEU 278 -45.623 -8.954 -11.051 1.00 0.00 O +ATOM 1708 N LYS 279 -43.920 -8.030 -9.896 1.00 0.00 N +ATOM 1709 H LYS 279 -42.923 -7.764 -9.975 1.00 0.00 H +ATOM 1710 CA LYS 279 -44.715 -7.840 -8.686 1.00 0.00 C +ATOM 1711 HA LYS 279 -45.225 -8.680 -8.498 1.00 0.00 H +ATOM 1712 CB LYS 279 -43.805 -7.482 -7.512 1.00 0.00 C +ATOM 1713 HB2 LYS 279 -43.176 -8.246 -7.362 1.00 0.00 H +ATOM 1714 HB3 LYS 279 -43.279 -6.667 -7.764 1.00 0.00 H +ATOM 1715 CG LYS 279 -44.532 -7.200 -6.214 1.00 0.00 C +ATOM 1716 HG2 LYS 279 -43.874 -6.876 -5.534 1.00 0.00 H +ATOM 1717 HG3 LYS 279 -45.224 -6.497 -6.372 1.00 0.00 H +ATOM 1718 CD LYS 279 -45.207 -8.448 -5.691 1.00 0.00 C +ATOM 1719 HD2 LYS 279 -45.969 -8.688 -6.296 1.00 0.00 H +ATOM 1720 HD3 LYS 279 -44.546 -9.201 -5.681 1.00 0.00 H +ATOM 1721 CE LYS 279 -45.763 -8.288 -4.271 1.00 0.00 C +ATOM 1722 HE2 LYS 279 -46.090 -9.184 -3.949 1.00 0.00 H +ATOM 1723 HE3 LYS 279 -45.018 -7.987 -3.664 1.00 0.00 H +ATOM 1724 NZ LYS 279 -46.892 -7.298 -4.182 1.00 0.00 N +ATOM 1725 HZ1 LYS 279 -47.093 -6.953 -5.096 1.00 0.00 H +ATOM 1726 HZ2 LYS 279 -47.694 -7.755 -3.806 1.00 0.00 H +ATOM 1727 HZ3 LYS 279 -46.618 -6.547 -3.586 1.00 0.00 H +ATOM 1728 C LYS 279 -45.696 -6.706 -8.913 1.00 0.00 C +ATOM 1729 O LYS 279 -46.876 -6.795 -8.559 1.00 0.00 O +ATOM 1730 N THR 280 -45.177 -5.634 -9.503 1.00 0.00 N +ATOM 1731 H THR 280 -44.158 -5.730 -9.741 1.00 0.00 H +ATOM 1732 CA THR 280 -45.943 -4.432 -9.797 1.00 0.00 C +ATOM 1733 HA THR 280 -46.245 -4.020 -8.924 1.00 0.00 H +ATOM 1734 CB THR 280 -45.039 -3.414 -10.528 1.00 0.00 C +ATOM 1735 HB THR 280 -44.638 -3.862 -11.348 1.00 0.00 H +ATOM 1736 CG2 THR 280 -45.819 -2.186 -10.931 1.00 0.00 C +ATOM 1737 HG21 THR 280 -46.797 -2.404 -10.999 1.00 0.00 H +ATOM 1738 HG22 THR 280 -45.696 -1.459 -10.249 1.00 0.00 H +ATOM 1739 HG23 THR 280 -45.500 -1.850 -11.822 1.00 0.00 H +ATOM 1740 OG1 THR 280 -43.962 -3.031 -9.655 1.00 0.00 O +ATOM 1741 HG1 THR 280 -43.250 -3.740 -9.651 1.00 0.00 H +ATOM 1742 C THR 280 -47.187 -4.732 -10.634 1.00 0.00 C +ATOM 1743 O THR 280 -48.260 -4.173 -10.379 1.00 0.00 O +ATOM 1744 N ILE 281 -47.040 -5.618 -11.619 1.00 0.00 N +ATOM 1745 H ILE 281 -46.090 -6.016 -11.711 1.00 0.00 H +ATOM 1746 CA ILE 281 -48.158 -5.979 -12.487 1.00 0.00 C +ATOM 1747 HA ILE 281 -48.818 -5.212 -12.429 1.00 0.00 H +ATOM 1748 CB ILE 281 -47.723 -6.197 -13.963 1.00 0.00 C +ATOM 1749 HB ILE 281 -48.546 -6.348 -14.500 1.00 0.00 H +ATOM 1750 CG2 ILE 281 -46.986 -4.959 -14.477 1.00 0.00 C +ATOM 1751 HG21 ILE 281 -46.747 -5.092 -15.436 1.00 0.00 H +ATOM 1752 HG22 ILE 281 -47.578 -4.162 -14.387 1.00 0.00 H +ATOM 1753 HG23 ILE 281 -46.156 -4.823 -13.941 1.00 0.00 H +ATOM 1754 CG1 ILE 281 -46.832 -7.434 -14.092 1.00 0.00 C +ATOM 1755 HG12 ILE 281 -45.954 -7.234 -13.667 1.00 0.00 H +ATOM 1756 HG13 ILE 281 -47.268 -8.183 -13.599 1.00 0.00 H +ATOM 1757 CD1 ILE 281 -46.609 -7.851 -15.520 1.00 0.00 C +ATOM 1758 HD11 ILE 281 -46.168 -7.106 -16.022 1.00 0.00 H +ATOM 1759 HD12 ILE 281 -46.022 -8.661 -15.545 1.00 0.00 H +ATOM 1760 HD13 ILE 281 -47.488 -8.065 -15.948 1.00 0.00 H +ATOM 1761 C ILE 281 -48.899 -7.226 -12.028 1.00 0.00 C +ATOM 1762 O ILE 281 -49.607 -7.858 -12.817 1.00 0.00 O +ATOM 1763 N ASN 282 -48.731 -7.578 -10.754 1.00 0.00 N +ATOM 1764 H ASN 282 -48.101 -6.948 -10.211 1.00 0.00 H +ATOM 1765 CA ASN 282 -49.380 -8.755 -10.167 1.00 0.00 C +ATOM 1766 HA ASN 282 -49.008 -8.849 -9.211 1.00 0.00 H +ATOM 1767 CB ASN 282 -50.877 -8.523 -9.987 1.00 0.00 C +ATOM 1768 HB2 ASN 282 -51.158 -7.797 -10.605 1.00 0.00 H +ATOM 1769 HB3 ASN 282 -51.352 -9.369 -10.204 1.00 0.00 H +ATOM 1770 CG ASN 282 -51.208 -8.122 -8.579 1.00 0.00 C +ATOM 1771 OD1 ASN 282 -51.177 -6.936 -8.252 1.00 0.00 O +ATOM 1772 ND2 ASN 282 -51.493 -9.099 -7.724 1.00 0.00 N +ATOM 1773 HD21 ASN 282 -51.725 -8.889 -6.778 1.00 0.00 H +ATOM 1774 HD22 ASN 282 -51.472 -10.051 -8.039 1.00 0.00 H +ATOM 1775 C ASN 282 -49.157 -10.096 -10.859 1.00 0.00 C +ATOM 1776 O ASN 282 -50.109 -10.831 -11.162 1.00 0.00 O +ATOM 1777 N GLN 283 -47.888 -10.398 -11.128 1.00 0.00 N +ATOM 1778 H GLN 283 -47.203 -9.656 -10.878 1.00 0.00 H +ATOM 1779 CA GLN 283 -47.501 -11.677 -11.728 1.00 0.00 C +ATOM 1780 HA GLN 283 -48.270 -12.287 -11.668 1.00 0.00 H +ATOM 1781 CB GLN 283 -46.992 -11.472 -13.156 1.00 0.00 C +ATOM 1782 HB2 GLN 283 -46.424 -10.653 -13.183 1.00 0.00 H +ATOM 1783 HB3 GLN 283 -46.453 -12.268 -13.425 1.00 0.00 H +ATOM 1784 CG GLN 283 -48.118 -11.299 -14.177 1.00 0.00 C +ATOM 1785 HG2 GLN 283 -48.852 -10.767 -13.754 1.00 0.00 H +ATOM 1786 HG3 GLN 283 -47.758 -10.800 -14.966 1.00 0.00 H +ATOM 1787 CD GLN 283 -48.696 -12.621 -14.661 1.00 0.00 C +ATOM 1788 OE1 GLN 283 -48.563 -13.663 -14.011 1.00 0.00 O +ATOM 1789 NE2 GLN 283 -49.364 -12.576 -15.803 1.00 0.00 N +ATOM 1790 HE21 GLN 283 -49.771 -13.424 -16.202 1.00 0.00 H +ATOM 1791 HE22 GLN 283 -49.470 -11.685 -16.282 1.00 0.00 H +ATOM 1792 C GLN 283 -46.402 -12.207 -10.825 1.00 0.00 C +ATOM 1793 O GLN 283 -45.402 -12.743 -11.289 1.00 0.00 O +ATOM 1794 N GLU 284 -46.614 -12.047 -9.522 1.00 0.00 N +ATOM 1795 H GLU 284 -47.524 -11.591 -9.286 1.00 0.00 H +ATOM 1796 CA GLU 284 -45.653 -12.474 -8.508 1.00 0.00 C +ATOM 1797 HA GLU 284 -44.825 -11.868 -8.554 1.00 0.00 H +ATOM 1798 CB GLU 284 -46.227 -12.220 -7.116 1.00 0.00 C +ATOM 1799 HB2 GLU 284 -46.836 -11.454 -7.181 1.00 0.00 H +ATOM 1800 HB3 GLU 284 -46.681 -13.040 -6.827 1.00 0.00 H +ATOM 1801 CG GLU 284 -45.167 -11.889 -6.099 1.00 0.00 C +ATOM 1802 HG2 GLU 284 -44.517 -12.628 -6.074 1.00 0.00 H +ATOM 1803 HG3 GLU 284 -44.746 -11.036 -6.351 1.00 0.00 H +ATOM 1804 CD GLU 284 -45.729 -11.727 -4.711 1.00 0.00 C +ATOM 1805 OE1 GLU 284 -46.883 -11.254 -4.595 1.00 0.00 O +ATOM 1806 OE2 GLU 284 -45.005 -12.055 -3.750 1.00 0.00 O +ATOM 1807 C GLU 284 -45.204 -13.933 -8.594 1.00 0.00 C +ATOM 1808 O GLU 284 -44.051 -14.254 -8.288 1.00 0.00 O +ATOM 1809 N SER 285 -46.099 -14.826 -9.001 1.00 0.00 N +ATOM 1810 H SER 285 -47.022 -14.453 -9.249 1.00 0.00 H +ATOM 1811 CA SER 285 -45.736 -16.237 -9.071 1.00 0.00 C +ATOM 1812 HA SER 285 -45.328 -16.499 -8.178 1.00 0.00 H +ATOM 1813 CB SER 285 -46.978 -17.107 -9.289 1.00 0.00 C +ATOM 1814 HB2 SER 285 -46.721 -18.065 -9.180 1.00 0.00 H +ATOM 1815 HB3 SER 285 -47.664 -16.861 -8.607 1.00 0.00 H +ATOM 1816 OG SER 285 -47.529 -16.922 -10.583 1.00 0.00 O +ATOM 1817 HG SER 285 -48.009 -16.047 -10.618 1.00 0.00 H +ATOM 1818 C SER 285 -44.711 -16.547 -10.158 1.00 0.00 C +ATOM 1819 O SER 285 -44.196 -17.662 -10.224 1.00 0.00 O +ATOM 1820 N CYS 286 -44.415 -15.567 -11.006 1.00 0.00 N +ATOM 1821 H CYS 286 -44.905 -14.674 -10.836 1.00 0.00 H +ATOM 1822 CA CYS 286 -43.460 -15.778 -12.088 1.00 0.00 C +ATOM 1823 HA CYS 286 -43.531 -16.747 -12.387 1.00 0.00 H +ATOM 1824 CB CYS 286 -43.816 -14.888 -13.282 1.00 0.00 C +ATOM 1825 HB2 CYS 286 -43.878 -13.941 -12.951 1.00 0.00 H +ATOM 1826 HB3 CYS 286 -43.062 -14.947 -13.944 1.00 0.00 H +ATOM 1827 SG CYS 286 -45.353 -15.297 -14.132 1.00 0.00 S +ATOM 1828 HG CYS 286 -45.691 -14.491 -14.619 1.00 0.00 H +ATOM 1829 C CYS 286 -42.018 -15.518 -11.677 1.00 0.00 C +ATOM 1830 O CYS 286 -41.087 -15.868 -12.400 1.00 0.00 O +ATOM 1831 N ILE 287 -41.841 -14.909 -10.510 1.00 0.00 N +ATOM 1832 H ILE 287 -42.715 -14.693 -9.994 1.00 0.00 H +ATOM 1833 CA ILE 287 -40.513 -14.583 -10.019 1.00 0.00 C +ATOM 1834 HA ILE 287 -40.056 -14.056 -10.766 1.00 0.00 H +ATOM 1835 CB ILE 287 -40.600 -13.656 -8.774 1.00 0.00 C +ATOM 1836 HB ILE 287 -41.148 -14.114 -8.094 1.00 0.00 H +ATOM 1837 CG2 ILE 287 -39.195 -13.338 -8.249 1.00 0.00 C +ATOM 1838 HG21 ILE 287 -39.270 -12.748 -7.449 1.00 0.00 H +ATOM 1839 HG22 ILE 287 -38.738 -14.188 -7.999 1.00 0.00 H +ATOM 1840 HG23 ILE 287 -38.676 -12.874 -8.962 1.00 0.00 H +ATOM 1841 CG1 ILE 287 -41.317 -12.348 -9.164 1.00 0.00 C +ATOM 1842 HG12 ILE 287 -40.728 -11.846 -9.800 1.00 0.00 H +ATOM 1843 HG13 ILE 287 -42.162 -12.590 -9.647 1.00 0.00 H +ATOM 1844 CD1 ILE 287 -41.672 -11.434 -7.997 1.00 0.00 C +ATOM 1845 HD11 ILE 287 -40.835 -11.174 -7.521 1.00 0.00 H +ATOM 1846 HD12 ILE 287 -42.129 -10.620 -8.348 1.00 0.00 H +ATOM 1847 HD13 ILE 287 -42.279 -11.922 -7.374 1.00 0.00 H +ATOM 1848 C ILE 287 -39.618 -15.775 -9.723 1.00 0.00 C +ATOM 1849 O ILE 287 -38.500 -15.831 -10.211 1.00 0.00 O +ATOM 1850 N GLU 288 -40.099 -16.733 -8.941 1.00 0.00 N +ATOM 1851 H GLU 288 -41.052 -16.591 -8.590 1.00 0.00 H +ATOM 1852 CA GLU 288 -39.275 -17.902 -8.630 1.00 0.00 C +ATOM 1853 HA GLU 288 -38.451 -17.615 -8.134 1.00 0.00 H +ATOM 1854 CB GLU 288 -40.025 -18.823 -7.677 1.00 0.00 C +ATOM 1855 HB2 GLU 288 -40.347 -18.280 -6.921 1.00 0.00 H +ATOM 1856 HB3 GLU 288 -40.765 -19.239 -8.175 1.00 0.00 H +ATOM 1857 CG GLU 288 -39.173 -19.947 -7.101 1.00 0.00 C +ATOM 1858 HG2 GLU 288 -39.013 -20.608 -7.809 1.00 0.00 H +ATOM 1859 HG3 GLU 288 -38.341 -19.560 -6.753 1.00 0.00 H +ATOM 1860 CD GLU 288 -39.856 -20.673 -5.944 1.00 0.00 C +ATOM 1861 OE1 GLU 288 -39.451 -20.469 -4.775 1.00 0.00 O +ATOM 1862 OE2 GLU 288 -40.804 -21.433 -6.218 1.00 0.00 O +ATOM 1863 C GLU 288 -38.859 -18.634 -9.919 1.00 0.00 C +ATOM 1864 O GLU 288 -37.709 -19.041 -10.060 1.00 0.00 O +ATOM 1865 N PRO 289 -39.785 -18.801 -10.879 1.00 0.00 N +ATOM 1866 CD PRO 289 -41.247 -18.648 -10.751 1.00 0.00 C +ATOM 1867 HD2 PRO 289 -41.522 -17.719 -10.984 1.00 0.00 H +ATOM 1868 HD3 PRO 289 -41.541 -18.866 -9.823 1.00 0.00 H +ATOM 1869 CG PRO 289 -41.764 -19.645 -11.745 1.00 0.00 C +ATOM 1870 HG2 PRO 289 -42.678 -19.407 -12.055 1.00 0.00 H +ATOM 1871 HG3 PRO 289 -41.753 -20.566 -11.372 1.00 0.00 H +ATOM 1872 CB PRO 289 -40.780 -19.528 -12.878 1.00 0.00 C +ATOM 1873 HB2 PRO 289 -40.935 -18.694 -13.394 1.00 0.00 H +ATOM 1874 HB3 PRO 289 -40.829 -20.321 -13.472 1.00 0.00 H +ATOM 1875 CA PRO 289 -39.443 -19.476 -12.140 1.00 0.00 C +ATOM 1876 HA PRO 289 -39.121 -20.408 -11.970 1.00 0.00 H +ATOM 1877 C PRO 289 -38.387 -18.666 -12.901 1.00 0.00 C +ATOM 1878 O PRO 289 -37.498 -19.231 -13.534 1.00 0.00 O +ATOM 1879 N LEU 290 -38.485 -17.340 -12.828 1.00 0.00 N +ATOM 1880 H LEU 290 -39.281 -16.987 -12.273 1.00 0.00 H +ATOM 1881 CA LEU 290 -37.515 -16.476 -13.500 1.00 0.00 C +ATOM 1882 HA LEU 290 -37.463 -16.744 -14.466 1.00 0.00 H +ATOM 1883 CB LEU 290 -37.923 -15.009 -13.387 1.00 0.00 C +ATOM 1884 HB2 LEU 290 -38.773 -14.889 -13.868 1.00 0.00 H +ATOM 1885 HB3 LEU 290 -37.998 -14.783 -12.434 1.00 0.00 H +ATOM 1886 CG LEU 290 -36.903 -14.052 -14.009 1.00 0.00 C +ATOM 1887 HG LEU 290 -36.003 -14.241 -13.620 1.00 0.00 H +ATOM 1888 CD1 LEU 290 -36.856 -14.244 -15.514 1.00 0.00 C +ATOM 1889 HD11 LEU 290 -37.759 -14.059 -15.905 1.00 0.00 H +ATOM 1890 HD12 LEU 290 -36.187 -13.615 -15.913 1.00 0.00 H +ATOM 1891 HD13 LEU 290 -36.591 -15.186 -15.725 1.00 0.00 H +ATOM 1892 CD2 LEU 290 -37.269 -12.634 -13.665 1.00 0.00 C +ATOM 1893 HD21 LEU 290 -37.271 -12.512 -12.669 1.00 0.00 H +ATOM 1894 HD22 LEU 290 -36.604 -12.000 -14.070 1.00 0.00 H +ATOM 1895 HD23 LEU 290 -38.182 -12.419 -14.021 1.00 0.00 H +ATOM 1896 C LEU 290 -36.131 -16.644 -12.878 1.00 0.00 C +ATOM 1897 O LEU 290 -35.124 -16.698 -13.586 1.00 0.00 O +ATOM 1898 N ALA 291 -36.087 -16.709 -11.550 1.00 0.00 N +ATOM 1899 H ALA 291 -37.001 -16.638 -11.075 1.00 0.00 H +ATOM 1900 CA ALA 291 -34.817 -16.870 -10.849 1.00 0.00 C +ATOM 1901 HA ALA 291 -34.208 -16.116 -11.104 1.00 0.00 H +ATOM 1902 CB ALA 291 -35.032 -16.836 -9.329 1.00 0.00 C +ATOM 1903 HB1 ALA 291 -35.841 -16.289 -9.125 1.00 0.00 H +ATOM 1904 HB2 ALA 291 -35.161 -17.767 -8.996 1.00 0.00 H +ATOM 1905 HB3 ALA 291 -34.231 -16.430 -8.894 1.00 0.00 H +ATOM 1906 C ALA 291 -34.166 -18.185 -11.261 1.00 0.00 C +ATOM 1907 O ALA 291 -32.949 -18.275 -11.381 1.00 0.00 O +ATOM 1908 N GLU 292 -34.989 -19.204 -11.477 1.00 0.00 N +ATOM 1909 H GLU 292 -35.994 -18.993 -11.330 1.00 0.00 H +ATOM 1910 CA GLU 292 -34.487 -20.500 -11.887 1.00 0.00 C +ATOM 1911 HA GLU 292 -33.766 -20.804 -11.261 1.00 0.00 H +ATOM 1912 CB GLU 292 -35.612 -21.538 -11.847 1.00 0.00 C +ATOM 1913 HB2 GLU 292 -36.072 -21.445 -10.981 1.00 0.00 H +ATOM 1914 HB3 GLU 292 -36.212 -21.357 -12.606 1.00 0.00 H +ATOM 1915 CG GLU 292 -35.134 -22.972 -11.966 1.00 0.00 C +ATOM 1916 HG2 GLU 292 -34.917 -23.149 -12.905 1.00 0.00 H +ATOM 1917 HG3 GLU 292 -34.367 -23.095 -11.369 1.00 0.00 H +ATOM 1918 CD GLU 292 -36.204 -23.960 -11.547 1.00 0.00 C +ATOM 1919 OE1 GLU 292 -36.975 -23.633 -10.618 1.00 0.00 O +ATOM 1920 OE2 GLU 292 -36.262 -25.059 -12.129 1.00 0.00 O +ATOM 1921 C GLU 292 -33.919 -20.405 -13.302 1.00 0.00 C +ATOM 1922 O GLU 292 -32.898 -21.015 -13.600 1.00 0.00 O +ATOM 1923 N SER 293 -34.587 -19.641 -14.168 1.00 0.00 N +ATOM 1924 H SER 293 -35.438 -19.189 -13.786 1.00 0.00 H +ATOM 1925 CA SER 293 -34.133 -19.468 -15.552 1.00 0.00 C +ATOM 1926 HA SER 293 -34.007 -20.383 -15.953 1.00 0.00 H +ATOM 1927 CB SER 293 -35.161 -18.677 -16.365 1.00 0.00 C +ATOM 1928 HB2 SER 293 -35.388 -17.844 -15.872 1.00 0.00 H +ATOM 1929 HB3 SER 293 -34.768 -18.458 -17.252 1.00 0.00 H +ATOM 1930 OG SER 293 -36.342 -19.437 -16.558 1.00 0.00 O +ATOM 1931 HG SER 293 -36.848 -19.490 -15.698 1.00 0.00 H +ATOM 1932 C SER 293 -32.793 -18.743 -15.604 1.00 0.00 C +ATOM 1933 O SER 293 -31.915 -19.092 -16.394 1.00 0.00 O +ATOM 1934 N ILE 294 -32.644 -17.729 -14.760 1.00 0.00 N +ATOM 1935 H ILE 294 -33.460 -17.532 -14.158 1.00 0.00 H +ATOM 1936 CA ILE 294 -31.398 -16.965 -14.712 1.00 0.00 C +ATOM 1937 HA ILE 294 -31.183 -16.718 -15.657 1.00 0.00 H +ATOM 1938 CB ILE 294 -31.517 -15.748 -13.765 1.00 0.00 C +ATOM 1939 HB ILE 294 -31.826 -16.078 -12.882 1.00 0.00 H +ATOM 1940 CG2 ILE 294 -30.166 -15.058 -13.630 1.00 0.00 C +ATOM 1941 HG21 ILE 294 -30.246 -14.291 -12.996 1.00 0.00 H +ATOM 1942 HG22 ILE 294 -29.493 -15.709 -13.283 1.00 0.00 H +ATOM 1943 HG23 ILE 294 -29.873 -14.722 -14.523 1.00 0.00 H +ATOM 1944 CG1 ILE 294 -32.565 -14.763 -14.298 1.00 0.00 C +ATOM 1945 HG12 ILE 294 -32.268 -14.440 -15.194 1.00 0.00 H +ATOM 1946 HG13 ILE 294 -33.429 -15.253 -14.404 1.00 0.00 H +ATOM 1947 CD1 ILE 294 -32.797 -13.561 -13.395 1.00 0.00 C +ATOM 1948 HD11 ILE 294 -31.941 -13.059 -13.292 1.00 0.00 H +ATOM 1949 HD12 ILE 294 -33.488 -12.971 -13.807 1.00 0.00 H +ATOM 1950 HD13 ILE 294 -33.112 -13.878 -12.503 1.00 0.00 H +ATOM 1951 C ILE 294 -30.263 -17.863 -14.226 1.00 0.00 C +ATOM 1952 O ILE 294 -29.157 -17.838 -14.768 1.00 0.00 O +ATOM 1953 N THR 295 -30.545 -18.657 -13.198 1.00 0.00 N +ATOM 1954 H THR 295 -31.511 -18.575 -12.833 1.00 0.00 H +ATOM 1955 CA THR 295 -29.547 -19.564 -12.648 1.00 0.00 C +ATOM 1956 HA THR 295 -28.737 -19.030 -12.387 1.00 0.00 H +ATOM 1957 CB THR 295 -30.079 -20.312 -11.406 1.00 0.00 C +ATOM 1958 HB THR 295 -30.869 -20.891 -11.687 1.00 0.00 H +ATOM 1959 CG2 THR 295 -28.976 -21.162 -10.787 1.00 0.00 C +ATOM 1960 HG21 THR 295 -28.350 -20.578 -10.266 1.00 0.00 H +ATOM 1961 HG22 THR 295 -29.378 -21.844 -10.172 1.00 0.00 H +ATOM 1962 HG23 THR 295 -28.464 -21.631 -11.509 1.00 0.00 H +ATOM 1963 OG1 THR 295 -30.539 -19.361 -10.441 1.00 0.00 O +ATOM 1964 HG1 THR 295 -31.401 -18.941 -10.746 1.00 0.00 H +ATOM 1965 C THR 295 -29.129 -20.588 -13.697 1.00 0.00 C +ATOM 1966 O THR 295 -27.951 -20.909 -13.808 1.00 0.00 O +ATOM 1967 N ASP 296 -30.092 -21.093 -14.469 1.00 0.00 N +ATOM 1968 H ASP 296 -31.041 -20.749 -14.276 1.00 0.00 H +ATOM 1969 CA ASP 296 -29.769 -22.070 -15.510 1.00 0.00 C +ATOM 1970 HA ASP 296 -29.272 -22.822 -15.064 1.00 0.00 H +ATOM 1971 CB ASP 296 -31.028 -22.577 -16.218 1.00 0.00 C +ATOM 1972 HB2 ASP 296 -31.595 -21.788 -16.432 1.00 0.00 H +ATOM 1973 HB3 ASP 296 -30.744 -23.035 -17.054 1.00 0.00 H +ATOM 1974 CG ASP 296 -31.823 -23.540 -15.375 1.00 0.00 C +ATOM 1975 OD1 ASP 296 -31.238 -24.168 -14.466 1.00 0.00 O +ATOM 1976 OD2 ASP 296 -33.035 -23.683 -15.635 1.00 0.00 O +ATOM 1977 C ASP 296 -28.836 -21.464 -16.544 1.00 0.00 C +ATOM 1978 O ASP 296 -27.879 -22.103 -16.968 1.00 0.00 O +ATOM 1979 N VAL 297 -29.112 -20.227 -16.948 1.00 0.00 N +ATOM 1980 H VAL 297 -29.944 -19.797 -16.515 1.00 0.00 H +ATOM 1981 CA VAL 297 -28.271 -19.561 -17.936 1.00 0.00 C +ATOM 1982 HA VAL 297 -28.191 -20.165 -18.739 1.00 0.00 H +ATOM 1983 CB VAL 297 -28.898 -18.220 -18.388 1.00 0.00 C +ATOM 1984 HB VAL 297 -29.063 -17.675 -17.576 1.00 0.00 H +ATOM 1985 CG1 VAL 297 -27.904 -17.436 -19.256 1.00 0.00 C +ATOM 1986 HG11 VAL 297 -28.385 -16.690 -19.711 1.00 0.00 H +ATOM 1987 HG12 VAL 297 -27.181 -17.068 -18.675 1.00 0.00 H +ATOM 1988 HG13 VAL 297 -27.510 -18.049 -19.937 1.00 0.00 H +ATOM 1989 CG2 VAL 297 -30.184 -18.490 -19.161 1.00 0.00 C +ATOM 1990 HG21 VAL 297 -30.804 -19.028 -18.590 1.00 0.00 H +ATOM 1991 HG22 VAL 297 -30.614 -17.620 -19.399 1.00 0.00 H +ATOM 1992 HG23 VAL 297 -29.966 -18.998 -19.994 1.00 0.00 H +ATOM 1993 C VAL 297 -26.868 -19.315 -17.393 1.00 0.00 C +ATOM 1994 O VAL 297 -25.877 -19.574 -18.071 1.00 0.00 O +ATOM 1995 N LEU 298 -26.787 -18.828 -16.159 1.00 0.00 N +ATOM 1996 H LEU 298 -27.691 -18.665 -15.687 1.00 0.00 H +ATOM 1997 CA LEU 298 -25.487 -18.551 -15.537 1.00 0.00 C +ATOM 1998 HA LEU 298 -24.962 -17.940 -16.154 1.00 0.00 H +ATOM 1999 CB LEU 298 -25.674 -17.814 -14.206 1.00 0.00 C +ATOM 2000 HB2 LEU 298 -26.062 -16.920 -14.406 1.00 0.00 H +ATOM 2001 HB3 LEU 298 -26.299 -18.348 -13.649 1.00 0.00 H +ATOM 2002 CG LEU 298 -24.404 -17.591 -13.390 1.00 0.00 C +ATOM 2003 HG LEU 298 -23.978 -18.472 -13.199 1.00 0.00 H +ATOM 2004 CD1 LEU 298 -23.426 -16.719 -14.175 1.00 0.00 C +ATOM 2005 HD11 LEU 298 -23.852 -15.836 -14.370 1.00 0.00 H +ATOM 2006 HD12 LEU 298 -22.598 -16.579 -13.633 1.00 0.00 H +ATOM 2007 HD13 LEU 298 -23.191 -17.174 -15.033 1.00 0.00 H +ATOM 2008 CD2 LEU 298 -24.747 -16.911 -12.069 1.00 0.00 C +ATOM 2009 HD21 LEU 298 -25.375 -17.490 -11.549 1.00 0.00 H +ATOM 2010 HD22 LEU 298 -23.910 -16.769 -11.540 1.00 0.00 H +ATOM 2011 HD23 LEU 298 -25.181 -16.028 -12.251 1.00 0.00 H +ATOM 2012 C LEU 298 -24.646 -19.810 -15.285 1.00 0.00 C +ATOM 2013 O LEU 298 -23.514 -19.923 -15.764 1.00 0.00 O +ATOM 2014 N VAL 299 -25.210 -20.758 -14.545 1.00 0.00 N +ATOM 2015 H VAL 299 -26.179 -20.563 -14.244 1.00 0.00 H +ATOM 2016 CA VAL 299 -24.480 -21.965 -14.208 1.00 0.00 C +ATOM 2017 HA VAL 299 -23.540 -21.688 -13.894 1.00 0.00 H +ATOM 2018 CB VAL 299 -25.121 -22.663 -12.966 1.00 0.00 C +ATOM 2019 HB VAL 299 -26.039 -22.940 -13.228 1.00 0.00 H +ATOM 2020 CG1 VAL 299 -24.354 -23.921 -12.597 1.00 0.00 C +ATOM 2021 HG11 VAL 299 -24.502 -24.133 -11.630 1.00 0.00 H +ATOM 2022 HG12 VAL 299 -24.675 -24.686 -13.157 1.00 0.00 H +ATOM 2023 HG13 VAL 299 -23.377 -23.778 -12.759 1.00 0.00 H +ATOM 2024 CG2 VAL 299 -25.133 -21.702 -11.781 1.00 0.00 C +ATOM 2025 HG21 VAL 299 -25.080 -20.763 -12.119 1.00 0.00 H +ATOM 2026 HG22 VAL 299 -25.979 -21.828 -11.265 1.00 0.00 H +ATOM 2027 HG23 VAL 299 -24.348 -21.895 -11.194 1.00 0.00 H +ATOM 2028 C VAL 299 -24.305 -22.980 -15.332 1.00 0.00 C +ATOM 2029 O VAL 299 -23.236 -23.584 -15.445 1.00 0.00 O +ATOM 2030 N ARG 300 -25.322 -23.160 -16.172 1.00 0.00 N +ATOM 2031 H ARG 300 -26.144 -22.561 -16.006 1.00 0.00 H +ATOM 2032 CA ARG 300 -25.236 -24.151 -17.242 1.00 0.00 C +ATOM 2033 HA ARG 300 -24.816 -25.000 -16.861 1.00 0.00 H +ATOM 2034 CB ARG 300 -26.636 -24.560 -17.707 1.00 0.00 C +ATOM 2035 HB2 ARG 300 -27.022 -23.808 -18.242 1.00 0.00 H +ATOM 2036 HB3 ARG 300 -26.551 -25.370 -18.287 1.00 0.00 H +ATOM 2037 CG ARG 300 -27.633 -24.894 -16.588 1.00 0.00 C +ATOM 2038 HG2 ARG 300 -27.621 -24.150 -15.906 1.00 0.00 H +ATOM 2039 HG3 ARG 300 -28.562 -24.940 -16.981 1.00 0.00 H +ATOM 2040 CD ARG 300 -27.369 -26.208 -15.855 1.00 0.00 C +ATOM 2041 HD2 ARG 300 -27.318 -26.931 -16.523 1.00 0.00 H +ATOM 2042 HD3 ARG 300 -26.528 -26.116 -15.348 1.00 0.00 H +ATOM 2043 NE ARG 300 -28.473 -26.492 -14.916 1.00 0.00 N +ATOM 2044 HE ARG 300 -29.244 -25.837 -14.901 1.00 0.00 H +ATOM 2045 CZ ARG 300 -28.533 -27.537 -14.093 1.00 0.00 C +ATOM 2046 NH1 ARG 300 -27.546 -28.413 -14.078 1.00 0.00 N +ATOM 2047 HH11 ARG 300 -26.740 -28.308 -14.653 1.00 0.00 H +ATOM 2048 HH12 ARG 300 -27.604 -29.218 -13.465 1.00 0.00 H +ATOM 2049 NH2 ARG 300 -29.593 -27.723 -13.305 1.00 0.00 N +ATOM 2050 HH21 ARG 300 -30.337 -27.049 -13.330 1.00 0.00 H +ATOM 2051 HH22 ARG 300 -29.643 -28.511 -12.706 1.00 0.00 H +ATOM 2052 C ARG 300 -24.416 -23.705 -18.443 1.00 0.00 C +ATOM 2053 O ARG 300 -23.952 -24.554 -19.191 1.00 0.00 O +ATOM 2054 N THR 301 -24.238 -22.398 -18.647 1.00 0.00 N +ATOM 2055 H THR 301 -24.694 -21.774 -17.981 1.00 0.00 H +ATOM 2056 CA THR 301 -23.423 -21.951 -19.781 1.00 0.00 C +ATOM 2057 HA THR 301 -23.268 -22.748 -20.395 1.00 0.00 H +ATOM 2058 CB THR 301 -24.154 -20.889 -20.679 1.00 0.00 C +ATOM 2059 HB THR 301 -23.608 -20.770 -21.533 1.00 0.00 H +ATOM 2060 CG2 THR 301 -25.556 -21.360 -21.005 1.00 0.00 C +ATOM 2061 HG21 THR 301 -25.521 -22.100 -21.682 1.00 0.00 H +ATOM 2062 HG22 THR 301 -26.006 -21.699 -20.175 1.00 0.00 H +ATOM 2063 HG23 THR 301 -26.095 -20.601 -21.380 1.00 0.00 H +ATOM 2064 OG1 THR 301 -24.228 -19.629 -20.004 1.00 0.00 O +ATOM 2065 HG1 THR 301 -24.915 -19.664 -19.270 1.00 0.00 H +ATOM 2066 C THR 301 -22.053 -21.387 -19.382 1.00 0.00 C +ATOM 2067 O THR 301 -21.204 -21.174 -20.242 1.00 0.00 O +ATOM 2068 N LYS 302 -21.823 -21.154 -18.093 1.00 0.00 N +ATOM 2069 H LYS 302 -22.586 -21.387 -17.452 1.00 0.00 H +ATOM 2070 CA LYS 302 -20.535 -20.595 -17.674 1.00 0.00 C +ATOM 2071 HA LYS 302 -19.895 -20.627 -18.471 1.00 0.00 H +ATOM 2072 CB LYS 302 -20.686 -19.101 -17.320 1.00 0.00 C +ATOM 2073 HB2 LYS 302 -21.279 -19.036 -16.517 1.00 0.00 H +ATOM 2074 HB3 LYS 302 -19.778 -18.749 -17.091 1.00 0.00 H +ATOM 2075 CG LYS 302 -21.274 -18.240 -18.425 1.00 0.00 C +ATOM 2076 HG2 LYS 302 -22.184 -18.595 -18.668 1.00 0.00 H +ATOM 2077 HG3 LYS 302 -21.379 -17.298 -18.087 1.00 0.00 H +ATOM 2078 CD LYS 302 -20.412 -18.213 -19.681 1.00 0.00 C +ATOM 2079 HD2 LYS 302 -19.526 -17.824 -19.459 1.00 0.00 H +ATOM 2080 HD3 LYS 302 -20.313 -19.137 -20.028 1.00 0.00 H +ATOM 2081 CE LYS 302 -21.052 -17.352 -20.782 1.00 0.00 C +ATOM 2082 HE2 LYS 302 -21.978 -17.698 -20.960 1.00 0.00 H +ATOM 2083 HE3 LYS 302 -21.119 -16.406 -20.450 1.00 0.00 H +ATOM 2084 NZ LYS 302 -20.267 -17.370 -22.056 1.00 0.00 N +ATOM 2085 HZ1 LYS 302 -19.328 -17.089 -21.866 1.00 0.00 H +ATOM 2086 HZ2 LYS 302 -20.274 -18.295 -22.432 1.00 0.00 H +ATOM 2087 HZ3 LYS 302 -20.684 -16.738 -22.707 1.00 0.00 H +ATOM 2088 C LYS 302 -19.875 -21.312 -16.498 1.00 0.00 C +ATOM 2089 O LYS 302 -19.105 -20.698 -15.763 1.00 0.00 O +ATOM 2090 N ARG 303 -20.147 -22.604 -16.328 1.00 0.00 N +ATOM 2091 H ARG 303 -20.771 -23.023 -17.027 1.00 0.00 H +ATOM 2092 CA ARG 303 -19.568 -23.337 -15.200 1.00 0.00 C +ATOM 2093 HA ARG 303 -19.917 -22.926 -14.337 1.00 0.00 H +ATOM 2094 CB ARG 303 -20.039 -24.794 -15.180 1.00 0.00 C +ATOM 2095 HB2 ARG 303 -21.023 -24.809 -15.259 1.00 0.00 H +ATOM 2096 HB3 ARG 303 -19.609 -25.276 -15.927 1.00 0.00 H +ATOM 2097 CG ARG 303 -19.662 -25.522 -13.875 1.00 0.00 C +ATOM 2098 HG2 ARG 303 -18.674 -25.478 -13.754 1.00 0.00 H +ATOM 2099 HG3 ARG 303 -20.121 -25.075 -13.112 1.00 0.00 H +ATOM 2100 CD ARG 303 -20.081 -26.981 -13.901 1.00 0.00 C +ATOM 2101 HD2 ARG 303 -19.638 -27.418 -14.690 1.00 0.00 H +ATOM 2102 HD3 ARG 303 -19.741 -27.417 -13.060 1.00 0.00 H +ATOM 2103 NE ARG 303 -21.528 -27.189 -13.993 1.00 0.00 N +ATOM 2104 HE ARG 303 -21.924 -27.307 -14.916 1.00 0.00 H +ATOM 2105 CZ ARG 303 -22.358 -27.234 -12.956 1.00 0.00 C +ATOM 2106 NH1 ARG 303 -21.903 -27.077 -11.718 1.00 0.00 N +ATOM 2107 HH11 ARG 303 -20.936 -26.903 -11.548 1.00 0.00 H +ATOM 2108 HH12 ARG 303 -22.540 -27.133 -10.943 1.00 0.00 H +ATOM 2109 NH2 ARG 303 -23.646 -27.480 -13.158 1.00 0.00 N +ATOM 2110 HH21 ARG 303 -23.990 -27.611 -14.090 1.00 0.00 H +ATOM 2111 HH22 ARG 303 -24.275 -27.534 -12.383 1.00 0.00 H +ATOM 2112 C ARG 303 -18.046 -23.309 -15.169 1.00 0.00 C +ATOM 2113 O ARG 303 -17.450 -23.016 -14.134 1.00 0.00 O +ATOM 2114 N ASP 304 -17.408 -23.618 -16.294 1.00 0.00 N +ATOM 2115 H ASP 304 -18.010 -23.844 -17.098 1.00 0.00 H +ATOM 2116 CA ASP 304 -15.945 -23.624 -16.343 1.00 0.00 C +ATOM 2117 HA ASP 304 -15.632 -24.350 -15.719 1.00 0.00 H +ATOM 2118 CB ASP 304 -15.438 -23.869 -17.767 1.00 0.00 C +ATOM 2119 HB2 ASP 304 -15.813 -23.158 -18.351 1.00 0.00 H +ATOM 2120 HB3 ASP 304 -14.446 -23.818 -17.752 1.00 0.00 H +ATOM 2121 CG ASP 304 -15.852 -25.219 -18.310 1.00 0.00 C +ATOM 2122 OD1 ASP 304 -15.508 -26.250 -17.690 1.00 0.00 O +ATOM 2123 OD2 ASP 304 -16.522 -25.239 -19.364 1.00 0.00 O +ATOM 2124 C ASP 304 -15.375 -22.313 -15.830 1.00 0.00 C +ATOM 2125 O ASP 304 -14.464 -22.313 -15.010 1.00 0.00 O +ATOM 2126 N TRP 305 -15.908 -21.198 -16.320 1.00 0.00 N +ATOM 2127 H TRP 305 -16.665 -21.343 -17.015 1.00 0.00 H +ATOM 2128 CA TRP 305 -15.447 -19.875 -15.898 1.00 0.00 C +ATOM 2129 HA TRP 305 -14.455 -19.833 -16.050 1.00 0.00 H +ATOM 2130 CB TRP 305 -16.178 -18.769 -16.674 1.00 0.00 C +ATOM 2131 HB2 TRP 305 -16.129 -18.965 -17.644 1.00 0.00 H +ATOM 2132 HB3 TRP 305 -17.119 -18.723 -16.367 1.00 0.00 H +ATOM 2133 CG TRP 305 -15.583 -17.381 -16.476 1.00 0.00 C +ATOM 2134 CD1 TRP 305 -14.605 -16.794 -17.230 1.00 0.00 C +ATOM 2135 HD1 TRP 305 -14.170 -17.210 -18.028 1.00 0.00 H +ATOM 2136 NE1 TRP 305 -14.305 -15.549 -16.734 1.00 0.00 N +ATOM 2137 HE1 TRP 305 -13.624 -14.921 -17.112 1.00 0.00 H +ATOM 2138 CE2 TRP 305 -15.087 -15.304 -15.639 1.00 0.00 C +ATOM 2139 CZ2 TRP 305 -15.143 -14.180 -14.801 1.00 0.00 C +ATOM 2140 HZ2 TRP 305 -14.543 -13.394 -14.973 1.00 0.00 H +ATOM 2141 CH2 TRP 305 -16.036 -14.206 -13.758 1.00 0.00 C +ATOM 2142 HH2 TRP 305 -16.103 -13.426 -13.138 1.00 0.00 H +ATOM 2143 CZ3 TRP 305 -16.871 -15.317 -13.538 1.00 0.00 C +ATOM 2144 HZ3 TRP 305 -17.511 -15.313 -12.780 1.00 0.00 H +ATOM 2145 CE3 TRP 305 -16.817 -16.438 -14.373 1.00 0.00 C +ATOM 2146 HE3 TRP 305 -17.412 -17.214 -14.203 1.00 0.00 H +ATOM 2147 CD2 TRP 305 -15.912 -16.433 -15.442 1.00 0.00 C +ATOM 2148 C TRP 305 -15.692 -19.669 -14.402 1.00 0.00 C +ATOM 2149 O TRP 305 -14.809 -19.222 -13.675 1.00 0.00 O +ATOM 2150 N LEU 306 -16.897 -19.995 -13.943 1.00 0.00 N +ATOM 2151 H LEU 306 -17.551 -20.370 -14.647 1.00 0.00 H +ATOM 2152 CA LEU 306 -17.230 -19.819 -12.533 1.00 0.00 C +ATOM 2153 HA LEU 306 -17.155 -18.836 -12.307 1.00 0.00 H +ATOM 2154 CB LEU 306 -18.679 -20.241 -12.273 1.00 0.00 C +ATOM 2155 HB2 LEU 306 -18.811 -21.132 -12.666 1.00 0.00 H +ATOM 2156 HB3 LEU 306 -18.829 -20.232 -11.303 1.00 0.00 H +ATOM 2157 CG LEU 306 -19.695 -19.297 -12.911 1.00 0.00 C +ATOM 2158 HG LEU 306 -19.384 -19.058 -13.830 1.00 0.00 H +ATOM 2159 CD1 LEU 306 -21.053 -19.967 -12.993 1.00 0.00 C +ATOM 2160 HD11 LEU 306 -21.366 -20.209 -12.073 1.00 0.00 H +ATOM 2161 HD12 LEU 306 -21.713 -19.341 -13.412 1.00 0.00 H +ATOM 2162 HD13 LEU 306 -20.986 -20.797 -13.548 1.00 0.00 H +ATOM 2163 CD2 LEU 306 -19.769 -18.011 -12.098 1.00 0.00 C +ATOM 2164 HD21 LEU 306 -18.869 -17.573 -12.083 1.00 0.00 H +ATOM 2165 HD22 LEU 306 -20.434 -17.391 -12.514 1.00 0.00 H +ATOM 2166 HD23 LEU 306 -20.052 -18.223 -11.162 1.00 0.00 H +ATOM 2167 C LEU 306 -16.291 -20.594 -11.618 1.00 0.00 C +ATOM 2168 O LEU 306 -15.801 -20.061 -10.624 1.00 0.00 O +ATOM 2169 N VAL 307 -16.037 -21.850 -11.955 1.00 0.00 N +ATOM 2170 H VAL 307 -16.500 -22.182 -12.814 1.00 0.00 H +ATOM 2171 CA VAL 307 -15.155 -22.673 -11.136 1.00 0.00 C +ATOM 2172 HA VAL 307 -15.501 -22.661 -10.192 1.00 0.00 H +ATOM 2173 CB VAL 307 -15.143 -24.141 -11.644 1.00 0.00 C +ATOM 2174 HB VAL 307 -14.859 -24.122 -12.597 1.00 0.00 H +ATOM 2175 CG1 VAL 307 -14.119 -24.965 -10.883 1.00 0.00 C +ATOM 2176 HG11 VAL 307 -14.459 -25.899 -10.766 1.00 0.00 H +ATOM 2177 HG12 VAL 307 -13.259 -24.987 -11.394 1.00 0.00 H +ATOM 2178 HG13 VAL 307 -13.960 -24.556 -9.984 1.00 0.00 H +ATOM 2179 CG2 VAL 307 -16.537 -24.742 -11.481 1.00 0.00 C +ATOM 2180 HG21 VAL 307 -16.594 -25.201 -10.595 1.00 0.00 H +ATOM 2181 HG22 VAL 307 -17.216 -24.011 -11.528 1.00 0.00 H +ATOM 2182 HG23 VAL 307 -16.697 -25.401 -12.215 1.00 0.00 H +ATOM 2183 C VAL 307 -13.741 -22.099 -11.125 1.00 0.00 C +ATOM 2184 O VAL 307 -13.110 -21.996 -10.069 1.00 0.00 O +ATOM 2185 N LYS 308 -13.249 -21.704 -12.293 1.00 0.00 N +ATOM 2186 H LYS 308 -13.872 -21.830 -13.103 1.00 0.00 H +ATOM 2187 CA LYS 308 -11.906 -21.133 -12.378 1.00 0.00 C +ATOM 2188 HA LYS 308 -11.246 -21.792 -12.001 1.00 0.00 H +ATOM 2189 CB LYS 308 -11.521 -20.884 -13.844 1.00 0.00 C +ATOM 2190 HB2 LYS 308 -11.676 -21.725 -14.353 1.00 0.00 H +ATOM 2191 HB3 LYS 308 -12.102 -20.157 -14.198 1.00 0.00 H +ATOM 2192 CG LYS 308 -10.063 -20.470 -14.035 1.00 0.00 C +ATOM 2193 HG2 LYS 308 -9.967 -19.500 -13.791 1.00 0.00 H +ATOM 2194 HG3 LYS 308 -9.487 -21.017 -13.421 1.00 0.00 H +ATOM 2195 CD LYS 308 -9.578 -20.665 -15.467 1.00 0.00 C +ATOM 2196 HD2 LYS 308 -9.666 -21.617 -15.710 1.00 0.00 H +ATOM 2197 HD3 LYS 308 -10.102 -20.084 -16.067 1.00 0.00 H +ATOM 2198 CE LYS 308 -8.105 -20.270 -15.570 1.00 0.00 C +ATOM 2199 HE2 LYS 308 -7.729 -20.632 -16.413 1.00 0.00 H +ATOM 2200 HE3 LYS 308 -8.031 -19.281 -15.549 1.00 0.00 H +ATOM 2201 NZ LYS 308 -7.345 -20.845 -14.406 1.00 0.00 N +ATOM 2202 HZ1 LYS 308 -6.403 -21.012 -14.685 1.00 0.00 H +ATOM 2203 HZ2 LYS 308 -7.367 -20.193 -13.652 1.00 0.00 H +ATOM 2204 HZ3 LYS 308 -7.775 -21.701 -14.130 1.00 0.00 H +ATOM 2205 C LYS 308 -11.812 -19.834 -11.569 1.00 0.00 C +ATOM 2206 O LYS 308 -10.761 -19.522 -11.011 1.00 0.00 O +ATOM 2207 N GLN 309 -12.916 -19.093 -11.480 1.00 0.00 N +ATOM 2208 H GLN 309 -13.738 -19.468 -11.979 1.00 0.00 H +ATOM 2209 CA GLN 309 -12.922 -17.846 -10.722 1.00 0.00 C +ATOM 2210 HA GLN 309 -11.984 -17.463 -10.743 1.00 0.00 H +ATOM 2211 CB GLN 309 -13.872 -16.832 -11.364 1.00 0.00 C +ATOM 2212 HB2 GLN 309 -14.777 -17.254 -11.456 1.00 0.00 H +ATOM 2213 HB3 GLN 309 -13.944 -16.033 -10.761 1.00 0.00 H +ATOM 2214 CG GLN 309 -13.433 -16.350 -12.736 1.00 0.00 C +ATOM 2215 HG2 GLN 309 -13.461 -17.122 -13.371 1.00 0.00 H +ATOM 2216 HG3 GLN 309 -14.067 -15.641 -13.045 1.00 0.00 H +ATOM 2217 CD GLN 309 -12.032 -15.779 -12.731 1.00 0.00 C +ATOM 2218 OE1 GLN 309 -11.704 -14.917 -11.908 1.00 0.00 O +ATOM 2219 NE2 GLN 309 -11.196 -16.252 -13.647 1.00 0.00 N +ATOM 2220 HE21 GLN 309 -10.241 -15.906 -13.714 1.00 0.00 H +ATOM 2221 HE22 GLN 309 -11.525 -16.973 -14.288 1.00 0.00 H +ATOM 2222 C GLN 309 -13.304 -18.048 -9.253 1.00 0.00 C +ATOM 2223 O GLN 309 -13.660 -17.099 -8.564 1.00 0.00 O +ATOM 2224 N ARG 310 -13.260 -19.298 -8.798 1.00 0.00 N +ATOM 2225 H ARG 310 -12.992 -20.009 -9.518 1.00 0.00 H +ATOM 2226 CA ARG 310 -13.561 -19.655 -7.407 1.00 0.00 C +ATOM 2227 HA ARG 310 -13.294 -20.640 -7.265 1.00 0.00 H +ATOM 2228 CB ARG 310 -12.605 -18.913 -6.455 1.00 0.00 C +ATOM 2229 HB2 ARG 310 -12.560 -17.965 -6.736 1.00 0.00 H +ATOM 2230 HB3 ARG 310 -12.956 -18.996 -5.534 1.00 0.00 H +ATOM 2231 CG ARG 310 -11.176 -19.478 -6.468 1.00 0.00 C +ATOM 2232 HG2 ARG 310 -11.160 -20.344 -5.969 1.00 0.00 H +ATOM 2233 HG3 ARG 310 -10.892 -19.632 -7.414 1.00 0.00 H +ATOM 2234 CD ARG 310 -10.153 -18.538 -5.816 1.00 0.00 C +ATOM 2235 HD2 ARG 310 -9.293 -19.041 -5.725 1.00 0.00 H +ATOM 2236 HD3 ARG 310 -10.021 -17.760 -6.432 1.00 0.00 H +ATOM 2237 NE ARG 310 -10.570 -18.050 -4.501 1.00 0.00 N +ATOM 2238 HE ARG 310 -10.736 -17.054 -4.406 1.00 0.00 H +ATOM 2239 CZ ARG 310 -10.749 -18.806 -3.424 1.00 0.00 C +ATOM 2240 NH1 ARG 310 -10.551 -20.116 -3.478 1.00 0.00 N +ATOM 2241 HH11 ARG 310 -10.245 -20.553 -4.321 1.00 0.00 H +ATOM 2242 HH12 ARG 310 -10.709 -20.678 -2.659 1.00 0.00 H +ATOM 2243 NH2 ARG 310 -11.135 -18.238 -2.288 1.00 0.00 N +ATOM 2244 HH21 ARG 310 -11.270 -17.247 -2.242 1.00 0.00 H +ATOM 2245 HH22 ARG 310 -11.291 -18.800 -1.475 1.00 0.00 H +ATOM 2246 C ARG 310 -15.009 -19.484 -6.950 1.00 0.00 C +ATOM 2247 O ARG 310 -15.268 -19.281 -5.769 1.00 0.00 O +ATOM 2248 N GLY 311 -15.940 -19.577 -7.895 1.00 0.00 N +ATOM 2249 H GLY 311 -15.578 -19.721 -8.854 1.00 0.00 H +ATOM 2250 CA GLY 311 -17.353 -19.479 -7.568 1.00 0.00 C +ATOM 2251 HA2 GLY 311 -17.898 -19.492 -8.441 1.00 0.00 H +ATOM 2252 HA3 GLY 311 -17.638 -20.331 -7.066 1.00 0.00 H +ATOM 2253 C GLY 311 -17.759 -18.269 -6.753 1.00 0.00 C +ATOM 2254 O GLY 311 -17.192 -17.194 -6.911 1.00 0.00 O +ATOM 2255 N TRP 312 -18.734 -18.445 -5.866 1.00 0.00 N +ATOM 2256 H TRP 312 -19.110 -19.405 -5.810 1.00 0.00 H +ATOM 2257 CA TRP 312 -19.204 -17.337 -5.056 1.00 0.00 C +ATOM 2258 HA TRP 312 -19.419 -16.563 -5.681 1.00 0.00 H +ATOM 2259 CB TRP 312 -20.528 -17.714 -4.385 1.00 0.00 C +ATOM 2260 HB2 TRP 312 -20.415 -18.561 -3.904 1.00 0.00 H +ATOM 2261 HB3 TRP 312 -20.812 -16.981 -3.798 1.00 0.00 H +ATOM 2262 CG TRP 312 -21.611 -17.918 -5.408 1.00 0.00 C +ATOM 2263 CD1 TRP 312 -22.114 -19.110 -5.855 1.00 0.00 C +ATOM 2264 HD1 TRP 312 -21.844 -20.009 -5.517 1.00 0.00 H +ATOM 2265 NE1 TRP 312 -23.050 -18.891 -6.843 1.00 0.00 N +ATOM 2266 HE1 TRP 312 -23.559 -19.598 -7.327 1.00 0.00 H +ATOM 2267 CE2 TRP 312 -23.165 -17.541 -7.050 1.00 0.00 C +ATOM 2268 CZ2 TRP 312 -23.979 -16.829 -7.943 1.00 0.00 C +ATOM 2269 HZ2 TRP 312 -24.602 -17.321 -8.557 1.00 0.00 H +ATOM 2270 CH2 TRP 312 -23.884 -15.462 -7.937 1.00 0.00 C +ATOM 2271 HH2 TRP 312 -24.446 -14.917 -8.558 1.00 0.00 H +ATOM 2272 CZ3 TRP 312 -23.001 -14.790 -7.064 1.00 0.00 C +ATOM 2273 HZ3 TRP 312 -22.953 -13.799 -7.082 1.00 0.00 H +ATOM 2274 CE3 TRP 312 -22.194 -15.496 -6.178 1.00 0.00 C +ATOM 2275 HE3 TRP 312 -21.575 -15.010 -5.568 1.00 0.00 H +ATOM 2276 CD2 TRP 312 -22.273 -16.895 -6.162 1.00 0.00 C +ATOM 2277 C TRP 312 -18.173 -16.830 -4.049 1.00 0.00 C +ATOM 2278 O TRP 312 -18.248 -15.684 -3.600 1.00 0.00 O +ATOM 2279 N ASP 313 -17.200 -17.662 -3.693 1.00 0.00 N +ATOM 2280 H ASP 313 -17.237 -18.598 -4.090 1.00 0.00 H +ATOM 2281 CA ASP 313 -16.167 -17.185 -2.776 1.00 0.00 C +ATOM 2282 HA ASP 313 -16.623 -16.709 -2.041 1.00 0.00 H +ATOM 2283 CB ASP 313 -15.235 -18.307 -2.338 1.00 0.00 C +ATOM 2284 HB2 ASP 313 -14.914 -18.779 -3.151 1.00 0.00 H +ATOM 2285 HB3 ASP 313 -14.473 -17.903 -1.846 1.00 0.00 H +ATOM 2286 CG ASP 313 -15.921 -19.311 -1.433 1.00 0.00 C +ATOM 2287 OD1 ASP 313 -16.655 -18.880 -0.517 1.00 0.00 O +ATOM 2288 OD2 ASP 313 -15.721 -20.525 -1.634 1.00 0.00 O +ATOM 2289 C ASP 313 -15.376 -16.151 -3.561 1.00 0.00 C +ATOM 2290 O ASP 313 -14.967 -15.123 -3.014 1.00 0.00 O +ATOM 2291 N GLY 314 -15.181 -16.427 -4.850 1.00 0.00 N +ATOM 2292 H GLY 314 -15.578 -17.322 -5.173 1.00 0.00 H +ATOM 2293 CA GLY 314 -14.453 -15.501 -5.703 1.00 0.00 C +ATOM 2294 HA2 GLY 314 -13.563 -15.285 -5.285 1.00 0.00 H +ATOM 2295 HA3 GLY 314 -14.285 -15.929 -6.599 1.00 0.00 H +ATOM 2296 C GLY 314 -15.239 -14.212 -5.902 1.00 0.00 C +ATOM 2297 O GLY 314 -14.670 -13.125 -5.933 1.00 0.00 O +ATOM 2298 N PHE 315 -16.550 -14.349 -6.055 1.00 0.00 N +ATOM 2299 H PHE 315 -16.884 -15.342 -6.033 1.00 0.00 H +ATOM 2300 CA PHE 315 -17.450 -13.216 -6.238 1.00 0.00 C +ATOM 2301 HA PHE 315 -17.134 -12.716 -7.046 1.00 0.00 H +ATOM 2302 CB PHE 315 -18.892 -13.727 -6.340 1.00 0.00 C +ATOM 2303 HB2 PHE 315 -18.956 -14.288 -7.155 1.00 0.00 H +ATOM 2304 HB3 PHE 315 -19.080 -14.264 -5.527 1.00 0.00 H +ATOM 2305 CG PHE 315 -19.936 -12.648 -6.435 1.00 0.00 C +ATOM 2306 CD1 PHE 315 -20.142 -11.951 -7.624 1.00 0.00 C +ATOM 2307 HD1 PHE 315 -19.563 -12.131 -8.412 1.00 0.00 H +ATOM 2308 CE1 PHE 315 -21.157 -10.998 -7.728 1.00 0.00 C +ATOM 2309 HE1 PHE 315 -21.297 -10.515 -8.595 1.00 0.00 H +ATOM 2310 CZ PHE 315 -21.963 -10.728 -6.626 1.00 0.00 C +ATOM 2311 HZ PHE 315 -22.686 -10.044 -6.694 1.00 0.00 H +ATOM 2312 CE2 PHE 315 -21.756 -11.415 -5.433 1.00 0.00 C +ATOM 2313 HE2 PHE 315 -22.341 -11.225 -4.628 1.00 0.00 H +ATOM 2314 CD2 PHE 315 -20.746 -12.361 -5.342 1.00 0.00 C +ATOM 2315 HD2 PHE 315 -20.598 -12.845 -4.478 1.00 0.00 H +ATOM 2316 C PHE 315 -17.323 -12.260 -5.052 1.00 0.00 C +ATOM 2317 O PHE 315 -17.168 -11.053 -5.223 1.00 0.00 O +ATOM 2318 N VAL 316 -17.398 -12.819 -3.850 1.00 0.00 N +ATOM 2319 H VAL 316 -17.527 -13.853 -3.859 1.00 0.00 H +ATOM 2320 CA VAL 316 -17.305 -12.036 -2.627 1.00 0.00 C +ATOM 2321 HA VAL 316 -18.019 -11.319 -2.655 1.00 0.00 H +ATOM 2322 CB VAL 316 -17.572 -12.943 -1.391 1.00 0.00 C +ATOM 2323 HB VAL 316 -16.970 -13.732 -1.470 1.00 0.00 H +ATOM 2324 CG1 VAL 316 -17.214 -12.225 -0.108 1.00 0.00 C +ATOM 2325 HG11 VAL 316 -16.431 -12.675 0.324 1.00 0.00 H +ATOM 2326 HG12 VAL 316 -16.978 -11.273 -0.308 1.00 0.00 H +ATOM 2327 HG13 VAL 316 -17.993 -12.246 0.520 1.00 0.00 H +ATOM 2328 CG2 VAL 316 -19.034 -13.352 -1.366 1.00 0.00 C +ATOM 2329 HG21 VAL 316 -19.224 -13.853 -0.521 1.00 0.00 H +ATOM 2330 HG22 VAL 316 -19.608 -12.534 -1.407 1.00 0.00 H +ATOM 2331 HG23 VAL 316 -19.228 -13.938 -2.153 1.00 0.00 H +ATOM 2332 C VAL 316 -15.951 -11.338 -2.486 1.00 0.00 C +ATOM 2333 O VAL 316 -15.879 -10.180 -2.059 1.00 0.00 O +ATOM 2334 N GLU 317 -14.883 -12.042 -2.854 1.00 0.00 N +ATOM 2335 H GLU 317 -15.092 -13.000 -3.199 1.00 0.00 H +ATOM 2336 CA GLU 317 -13.536 -11.493 -2.772 1.00 0.00 C +ATOM 2337 HA GLU 317 -13.370 -11.138 -1.844 1.00 0.00 H +ATOM 2338 CB GLU 317 -12.481 -12.571 -3.051 1.00 0.00 C +ATOM 2339 HB2 GLU 317 -12.613 -12.880 -3.983 1.00 0.00 H +ATOM 2340 HB3 GLU 317 -11.592 -12.152 -2.938 1.00 0.00 H +ATOM 2341 CG GLU 317 -12.538 -13.785 -2.149 1.00 0.00 C +ATOM 2342 HG2 GLU 317 -12.380 -13.497 -1.226 1.00 0.00 H +ATOM 2343 HG3 GLU 317 -13.405 -14.225 -2.268 1.00 0.00 H +ATOM 2344 CD GLU 317 -11.460 -14.806 -2.497 1.00 0.00 C +ATOM 2345 OE1 GLU 317 -11.286 -15.099 -3.704 1.00 0.00 O +ATOM 2346 OE2 GLU 317 -10.791 -15.314 -1.570 1.00 0.00 O +ATOM 2347 C GLU 317 -13.347 -10.373 -3.785 1.00 0.00 C +ATOM 2348 O GLU 317 -12.708 -9.370 -3.488 1.00 0.00 O +ATOM 2349 N PHE 318 -13.903 -10.554 -4.982 1.00 0.00 N +ATOM 2350 H PHE 318 -14.429 -11.445 -5.085 1.00 0.00 H +ATOM 2351 CA PHE 318 -13.772 -9.570 -6.046 1.00 0.00 C +ATOM 2352 HA PHE 318 -12.782 -9.417 -6.185 1.00 0.00 H +ATOM 2353 CB PHE 318 -14.452 -10.090 -7.317 1.00 0.00 C +ATOM 2354 HB2 PHE 318 -14.103 -10.997 -7.496 1.00 0.00 H +ATOM 2355 HB3 PHE 318 -15.427 -10.104 -7.153 1.00 0.00 H +ATOM 2356 CG PHE 318 -14.196 -9.244 -8.532 1.00 0.00 C +ATOM 2357 CD1 PHE 318 -12.948 -9.247 -9.151 1.00 0.00 C +ATOM 2358 HD1 PHE 318 -12.214 -9.809 -8.785 1.00 0.00 H +ATOM 2359 CE1 PHE 318 -12.711 -8.470 -10.285 1.00 0.00 C +ATOM 2360 HE1 PHE 318 -11.806 -8.485 -10.717 1.00 0.00 H +ATOM 2361 CZ PHE 318 -13.733 -7.679 -10.806 1.00 0.00 C +ATOM 2362 HZ PHE 318 -13.569 -7.123 -11.616 1.00 0.00 H +ATOM 2363 CE2 PHE 318 -14.986 -7.671 -10.188 1.00 0.00 C +ATOM 2364 HE2 PHE 318 -15.731 -7.098 -10.559 1.00 0.00 H +ATOM 2365 CD2 PHE 318 -15.206 -8.450 -9.061 1.00 0.00 C +ATOM 2366 HD2 PHE 318 -16.107 -8.441 -8.622 1.00 0.00 H +ATOM 2367 C PHE 318 -14.374 -8.229 -5.662 1.00 0.00 C +ATOM 2368 O PHE 318 -13.821 -7.177 -5.980 1.00 0.00 O +ATOM 2369 N PHE 319 -15.495 -8.275 -4.950 1.00 0.00 N +ATOM 2370 H PHE 319 -15.820 -9.231 -4.708 1.00 0.00 H +ATOM 2371 CA PHE 319 -16.196 -7.061 -4.551 1.00 0.00 C +ATOM 2372 HA PHE 319 -15.856 -6.310 -5.159 1.00 0.00 H +ATOM 2373 CB PHE 319 -17.685 -7.247 -4.792 1.00 0.00 C +ATOM 2374 HB2 PHE 319 -17.942 -8.144 -4.459 1.00 0.00 H +ATOM 2375 HB3 PHE 319 -18.168 -6.534 -4.303 1.00 0.00 H +ATOM 2376 CG PHE 319 -18.090 -7.163 -6.243 1.00 0.00 C +ATOM 2377 CD1 PHE 319 -18.040 -5.950 -6.913 1.00 0.00 C +ATOM 2378 HD1 PHE 319 -17.728 -5.131 -6.441 1.00 0.00 H +ATOM 2379 CE1 PHE 319 -18.422 -5.856 -8.254 1.00 0.00 C +ATOM 2380 HE1 PHE 319 -18.436 -4.956 -8.701 1.00 0.00 H +ATOM 2381 CZ PHE 319 -18.780 -7.001 -8.956 1.00 0.00 C +ATOM 2382 HZ PHE 319 -19.001 -6.942 -9.925 1.00 0.00 H +ATOM 2383 CE2 PHE 319 -18.824 -8.218 -8.294 1.00 0.00 C +ATOM 2384 HE2 PHE 319 -19.135 -9.053 -8.780 1.00 0.00 H +ATOM 2385 CD2 PHE 319 -18.445 -8.302 -6.964 1.00 0.00 C +ATOM 2386 HD2 PHE 319 -18.424 -9.195 -6.510 1.00 0.00 H +ATOM 2387 C PHE 319 -15.959 -6.591 -3.113 1.00 0.00 C +ATOM 2388 O PHE 319 -16.508 -5.563 -2.702 1.00 0.00 O +ATOM 2389 N HIE 320 -15.142 -7.327 -2.360 1.00 0.00 N +ATOM 2390 H HIE 320 -14.746 -8.163 -2.844 1.00 0.00 H +ATOM 2391 CA HIE 320 -14.827 -6.989 -0.970 1.00 0.00 C +ATOM 2392 HA HIE 320 -15.658 -7.155 -0.409 1.00 0.00 H +ATOM 2393 CB HIE 320 -13.721 -7.908 -0.459 1.00 0.00 C +ATOM 2394 HB2 HIE 320 -14.045 -8.860 -0.483 1.00 0.00 H +ATOM 2395 HB3 HIE 320 -12.921 -7.827 -1.063 1.00 0.00 H +ATOM 2396 CG HIE 320 -13.281 -7.599 0.943 1.00 0.00 C +ATOM 2397 ND1 HIE 320 -12.082 -7.001 1.233 1.00 0.00 N +ATOM 2398 CE1 HIE 320 -11.992 -6.810 2.544 1.00 0.00 C +ATOM 2399 HE1 HIE 320 -11.224 -6.395 3.018 1.00 0.00 H +ATOM 2400 NE2 HIE 320 -13.094 -7.268 3.099 1.00 0.00 N +ATOM 2401 HE2 HIE 320 -13.305 -7.253 4.087 1.00 0.00 H +ATOM 2402 CD2 HIE 320 -13.922 -7.773 2.122 1.00 0.00 C +ATOM 2403 HD2 HIE 320 -14.814 -8.185 2.260 1.00 0.00 H +ATOM 2404 C HIE 320 -14.408 -5.537 -0.782 1.00 0.00 C +ATOM 2405 O HIE 320 -13.615 -5.004 -1.559 1.00 0.00 O +ATOM 2406 N VAL 321 -14.952 -4.910 0.258 1.00 0.00 N +ATOM 2407 H VAL 321 -15.604 -5.489 0.824 1.00 0.00 H +ATOM 2408 CA VAL 321 -14.645 -3.513 0.566 1.00 0.00 C +ATOM 2409 HA VAL 321 -14.327 -3.069 -0.278 1.00 0.00 H +ATOM 2410 CB VAL 321 -15.896 -2.762 1.098 1.00 0.00 C +ATOM 2411 HB VAL 321 -15.663 -1.800 1.156 1.00 0.00 H +ATOM 2412 CG1 VAL 321 -17.041 -2.889 0.101 1.00 0.00 C +ATOM 2413 HG11 VAL 321 -16.676 -2.876 -0.829 1.00 0.00 H +ATOM 2414 HG12 VAL 321 -17.525 -3.750 0.257 1.00 0.00 H +ATOM 2415 HG13 VAL 321 -17.674 -2.125 0.221 1.00 0.00 H +ATOM 2416 CG2 VAL 321 -16.310 -3.320 2.445 1.00 0.00 C +ATOM 2417 HG21 VAL 321 -16.918 -4.103 2.309 1.00 0.00 H +ATOM 2418 HG22 VAL 321 -15.496 -3.613 2.949 1.00 0.00 H +ATOM 2419 HG23 VAL 321 -16.789 -2.612 2.966 1.00 0.00 H +ATOM 2420 C VAL 321 -13.520 -3.423 1.597 1.00 0.00 C +ATOM 2421 O VAL 321 -12.468 -2.832 1.254 1.00 0.00 O +ATOM 2422 OXT VAL 321 -13.431 -3.824 2.731 1.00 0.00 O +END diff --git a/receptor/pdb_files/AFv6_MCL1_171-321_wt_H.pdb b/receptor/pdb_files/AFv6_MCL1_171-321_wt_H.pdb new file mode 100644 index 0000000..f2b62fe --- /dev/null +++ b/receptor/pdb_files/AFv6_MCL1_171-321_wt_H.pdb @@ -0,0 +1,2455 @@ +HELIX 1 1 ASP 172 THR 191 1 20 +HELIX 2 2 GLY 203 ASN 223 1 21 +HELIX 3 3 GLU 225 LEU 235 1 11 +HELIX 4 4 GLU 240 PHE 254 1 15 +HELIX 5 5 TRP 261 THR 280 1 20 +HELIX 6 6 GLU 284 LYS 308 1 25 +HELIX 7 7 GLY 311 HIE 320 1 10 +ATOM 1 N GLU 171 -21.539 -30.540 -8.894 1.00 0.00 N +ATOM 2 H1 GLU 171 -22.092 -30.516 -8.049 1.00 0.00 H +ATOM 3 H2 GLU 171 -20.728 -29.951 -8.769 1.00 0.00 H +ATOM 4 H3 GLU 171 -21.424 -31.502 -9.179 1.00 0.00 H +ATOM 5 CA GLU 171 -22.307 -29.917 -9.952 1.00 0.00 C +ATOM 6 HA GLU 171 -21.764 -29.057 -10.347 1.00 0.00 H +ATOM 7 CB GLU 171 -22.546 -30.912 -11.093 1.00 0.00 C +ATOM 8 HB2 GLU 171 -22.717 -31.898 -10.660 1.00 0.00 H +ATOM 9 HB3 GLU 171 -23.433 -30.598 -11.644 1.00 0.00 H +ATOM 10 CG GLU 171 -21.347 -30.975 -12.050 1.00 0.00 C +ATOM 11 HG2 GLU 171 -21.098 -29.917 -12.125 1.00 0.00 H +ATOM 12 HG3 GLU 171 -20.481 -31.526 -11.682 1.00 0.00 H +ATOM 13 CD GLU 171 -21.738 -31.506 -13.431 1.00 0.00 C +ATOM 14 OE1 GLU 171 -20.925 -32.237 -14.031 1.00 0.00 O +ATOM 15 OE2 GLU 171 -22.779 -31.019 -13.947 1.00 0.00 O +ATOM 16 C GLU 171 -23.637 -29.350 -9.453 1.00 0.00 C +ATOM 17 O GLU 171 -23.992 -28.209 -9.793 1.00 0.00 O +ATOM 18 N ASP 172 -24.327 -30.123 -8.625 1.00 0.00 N +ATOM 19 H ASP 172 -23.970 -31.052 -8.450 1.00 0.00 H +ATOM 20 CA ASP 172 -25.595 -29.748 -8.023 1.00 0.00 C +ATOM 21 HA ASP 172 -26.244 -29.271 -8.758 1.00 0.00 H +ATOM 22 CB ASP 172 -26.288 -31.016 -7.505 1.00 0.00 C +ATOM 23 HB2 ASP 172 -25.453 -31.555 -7.059 1.00 0.00 H +ATOM 24 HB3 ASP 172 -27.040 -30.816 -6.742 1.00 0.00 H +ATOM 25 CG ASP 172 -26.908 -31.866 -8.624 1.00 0.00 C +ATOM 26 OD1 ASP 172 -27.081 -31.331 -9.747 1.00 0.00 O +ATOM 27 OD2 ASP 172 -27.332 -32.994 -8.297 1.00 0.00 O +ATOM 28 C ASP 172 -25.423 -28.704 -6.915 1.00 0.00 C +ATOM 29 O ASP 172 -26.259 -27.806 -6.781 1.00 0.00 O +ATOM 30 N GLU 173 -24.321 -28.732 -6.158 1.00 0.00 N +ATOM 31 H GLU 173 -23.668 -29.494 -6.264 1.00 0.00 H +ATOM 32 CA GLU 173 -24.092 -27.764 -5.081 1.00 0.00 C +ATOM 33 HA GLU 173 -24.993 -27.661 -4.477 1.00 0.00 H +ATOM 34 CB GLU 173 -22.944 -28.236 -4.175 1.00 0.00 C +ATOM 35 HB2 GLU 173 -23.206 -29.236 -3.828 1.00 0.00 H +ATOM 36 HB3 GLU 173 -22.052 -28.291 -4.800 1.00 0.00 H +ATOM 37 CG GLU 173 -22.665 -27.327 -2.961 1.00 0.00 C +ATOM 38 HG2 GLU 173 -21.789 -27.743 -2.463 1.00 0.00 H +ATOM 39 HG3 GLU 173 -22.416 -26.350 -3.377 1.00 0.00 H +ATOM 40 CD GLU 173 -23.813 -27.174 -1.941 1.00 0.00 C +ATOM 41 OE1 GLU 173 -23.716 -26.295 -1.050 1.00 0.00 O +ATOM 42 OE2 GLU 173 -24.847 -27.881 -1.961 1.00 0.00 O +ATOM 43 C GLU 173 -23.869 -26.342 -5.618 1.00 0.00 C +ATOM 44 O GLU 173 -24.464 -25.398 -5.088 1.00 0.00 O +ATOM 45 N LEU 174 -23.090 -26.164 -6.698 1.00 0.00 N +ATOM 46 H LEU 174 -22.566 -26.943 -7.070 1.00 0.00 H +ATOM 47 CA LEU 174 -22.914 -24.843 -7.323 1.00 0.00 C +ATOM 48 HA LEU 174 -22.586 -24.121 -6.574 1.00 0.00 H +ATOM 49 CB LEU 174 -21.853 -24.912 -8.440 1.00 0.00 C +ATOM 50 HB2 LEU 174 -20.935 -25.266 -7.969 1.00 0.00 H +ATOM 51 HB3 LEU 174 -22.188 -25.640 -9.179 1.00 0.00 H +ATOM 52 CG LEU 174 -21.585 -23.557 -9.136 1.00 0.00 C +ATOM 53 HG LEU 174 -22.536 -23.174 -9.504 1.00 0.00 H +ATOM 54 CD1 LEU 174 -20.950 -22.527 -8.195 1.00 0.00 C +ATOM 55 HD11 LEU 174 -19.998 -22.909 -7.827 1.00 0.00 H +ATOM 56 HD12 LEU 174 -20.782 -21.595 -8.734 1.00 0.00 H +ATOM 57 HD13 LEU 174 -21.617 -22.344 -7.352 1.00 0.00 H +ATOM 58 CD2 LEU 174 -20.655 -23.748 -10.333 1.00 0.00 C +ATOM 59 HD21 LEU 174 -21.116 -24.428 -11.048 1.00 0.00 H +ATOM 60 HD22 LEU 174 -20.476 -22.785 -10.812 1.00 0.00 H +ATOM 61 HD23 LEU 174 -19.707 -24.166 -9.994 1.00 0.00 H +ATOM 62 C LEU 174 -24.243 -24.308 -7.870 1.00 0.00 C +ATOM 63 O LEU 174 -24.538 -23.117 -7.724 1.00 0.00 O +ATOM 64 N TYR 175 -25.052 -25.176 -8.485 1.00 0.00 N +ATOM 65 H TYR 175 -24.720 -26.115 -8.653 1.00 0.00 H +ATOM 66 CA TYR 175 -26.368 -24.805 -8.996 1.00 0.00 C +ATOM 67 HA TYR 175 -26.284 -23.936 -9.648 1.00 0.00 H +ATOM 68 CB TYR 175 -26.963 -25.964 -9.801 1.00 0.00 C +ATOM 69 HB2 TYR 175 -26.256 -26.295 -10.561 1.00 0.00 H +ATOM 70 HB3 TYR 175 -27.142 -26.774 -9.094 1.00 0.00 H +ATOM 71 CG TYR 175 -28.268 -25.576 -10.460 1.00 0.00 C +ATOM 72 CD1 TYR 175 -29.486 -25.721 -9.767 1.00 0.00 C +ATOM 73 HD1 TYR 175 -29.495 -26.151 -8.766 1.00 0.00 H +ATOM 74 CE1 TYR 175 -30.690 -25.310 -10.369 1.00 0.00 C +ATOM 75 HE1 TYR 175 -31.629 -25.390 -9.820 1.00 0.00 H +ATOM 76 CZ TYR 175 -30.678 -24.769 -11.668 1.00 0.00 C +ATOM 77 OH TYR 175 -31.846 -24.418 -12.258 1.00 0.00 O +ATOM 78 HH TYR 175 -32.611 -24.581 -11.701 1.00 0.00 H +ATOM 79 CE2 TYR 175 -29.454 -24.625 -12.355 1.00 0.00 C +ATOM 80 HE2 TYR 175 -29.445 -24.200 -13.359 1.00 0.00 H +ATOM 81 CD2 TYR 175 -28.251 -25.025 -11.752 1.00 0.00 C +ATOM 82 HD2 TYR 175 -27.308 -24.908 -12.286 1.00 0.00 H +ATOM 83 C TYR 175 -27.301 -24.382 -7.860 1.00 0.00 C +ATOM 84 O TYR 175 -27.832 -23.271 -7.869 1.00 0.00 O +ATOM 85 N ARG 176 -27.428 -25.226 -6.831 1.00 0.00 N +ATOM 86 H ARG 176 -26.933 -26.104 -6.902 1.00 0.00 H +ATOM 87 CA ARG 176 -28.265 -24.993 -5.652 1.00 0.00 C +ATOM 88 HA ARG 176 -29.313 -24.866 -5.927 1.00 0.00 H +ATOM 89 CB ARG 176 -28.142 -26.233 -4.753 1.00 0.00 C +ATOM 90 HB2 ARG 176 -28.266 -27.113 -5.383 1.00 0.00 H +ATOM 91 HB3 ARG 176 -27.140 -26.233 -4.324 1.00 0.00 H +ATOM 92 CG ARG 176 -29.179 -26.262 -3.625 1.00 0.00 C +ATOM 93 HG2 ARG 176 -29.237 -25.268 -3.182 1.00 0.00 H +ATOM 94 HG3 ARG 176 -30.147 -26.526 -4.051 1.00 0.00 H +ATOM 95 CD ARG 176 -28.799 -27.286 -2.539 1.00 0.00 C +ATOM 96 HD2 ARG 176 -29.628 -27.364 -1.836 1.00 0.00 H +ATOM 97 HD3 ARG 176 -28.638 -28.252 -3.019 1.00 0.00 H +ATOM 98 NE ARG 176 -27.575 -26.918 -1.792 1.00 0.00 N +ATOM 99 HE ARG 176 -26.818 -27.580 -1.883 1.00 0.00 H +ATOM 100 CZ ARG 176 -27.396 -25.859 -1.027 1.00 0.00 C +ATOM 101 NH1 ARG 176 -28.341 -24.989 -0.779 1.00 0.00 N +ATOM 102 HH11 ARG 176 -29.258 -25.116 -1.181 1.00 0.00 H +ATOM 103 HH12 ARG 176 -28.149 -24.194 -0.186 1.00 0.00 H +ATOM 104 NH2 ARG 176 -26.241 -25.617 -0.498 1.00 0.00 N +ATOM 105 HH21 ARG 176 -25.468 -26.244 -0.671 1.00 0.00 H +ATOM 106 HH22 ARG 176 -26.118 -24.801 0.085 1.00 0.00 H +ATOM 107 C ARG 176 -27.860 -23.719 -4.912 1.00 0.00 C +ATOM 108 O ARG 176 -28.725 -22.945 -4.505 1.00 0.00 O +ATOM 109 N GLN 177 -26.558 -23.480 -4.753 1.00 0.00 N +ATOM 110 H GLN 177 -25.902 -24.196 -5.030 1.00 0.00 H +ATOM 111 CA GLN 177 -26.033 -22.260 -4.140 1.00 0.00 C +ATOM 112 HA GLN 177 -26.491 -22.098 -3.164 1.00 0.00 H +ATOM 113 CB GLN 177 -24.513 -22.396 -3.953 1.00 0.00 C +ATOM 114 HB2 GLN 177 -24.299 -23.331 -3.433 1.00 0.00 H +ATOM 115 HB3 GLN 177 -24.032 -22.406 -4.931 1.00 0.00 H +ATOM 116 CG GLN 177 -23.975 -21.220 -3.131 1.00 0.00 C +ATOM 117 HG2 GLN 177 -24.310 -20.281 -3.573 1.00 0.00 H +ATOM 118 HG3 GLN 177 -24.413 -21.330 -2.139 1.00 0.00 H +ATOM 119 CD GLN 177 -22.461 -21.178 -2.993 1.00 0.00 C +ATOM 120 OE1 GLN 177 -21.697 -21.805 -3.702 1.00 0.00 O +ATOM 121 NE2 GLN 177 -21.967 -20.373 -2.081 1.00 0.00 N +ATOM 122 HE21 GLN 177 -20.967 -20.312 -1.953 1.00 0.00 H +ATOM 123 HE22 GLN 177 -22.590 -19.819 -1.511 1.00 0.00 H +ATOM 124 C GLN 177 -26.371 -21.019 -4.978 1.00 0.00 C +ATOM 125 O GLN 177 -26.834 -20.015 -4.435 1.00 0.00 O +ATOM 126 N SER 178 -26.163 -21.087 -6.295 1.00 0.00 N +ATOM 127 H SER 178 -25.752 -21.928 -6.675 1.00 0.00 H +ATOM 128 CA SER 178 -26.452 -19.977 -7.213 1.00 0.00 C +ATOM 129 HA SER 178 -25.930 -19.079 -6.882 1.00 0.00 H +ATOM 130 CB SER 178 -25.986 -20.318 -8.630 1.00 0.00 C +ATOM 131 HB2 SER 178 -26.538 -21.187 -8.988 1.00 0.00 H +ATOM 132 HB3 SER 178 -26.182 -19.468 -9.284 1.00 0.00 H +ATOM 133 OG SER 178 -24.601 -20.605 -8.634 1.00 0.00 O +ATOM 134 HG SER 178 -24.321 -20.817 -9.527 1.00 0.00 H +ATOM 135 C SER 178 -27.939 -19.632 -7.225 1.00 0.00 C +ATOM 136 O SER 178 -28.290 -18.458 -7.098 1.00 0.00 O +ATOM 137 N LEU 179 -28.800 -20.652 -7.278 1.00 0.00 N +ATOM 138 H LEU 179 -28.429 -21.584 -7.403 1.00 0.00 H +ATOM 139 CA LEU 179 -30.248 -20.487 -7.227 1.00 0.00 C +ATOM 140 HA LEU 179 -30.579 -19.816 -8.020 1.00 0.00 H +ATOM 141 CB LEU 179 -30.932 -21.854 -7.421 1.00 0.00 C +ATOM 142 HB2 LEU 179 -30.526 -22.298 -8.330 1.00 0.00 H +ATOM 143 HB3 LEU 179 -30.669 -22.475 -6.565 1.00 0.00 H +ATOM 144 CG LEU 179 -32.466 -21.761 -7.537 1.00 0.00 C +ATOM 145 HG LEU 179 -32.852 -21.314 -6.621 1.00 0.00 H +ATOM 146 CD1 LEU 179 -32.896 -20.918 -8.735 1.00 0.00 C +ATOM 147 HD11 LEU 179 -32.512 -21.365 -9.652 1.00 0.00 H +ATOM 148 HD12 LEU 179 -33.985 -20.879 -8.780 1.00 0.00 H +ATOM 149 HD13 LEU 179 -32.500 -19.908 -8.630 1.00 0.00 H +ATOM 150 CD2 LEU 179 -33.047 -23.163 -7.705 1.00 0.00 C +ATOM 151 HD21 LEU 179 -32.783 -23.772 -6.841 1.00 0.00 H +ATOM 152 HD22 LEU 179 -34.131 -23.100 -7.787 1.00 0.00 H +ATOM 153 HD23 LEU 179 -32.641 -23.619 -8.607 1.00 0.00 H +ATOM 154 C LEU 179 -30.682 -19.844 -5.911 1.00 0.00 C +ATOM 155 O LEU 179 -31.489 -18.917 -5.915 1.00 0.00 O +ATOM 156 N GLU 180 -30.121 -20.285 -4.781 1.00 0.00 N +ATOM 157 H GLU 180 -29.515 -21.091 -4.825 1.00 0.00 H +ATOM 158 CA GLU 180 -30.434 -19.722 -3.466 1.00 0.00 C +ATOM 159 HA GLU 180 -31.509 -19.748 -3.291 1.00 0.00 H +ATOM 160 CB GLU 180 -29.735 -20.551 -2.368 1.00 0.00 C +ATOM 161 HB2 GLU 180 -30.141 -21.563 -2.390 1.00 0.00 H +ATOM 162 HB3 GLU 180 -28.668 -20.584 -2.589 1.00 0.00 H +ATOM 163 CG GLU 180 -29.949 -19.946 -0.975 1.00 0.00 C +ATOM 164 HG2 GLU 180 -29.255 -19.106 -0.949 1.00 0.00 H +ATOM 165 HG3 GLU 180 -30.970 -19.575 -0.881 1.00 0.00 H +ATOM 166 CD GLU 180 -29.642 -20.899 0.188 1.00 0.00 C +ATOM 167 OE1 GLU 180 -30.475 -20.901 1.127 1.00 0.00 O +ATOM 168 OE2 GLU 180 -28.581 -21.569 0.227 1.00 0.00 O +ATOM 169 C GLU 180 -30.079 -18.227 -3.378 1.00 0.00 C +ATOM 170 O GLU 180 -30.871 -17.436 -2.862 1.00 0.00 O +ATOM 171 N ILE 181 -28.918 -17.825 -3.898 1.00 0.00 N +ATOM 172 H ILE 181 -28.288 -18.528 -4.258 1.00 0.00 H +ATOM 173 CA ILE 181 -28.466 -16.426 -3.883 1.00 0.00 C +ATOM 174 HA ILE 181 -28.618 -15.978 -2.901 1.00 0.00 H +ATOM 175 CB ILE 181 -26.965 -16.362 -4.252 1.00 0.00 C +ATOM 176 HB ILE 181 -26.809 -16.933 -5.168 1.00 0.00 H +ATOM 177 CG2 ILE 181 -26.500 -14.911 -4.468 1.00 0.00 C +ATOM 178 HG21 ILE 181 -26.655 -14.340 -3.552 1.00 0.00 H +ATOM 179 HG22 ILE 181 -25.441 -14.903 -4.725 1.00 0.00 H +ATOM 180 HG23 ILE 181 -27.075 -14.462 -5.278 1.00 0.00 H +ATOM 181 CG1 ILE 181 -26.107 -17.017 -3.145 1.00 0.00 C +ATOM 182 HG12 ILE 181 -26.047 -16.318 -2.310 1.00 0.00 H +ATOM 183 HG13 ILE 181 -26.615 -17.925 -2.821 1.00 0.00 H +ATOM 184 CD1 ILE 181 -24.693 -17.365 -3.620 1.00 0.00 C +ATOM 185 HD11 ILE 181 -24.184 -16.456 -3.943 1.00 0.00 H +ATOM 186 HD12 ILE 181 -24.136 -17.822 -2.802 1.00 0.00 H +ATOM 187 HD13 ILE 181 -24.751 -18.064 -4.454 1.00 0.00 H +ATOM 188 C ILE 181 -29.335 -15.562 -4.807 1.00 0.00 C +ATOM 189 O ILE 181 -29.830 -14.512 -4.384 1.00 0.00 O +ATOM 190 N ILE 182 -29.540 -15.997 -6.055 1.00 0.00 N +ATOM 191 H ILE 182 -29.107 -16.869 -6.323 1.00 0.00 H +ATOM 192 CA ILE 182 -30.261 -15.231 -7.082 1.00 0.00 C +ATOM 193 HA ILE 182 -29.915 -14.197 -7.095 1.00 0.00 H +ATOM 194 CB ILE 182 -30.041 -15.865 -8.478 1.00 0.00 C +ATOM 195 HB ILE 182 -30.272 -16.929 -8.413 1.00 0.00 H +ATOM 196 CG2 ILE 182 -30.939 -15.208 -9.546 1.00 0.00 C +ATOM 197 HG21 ILE 182 -30.708 -14.144 -9.610 1.00 0.00 H +ATOM 198 HG22 ILE 182 -30.759 -15.677 -10.512 1.00 0.00 H +ATOM 199 HG23 ILE 182 -31.986 -15.336 -9.270 1.00 0.00 H +ATOM 200 CG1 ILE 182 -28.555 -15.719 -8.891 1.00 0.00 C +ATOM 201 HG12 ILE 182 -28.396 -14.672 -9.148 1.00 0.00 H +ATOM 202 HG13 ILE 182 -27.954 -15.975 -8.020 1.00 0.00 H +ATOM 203 CD1 ILE 182 -28.142 -16.603 -10.073 1.00 0.00 C +ATOM 204 HD11 ILE 182 -28.743 -16.348 -10.947 1.00 0.00 H +ATOM 205 HD12 ILE 182 -27.088 -16.440 -10.299 1.00 0.00 H +ATOM 206 HD13 ILE 182 -28.301 -17.651 -9.817 1.00 0.00 H +ATOM 207 C ILE 182 -31.744 -15.100 -6.719 1.00 0.00 C +ATOM 208 O ILE 182 -32.277 -13.989 -6.739 1.00 0.00 O +ATOM 209 N SER 183 -32.399 -16.194 -6.318 1.00 0.00 N +ATOM 210 H SER 183 -31.900 -17.072 -6.287 1.00 0.00 H +ATOM 211 CA SER 183 -33.830 -16.192 -5.976 1.00 0.00 C +ATOM 212 HA SER 183 -34.397 -15.770 -6.805 1.00 0.00 H +ATOM 213 CB SER 183 -34.348 -17.608 -5.699 1.00 0.00 C +ATOM 214 HB2 SER 183 -33.900 -17.989 -4.781 1.00 0.00 H +ATOM 215 HB3 SER 183 -35.433 -17.586 -5.590 1.00 0.00 H +ATOM 216 OG SER 183 -34.002 -18.446 -6.771 1.00 0.00 O +ATOM 217 HG SER 183 -34.325 -19.333 -6.600 1.00 0.00 H +ATOM 218 C SER 183 -34.118 -15.305 -4.772 1.00 0.00 C +ATOM 219 O SER 183 -35.060 -14.509 -4.798 1.00 0.00 O +ATOM 220 N ARG 184 -33.268 -15.359 -3.735 1.00 0.00 N +ATOM 221 H ARG 184 -32.562 -16.080 -3.703 1.00 0.00 H +ATOM 222 CA ARG 184 -33.385 -14.446 -2.590 1.00 0.00 C +ATOM 223 HA ARG 184 -34.394 -14.504 -2.182 1.00 0.00 H +ATOM 224 CB ARG 184 -32.389 -14.808 -1.487 1.00 0.00 C +ATOM 225 HB2 ARG 184 -31.415 -14.969 -1.948 1.00 0.00 H +ATOM 226 HB3 ARG 184 -32.328 -13.969 -0.795 1.00 0.00 H +ATOM 227 CG ARG 184 -32.809 -16.072 -0.723 1.00 0.00 C +ATOM 228 HG2 ARG 184 -33.742 -15.898 -0.187 1.00 0.00 H +ATOM 229 HG3 ARG 184 -32.936 -16.906 -1.413 1.00 0.00 H +ATOM 230 CD ARG 184 -31.702 -16.404 0.278 1.00 0.00 C +ATOM 231 HD2 ARG 184 -30.753 -16.460 -0.255 1.00 0.00 H +ATOM 232 HD3 ARG 184 -31.652 -15.609 1.023 1.00 0.00 H +ATOM 233 NE ARG 184 -31.933 -17.684 0.967 1.00 0.00 N +ATOM 234 HE ARG 184 -32.006 -18.473 0.343 1.00 0.00 H +ATOM 235 CZ ARG 184 -32.080 -17.889 2.259 1.00 0.00 C +ATOM 236 NH1 ARG 184 -32.196 -16.911 3.112 1.00 0.00 N +ATOM 237 HH11 ARG 184 -32.175 -15.955 2.787 1.00 0.00 H +ATOM 238 HH12 ARG 184 -32.307 -17.114 4.096 1.00 0.00 H +ATOM 239 NH2 ARG 184 -32.074 -19.112 2.698 1.00 0.00 N +ATOM 240 HH21 ARG 184 -31.957 -19.878 2.050 1.00 0.00 H +ATOM 241 HH22 ARG 184 -32.186 -19.291 3.686 1.00 0.00 H +ATOM 242 C ARG 184 -33.206 -12.997 -3.024 1.00 0.00 C +ATOM 243 O ARG 184 -34.047 -12.180 -2.675 1.00 0.00 O +ATOM 244 N TYR 185 -32.179 -12.670 -3.810 1.00 0.00 N +ATOM 245 H TYR 185 -31.489 -13.366 -4.054 1.00 0.00 H +ATOM 246 CA TYR 185 -31.968 -11.292 -4.266 1.00 0.00 C +ATOM 247 HA TYR 185 -31.880 -10.627 -3.407 1.00 0.00 H +ATOM 248 CB TYR 185 -30.679 -11.198 -5.094 1.00 0.00 C +ATOM 249 HB2 TYR 185 -29.843 -11.579 -4.507 1.00 0.00 H +ATOM 250 HB3 TYR 185 -30.836 -11.841 -5.960 1.00 0.00 H +ATOM 251 CG TYR 185 -30.368 -9.787 -5.562 1.00 0.00 C +ATOM 252 CD1 TYR 185 -30.349 -9.492 -6.938 1.00 0.00 C +ATOM 253 HD1 TYR 185 -30.531 -10.284 -7.663 1.00 0.00 H +ATOM 254 CE1 TYR 185 -30.096 -8.176 -7.379 1.00 0.00 C +ATOM 255 HE1 TYR 185 -30.021 -7.967 -8.446 1.00 0.00 H +ATOM 256 CZ TYR 185 -29.898 -7.140 -6.441 1.00 0.00 C +ATOM 257 OH TYR 185 -29.721 -5.856 -6.860 1.00 0.00 O +ATOM 258 HH TYR 185 -29.750 -5.765 -7.816 1.00 0.00 H +ATOM 259 CE2 TYR 185 -29.926 -7.436 -5.063 1.00 0.00 C +ATOM 260 HE2 TYR 185 -29.778 -6.638 -4.336 1.00 0.00 H +ATOM 261 CD2 TYR 185 -30.145 -8.759 -4.624 1.00 0.00 C +ATOM 262 HD2 TYR 185 -30.143 -8.986 -3.558 1.00 0.00 H +ATOM 263 C TYR 185 -33.166 -10.746 -5.058 1.00 0.00 C +ATOM 264 O TYR 185 -33.653 -9.657 -4.760 1.00 0.00 O +ATOM 265 N LEU 186 -33.691 -11.513 -6.020 1.00 0.00 N +ATOM 266 H LEU 186 -33.230 -12.384 -6.240 1.00 0.00 H +ATOM 267 CA LEU 186 -34.859 -11.122 -6.820 1.00 0.00 C +ATOM 268 HA LEU 186 -34.689 -10.154 -7.292 1.00 0.00 H +ATOM 269 CB LEU 186 -35.096 -12.173 -7.923 1.00 0.00 C +ATOM 270 HB2 LEU 186 -34.649 -13.095 -7.553 1.00 0.00 H +ATOM 271 HB3 LEU 186 -36.170 -12.312 -8.043 1.00 0.00 H +ATOM 272 CG LEU 186 -34.471 -11.809 -9.280 1.00 0.00 C +ATOM 273 HG LEU 186 -34.948 -10.890 -9.619 1.00 0.00 H +ATOM 274 CD1 LEU 186 -32.955 -11.609 -9.229 1.00 0.00 C +ATOM 275 HD11 LEU 186 -32.477 -12.528 -8.890 1.00 0.00 H +ATOM 276 HD12 LEU 186 -32.589 -11.355 -10.223 1.00 0.00 H +ATOM 277 HD13 LEU 186 -32.718 -10.800 -8.538 1.00 0.00 H +ATOM 278 CD2 LEU 186 -34.781 -12.902 -10.299 1.00 0.00 C +ATOM 279 HD21 LEU 186 -35.861 -12.998 -10.413 1.00 0.00 H +ATOM 280 HD22 LEU 186 -34.336 -12.640 -11.259 1.00 0.00 H +ATOM 281 HD23 LEU 186 -34.367 -13.849 -9.953 1.00 0.00 H +ATOM 282 C LEU 186 -36.115 -10.940 -5.959 1.00 0.00 C +ATOM 283 O LEU 186 -36.826 -9.945 -6.110 1.00 0.00 O +ATOM 284 N ARG 187 -36.372 -11.863 -5.023 1.00 0.00 N +ATOM 285 H ARG 187 -35.782 -12.682 -4.989 1.00 0.00 H +ATOM 286 CA ARG 187 -37.516 -11.789 -4.103 1.00 0.00 C +ATOM 287 HA ARG 187 -38.444 -11.626 -4.652 1.00 0.00 H +ATOM 288 CB ARG 187 -37.621 -13.120 -3.347 1.00 0.00 C +ATOM 289 HB2 ARG 187 -37.540 -13.926 -4.078 1.00 0.00 H +ATOM 290 HB3 ARG 187 -36.784 -13.175 -2.652 1.00 0.00 H +ATOM 291 CG ARG 187 -38.941 -13.264 -2.571 1.00 0.00 C +ATOM 292 HG2 ARG 187 -39.048 -12.406 -1.906 1.00 0.00 H +ATOM 293 HG3 ARG 187 -39.764 -13.273 -3.286 1.00 0.00 H +ATOM 294 CD ARG 187 -38.965 -14.559 -1.745 1.00 0.00 C +ATOM 295 HD2 ARG 187 -38.164 -14.519 -1.007 1.00 0.00 H +ATOM 296 HD3 ARG 187 -39.925 -14.632 -1.236 1.00 0.00 H +ATOM 297 NE ARG 187 -38.778 -15.765 -2.581 1.00 0.00 N +ATOM 298 HE ARG 187 -39.228 -15.719 -3.483 1.00 0.00 H +ATOM 299 CZ ARG 187 -38.110 -16.862 -2.263 1.00 0.00 C +ATOM 300 NH1 ARG 187 -37.549 -17.040 -1.095 1.00 0.00 N +ATOM 301 HH11 ARG 187 -37.617 -16.320 -0.390 1.00 0.00 H +ATOM 302 HH12 ARG 187 -37.049 -17.898 -0.903 1.00 0.00 H +ATOM 303 NH2 ARG 187 -37.977 -17.825 -3.132 1.00 0.00 N +ATOM 304 HH21 ARG 187 -38.386 -17.731 -4.052 1.00 0.00 H +ATOM 305 HH22 ARG 187 -37.466 -18.659 -2.883 1.00 0.00 H +ATOM 306 C ARG 187 -37.412 -10.599 -3.150 1.00 0.00 C +ATOM 307 O ARG 187 -38.406 -9.906 -2.941 1.00 0.00 O +ATOM 308 N GLU 188 -36.224 -10.325 -2.611 1.00 0.00 N +ATOM 309 H GLU 188 -35.465 -10.973 -2.768 1.00 0.00 H +ATOM 310 CA GLU 188 -35.973 -9.149 -1.767 1.00 0.00 C +ATOM 311 HA GLU 188 -36.668 -9.149 -0.927 1.00 0.00 H +ATOM 312 CB GLU 188 -34.537 -9.160 -1.216 1.00 0.00 C +ATOM 313 HB2 GLU 188 -33.863 -9.354 -2.051 1.00 0.00 H +ATOM 314 HB3 GLU 188 -34.331 -8.171 -0.805 1.00 0.00 H +ATOM 315 CG GLU 188 -34.322 -10.221 -0.127 1.00 0.00 C +ATOM 316 HG2 GLU 188 -35.136 -10.058 0.579 1.00 0.00 H +ATOM 317 HG3 GLU 188 -34.406 -11.220 -0.556 1.00 0.00 H +ATOM 318 CD GLU 188 -32.980 -10.091 0.600 1.00 0.00 C +ATOM 319 OE1 GLU 188 -32.762 -10.821 1.593 1.00 0.00 O +ATOM 320 OE2 GLU 188 -32.129 -9.232 0.267 1.00 0.00 O +ATOM 321 C GLU 188 -36.205 -7.848 -2.540 1.00 0.00 C +ATOM 322 O GLU 188 -36.816 -6.920 -2.015 1.00 0.00 O +ATOM 323 N GLN 189 -35.777 -7.789 -3.804 1.00 0.00 N +ATOM 324 H GLN 189 -35.241 -8.564 -4.166 1.00 0.00 H +ATOM 325 CA GLN 189 -35.979 -6.622 -4.666 1.00 0.00 C +ATOM 326 HA GLN 189 -35.673 -5.712 -4.150 1.00 0.00 H +ATOM 327 CB GLN 189 -35.128 -6.777 -5.935 1.00 0.00 C +ATOM 328 HB2 GLN 189 -35.272 -7.777 -6.343 1.00 0.00 H +ATOM 329 HB3 GLN 189 -35.444 -6.036 -6.670 1.00 0.00 H +ATOM 330 CG GLN 189 -33.644 -6.568 -5.605 1.00 0.00 C +ATOM 331 HG2 GLN 189 -33.434 -7.123 -4.691 1.00 0.00 H +ATOM 332 HG3 GLN 189 -33.029 -6.958 -6.415 1.00 0.00 H +ATOM 333 CD GLN 189 -33.282 -5.106 -5.380 1.00 0.00 C +ATOM 334 OE1 GLN 189 -33.627 -4.215 -6.160 1.00 0.00 O +ATOM 335 NE2 GLN 189 -32.551 -4.842 -4.324 1.00 0.00 N +ATOM 336 HE21 GLN 189 -32.280 -3.889 -4.125 1.00 0.00 H +ATOM 337 HE22 GLN 189 -32.262 -5.593 -3.713 1.00 0.00 H +ATOM 338 C GLN 189 -37.452 -6.404 -5.014 1.00 0.00 C +ATOM 339 O GLN 189 -37.911 -5.266 -5.005 1.00 0.00 O +ATOM 340 N ALA 190 -38.197 -7.475 -5.291 1.00 0.00 N +ATOM 341 H ALA 190 -37.748 -8.379 -5.318 1.00 0.00 H +ATOM 342 CA ALA 190 -39.615 -7.397 -5.620 1.00 0.00 C +ATOM 343 HA ALA 190 -39.775 -6.617 -6.364 1.00 0.00 H +ATOM 344 CB ALA 190 -40.018 -8.741 -6.225 1.00 0.00 C +ATOM 345 HB1 ALA 190 -39.873 -9.531 -5.487 1.00 0.00 H +ATOM 346 HB2 ALA 190 -41.067 -8.708 -6.518 1.00 0.00 H +ATOM 347 HB3 ALA 190 -39.403 -8.945 -7.101 1.00 0.00 H +ATOM 348 C ALA 190 -40.490 -7.045 -4.408 1.00 0.00 C +ATOM 349 O ALA 190 -41.403 -6.233 -4.517 1.00 0.00 O +ATOM 350 N THR 191 -40.226 -7.651 -3.249 1.00 0.00 N +ATOM 351 H THR 191 -39.443 -8.287 -3.203 1.00 0.00 H +ATOM 352 CA THR 191 -41.072 -7.495 -2.051 1.00 0.00 C +ATOM 353 HA THR 191 -42.087 -7.214 -2.332 1.00 0.00 H +ATOM 354 CB THR 191 -41.131 -8.793 -1.235 1.00 0.00 C +ATOM 355 HB THR 191 -41.773 -8.613 -0.372 1.00 0.00 H +ATOM 356 CG2 THR 191 -41.674 -9.979 -2.035 1.00 0.00 C +ATOM 357 HG21 THR 191 -41.033 -10.160 -2.897 1.00 0.00 H +ATOM 358 HG22 THR 191 -41.692 -10.867 -1.403 1.00 0.00 H +ATOM 359 HG23 THR 191 -42.685 -9.756 -2.375 1.00 0.00 H +ATOM 360 OG1 THR 191 -39.850 -9.128 -0.758 1.00 0.00 O +ATOM 361 HG1 THR 191 -39.901 -9.941 -0.249 1.00 0.00 H +ATOM 362 C THR 191 -40.637 -6.353 -1.134 1.00 0.00 C +ATOM 363 O THR 191 -41.428 -5.903 -0.308 1.00 0.00 O +ATOM 364 N GLY 192 -39.384 -5.899 -1.237 1.00 0.00 N +ATOM 365 H GLY 192 -38.834 -6.218 -2.022 1.00 0.00 H +ATOM 366 CA GLY 192 -38.765 -4.973 -0.286 1.00 0.00 C +ATOM 367 HA2 GLY 192 -37.836 -4.616 -0.729 1.00 0.00 H +ATOM 368 HA3 GLY 192 -39.449 -4.134 -0.150 1.00 0.00 H +ATOM 369 C GLY 192 -38.459 -5.594 1.085 1.00 0.00 C +ATOM 370 O GLY 192 -37.940 -4.905 1.964 1.00 0.00 O +ATOM 371 N ALA 193 -38.760 -6.882 1.287 1.00 0.00 N +ATOM 372 H ALA 193 -39.199 -7.372 0.521 1.00 0.00 H +ATOM 373 CA ALA 193 -38.572 -7.592 2.545 1.00 0.00 C +ATOM 374 HA ALA 193 -38.324 -6.881 3.334 1.00 0.00 H +ATOM 375 CB ALA 193 -39.878 -8.301 2.918 1.00 0.00 C +ATOM 376 HB1 ALA 193 -40.135 -9.022 2.142 1.00 0.00 H +ATOM 377 HB2 ALA 193 -39.753 -8.820 3.868 1.00 0.00 H +ATOM 378 HB3 ALA 193 -40.678 -7.566 3.008 1.00 0.00 H +ATOM 379 C ALA 193 -37.392 -8.566 2.448 1.00 0.00 C +ATOM 380 O ALA 193 -37.286 -9.334 1.495 1.00 0.00 O +ATOM 381 N LYS 194 -36.511 -8.549 3.455 1.00 0.00 N +ATOM 382 H LYS 194 -36.582 -7.817 4.146 1.00 0.00 H +ATOM 383 CA LYS 194 -35.380 -9.484 3.543 1.00 0.00 C +ATOM 384 HA LYS 194 -34.938 -9.609 2.555 1.00 0.00 H +ATOM 385 CB LYS 194 -34.300 -8.970 4.500 1.00 0.00 C +ATOM 386 HB2 LYS 194 -34.772 -8.707 5.447 1.00 0.00 H +ATOM 387 HB3 LYS 194 -33.574 -9.766 4.665 1.00 0.00 H +ATOM 388 CG LYS 194 -33.587 -7.739 3.923 1.00 0.00 C +ATOM 389 HG2 LYS 194 -33.162 -7.996 2.953 1.00 0.00 H +ATOM 390 HG3 LYS 194 -34.312 -6.934 3.800 1.00 0.00 H +ATOM 391 CD LYS 194 -32.470 -7.279 4.864 1.00 0.00 C +ATOM 392 HD2 LYS 194 -32.895 -7.025 5.835 1.00 0.00 H +ATOM 393 HD3 LYS 194 -31.744 -8.083 4.985 1.00 0.00 H +ATOM 394 CE LYS 194 -31.776 -6.050 4.272 1.00 0.00 C +ATOM 395 HE2 LYS 194 -31.328 -6.331 3.319 1.00 0.00 H +ATOM 396 HE3 LYS 194 -32.526 -5.276 4.107 1.00 0.00 H +ATOM 397 NZ LYS 194 -30.723 -5.531 5.180 1.00 0.00 N +ATOM 398 HZ1 LYS 194 -30.028 -6.248 5.333 1.00 0.00 H +ATOM 399 HZ2 LYS 194 -30.286 -4.723 4.760 1.00 0.00 H +ATOM 400 HZ3 LYS 194 -31.137 -5.270 6.063 1.00 0.00 H +ATOM 401 C LYS 194 -35.854 -10.881 3.933 1.00 0.00 C +ATOM 402 O LYS 194 -36.648 -11.018 4.864 1.00 0.00 O +ATOM 403 N ASP 195 -35.321 -11.907 3.274 1.00 0.00 N +ATOM 404 H ASP 195 -34.756 -11.725 2.457 1.00 0.00 H +ATOM 405 CA ASP 195 -35.616 -13.301 3.620 1.00 0.00 C +ATOM 406 HA ASP 195 -36.660 -13.396 3.918 1.00 0.00 H +ATOM 407 CB ASP 195 -35.363 -14.220 2.411 1.00 0.00 C +ATOM 408 HB2 ASP 195 -35.839 -13.742 1.554 1.00 0.00 H +ATOM 409 HB3 ASP 195 -34.289 -14.285 2.239 1.00 0.00 H +ATOM 410 CG ASP 195 -35.939 -15.632 2.595 1.00 0.00 C +ATOM 411 OD1 ASP 195 -35.979 -16.105 3.754 1.00 0.00 O +ATOM 412 OD2 ASP 195 -36.315 -16.245 1.568 1.00 0.00 O +ATOM 413 C ASP 195 -34.810 -13.709 4.865 1.00 0.00 C +ATOM 414 O ASP 195 -33.576 -13.728 4.852 1.00 0.00 O +ATOM 415 N THR 196 -35.508 -14.019 5.960 1.00 0.00 N +ATOM 416 H THR 196 -36.512 -13.925 5.909 1.00 0.00 H +ATOM 417 CA THR 196 -34.906 -14.397 7.248 1.00 0.00 C +ATOM 418 HA THR 196 -33.924 -13.933 7.335 1.00 0.00 H +ATOM 419 CB THR 196 -35.776 -13.926 8.423 1.00 0.00 C +ATOM 420 HB THR 196 -35.318 -14.278 9.347 1.00 0.00 H +ATOM 421 CG2 THR 196 -35.911 -12.404 8.469 1.00 0.00 C +ATOM 422 HG21 THR 196 -36.370 -12.051 7.545 1.00 0.00 H +ATOM 423 HG22 THR 196 -36.535 -12.119 9.317 1.00 0.00 H +ATOM 424 HG23 THR 196 -34.923 -11.955 8.578 1.00 0.00 H +ATOM 425 OG1 THR 196 -37.075 -14.460 8.308 1.00 0.00 O +ATOM 426 HG1 THR 196 -37.611 -14.160 9.046 1.00 0.00 H +ATOM 427 C THR 196 -34.631 -15.896 7.376 1.00 0.00 C +ATOM 428 O THR 196 -34.060 -16.327 8.381 1.00 0.00 O +ATOM 429 N LYS 197 -35.000 -16.711 6.378 1.00 0.00 N +ATOM 430 H LYS 197 -35.496 -16.313 5.593 1.00 0.00 H +ATOM 431 CA LYS 197 -34.788 -18.161 6.403 1.00 0.00 C +ATOM 432 HA LYS 197 -35.199 -18.593 7.315 1.00 0.00 H +ATOM 433 CB LYS 197 -35.503 -18.790 5.194 1.00 0.00 C +ATOM 434 HB2 LYS 197 -36.505 -18.365 5.148 1.00 0.00 H +ATOM 435 HB3 LYS 197 -34.948 -18.508 4.301 1.00 0.00 H +ATOM 436 CG LYS 197 -35.601 -20.319 5.273 1.00 0.00 C +ATOM 437 HG2 LYS 197 -34.594 -20.734 5.284 1.00 0.00 H +ATOM 438 HG3 LYS 197 -36.115 -20.590 6.196 1.00 0.00 H +ATOM 439 CD LYS 197 -36.371 -20.882 4.076 1.00 0.00 C +ATOM 440 HD2 LYS 197 -37.375 -20.457 4.062 1.00 0.00 H +ATOM 441 HD3 LYS 197 -35.851 -20.614 3.156 1.00 0.00 H +ATOM 442 CE LYS 197 -36.465 -22.408 4.183 1.00 0.00 C +ATOM 443 HE2 LYS 197 -35.454 -22.816 4.200 1.00 0.00 H +ATOM 444 HE3 LYS 197 -36.973 -22.657 5.115 1.00 0.00 H +ATOM 445 NZ LYS 197 -37.214 -22.990 3.040 1.00 0.00 N +ATOM 446 HZ1 LYS 197 -36.743 -22.759 2.177 1.00 0.00 H +ATOM 447 HZ2 LYS 197 -37.256 -23.993 3.142 1.00 0.00 H +ATOM 448 HZ3 LYS 197 -38.150 -22.612 3.024 1.00 0.00 H +ATOM 449 C LYS 197 -33.285 -18.477 6.421 1.00 0.00 C +ATOM 450 O LYS 197 -32.531 -17.853 5.669 1.00 0.00 O +ATOM 451 N PRO 198 -32.817 -19.462 7.210 1.00 0.00 N +ATOM 452 CD PRO 198 -33.570 -20.317 8.116 1.00 0.00 C +ATOM 453 HD2 PRO 198 -34.546 -20.516 7.673 1.00 0.00 H +ATOM 454 HD3 PRO 198 -33.700 -19.790 9.061 1.00 0.00 H +ATOM 455 CG PRO 198 -32.726 -21.579 8.265 1.00 0.00 C +ATOM 456 HG2 PRO 198 -32.942 -22.293 7.470 1.00 0.00 H +ATOM 457 HG3 PRO 198 -32.895 -22.052 9.233 1.00 0.00 H +ATOM 458 CB PRO 198 -31.299 -21.044 8.161 1.00 0.00 C +ATOM 459 HB2 PRO 198 -30.637 -21.811 7.760 1.00 0.00 H +ATOM 460 HB3 PRO 198 -30.899 -20.679 9.108 1.00 0.00 H +ATOM 461 CA PRO 198 -31.419 -19.886 7.164 1.00 0.00 C +ATOM 462 HA PRO 198 -30.790 -19.060 7.495 1.00 0.00 H +ATOM 463 C PRO 198 -31.018 -20.294 5.740 1.00 0.00 C +ATOM 464 O PRO 198 -31.831 -20.849 4.998 1.00 0.00 O +ATOM 465 N MET 199 -29.788 -19.964 5.344 1.00 0.00 N +ATOM 466 H MET 199 -29.262 -19.300 5.894 1.00 0.00 H +ATOM 467 CA MET 199 -29.210 -20.430 4.078 1.00 0.00 C +ATOM 468 HA MET 199 -29.996 -20.504 3.326 1.00 0.00 H +ATOM 469 CB MET 199 -28.134 -19.464 3.568 1.00 0.00 C +ATOM 470 HB2 MET 199 -27.485 -19.209 4.406 1.00 0.00 H +ATOM 471 HB3 MET 199 -27.553 -19.978 2.802 1.00 0.00 H +ATOM 472 CG MET 199 -28.735 -18.186 2.982 1.00 0.00 C +ATOM 473 HG2 MET 199 -29.341 -18.457 2.118 1.00 0.00 H +ATOM 474 HG3 MET 199 -29.369 -17.725 3.739 1.00 0.00 H +ATOM 475 SD MET 199 -27.469 -17.008 2.472 1.00 0.00 S +ATOM 476 CE MET 199 -28.459 -15.691 1.739 1.00 0.00 C +ATOM 477 HE1 MET 199 -29.141 -15.289 2.488 1.00 0.00 H +ATOM 478 HE2 MET 199 -27.803 -14.898 1.382 1.00 0.00 H +ATOM 479 HE3 MET 199 -29.034 -16.090 0.903 1.00 0.00 H +ATOM 480 C MET 199 -28.683 -21.861 4.208 1.00 0.00 C +ATOM 481 O MET 199 -28.428 -22.315 5.325 1.00 0.00 O +ATOM 482 N GLY 200 -28.536 -22.563 3.080 1.00 0.00 N +ATOM 483 H GLY 200 -28.747 -22.101 2.207 1.00 0.00 H +ATOM 484 CA GLY 200 -28.089 -23.959 3.035 1.00 0.00 C +ATOM 485 HA2 GLY 200 -28.738 -24.527 3.701 1.00 0.00 H +ATOM 486 HA3 GLY 200 -28.224 -24.308 2.012 1.00 0.00 H +ATOM 487 C GLY 200 -26.626 -24.182 3.452 1.00 0.00 C +ATOM 488 O GLY 200 -26.008 -23.357 4.126 1.00 0.00 O +ATOM 489 N ARG 201 -26.045 -25.313 3.021 1.00 0.00 N +ATOM 490 H ARG 201 -26.616 -25.919 2.448 1.00 0.00 H +ATOM 491 CA ARG 201 -24.692 -25.779 3.405 1.00 0.00 C +ATOM 492 HA ARG 201 -24.649 -26.018 4.468 1.00 0.00 H +ATOM 493 CB ARG 201 -24.378 -27.058 2.599 1.00 0.00 C +ATOM 494 HB2 ARG 201 -25.178 -27.769 2.802 1.00 0.00 H +ATOM 495 HB3 ARG 201 -24.396 -26.783 1.544 1.00 0.00 H +ATOM 496 CG ARG 201 -23.021 -27.701 2.938 1.00 0.00 C +ATOM 497 HG2 ARG 201 -22.239 -26.964 2.759 1.00 0.00 H +ATOM 498 HG3 ARG 201 -23.026 -27.975 3.993 1.00 0.00 H +ATOM 499 CD ARG 201 -22.752 -28.954 2.084 1.00 0.00 C +ATOM 500 HD2 ARG 201 -23.397 -28.913 1.206 1.00 0.00 H +ATOM 501 HD3 ARG 201 -21.709 -28.935 1.770 1.00 0.00 H +ATOM 502 NE ARG 201 -23.009 -30.223 2.802 1.00 0.00 N +ATOM 503 HE ARG 201 -23.163 -30.146 3.797 1.00 0.00 H +ATOM 504 CZ ARG 201 -23.055 -31.428 2.246 1.00 0.00 C +ATOM 505 NH1 ARG 201 -23.019 -31.605 0.954 1.00 0.00 N +ATOM 506 HH11 ARG 201 -22.953 -30.807 0.339 1.00 0.00 H +ATOM 507 HH12 ARG 201 -23.057 -32.540 0.574 1.00 0.00 H +ATOM 508 NH2 ARG 201 -23.134 -32.500 2.985 1.00 0.00 N +ATOM 509 HH21 ARG 201 -23.161 -32.414 3.991 1.00 0.00 H +ATOM 510 HH22 ARG 201 -23.169 -33.409 2.547 1.00 0.00 H +ATOM 511 C ARG 201 -23.608 -24.701 3.241 1.00 0.00 C +ATOM 512 O ARG 201 -22.802 -24.508 4.144 1.00 0.00 O +ATOM 513 N SER 202 -23.651 -23.933 2.151 1.00 0.00 N +ATOM 514 H SER 202 -24.269 -24.236 1.411 1.00 0.00 H +ATOM 515 CA SER 202 -22.743 -22.802 1.884 1.00 0.00 C +ATOM 516 HA SER 202 -21.834 -22.900 2.477 1.00 0.00 H +ATOM 517 CB SER 202 -22.362 -22.791 0.400 1.00 0.00 C +ATOM 518 HB2 SER 202 -22.201 -23.809 0.049 1.00 0.00 H +ATOM 519 HB3 SER 202 -23.154 -22.325 -0.186 1.00 0.00 H +ATOM 520 OG SER 202 -21.172 -22.050 0.252 1.00 0.00 O +ATOM 521 HG SER 202 -20.919 -22.033 -0.674 1.00 0.00 H +ATOM 522 C SER 202 -23.270 -21.448 2.404 1.00 0.00 C +ATOM 523 O SER 202 -23.106 -20.390 1.788 1.00 0.00 O +ATOM 524 N GLY 203 -23.966 -21.445 3.546 1.00 0.00 N +ATOM 525 H GLY 203 -23.977 -22.290 4.100 1.00 0.00 H +ATOM 526 CA GLY 203 -24.714 -20.284 4.034 1.00 0.00 C +ATOM 527 HA2 GLY 203 -25.381 -19.976 3.229 1.00 0.00 H +ATOM 528 HA3 GLY 203 -25.304 -20.624 4.885 1.00 0.00 H +ATOM 529 C GLY 203 -23.864 -19.083 4.464 1.00 0.00 C +ATOM 530 O GLY 203 -24.362 -17.960 4.501 1.00 0.00 O +ATOM 531 N ALA 204 -22.580 -19.262 4.786 1.00 0.00 N +ATOM 532 H ALA 204 -22.227 -20.199 4.911 1.00 0.00 H +ATOM 533 CA ALA 204 -21.684 -18.137 5.076 1.00 0.00 C +ATOM 534 HA ALA 204 -22.219 -17.432 5.712 1.00 0.00 H +ATOM 535 CB ALA 204 -20.456 -18.648 5.835 1.00 0.00 C +ATOM 536 HB1 ALA 204 -19.905 -19.349 5.207 1.00 0.00 H +ATOM 537 HB2 ALA 204 -19.812 -17.808 6.092 1.00 0.00 H +ATOM 538 HB3 ALA 204 -20.776 -19.153 6.746 1.00 0.00 H +ATOM 539 C ALA 204 -21.311 -17.369 3.796 1.00 0.00 C +ATOM 540 O ALA 204 -21.524 -16.157 3.728 1.00 0.00 O +ATOM 541 N THR 205 -20.824 -18.074 2.773 1.00 0.00 N +ATOM 542 H THR 205 -20.636 -19.055 2.930 1.00 0.00 H +ATOM 543 CA THR 205 -20.488 -17.502 1.461 1.00 0.00 C +ATOM 544 HA THR 205 -19.805 -16.659 1.564 1.00 0.00 H +ATOM 545 CB THR 205 -19.821 -18.569 0.580 1.00 0.00 C +ATOM 546 HB THR 205 -20.507 -19.414 0.507 1.00 0.00 H +ATOM 547 CG2 THR 205 -19.485 -18.065 -0.821 1.00 0.00 C +ATOM 548 HG21 THR 205 -18.799 -17.221 -0.750 1.00 0.00 H +ATOM 549 HG22 THR 205 -19.017 -18.865 -1.394 1.00 0.00 H +ATOM 550 HG23 THR 205 -20.399 -17.747 -1.323 1.00 0.00 H +ATOM 551 OG1 THR 205 -18.647 -18.969 1.244 1.00 0.00 O +ATOM 552 HG1 THR 205 -18.197 -19.639 0.723 1.00 0.00 H +ATOM 553 C THR 205 -21.724 -16.933 0.775 1.00 0.00 C +ATOM 554 O THR 205 -21.692 -15.803 0.296 1.00 0.00 O +ATOM 555 N SER 206 -22.848 -17.650 0.819 1.00 0.00 N +ATOM 556 H SER 206 -22.819 -18.570 1.236 1.00 0.00 H +ATOM 557 CA SER 206 -24.106 -17.204 0.204 1.00 0.00 C +ATOM 558 HA SER 206 -23.934 -16.944 -0.841 1.00 0.00 H +ATOM 559 CB SER 206 -25.155 -18.317 0.266 1.00 0.00 C +ATOM 560 HB2 SER 206 -25.439 -18.493 1.303 1.00 0.00 H +ATOM 561 HB3 SER 206 -26.035 -18.021 -0.305 1.00 0.00 H +ATOM 562 OG SER 206 -24.615 -19.502 -0.282 1.00 0.00 O +ATOM 563 HG SER 206 -25.271 -20.200 -0.244 1.00 0.00 H +ATOM 564 C SER 206 -24.643 -15.914 0.834 1.00 0.00 C +ATOM 565 O SER 206 -25.127 -15.038 0.118 1.00 0.00 O +ATOM 566 N ARG 207 -24.482 -15.729 2.156 1.00 0.00 N +ATOM 567 H ARG 207 -24.158 -16.500 2.722 1.00 0.00 H +ATOM 568 CA ARG 207 -24.838 -14.467 2.831 1.00 0.00 C +ATOM 569 HA ARG 207 -25.858 -14.191 2.564 1.00 0.00 H +ATOM 570 CB ARG 207 -24.750 -14.599 4.360 1.00 0.00 C +ATOM 571 HB2 ARG 207 -23.881 -15.213 4.597 1.00 0.00 H +ATOM 572 HB3 ARG 207 -24.615 -13.602 4.779 1.00 0.00 H +ATOM 573 CG ARG 207 -26.008 -15.240 4.959 1.00 0.00 C +ATOM 574 HG2 ARG 207 -26.872 -14.656 4.642 1.00 0.00 H +ATOM 575 HG3 ARG 207 -26.092 -16.254 4.568 1.00 0.00 H +ATOM 576 CD ARG 207 -25.959 -15.287 6.485 1.00 0.00 C +ATOM 577 HD2 ARG 207 -25.706 -14.299 6.868 1.00 0.00 H +ATOM 578 HD3 ARG 207 -26.936 -15.586 6.868 1.00 0.00 H +ATOM 579 NE ARG 207 -24.951 -16.251 6.961 1.00 0.00 N +ATOM 580 HE ARG 207 -24.545 -16.850 6.256 1.00 0.00 H +ATOM 581 CZ ARG 207 -24.542 -16.380 8.211 1.00 0.00 C +ATOM 582 NH1 ARG 207 -25.021 -15.636 9.170 1.00 0.00 N +ATOM 583 HH11 ARG 207 -25.724 -14.941 8.964 1.00 0.00 H +ATOM 584 HH12 ARG 207 -24.687 -15.760 10.115 1.00 0.00 H +ATOM 585 NH2 ARG 207 -23.645 -17.270 8.527 1.00 0.00 N +ATOM 586 HH21 ARG 207 -23.257 -17.868 7.812 1.00 0.00 H +ATOM 587 HH22 ARG 207 -23.341 -17.358 9.487 1.00 0.00 H +ATOM 588 C ARG 207 -23.972 -13.308 2.352 1.00 0.00 C +ATOM 589 O ARG 207 -24.517 -12.270 1.986 1.00 0.00 O +ATOM 590 N LYS 208 -22.650 -13.497 2.298 1.00 0.00 N +ATOM 591 H LYS 208 -22.275 -14.374 2.630 1.00 0.00 H +ATOM 592 CA LYS 208 -21.708 -12.471 1.816 1.00 0.00 C +ATOM 593 HA LYS 208 -21.844 -11.547 2.376 1.00 0.00 H +ATOM 594 CB LYS 208 -20.266 -12.952 2.008 1.00 0.00 C +ATOM 595 HB2 LYS 208 -20.187 -13.935 1.542 1.00 0.00 H +ATOM 596 HB3 LYS 208 -19.617 -12.249 1.486 1.00 0.00 H +ATOM 597 CG LYS 208 -19.838 -13.048 3.478 1.00 0.00 C +ATOM 598 HG2 LYS 208 -19.918 -12.069 3.950 1.00 0.00 H +ATOM 599 HG3 LYS 208 -20.476 -13.759 4.003 1.00 0.00 H +ATOM 600 CD LYS 208 -18.383 -13.527 3.538 1.00 0.00 C +ATOM 601 HD2 LYS 208 -18.321 -14.509 3.068 1.00 0.00 H +ATOM 602 HD3 LYS 208 -17.762 -12.821 2.988 1.00 0.00 H +ATOM 603 CE LYS 208 -17.888 -13.622 4.983 1.00 0.00 C +ATOM 604 HE2 LYS 208 -17.987 -12.646 5.456 1.00 0.00 H +ATOM 605 HE3 LYS 208 -18.499 -14.348 5.520 1.00 0.00 H +ATOM 606 NZ LYS 208 -16.466 -14.048 5.020 1.00 0.00 N +ATOM 607 HZ1 LYS 208 -15.900 -13.375 4.523 1.00 0.00 H +ATOM 608 HZ2 LYS 208 -16.156 -14.105 5.979 1.00 0.00 H +ATOM 609 HZ3 LYS 208 -16.374 -14.953 4.582 1.00 0.00 H +ATOM 610 C LYS 208 -21.936 -12.123 0.342 1.00 0.00 C +ATOM 611 O LYS 208 -21.875 -10.952 -0.033 1.00 0.00 O +ATOM 612 N ALA 209 -22.229 -13.119 -0.492 1.00 0.00 N +ATOM 613 H ALA 209 -22.165 -14.065 -0.144 1.00 0.00 H +ATOM 614 CA ALA 209 -22.561 -12.920 -1.900 1.00 0.00 C +ATOM 615 HA ALA 209 -21.779 -12.334 -2.383 1.00 0.00 H +ATOM 616 CB ALA 209 -22.641 -14.287 -2.583 1.00 0.00 C +ATOM 617 HB1 ALA 209 -23.426 -14.881 -2.117 1.00 0.00 H +ATOM 618 HB2 ALA 209 -22.868 -14.153 -3.641 1.00 0.00 H +ATOM 619 HB3 ALA 209 -21.686 -14.802 -2.480 1.00 0.00 H +ATOM 620 C ALA 209 -23.864 -12.126 -2.053 1.00 0.00 C +ATOM 621 O ALA 209 -23.909 -11.167 -2.821 1.00 0.00 O +ATOM 622 N LEU 210 -24.891 -12.445 -1.261 1.00 0.00 N +ATOM 623 H LEU 210 -24.829 -13.282 -0.699 1.00 0.00 H +ATOM 624 CA LEU 210 -26.147 -11.699 -1.256 1.00 0.00 C +ATOM 625 HA LEU 210 -26.533 -11.583 -2.269 1.00 0.00 H +ATOM 626 CB LEU 210 -27.176 -12.484 -0.425 1.00 0.00 C +ATOM 627 HB2 LEU 210 -27.191 -13.504 -0.808 1.00 0.00 H +ATOM 628 HB3 LEU 210 -26.820 -12.489 0.605 1.00 0.00 H +ATOM 629 CG LEU 210 -28.596 -11.897 -0.472 1.00 0.00 C +ATOM 630 HG LEU 210 -28.552 -10.876 -0.092 1.00 0.00 H +ATOM 631 CD1 LEU 210 -29.176 -11.890 -1.881 1.00 0.00 C +ATOM 632 HD11 LEU 210 -29.221 -12.910 -2.262 1.00 0.00 H +ATOM 633 HD12 LEU 210 -30.181 -11.467 -1.860 1.00 0.00 H +ATOM 634 HD13 LEU 210 -28.542 -11.288 -2.532 1.00 0.00 H +ATOM 635 CD2 LEU 210 -29.531 -12.724 0.409 1.00 0.00 C +ATOM 636 HD21 LEU 210 -29.171 -12.709 1.437 1.00 0.00 H +ATOM 637 HD22 LEU 210 -30.535 -12.303 0.370 1.00 0.00 H +ATOM 638 HD23 LEU 210 -29.555 -13.752 0.048 1.00 0.00 H +ATOM 639 C LEU 210 -25.962 -10.251 -0.765 1.00 0.00 C +ATOM 640 O LEU 210 -26.504 -9.326 -1.358 1.00 0.00 O +ATOM 641 N GLU 211 -25.161 -10.017 0.279 1.00 0.00 N +ATOM 642 H GLU 211 -24.822 -10.807 0.808 1.00 0.00 H +ATOM 643 CA GLU 211 -24.784 -8.664 0.725 1.00 0.00 C +ATOM 644 HA GLU 211 -25.676 -8.085 0.967 1.00 0.00 H +ATOM 645 CB GLU 211 -23.905 -8.759 1.980 1.00 0.00 C +ATOM 646 HB2 GLU 211 -23.140 -9.515 1.804 1.00 0.00 H +ATOM 647 HB3 GLU 211 -23.430 -7.791 2.139 1.00 0.00 H +ATOM 648 CG GLU 211 -24.723 -9.139 3.222 1.00 0.00 C +ATOM 649 HG2 GLU 211 -25.369 -8.301 3.482 1.00 0.00 H +ATOM 650 HG3 GLU 211 -25.335 -9.995 2.937 1.00 0.00 H +ATOM 651 CD GLU 211 -23.856 -9.510 4.436 1.00 0.00 C +ATOM 652 OE1 GLU 211 -24.475 -9.921 5.444 1.00 0.00 O +ATOM 653 OE2 GLU 211 -22.612 -9.414 4.351 1.00 0.00 O +ATOM 654 C GLU 211 -24.044 -7.877 -0.364 1.00 0.00 C +ATOM 655 O GLU 211 -24.339 -6.703 -0.601 1.00 0.00 O +ATOM 656 N THR 212 -23.135 -8.540 -1.075 1.00 0.00 N +ATOM 657 H THR 212 -22.891 -9.475 -0.777 1.00 0.00 H +ATOM 658 CA THR 212 -22.409 -7.962 -2.210 1.00 0.00 C +ATOM 659 HA THR 212 -21.954 -7.018 -1.909 1.00 0.00 H +ATOM 660 CB THR 212 -21.301 -8.918 -2.659 1.00 0.00 C +ATOM 661 HB THR 212 -21.770 -9.861 -2.938 1.00 0.00 H +ATOM 662 CG2 THR 212 -20.495 -8.385 -3.836 1.00 0.00 C +ATOM 663 HG21 THR 212 -20.025 -7.442 -3.558 1.00 0.00 H +ATOM 664 HG22 THR 212 -19.726 -9.108 -4.107 1.00 0.00 H +ATOM 665 HG23 THR 212 -21.157 -8.223 -4.686 1.00 0.00 H +ATOM 666 OG1 THR 212 -20.403 -9.117 -1.590 1.00 0.00 O +ATOM 667 HG1 THR 212 -19.705 -9.716 -1.865 1.00 0.00 H +ATOM 668 C THR 212 -23.358 -7.619 -3.361 1.00 0.00 C +ATOM 669 O THR 212 -23.272 -6.516 -3.899 1.00 0.00 O +ATOM 670 N LEU 213 -24.314 -8.496 -3.694 1.00 0.00 N +ATOM 671 H LEU 213 -24.299 -9.402 -3.250 1.00 0.00 H +ATOM 672 CA LEU 213 -25.348 -8.232 -4.702 1.00 0.00 C +ATOM 673 HA LEU 213 -24.878 -7.964 -5.648 1.00 0.00 H +ATOM 674 CB LEU 213 -26.227 -9.476 -4.923 1.00 0.00 C +ATOM 675 HB2 LEU 213 -26.389 -9.940 -3.950 1.00 0.00 H +ATOM 676 HB3 LEU 213 -27.177 -9.107 -5.312 1.00 0.00 H +ATOM 677 CG LEU 213 -25.647 -10.514 -5.894 1.00 0.00 C +ATOM 678 HG LEU 213 -24.646 -10.804 -5.571 1.00 0.00 H +ATOM 679 CD1 LEU 213 -26.553 -11.741 -5.900 1.00 0.00 C +ATOM 680 HD11 LEU 213 -27.553 -11.453 -6.223 1.00 0.00 H +ATOM 681 HD12 LEU 213 -26.151 -12.486 -6.586 1.00 0.00 H +ATOM 682 HD13 LEU 213 -26.603 -12.162 -4.895 1.00 0.00 H +ATOM 683 CD2 LEU 213 -25.571 -9.984 -7.326 1.00 0.00 C +ATOM 684 HD21 LEU 213 -24.934 -9.101 -7.353 1.00 0.00 H +ATOM 685 HD22 LEU 213 -25.154 -10.753 -7.976 1.00 0.00 H +ATOM 686 HD23 LEU 213 -26.571 -9.721 -7.670 1.00 0.00 H +ATOM 687 C LEU 213 -26.241 -7.053 -4.324 1.00 0.00 C +ATOM 688 O LEU 213 -26.521 -6.228 -5.184 1.00 0.00 O +ATOM 689 N ARG 214 -26.637 -6.912 -3.055 1.00 0.00 N +ATOM 690 H ARG 214 -26.480 -7.655 -2.390 1.00 0.00 H +ATOM 691 CA ARG 214 -27.373 -5.718 -2.606 1.00 0.00 C +ATOM 692 HA ARG 214 -28.286 -5.610 -3.191 1.00 0.00 H +ATOM 693 CB ARG 214 -27.750 -5.831 -1.125 1.00 0.00 C +ATOM 694 HB2 ARG 214 -26.837 -6.054 -0.573 1.00 0.00 H +ATOM 695 HB3 ARG 214 -28.137 -4.861 -0.812 1.00 0.00 H +ATOM 696 CG ARG 214 -28.799 -6.916 -0.841 1.00 0.00 C +ATOM 697 HG2 ARG 214 -29.745 -6.656 -1.313 1.00 0.00 H +ATOM 698 HG3 ARG 214 -28.455 -7.878 -1.222 1.00 0.00 H +ATOM 699 CD ARG 214 -28.994 -7.010 0.676 1.00 0.00 C +ATOM 700 HD2 ARG 214 -28.015 -7.028 1.155 1.00 0.00 H +ATOM 701 HD3 ARG 214 -29.548 -6.133 1.012 1.00 0.00 H +ATOM 702 NE ARG 214 -29.737 -8.217 1.074 1.00 0.00 N +ATOM 703 HE ARG 214 -30.624 -8.315 0.601 1.00 0.00 H +ATOM 704 CZ ARG 214 -29.373 -9.153 1.929 1.00 0.00 C +ATOM 705 NH1 ARG 214 -28.198 -9.167 2.497 1.00 0.00 N +ATOM 706 HH11 ARG 214 -27.530 -8.441 2.285 1.00 0.00 H +ATOM 707 HH12 ARG 214 -27.963 -9.904 3.146 1.00 0.00 H +ATOM 708 NH2 ARG 214 -30.204 -10.093 2.253 1.00 0.00 N +ATOM 709 HH21 ARG 214 -31.130 -10.106 1.849 1.00 0.00 H +ATOM 710 HH22 ARG 214 -29.922 -10.809 2.908 1.00 0.00 H +ATOM 711 C ARG 214 -26.562 -4.451 -2.858 1.00 0.00 C +ATOM 712 O ARG 214 -27.062 -3.505 -3.446 1.00 0.00 O +ATOM 713 N ARG 215 -25.282 -4.424 -2.477 1.00 0.00 N +ATOM 714 H ARG 215 -24.894 -5.211 -1.976 1.00 0.00 H +ATOM 715 CA ARG 215 -24.442 -3.230 -2.659 1.00 0.00 C +ATOM 716 HA ARG 215 -24.949 -2.343 -2.279 1.00 0.00 H +ATOM 717 CB ARG 215 -23.135 -3.418 -1.882 1.00 0.00 C +ATOM 718 HB2 ARG 215 -23.385 -3.563 -0.831 1.00 0.00 H +ATOM 719 HB3 ARG 215 -22.640 -4.310 -2.264 1.00 0.00 H +ATOM 720 CG ARG 215 -22.191 -2.209 -2.022 1.00 0.00 C +ATOM 721 HG2 ARG 215 -21.880 -2.133 -3.065 1.00 0.00 H +ATOM 722 HG3 ARG 215 -22.739 -1.310 -1.742 1.00 0.00 H +ATOM 723 CD ARG 215 -20.952 -2.352 -1.130 1.00 0.00 C +ATOM 724 HD2 ARG 215 -20.282 -1.510 -1.310 1.00 0.00 H +ATOM 725 HD3 ARG 215 -21.263 -2.350 -0.085 1.00 0.00 H +ATOM 726 NE ARG 215 -20.223 -3.603 -1.403 1.00 0.00 N +ATOM 727 HE ARG 215 -20.488 -4.370 -0.801 1.00 0.00 H +ATOM 728 CZ ARG 215 -19.305 -3.816 -2.327 1.00 0.00 C +ATOM 729 NH1 ARG 215 -18.873 -2.890 -3.135 1.00 0.00 N +ATOM 730 HH11 ARG 215 -19.245 -1.954 -3.070 1.00 0.00 H +ATOM 731 HH12 ARG 215 -18.168 -3.113 -3.823 1.00 0.00 H +ATOM 732 NH2 ARG 215 -18.787 -5.000 -2.442 1.00 0.00 N +ATOM 733 HH21 ARG 215 -19.089 -5.742 -1.826 1.00 0.00 H +ATOM 734 HH22 ARG 215 -18.083 -5.174 -3.145 1.00 0.00 H +ATOM 735 C ARG 215 -24.201 -2.901 -4.136 1.00 0.00 C +ATOM 736 O ARG 215 -24.439 -1.775 -4.566 1.00 0.00 O +ATOM 737 N VAL 216 -23.697 -3.870 -4.896 1.00 0.00 N +ATOM 738 H VAL 216 -23.558 -4.780 -4.479 1.00 0.00 H +ATOM 739 CA VAL 216 -23.269 -3.669 -6.287 1.00 0.00 C +ATOM 740 HA VAL 216 -22.794 -2.693 -6.387 1.00 0.00 H +ATOM 741 CB VAL 216 -22.263 -4.753 -6.719 1.00 0.00 C +ATOM 742 HB VAL 216 -22.747 -5.726 -6.634 1.00 0.00 H +ATOM 743 CG1 VAL 216 -21.788 -4.543 -8.163 1.00 0.00 C +ATOM 744 HG11 VAL 216 -21.303 -3.571 -8.248 1.00 0.00 H +ATOM 745 HG12 VAL 216 -21.080 -5.328 -8.431 1.00 0.00 H +ATOM 746 HG13 VAL 216 -22.644 -4.582 -8.837 1.00 0.00 H +ATOM 747 CG2 VAL 216 -21.022 -4.747 -5.814 1.00 0.00 C +ATOM 748 HG21 VAL 216 -21.321 -4.939 -4.784 1.00 0.00 H +ATOM 749 HG22 VAL 216 -20.329 -5.521 -6.142 1.00 0.00 H +ATOM 750 HG23 VAL 216 -20.533 -3.775 -5.874 1.00 0.00 H +ATOM 751 C VAL 216 -24.473 -3.649 -7.216 1.00 0.00 C +ATOM 752 O VAL 216 -24.611 -2.740 -8.033 1.00 0.00 O +ATOM 753 N GLY 217 -25.373 -4.616 -7.067 1.00 0.00 N +ATOM 754 H GLY 217 -25.251 -5.268 -6.306 1.00 0.00 H +ATOM 755 CA GLY 217 -26.522 -4.785 -7.941 1.00 0.00 C +ATOM 756 HA2 GLY 217 -26.160 -4.848 -8.966 1.00 0.00 H +ATOM 757 HA3 GLY 217 -27.017 -5.718 -7.672 1.00 0.00 H +ATOM 758 C GLY 217 -27.529 -3.642 -7.840 1.00 0.00 C +ATOM 759 O GLY 217 -28.032 -3.197 -8.872 1.00 0.00 O +ATOM 760 N ASP 218 -27.759 -3.092 -6.643 1.00 0.00 N +ATOM 761 H ASP 218 -27.353 -3.518 -5.823 1.00 0.00 H +ATOM 762 CA ASP 218 -28.621 -1.914 -6.464 1.00 0.00 C +ATOM 763 HA ASP 218 -29.531 -2.043 -7.048 1.00 0.00 H +ATOM 764 CB ASP 218 -29.008 -1.712 -4.988 1.00 0.00 C +ATOM 765 HB2 ASP 218 -28.052 -1.583 -4.479 1.00 0.00 H +ATOM 766 HB3 ASP 218 -29.597 -0.800 -4.891 1.00 0.00 H +ATOM 767 CG ASP 218 -29.772 -2.885 -4.352 1.00 0.00 C +ATOM 768 OD1 ASP 218 -29.982 -3.920 -5.030 1.00 0.00 O +ATOM 769 OD2 ASP 218 -30.213 -2.733 -3.194 1.00 0.00 O +ATOM 770 C ASP 218 -27.939 -0.640 -6.983 1.00 0.00 C +ATOM 771 O ASP 218 -28.604 0.298 -7.427 1.00 0.00 O +ATOM 772 N GLY 219 -26.602 -0.589 -6.950 1.00 0.00 N +ATOM 773 H GLY 219 -26.110 -1.303 -6.432 1.00 0.00 H +ATOM 774 CA GLY 219 -25.815 0.446 -7.623 1.00 0.00 C +ATOM 775 HA2 GLY 219 -26.137 1.422 -7.261 1.00 0.00 H +ATOM 776 HA3 GLY 219 -24.762 0.299 -7.384 1.00 0.00 H +ATOM 777 C GLY 219 -25.992 0.397 -9.143 1.00 0.00 C +ATOM 778 O GLY 219 -26.306 1.414 -9.754 1.00 0.00 O +ATOM 779 N VAL 220 -25.874 -0.791 -9.744 1.00 0.00 N +ATOM 780 H VAL 220 -25.568 -1.571 -9.180 1.00 0.00 H +ATOM 781 CA VAL 220 -26.084 -1.012 -11.186 1.00 0.00 C +ATOM 782 HA VAL 220 -25.419 -0.366 -11.760 1.00 0.00 H +ATOM 783 CB VAL 220 -25.789 -2.480 -11.562 1.00 0.00 C +ATOM 784 HB VAL 220 -26.335 -3.113 -10.862 1.00 0.00 H +ATOM 785 CG1 VAL 220 -26.195 -2.836 -12.998 1.00 0.00 C +ATOM 786 HG11 VAL 220 -25.648 -2.204 -13.698 1.00 0.00 H +ATOM 787 HG12 VAL 220 -25.960 -3.882 -13.195 1.00 0.00 H +ATOM 788 HG13 VAL 220 -27.266 -2.676 -13.124 1.00 0.00 H +ATOM 789 CG2 VAL 220 -24.291 -2.783 -11.435 1.00 0.00 C +ATOM 790 HG21 VAL 220 -23.971 -2.611 -10.407 1.00 0.00 H +ATOM 791 HG22 VAL 220 -24.106 -3.822 -11.704 1.00 0.00 H +ATOM 792 HG23 VAL 220 -23.730 -2.130 -12.103 1.00 0.00 H +ATOM 793 C VAL 220 -27.498 -0.613 -11.606 1.00 0.00 C +ATOM 794 O VAL 220 -27.654 0.126 -12.576 1.00 0.00 O +ATOM 795 N GLN 221 -28.525 -1.035 -10.862 1.00 0.00 N +ATOM 796 H GLN 221 -28.350 -1.649 -10.079 1.00 0.00 H +ATOM 797 CA GLN 221 -29.914 -0.690 -11.179 1.00 0.00 C +ATOM 798 HA GLN 221 -30.153 -1.006 -12.195 1.00 0.00 H +ATOM 799 CB GLN 221 -30.867 -1.397 -10.209 1.00 0.00 C +ATOM 800 HB2 GLN 221 -30.496 -1.233 -9.197 1.00 0.00 H +ATOM 801 HB3 GLN 221 -31.850 -0.937 -10.314 1.00 0.00 H +ATOM 802 CG GLN 221 -30.977 -2.905 -10.475 1.00 0.00 C +ATOM 803 HG2 GLN 221 -31.339 -2.988 -11.500 1.00 0.00 H +ATOM 804 HG3 GLN 221 -30.045 -3.460 -10.373 1.00 0.00 H +ATOM 805 CD GLN 221 -32.009 -3.516 -9.546 1.00 0.00 C +ATOM 806 OE1 GLN 221 -33.198 -3.320 -9.733 1.00 0.00 O +ATOM 807 NE2 GLN 221 -31.630 -4.162 -8.465 1.00 0.00 N +ATOM 808 HE21 GLN 221 -32.324 -4.566 -7.852 1.00 0.00 H +ATOM 809 HE22 GLN 221 -30.646 -4.251 -8.252 1.00 0.00 H +ATOM 810 C GLN 221 -30.164 0.823 -11.152 1.00 0.00 C +ATOM 811 O GLN 221 -30.831 1.332 -12.046 1.00 0.00 O +ATOM 812 N ARG 222 -29.602 1.550 -10.174 1.00 0.00 N +ATOM 813 H ARG 222 -29.122 1.069 -9.427 1.00 0.00 H +ATOM 814 CA ARG 222 -29.714 3.019 -10.102 1.00 0.00 C +ATOM 815 HA ARG 222 -30.754 3.320 -10.224 1.00 0.00 H +ATOM 816 CB ARG 222 -29.215 3.519 -8.738 1.00 0.00 C +ATOM 817 HB2 ARG 222 -28.272 3.020 -8.514 1.00 0.00 H +ATOM 818 HB3 ARG 222 -29.050 4.594 -8.807 1.00 0.00 H +ATOM 819 CG ARG 222 -30.226 3.229 -7.621 1.00 0.00 C +ATOM 820 HG2 ARG 222 -31.166 3.724 -7.863 1.00 0.00 H +ATOM 821 HG3 ARG 222 -30.387 2.152 -7.567 1.00 0.00 H +ATOM 822 CD ARG 222 -29.717 3.736 -6.267 1.00 0.00 C +ATOM 823 HD2 ARG 222 -29.397 4.773 -6.370 1.00 0.00 H +ATOM 824 HD3 ARG 222 -30.523 3.676 -5.536 1.00 0.00 H +ATOM 825 NE ARG 222 -28.575 2.936 -5.780 1.00 0.00 N +ATOM 826 HE ARG 222 -28.584 1.970 -6.072 1.00 0.00 H +ATOM 827 CZ ARG 222 -27.579 3.356 -5.019 1.00 0.00 C +ATOM 828 NH1 ARG 222 -27.451 4.607 -4.667 1.00 0.00 N +ATOM 829 HH11 ARG 222 -28.128 5.288 -4.979 1.00 0.00 H +ATOM 830 HH12 ARG 222 -26.675 4.887 -4.085 1.00 0.00 H +ATOM 831 NH2 ARG 222 -26.680 2.514 -4.594 1.00 0.00 N +ATOM 832 HH21 ARG 222 -26.746 1.538 -4.848 1.00 0.00 H +ATOM 833 HH22 ARG 222 -25.921 2.840 -4.013 1.00 0.00 H +ATOM 834 C ARG 222 -28.956 3.715 -11.231 1.00 0.00 C +ATOM 835 O ARG 222 -29.484 4.630 -11.850 1.00 0.00 O +ATOM 836 N ASN 223 -27.737 3.270 -11.524 1.00 0.00 N +ATOM 837 H ASN 223 -27.359 2.496 -10.996 1.00 0.00 H +ATOM 838 CA ASN 223 -26.890 3.897 -12.542 1.00 0.00 C +ATOM 839 HA ASN 223 -26.866 4.979 -12.412 1.00 0.00 H +ATOM 840 CB ASN 223 -25.461 3.354 -12.390 1.00 0.00 C +ATOM 841 HB2 ASN 223 -25.527 2.266 -12.373 1.00 0.00 H +ATOM 842 HB3 ASN 223 -24.864 3.668 -13.246 1.00 0.00 H +ATOM 843 CG ASN 223 -24.771 3.819 -11.121 1.00 0.00 C +ATOM 844 OD1 ASN 223 -25.153 4.766 -10.456 1.00 0.00 O +ATOM 845 ND2 ASN 223 -23.694 3.167 -10.751 1.00 0.00 N +ATOM 846 HD21 ASN 223 -23.204 3.444 -9.913 1.00 0.00 H +ATOM 847 HD22 ASN 223 -23.361 2.392 -11.306 1.00 0.00 H +ATOM 848 C ASN 223 -27.404 3.673 -13.972 1.00 0.00 C +ATOM 849 O ASN 223 -27.159 4.496 -14.851 1.00 0.00 O +ATOM 850 N HIE 224 -28.110 2.566 -14.210 1.00 0.00 N +ATOM 851 H HIE 224 -28.212 1.911 -13.448 1.00 0.00 H +ATOM 852 CA HIE 224 -28.603 2.174 -15.530 1.00 0.00 C +ATOM 853 HA HIE 224 -28.363 2.941 -16.267 1.00 0.00 H +ATOM 854 CB HIE 224 -27.933 0.859 -15.957 1.00 0.00 C +ATOM 855 HB2 HIE 224 -28.143 0.106 -15.197 1.00 0.00 H +ATOM 856 HB3 HIE 224 -28.275 0.499 -16.927 1.00 0.00 H +ATOM 857 CG HIE 224 -26.432 0.977 -16.045 1.00 0.00 C +ATOM 858 ND1 HIE 224 -25.722 1.606 -17.042 1.00 0.00 N +ATOM 859 CE1 HIE 224 -24.416 1.531 -16.734 1.00 0.00 C +ATOM 860 HE1 HIE 224 -23.693 1.971 -17.421 1.00 0.00 H +ATOM 861 NE2 HIE 224 -24.245 0.888 -15.568 1.00 0.00 N +ATOM 862 HE2 HIE 224 -23.385 0.686 -15.079 1.00 0.00 H +ATOM 863 CD2 HIE 224 -25.522 0.531 -15.127 1.00 0.00 C +ATOM 864 HD2 HIE 224 -25.642 -0.011 -14.189 1.00 0.00 H +ATOM 865 C HIE 224 -30.133 2.135 -15.615 1.00 0.00 C +ATOM 866 O HIE 224 -30.676 1.497 -16.517 1.00 0.00 O +ATOM 867 N GLU 225 -30.838 2.840 -14.722 1.00 0.00 N +ATOM 868 H GLU 225 -30.329 3.385 -14.042 1.00 0.00 H +ATOM 869 CA GLU 225 -32.301 2.797 -14.625 1.00 0.00 C +ATOM 870 HA GLU 225 -32.631 1.792 -14.364 1.00 0.00 H +ATOM 871 CB GLU 225 -32.775 3.769 -13.533 1.00 0.00 C +ATOM 872 HB2 GLU 225 -32.296 3.510 -12.588 1.00 0.00 H +ATOM 873 HB3 GLU 225 -32.498 4.786 -13.813 1.00 0.00 H +ATOM 874 CG GLU 225 -34.299 3.679 -13.375 1.00 0.00 C +ATOM 875 HG2 GLU 225 -34.727 4.026 -14.315 1.00 0.00 H +ATOM 876 HG3 GLU 225 -34.546 2.628 -13.230 1.00 0.00 H +ATOM 877 CD GLU 225 -34.873 4.501 -12.219 1.00 0.00 C +ATOM 878 OE1 GLU 225 -36.101 4.350 -12.023 1.00 0.00 O +ATOM 879 OE2 GLU 225 -34.118 5.254 -11.566 1.00 0.00 O +ATOM 880 C GLU 225 -32.985 3.099 -15.967 1.00 0.00 C +ATOM 881 O GLU 225 -33.809 2.313 -16.431 1.00 0.00 O +ATOM 882 N THR 226 -32.600 4.183 -16.647 1.00 0.00 N +ATOM 883 H THR 226 -31.893 4.781 -16.241 1.00 0.00 H +ATOM 884 CA THR 226 -33.178 4.569 -17.947 1.00 0.00 C +ATOM 885 HA THR 226 -34.250 4.731 -17.833 1.00 0.00 H +ATOM 886 CB THR 226 -32.535 5.871 -18.450 1.00 0.00 C +ATOM 887 HB THR 226 -31.491 5.657 -18.677 1.00 0.00 H +ATOM 888 CG2 THR 226 -33.220 6.439 -19.693 1.00 0.00 C +ATOM 889 HG21 THR 226 -34.264 6.654 -19.467 1.00 0.00 H +ATOM 890 HG22 THR 226 -32.718 7.357 -19.997 1.00 0.00 H +ATOM 891 HG23 THR 226 -33.166 5.710 -20.503 1.00 0.00 H +ATOM 892 OG1 THR 226 -32.619 6.853 -17.446 1.00 0.00 O +ATOM 893 HG1 THR 226 -32.217 7.666 -17.760 1.00 0.00 H +ATOM 894 C THR 226 -32.994 3.484 -19.011 1.00 0.00 C +ATOM 895 O THR 226 -33.915 3.189 -19.776 1.00 0.00 O +ATOM 896 N ALA 227 -31.816 2.856 -19.053 1.00 0.00 N +ATOM 897 H ALA 227 -31.068 3.177 -18.455 1.00 0.00 H +ATOM 898 CA ALA 227 -31.537 1.772 -19.990 1.00 0.00 C +ATOM 899 HA ALA 227 -31.826 2.074 -20.997 1.00 0.00 H +ATOM 900 CB ALA 227 -30.031 1.481 -19.981 1.00 0.00 C +ATOM 901 HB1 ALA 227 -29.728 1.168 -18.982 1.00 0.00 H +ATOM 902 HB2 ALA 227 -29.809 0.686 -20.693 1.00 0.00 H +ATOM 903 HB3 ALA 227 -29.485 2.382 -20.261 1.00 0.00 H +ATOM 904 C ALA 227 -32.369 0.527 -19.650 1.00 0.00 C +ATOM 905 O ALA 227 -32.960 -0.085 -20.540 1.00 0.00 O +ATOM 906 N PHE 228 -32.468 0.185 -18.363 1.00 0.00 N +ATOM 907 H PHE 228 -31.923 0.716 -17.698 1.00 0.00 H +ATOM 908 CA PHE 228 -33.241 -0.955 -17.873 1.00 0.00 C +ATOM 909 HA PHE 228 -32.960 -1.861 -18.409 1.00 0.00 H +ATOM 910 CB PHE 228 -32.958 -1.162 -16.377 1.00 0.00 C +ATOM 911 HB2 PHE 228 -32.903 -0.179 -15.910 1.00 0.00 H +ATOM 912 HB3 PHE 228 -33.768 -1.733 -15.925 1.00 0.00 H +ATOM 913 CG PHE 228 -31.666 -1.885 -16.026 1.00 0.00 C +ATOM 914 CD1 PHE 228 -30.559 -1.933 -16.900 1.00 0.00 C +ATOM 915 HD1 PHE 228 -30.594 -1.382 -17.839 1.00 0.00 H +ATOM 916 CE1 PHE 228 -29.418 -2.683 -16.568 1.00 0.00 C +ATOM 917 HE1 PHE 228 -28.576 -2.728 -17.258 1.00 0.00 H +ATOM 918 CZ PHE 228 -29.362 -3.373 -15.347 1.00 0.00 C +ATOM 919 HZ PHE 228 -28.486 -3.969 -15.092 1.00 0.00 H +ATOM 920 CE2 PHE 228 -30.440 -3.294 -14.453 1.00 0.00 C +ATOM 921 HE2 PHE 228 -30.388 -3.809 -13.494 1.00 0.00 H +ATOM 922 CD2 PHE 228 -31.586 -2.553 -14.791 1.00 0.00 C +ATOM 923 HD2 PHE 228 -32.421 -2.492 -14.093 1.00 0.00 H +ATOM 924 C PHE 228 -34.735 -0.778 -18.147 1.00 0.00 C +ATOM 925 O PHE 228 -35.365 -1.699 -18.662 1.00 0.00 O +ATOM 926 N GLN 229 -35.287 0.416 -17.919 1.00 0.00 N +ATOM 927 H GLN 229 -34.732 1.119 -17.451 1.00 0.00 H +ATOM 928 CA GLN 229 -36.664 0.749 -18.285 1.00 0.00 C +ATOM 929 HA GLN 229 -37.357 0.077 -17.778 1.00 0.00 H +ATOM 930 CB GLN 229 -36.989 2.192 -17.872 1.00 0.00 C +ATOM 931 HB2 GLN 229 -36.172 2.821 -18.226 1.00 0.00 H +ATOM 932 HB3 GLN 229 -37.911 2.473 -18.382 1.00 0.00 H +ATOM 933 CG GLN 229 -37.164 2.385 -16.357 1.00 0.00 C +ATOM 934 HG2 GLN 229 -37.914 1.698 -15.965 1.00 0.00 H +ATOM 935 HG3 GLN 229 -36.198 2.167 -15.902 1.00 0.00 H +ATOM 936 CD GLN 229 -37.566 3.810 -15.989 1.00 0.00 C +ATOM 937 OE1 GLN 229 -37.952 4.605 -16.836 1.00 0.00 O +ATOM 938 NE2 GLN 229 -37.548 4.182 -14.727 1.00 0.00 N +ATOM 939 HE21 GLN 229 -37.814 5.124 -14.478 1.00 0.00 H +ATOM 940 HE22 GLN 229 -37.268 3.524 -14.013 1.00 0.00 H +ATOM 941 C GLN 229 -36.903 0.593 -19.793 1.00 0.00 C +ATOM 942 O GLN 229 -37.908 0.012 -20.203 1.00 0.00 O +ATOM 943 N GLY 230 -35.980 1.080 -20.629 1.00 0.00 N +ATOM 944 H GLY 230 -35.188 1.577 -20.246 1.00 0.00 H +ATOM 945 CA GLY 230 -36.063 0.924 -22.082 1.00 0.00 C +ATOM 946 HA2 GLY 230 -36.981 1.402 -22.425 1.00 0.00 H +ATOM 947 HA3 GLY 230 -35.204 1.425 -22.530 1.00 0.00 H +ATOM 948 C GLY 230 -36.070 -0.543 -22.523 1.00 0.00 C +ATOM 949 O GLY 230 -36.877 -0.925 -23.370 1.00 0.00 O +ATOM 950 N MET 231 -35.212 -1.375 -21.927 1.00 0.00 N +ATOM 951 H MET 231 -34.527 -0.984 -21.297 1.00 0.00 H +ATOM 952 CA MET 231 -35.165 -2.818 -22.197 1.00 0.00 C +ATOM 953 HA MET 231 -35.120 -2.994 -23.272 1.00 0.00 H +ATOM 954 CB MET 231 -33.923 -3.443 -21.546 1.00 0.00 C +ATOM 955 HB2 MET 231 -33.887 -3.138 -20.500 1.00 0.00 H +ATOM 956 HB3 MET 231 -34.007 -4.528 -21.604 1.00 0.00 H +ATOM 957 CG MET 231 -32.642 -2.990 -22.254 1.00 0.00 C +ATOM 958 HG2 MET 231 -32.770 -3.222 -23.311 1.00 0.00 H +ATOM 959 HG3 MET 231 -32.577 -1.910 -22.125 1.00 0.00 H +ATOM 960 SD MET 231 -31.111 -3.754 -21.657 1.00 0.00 S +ATOM 961 CE MET 231 -31.034 -3.150 -19.957 1.00 0.00 C +ATOM 962 HE1 MET 231 -31.919 -3.480 -19.413 1.00 0.00 H +ATOM 963 HE2 MET 231 -30.141 -3.543 -19.472 1.00 0.00 H +ATOM 964 HE3 MET 231 -30.996 -2.060 -19.960 1.00 0.00 H +ATOM 965 C MET 231 -36.432 -3.531 -21.721 1.00 0.00 C +ATOM 966 O MET 231 -37.022 -4.284 -22.488 1.00 0.00 O +ATOM 967 N LEU 232 -36.899 -3.242 -20.504 1.00 0.00 N +ATOM 968 H LEU 232 -36.350 -2.631 -19.917 1.00 0.00 H +ATOM 969 CA LEU 232 -38.124 -3.818 -19.949 1.00 0.00 C +ATOM 970 HA LEU 232 -38.053 -4.905 -19.890 1.00 0.00 H +ATOM 971 CB LEU 232 -38.315 -3.261 -18.528 1.00 0.00 C +ATOM 972 HB2 LEU 232 -37.422 -3.530 -17.964 1.00 0.00 H +ATOM 973 HB3 LEU 232 -38.386 -2.176 -18.601 1.00 0.00 H +ATOM 974 CG LEU 232 -39.560 -3.809 -17.809 1.00 0.00 C +ATOM 975 HG LEU 232 -40.423 -3.662 -18.458 1.00 0.00 H +ATOM 976 CD1 LEU 232 -39.417 -5.294 -17.481 1.00 0.00 C +ATOM 977 HD11 LEU 232 -38.554 -5.442 -16.832 1.00 0.00 H +ATOM 978 HD12 LEU 232 -40.316 -5.643 -16.974 1.00 0.00 H +ATOM 979 HD13 LEU 232 -39.278 -5.860 -18.402 1.00 0.00 H +ATOM 980 CD2 LEU 232 -39.775 -3.032 -16.515 1.00 0.00 C +ATOM 981 HD21 LEU 232 -39.921 -1.976 -16.744 1.00 0.00 H +ATOM 982 HD22 LEU 232 -40.656 -3.416 -16.001 1.00 0.00 H +ATOM 983 HD23 LEU 232 -38.902 -3.146 -15.873 1.00 0.00 H +ATOM 984 C LEU 232 -39.342 -3.531 -20.842 1.00 0.00 C +ATOM 985 O LEU 232 -40.116 -4.438 -21.134 1.00 0.00 O +ATOM 986 N ARG 233 -39.476 -2.293 -21.343 1.00 0.00 N +ATOM 987 H ARG 233 -38.835 -1.574 -21.040 1.00 0.00 H +ATOM 988 CA ARG 233 -40.552 -1.922 -22.280 1.00 0.00 C +ATOM 989 HA ARG 233 -41.519 -2.180 -21.849 1.00 0.00 H +ATOM 990 CB ARG 233 -40.529 -0.417 -22.564 1.00 0.00 C +ATOM 991 HB2 ARG 233 -39.502 -0.136 -22.797 1.00 0.00 H +ATOM 992 HB3 ARG 233 -41.162 -0.231 -23.432 1.00 0.00 H +ATOM 993 CG ARG 233 -41.028 0.416 -21.380 1.00 0.00 C +ATOM 994 HG2 ARG 233 -42.055 0.139 -21.140 1.00 0.00 H +ATOM 995 HG3 ARG 233 -40.393 0.244 -20.512 1.00 0.00 H +ATOM 996 CD ARG 233 -40.977 1.899 -21.763 1.00 0.00 C +ATOM 997 HD2 ARG 233 -39.994 2.127 -22.175 1.00 0.00 H +ATOM 998 HD3 ARG 233 -41.741 2.101 -22.513 1.00 0.00 H +ATOM 999 NE ARG 233 -41.215 2.770 -20.601 1.00 0.00 N +ATOM 1000 HE ARG 233 -41.509 2.300 -19.757 1.00 0.00 H +ATOM 1001 CZ ARG 233 -41.085 4.084 -20.578 1.00 0.00 C +ATOM 1002 NH1 ARG 233 -40.835 4.773 -21.659 1.00 0.00 N +ATOM 1003 HH11 ARG 233 -40.736 4.298 -22.545 1.00 0.00 H +ATOM 1004 HH12 ARG 233 -40.742 5.777 -21.605 1.00 0.00 H +ATOM 1005 NH2 ARG 233 -41.194 4.738 -19.456 1.00 0.00 N +ATOM 1006 HH21 ARG 233 -41.380 4.236 -18.599 1.00 0.00 H +ATOM 1007 HH22 ARG 233 -41.093 5.743 -19.449 1.00 0.00 H +ATOM 1008 C ARG 233 -40.470 -2.675 -23.604 1.00 0.00 C +ATOM 1009 O ARG 233 -41.504 -3.035 -24.149 1.00 0.00 O +ATOM 1010 N LYS 234 -39.262 -2.899 -24.132 1.00 0.00 N +ATOM 1011 H LYS 234 -38.451 -2.504 -23.677 1.00 0.00 H +ATOM 1012 CA LYS 234 -39.063 -3.651 -25.384 1.00 0.00 C +ATOM 1013 HA LYS 234 -39.734 -3.271 -26.154 1.00 0.00 H +ATOM 1014 CB LYS 234 -37.620 -3.502 -25.875 1.00 0.00 C +ATOM 1015 HB2 LYS 234 -36.958 -3.639 -25.019 1.00 0.00 H +ATOM 1016 HB3 LYS 234 -37.432 -4.287 -26.608 1.00 0.00 H +ATOM 1017 CG LYS 234 -37.353 -2.135 -26.511 1.00 0.00 C +ATOM 1018 HG2 LYS 234 -38.006 -1.999 -27.374 1.00 0.00 H +ATOM 1019 HG3 LYS 234 -37.546 -1.347 -25.782 1.00 0.00 H +ATOM 1020 CD LYS 234 -35.890 -2.066 -26.962 1.00 0.00 C +ATOM 1021 HD2 LYS 234 -35.245 -2.187 -26.092 1.00 0.00 H +ATOM 1022 HD3 LYS 234 -35.700 -2.873 -27.669 1.00 0.00 H +ATOM 1023 CE LYS 234 -35.594 -0.722 -27.632 1.00 0.00 C +ATOM 1024 HE2 LYS 234 -36.271 -0.597 -28.478 1.00 0.00 H +ATOM 1025 HE3 LYS 234 -35.768 0.075 -26.909 1.00 0.00 H +ATOM 1026 NZ LYS 234 -34.189 -0.659 -28.109 1.00 0.00 N +ATOM 1027 HZ1 LYS 234 -34.028 -1.397 -28.779 1.00 0.00 H +ATOM 1028 HZ2 LYS 234 -34.021 0.236 -28.545 1.00 0.00 H +ATOM 1029 HZ3 LYS 234 -33.562 -0.774 -27.325 1.00 0.00 H +ATOM 1030 C LYS 234 -39.398 -5.134 -25.240 1.00 0.00 C +ATOM 1031 O LYS 234 -39.814 -5.739 -26.220 1.00 0.00 O +ATOM 1032 N LEU 235 -39.190 -5.701 -24.053 1.00 0.00 N +ATOM 1033 H LEU 235 -38.744 -5.154 -23.332 1.00 0.00 H +ATOM 1034 CA LEU 235 -39.505 -7.100 -23.768 1.00 0.00 C +ATOM 1035 HA LEU 235 -39.251 -7.733 -24.618 1.00 0.00 H +ATOM 1036 CB LEU 235 -38.681 -7.555 -22.555 1.00 0.00 C +ATOM 1037 HB2 LEU 235 -38.876 -6.834 -21.761 1.00 0.00 H +ATOM 1038 HB3 LEU 235 -39.049 -8.536 -22.251 1.00 0.00 H +ATOM 1039 CG LEU 235 -37.167 -7.634 -22.815 1.00 0.00 C +ATOM 1040 HG LEU 235 -36.830 -6.740 -23.340 1.00 0.00 H +ATOM 1041 CD1 LEU 235 -36.458 -7.729 -21.470 1.00 0.00 C +ATOM 1042 HD11 LEU 235 -36.794 -8.622 -20.944 1.00 0.00 H +ATOM 1043 HD12 LEU 235 -35.381 -7.786 -21.629 1.00 0.00 H +ATOM 1044 HD13 LEU 235 -36.690 -6.847 -20.872 1.00 0.00 H +ATOM 1045 CD2 LEU 235 -36.782 -8.836 -23.676 1.00 0.00 C +ATOM 1046 HD21 LEU 235 -37.285 -8.768 -24.641 1.00 0.00 H +ATOM 1047 HD22 LEU 235 -35.703 -8.843 -23.829 1.00 0.00 H +ATOM 1048 HD23 LEU 235 -37.083 -9.754 -23.173 1.00 0.00 H +ATOM 1049 C LEU 235 -41.004 -7.340 -23.534 1.00 0.00 C +ATOM 1050 O LEU 235 -41.434 -8.475 -23.667 1.00 0.00 O +ATOM 1051 N ASP 236 -41.773 -6.296 -23.197 1.00 0.00 N +ATOM 1052 H ASP 236 -41.279 -5.463 -22.912 1.00 0.00 H +ATOM 1053 CA ASP 236 -43.237 -6.337 -23.015 1.00 0.00 C +ATOM 1054 HA ASP 236 -43.560 -5.492 -22.409 1.00 0.00 H +ATOM 1055 CB ASP 236 -43.948 -6.263 -24.381 1.00 0.00 C +ATOM 1056 HB2 ASP 236 -43.478 -5.519 -25.023 1.00 0.00 H +ATOM 1057 HB3 ASP 236 -43.805 -7.255 -24.810 1.00 0.00 H +ATOM 1058 CG ASP 236 -45.451 -5.967 -24.267 1.00 0.00 C +ATOM 1059 OD1 ASP 236 -45.874 -5.225 -23.349 1.00 0.00 O +ATOM 1060 OD2 ASP 236 -46.236 -6.406 -25.143 1.00 0.00 O +ATOM 1061 C ASP 236 -43.724 -7.487 -22.108 1.00 0.00 C +ATOM 1062 O ASP 236 -44.690 -8.183 -22.407 1.00 0.00 O +ATOM 1063 N ILE 237 -43.035 -7.691 -20.979 1.00 0.00 N +ATOM 1064 H ILE 237 -42.252 -7.083 -20.787 1.00 0.00 H +ATOM 1065 CA ILE 237 -43.295 -8.805 -20.054 1.00 0.00 C +ATOM 1066 HA ILE 237 -43.458 -9.735 -20.599 1.00 0.00 H +ATOM 1067 CB ILE 237 -42.128 -8.989 -19.057 1.00 0.00 C +ATOM 1068 HB ILE 237 -42.022 -8.078 -18.468 1.00 0.00 H +ATOM 1069 CG2 ILE 237 -42.391 -10.182 -18.114 1.00 0.00 C +ATOM 1070 HG21 ILE 237 -42.497 -11.095 -18.701 1.00 0.00 H +ATOM 1071 HG22 ILE 237 -41.556 -10.291 -17.422 1.00 0.00 H +ATOM 1072 HG23 ILE 237 -43.308 -10.006 -17.551 1.00 0.00 H +ATOM 1073 CG1 ILE 237 -40.789 -9.181 -19.808 1.00 0.00 C +ATOM 1074 HG12 ILE 237 -40.865 -10.116 -20.364 1.00 0.00 H +ATOM 1075 HG13 ILE 237 -40.694 -8.350 -20.508 1.00 0.00 H +ATOM 1076 CD1 ILE 237 -39.559 -9.225 -18.898 1.00 0.00 C +ATOM 1077 HD11 ILE 237 -39.654 -10.056 -18.199 1.00 0.00 H +ATOM 1078 HD12 ILE 237 -38.663 -9.361 -19.504 1.00 0.00 H +ATOM 1079 HD13 ILE 237 -39.483 -8.290 -18.344 1.00 0.00 H +ATOM 1080 C ILE 237 -44.631 -8.592 -19.330 1.00 0.00 C +ATOM 1081 O ILE 237 -44.774 -7.654 -18.536 1.00 0.00 O +ATOM 1082 N LYS 238 -45.589 -9.489 -19.576 1.00 0.00 N +ATOM 1083 H LYS 238 -45.343 -10.234 -20.212 1.00 0.00 H +ATOM 1084 CA LYS 238 -46.952 -9.464 -19.022 1.00 0.00 C +ATOM 1085 HA LYS 238 -47.078 -8.632 -18.330 1.00 0.00 H +ATOM 1086 CB LYS 238 -47.936 -9.286 -20.187 1.00 0.00 C +ATOM 1087 HB2 LYS 238 -47.690 -10.017 -20.956 1.00 0.00 H +ATOM 1088 HB3 LYS 238 -48.943 -9.477 -19.815 1.00 0.00 H +ATOM 1089 CG LYS 238 -47.872 -7.877 -20.784 1.00 0.00 C +ATOM 1090 HG2 LYS 238 -48.379 -7.183 -20.113 1.00 0.00 H +ATOM 1091 HG3 LYS 238 -46.828 -7.582 -20.889 1.00 0.00 H +ATOM 1092 CD LYS 238 -48.549 -7.848 -22.152 1.00 0.00 C +ATOM 1093 HD2 LYS 238 -47.977 -8.437 -22.869 1.00 0.00 H +ATOM 1094 HD3 LYS 238 -49.561 -8.245 -22.081 1.00 0.00 H +ATOM 1095 CE LYS 238 -48.605 -6.397 -22.618 1.00 0.00 C +ATOM 1096 HE2 LYS 238 -49.486 -5.927 -22.179 1.00 0.00 H +ATOM 1097 HE3 LYS 238 -47.708 -5.887 -22.267 1.00 0.00 H +ATOM 1098 NZ LYS 238 -48.680 -6.302 -24.086 1.00 0.00 N +ATOM 1099 HZ1 LYS 238 -49.512 -6.773 -24.411 1.00 0.00 H +ATOM 1100 HZ2 LYS 238 -48.716 -5.330 -24.359 1.00 0.00 H +ATOM 1101 HZ3 LYS 238 -47.865 -6.737 -24.494 1.00 0.00 H +ATOM 1102 C LYS 238 -47.313 -10.731 -18.252 1.00 0.00 C +ATOM 1103 O LYS 238 -48.158 -10.670 -17.363 1.00 0.00 O +ATOM 1104 N ASN 239 -46.726 -11.870 -18.605 1.00 0.00 N +ATOM 1105 H ASN 239 -46.056 -11.833 -19.361 1.00 0.00 H +ATOM 1106 CA ASN 239 -47.063 -13.177 -18.040 1.00 0.00 C +ATOM 1107 HA ASN 239 -47.381 -13.091 -17.001 1.00 0.00 H +ATOM 1108 CB ASN 239 -48.235 -13.750 -18.867 1.00 0.00 C +ATOM 1109 HB2 ASN 239 -48.464 -14.727 -18.443 1.00 0.00 H +ATOM 1110 HB3 ASN 239 -49.122 -13.117 -18.821 1.00 0.00 H +ATOM 1111 CG ASN 239 -47.846 -13.932 -20.322 1.00 0.00 C +ATOM 1112 OD1 ASN 239 -46.968 -14.709 -20.634 1.00 0.00 O +ATOM 1113 ND2 ASN 239 -48.417 -13.191 -21.237 1.00 0.00 N +ATOM 1114 HD21 ASN 239 -48.163 -13.306 -22.208 1.00 0.00 H +ATOM 1115 HD22 ASN 239 -49.110 -12.506 -20.967 1.00 0.00 H +ATOM 1116 C ASN 239 -45.839 -14.119 -17.988 1.00 0.00 C +ATOM 1117 O ASN 239 -44.724 -13.747 -18.357 1.00 0.00 O +ATOM 1118 N GLU 240 -46.048 -15.347 -17.509 1.00 0.00 N +ATOM 1119 H GLU 240 -46.982 -15.569 -17.197 1.00 0.00 H +ATOM 1120 CA GLU 240 -45.005 -16.374 -17.372 1.00 0.00 C +ATOM 1121 HA GLU 240 -44.182 -16.016 -16.754 1.00 0.00 H +ATOM 1122 CB GLU 240 -45.635 -17.600 -16.691 1.00 0.00 C +ATOM 1123 HB2 GLU 240 -46.254 -17.241 -15.869 1.00 0.00 H +ATOM 1124 HB3 GLU 240 -46.264 -18.102 -17.428 1.00 0.00 H +ATOM 1125 CG GLU 240 -44.591 -18.590 -16.152 1.00 0.00 C +ATOM 1126 HG2 GLU 240 -43.867 -18.718 -16.957 1.00 0.00 H +ATOM 1127 HG3 GLU 240 -44.086 -18.202 -15.268 1.00 0.00 H +ATOM 1128 CD GLU 240 -45.231 -19.943 -15.822 1.00 0.00 C +ATOM 1129 OE1 GLU 240 -44.695 -20.964 -16.328 1.00 0.00 O +ATOM 1130 OE2 GLU 240 -46.277 -19.953 -15.139 1.00 0.00 O +ATOM 1131 C GLU 240 -44.376 -16.794 -18.715 1.00 0.00 C +ATOM 1132 O GLU 240 -43.177 -17.075 -18.780 1.00 0.00 O +ATOM 1133 N ASP 241 -45.147 -16.813 -19.807 1.00 0.00 N +ATOM 1134 H ASP 241 -46.136 -16.630 -19.714 1.00 0.00 H +ATOM 1135 CA ASP 241 -44.630 -17.188 -21.130 1.00 0.00 C +ATOM 1136 HA ASP 241 -44.063 -18.115 -21.048 1.00 0.00 H +ATOM 1137 CB ASP 241 -45.774 -17.400 -22.137 1.00 0.00 C +ATOM 1138 HB2 ASP 241 -46.341 -16.469 -22.103 1.00 0.00 H +ATOM 1139 HB3 ASP 241 -45.377 -17.547 -23.141 1.00 0.00 H +ATOM 1140 CG ASP 241 -46.694 -18.571 -21.774 1.00 0.00 C +ATOM 1141 OD1 ASP 241 -46.169 -19.585 -21.243 1.00 0.00 O +ATOM 1142 OD2 ASP 241 -47.901 -18.478 -22.097 1.00 0.00 O +ATOM 1143 C ASP 241 -43.621 -16.153 -21.645 1.00 0.00 C +ATOM 1144 O ASP 241 -42.603 -16.510 -22.249 1.00 0.00 O +ATOM 1145 N ASP 242 -43.832 -14.877 -21.315 1.00 0.00 N +ATOM 1146 H ASP 242 -44.707 -14.626 -20.878 1.00 0.00 H +ATOM 1147 CA ASP 242 -42.877 -13.811 -21.620 1.00 0.00 C +ATOM 1148 HA ASP 242 -42.592 -13.868 -22.670 1.00 0.00 H +ATOM 1149 CB ASP 242 -43.488 -12.432 -21.351 1.00 0.00 C +ATOM 1150 HB2 ASP 242 -43.614 -12.336 -20.273 1.00 0.00 H +ATOM 1151 HB3 ASP 242 -42.765 -11.694 -21.699 1.00 0.00 H +ATOM 1152 CG ASP 242 -44.832 -12.196 -22.045 1.00 0.00 C +ATOM 1153 OD1 ASP 242 -44.991 -12.596 -23.218 1.00 0.00 O +ATOM 1154 OD2 ASP 242 -45.705 -11.606 -21.365 1.00 0.00 O +ATOM 1155 C ASP 242 -41.577 -13.980 -20.815 1.00 0.00 C +ATOM 1156 O ASP 242 -40.487 -13.743 -21.341 1.00 0.00 O +ATOM 1157 N VAL 243 -41.650 -14.474 -19.572 1.00 0.00 N +ATOM 1158 H VAL 243 -42.561 -14.551 -19.141 1.00 0.00 H +ATOM 1159 CA VAL 243 -40.462 -14.798 -18.759 1.00 0.00 C +ATOM 1160 HA VAL 243 -39.774 -13.953 -18.775 1.00 0.00 H +ATOM 1161 CB VAL 243 -40.840 -15.098 -17.292 1.00 0.00 C +ATOM 1162 HB VAL 243 -41.597 -15.882 -17.294 1.00 0.00 H +ATOM 1163 CG1 VAL 243 -39.638 -15.552 -16.456 1.00 0.00 C +ATOM 1164 HG11 VAL 243 -38.880 -14.768 -16.454 1.00 0.00 H +ATOM 1165 HG12 VAL 243 -39.959 -15.750 -15.433 1.00 0.00 H +ATOM 1166 HG13 VAL 243 -39.218 -16.461 -16.886 1.00 0.00 H +ATOM 1167 CG2 VAL 243 -41.415 -13.834 -16.641 1.00 0.00 C +ATOM 1168 HG21 VAL 243 -42.304 -13.515 -17.186 1.00 0.00 H +ATOM 1169 HG22 VAL 243 -41.682 -14.047 -15.606 1.00 0.00 H +ATOM 1170 HG23 VAL 243 -40.669 -13.039 -16.667 1.00 0.00 H +ATOM 1171 C VAL 243 -39.656 -15.943 -19.382 1.00 0.00 C +ATOM 1172 O VAL 243 -38.430 -15.861 -19.446 1.00 0.00 O +ATOM 1173 N LYS 244 -40.310 -16.964 -19.948 1.00 0.00 N +ATOM 1174 H LYS 244 -41.308 -17.045 -19.813 1.00 0.00 H +ATOM 1175 CA LYS 244 -39.619 -18.019 -20.719 1.00 0.00 C +ATOM 1176 HA LYS 244 -38.819 -18.454 -20.120 1.00 0.00 H +ATOM 1177 CB LYS 244 -40.608 -19.132 -21.096 1.00 0.00 C +ATOM 1178 HB2 LYS 244 -41.460 -18.673 -21.598 1.00 0.00 H +ATOM 1179 HB3 LYS 244 -40.106 -19.812 -21.783 1.00 0.00 H +ATOM 1180 CG LYS 244 -41.098 -19.913 -19.871 1.00 0.00 C +ATOM 1181 HG2 LYS 244 -40.262 -20.485 -19.471 1.00 0.00 H +ATOM 1182 HG3 LYS 244 -41.440 -19.198 -19.122 1.00 0.00 H +ATOM 1183 CD LYS 244 -42.246 -20.866 -20.230 1.00 0.00 C +ATOM 1184 HD2 LYS 244 -43.055 -20.321 -20.717 1.00 0.00 H +ATOM 1185 HD3 LYS 244 -41.890 -21.656 -20.891 1.00 0.00 H +ATOM 1186 CE LYS 244 -42.761 -21.484 -18.925 1.00 0.00 C +ATOM 1187 HE2 LYS 244 -42.203 -22.405 -18.754 1.00 0.00 H +ATOM 1188 HE3 LYS 244 -42.552 -20.779 -18.121 1.00 0.00 H +ATOM 1189 NZ LYS 244 -44.210 -21.784 -18.954 1.00 0.00 N +ATOM 1190 HZ1 LYS 244 -44.404 -22.438 -19.699 1.00 0.00 H +ATOM 1191 HZ2 LYS 244 -44.489 -22.188 -18.071 1.00 0.00 H +ATOM 1192 HZ3 LYS 244 -44.727 -20.931 -19.113 1.00 0.00 H +ATOM 1193 C LYS 244 -38.950 -17.467 -21.979 1.00 0.00 C +ATOM 1194 O LYS 244 -37.899 -17.950 -22.403 1.00 0.00 O +ATOM 1195 N SER 245 -39.543 -16.449 -22.604 1.00 0.00 N +ATOM 1196 H SER 245 -40.485 -16.194 -22.344 1.00 0.00 H +ATOM 1197 CA SER 245 -38.930 -15.770 -23.750 1.00 0.00 C +ATOM 1198 HA SER 245 -38.538 -16.508 -24.450 1.00 0.00 H +ATOM 1199 CB SER 245 -39.966 -14.906 -24.478 1.00 0.00 C +ATOM 1200 HB2 SER 245 -39.672 -14.842 -25.526 1.00 0.00 H +ATOM 1201 HB3 SER 245 -40.931 -15.406 -24.402 1.00 0.00 H +ATOM 1202 OG SER 245 -40.066 -13.610 -23.940 1.00 0.00 O +ATOM 1203 HG SER 245 -40.724 -13.111 -24.428 1.00 0.00 H +ATOM 1204 C SER 245 -37.679 -14.978 -23.343 1.00 0.00 C +ATOM 1205 O SER 245 -36.672 -15.009 -24.058 1.00 0.00 O +ATOM 1206 N LEU 246 -37.692 -14.367 -22.151 1.00 0.00 N +ATOM 1207 H LEU 246 -38.570 -14.348 -21.652 1.00 0.00 H +ATOM 1208 CA LEU 246 -36.553 -13.652 -21.579 1.00 0.00 C +ATOM 1209 HA LEU 246 -36.209 -12.874 -22.260 1.00 0.00 H +ATOM 1210 CB LEU 246 -36.988 -12.992 -20.257 1.00 0.00 C +ATOM 1211 HB2 LEU 246 -37.802 -12.309 -20.503 1.00 0.00 H +ATOM 1212 HB3 LEU 246 -37.365 -13.787 -19.613 1.00 0.00 H +ATOM 1213 CG LEU 246 -35.879 -12.223 -19.523 1.00 0.00 C +ATOM 1214 HG LEU 246 -35.090 -12.927 -19.259 1.00 0.00 H +ATOM 1215 CD1 LEU 246 -35.297 -11.110 -20.389 1.00 0.00 C +ATOM 1216 HD11 LEU 246 -36.085 -10.405 -20.654 1.00 0.00 H +ATOM 1217 HD12 LEU 246 -34.516 -10.589 -19.836 1.00 0.00 H +ATOM 1218 HD13 LEU 246 -34.874 -11.539 -21.297 1.00 0.00 H +ATOM 1219 CD2 LEU 246 -36.440 -11.599 -18.250 1.00 0.00 C +ATOM 1220 HD21 LEU 246 -36.825 -12.383 -17.600 1.00 0.00 H +ATOM 1221 HD22 LEU 246 -35.650 -11.054 -17.732 1.00 0.00 H +ATOM 1222 HD23 LEU 246 -37.246 -10.911 -18.506 1.00 0.00 H +ATOM 1223 C LEU 246 -35.340 -14.574 -21.400 1.00 0.00 C +ATOM 1224 O LEU 246 -34.221 -14.152 -21.689 1.00 0.00 O +ATOM 1225 N SER 247 -35.545 -15.844 -21.037 1.00 0.00 N +ATOM 1226 H SER 247 -36.483 -16.115 -20.779 1.00 0.00 H +ATOM 1227 CA SER 247 -34.483 -16.864 -20.978 1.00 0.00 C +ATOM 1228 HA SER 247 -33.807 -16.647 -20.152 1.00 0.00 H +ATOM 1229 CB SER 247 -35.088 -18.253 -20.762 1.00 0.00 C +ATOM 1230 HB2 SER 247 -35.567 -18.574 -21.687 1.00 0.00 H +ATOM 1231 HB3 SER 247 -34.289 -18.948 -20.507 1.00 0.00 H +ATOM 1232 OG SER 247 -36.040 -18.230 -19.725 1.00 0.00 O +ATOM 1233 HG SER 247 -36.406 -19.109 -19.607 1.00 0.00 H +ATOM 1234 C SER 247 -33.642 -16.912 -22.252 1.00 0.00 C +ATOM 1235 O SER 247 -32.414 -16.952 -22.193 1.00 0.00 O +ATOM 1236 N ARG 248 -34.292 -16.840 -23.420 1.00 0.00 N +ATOM 1237 H ARG 248 -35.302 -16.824 -23.411 1.00 0.00 H +ATOM 1238 CA ARG 248 -33.607 -16.857 -24.721 1.00 0.00 C +ATOM 1239 HA ARG 248 -32.907 -17.693 -24.756 1.00 0.00 H +ATOM 1240 CB ARG 248 -34.616 -17.015 -25.864 1.00 0.00 C +ATOM 1241 HB2 ARG 248 -35.304 -16.169 -25.828 1.00 0.00 H +ATOM 1242 HB3 ARG 248 -34.067 -16.994 -26.805 1.00 0.00 H +ATOM 1243 CG ARG 248 -35.409 -18.324 -25.764 1.00 0.00 C +ATOM 1244 HG2 ARG 248 -34.719 -19.167 -25.798 1.00 0.00 H +ATOM 1245 HG3 ARG 248 -35.958 -18.341 -24.823 1.00 0.00 H +ATOM 1246 CD ARG 248 -36.393 -18.423 -26.931 1.00 0.00 C +ATOM 1247 HD2 ARG 248 -37.099 -17.594 -26.882 1.00 0.00 H +ATOM 1248 HD3 ARG 248 -35.846 -18.380 -27.872 1.00 0.00 H +ATOM 1249 NE ARG 248 -37.145 -19.689 -26.879 1.00 0.00 N +ATOM 1250 HE ARG 248 -36.790 -20.374 -26.228 1.00 0.00 H +ATOM 1251 CZ ARG 248 -38.207 -19.996 -27.600 1.00 0.00 C +ATOM 1252 NH1 ARG 248 -38.701 -19.170 -28.482 1.00 0.00 N +ATOM 1253 HH11 ARG 248 -38.266 -18.269 -28.624 1.00 0.00 H +ATOM 1254 HH12 ARG 248 -39.514 -19.436 -29.017 1.00 0.00 H +ATOM 1255 NH2 ARG 248 -38.801 -21.144 -27.436 1.00 0.00 N +ATOM 1256 HH21 ARG 248 -38.447 -21.801 -26.755 1.00 0.00 H +ATOM 1257 HH22 ARG 248 -39.613 -21.373 -27.991 1.00 0.00 H +ATOM 1258 C ARG 248 -32.761 -15.604 -24.923 1.00 0.00 C +ATOM 1259 O ARG 248 -31.647 -15.699 -25.424 1.00 0.00 O +ATOM 1260 N VAL 249 -33.257 -14.446 -24.490 1.00 0.00 N +ATOM 1261 H VAL 249 -34.212 -14.429 -24.160 1.00 0.00 H +ATOM 1262 CA VAL 249 -32.516 -13.177 -24.546 1.00 0.00 C +ATOM 1263 HA VAL 249 -32.107 -13.026 -25.546 1.00 0.00 H +ATOM 1264 CB VAL 249 -33.432 -11.985 -24.203 1.00 0.00 C +ATOM 1265 HB VAL 249 -33.805 -12.122 -23.188 1.00 0.00 H +ATOM 1266 CG1 VAL 249 -32.689 -10.645 -24.297 1.00 0.00 C +ATOM 1267 HG11 VAL 249 -32.316 -10.507 -25.313 1.00 0.00 H +ATOM 1268 HG12 VAL 249 -33.371 -9.833 -24.047 1.00 0.00 H +ATOM 1269 HG13 VAL 249 -31.852 -10.644 -23.600 1.00 0.00 H +ATOM 1270 CG2 VAL 249 -34.639 -11.923 -25.149 1.00 0.00 C +ATOM 1271 HG21 VAL 249 -35.218 -12.843 -25.061 1.00 0.00 H +ATOM 1272 HG22 VAL 249 -35.267 -11.073 -24.882 1.00 0.00 H +ATOM 1273 HG23 VAL 249 -34.291 -11.811 -26.175 1.00 0.00 H +ATOM 1274 C VAL 249 -31.293 -13.216 -23.626 1.00 0.00 C +ATOM 1275 O VAL 249 -30.223 -12.750 -24.012 1.00 0.00 O +ATOM 1276 N MET 250 -31.410 -13.823 -22.441 1.00 0.00 N +ATOM 1277 H MET 250 -32.318 -14.169 -22.167 1.00 0.00 H +ATOM 1278 CA MET 250 -30.306 -13.926 -21.479 1.00 0.00 C +ATOM 1279 HA MET 250 -29.859 -12.945 -21.320 1.00 0.00 H +ATOM 1280 CB MET 250 -30.822 -14.452 -20.133 1.00 0.00 C +ATOM 1281 HB2 MET 250 -31.357 -15.386 -20.303 1.00 0.00 H +ATOM 1282 HB3 MET 250 -29.971 -14.635 -19.478 1.00 0.00 H +ATOM 1283 CG MET 250 -31.764 -13.438 -19.475 1.00 0.00 C +ATOM 1284 HG2 MET 250 -31.260 -12.472 -19.506 1.00 0.00 H +ATOM 1285 HG3 MET 250 -32.664 -13.397 -20.089 1.00 0.00 H +ATOM 1286 SD MET 250 -32.227 -13.811 -17.767 1.00 0.00 S +ATOM 1287 CE MET 250 -33.280 -15.268 -17.964 1.00 0.00 C +ATOM 1288 HE1 MET 250 -32.710 -16.068 -18.434 1.00 0.00 H +ATOM 1289 HE2 MET 250 -33.631 -15.597 -16.986 1.00 0.00 H +ATOM 1290 HE3 MET 250 -34.136 -15.016 -18.590 1.00 0.00 H +ATOM 1291 C MET 250 -29.142 -14.784 -21.988 1.00 0.00 C +ATOM 1292 O MET 250 -27.989 -14.446 -21.728 1.00 0.00 O +ATOM 1293 N ILE 251 -29.403 -15.834 -22.775 1.00 0.00 N +ATOM 1294 H ILE 251 -30.364 -16.122 -22.891 1.00 0.00 H +ATOM 1295 CA ILE 251 -28.345 -16.646 -23.412 1.00 0.00 C +ATOM 1296 HA ILE 251 -27.653 -17.035 -22.665 1.00 0.00 H +ATOM 1297 CB ILE 251 -28.974 -17.824 -24.195 1.00 0.00 C +ATOM 1298 HB ILE 251 -29.753 -17.426 -24.844 1.00 0.00 H +ATOM 1299 CG2 ILE 251 -27.927 -18.569 -25.047 1.00 0.00 C +ATOM 1300 HG21 ILE 251 -27.148 -18.968 -24.398 1.00 0.00 H +ATOM 1301 HG22 ILE 251 -28.409 -19.388 -25.581 1.00 0.00 H +ATOM 1302 HG23 ILE 251 -27.484 -17.879 -25.765 1.00 0.00 H +ATOM 1303 CG1 ILE 251 -29.645 -18.811 -23.212 1.00 0.00 C +ATOM 1304 HG12 ILE 251 -28.845 -19.317 -22.672 1.00 0.00 H +ATOM 1305 HG13 ILE 251 -30.234 -18.216 -22.514 1.00 0.00 H +ATOM 1306 CD1 ILE 251 -30.547 -19.852 -23.884 1.00 0.00 C +ATOM 1307 HD11 ILE 251 -29.959 -20.448 -24.582 1.00 0.00 H +ATOM 1308 HD12 ILE 251 -30.978 -20.504 -23.125 1.00 0.00 H +ATOM 1309 HD13 ILE 251 -31.347 -19.347 -24.424 1.00 0.00 H +ATOM 1310 C ILE 251 -27.451 -15.780 -24.314 1.00 0.00 C +ATOM 1311 O ILE 251 -26.231 -15.954 -24.346 1.00 0.00 O +ATOM 1312 N HIE 252 -28.031 -14.791 -25.002 1.00 0.00 N +ATOM 1313 H HIE 252 -29.037 -14.704 -24.985 1.00 0.00 H +ATOM 1314 CA HIE 252 -27.274 -13.908 -25.889 1.00 0.00 C +ATOM 1315 HA HIE 252 -26.597 -14.496 -26.509 1.00 0.00 H +ATOM 1316 CB HIE 252 -28.227 -13.132 -26.805 1.00 0.00 C +ATOM 1317 HB2 HIE 252 -29.047 -12.694 -26.235 1.00 0.00 H +ATOM 1318 HB3 HIE 252 -27.690 -12.343 -27.332 1.00 0.00 H +ATOM 1319 CG HIE 252 -28.853 -14.006 -27.858 1.00 0.00 C +ATOM 1320 ND1 HIE 252 -28.202 -14.536 -28.948 1.00 0.00 N +ATOM 1321 CE1 HIE 252 -29.091 -15.251 -29.655 1.00 0.00 C +ATOM 1322 HE1 HIE 252 -28.751 -15.757 -30.558 1.00 0.00 H +ATOM 1323 NE2 HIE 252 -30.301 -15.202 -29.077 1.00 0.00 N +ATOM 1324 HE2 HIE 252 -31.163 -15.632 -29.380 1.00 0.00 H +ATOM 1325 CD2 HIE 252 -30.157 -14.417 -27.928 1.00 0.00 C +ATOM 1326 HD2 HIE 252 -31.015 -14.238 -27.279 1.00 0.00 H +ATOM 1327 C HIE 252 -26.309 -12.969 -25.153 1.00 0.00 C +ATOM 1328 O HIE 252 -25.345 -12.516 -25.770 1.00 0.00 O +ATOM 1329 N VAL 253 -26.491 -12.729 -23.848 1.00 0.00 N +ATOM 1330 H VAL 253 -27.300 -13.140 -23.404 1.00 0.00 H +ATOM 1331 CA VAL 253 -25.607 -11.868 -23.035 1.00 0.00 C +ATOM 1332 HA VAL 253 -25.595 -10.857 -23.442 1.00 0.00 H +ATOM 1333 CB VAL 253 -26.106 -11.806 -21.576 1.00 0.00 C +ATOM 1334 HB VAL 253 -26.177 -12.831 -21.213 1.00 0.00 H +ATOM 1335 CG1 VAL 253 -25.192 -10.996 -20.643 1.00 0.00 C +ATOM 1336 HG11 VAL 253 -25.121 -9.971 -21.004 1.00 0.00 H +ATOM 1337 HG12 VAL 253 -25.607 -10.998 -19.636 1.00 0.00 H +ATOM 1338 HG13 VAL 253 -24.199 -11.445 -20.627 1.00 0.00 H +ATOM 1339 CG2 VAL 253 -27.493 -11.160 -21.509 1.00 0.00 C +ATOM 1340 HG21 VAL 253 -28.196 -11.748 -22.099 1.00 0.00 H +ATOM 1341 HG22 VAL 253 -27.829 -11.125 -20.473 1.00 0.00 H +ATOM 1342 HG23 VAL 253 -27.442 -10.147 -21.909 1.00 0.00 H +ATOM 1343 C VAL 253 -24.156 -12.355 -23.051 1.00 0.00 C +ATOM 1344 O VAL 253 -23.235 -11.544 -22.984 1.00 0.00 O +ATOM 1345 N PHE 254 -23.943 -13.667 -23.163 1.00 0.00 N +ATOM 1346 H PHE 254 -24.749 -14.275 -23.183 1.00 0.00 H +ATOM 1347 CA PHE 254 -22.612 -14.280 -23.149 1.00 0.00 C +ATOM 1348 HA PHE 254 -21.847 -13.520 -22.989 1.00 0.00 H +ATOM 1349 CB PHE 254 -22.536 -15.297 -22.013 1.00 0.00 C +ATOM 1350 HB2 PHE 254 -23.257 -16.086 -22.229 1.00 0.00 H +ATOM 1351 HB3 PHE 254 -21.537 -15.727 -21.950 1.00 0.00 H +ATOM 1352 CG PHE 254 -22.870 -14.772 -20.633 1.00 0.00 C +ATOM 1353 CD1 PHE 254 -21.951 -13.942 -19.962 1.00 0.00 C +ATOM 1354 HD1 PHE 254 -21.018 -13.660 -20.448 1.00 0.00 H +ATOM 1355 CE1 PHE 254 -22.237 -13.479 -18.665 1.00 0.00 C +ATOM 1356 HE1 PHE 254 -21.527 -12.835 -18.146 1.00 0.00 H +ATOM 1357 CZ PHE 254 -23.440 -13.848 -18.038 1.00 0.00 C +ATOM 1358 HZ PHE 254 -23.666 -13.487 -17.034 1.00 0.00 H +ATOM 1359 CE2 PHE 254 -24.354 -14.684 -18.705 1.00 0.00 C +ATOM 1360 HE2 PHE 254 -25.281 -14.977 -18.214 1.00 0.00 H +ATOM 1361 CD2 PHE 254 -24.073 -15.140 -20.004 1.00 0.00 C +ATOM 1362 HD2 PHE 254 -24.787 -15.779 -20.523 1.00 0.00 H +ATOM 1363 C PHE 254 -22.207 -14.906 -24.491 1.00 0.00 C +ATOM 1364 O PHE 254 -21.304 -15.749 -24.528 1.00 0.00 O +ATOM 1365 N SER 255 -22.892 -14.530 -25.575 1.00 0.00 N +ATOM 1366 H SER 255 -23.639 -13.861 -25.452 1.00 0.00 H +ATOM 1367 CA SER 255 -22.694 -15.117 -26.909 1.00 0.00 C +ATOM 1368 HA SER 255 -22.559 -16.195 -26.820 1.00 0.00 H +ATOM 1369 CB SER 255 -23.907 -14.849 -27.805 1.00 0.00 C +ATOM 1370 HB2 SER 255 -23.720 -15.322 -28.768 1.00 0.00 H +ATOM 1371 HB3 SER 255 -24.776 -15.312 -27.336 1.00 0.00 H +ATOM 1372 OG SER 255 -24.156 -13.466 -27.998 1.00 0.00 O +ATOM 1373 HG SER 255 -24.923 -13.355 -28.564 1.00 0.00 H +ATOM 1374 C SER 255 -21.407 -14.673 -27.608 1.00 0.00 C +ATOM 1375 O SER 255 -20.943 -15.359 -28.512 1.00 0.00 O +ATOM 1376 N ASP 256 -20.783 -13.585 -27.156 1.00 0.00 N +ATOM 1377 H ASP 256 -21.279 -13.017 -26.485 1.00 0.00 H +ATOM 1378 CA ASP 256 -19.480 -13.113 -27.644 1.00 0.00 C +ATOM 1379 HA ASP 256 -19.366 -13.330 -28.706 1.00 0.00 H +ATOM 1380 CB ASP 256 -19.396 -11.592 -27.442 1.00 0.00 C +ATOM 1381 HB2 ASP 256 -18.478 -11.279 -27.940 1.00 0.00 H +ATOM 1382 HB3 ASP 256 -20.250 -11.113 -27.921 1.00 0.00 H +ATOM 1383 CG ASP 256 -19.342 -11.182 -25.972 1.00 0.00 C +ATOM 1384 OD1 ASP 256 -19.484 -12.039 -25.068 1.00 0.00 O +ATOM 1385 OD2 ASP 256 -19.200 -9.973 -25.689 1.00 0.00 O +ATOM 1386 C ASP 256 -18.282 -13.839 -26.996 1.00 0.00 C +ATOM 1387 O ASP 256 -17.133 -13.459 -27.207 1.00 0.00 O +ATOM 1388 N GLY 257 -18.540 -14.855 -26.166 1.00 0.00 N +ATOM 1389 H GLY 257 -19.511 -15.097 -26.028 1.00 0.00 H +ATOM 1390 CA GLY 257 -17.524 -15.629 -25.452 1.00 0.00 C +ATOM 1391 HA2 GLY 257 -17.972 -16.586 -25.186 1.00 0.00 H +ATOM 1392 HA3 GLY 257 -16.697 -15.795 -26.143 1.00 0.00 H +ATOM 1393 C GLY 257 -16.986 -14.960 -24.183 1.00 0.00 C +ATOM 1394 O GLY 257 -16.421 -15.639 -23.324 1.00 0.00 O +ATOM 1395 N VAL 258 -17.219 -13.661 -23.980 1.00 0.00 N +ATOM 1396 H VAL 258 -17.736 -13.144 -24.677 1.00 0.00 H +ATOM 1397 CA VAL 258 -16.640 -12.921 -22.854 1.00 0.00 C +ATOM 1398 HA VAL 258 -15.684 -13.361 -22.572 1.00 0.00 H +ATOM 1399 CB VAL 258 -16.415 -11.439 -23.204 1.00 0.00 C +ATOM 1400 HB VAL 258 -17.370 -11.006 -23.504 1.00 0.00 H +ATOM 1401 CG1 VAL 258 -15.850 -10.658 -22.007 1.00 0.00 C +ATOM 1402 HG11 VAL 258 -14.896 -11.092 -21.707 1.00 0.00 H +ATOM 1403 HG12 VAL 258 -15.704 -9.616 -22.289 1.00 0.00 H +ATOM 1404 HG13 VAL 258 -16.551 -10.713 -21.173 1.00 0.00 H +ATOM 1405 CG2 VAL 258 -15.441 -11.290 -24.378 1.00 0.00 C +ATOM 1406 HG21 VAL 258 -15.846 -11.797 -25.253 1.00 0.00 H +ATOM 1407 HG22 VAL 258 -15.301 -10.233 -24.602 1.00 0.00 H +ATOM 1408 HG23 VAL 258 -14.481 -11.734 -24.113 1.00 0.00 H +ATOM 1409 C VAL 258 -17.482 -13.102 -21.592 1.00 0.00 C +ATOM 1410 O VAL 258 -18.664 -12.754 -21.530 1.00 0.00 O +ATOM 1411 N THR 259 -16.840 -13.604 -20.535 1.00 0.00 N +ATOM 1412 H THR 259 -15.881 -13.892 -20.665 1.00 0.00 H +ATOM 1413 CA THR 259 -17.465 -13.832 -19.222 1.00 0.00 C +ATOM 1414 HA THR 259 -18.455 -13.377 -19.207 1.00 0.00 H +ATOM 1415 CB THR 259 -17.610 -15.334 -18.936 1.00 0.00 C +ATOM 1416 HB THR 259 -16.622 -15.742 -18.728 1.00 0.00 H +ATOM 1417 CG2 THR 259 -18.530 -15.595 -17.742 1.00 0.00 C +ATOM 1418 HG21 THR 259 -19.520 -15.188 -17.948 1.00 0.00 H +ATOM 1419 HG22 THR 259 -18.608 -16.669 -17.571 1.00 0.00 H +ATOM 1420 HG23 THR 259 -18.119 -15.116 -16.854 1.00 0.00 H +ATOM 1421 OG1 THR 259 -18.163 -15.961 -20.080 1.00 0.00 O +ATOM 1422 HG1 THR 259 -18.259 -16.901 -19.913 1.00 0.00 H +ATOM 1423 C THR 259 -16.656 -13.136 -18.131 1.00 0.00 C +ATOM 1424 O THR 259 -15.450 -13.339 -18.020 1.00 0.00 O +ATOM 1425 N ASN 260 -17.317 -12.285 -17.342 1.00 0.00 N +ATOM 1426 H ASN 260 -18.258 -12.044 -17.617 1.00 0.00 H +ATOM 1427 CA ASN 260 -16.736 -11.604 -16.185 1.00 0.00 C +ATOM 1428 HA ASN 260 -16.048 -12.274 -15.669 1.00 0.00 H +ATOM 1429 CB ASN 260 -15.962 -10.348 -16.630 1.00 0.00 C +ATOM 1430 HB2 ASN 260 -15.459 -9.936 -15.754 1.00 0.00 H +ATOM 1431 HB3 ASN 260 -15.218 -10.647 -17.368 1.00 0.00 H +ATOM 1432 CG ASN 260 -16.840 -9.270 -17.235 1.00 0.00 C +ATOM 1433 OD1 ASN 260 -17.654 -8.654 -16.567 1.00 0.00 O +ATOM 1434 ND2 ASN 260 -16.714 -9.008 -18.514 1.00 0.00 N +ATOM 1435 HD21 ASN 260 -17.288 -8.294 -18.939 1.00 0.00 H +ATOM 1436 HD22 ASN 260 -16.042 -9.520 -19.068 1.00 0.00 H +ATOM 1437 C ASN 260 -17.817 -11.285 -15.140 1.00 0.00 C +ATOM 1438 O ASN 260 -19.011 -11.256 -15.457 1.00 0.00 O +ATOM 1439 N TRP 261 -17.396 -10.999 -13.904 1.00 0.00 N +ATOM 1440 H TRP 261 -16.408 -11.056 -13.703 1.00 0.00 H +ATOM 1441 CA TRP 261 -18.313 -10.702 -12.801 1.00 0.00 C +ATOM 1442 HA TRP 261 -19.030 -11.514 -12.678 1.00 0.00 H +ATOM 1443 CB TRP 261 -17.520 -10.548 -11.499 1.00 0.00 C +ATOM 1444 HB2 TRP 261 -16.682 -9.863 -11.631 1.00 0.00 H +ATOM 1445 HB3 TRP 261 -18.192 -10.154 -10.738 1.00 0.00 H +ATOM 1446 CG TRP 261 -16.952 -11.820 -10.951 1.00 0.00 C +ATOM 1447 CD1 TRP 261 -15.660 -12.031 -10.614 1.00 0.00 C +ATOM 1448 HD1 TRP 261 -14.960 -11.211 -10.774 1.00 0.00 H +ATOM 1449 NE1 TRP 261 -15.512 -13.311 -10.115 1.00 0.00 N +ATOM 1450 HE1 TRP 261 -14.626 -13.678 -9.800 1.00 0.00 H +ATOM 1451 CE2 TRP 261 -16.709 -13.990 -10.103 1.00 0.00 C +ATOM 1452 CZ2 TRP 261 -17.074 -15.278 -9.691 1.00 0.00 C +ATOM 1453 HZ2 TRP 261 -16.279 -15.912 -9.295 1.00 0.00 H +ATOM 1454 CH2 TRP 261 -18.414 -15.679 -9.805 1.00 0.00 C +ATOM 1455 HH2 TRP 261 -18.729 -16.676 -9.498 1.00 0.00 H +ATOM 1456 CZ3 TRP 261 -19.373 -14.792 -10.323 1.00 0.00 C +ATOM 1457 HZ3 TRP 261 -20.421 -15.075 -10.417 1.00 0.00 H +ATOM 1458 CE3 TRP 261 -18.997 -13.500 -10.735 1.00 0.00 C +ATOM 1459 HE3 TRP 261 -19.799 -12.870 -11.123 1.00 0.00 H +ATOM 1460 CD2 TRP 261 -17.656 -13.063 -10.635 1.00 0.00 C +ATOM 1461 C TRP 261 -19.197 -9.474 -13.046 1.00 0.00 C +ATOM 1462 O TRP 261 -20.350 -9.477 -12.623 1.00 0.00 O +ATOM 1463 N GLY 262 -18.709 -8.469 -13.781 1.00 0.00 N +ATOM 1464 H GLY 262 -17.746 -8.537 -14.079 1.00 0.00 H +ATOM 1465 CA GLY 262 -19.478 -7.285 -14.179 1.00 0.00 C +ATOM 1466 HA2 GLY 262 -19.810 -6.776 -13.274 1.00 0.00 H +ATOM 1467 HA3 GLY 262 -18.820 -6.626 -14.746 1.00 0.00 H +ATOM 1468 C GLY 262 -20.702 -7.626 -15.038 1.00 0.00 C +ATOM 1469 O GLY 262 -21.806 -7.142 -14.790 1.00 0.00 O +ATOM 1470 N ARG 263 -20.545 -8.526 -16.015 1.00 0.00 N +ATOM 1471 H ARG 263 -19.613 -8.851 -16.231 1.00 0.00 H +ATOM 1472 CA ARG 263 -21.665 -9.011 -16.843 1.00 0.00 C +ATOM 1473 HA ARG 263 -22.251 -8.167 -17.206 1.00 0.00 H +ATOM 1474 CB ARG 263 -21.135 -9.793 -18.047 1.00 0.00 C +ATOM 1475 HB2 ARG 263 -20.419 -10.534 -17.694 1.00 0.00 H +ATOM 1476 HB3 ARG 263 -21.971 -10.298 -18.530 1.00 0.00 H +ATOM 1477 CG ARG 263 -20.452 -8.862 -19.050 1.00 0.00 C +ATOM 1478 HG2 ARG 263 -21.147 -8.086 -19.371 1.00 0.00 H +ATOM 1479 HG3 ARG 263 -19.577 -8.400 -18.593 1.00 0.00 H +ATOM 1480 CD ARG 263 -20.019 -9.686 -20.257 1.00 0.00 C +ATOM 1481 HD2 ARG 263 -19.250 -10.394 -19.949 1.00 0.00 H +ATOM 1482 HD3 ARG 263 -20.880 -10.232 -20.644 1.00 0.00 H +ATOM 1483 NE ARG 263 -19.477 -8.838 -21.330 1.00 0.00 N +ATOM 1484 HE ARG 263 -19.145 -7.915 -21.088 1.00 0.00 H +ATOM 1485 CZ ARG 263 -19.414 -9.217 -22.590 1.00 0.00 C +ATOM 1486 NH1 ARG 263 -19.787 -10.400 -22.953 1.00 0.00 N +ATOM 1487 HH11 ARG 263 -20.134 -11.050 -22.264 1.00 0.00 H +ATOM 1488 HH12 ARG 263 -19.729 -10.668 -23.925 1.00 0.00 H +ATOM 1489 NH2 ARG 263 -18.967 -8.430 -23.517 1.00 0.00 N +ATOM 1490 HH21 ARG 263 -18.657 -7.499 -23.279 1.00 0.00 H +ATOM 1491 HH22 ARG 263 -18.932 -8.751 -24.475 1.00 0.00 H +ATOM 1492 C ARG 263 -22.643 -9.866 -16.046 1.00 0.00 C +ATOM 1493 O ARG 263 -23.851 -9.688 -16.182 1.00 0.00 O +ATOM 1494 N ILE 264 -22.128 -10.740 -15.182 1.00 0.00 N +ATOM 1495 H ILE 264 -21.127 -10.874 -15.177 1.00 0.00 H +ATOM 1496 CA ILE 264 -22.950 -11.594 -14.314 1.00 0.00 C +ATOM 1497 HA ILE 264 -23.704 -12.128 -14.892 1.00 0.00 H +ATOM 1498 CB ILE 264 -22.061 -12.614 -13.564 1.00 0.00 C +ATOM 1499 HB ILE 264 -21.245 -12.079 -13.079 1.00 0.00 H +ATOM 1500 CG2 ILE 264 -22.878 -13.375 -12.503 1.00 0.00 C +ATOM 1501 HG21 ILE 264 -23.694 -13.910 -12.986 1.00 0.00 H +ATOM 1502 HG22 ILE 264 -22.232 -14.086 -11.988 1.00 0.00 H +ATOM 1503 HG23 ILE 264 -23.285 -12.667 -11.781 1.00 0.00 H +ATOM 1504 CG1 ILE 264 -21.432 -13.598 -14.577 1.00 0.00 C +ATOM 1505 HG12 ILE 264 -22.237 -14.229 -14.954 1.00 0.00 H +ATOM 1506 HG13 ILE 264 -21.026 -13.001 -15.395 1.00 0.00 H +ATOM 1507 CD1 ILE 264 -20.326 -14.479 -13.989 1.00 0.00 C +ATOM 1508 HD11 ILE 264 -20.732 -15.076 -13.172 1.00 0.00 H +ATOM 1509 HD12 ILE 264 -19.937 -15.140 -14.764 1.00 0.00 H +ATOM 1510 HD13 ILE 264 -19.521 -13.849 -13.613 1.00 0.00 H +ATOM 1511 C ILE 264 -23.796 -10.741 -13.360 1.00 0.00 C +ATOM 1512 O ILE 264 -25.010 -10.926 -13.300 1.00 0.00 O +ATOM 1513 N VAL 265 -23.196 -9.762 -12.668 1.00 0.00 N +ATOM 1514 H VAL 265 -22.189 -9.687 -12.677 1.00 0.00 H +ATOM 1515 CA VAL 265 -23.954 -8.885 -11.762 1.00 0.00 C +ATOM 1516 HA VAL 265 -24.603 -9.480 -11.120 1.00 0.00 H +ATOM 1517 CB VAL 265 -23.043 -8.014 -10.871 1.00 0.00 C +ATOM 1518 HB VAL 265 -22.326 -8.691 -10.406 1.00 0.00 H +ATOM 1519 CG1 VAL 265 -22.291 -6.896 -11.595 1.00 0.00 C +ATOM 1520 HG11 VAL 265 -23.007 -6.218 -12.059 1.00 0.00 H +ATOM 1521 HG12 VAL 265 -21.681 -6.345 -10.880 1.00 0.00 H +ATOM 1522 HG13 VAL 265 -21.649 -7.328 -12.363 1.00 0.00 H +ATOM 1523 CG2 VAL 265 -23.850 -7.360 -9.748 1.00 0.00 C +ATOM 1524 HG21 VAL 265 -24.309 -8.134 -9.132 1.00 0.00 H +ATOM 1525 HG22 VAL 265 -23.189 -6.751 -9.131 1.00 0.00 H +ATOM 1526 HG23 VAL 265 -24.628 -6.730 -10.177 1.00 0.00 H +ATOM 1527 C VAL 265 -24.982 -8.052 -12.519 1.00 0.00 C +ATOM 1528 O VAL 265 -26.100 -7.904 -12.047 1.00 0.00 O +ATOM 1529 N THR 266 -24.660 -7.585 -13.728 1.00 0.00 N +ATOM 1530 H THR 266 -23.722 -7.731 -14.073 1.00 0.00 H +ATOM 1531 CA THR 266 -25.600 -6.825 -14.566 1.00 0.00 C +ATOM 1532 HA THR 266 -25.977 -5.972 -14.003 1.00 0.00 H +ATOM 1533 CB THR 266 -24.906 -6.311 -15.825 1.00 0.00 C +ATOM 1534 HB THR 266 -24.540 -7.174 -16.381 1.00 0.00 H +ATOM 1535 CG2 THR 266 -25.839 -5.485 -16.718 1.00 0.00 C +ATOM 1536 HG21 THR 266 -26.204 -4.622 -16.162 1.00 0.00 H +ATOM 1537 HG22 THR 266 -25.293 -5.145 -17.598 1.00 0.00 H +ATOM 1538 HG23 THR 266 -26.682 -6.101 -17.030 1.00 0.00 H +ATOM 1539 OG1 THR 266 -23.840 -5.495 -15.407 1.00 0.00 O +ATOM 1540 HG1 THR 266 -23.379 -5.153 -16.176 1.00 0.00 H +ATOM 1541 C THR 266 -26.811 -7.654 -14.967 1.00 0.00 C +ATOM 1542 O THR 266 -27.936 -7.160 -14.888 1.00 0.00 O +ATOM 1543 N LEU 267 -26.597 -8.910 -15.364 1.00 0.00 N +ATOM 1544 H LEU 267 -25.645 -9.223 -15.490 1.00 0.00 H +ATOM 1545 CA LEU 267 -27.677 -9.834 -15.692 1.00 0.00 C +ATOM 1546 HA LEU 267 -28.303 -9.432 -16.489 1.00 0.00 H +ATOM 1547 CB LEU 267 -27.055 -11.156 -16.174 1.00 0.00 C +ATOM 1548 HB2 LEU 267 -26.480 -10.933 -17.073 1.00 0.00 H +ATOM 1549 HB3 LEU 267 -26.382 -11.504 -15.390 1.00 0.00 H +ATOM 1550 CG LEU 267 -28.089 -12.250 -16.485 1.00 0.00 C +ATOM 1551 HG LEU 267 -28.643 -12.474 -15.573 1.00 0.00 H +ATOM 1552 CD1 LEU 267 -29.060 -11.801 -17.572 1.00 0.00 C +ATOM 1553 HD11 LEU 267 -28.507 -11.577 -18.484 1.00 0.00 H +ATOM 1554 HD12 LEU 267 -29.779 -12.596 -17.770 1.00 0.00 H +ATOM 1555 HD13 LEU 267 -29.589 -10.908 -17.241 1.00 0.00 H +ATOM 1556 CD2 LEU 267 -27.376 -13.512 -16.963 1.00 0.00 C +ATOM 1557 HD21 LEU 267 -26.700 -13.866 -16.184 1.00 0.00 H +ATOM 1558 HD22 LEU 267 -28.112 -14.285 -17.183 1.00 0.00 H +ATOM 1559 HD23 LEU 267 -26.805 -13.288 -17.865 1.00 0.00 H +ATOM 1560 C LEU 267 -28.606 -10.042 -14.488 1.00 0.00 C +ATOM 1561 O LEU 267 -29.820 -9.899 -14.613 1.00 0.00 O +ATOM 1562 N ILE 268 -28.034 -10.307 -13.311 1.00 0.00 N +ATOM 1563 H ILE 268 -27.035 -10.450 -13.288 1.00 0.00 H +ATOM 1564 CA ILE 268 -28.795 -10.505 -12.069 1.00 0.00 C +ATOM 1565 HA ILE 268 -29.605 -11.218 -12.218 1.00 0.00 H +ATOM 1566 CB ILE 268 -27.854 -11.018 -10.955 1.00 0.00 C +ATOM 1567 HB ILE 268 -27.004 -10.342 -10.871 1.00 0.00 H +ATOM 1568 CG2 ILE 268 -28.595 -11.082 -9.608 1.00 0.00 C +ATOM 1569 HG21 ILE 268 -29.445 -11.759 -9.692 1.00 0.00 H +ATOM 1570 HG22 ILE 268 -27.916 -11.446 -8.837 1.00 0.00 H +ATOM 1571 HG23 ILE 268 -28.949 -10.086 -9.340 1.00 0.00 H +ATOM 1572 CG1 ILE 268 -27.293 -12.416 -11.312 1.00 0.00 C +ATOM 1573 HG12 ILE 268 -28.107 -13.132 -11.205 1.00 0.00 H +ATOM 1574 HG13 ILE 268 -26.972 -12.383 -12.353 1.00 0.00 H +ATOM 1575 CD1 ILE 268 -26.116 -12.844 -10.428 1.00 0.00 C +ATOM 1576 HD11 ILE 268 -26.436 -12.877 -9.386 1.00 0.00 H +ATOM 1577 HD12 ILE 268 -25.773 -13.833 -10.733 1.00 0.00 H +ATOM 1578 HD13 ILE 268 -25.301 -12.128 -10.534 1.00 0.00 H +ATOM 1579 C ILE 268 -29.536 -9.216 -11.669 1.00 0.00 C +ATOM 1580 O ILE 268 -30.711 -9.267 -11.311 1.00 0.00 O +ATOM 1581 N SER 269 -28.895 -8.051 -11.787 1.00 0.00 N +ATOM 1582 H SER 269 -27.924 -8.087 -12.064 1.00 0.00 H +ATOM 1583 CA SER 269 -29.502 -6.735 -11.550 1.00 0.00 C +ATOM 1584 HA SER 269 -29.864 -6.671 -10.523 1.00 0.00 H +ATOM 1585 CB SER 269 -28.468 -5.633 -11.773 1.00 0.00 C +ATOM 1586 HB2 SER 269 -27.917 -5.842 -12.690 1.00 0.00 H +ATOM 1587 HB3 SER 269 -28.981 -4.676 -11.868 1.00 0.00 H +ATOM 1588 OG SER 269 -27.576 -5.581 -10.693 1.00 0.00 O +ATOM 1589 HG SER 269 -26.931 -4.885 -10.844 1.00 0.00 H +ATOM 1590 C SER 269 -30.673 -6.450 -12.481 1.00 0.00 C +ATOM 1591 O SER 269 -31.685 -5.906 -12.040 1.00 0.00 O +ATOM 1592 N PHE 270 -30.560 -6.802 -13.762 1.00 0.00 N +ATOM 1593 H PHE 270 -29.664 -7.100 -14.120 1.00 0.00 H +ATOM 1594 CA PHE 270 -31.671 -6.673 -14.698 1.00 0.00 C +ATOM 1595 HA PHE 270 -32.122 -5.684 -14.608 1.00 0.00 H +ATOM 1596 CB PHE 270 -31.171 -6.853 -16.134 1.00 0.00 C +ATOM 1597 HB2 PHE 270 -30.350 -6.186 -16.397 1.00 0.00 H +ATOM 1598 HB3 PHE 270 -30.853 -7.888 -16.260 1.00 0.00 H +ATOM 1599 CG PHE 270 -32.267 -6.611 -17.150 1.00 0.00 C +ATOM 1600 CD1 PHE 270 -32.782 -7.672 -17.917 1.00 0.00 C +ATOM 1601 HD1 PHE 270 -32.362 -8.673 -17.819 1.00 0.00 H +ATOM 1602 CE1 PHE 270 -33.839 -7.438 -18.814 1.00 0.00 C +ATOM 1603 HE1 PHE 270 -34.233 -8.255 -19.419 1.00 0.00 H +ATOM 1604 CZ PHE 270 -34.390 -6.149 -18.930 1.00 0.00 C +ATOM 1605 HZ PHE 270 -35.212 -5.973 -19.624 1.00 0.00 H +ATOM 1606 CE2 PHE 270 -33.886 -5.092 -18.158 1.00 0.00 C +ATOM 1607 HE2 PHE 270 -34.319 -4.096 -18.241 1.00 0.00 H +ATOM 1608 CD2 PHE 270 -32.819 -5.322 -17.275 1.00 0.00 C +ATOM 1609 HD2 PHE 270 -32.414 -4.500 -16.683 1.00 0.00 H +ATOM 1610 C PHE 270 -32.799 -7.651 -14.351 1.00 0.00 C +ATOM 1611 O PHE 270 -33.962 -7.259 -14.342 1.00 0.00 O +ATOM 1612 N GLY 271 -32.468 -8.882 -13.950 1.00 0.00 N +ATOM 1613 H GLY 271 -31.503 -9.167 -14.034 1.00 0.00 H +ATOM 1614 CA GLY 271 -33.428 -9.840 -13.395 1.00 0.00 C +ATOM 1615 HA2 GLY 271 -34.141 -10.099 -14.178 1.00 0.00 H +ATOM 1616 HA3 GLY 271 -32.883 -10.733 -13.092 1.00 0.00 H +ATOM 1617 C GLY 271 -34.195 -9.288 -12.187 1.00 0.00 C +ATOM 1618 O GLY 271 -35.417 -9.379 -12.139 1.00 0.00 O +ATOM 1619 N ALA 272 -33.512 -8.628 -11.250 1.00 0.00 N +ATOM 1620 H ALA 272 -32.503 -8.641 -11.297 1.00 0.00 H +ATOM 1621 CA ALA 272 -34.146 -7.937 -10.123 1.00 0.00 C +ATOM 1622 HA ALA 272 -34.770 -8.647 -9.582 1.00 0.00 H +ATOM 1623 CB ALA 272 -33.046 -7.440 -9.188 1.00 0.00 C +ATOM 1624 HB1 ALA 272 -32.419 -6.720 -9.713 1.00 0.00 H +ATOM 1625 HB2 ALA 272 -33.497 -6.961 -8.318 1.00 0.00 H +ATOM 1626 HB3 ALA 272 -32.437 -8.283 -8.862 1.00 0.00 H +ATOM 1627 C ALA 272 -35.050 -6.770 -10.559 1.00 0.00 C +ATOM 1628 O ALA 272 -36.110 -6.545 -9.969 1.00 0.00 O +ATOM 1629 N PHE 273 -34.661 -6.040 -11.607 1.00 0.00 N +ATOM 1630 H PHE 273 -33.729 -6.179 -11.969 1.00 0.00 H +ATOM 1631 CA PHE 273 -35.483 -4.985 -12.197 1.00 0.00 C +ATOM 1632 HA PHE 273 -35.817 -4.285 -11.432 1.00 0.00 H +ATOM 1633 CB PHE 273 -34.641 -4.222 -13.226 1.00 0.00 C +ATOM 1634 HB2 PHE 273 -33.643 -4.007 -12.843 1.00 0.00 H +ATOM 1635 HB3 PHE 273 -34.560 -4.813 -14.139 1.00 0.00 H +ATOM 1636 CG PHE 273 -35.247 -2.897 -13.621 1.00 0.00 C +ATOM 1637 CD1 PHE 273 -36.157 -2.820 -14.692 1.00 0.00 C +ATOM 1638 HD1 PHE 273 -36.402 -3.712 -15.270 1.00 0.00 H +ATOM 1639 CE1 PHE 273 -36.751 -1.588 -15.016 1.00 0.00 C +ATOM 1640 HE1 PHE 273 -37.451 -1.518 -15.848 1.00 0.00 H +ATOM 1641 CZ PHE 273 -36.440 -0.444 -14.261 1.00 0.00 C +ATOM 1642 HZ PHE 273 -36.928 0.503 -14.496 1.00 0.00 H +ATOM 1643 CE2 PHE 273 -35.509 -0.513 -13.214 1.00 0.00 C +ATOM 1644 HE2 PHE 273 -35.249 0.385 -12.652 1.00 0.00 H +ATOM 1645 CD2 PHE 273 -34.913 -1.741 -12.891 1.00 0.00 C +ATOM 1646 HD2 PHE 273 -34.192 -1.800 -12.076 1.00 0.00 H +ATOM 1647 C PHE 273 -36.777 -5.551 -12.807 1.00 0.00 C +ATOM 1648 O PHE 273 -37.860 -5.010 -12.581 1.00 0.00 O +ATOM 1649 N VAL 274 -36.685 -6.686 -13.510 1.00 0.00 N +ATOM 1650 H VAL 274 -35.759 -7.013 -13.744 1.00 0.00 H +ATOM 1651 CA VAL 274 -37.841 -7.433 -14.030 1.00 0.00 C +ATOM 1652 HA VAL 274 -38.499 -6.757 -14.576 1.00 0.00 H +ATOM 1653 CB VAL 274 -37.389 -8.558 -14.984 1.00 0.00 C +ATOM 1654 HB VAL 274 -36.673 -9.188 -14.456 1.00 0.00 H +ATOM 1655 CG1 VAL 274 -38.570 -9.414 -15.459 1.00 0.00 C +ATOM 1656 HG11 VAL 274 -39.286 -8.785 -15.988 1.00 0.00 H +ATOM 1657 HG12 VAL 274 -38.207 -10.195 -16.129 1.00 0.00 H +ATOM 1658 HG13 VAL 274 -39.056 -9.873 -14.598 1.00 0.00 H +ATOM 1659 CG2 VAL 274 -36.702 -8.001 -16.241 1.00 0.00 C +ATOM 1660 HG21 VAL 274 -35.822 -7.426 -15.950 1.00 0.00 H +ATOM 1661 HG22 VAL 274 -36.399 -8.826 -16.885 1.00 0.00 H +ATOM 1662 HG23 VAL 274 -37.395 -7.356 -16.779 1.00 0.00 H +ATOM 1663 C VAL 274 -38.697 -7.991 -12.887 1.00 0.00 C +ATOM 1664 O VAL 274 -39.917 -7.877 -12.941 1.00 0.00 O +ATOM 1665 N ALA 275 -38.099 -8.525 -11.817 1.00 0.00 N +ATOM 1666 H ALA 275 -37.096 -8.642 -11.837 1.00 0.00 H +ATOM 1667 CA ALA 275 -38.836 -9.038 -10.659 1.00 0.00 C +ATOM 1668 HA ALA 275 -39.532 -9.800 -11.009 1.00 0.00 H +ATOM 1669 CB ALA 275 -37.841 -9.691 -9.692 1.00 0.00 C +ATOM 1670 HB1 ALA 275 -37.142 -8.938 -9.326 1.00 0.00 H +ATOM 1671 HB2 ALA 275 -38.382 -10.124 -8.851 1.00 0.00 H +ATOM 1672 HB3 ALA 275 -37.290 -10.476 -10.211 1.00 0.00 H +ATOM 1673 C ALA 275 -39.682 -7.949 -9.970 1.00 0.00 C +ATOM 1674 O ALA 275 -40.830 -8.198 -9.598 1.00 0.00 O +ATOM 1675 N LYS 276 -39.162 -6.716 -9.870 1.00 0.00 N +ATOM 1676 H LYS 276 -38.176 -6.593 -10.056 1.00 0.00 H +ATOM 1677 CA LYS 276 -39.938 -5.551 -9.412 1.00 0.00 C +ATOM 1678 HA LYS 276 -40.380 -5.760 -8.437 1.00 0.00 H +ATOM 1679 CB LYS 276 -39.029 -4.317 -9.286 1.00 0.00 C +ATOM 1680 HB2 LYS 276 -38.329 -4.292 -10.121 1.00 0.00 H +ATOM 1681 HB3 LYS 276 -39.637 -3.412 -9.294 1.00 0.00 H +ATOM 1682 CG LYS 276 -38.252 -4.396 -7.971 1.00 0.00 C +ATOM 1683 HG2 LYS 276 -38.990 -4.486 -7.173 1.00 0.00 H +ATOM 1684 HG3 LYS 276 -37.651 -5.304 -8.014 1.00 0.00 H +ATOM 1685 CD LYS 276 -37.343 -3.196 -7.694 1.00 0.00 C +ATOM 1686 HD2 LYS 276 -37.911 -2.283 -7.874 1.00 0.00 H +ATOM 1687 HD3 LYS 276 -37.034 -3.231 -6.649 1.00 0.00 H +ATOM 1688 CE LYS 276 -36.108 -3.211 -8.591 1.00 0.00 C +ATOM 1689 HE2 LYS 276 -35.762 -4.239 -8.696 1.00 0.00 H +ATOM 1690 HE3 LYS 276 -36.380 -2.818 -9.570 1.00 0.00 H +ATOM 1691 NZ LYS 276 -35.028 -2.385 -8.012 1.00 0.00 N +ATOM 1692 HZ1 LYS 276 -34.775 -2.750 -7.105 1.00 0.00 H +ATOM 1693 HZ2 LYS 276 -34.222 -2.409 -8.622 1.00 0.00 H +ATOM 1694 HZ3 LYS 276 -35.348 -1.432 -7.915 1.00 0.00 H +ATOM 1695 C LYS 276 -41.130 -5.262 -10.318 1.00 0.00 C +ATOM 1696 O LYS 276 -42.234 -5.069 -9.821 1.00 0.00 O +ATOM 1697 N HIE 277 -40.937 -5.292 -11.636 1.00 0.00 N +ATOM 1698 H HIE 277 -39.996 -5.361 -11.995 1.00 0.00 H +ATOM 1699 CA HIE 277 -42.036 -5.131 -12.594 1.00 0.00 C +ATOM 1700 HA HIE 277 -42.576 -4.203 -12.399 1.00 0.00 H +ATOM 1701 CB HIE 277 -41.469 -5.076 -14.011 1.00 0.00 C +ATOM 1702 HB2 HIE 277 -40.818 -4.216 -14.166 1.00 0.00 H +ATOM 1703 HB3 HIE 277 -40.912 -5.993 -14.205 1.00 0.00 H +ATOM 1704 CG HIE 277 -42.545 -4.997 -15.062 1.00 0.00 C +ATOM 1705 ND1 HIE 277 -43.337 -3.880 -15.324 1.00 0.00 N +ATOM 1706 CE1 HIE 277 -44.188 -4.260 -16.290 1.00 0.00 C +ATOM 1707 HE1 HIE 277 -44.924 -3.539 -16.644 1.00 0.00 H +ATOM 1708 NE2 HIE 277 -43.954 -5.534 -16.654 1.00 0.00 N +ATOM 1709 HE2 HIE 277 -44.438 -6.059 -17.369 1.00 0.00 H +ATOM 1710 CD2 HIE 277 -42.928 -6.017 -15.881 1.00 0.00 C +ATOM 1711 HD2 HIE 277 -42.587 -7.045 -16.007 1.00 0.00 H +ATOM 1712 C HIE 277 -43.095 -6.231 -12.446 1.00 0.00 C +ATOM 1713 O HIE 277 -44.277 -5.916 -12.327 1.00 0.00 O +ATOM 1714 N LEU 278 -42.683 -7.499 -12.339 1.00 0.00 N +ATOM 1715 H LEU 278 -41.700 -7.687 -12.467 1.00 0.00 H +ATOM 1716 CA LEU 278 -43.586 -8.634 -12.121 1.00 0.00 C +ATOM 1717 HA LEU 278 -44.293 -8.714 -12.947 1.00 0.00 H +ATOM 1718 CB LEU 278 -42.778 -9.940 -12.037 1.00 0.00 C +ATOM 1719 HB2 LEU 278 -41.981 -9.762 -11.315 1.00 0.00 H +ATOM 1720 HB3 LEU 278 -43.450 -10.707 -11.653 1.00 0.00 H +ATOM 1721 CG LEU 278 -42.166 -10.415 -13.370 1.00 0.00 C +ATOM 1722 HG LEU 278 -41.594 -9.603 -13.819 1.00 0.00 H +ATOM 1723 CD1 LEU 278 -41.242 -11.604 -13.108 1.00 0.00 C +ATOM 1724 HD11 LEU 278 -41.813 -12.417 -12.659 1.00 0.00 H +ATOM 1725 HD12 LEU 278 -40.807 -11.942 -14.049 1.00 0.00 H +ATOM 1726 HD13 LEU 278 -40.444 -11.303 -12.428 1.00 0.00 H +ATOM 1727 CD2 LEU 278 -43.233 -10.843 -14.377 1.00 0.00 C +ATOM 1728 HD21 LEU 278 -43.892 -10.001 -14.589 1.00 0.00 H +ATOM 1729 HD22 LEU 278 -42.753 -11.169 -15.299 1.00 0.00 H +ATOM 1730 HD23 LEU 278 -43.816 -11.664 -13.962 1.00 0.00 H +ATOM 1731 C LEU 278 -44.447 -8.448 -10.863 1.00 0.00 C +ATOM 1732 O LEU 278 -45.651 -8.697 -10.907 1.00 0.00 O +ATOM 1733 N LYS 279 -43.873 -7.927 -9.768 1.00 0.00 N +ATOM 1734 H LYS 279 -42.866 -7.851 -9.735 1.00 0.00 H +ATOM 1735 CA LYS 279 -44.641 -7.553 -8.570 1.00 0.00 C +ATOM 1736 HA LYS 279 -45.219 -8.406 -8.213 1.00 0.00 H +ATOM 1737 CB LYS 279 -43.680 -7.107 -7.453 1.00 0.00 C +ATOM 1738 HB2 LYS 279 -43.025 -7.953 -7.243 1.00 0.00 H +ATOM 1739 HB3 LYS 279 -43.091 -6.283 -7.853 1.00 0.00 H +ATOM 1740 CG LYS 279 -44.375 -6.660 -6.154 1.00 0.00 C +ATOM 1741 HG2 LYS 279 -43.617 -6.227 -5.502 1.00 0.00 H +ATOM 1742 HG3 LYS 279 -45.109 -5.897 -6.413 1.00 0.00 H +ATOM 1743 CD LYS 279 -45.070 -7.812 -5.432 1.00 0.00 C +ATOM 1744 HD2 LYS 279 -45.916 -8.141 -6.037 1.00 0.00 H +ATOM 1745 HD3 LYS 279 -44.362 -8.631 -5.321 1.00 0.00 H +ATOM 1746 CE LYS 279 -45.571 -7.378 -4.050 1.00 0.00 C +ATOM 1747 HE2 LYS 279 -44.710 -7.089 -3.447 1.00 0.00 H +ATOM 1748 HE3 LYS 279 -46.230 -6.519 -4.176 1.00 0.00 H +ATOM 1749 NZ LYS 279 -46.305 -8.469 -3.369 1.00 0.00 N +ATOM 1750 HZ1 LYS 279 -45.694 -9.264 -3.252 1.00 0.00 H +ATOM 1751 HZ2 LYS 279 -46.619 -8.149 -2.464 1.00 0.00 H +ATOM 1752 HZ3 LYS 279 -47.103 -8.736 -3.927 1.00 0.00 H +ATOM 1753 C LYS 279 -45.689 -6.480 -8.870 1.00 0.00 C +ATOM 1754 O LYS 279 -46.829 -6.625 -8.440 1.00 0.00 O +ATOM 1755 N THR 280 -45.340 -5.429 -9.619 1.00 0.00 N +ATOM 1756 H THR 280 -44.382 -5.337 -9.922 1.00 0.00 H +ATOM 1757 CA THR 280 -46.285 -4.337 -9.939 1.00 0.00 C +ATOM 1758 HA THR 280 -46.801 -3.987 -9.045 1.00 0.00 H +ATOM 1759 CB THR 280 -45.617 -3.135 -10.623 1.00 0.00 C +ATOM 1760 HB THR 280 -46.393 -2.398 -10.832 1.00 0.00 H +ATOM 1761 CG2 THR 280 -44.525 -2.496 -9.767 1.00 0.00 C +ATOM 1762 HG21 THR 280 -43.749 -3.232 -9.558 1.00 0.00 H +ATOM 1763 HG22 THR 280 -44.090 -1.652 -10.303 1.00 0.00 H +ATOM 1764 HG23 THR 280 -44.955 -2.146 -8.829 1.00 0.00 H +ATOM 1765 OG1 THR 280 -45.065 -3.424 -11.886 1.00 0.00 O +ATOM 1766 HG1 THR 280 -44.667 -2.631 -12.250 1.00 0.00 H +ATOM 1767 C THR 280 -47.473 -4.781 -10.790 1.00 0.00 C +ATOM 1768 O THR 280 -48.557 -4.222 -10.646 1.00 0.00 O +ATOM 1769 N ILE 281 -47.299 -5.809 -11.627 1.00 0.00 N +ATOM 1770 H ILE 281 -46.348 -6.101 -11.801 1.00 0.00 H +ATOM 1771 CA ILE 281 -48.374 -6.411 -12.435 1.00 0.00 C +ATOM 1772 HA ILE 281 -49.277 -5.801 -12.442 1.00 0.00 H +ATOM 1773 CB ILE 281 -47.914 -6.666 -13.888 1.00 0.00 C +ATOM 1774 HB ILE 281 -48.744 -7.094 -14.451 1.00 0.00 H +ATOM 1775 CG2 ILE 281 -47.467 -5.351 -14.554 1.00 0.00 C +ATOM 1776 HG21 ILE 281 -46.637 -4.922 -13.993 1.00 0.00 H +ATOM 1777 HG22 ILE 281 -47.147 -5.551 -15.577 1.00 0.00 H +ATOM 1778 HG23 ILE 281 -48.299 -4.647 -14.565 1.00 0.00 H +ATOM 1779 CG1 ILE 281 -46.809 -7.738 -13.954 1.00 0.00 C +ATOM 1780 HG12 ILE 281 -45.917 -7.315 -13.492 1.00 0.00 H +ATOM 1781 HG13 ILE 281 -47.150 -8.594 -13.370 1.00 0.00 H +ATOM 1782 CD1 ILE 281 -46.479 -8.193 -15.377 1.00 0.00 C +ATOM 1783 HD11 ILE 281 -46.138 -7.339 -15.963 1.00 0.00 H +ATOM 1784 HD12 ILE 281 -45.693 -8.948 -15.344 1.00 0.00 H +ATOM 1785 HD13 ILE 281 -47.370 -8.617 -15.840 1.00 0.00 H +ATOM 1786 C ILE 281 -49.001 -7.653 -11.776 1.00 0.00 C +ATOM 1787 O ILE 281 -49.738 -8.390 -12.426 1.00 0.00 O +ATOM 1788 N ASN 282 -48.718 -7.889 -10.489 1.00 0.00 N +ATOM 1789 H ASN 282 -47.952 -7.351 -10.109 1.00 0.00 H +ATOM 1790 CA ASN 282 -49.268 -8.982 -9.681 1.00 0.00 C +ATOM 1791 HA ASN 282 -48.750 -9.057 -8.725 1.00 0.00 H +ATOM 1792 CB ASN 282 -50.757 -8.683 -9.413 1.00 0.00 C +ATOM 1793 HB2 ASN 282 -50.899 -7.603 -9.458 1.00 0.00 H +ATOM 1794 HB3 ASN 282 -51.368 -9.163 -10.178 1.00 0.00 H +ATOM 1795 CG ASN 282 -51.209 -9.173 -8.056 1.00 0.00 C +ATOM 1796 OD1 ASN 282 -51.139 -8.468 -7.066 1.00 0.00 O +ATOM 1797 ND2 ASN 282 -51.666 -10.396 -7.962 1.00 0.00 N +ATOM 1798 HD21 ASN 282 -51.975 -10.750 -7.068 1.00 0.00 H +ATOM 1799 HD22 ASN 282 -51.708 -10.981 -8.785 1.00 0.00 H +ATOM 1800 C ASN 282 -48.954 -10.400 -10.220 1.00 0.00 C +ATOM 1801 O ASN 282 -49.737 -11.331 -10.036 1.00 0.00 O +ATOM 1802 N GLN 283 -47.791 -10.561 -10.863 1.00 0.00 N +ATOM 1803 H GLN 283 -47.285 -9.702 -11.024 1.00 0.00 H +ATOM 1804 CA GLN 283 -47.246 -11.809 -11.425 1.00 0.00 C +ATOM 1805 HA GLN 283 -47.999 -12.597 -11.386 1.00 0.00 H +ATOM 1806 CB GLN 283 -46.838 -11.589 -12.894 1.00 0.00 C +ATOM 1807 HB2 GLN 283 -46.200 -10.706 -12.928 1.00 0.00 H +ATOM 1808 HB3 GLN 283 -46.266 -12.462 -13.210 1.00 0.00 H +ATOM 1809 CG GLN 283 -48.033 -11.394 -13.836 1.00 0.00 C +ATOM 1810 HG2 GLN 283 -48.675 -10.628 -13.400 1.00 0.00 H +ATOM 1811 HG3 GLN 283 -47.665 -11.052 -14.803 1.00 0.00 H +ATOM 1812 CD GLN 283 -48.859 -12.660 -14.048 1.00 0.00 C +ATOM 1813 OE1 GLN 283 -48.490 -13.766 -13.690 1.00 0.00 O +ATOM 1814 NE2 GLN 283 -50.016 -12.551 -14.658 1.00 0.00 N +ATOM 1815 HE21 GLN 283 -50.583 -13.373 -14.811 1.00 0.00 H +ATOM 1816 HE22 GLN 283 -50.335 -11.646 -14.972 1.00 0.00 H +ATOM 1817 C GLN 283 -46.080 -12.350 -10.578 1.00 0.00 C +ATOM 1818 O GLN 283 -45.052 -12.790 -11.090 1.00 0.00 O +ATOM 1819 N GLU 284 -46.209 -12.298 -9.252 1.00 0.00 N +ATOM 1820 H GLU 284 -47.077 -11.956 -8.865 1.00 0.00 H +ATOM 1821 CA GLU 284 -45.138 -12.696 -8.322 1.00 0.00 C +ATOM 1822 HA GLU 284 -44.235 -12.118 -8.517 1.00 0.00 H +ATOM 1823 CB GLU 284 -45.583 -12.435 -6.885 1.00 0.00 C +ATOM 1824 HB2 GLU 284 -46.545 -12.920 -6.718 1.00 0.00 H +ATOM 1825 HB3 GLU 284 -44.843 -12.854 -6.203 1.00 0.00 H +ATOM 1826 CG GLU 284 -45.718 -10.943 -6.631 1.00 0.00 C +ATOM 1827 HG2 GLU 284 -44.666 -10.660 -6.669 1.00 0.00 H +ATOM 1828 HG3 GLU 284 -46.282 -10.344 -7.346 1.00 0.00 H +ATOM 1829 CD GLU 284 -46.258 -10.702 -5.230 1.00 0.00 C +ATOM 1830 OE1 GLU 284 -47.334 -10.077 -5.122 1.00 0.00 O +ATOM 1831 OE2 GLU 284 -45.534 -10.924 -4.232 1.00 0.00 O +ATOM 1832 C GLU 284 -44.742 -14.169 -8.434 1.00 0.00 C +ATOM 1833 O GLU 284 -43.588 -14.513 -8.188 1.00 0.00 O +ATOM 1834 N SER 285 -45.673 -15.031 -8.855 1.00 0.00 N +ATOM 1835 H SER 285 -46.619 -14.693 -8.953 1.00 0.00 H +ATOM 1836 CA SER 285 -45.406 -16.444 -9.138 1.00 0.00 C +ATOM 1837 HA SER 285 -45.018 -16.937 -8.246 1.00 0.00 H +ATOM 1838 CB SER 285 -46.701 -17.145 -9.560 1.00 0.00 C +ATOM 1839 HB2 SER 285 -46.468 -18.159 -9.884 1.00 0.00 H +ATOM 1840 HB3 SER 285 -47.380 -17.184 -8.709 1.00 0.00 H +ATOM 1841 OG SER 285 -47.316 -16.441 -10.623 1.00 0.00 O +ATOM 1842 HG SER 285 -48.126 -16.889 -10.878 1.00 0.00 H +ATOM 1843 C SER 285 -44.347 -16.644 -10.224 1.00 0.00 C +ATOM 1844 O SER 285 -43.709 -17.688 -10.252 1.00 0.00 O +ATOM 1845 N CYS 286 -44.114 -15.641 -11.080 1.00 0.00 N +ATOM 1846 H CYS 286 -44.707 -14.826 -11.016 1.00 0.00 H +ATOM 1847 CA CYS 286 -43.109 -15.686 -12.141 1.00 0.00 C +ATOM 1848 HA CYS 286 -43.015 -16.697 -12.538 1.00 0.00 H +ATOM 1849 CB CYS 286 -43.545 -14.754 -13.277 1.00 0.00 C +ATOM 1850 HB2 CYS 286 -43.663 -13.728 -12.928 1.00 0.00 H +ATOM 1851 HB3 CYS 286 -42.834 -14.775 -14.104 1.00 0.00 H +ATOM 1852 SG CYS 286 -45.146 -15.235 -13.977 1.00 0.00 S +ATOM 1853 HG CYS 286 -45.200 -14.261 -14.882 1.00 0.00 H +ATOM 1854 C CYS 286 -41.690 -15.327 -11.664 1.00 0.00 C +ATOM 1855 O CYS 286 -40.738 -15.477 -12.428 1.00 0.00 O +ATOM 1856 N ILE 287 -41.518 -14.860 -10.419 1.00 0.00 N +ATOM 1857 H ILE 287 -42.333 -14.703 -9.844 1.00 0.00 H +ATOM 1858 CA ILE 287 -40.203 -14.459 -9.890 1.00 0.00 C +ATOM 1859 HA ILE 287 -39.655 -13.877 -10.632 1.00 0.00 H +ATOM 1860 CB ILE 287 -40.360 -13.626 -8.595 1.00 0.00 C +ATOM 1861 HB ILE 287 -40.962 -14.191 -7.884 1.00 0.00 H +ATOM 1862 CG2 ILE 287 -38.983 -13.316 -7.969 1.00 0.00 C +ATOM 1863 HG21 ILE 287 -38.380 -12.748 -8.678 1.00 0.00 H +ATOM 1864 HG22 ILE 287 -39.120 -12.730 -7.060 1.00 0.00 H +ATOM 1865 HG23 ILE 287 -38.476 -14.249 -7.725 1.00 0.00 H +ATOM 1866 CG1 ILE 287 -41.114 -12.307 -8.895 1.00 0.00 C +ATOM 1867 HG12 ILE 287 -40.446 -11.678 -9.483 1.00 0.00 H +ATOM 1868 HG13 ILE 287 -41.990 -12.563 -9.492 1.00 0.00 H +ATOM 1869 CD1 ILE 287 -41.555 -11.549 -7.638 1.00 0.00 C +ATOM 1870 HD11 ILE 287 -40.680 -11.293 -7.041 1.00 0.00 H +ATOM 1871 HD12 ILE 287 -42.077 -10.637 -7.928 1.00 0.00 H +ATOM 1872 HD13 ILE 287 -42.224 -12.178 -7.050 1.00 0.00 H +ATOM 1873 C ILE 287 -39.292 -15.676 -9.680 1.00 0.00 C +ATOM 1874 O ILE 287 -38.106 -15.599 -9.997 1.00 0.00 O +ATOM 1875 N GLU 288 -39.827 -16.797 -9.186 1.00 0.00 N +ATOM 1876 H GLU 288 -40.768 -16.773 -8.819 1.00 0.00 H +ATOM 1877 CA GLU 288 -39.035 -18.023 -8.998 1.00 0.00 C +ATOM 1878 HA GLU 288 -38.071 -17.766 -8.560 1.00 0.00 H +ATOM 1879 CB GLU 288 -39.752 -19.017 -8.064 1.00 0.00 C +ATOM 1880 HB2 GLU 288 -40.256 -18.444 -7.287 1.00 0.00 H +ATOM 1881 HB3 GLU 288 -40.492 -19.558 -8.654 1.00 0.00 H +ATOM 1882 CG GLU 288 -38.784 -20.019 -7.414 1.00 0.00 C +ATOM 1883 HG2 GLU 288 -39.456 -20.767 -6.995 1.00 0.00 H +ATOM 1884 HG3 GLU 288 -38.131 -20.488 -8.150 1.00 0.00 H +ATOM 1885 CD GLU 288 -37.931 -19.406 -6.287 1.00 0.00 C +ATOM 1886 OE1 GLU 288 -36.970 -20.055 -5.824 1.00 0.00 O +ATOM 1887 OE2 GLU 288 -38.279 -18.310 -5.772 1.00 0.00 O +ATOM 1888 C GLU 288 -38.616 -18.639 -10.348 1.00 0.00 C +ATOM 1889 O GLU 288 -37.414 -18.815 -10.546 1.00 0.00 O +ATOM 1890 N PRO 289 -39.518 -18.821 -11.341 1.00 0.00 N +ATOM 1891 CD PRO 289 -40.975 -18.786 -11.249 1.00 0.00 C +ATOM 1892 HD2 PRO 289 -41.283 -17.741 -11.223 1.00 0.00 H +ATOM 1893 HD3 PRO 289 -41.264 -19.273 -10.318 1.00 0.00 H +ATOM 1894 CG PRO 289 -41.498 -19.521 -12.476 1.00 0.00 C +ATOM 1895 HG2 PRO 289 -42.464 -19.125 -12.791 1.00 0.00 H +ATOM 1896 HG3 PRO 289 -41.588 -20.590 -12.286 1.00 0.00 H +ATOM 1897 CB PRO 289 -40.419 -19.241 -13.513 1.00 0.00 C +ATOM 1898 HB2 PRO 289 -40.555 -18.275 -13.999 1.00 0.00 H +ATOM 1899 HB3 PRO 289 -40.375 -20.025 -14.270 1.00 0.00 H +ATOM 1900 CA PRO 289 -39.124 -19.233 -12.694 1.00 0.00 C +ATOM 1901 HA PRO 289 -38.714 -20.241 -12.617 1.00 0.00 H +ATOM 1902 C PRO 289 -38.088 -18.311 -13.353 1.00 0.00 C +ATOM 1903 O PRO 289 -37.203 -18.771 -14.075 1.00 0.00 O +ATOM 1904 N LEU 290 -38.164 -16.997 -13.106 1.00 0.00 N +ATOM 1905 H LEU 290 -38.972 -16.630 -12.623 1.00 0.00 H +ATOM 1906 CA LEU 290 -37.154 -16.051 -13.582 1.00 0.00 C +ATOM 1907 HA LEU 290 -37.003 -16.164 -14.656 1.00 0.00 H +ATOM 1908 CB LEU 290 -37.636 -14.616 -13.300 1.00 0.00 C +ATOM 1909 HB2 LEU 290 -38.545 -14.468 -13.883 1.00 0.00 H +ATOM 1910 HB3 LEU 290 -37.873 -14.558 -12.238 1.00 0.00 H +ATOM 1911 CG LEU 290 -36.615 -13.523 -13.659 1.00 0.00 C +ATOM 1912 HG LEU 290 -35.707 -13.708 -13.084 1.00 0.00 H +ATOM 1913 CD1 LEU 290 -36.280 -13.509 -15.148 1.00 0.00 C +ATOM 1914 HD11 LEU 290 -37.188 -13.324 -15.723 1.00 0.00 H +ATOM 1915 HD12 LEU 290 -35.555 -12.720 -15.351 1.00 0.00 H +ATOM 1916 HD13 LEU 290 -35.859 -14.472 -15.436 1.00 0.00 H +ATOM 1917 CD2 LEU 290 -37.185 -12.159 -13.280 1.00 0.00 C +ATOM 1918 HD21 LEU 290 -37.386 -12.133 -12.209 1.00 0.00 H +ATOM 1919 HD22 LEU 290 -36.465 -11.380 -13.532 1.00 0.00 H +ATOM 1920 HD23 LEU 290 -38.111 -11.987 -13.827 1.00 0.00 H +ATOM 1921 C LEU 290 -35.783 -16.327 -12.945 1.00 0.00 C +ATOM 1922 O LEU 290 -34.770 -16.332 -13.645 1.00 0.00 O +ATOM 1923 N ALA 291 -35.741 -16.560 -11.632 1.00 0.00 N +ATOM 1924 H ALA 291 -36.596 -16.471 -11.102 1.00 0.00 H +ATOM 1925 CA ALA 291 -34.508 -16.853 -10.913 1.00 0.00 C +ATOM 1926 HA ALA 291 -33.771 -16.085 -11.149 1.00 0.00 H +ATOM 1927 CB ALA 291 -34.799 -16.807 -9.414 1.00 0.00 C +ATOM 1928 HB1 ALA 291 -35.528 -17.576 -9.161 1.00 0.00 H +ATOM 1929 HB2 ALA 291 -33.878 -16.983 -8.858 1.00 0.00 H +ATOM 1930 HB3 ALA 291 -35.200 -15.828 -9.151 1.00 0.00 H +ATOM 1931 C ALA 291 -33.895 -18.200 -11.331 1.00 0.00 C +ATOM 1932 O ALA 291 -32.684 -18.272 -11.564 1.00 0.00 O +ATOM 1933 N GLU 292 -34.724 -19.231 -11.506 1.00 0.00 N +ATOM 1934 H GLU 292 -35.679 -19.113 -11.197 1.00 0.00 H +ATOM 1935 CA GLU 292 -34.332 -20.523 -12.077 1.00 0.00 C +ATOM 1936 HA GLU 292 -33.568 -20.986 -11.454 1.00 0.00 H +ATOM 1937 CB GLU 292 -35.541 -21.463 -12.152 1.00 0.00 C +ATOM 1938 HB2 GLU 292 -36.365 -20.915 -12.608 1.00 0.00 H +ATOM 1939 HB3 GLU 292 -35.271 -22.307 -12.787 1.00 0.00 H +ATOM 1940 CG GLU 292 -35.973 -21.980 -10.771 1.00 0.00 C +ATOM 1941 HG2 GLU 292 -35.151 -22.568 -10.361 1.00 0.00 H +ATOM 1942 HG3 GLU 292 -36.152 -21.114 -10.134 1.00 0.00 H +ATOM 1943 CD GLU 292 -37.243 -22.846 -10.828 1.00 0.00 C +ATOM 1944 OE1 GLU 292 -37.772 -23.159 -9.739 1.00 0.00 O +ATOM 1945 OE2 GLU 292 -37.685 -23.192 -11.949 1.00 0.00 O +ATOM 1946 C GLU 292 -33.735 -20.339 -13.469 1.00 0.00 C +ATOM 1947 O GLU 292 -32.633 -20.810 -13.737 1.00 0.00 O +ATOM 1948 N SER 293 -34.385 -19.555 -14.334 1.00 0.00 N +ATOM 1949 H SER 293 -35.276 -19.154 -14.076 1.00 0.00 H +ATOM 1950 CA SER 293 -33.877 -19.304 -15.678 1.00 0.00 C +ATOM 1951 HA SER 293 -33.686 -20.251 -16.183 1.00 0.00 H +ATOM 1952 CB SER 293 -34.893 -18.514 -16.491 1.00 0.00 C +ATOM 1953 HB2 SER 293 -35.817 -19.080 -16.612 1.00 0.00 H +ATOM 1954 HB3 SER 293 -35.113 -17.558 -16.016 1.00 0.00 H +ATOM 1955 OG SER 293 -34.309 -18.287 -17.760 1.00 0.00 O +ATOM 1956 HG SER 293 -34.919 -17.789 -18.308 1.00 0.00 H +ATOM 1957 C SER 293 -32.537 -18.563 -15.695 1.00 0.00 C +ATOM 1958 O SER 293 -31.686 -18.895 -16.522 1.00 0.00 O +ATOM 1959 N ILE 294 -32.343 -17.547 -14.849 1.00 0.00 N +ATOM 1960 H ILE 294 -33.112 -17.222 -14.280 1.00 0.00 H +ATOM 1961 CA ILE 294 -31.056 -16.836 -14.754 1.00 0.00 C +ATOM 1962 HA ILE 294 -30.763 -16.494 -15.747 1.00 0.00 H +ATOM 1963 CB ILE 294 -31.160 -15.621 -13.802 1.00 0.00 C +ATOM 1964 HB ILE 294 -31.596 -15.957 -12.861 1.00 0.00 H +ATOM 1965 CG2 ILE 294 -29.776 -14.993 -13.532 1.00 0.00 C +ATOM 1966 HG21 ILE 294 -29.339 -14.657 -14.472 1.00 0.00 H +ATOM 1967 HG22 ILE 294 -29.888 -14.143 -12.859 1.00 0.00 H +ATOM 1968 HG23 ILE 294 -29.123 -15.736 -13.074 1.00 0.00 H +ATOM 1969 CG1 ILE 294 -32.071 -14.530 -14.397 1.00 0.00 C +ATOM 1970 HG12 ILE 294 -31.503 -14.026 -15.179 1.00 0.00 H +ATOM 1971 HG13 ILE 294 -32.931 -15.034 -14.840 1.00 0.00 H +ATOM 1972 CD1 ILE 294 -32.555 -13.501 -13.375 1.00 0.00 C +ATOM 1973 HD11 ILE 294 -31.695 -12.997 -12.932 1.00 0.00 H +ATOM 1974 HD12 ILE 294 -33.190 -12.766 -13.870 1.00 0.00 H +ATOM 1975 HD13 ILE 294 -33.123 -14.003 -12.593 1.00 0.00 H +ATOM 1976 C ILE 294 -29.971 -17.809 -14.284 1.00 0.00 C +ATOM 1977 O ILE 294 -28.866 -17.821 -14.832 1.00 0.00 O +ATOM 1978 N THR 295 -30.297 -18.638 -13.292 1.00 0.00 N +ATOM 1979 H THR 295 -31.215 -18.546 -12.880 1.00 0.00 H +ATOM 1980 CA THR 295 -29.375 -19.623 -12.722 1.00 0.00 C +ATOM 1981 HA THR 295 -28.457 -19.103 -12.448 1.00 0.00 H +ATOM 1982 CB THR 295 -29.962 -20.276 -11.467 1.00 0.00 C +ATOM 1983 HB THR 295 -30.816 -20.892 -11.746 1.00 0.00 H +ATOM 1984 CG2 THR 295 -28.906 -21.147 -10.793 1.00 0.00 C +ATOM 1985 HG21 THR 295 -28.051 -20.531 -10.513 1.00 0.00 H +ATOM 1986 HG22 THR 295 -29.329 -21.608 -9.901 1.00 0.00 H +ATOM 1987 HG23 THR 295 -28.581 -21.925 -11.484 1.00 0.00 H +ATOM 1988 OG1 THR 295 -30.341 -19.273 -10.550 1.00 0.00 O +ATOM 1989 HG1 THR 295 -30.708 -19.682 -9.762 1.00 0.00 H +ATOM 1990 C THR 295 -29.003 -20.694 -13.743 1.00 0.00 C +ATOM 1991 O THR 295 -27.823 -20.995 -13.896 1.00 0.00 O +ATOM 1992 N ASP 296 -29.977 -21.209 -14.494 1.00 0.00 N +ATOM 1993 H ASP 296 -30.923 -20.940 -14.266 1.00 0.00 H +ATOM 1994 CA ASP 296 -29.770 -22.154 -15.591 1.00 0.00 C +ATOM 1995 HA ASP 296 -29.341 -23.080 -15.209 1.00 0.00 H +ATOM 1996 CB ASP 296 -31.117 -22.479 -16.271 1.00 0.00 C +ATOM 1997 HB2 ASP 296 -31.661 -21.589 -15.955 1.00 0.00 H +ATOM 1998 HB3 ASP 296 -31.091 -22.521 -17.359 1.00 0.00 H +ATOM 1999 CG ASP 296 -31.821 -23.724 -15.730 1.00 0.00 C +ATOM 2000 OD1 ASP 296 -31.307 -24.339 -14.777 1.00 0.00 O +ATOM 2001 OD2 ASP 296 -32.765 -24.198 -16.396 1.00 0.00 O +ATOM 2002 C ASP 296 -28.794 -21.599 -16.625 1.00 0.00 C +ATOM 2003 O ASP 296 -27.808 -22.257 -16.951 1.00 0.00 O +ATOM 2004 N VAL 297 -29.028 -20.375 -17.111 1.00 0.00 N +ATOM 2005 H VAL 297 -29.874 -19.891 -16.846 1.00 0.00 H +ATOM 2006 CA VAL 297 -28.141 -19.742 -18.096 1.00 0.00 C +ATOM 2007 HA VAL 297 -28.040 -20.403 -18.957 1.00 0.00 H +ATOM 2008 CB VAL 297 -28.710 -18.392 -18.576 1.00 0.00 C +ATOM 2009 HB VAL 297 -28.953 -17.798 -17.695 1.00 0.00 H +ATOM 2010 CG1 VAL 297 -27.721 -17.615 -19.459 1.00 0.00 C +ATOM 2011 HG11 VAL 297 -27.478 -18.208 -20.341 1.00 0.00 H +ATOM 2012 HG12 VAL 297 -28.172 -16.672 -19.769 1.00 0.00 H +ATOM 2013 HG13 VAL 297 -26.810 -17.413 -18.895 1.00 0.00 H +ATOM 2014 CG2 VAL 297 -29.977 -18.619 -19.411 1.00 0.00 C +ATOM 2015 HG21 VAL 297 -30.727 -19.127 -18.804 1.00 0.00 H +ATOM 2016 HG22 VAL 297 -30.370 -17.658 -19.745 1.00 0.00 H +ATOM 2017 HG23 VAL 297 -29.736 -19.233 -20.279 1.00 0.00 H +ATOM 2018 C VAL 297 -26.737 -19.583 -17.522 1.00 0.00 C +ATOM 2019 O VAL 297 -25.765 -19.941 -18.182 1.00 0.00 O +ATOM 2020 N LEU 298 -26.610 -19.082 -16.294 1.00 0.00 N +ATOM 2021 H LEU 298 -27.442 -18.811 -15.790 1.00 0.00 H +ATOM 2022 CA LEU 298 -25.314 -18.816 -15.683 1.00 0.00 C +ATOM 2023 HA LEU 298 -24.673 -18.246 -16.356 1.00 0.00 H +ATOM 2024 CB LEU 298 -25.553 -17.985 -14.410 1.00 0.00 C +ATOM 2025 HB2 LEU 298 -26.057 -17.074 -14.732 1.00 0.00 H +ATOM 2026 HB3 LEU 298 -26.214 -18.555 -13.757 1.00 0.00 H +ATOM 2027 CG LEU 298 -24.272 -17.618 -13.647 1.00 0.00 C +ATOM 2028 HG LEU 298 -23.799 -18.541 -13.313 1.00 0.00 H +ATOM 2029 CD1 LEU 298 -23.292 -16.829 -14.518 1.00 0.00 C +ATOM 2030 HD11 LEU 298 -23.765 -15.905 -14.852 1.00 0.00 H +ATOM 2031 HD12 LEU 298 -22.401 -16.591 -13.937 1.00 0.00 H +ATOM 2032 HD13 LEU 298 -23.011 -17.428 -15.384 1.00 0.00 H +ATOM 2033 CD2 LEU 298 -24.620 -16.784 -12.416 1.00 0.00 C +ATOM 2034 HD21 LEU 298 -25.275 -17.358 -11.760 1.00 0.00 H +ATOM 2035 HD22 LEU 298 -23.705 -16.528 -11.880 1.00 0.00 H +ATOM 2036 HD23 LEU 298 -25.126 -15.870 -12.727 1.00 0.00 H +ATOM 2037 C LEU 298 -24.529 -20.105 -15.409 1.00 0.00 C +ATOM 2038 O LEU 298 -23.395 -20.252 -15.863 1.00 0.00 O +ATOM 2039 N VAL 299 -25.126 -21.045 -14.680 1.00 0.00 N +ATOM 2040 H VAL 299 -26.079 -20.890 -14.382 1.00 0.00 H +ATOM 2041 CA VAL 299 -24.433 -22.239 -14.195 1.00 0.00 C +ATOM 2042 HA VAL 299 -23.425 -21.962 -13.884 1.00 0.00 H +ATOM 2043 CB VAL 299 -25.160 -22.873 -12.996 1.00 0.00 C +ATOM 2044 HB VAL 299 -26.164 -23.154 -13.312 1.00 0.00 H +ATOM 2045 CG1 VAL 299 -24.419 -24.115 -12.479 1.00 0.00 C +ATOM 2046 HG11 VAL 299 -23.414 -23.834 -12.163 1.00 0.00 H +ATOM 2047 HG12 VAL 299 -24.962 -24.535 -11.633 1.00 0.00 H +ATOM 2048 HG13 VAL 299 -24.355 -24.857 -13.275 1.00 0.00 H +ATOM 2049 CG2 VAL 299 -25.256 -21.873 -11.834 1.00 0.00 C +ATOM 2050 HG21 VAL 299 -25.809 -20.992 -12.158 1.00 0.00 H +ATOM 2051 HG22 VAL 299 -25.772 -22.340 -10.995 1.00 0.00 H +ATOM 2052 HG23 VAL 299 -24.253 -21.579 -11.524 1.00 0.00 H +ATOM 2053 C VAL 299 -24.228 -23.239 -15.323 1.00 0.00 C +ATOM 2054 O VAL 299 -23.119 -23.736 -15.466 1.00 0.00 O +ATOM 2055 N ARG 300 -25.228 -23.497 -16.179 1.00 0.00 N +ATOM 2056 H ARG 300 -26.130 -23.060 -16.062 1.00 0.00 H +ATOM 2057 CA ARG 300 -25.074 -24.509 -17.239 1.00 0.00 C +ATOM 2058 HA ARG 300 -24.568 -25.382 -16.826 1.00 0.00 H +ATOM 2059 CB ARG 300 -26.425 -24.952 -17.815 1.00 0.00 C +ATOM 2060 HB2 ARG 300 -26.917 -24.068 -18.220 1.00 0.00 H +ATOM 2061 HB3 ARG 300 -26.225 -25.656 -18.622 1.00 0.00 H +ATOM 2062 CG ARG 300 -27.337 -25.613 -16.773 1.00 0.00 C +ATOM 2063 HG2 ARG 300 -26.822 -26.461 -16.320 1.00 0.00 H +ATOM 2064 HG3 ARG 300 -27.594 -24.889 -15.999 1.00 0.00 H +ATOM 2065 CD ARG 300 -28.615 -26.101 -17.460 1.00 0.00 C +ATOM 2066 HD2 ARG 300 -29.214 -25.239 -17.754 1.00 0.00 H +ATOM 2067 HD3 ARG 300 -28.348 -26.676 -18.346 1.00 0.00 H +ATOM 2068 NE ARG 300 -29.422 -26.954 -16.569 1.00 0.00 N +ATOM 2069 HE ARG 300 -28.894 -27.526 -15.926 1.00 0.00 H +ATOM 2070 CZ ARG 300 -30.739 -27.051 -16.562 1.00 0.00 C +ATOM 2071 NH1 ARG 300 -31.480 -26.455 -17.450 1.00 0.00 N +ATOM 2072 HH11 ARG 300 -31.048 -25.898 -18.172 1.00 0.00 H +ATOM 2073 HH12 ARG 300 -32.485 -26.553 -17.412 1.00 0.00 H +ATOM 2074 NH2 ARG 300 -31.355 -27.729 -15.640 1.00 0.00 N +ATOM 2075 HH21 ARG 300 -30.822 -28.189 -14.916 1.00 0.00 H +ATOM 2076 HH22 ARG 300 -32.363 -27.791 -15.651 1.00 0.00 H +ATOM 2077 C ARG 300 -24.149 -24.063 -18.365 1.00 0.00 C +ATOM 2078 O ARG 300 -23.494 -24.908 -18.960 1.00 0.00 O +ATOM 2079 N THR 301 -24.076 -22.764 -18.672 1.00 0.00 N +ATOM 2080 H THR 301 -24.687 -22.101 -18.217 1.00 0.00 H +ATOM 2081 CA THR 301 -23.220 -22.284 -19.776 1.00 0.00 C +ATOM 2082 HA THR 301 -22.918 -23.106 -20.426 1.00 0.00 H +ATOM 2083 CB THR 301 -23.879 -21.196 -20.635 1.00 0.00 C +ATOM 2084 HB THR 301 -23.246 -21.042 -21.509 1.00 0.00 H +ATOM 2085 CG2 THR 301 -25.295 -21.549 -21.089 1.00 0.00 C +ATOM 2086 HG21 THR 301 -25.929 -21.702 -20.215 1.00 0.00 H +ATOM 2087 HG22 THR 301 -25.698 -20.735 -21.692 1.00 0.00 H +ATOM 2088 HG23 THR 301 -25.270 -22.462 -21.683 1.00 0.00 H +ATOM 2089 OG1 THR 301 -23.917 -19.948 -19.989 1.00 0.00 O +ATOM 2090 HG1 THR 301 -24.336 -19.304 -20.563 1.00 0.00 H +ATOM 2091 C THR 301 -21.837 -21.825 -19.327 1.00 0.00 C +ATOM 2092 O THR 301 -20.921 -21.813 -20.146 1.00 0.00 O +ATOM 2093 N LYS 302 -21.664 -21.438 -18.053 1.00 0.00 N +ATOM 2094 H LYS 302 -22.479 -21.436 -17.458 1.00 0.00 H +ATOM 2095 CA LYS 302 -20.408 -20.880 -17.518 1.00 0.00 C +ATOM 2096 HA LYS 302 -19.607 -21.029 -18.242 1.00 0.00 H +ATOM 2097 CB LYS 302 -20.546 -19.364 -17.239 1.00 0.00 C +ATOM 2098 HB2 LYS 302 -21.219 -19.267 -16.386 1.00 0.00 H +ATOM 2099 HB3 LYS 302 -19.554 -19.009 -16.960 1.00 0.00 H +ATOM 2100 CG LYS 302 -21.079 -18.527 -18.408 1.00 0.00 C +ATOM 2101 HG2 LYS 302 -22.068 -18.903 -18.671 1.00 0.00 H +ATOM 2102 HG3 LYS 302 -21.160 -17.493 -18.076 1.00 0.00 H +ATOM 2103 CD LYS 302 -20.162 -18.599 -19.637 1.00 0.00 C +ATOM 2104 HD2 LYS 302 -19.208 -18.126 -19.404 1.00 0.00 H +ATOM 2105 HD3 LYS 302 -19.995 -19.643 -19.903 1.00 0.00 H +ATOM 2106 CE LYS 302 -20.814 -17.875 -20.809 1.00 0.00 C +ATOM 2107 HE2 LYS 302 -21.736 -18.396 -21.067 1.00 0.00 H +ATOM 2108 HE3 LYS 302 -21.046 -16.856 -20.500 1.00 0.00 H +ATOM 2109 NZ LYS 302 -19.917 -17.841 -21.992 1.00 0.00 N +ATOM 2110 HZ1 LYS 302 -19.701 -18.785 -22.279 1.00 0.00 H +ATOM 2111 HZ2 LYS 302 -20.378 -17.356 -22.749 1.00 0.00 H +ATOM 2112 HZ3 LYS 302 -19.063 -17.358 -21.754 1.00 0.00 H +ATOM 2113 C LYS 302 -19.871 -21.637 -16.304 1.00 0.00 C +ATOM 2114 O LYS 302 -19.064 -21.064 -15.570 1.00 0.00 O +ATOM 2115 N ARG 303 -20.268 -22.901 -16.097 1.00 0.00 N +ATOM 2116 H ARG 303 -20.958 -23.277 -16.731 1.00 0.00 H +ATOM 2117 CA ARG 303 -19.812 -23.746 -14.974 1.00 0.00 C +ATOM 2118 HA ARG 303 -20.233 -23.371 -14.042 1.00 0.00 H +ATOM 2119 CB ARG 303 -20.262 -25.213 -15.165 1.00 0.00 C +ATOM 2120 HB2 ARG 303 -21.325 -25.225 -15.409 1.00 0.00 H +ATOM 2121 HB3 ARG 303 -19.696 -25.650 -15.987 1.00 0.00 H +ATOM 2122 CG ARG 303 -20.021 -26.029 -13.886 1.00 0.00 C +ATOM 2123 HG2 ARG 303 -18.971 -25.912 -13.616 1.00 0.00 H +ATOM 2124 HG3 ARG 303 -20.646 -25.602 -13.102 1.00 0.00 H +ATOM 2125 CD ARG 303 -20.346 -27.524 -14.045 1.00 0.00 C +ATOM 2126 HD2 ARG 303 -19.900 -27.854 -14.982 1.00 0.00 H +ATOM 2127 HD3 ARG 303 -19.875 -28.048 -13.213 1.00 0.00 H +ATOM 2128 NE ARG 303 -21.789 -27.859 -14.061 1.00 0.00 N +ATOM 2129 HE ARG 303 -22.167 -28.032 -14.981 1.00 0.00 H +ATOM 2130 CZ ARG 303 -22.606 -27.905 -13.027 1.00 0.00 C +ATOM 2131 NH1 ARG 303 -22.299 -27.383 -11.880 1.00 0.00 N +ATOM 2132 HH11 ARG 303 -21.408 -26.922 -11.761 1.00 0.00 H +ATOM 2133 HH12 ARG 303 -22.953 -27.439 -11.112 1.00 0.00 H +ATOM 2134 NH2 ARG 303 -23.741 -28.527 -13.104 1.00 0.00 N +ATOM 2135 HH21 ARG 303 -24.006 -28.983 -13.966 1.00 0.00 H +ATOM 2136 HH22 ARG 303 -24.355 -28.553 -12.303 1.00 0.00 H +ATOM 2137 C ARG 303 -18.297 -23.691 -14.798 1.00 0.00 C +ATOM 2138 O ARG 303 -17.828 -23.278 -13.743 1.00 0.00 O +ATOM 2139 N ASP 304 -17.547 -24.024 -15.846 1.00 0.00 N +ATOM 2140 H ASP 304 -18.007 -24.244 -16.718 1.00 0.00 H +ATOM 2141 CA ASP 304 -16.081 -24.105 -15.793 1.00 0.00 C +ATOM 2142 HA ASP 304 -15.770 -24.837 -15.048 1.00 0.00 H +ATOM 2143 CB ASP 304 -15.538 -24.536 -17.163 1.00 0.00 C +ATOM 2144 HB2 ASP 304 -15.776 -23.785 -17.916 1.00 0.00 H +ATOM 2145 HB3 ASP 304 -14.457 -24.586 -17.030 1.00 0.00 H +ATOM 2146 CG ASP 304 -16.058 -25.898 -17.618 1.00 0.00 C +ATOM 2147 OD1 ASP 304 -16.504 -26.667 -16.740 1.00 0.00 O +ATOM 2148 OD2 ASP 304 -16.057 -26.108 -18.847 1.00 0.00 O +ATOM 2149 C ASP 304 -15.448 -22.767 -15.413 1.00 0.00 C +ATOM 2150 O ASP 304 -14.514 -22.705 -14.612 1.00 0.00 O +ATOM 2151 N TRP 305 -15.995 -21.670 -15.943 1.00 0.00 N +ATOM 2152 H TRP 305 -16.698 -21.771 -16.662 1.00 0.00 H +ATOM 2153 CA TRP 305 -15.545 -20.327 -15.600 1.00 0.00 C +ATOM 2154 HA TRP 305 -14.460 -20.264 -15.686 1.00 0.00 H +ATOM 2155 CB TRP 305 -16.172 -19.304 -16.552 1.00 0.00 C +ATOM 2156 HB2 TRP 305 -15.937 -19.590 -17.578 1.00 0.00 H +ATOM 2157 HB3 TRP 305 -17.254 -19.256 -16.429 1.00 0.00 H +ATOM 2158 CG TRP 305 -15.658 -17.911 -16.367 1.00 0.00 C +ATOM 2159 CD1 TRP 305 -14.643 -17.350 -17.063 1.00 0.00 C +ATOM 2160 HD1 TRP 305 -14.170 -17.954 -17.838 1.00 0.00 H +ATOM 2161 NE1 TRP 305 -14.425 -16.066 -16.606 1.00 0.00 N +ATOM 2162 HE1 TRP 305 -13.723 -15.454 -16.999 1.00 0.00 H +ATOM 2163 CE2 TRP 305 -15.274 -15.747 -15.570 1.00 0.00 C +ATOM 2164 CZ2 TRP 305 -15.414 -14.604 -14.773 1.00 0.00 C +ATOM 2165 HZ2 TRP 305 -14.729 -13.779 -14.969 1.00 0.00 H +ATOM 2166 CH2 TRP 305 -16.409 -14.581 -13.782 1.00 0.00 C +ATOM 2167 HH2 TRP 305 -16.550 -13.709 -13.143 1.00 0.00 H +ATOM 2168 CZ3 TRP 305 -17.243 -15.699 -13.603 1.00 0.00 C +ATOM 2169 HZ3 TRP 305 -18.020 -15.711 -12.837 1.00 0.00 H +ATOM 2170 CE3 TRP 305 -17.097 -16.840 -14.414 1.00 0.00 C +ATOM 2171 HE3 TRP 305 -17.789 -17.659 -14.216 1.00 0.00 H +ATOM 2172 CD2 TRP 305 -16.097 -16.901 -15.409 1.00 0.00 C +ATOM 2173 C TRP 305 -15.840 -20.005 -14.132 1.00 0.00 C +ATOM 2174 O TRP 305 -14.952 -19.524 -13.433 1.00 0.00 O +ATOM 2175 N LEU 306 -17.045 -20.306 -13.637 1.00 0.00 N +ATOM 2176 H LEU 306 -17.745 -20.671 -14.268 1.00 0.00 H +ATOM 2177 CA LEU 306 -17.417 -20.086 -12.237 1.00 0.00 C +ATOM 2178 HA LEU 306 -17.290 -19.035 -11.978 1.00 0.00 H +ATOM 2179 CB LEU 306 -18.890 -20.472 -12.012 1.00 0.00 C +ATOM 2180 HB2 LEU 306 -19.014 -21.476 -12.420 1.00 0.00 H +ATOM 2181 HB3 LEU 306 -19.062 -20.493 -10.936 1.00 0.00 H +ATOM 2182 CG LEU 306 -19.900 -19.524 -12.673 1.00 0.00 C +ATOM 2183 HG LEU 306 -19.580 -19.301 -13.691 1.00 0.00 H +ATOM 2184 CD1 LEU 306 -21.273 -20.189 -12.706 1.00 0.00 C +ATOM 2185 HD11 LEU 306 -21.594 -20.412 -11.689 1.00 0.00 H +ATOM 2186 HD12 LEU 306 -21.992 -19.518 -13.174 1.00 0.00 H +ATOM 2187 HD13 LEU 306 -21.214 -21.115 -13.278 1.00 0.00 H +ATOM 2188 CD2 LEU 306 -20.014 -18.197 -11.917 1.00 0.00 C +ATOM 2189 HD21 LEU 306 -19.043 -17.704 -11.900 1.00 0.00 H +ATOM 2190 HD22 LEU 306 -20.738 -17.554 -12.417 1.00 0.00 H +ATOM 2191 HD23 LEU 306 -20.342 -18.387 -10.896 1.00 0.00 H +ATOM 2192 C LEU 306 -16.514 -20.885 -11.296 1.00 0.00 C +ATOM 2193 O LEU 306 -15.996 -20.319 -10.339 1.00 0.00 O +ATOM 2194 N VAL 307 -16.267 -22.162 -11.590 1.00 0.00 N +ATOM 2195 H VAL 307 -16.777 -22.580 -12.356 1.00 0.00 H +ATOM 2196 CA VAL 307 -15.371 -23.020 -10.800 1.00 0.00 C +ATOM 2197 HA VAL 307 -15.673 -22.996 -9.753 1.00 0.00 H +ATOM 2198 CB VAL 307 -15.435 -24.478 -11.298 1.00 0.00 C +ATOM 2199 HB VAL 307 -15.231 -24.482 -12.369 1.00 0.00 H +ATOM 2200 CG1 VAL 307 -14.418 -25.373 -10.582 1.00 0.00 C +ATOM 2201 HG11 VAL 307 -14.620 -25.370 -9.511 1.00 0.00 H +ATOM 2202 HG12 VAL 307 -14.497 -26.392 -10.963 1.00 0.00 H +ATOM 2203 HG13 VAL 307 -13.411 -24.996 -10.761 1.00 0.00 H +ATOM 2204 CG2 VAL 307 -16.827 -25.077 -11.051 1.00 0.00 C +ATOM 2205 HG21 VAL 307 -17.575 -24.490 -11.583 1.00 0.00 H +ATOM 2206 HG22 VAL 307 -16.850 -26.105 -11.410 1.00 0.00 H +ATOM 2207 HG23 VAL 307 -17.045 -25.060 -9.983 1.00 0.00 H +ATOM 2208 C VAL 307 -13.941 -22.469 -10.817 1.00 0.00 C +ATOM 2209 O VAL 307 -13.342 -22.289 -9.755 1.00 0.00 O +ATOM 2210 N LYS 308 -13.419 -22.088 -11.993 1.00 0.00 N +ATOM 2211 H LYS 308 -13.942 -22.306 -12.829 1.00 0.00 H +ATOM 2212 CA LYS 308 -12.094 -21.453 -12.143 1.00 0.00 C +ATOM 2213 HA LYS 308 -11.309 -22.097 -11.747 1.00 0.00 H +ATOM 2214 CB LYS 308 -11.830 -21.219 -13.641 1.00 0.00 C +ATOM 2215 HB2 LYS 308 -11.944 -22.183 -14.137 1.00 0.00 H +ATOM 2216 HB3 LYS 308 -12.600 -20.535 -13.997 1.00 0.00 H +ATOM 2217 CG LYS 308 -10.440 -20.639 -13.963 1.00 0.00 C +ATOM 2218 HG2 LYS 308 -10.355 -19.645 -13.525 1.00 0.00 H +ATOM 2219 HG3 LYS 308 -9.672 -21.288 -13.542 1.00 0.00 H +ATOM 2220 CD LYS 308 -10.252 -20.545 -15.488 1.00 0.00 C +ATOM 2221 HD2 LYS 308 -10.379 -21.545 -15.901 1.00 0.00 H +ATOM 2222 HD3 LYS 308 -11.030 -19.889 -15.879 1.00 0.00 H +ATOM 2223 CE LYS 308 -8.873 -19.998 -15.886 1.00 0.00 C +ATOM 2224 HE2 LYS 308 -8.784 -18.978 -15.511 1.00 0.00 H +ATOM 2225 HE3 LYS 308 -8.107 -20.622 -15.426 1.00 0.00 H +ATOM 2226 NZ LYS 308 -8.693 -20.000 -17.369 1.00 0.00 N +ATOM 2227 HZ1 LYS 308 -9.403 -19.422 -17.795 1.00 0.00 H +ATOM 2228 HZ2 LYS 308 -7.779 -19.636 -17.597 1.00 0.00 H +ATOM 2229 HZ3 LYS 308 -8.776 -20.946 -17.716 1.00 0.00 H +ATOM 2230 C LYS 308 -11.971 -20.156 -11.337 1.00 0.00 C +ATOM 2231 O LYS 308 -10.900 -19.858 -10.817 1.00 0.00 O +ATOM 2232 N GLN 309 -13.061 -19.402 -11.204 1.00 0.00 N +ATOM 2233 H GLN 309 -13.863 -19.659 -11.762 1.00 0.00 H +ATOM 2234 CA GLN 309 -13.134 -18.175 -10.409 1.00 0.00 C +ATOM 2235 HA GLN 309 -12.145 -17.721 -10.334 1.00 0.00 H +ATOM 2236 CB GLN 309 -14.087 -17.168 -11.074 1.00 0.00 C +ATOM 2237 HB2 GLN 309 -15.067 -17.641 -11.142 1.00 0.00 H +ATOM 2238 HB3 GLN 309 -14.150 -16.297 -10.422 1.00 0.00 H +ATOM 2239 CG GLN 309 -13.636 -16.728 -12.470 1.00 0.00 C +ATOM 2240 HG2 GLN 309 -13.561 -17.635 -13.070 1.00 0.00 H +ATOM 2241 HG3 GLN 309 -14.397 -16.073 -12.897 1.00 0.00 H +ATOM 2242 CD GLN 309 -12.297 -16.008 -12.510 1.00 0.00 C +ATOM 2243 OE1 GLN 309 -11.906 -15.277 -11.616 1.00 0.00 O +ATOM 2244 NE2 GLN 309 -11.546 -16.166 -13.578 1.00 0.00 N +ATOM 2245 HE21 GLN 309 -10.652 -15.701 -13.635 1.00 0.00 H +ATOM 2246 HE22 GLN 309 -11.868 -16.751 -14.336 1.00 0.00 H +ATOM 2247 C GLN 309 -13.508 -18.418 -8.940 1.00 0.00 C +ATOM 2248 O GLN 309 -13.855 -17.465 -8.255 1.00 0.00 O +ATOM 2249 N ARG 310 -13.432 -19.655 -8.424 1.00 0.00 N +ATOM 2250 H ARG 310 -13.231 -20.403 -9.071 1.00 0.00 H +ATOM 2251 CA ARG 310 -13.779 -20.007 -7.029 1.00 0.00 C +ATOM 2252 HA ARG 310 -13.762 -21.090 -6.913 1.00 0.00 H +ATOM 2253 CB ARG 310 -12.777 -19.389 -6.031 1.00 0.00 C +ATOM 2254 HB2 ARG 310 -12.898 -18.306 -6.079 1.00 0.00 H +ATOM 2255 HB3 ARG 310 -13.051 -19.741 -5.037 1.00 0.00 H +ATOM 2256 CG ARG 310 -11.311 -19.753 -6.317 1.00 0.00 C +ATOM 2257 HG2 ARG 310 -11.177 -20.820 -6.140 1.00 0.00 H +ATOM 2258 HG3 ARG 310 -11.094 -19.528 -7.362 1.00 0.00 H +ATOM 2259 CD ARG 310 -10.354 -18.963 -5.416 1.00 0.00 C +ATOM 2260 HD2 ARG 310 -9.329 -19.225 -5.679 1.00 0.00 H +ATOM 2261 HD3 ARG 310 -10.512 -17.898 -5.588 1.00 0.00 H +ATOM 2262 NE ARG 310 -10.563 -19.247 -3.981 1.00 0.00 N +ATOM 2263 HE ARG 310 -10.878 -20.181 -3.760 1.00 0.00 H +ATOM 2264 CZ ARG 310 -10.366 -18.396 -2.988 1.00 0.00 C +ATOM 2265 NH1 ARG 310 -9.853 -17.215 -3.194 1.00 0.00 N +ATOM 2266 HH11 ARG 310 -9.596 -16.936 -4.130 1.00 0.00 H +ATOM 2267 HH12 ARG 310 -9.714 -16.585 -2.417 1.00 0.00 H +ATOM 2268 NH2 ARG 310 -10.692 -18.721 -1.770 1.00 0.00 N +ATOM 2269 HH21 ARG 310 -11.097 -19.627 -1.583 1.00 0.00 H +ATOM 2270 HH22 ARG 310 -10.539 -18.064 -1.018 1.00 0.00 H +ATOM 2271 C ARG 310 -15.239 -19.692 -6.664 1.00 0.00 C +ATOM 2272 O ARG 310 -15.542 -19.315 -5.534 1.00 0.00 O +ATOM 2273 N GLY 311 -16.144 -19.830 -7.630 1.00 0.00 N +ATOM 2274 H GLY 311 -15.790 -20.070 -8.545 1.00 0.00 H +ATOM 2275 CA GLY 311 -17.585 -19.664 -7.467 1.00 0.00 C +ATOM 2276 HA2 GLY 311 -18.044 -19.712 -8.454 1.00 0.00 H +ATOM 2277 HA3 GLY 311 -17.954 -20.485 -6.853 1.00 0.00 H +ATOM 2278 C GLY 311 -17.966 -18.339 -6.805 1.00 0.00 C +ATOM 2279 O GLY 311 -17.419 -17.276 -7.102 1.00 0.00 O +ATOM 2280 N TRP 312 -18.914 -18.408 -5.874 1.00 0.00 N +ATOM 2281 H TRP 312 -19.387 -19.289 -5.724 1.00 0.00 H +ATOM 2282 CA TRP 312 -19.394 -17.232 -5.151 1.00 0.00 C +ATOM 2283 HA TRP 312 -19.529 -16.394 -5.835 1.00 0.00 H +ATOM 2284 CB TRP 312 -20.741 -17.557 -4.505 1.00 0.00 C +ATOM 2285 HB2 TRP 312 -20.640 -18.492 -3.955 1.00 0.00 H +ATOM 2286 HB3 TRP 312 -21.079 -16.772 -3.829 1.00 0.00 H +ATOM 2287 CG TRP 312 -21.837 -17.763 -5.503 1.00 0.00 C +ATOM 2288 CD1 TRP 312 -22.326 -18.956 -5.913 1.00 0.00 C +ATOM 2289 HD1 TRP 312 -21.910 -19.857 -5.462 1.00 0.00 H +ATOM 2290 NE1 TRP 312 -23.300 -18.745 -6.867 1.00 0.00 N +ATOM 2291 HE1 TRP 312 -23.775 -19.504 -7.335 1.00 0.00 H +ATOM 2292 CE2 TRP 312 -23.510 -17.405 -7.102 1.00 0.00 C +ATOM 2293 CZ2 TRP 312 -24.386 -16.705 -7.941 1.00 0.00 C +ATOM 2294 HZ2 TRP 312 -25.085 -17.298 -8.532 1.00 0.00 H +ATOM 2295 CH2 TRP 312 -24.320 -15.302 -7.977 1.00 0.00 C +ATOM 2296 HH2 TRP 312 -24.991 -14.725 -8.612 1.00 0.00 H +ATOM 2297 CZ3 TRP 312 -23.376 -14.622 -7.187 1.00 0.00 C +ATOM 2298 HZ3 TRP 312 -23.293 -13.535 -7.204 1.00 0.00 H +ATOM 2299 CE3 TRP 312 -22.505 -15.339 -6.342 1.00 0.00 C +ATOM 2300 HE3 TRP 312 -21.803 -14.740 -5.763 1.00 0.00 H +ATOM 2301 CD2 TRP 312 -22.559 -16.748 -6.268 1.00 0.00 C +ATOM 2302 C TRP 312 -18.385 -16.669 -4.140 1.00 0.00 C +ATOM 2303 O TRP 312 -18.498 -15.496 -3.786 1.00 0.00 O +ATOM 2304 N ASP 313 -17.377 -17.437 -3.711 1.00 0.00 N +ATOM 2305 H ASP 313 -17.379 -18.427 -3.914 1.00 0.00 H +ATOM 2306 CA ASP 313 -16.285 -16.897 -2.889 1.00 0.00 C +ATOM 2307 HA ASP 313 -16.708 -16.331 -2.058 1.00 0.00 H +ATOM 2308 CB ASP 313 -15.396 -18.013 -2.321 1.00 0.00 C +ATOM 2309 HB2 ASP 313 -15.100 -18.664 -3.144 1.00 0.00 H +ATOM 2310 HB3 ASP 313 -14.510 -17.549 -1.889 1.00 0.00 H +ATOM 2311 CG ASP 313 -16.111 -18.837 -1.253 1.00 0.00 C +ATOM 2312 OD1 ASP 313 -16.513 -18.245 -0.222 1.00 0.00 O +ATOM 2313 OD2 ASP 313 -16.265 -20.056 -1.458 1.00 0.00 O +ATOM 2314 C ASP 313 -15.436 -15.909 -3.694 1.00 0.00 C +ATOM 2315 O ASP 313 -15.146 -14.813 -3.214 1.00 0.00 O +ATOM 2316 N GLY 314 -15.099 -16.247 -4.942 1.00 0.00 N +ATOM 2317 H GLY 314 -15.345 -17.159 -5.301 1.00 0.00 H +ATOM 2318 CA GLY 314 -14.377 -15.328 -5.820 1.00 0.00 C +ATOM 2319 HA2 GLY 314 -13.498 -14.971 -5.283 1.00 0.00 H +ATOM 2320 HA3 GLY 314 -14.061 -15.886 -6.703 1.00 0.00 H +ATOM 2321 C GLY 314 -15.210 -14.128 -6.263 1.00 0.00 C +ATOM 2322 O GLY 314 -14.659 -13.040 -6.404 1.00 0.00 O +ATOM 2323 N PHE 315 -16.533 -14.274 -6.403 1.00 0.00 N +ATOM 2324 H PHE 315 -16.931 -15.203 -6.402 1.00 0.00 H +ATOM 2325 CA PHE 315 -17.435 -13.130 -6.593 1.00 0.00 C +ATOM 2326 HA PHE 315 -17.161 -12.582 -7.495 1.00 0.00 H +ATOM 2327 CB PHE 315 -18.880 -13.622 -6.739 1.00 0.00 C +ATOM 2328 HB2 PHE 315 -18.988 -14.156 -7.683 1.00 0.00 H +ATOM 2329 HB3 PHE 315 -19.133 -14.288 -5.914 1.00 0.00 H +ATOM 2330 CG PHE 315 -19.921 -12.520 -6.743 1.00 0.00 C +ATOM 2331 CD1 PHE 315 -20.656 -12.236 -5.577 1.00 0.00 C +ATOM 2332 HD1 PHE 315 -20.466 -12.799 -4.663 1.00 0.00 H +ATOM 2333 CE1 PHE 315 -21.634 -11.226 -5.590 1.00 0.00 C +ATOM 2334 HE1 PHE 315 -22.202 -11.013 -4.685 1.00 0.00 H +ATOM 2335 CZ PHE 315 -21.880 -10.495 -6.762 1.00 0.00 C +ATOM 2336 HZ PHE 315 -22.627 -9.702 -6.768 1.00 0.00 H +ATOM 2337 CE2 PHE 315 -21.159 -10.787 -7.930 1.00 0.00 C +ATOM 2338 HE2 PHE 315 -21.371 -10.244 -8.852 1.00 0.00 H +ATOM 2339 CD2 PHE 315 -20.166 -11.780 -7.912 1.00 0.00 C +ATOM 2340 HD2 PHE 315 -19.579 -11.981 -8.809 1.00 0.00 H +ATOM 2341 C PHE 315 -17.349 -12.143 -5.423 1.00 0.00 C +ATOM 2342 O PHE 315 -17.194 -10.938 -5.632 1.00 0.00 O +ATOM 2343 N VAL 316 -17.432 -12.651 -4.189 1.00 0.00 N +ATOM 2344 H VAL 316 -17.647 -13.631 -4.075 1.00 0.00 H +ATOM 2345 CA VAL 316 -17.309 -11.821 -2.986 1.00 0.00 C +ATOM 2346 HA VAL 316 -18.039 -11.014 -3.045 1.00 0.00 H +ATOM 2347 CB VAL 316 -17.582 -12.638 -1.710 1.00 0.00 C +ATOM 2348 HB VAL 316 -16.970 -13.539 -1.754 1.00 0.00 H +ATOM 2349 CG1 VAL 316 -17.260 -11.863 -0.424 1.00 0.00 C +ATOM 2350 HG11 VAL 316 -17.873 -10.963 -0.379 1.00 0.00 H +ATOM 2351 HG12 VAL 316 -17.473 -12.490 0.442 1.00 0.00 H +ATOM 2352 HG13 VAL 316 -16.206 -11.585 -0.422 1.00 0.00 H +ATOM 2353 CG2 VAL 316 -19.065 -13.014 -1.634 1.00 0.00 C +ATOM 2354 HG21 VAL 316 -19.334 -13.611 -2.506 1.00 0.00 H +ATOM 2355 HG22 VAL 316 -19.248 -13.592 -0.729 1.00 0.00 H +ATOM 2356 HG23 VAL 316 -19.669 -12.107 -1.615 1.00 0.00 H +ATOM 2357 C VAL 316 -15.934 -11.166 -2.945 1.00 0.00 C +ATOM 2358 O VAL 316 -15.866 -9.958 -2.765 1.00 0.00 O +ATOM 2359 N GLU 317 -14.854 -11.921 -3.154 1.00 0.00 N +ATOM 2360 H GLU 317 -14.988 -12.916 -3.266 1.00 0.00 H +ATOM 2361 CA GLU 317 -13.481 -11.402 -3.135 1.00 0.00 C +ATOM 2362 HA GLU 317 -13.267 -10.915 -2.183 1.00 0.00 H +ATOM 2363 CB GLU 317 -12.503 -12.576 -3.316 1.00 0.00 C +ATOM 2364 HB2 GLU 317 -12.775 -13.350 -2.598 1.00 0.00 H +ATOM 2365 HB3 GLU 317 -12.630 -12.961 -4.328 1.00 0.00 H +ATOM 2366 CG GLU 317 -11.035 -12.171 -3.102 1.00 0.00 C +ATOM 2367 HG2 GLU 317 -10.760 -11.426 -3.847 1.00 0.00 H +ATOM 2368 HG3 GLU 317 -11.005 -11.721 -2.110 1.00 0.00 H +ATOM 2369 CD GLU 317 -10.042 -13.350 -3.162 1.00 0.00 C +ATOM 2370 OE1 GLU 317 -8.826 -13.070 -3.265 1.00 0.00 O +ATOM 2371 OE2 GLU 317 -10.457 -14.533 -3.063 1.00 0.00 O +ATOM 2372 C GLU 317 -13.258 -10.303 -4.185 1.00 0.00 C +ATOM 2373 O GLU 317 -12.703 -9.252 -3.862 1.00 0.00 O +ATOM 2374 N PHE 318 -13.761 -10.504 -5.408 1.00 0.00 N +ATOM 2375 H PHE 318 -14.193 -11.398 -5.595 1.00 0.00 H +ATOM 2376 CA PHE 318 -13.662 -9.540 -6.505 1.00 0.00 C +ATOM 2377 HA PHE 318 -12.618 -9.333 -6.740 1.00 0.00 H +ATOM 2378 CB PHE 318 -14.338 -10.134 -7.752 1.00 0.00 C +ATOM 2379 HB2 PHE 318 -13.865 -11.073 -8.039 1.00 0.00 H +ATOM 2380 HB3 PHE 318 -15.392 -10.308 -7.536 1.00 0.00 H +ATOM 2381 CG PHE 318 -14.288 -9.233 -8.969 1.00 0.00 C +ATOM 2382 CD1 PHE 318 -15.369 -8.385 -9.269 1.00 0.00 C +ATOM 2383 HD1 PHE 318 -16.258 -8.397 -8.636 1.00 0.00 H +ATOM 2384 CE1 PHE 318 -15.310 -7.525 -10.379 1.00 0.00 C +ATOM 2385 HE1 PHE 318 -16.147 -6.864 -10.603 1.00 0.00 H +ATOM 2386 CZ PHE 318 -14.170 -7.517 -11.199 1.00 0.00 C +ATOM 2387 HZ PHE 318 -14.122 -6.850 -12.059 1.00 0.00 H +ATOM 2388 CE2 PHE 318 -13.090 -8.369 -10.909 1.00 0.00 C +ATOM 2389 HE2 PHE 318 -12.208 -8.368 -11.549 1.00 0.00 H +ATOM 2390 CD2 PHE 318 -13.148 -9.224 -9.793 1.00 0.00 C +ATOM 2391 HD2 PHE 318 -12.309 -9.881 -9.566 1.00 0.00 H +ATOM 2392 C PHE 318 -14.273 -8.182 -6.136 1.00 0.00 C +ATOM 2393 O PHE 318 -13.662 -7.145 -6.376 1.00 0.00 O +ATOM 2394 N PHE 319 -15.445 -8.183 -5.495 1.00 0.00 N +ATOM 2395 H PHE 319 -15.915 -9.064 -5.343 1.00 0.00 H +ATOM 2396 CA PHE 319 -16.132 -6.953 -5.101 1.00 0.00 C +ATOM 2397 HA PHE 319 -15.806 -6.116 -5.719 1.00 0.00 H +ATOM 2398 CB PHE 319 -17.637 -7.146 -5.295 1.00 0.00 C +ATOM 2399 HB2 PHE 319 -17.951 -8.092 -4.853 1.00 0.00 H +ATOM 2400 HB3 PHE 319 -18.178 -6.327 -4.821 1.00 0.00 H +ATOM 2401 CG PHE 319 -18.080 -7.178 -6.743 1.00 0.00 C +ATOM 2402 CD1 PHE 319 -17.949 -6.023 -7.539 1.00 0.00 C +ATOM 2403 HD1 PHE 319 -17.523 -5.117 -7.109 1.00 0.00 H +ATOM 2404 CE1 PHE 319 -18.366 -6.035 -8.881 1.00 0.00 C +ATOM 2405 HE1 PHE 319 -18.275 -5.134 -9.487 1.00 0.00 H +ATOM 2406 CZ PHE 319 -18.898 -7.208 -9.440 1.00 0.00 C +ATOM 2407 HZ PHE 319 -19.221 -7.224 -10.481 1.00 0.00 H +ATOM 2408 CE2 PHE 319 -19.014 -8.363 -8.652 1.00 0.00 C +ATOM 2409 HE2 PHE 319 -19.413 -9.276 -9.094 1.00 0.00 H +ATOM 2410 CD2 PHE 319 -18.619 -8.350 -7.303 1.00 0.00 C +ATOM 2411 HD2 PHE 319 -18.731 -9.247 -6.693 1.00 0.00 H +ATOM 2412 C PHE 319 -15.807 -6.474 -3.681 1.00 0.00 C +ATOM 2413 O PHE 319 -16.211 -5.365 -3.322 1.00 0.00 O +ATOM 2414 N HIE 320 -15.112 -7.264 -2.856 1.00 0.00 N +ATOM 2415 H HIE 320 -14.868 -8.188 -3.181 1.00 0.00 H +ATOM 2416 CA HIE 320 -14.753 -6.893 -1.482 1.00 0.00 C +ATOM 2417 HA HIE 320 -15.628 -6.513 -0.954 1.00 0.00 H +ATOM 2418 CB HIE 320 -14.223 -8.129 -0.731 1.00 0.00 C +ATOM 2419 HB2 HIE 320 -14.957 -8.928 -0.837 1.00 0.00 H +ATOM 2420 HB3 HIE 320 -13.265 -8.461 -1.130 1.00 0.00 H +ATOM 2421 CG HIE 320 -14.025 -7.920 0.747 1.00 0.00 C +ATOM 2422 ND1 HIE 320 -15.004 -7.576 1.651 1.00 0.00 N +ATOM 2423 CE1 HIE 320 -14.441 -7.505 2.867 1.00 0.00 C +ATOM 2424 HE1 HIE 320 -15.064 -7.211 3.711 1.00 0.00 H +ATOM 2425 NE2 HIE 320 -13.141 -7.830 2.804 1.00 0.00 N +ATOM 2426 HE2 HIE 320 -12.469 -7.895 3.556 1.00 0.00 H +ATOM 2427 CD2 HIE 320 -12.862 -8.074 1.454 1.00 0.00 C +ATOM 2428 HD2 HIE 320 -11.850 -8.334 1.145 1.00 0.00 H +ATOM 2429 C HIE 320 -13.730 -5.749 -1.441 1.00 0.00 C +ATOM 2430 O HIE 320 -13.750 -4.945 -0.519 1.00 0.00 O +ATOM 2431 N VAL 321 -12.868 -5.638 -2.458 1.00 0.00 N +ATOM 2432 H VAL 321 -12.913 -6.349 -3.174 1.00 0.00 H +ATOM 2433 CA VAL 321 -11.750 -4.671 -2.498 1.00 0.00 C +ATOM 2434 HA VAL 321 -11.478 -4.381 -1.483 1.00 0.00 H +ATOM 2435 CB VAL 321 -10.521 -5.332 -3.170 1.00 0.00 C +ATOM 2436 HB VAL 321 -10.817 -5.582 -4.189 1.00 0.00 H +ATOM 2437 CG1 VAL 321 -9.258 -4.458 -3.203 1.00 0.00 C +ATOM 2438 HG11 VAL 321 -8.961 -4.208 -2.184 1.00 0.00 H +ATOM 2439 HG12 VAL 321 -8.451 -5.004 -3.692 1.00 0.00 H +ATOM 2440 HG13 VAL 321 -9.464 -3.542 -3.756 1.00 0.00 H +ATOM 2441 CG2 VAL 321 -10.132 -6.611 -2.405 1.00 0.00 C +ATOM 2442 HG21 VAL 321 -10.967 -7.311 -2.417 1.00 0.00 H +ATOM 2443 HG22 VAL 321 -9.267 -7.071 -2.883 1.00 0.00 H +ATOM 2444 HG23 VAL 321 -9.885 -6.358 -1.374 1.00 0.00 H +ATOM 2445 C VAL 321 -12.156 -3.309 -3.094 1.00 0.00 C +ATOM 2446 O VAL 321 -11.349 -2.393 -3.207 1.00 0.00 O +ATOM 2447 OXT VAL 321 -13.286 -3.138 -3.547 1.00 0.00 O +END diff --git a/receptor/pdbqt_files/6o6f_A227V_H.pdbqt b/receptor/pdbqt_files/6o6f_A227V_H.pdbqt new file mode 100644 index 0000000..e981e2a --- /dev/null +++ b/receptor/pdbqt_files/6o6f_A227V_H.pdbqt @@ -0,0 +1,2429 @@ +REMARK Name = ../receptor/6o6f_A227V_H.pdb +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ATOM 1 N SER 171 -23.840 -34.508 -6.167 0.00 0.00 +0.000 NA +ATOM 2 H1 SER 171 -24.073 -34.914 -5.272 0.00 0.00 +0.000 HD +ATOM 3 H2 SER 171 -23.979 -34.837 -5.236 0.00 0.00 +0.000 HD +ATOM 4 H3 SER 171 -23.978 -35.254 -6.813 0.00 0.00 +0.000 HD +ATOM 5 CA SER 171 -24.823 -33.425 -6.454 0.00 0.00 +0.000 C +ATOM 6 HA SER 171 -25.412 -33.750 -7.212 0.00 0.00 +0.000 HD +ATOM 7 CB SER 171 -25.708 -33.194 -5.243 0.00 0.00 +0.000 C +ATOM 8 HB2 SER 171 -26.374 -32.476 -5.458 0.00 0.00 +0.000 HD +ATOM 9 HB3 SER 171 -26.200 -34.043 -5.033 0.00 0.00 +0.000 HD +ATOM 10 OG SER 171 -24.971 -32.802 -4.100 0.00 0.00 +0.000 OA +ATOM 11 HG SER 171 -24.797 -31.818 -4.136 0.00 0.00 +0.000 HD +ATOM 12 C SER 171 -24.177 -32.110 -6.883 0.00 0.00 +0.000 C +ATOM 13 O SER 171 -22.964 -31.912 -6.751 0.00 0.00 +0.000 OA +ATOM 14 N ASP 172 -25.017 -31.207 -7.377 0.00 0.00 +0.000 N +ATOM 15 H ASP 172 -26.019 -31.507 -7.379 0.00 0.00 +0.000 HD +ATOM 16 CA ASP 172 -24.576 -29.909 -7.873 0.00 0.00 +0.000 C +ATOM 17 HA ASP 172 -23.602 -30.008 -8.149 0.00 0.00 +0.000 HD +ATOM 18 CB ASP 172 -25.432 -29.532 -9.076 0.00 0.00 +0.000 C +ATOM 19 HB2 ASP 172 -25.664 -30.370 -9.561 0.00 0.00 +0.000 HD +ATOM 20 HB3 ASP 172 -26.258 -29.091 -8.739 0.00 0.00 +0.000 HD +ATOM 21 CG ASP 172 -24.727 -28.599 -10.018 0.00 0.00 +0.000 C +ATOM 22 OD1 ASP 172 -23.703 -27.997 -9.623 0.00 0.00 +0.000 OA +ATOM 23 OD2 ASP 172 -25.214 -28.470 -11.157 0.00 0.00 +0.000 OA +ATOM 24 C ASP 172 -24.625 -28.796 -6.824 0.00 0.00 +0.000 C +ATOM 25 O ASP 172 -25.612 -28.057 -6.729 0.00 0.00 +0.000 OA +ATOM 26 N GLU 173 -23.548 -28.683 -6.049 0.00 0.00 +0.000 N +ATOM 27 H GLU 173 -22.790 -29.365 -6.257 0.00 0.00 +0.000 HD +ATOM 28 CA GLU 173 -23.453 -27.676 -4.995 0.00 0.00 +0.000 C +ATOM 29 HA GLU 173 -24.232 -27.772 -4.359 0.00 0.00 +0.000 HD +ATOM 30 CB GLU 173 -22.200 -27.947 -4.155 0.00 0.00 +0.000 C +ATOM 31 HB2 GLU 173 -22.347 -28.794 -3.669 0.00 0.00 +0.000 HD +ATOM 32 HB3 GLU 173 -21.435 -28.012 -4.775 0.00 0.00 +0.000 HD +ATOM 33 CG GLU 173 -21.879 -26.877 -3.134 0.00 0.00 +0.000 C +ATOM 34 HG2 GLU 173 -21.026 -27.114 -2.693 0.00 0.00 +0.000 HD +ATOM 35 HG3 GLU 173 -21.810 -26.008 -3.602 0.00 0.00 +0.000 HD +ATOM 36 CD GLU 173 -22.924 -26.721 -2.045 0.00 0.00 +0.000 C +ATOM 37 OE1 GLU 173 -23.943 -27.446 -2.041 0.00 0.00 +0.000 OA +ATOM 38 OE2 GLU 173 -22.734 -25.830 -1.194 0.00 0.00 +0.000 OA +ATOM 39 C GLU 173 -23.443 -26.240 -5.559 0.00 0.00 +0.000 C +ATOM 40 O GLU 173 -24.129 -25.350 -5.049 0.00 0.00 +0.000 OA +ATOM 41 N LEU 174 -22.675 -26.019 -6.620 0.00 0.00 +0.000 N +ATOM 42 H LEU 174 -22.143 -26.835 -6.959 0.00 0.00 +0.000 HD +ATOM 43 CA LEU 174 -22.619 -24.699 -7.230 0.00 0.00 +0.000 C +ATOM 44 HA LEU 174 -22.328 -24.032 -6.531 0.00 0.00 +0.000 HD +ATOM 45 CB LEU 174 -21.586 -24.661 -8.357 0.00 0.00 +0.000 C +ATOM 46 HB2 LEU 174 -20.686 -24.796 -7.952 0.00 0.00 +0.000 HD +ATOM 47 HB3 LEU 174 -21.794 -25.401 -8.988 0.00 0.00 +0.000 HD +ATOM 48 CG LEU 174 -21.530 -23.367 -9.171 0.00 0.00 +0.000 C +ATOM 49 HG LEU 174 -22.441 -23.160 -9.522 0.00 0.00 +0.000 HD +ATOM 50 CD1 LEU 174 -21.054 -22.201 -8.293 0.00 0.00 +0.000 C +ATOM 51 HD11 LEU 174 -20.143 -22.406 -7.942 0.00 0.00 +0.000 HD +ATOM 52 HD12 LEU 174 -21.025 -21.368 -8.842 0.00 0.00 +0.000 HD +ATOM 53 HD13 LEU 174 -21.690 -22.082 -7.533 0.00 0.00 +0.000 HD +ATOM 54 CD2 LEU 174 -20.605 -23.568 -10.350 0.00 0.00 +0.000 C +ATOM 55 HD21 LEU 174 -20.947 -24.313 -10.927 0.00 0.00 +0.000 HD +ATOM 56 HD22 LEU 174 -20.559 -22.727 -10.893 0.00 0.00 +0.000 HD +ATOM 57 HD23 LEU 174 -19.686 -23.800 -10.025 0.00 0.00 +0.000 HD +ATOM 58 C LEU 174 -23.982 -24.270 -7.762 0.00 0.00 +0.000 C +ATOM 59 O LEU 174 -24.374 -23.103 -7.633 0.00 0.00 +0.000 OA +ATOM 60 N TYR 175 -24.715 -25.192 -8.372 0.00 0.00 +0.000 N +ATOM 61 H TYR 175 -24.296 -26.118 -8.460 0.00 0.00 +0.000 HD +ATOM 62 CA TYR 175 -26.039 -24.830 -8.864 0.00 0.00 +0.000 C +ATOM 63 HA TYR 175 -25.951 -24.004 -9.436 0.00 0.00 +0.000 HD +ATOM 64 CB TYR 175 -26.649 -25.942 -9.716 0.00 0.00 +0.000 C +ATOM 65 HB2 TYR 175 -26.023 -26.152 -10.448 0.00 0.00 +0.000 HD +ATOM 66 HB3 TYR 175 -26.811 -26.724 -9.137 0.00 0.00 +0.000 HD +ATOM 67 CG TYR 175 -27.958 -25.506 -10.312 0.00 0.00 +0.000 A +ATOM 68 CD1 TYR 175 -27.995 -24.770 -11.495 0.00 0.00 +0.000 A +ATOM 69 HD1 TYR 175 -27.147 -24.606 -12.002 0.00 0.00 +0.000 HD +ATOM 70 CE1 TYR 175 -29.191 -24.255 -11.988 0.00 0.00 +0.000 A +ATOM 71 HE1 TYR 175 -29.198 -23.731 -12.840 0.00 0.00 +0.000 HD +ATOM 72 CZ TYR 175 -30.369 -24.474 -11.292 0.00 0.00 +0.000 A +ATOM 73 OH TYR 175 -31.551 -23.926 -11.754 0.00 0.00 +0.000 OA +ATOM 74 HH TYR 175 -31.551 -23.947 -12.751 0.00 0.00 +0.000 HD +ATOM 75 CE2 TYR 175 -30.358 -25.213 -10.119 0.00 0.00 +0.000 A +ATOM 76 HE2 TYR 175 -31.208 -25.379 -9.621 0.00 0.00 +0.000 HD +ATOM 77 CD2 TYR 175 -29.155 -25.724 -9.637 0.00 0.00 +0.000 A +ATOM 78 HD2 TYR 175 -29.154 -26.257 -8.793 0.00 0.00 +0.000 HD +ATOM 79 C TYR 175 -26.995 -24.507 -7.714 0.00 0.00 +0.000 C +ATOM 80 O TYR 175 -27.704 -23.510 -7.775 0.00 0.00 +0.000 OA +ATOM 81 N ARG 176 -27.007 -25.346 -6.679 0.00 0.00 +0.000 N +ATOM 82 H ARG 176 -26.357 -26.148 -6.760 0.00 0.00 +0.000 HD +ATOM 83 CA ARG 176 -27.880 -25.122 -5.538 0.00 0.00 +0.000 C +ATOM 84 HA ARG 176 -28.838 -25.126 -5.855 0.00 0.00 +0.000 HD +ATOM 85 CB ARG 176 -27.703 -26.232 -4.499 0.00 0.00 +0.000 C +ATOM 86 HB2 ARG 176 -27.919 -27.104 -4.934 0.00 0.00 +0.000 HD +ATOM 87 HB3 ARG 176 -26.751 -26.231 -4.201 0.00 0.00 +0.000 HD +ATOM 88 CG ARG 176 -28.582 -26.093 -3.263 0.00 0.00 +0.000 C +ATOM 89 HG2 ARG 176 -28.651 -25.127 -3.013 0.00 0.00 +0.000 HD +ATOM 90 HG3 ARG 176 -29.494 -26.450 -3.465 0.00 0.00 +0.000 HD +ATOM 91 CD ARG 176 -28.029 -26.853 -2.073 0.00 0.00 +0.000 C +ATOM 92 HD2 ARG 176 -28.698 -26.811 -1.338 0.00 0.00 +0.000 HD +ATOM 93 HD3 ARG 176 -27.879 -27.797 -2.350 0.00 0.00 +0.000 HD +ATOM 94 NE ARG 176 -26.768 -26.279 -1.611 0.00 0.00 +0.000 N +ATOM 95 HE ARG 176 -25.931 -26.828 -1.727 0.00 0.00 +0.000 HD +ATOM 96 CZ ARG 176 -26.649 -25.079 -1.047 0.00 0.00 +0.000 C +ATOM 97 NH1 ARG 176 -25.462 -24.636 -0.662 0.00 0.00 +0.000 N +ATOM 98 HH11 ARG 176 -24.638 -25.179 -0.804 0.00 0.00 +0.000 HD +ATOM 99 HH12 ARG 176 -25.387 -23.734 -0.219 0.00 0.00 +0.000 HD +ATOM 100 NH2 ARG 176 -27.717 -24.321 -0.856 0.00 0.00 +0.000 N +ATOM 101 HH21 ARG 176 -28.617 -24.651 -1.158 0.00 0.00 +0.000 HD +ATOM 102 HH22 ARG 176 -27.634 -23.430 -0.418 0.00 0.00 +0.000 HD +ATOM 103 C ARG 176 -27.593 -23.783 -4.878 0.00 0.00 +0.000 C +ATOM 104 O ARG 176 -28.505 -23.016 -4.554 0.00 0.00 +0.000 OA +ATOM 105 N GLN 177 -26.313 -23.517 -4.660 0.00 0.00 +0.000 N +ATOM 106 H GLN 177 -25.654 -24.258 -4.972 0.00 0.00 +0.000 HD +ATOM 107 CA GLN 177 -25.894 -22.281 -4.034 0.00 0.00 +0.000 C +ATOM 108 HA GLN 177 -26.375 -22.196 -3.149 0.00 0.00 +0.000 HD +ATOM 109 CB GLN 177 -24.390 -22.315 -3.808 0.00 0.00 +0.000 C +ATOM 110 HB2 GLN 177 -24.174 -23.066 -3.180 0.00 0.00 +0.000 HD +ATOM 111 HB3 GLN 177 -23.935 -22.483 -4.686 0.00 0.00 +0.000 HD +ATOM 112 CG GLN 177 -23.831 -21.036 -3.224 0.00 0.00 +0.000 C +ATOM 113 HG2 GLN 177 -23.923 -20.309 -3.898 0.00 0.00 +0.000 HD +ATOM 114 HG3 GLN 177 -24.344 -20.808 -2.401 0.00 0.00 +0.000 HD +ATOM 115 CD GLN 177 -22.379 -21.189 -2.867 0.00 0.00 +0.000 C +ATOM 116 OE1 GLN 177 -21.604 -21.751 -3.639 0.00 0.00 +0.000 OA +ATOM 117 NE2 GLN 177 -21.996 -20.691 -1.694 0.00 0.00 +0.000 N +ATOM 118 HE21 GLN 177 -21.032 -20.769 -1.378 0.00 0.00 +0.000 HD +ATOM 119 HE22 GLN 177 -22.690 -20.224 -1.110 0.00 0.00 +0.000 HD +ATOM 120 C GLN 177 -26.268 -21.070 -4.879 0.00 0.00 +0.000 C +ATOM 121 O GLN 177 -26.763 -20.074 -4.355 0.00 0.00 +0.000 OA +ATOM 122 N SER 178 -26.034 -21.158 -6.184 0.00 0.00 +0.000 N +ATOM 123 H SER 178 -25.612 -22.049 -6.496 0.00 0.00 +0.000 HD +ATOM 124 CA SER 178 -26.362 -20.057 -7.081 0.00 0.00 +0.000 C +ATOM 125 HA SER 178 -25.897 -19.228 -6.744 0.00 0.00 +0.000 HD +ATOM 126 CB SER 178 -25.888 -20.374 -8.504 0.00 0.00 +0.000 C +ATOM 127 HB2 SER 178 -26.337 -21.208 -8.813 0.00 0.00 +0.000 HD +ATOM 128 HB3 SER 178 -26.132 -19.613 -9.099 0.00 0.00 +0.000 HD +ATOM 129 OG SER 178 -24.482 -20.562 -8.549 0.00 0.00 +0.000 OA +ATOM 130 HG SER 178 -24.258 -21.476 -8.214 0.00 0.00 +0.000 HD +ATOM 131 C SER 178 -27.863 -19.774 -7.098 0.00 0.00 +0.000 C +ATOM 132 O SER 178 -28.285 -18.616 -7.152 0.00 0.00 +0.000 OA +ATOM 133 N LEU 179 -28.669 -20.829 -7.054 0.00 0.00 +0.000 N +ATOM 134 H LEU 179 -28.201 -21.744 -7.001 0.00 0.00 +0.000 HD +ATOM 135 CA LEU 179 -30.117 -20.652 -7.082 0.00 0.00 +0.000 C +ATOM 136 HA LEU 179 -30.355 -20.079 -7.882 0.00 0.00 +0.000 HD +ATOM 137 CB LEU 179 -30.823 -21.998 -7.275 0.00 0.00 +0.000 C +ATOM 138 HB2 LEU 179 -30.510 -22.388 -8.129 0.00 0.00 +0.000 HD +ATOM 139 HB3 LEU 179 -30.592 -22.578 -6.509 0.00 0.00 +0.000 HD +ATOM 140 CG LEU 179 -32.355 -21.915 -7.344 0.00 0.00 +0.000 C +ATOM 141 HG LEU 179 -32.701 -21.589 -6.466 0.00 0.00 +0.000 HD +ATOM 142 CD1 LEU 179 -32.793 -20.955 -8.449 0.00 0.00 +0.000 C +ATOM 143 HD11 LEU 179 -32.446 -21.281 -9.328 0.00 0.00 +0.000 HD +ATOM 144 HD12 LEU 179 -33.791 -20.915 -8.477 0.00 0.00 +0.000 HD +ATOM 145 HD13 LEU 179 -32.427 -20.044 -8.261 0.00 0.00 +0.000 HD +ATOM 146 CD2 LEU 179 -32.923 -23.296 -7.579 0.00 0.00 +0.000 C +ATOM 147 HD21 LEU 179 -32.657 -23.905 -6.828 0.00 0.00 +0.000 HD +ATOM 148 HD22 LEU 179 -33.923 -23.249 -7.625 0.00 0.00 +0.000 HD +ATOM 149 HD23 LEU 179 -32.572 -23.666 -8.442 0.00 0.00 +0.000 HD +ATOM 150 C LEU 179 -30.643 -19.964 -5.827 0.00 0.00 +0.000 C +ATOM 151 O LEU 179 -31.515 -19.100 -5.916 0.00 0.00 +0.000 OA +ATOM 152 N GLU 180 -30.114 -20.332 -4.664 0.00 0.00 +0.000 N +ATOM 153 H GLU 180 -29.384 -21.055 -4.720 0.00 0.00 +0.000 HD +ATOM 154 CA GLU 180 -30.573 -19.723 -3.431 0.00 0.00 +0.000 C +ATOM 155 HA GLU 180 -31.571 -19.818 -3.350 0.00 0.00 +0.000 HD +ATOM 156 CB GLU 180 -29.980 -20.469 -2.231 0.00 0.00 +0.000 C +ATOM 157 HB2 GLU 180 -30.326 -21.392 -2.254 0.00 0.00 +0.000 HD +ATOM 158 HB3 GLU 180 -28.999 -20.442 -2.318 0.00 0.00 +0.000 HD +ATOM 159 CG GLU 180 -30.342 -19.873 -0.882 0.00 0.00 +0.000 C +ATOM 160 HG2 GLU 180 -29.648 -19.218 -0.637 0.00 0.00 +0.000 HD +ATOM 161 HG3 GLU 180 -31.231 -19.455 -0.955 0.00 0.00 +0.000 HD +ATOM 162 CD GLU 180 -30.412 -20.902 0.231 0.00 0.00 +0.000 C +ATOM 163 OE1 GLU 180 -29.479 -21.732 0.342 0.00 0.00 +0.000 OA +ATOM 164 OE2 GLU 180 -31.405 -20.868 1.003 0.00 0.00 +0.000 OA +ATOM 165 C GLU 180 -30.206 -18.237 -3.394 0.00 0.00 +0.000 C +ATOM 166 O GLU 180 -31.022 -17.410 -3.014 0.00 0.00 +0.000 OA +ATOM 167 N ILE 181 -28.991 -17.898 -3.817 0.00 0.00 +0.000 N +ATOM 168 H ILE 181 -28.400 -18.686 -4.133 0.00 0.00 +0.000 HD +ATOM 169 CA ILE 181 -28.557 -16.506 -3.821 0.00 0.00 +0.000 C +ATOM 170 HA ILE 181 -28.724 -16.153 -2.890 0.00 0.00 +0.000 HD +ATOM 171 CB ILE 181 -27.079 -16.406 -4.239 0.00 0.00 +0.000 C +ATOM 172 HB ILE 181 -26.977 -16.860 -5.115 0.00 0.00 +0.000 HD +ATOM 173 CG2 ILE 181 -26.670 -14.946 -4.374 0.00 0.00 +0.000 C +ATOM 174 HG21 ILE 181 -25.720 -14.892 -4.676 0.00 0.00 +0.000 HD +ATOM 175 HG22 ILE 181 -27.257 -14.496 -5.045 0.00 0.00 +0.000 HD +ATOM 176 HG23 ILE 181 -26.764 -14.490 -3.491 0.00 0.00 +0.000 HD +ATOM 177 CG1 ILE 181 -26.205 -17.135 -3.221 0.00 0.00 +0.000 C +ATOM 178 HG12 ILE 181 -26.169 -16.593 -2.387 0.00 0.00 +0.000 HD +ATOM 179 HG13 ILE 181 -26.625 -18.016 -3.019 0.00 0.00 +0.000 HD +ATOM 180 CD1 ILE 181 -24.790 -17.375 -3.713 0.00 0.00 +0.000 C +ATOM 181 HD11 ILE 181 -24.357 -16.498 -3.912 0.00 0.00 +0.000 HD +ATOM 182 HD12 ILE 181 -24.272 -17.853 -3.006 0.00 0.00 +0.000 HD +ATOM 183 HD13 ILE 181 -24.819 -17.931 -4.542 0.00 0.00 +0.000 HD +ATOM 184 C ILE 181 -29.390 -15.639 -4.768 0.00 0.00 +0.000 C +ATOM 185 O ILE 181 -29.881 -14.570 -4.388 0.00 0.00 +0.000 OA +ATOM 186 N ILE 182 -29.538 -16.098 -6.006 0.00 0.00 +0.000 N +ATOM 187 H ILE 182 -29.087 -17.009 -6.196 0.00 0.00 +0.000 HD +ATOM 188 CA ILE 182 -30.293 -15.344 -7.008 0.00 0.00 +0.000 C +ATOM 189 HA ILE 182 -29.944 -14.397 -6.971 0.00 0.00 +0.000 HD +ATOM 190 CB ILE 182 -30.077 -15.948 -8.418 0.00 0.00 +0.000 C +ATOM 191 HB ILE 182 -30.270 -16.917 -8.367 0.00 0.00 +0.000 HD +ATOM 192 CG2 ILE 182 -31.002 -15.272 -9.432 0.00 0.00 +0.000 C +ATOM 193 HG21 ILE 182 -30.867 -15.687 -10.329 0.00 0.00 +0.000 HD +ATOM 194 HG22 ILE 182 -31.950 -15.393 -9.146 0.00 0.00 +0.000 HD +ATOM 195 HG23 ILE 182 -30.787 -14.299 -9.477 0.00 0.00 +0.000 HD +ATOM 196 CG1 ILE 182 -28.607 -15.776 -8.836 0.00 0.00 +0.000 C +ATOM 197 HG12 ILE 182 -28.430 -14.805 -8.974 0.00 0.00 +0.000 HD +ATOM 198 HG13 ILE 182 -28.030 -16.107 -8.092 0.00 0.00 +0.000 HD +ATOM 199 CD1 ILE 182 -28.233 -16.529 -10.110 0.00 0.00 +0.000 C +ATOM 200 HD11 ILE 182 -28.798 -16.197 -10.861 0.00 0.00 +0.000 HD +ATOM 201 HD12 ILE 182 -27.270 -16.367 -10.312 0.00 0.00 +0.000 HD +ATOM 202 HD13 ILE 182 -28.392 -17.503 -9.970 0.00 0.00 +0.000 HD +ATOM 203 C ILE 182 -31.792 -15.266 -6.690 0.00 0.00 +0.000 C +ATOM 204 O ILE 182 -32.411 -14.222 -6.884 0.00 0.00 +0.000 OA +ATOM 205 N SER 183 -32.364 -16.364 -6.197 0.00 0.00 +0.000 N +ATOM 206 H SER 183 -31.726 -17.177 -6.091 0.00 0.00 +0.000 HD +ATOM 207 CA SER 183 -33.785 -16.407 -5.836 0.00 0.00 +0.000 C +ATOM 208 HA SER 183 -34.316 -16.106 -6.633 0.00 0.00 +0.000 HD +ATOM 209 CB SER 183 -34.195 -17.822 -5.410 0.00 0.00 +0.000 C +ATOM 210 HB2 SER 183 -33.678 -18.068 -4.594 0.00 0.00 +0.000 HD +ATOM 211 HB3 SER 183 -35.171 -17.819 -5.206 0.00 0.00 +0.000 HD +ATOM 212 OG SER 183 -33.934 -18.750 -6.427 0.00 0.00 +0.000 OA +ATOM 213 HG SER 183 -32.968 -19.016 -6.406 0.00 0.00 +0.000 HD +ATOM 214 C SER 183 -34.077 -15.447 -4.686 0.00 0.00 +0.000 C +ATOM 215 O SER 183 -35.054 -14.693 -4.717 0.00 0.00 +0.000 OA +ATOM 216 N ARG 184 -33.228 -15.485 -3.665 0.00 0.00 +0.000 N +ATOM 217 H ARG 184 -32.460 -16.164 -3.751 0.00 0.00 +0.000 HD +ATOM 218 CA ARG 184 -33.417 -14.602 -2.522 0.00 0.00 +0.000 C +ATOM 219 HA ARG 184 -34.340 -14.751 -2.143 0.00 0.00 +0.000 HD +ATOM 220 CB ARG 184 -32.406 -14.909 -1.415 0.00 0.00 +0.000 C +ATOM 221 HB2 ARG 184 -31.495 -14.916 -1.821 0.00 0.00 +0.000 HD +ATOM 222 HB3 ARG 184 -32.467 -14.186 -0.731 0.00 0.00 +0.000 HD +ATOM 223 CG ARG 184 -32.626 -16.236 -0.722 0.00 0.00 +0.000 C +ATOM 224 HG2 ARG 184 -33.580 -16.493 -0.787 0.00 0.00 +0.000 HD +ATOM 225 HG3 ARG 184 -32.043 -16.926 -1.128 0.00 0.00 +0.000 HD +ATOM 226 CD ARG 184 -32.264 -16.113 0.746 0.00 0.00 +0.000 C +ATOM 227 HD2 ARG 184 -31.310 -15.829 0.808 0.00 0.00 +0.000 HD +ATOM 228 HD3 ARG 184 -32.853 -15.418 1.153 0.00 0.00 +0.000 HD +ATOM 229 NE ARG 184 -32.439 -17.372 1.459 0.00 0.00 +0.000 N +ATOM 230 HE ARG 184 -32.645 -18.196 0.918 0.00 0.00 +0.000 HD +ATOM 231 CZ ARG 184 -32.344 -17.503 2.777 0.00 0.00 +0.000 C +ATOM 232 NH1 ARG 184 -32.079 -16.447 3.533 0.00 0.00 +0.000 N +ATOM 233 HH11 ARG 184 -31.967 -15.541 3.135 0.00 0.00 +0.000 HD +ATOM 234 HH12 ARG 184 -31.990 -16.561 4.531 0.00 0.00 +0.000 HD +ATOM 235 NH2 ARG 184 -32.508 -18.695 3.339 0.00 0.00 +0.000 N +ATOM 236 HH21 ARG 184 -32.723 -19.488 2.764 0.00 0.00 +0.000 HD +ATOM 237 HH22 ARG 184 -32.420 -18.802 4.326 0.00 0.00 +0.000 HD +ATOM 238 C ARG 184 -33.290 -13.134 -2.923 0.00 0.00 +0.000 C +ATOM 239 O ARG 184 -34.059 -12.283 -2.466 0.00 0.00 +0.000 OA +ATOM 240 N TYR 185 -32.320 -12.830 -3.777 0.00 0.00 +0.000 N +ATOM 241 H TYR 185 -31.741 -13.617 -4.093 0.00 0.00 +0.000 HD +ATOM 242 CA TYR 185 -32.137 -11.452 -4.202 0.00 0.00 +0.000 C +ATOM 243 HA TYR 185 -32.029 -10.877 -3.383 0.00 0.00 +0.000 HD +ATOM 244 CB TYR 185 -30.880 -11.310 -5.074 0.00 0.00 +0.000 C +ATOM 245 HB2 TYR 185 -30.112 -11.686 -4.573 0.00 0.00 +0.000 HD +ATOM 246 HB3 TYR 185 -31.031 -11.809 -5.917 0.00 0.00 +0.000 HD +ATOM 247 CG TYR 185 -30.570 -9.871 -5.419 0.00 0.00 +0.000 A +ATOM 248 CD1 TYR 185 -30.431 -8.910 -4.413 0.00 0.00 +0.000 A +ATOM 249 HD1 TYR 185 -30.515 -9.183 -3.455 0.00 0.00 +0.000 HD +ATOM 250 CE1 TYR 185 -30.178 -7.574 -4.723 0.00 0.00 +0.000 A +ATOM 251 HE1 TYR 185 -30.077 -6.899 -3.995 0.00 0.00 +0.000 HD +ATOM 252 CZ TYR 185 -30.066 -7.189 -6.058 0.00 0.00 +0.000 A +ATOM 253 OH TYR 185 -29.845 -5.870 -6.376 0.00 0.00 +0.000 OA +ATOM 254 HH TYR 185 -29.842 -5.326 -5.538 0.00 0.00 +0.000 HD +ATOM 255 CE2 TYR 185 -30.197 -8.120 -7.069 0.00 0.00 +0.000 A +ATOM 256 HE2 TYR 185 -30.117 -7.847 -8.025 0.00 0.00 +0.000 HD +ATOM 257 CD2 TYR 185 -30.445 -9.460 -6.746 0.00 0.00 +0.000 A +ATOM 258 HD2 TYR 185 -30.532 -10.128 -7.480 0.00 0.00 +0.000 HD +ATOM 259 C TYR 185 -33.360 -10.955 -4.969 0.00 0.00 +0.000 C +ATOM 260 O TYR 185 -33.872 -9.872 -4.690 0.00 0.00 +0.000 OA +ATOM 261 N LEU 186 -33.840 -11.739 -5.933 0.00 0.00 +0.000 N +ATOM 262 H LEU 186 -33.347 -12.629 -6.071 0.00 0.00 +0.000 HD +ATOM 263 CA LEU 186 -35.002 -11.314 -6.721 0.00 0.00 +0.000 C +ATOM 264 HA LEU 186 -34.796 -10.410 -7.129 0.00 0.00 +0.000 HD +ATOM 265 CB LEU 186 -35.257 -12.282 -7.881 0.00 0.00 +0.000 C +ATOM 266 HB2 LEU 186 -34.873 -13.166 -7.630 0.00 0.00 +0.000 HD +ATOM 267 HB3 LEU 186 -36.241 -12.357 -8.005 0.00 0.00 +0.000 HD +ATOM 268 CG LEU 186 -34.654 -11.889 -9.231 0.00 0.00 +0.000 C +ATOM 269 HG LEU 186 -35.038 -11.015 -9.515 0.00 0.00 +0.000 HD +ATOM 270 CD1 LEU 186 -33.146 -11.763 -9.099 0.00 0.00 +0.000 C +ATOM 271 HD11 LEU 186 -32.760 -12.639 -8.806 0.00 0.00 +0.000 HD +ATOM 272 HD12 LEU 186 -32.752 -11.506 -9.982 0.00 0.00 +0.000 HD +ATOM 273 HD13 LEU 186 -32.926 -11.061 -8.421 0.00 0.00 +0.000 HD +ATOM 274 CD2 LEU 186 -35.024 -12.920 -10.294 0.00 0.00 +0.000 C +ATOM 275 HD21 LEU 186 -36.019 -12.966 -10.380 0.00 0.00 +0.000 HD +ATOM 276 HD22 LEU 186 -34.624 -12.652 -11.170 0.00 0.00 +0.000 HD +ATOM 277 HD23 LEU 186 -34.670 -13.816 -10.025 0.00 0.00 +0.000 HD +ATOM 278 C LEU 186 -36.268 -11.184 -5.879 0.00 0.00 +0.000 C +ATOM 279 O LEU 186 -37.076 -10.276 -6.093 0.00 0.00 +0.000 OA +ATOM 280 N ARG 187 -36.440 -12.076 -4.913 0.00 0.00 +0.000 N +ATOM 281 H ARG 187 -35.706 -12.783 -4.821 0.00 0.00 +0.000 HD +ATOM 282 CA ARG 187 -37.615 -11.988 -4.085 0.00 0.00 +0.000 C +ATOM 283 HA ARG 187 -38.439 -11.913 -4.678 0.00 0.00 +0.000 HD +ATOM 284 CB ARG 187 -37.800 -13.281 -3.308 0.00 0.00 +0.000 C +ATOM 285 HB2 ARG 187 -37.759 -14.036 -3.941 0.00 0.00 +0.000 HD +ATOM 286 HB3 ARG 187 -37.094 -13.340 -2.623 0.00 0.00 +0.000 HD +ATOM 287 CG ARG 187 -39.143 -13.318 -2.610 0.00 0.00 +0.000 C +ATOM 288 HG2 ARG 187 -39.139 -12.689 -1.827 0.00 0.00 +0.000 HD +ATOM 289 HG3 ARG 187 -39.867 -13.037 -3.247 0.00 0.00 +0.000 HD +ATOM 290 CD ARG 187 -39.527 -14.716 -2.071 0.00 0.00 +0.000 C +ATOM 291 HD2 ARG 187 -39.428 -15.360 -2.826 0.00 0.00 +0.000 HD +ATOM 292 HD3 ARG 187 -38.879 -14.939 -1.346 0.00 0.00 +0.000 HD +ATOM 293 NE ARG 187 -40.880 -14.758 -1.558 0.00 0.00 +0.000 N +ATOM 294 HE ARG 187 -41.022 -15.060 -0.606 0.00 0.00 +0.000 HD +ATOM 295 CZ ARG 187 -41.962 -14.422 -2.263 0.00 0.00 +0.000 C +ATOM 296 NH1 ARG 187 -41.866 -14.026 -3.524 0.00 0.00 +0.000 N +ATOM 297 HH11 ARG 187 -40.975 -13.992 -3.976 0.00 0.00 +0.000 HD +ATOM 298 HH12 ARG 187 -42.689 -13.760 -4.030 0.00 0.00 +0.000 HD +ATOM 299 NH2 ARG 187 -43.169 -14.421 -1.700 0.00 0.00 +0.000 N +ATOM 300 HH21 ARG 187 -43.253 -14.698 -0.737 0.00 0.00 +0.000 HD +ATOM 301 HH22 ARG 187 -43.969 -14.154 -2.221 0.00 0.00 +0.000 HD +ATOM 302 C ARG 187 -37.607 -10.776 -3.138 0.00 0.00 +0.000 C +ATOM 303 O ARG 187 -38.623 -10.082 -2.999 0.00 0.00 +0.000 OA +ATOM 304 N GLU 188 -36.486 -10.498 -2.479 0.00 0.00 +0.000 N +ATOM 305 H GLU 188 -35.700 -11.122 -2.635 0.00 0.00 +0.000 HD +ATOM 306 CA GLU 188 -36.463 -9.332 -1.590 0.00 0.00 +0.000 C +ATOM 307 HA GLU 188 -37.257 -9.366 -0.968 0.00 0.00 +0.000 HD +ATOM 308 CB GLU 188 -35.257 -9.375 -0.649 0.00 0.00 +0.000 C +ATOM 309 HB2 GLU 188 -35.354 -8.607 -0.018 0.00 0.00 +0.000 HD +ATOM 310 HB3 GLU 188 -35.314 -10.234 -0.143 0.00 0.00 +0.000 HD +ATOM 311 CG GLU 188 -33.914 -9.293 -1.280 0.00 0.00 +0.000 C +ATOM 312 HG2 GLU 188 -33.715 -10.144 -1.726 0.00 0.00 +0.000 HD +ATOM 313 HG3 GLU 188 -33.892 -8.530 -1.896 0.00 0.00 +0.000 HD +ATOM 314 CD GLU 188 -32.836 -9.065 -0.246 0.00 0.00 +0.000 C +ATOM 315 OE1 GLU 188 -32.857 -9.773 0.778 0.00 0.00 +0.000 OA +ATOM 316 OE2 GLU 188 -31.959 -8.199 -0.446 0.00 0.00 +0.000 OA +ATOM 317 C GLU 188 -36.491 -8.010 -2.371 0.00 0.00 +0.000 C +ATOM 318 O GLU 188 -36.955 -6.991 -1.860 0.00 0.00 +0.000 OA +ATOM 319 N GLN 189 -35.996 -8.024 -3.606 0.00 0.00 +0.000 N +ATOM 320 H GLN 189 -35.603 -8.921 -3.916 0.00 0.00 +0.000 HD +ATOM 321 CA GLN 189 -36.035 -6.818 -4.421 0.00 0.00 +0.000 C +ATOM 322 HA GLN 189 -35.710 -6.055 -3.868 0.00 0.00 +0.000 HD +ATOM 323 CB GLN 189 -35.194 -7.003 -5.691 0.00 0.00 +0.000 C +ATOM 324 HB2 GLN 189 -35.385 -7.912 -6.070 0.00 0.00 +0.000 HD +ATOM 325 HB3 GLN 189 -35.471 -6.308 -6.361 0.00 0.00 +0.000 HD +ATOM 326 CG GLN 189 -33.694 -6.884 -5.479 0.00 0.00 +0.000 C +ATOM 327 HG2 GLN 189 -33.455 -7.324 -4.617 0.00 0.00 +0.000 HD +ATOM 328 HG3 GLN 189 -33.226 -7.337 -6.234 0.00 0.00 +0.000 HD +ATOM 329 CD GLN 189 -33.241 -5.437 -5.425 0.00 0.00 +0.000 C +ATOM 330 OE1 GLN 189 -33.468 -4.676 -6.366 0.00 0.00 +0.000 OA +ATOM 331 NE2 GLN 189 -32.601 -5.047 -4.324 0.00 0.00 +0.000 N +ATOM 332 HE21 GLN 189 -32.259 -4.100 -4.226 0.00 0.00 +0.000 HD +ATOM 333 HE22 GLN 189 -32.462 -5.726 -3.575 0.00 0.00 +0.000 HD +ATOM 334 C GLN 189 -37.491 -6.535 -4.794 0.00 0.00 +0.000 C +ATOM 335 O GLN 189 -37.945 -5.398 -4.771 0.00 0.00 +0.000 OA +ATOM 336 N ALA 190 -38.227 -7.591 -5.125 0.00 0.00 +0.000 N +ATOM 337 H ALA 190 -37.734 -8.501 -5.082 0.00 0.00 +0.000 HD +ATOM 338 CA ALA 190 -39.628 -7.450 -5.517 0.00 0.00 +0.000 C +ATOM 339 HA ALA 190 -39.696 -6.704 -6.210 0.00 0.00 +0.000 HD +ATOM 340 CB ALA 190 -40.105 -8.721 -6.222 0.00 0.00 +0.000 C +ATOM 341 HB1 ALA 190 -39.426 -9.442 -6.098 0.00 0.00 +0.000 HD +ATOM 342 HB2 ALA 190 -40.976 -9.010 -5.829 0.00 0.00 +0.000 HD +ATOM 343 HB3 ALA 190 -40.222 -8.534 -7.196 0.00 0.00 +0.000 HD +ATOM 344 C ALA 190 -40.575 -7.118 -4.363 0.00 0.00 +0.000 C +ATOM 345 O ALA 190 -41.540 -6.361 -4.534 0.00 0.00 +0.000 OA +ATOM 346 N THR 191 -40.291 -7.670 -3.188 0.00 0.00 +0.000 N +ATOM 347 H THR 191 -39.428 -8.249 -3.176 0.00 0.00 +0.000 HD +ATOM 348 CA THR 191 -41.137 -7.467 -2.017 0.00 0.00 +0.000 C +ATOM 349 HA THR 191 -42.084 -7.255 -2.340 0.00 0.00 +0.000 HD +ATOM 350 CB THR 191 -41.212 -8.756 -1.190 0.00 0.00 +0.000 C +ATOM 351 HB THR 191 -41.899 -8.633 -0.445 0.00 0.00 +0.000 HD +ATOM 352 CG2 THR 191 -41.579 -9.934 -2.094 0.00 0.00 +0.000 C +ATOM 353 HG21 THR 191 -40.796 -10.553 -2.174 0.00 0.00 +0.000 HD +ATOM 354 HG22 THR 191 -42.355 -10.430 -1.701 0.00 0.00 +0.000 HD +ATOM 355 HG23 THR 191 -41.828 -9.595 -3.003 0.00 0.00 +0.000 HD +ATOM 356 OG1 THR 191 -39.938 -9.010 -0.582 0.00 0.00 +0.000 OA +ATOM 357 HG1 THR 191 -39.291 -9.367 -1.264 0.00 0.00 +0.000 HD +ATOM 358 C THR 191 -40.690 -6.337 -1.095 0.00 0.00 +0.000 C +ATOM 359 O THR 191 -41.528 -5.627 -0.535 0.00 0.00 +0.000 OA +ATOM 360 N GLY 192 -39.380 -6.175 -0.932 0.00 0.00 +0.000 N +ATOM 361 H GLY 192 -38.786 -6.840 -1.450 0.00 0.00 +0.000 HD +ATOM 362 CA GLY 192 -38.866 -5.120 -0.073 0.00 0.00 +0.000 C +ATOM 363 HA2 GLY 192 -38.083 -4.662 -0.540 0.00 0.00 +0.000 HD +ATOM 364 HA3 GLY 192 -39.585 -4.405 0.045 0.00 0.00 +0.000 HD +ATOM 365 C GLY 192 -38.419 -5.605 1.289 0.00 0.00 +0.000 C +ATOM 366 O GLY 192 -38.015 -4.815 2.149 0.00 0.00 +0.000 OA +ATOM 367 N ALA 193 -38.481 -6.913 1.503 0.00 0.00 +0.000 N +ATOM 368 H ALA 193 -38.812 -7.479 0.708 0.00 0.00 +0.000 HD +ATOM 369 CA ALA 193 -38.095 -7.481 2.800 0.00 0.00 +0.000 C +ATOM 370 HA ALA 193 -37.816 -6.717 3.416 0.00 0.00 +0.000 HD +ATOM 371 CB ALA 193 -39.311 -8.131 3.428 0.00 0.00 +0.000 C +ATOM 372 HB1 ALA 193 -39.671 -8.836 2.816 0.00 0.00 +0.000 HD +ATOM 373 HB2 ALA 193 -39.057 -8.551 4.300 0.00 0.00 +0.000 HD +ATOM 374 HB3 ALA 193 -40.018 -7.441 3.588 0.00 0.00 +0.000 HD +ATOM 375 C ALA 193 -36.941 -8.491 2.737 0.00 0.00 +0.000 C +ATOM 376 O ALA 193 -36.797 -9.218 1.764 0.00 0.00 +0.000 OA +ATOM 377 N LYS 194 -36.137 -8.521 3.792 0.00 0.00 +0.000 N +ATOM 378 H LYS 194 -36.399 -7.834 4.546 0.00 0.00 +0.000 HD +ATOM 379 CA LYS 194 -35.000 -9.414 3.905 0.00 0.00 +0.000 C +ATOM 380 HA LYS 194 -34.637 -9.608 2.994 0.00 0.00 +0.000 HD +ATOM 381 CB LYS 194 -33.962 -8.782 4.828 0.00 0.00 +0.000 C +ATOM 382 HB2 LYS 194 -34.314 -7.891 5.142 0.00 0.00 +0.000 HD +ATOM 383 HB3 LYS 194 -33.850 -9.376 5.637 0.00 0.00 +0.000 HD +ATOM 384 CG LYS 194 -32.552 -8.537 4.238 0.00 0.00 +0.000 C +ATOM 385 HG2 LYS 194 -32.228 -9.382 3.836 0.00 0.00 +0.000 HD +ATOM 386 HG3 LYS 194 -32.614 -7.819 3.560 0.00 0.00 +0.000 HD +ATOM 387 CD LYS 194 -31.598 -8.106 5.345 0.00 0.00 +0.000 C +ATOM 388 HD2 LYS 194 -30.683 -8.034 4.977 0.00 0.00 +0.000 HD +ATOM 389 HD3 LYS 194 -31.904 -7.246 5.723 0.00 0.00 +0.000 HD +ATOM 390 CE LYS 194 -31.578 -9.150 6.480 0.00 0.00 +0.000 C +ATOM 391 HE2 LYS 194 -31.475 -8.660 7.367 0.00 0.00 +0.000 HD +ATOM 392 HE3 LYS 194 -32.485 -9.612 6.509 0.00 0.00 +0.000 HD +ATOM 393 NZ LYS 194 -30.502 -10.219 6.399 0.00 0.00 +0.000 N +ATOM 394 HZ1 LYS 194 -29.673 -9.866 6.821 0.00 0.00 +0.000 HD +ATOM 395 HZ2 LYS 194 -30.821 -11.027 6.884 0.00 0.00 +0.000 HD +ATOM 396 HZ3 LYS 194 -30.339 -10.432 5.441 0.00 0.00 +0.000 HD +ATOM 397 C LYS 194 -35.461 -10.736 4.534 0.00 0.00 +0.000 C +ATOM 398 O LYS 194 -36.205 -10.719 5.517 0.00 0.00 +0.000 OA +ATOM 399 N ASP 195 -35.042 -11.872 3.975 0.00 0.00 +0.000 N +ATOM 400 H ASP 195 -34.456 -11.759 3.133 0.00 0.00 +0.000 HD +ATOM 401 CA ASP 195 -35.407 -13.175 4.543 0.00 0.00 +0.000 C +ATOM 402 HA ASP 195 -36.292 -13.075 4.961 0.00 0.00 +0.000 HD +ATOM 403 CB ASP 195 -35.264 -14.296 3.512 0.00 0.00 +0.000 C +ATOM 404 HB2 ASP 195 -35.753 -14.024 2.693 0.00 0.00 +0.000 HD +ATOM 405 HB3 ASP 195 -34.299 -14.418 3.323 0.00 0.00 +0.000 HD +ATOM 406 CG ASP 195 -35.836 -15.608 4.010 0.00 0.00 +0.000 C +ATOM 407 OD1 ASP 195 -35.806 -15.841 5.242 0.00 0.00 +0.000 OA +ATOM 408 OD2 ASP 195 -36.306 -16.414 3.179 0.00 0.00 +0.000 OA +ATOM 409 C ASP 195 -34.400 -13.409 5.671 0.00 0.00 +0.000 C +ATOM 410 O ASP 195 -33.192 -13.293 5.460 0.00 0.00 +0.000 OA +ATOM 411 N THR 196 -34.881 -13.764 6.859 0.00 0.00 +0.000 N +ATOM 412 H THR 196 -35.908 -13.876 6.902 0.00 0.00 +0.000 HD +ATOM 413 CA THR 196 -33.995 -13.974 8.004 0.00 0.00 +0.000 C +ATOM 414 HA THR 196 -33.160 -13.396 7.871 0.00 0.00 +0.000 HD +ATOM 415 CB THR 196 -34.663 -13.462 9.298 0.00 0.00 +0.000 C +ATOM 416 HB THR 196 -34.741 -12.447 9.246 0.00 0.00 +0.000 HD +ATOM 417 CG2 THR 196 -36.039 -14.081 9.476 0.00 0.00 +0.000 C +ATOM 418 HG21 THR 196 -36.744 -13.372 9.400 0.00 0.00 +0.000 HD +ATOM 419 HG22 THR 196 -36.195 -14.775 8.769 0.00 0.00 +0.000 HD +ATOM 420 HG23 THR 196 -36.105 -14.513 10.379 0.00 0.00 +0.000 HD +ATOM 421 OG1 THR 196 -33.838 -13.793 10.419 0.00 0.00 +0.000 OA +ATOM 422 HG1 THR 196 -33.244 -14.575 10.199 0.00 0.00 +0.000 HD +ATOM 423 C THR 196 -33.533 -15.420 8.225 0.00 0.00 +0.000 C +ATOM 424 O THR 196 -32.717 -15.686 9.106 0.00 0.00 +0.000 OA +ATOM 425 N LYS 197 -34.047 -16.354 7.436 0.00 0.00 +0.000 N +ATOM 426 H LYS 197 -34.728 -16.019 6.736 0.00 0.00 +0.000 HD +ATOM 427 CA LYS 197 -33.653 -17.761 7.574 0.00 0.00 +0.000 C +ATOM 428 HA LYS 197 -33.695 -18.013 8.550 0.00 0.00 +0.000 HD +ATOM 429 CB LYS 197 -34.582 -18.672 6.768 0.00 0.00 +0.000 C +ATOM 430 HB2 LYS 197 -34.700 -18.260 5.855 0.00 0.00 +0.000 HD +ATOM 431 HB3 LYS 197 -34.116 -19.560 6.652 0.00 0.00 +0.000 HD +ATOM 432 CG LYS 197 -35.945 -18.920 7.360 0.00 0.00 +0.000 C +ATOM 433 HG2 LYS 197 -35.859 -19.468 8.180 0.00 0.00 +0.000 HD +ATOM 434 HG3 LYS 197 -36.390 -18.057 7.552 0.00 0.00 +0.000 HD +ATOM 435 CD LYS 197 -36.792 -19.691 6.345 0.00 0.00 +0.000 C +ATOM 436 HD2 LYS 197 -36.349 -20.560 6.155 0.00 0.00 +0.000 HD +ATOM 437 HD3 LYS 197 -37.697 -19.837 6.728 0.00 0.00 +0.000 HD +ATOM 438 CE LYS 197 -36.937 -18.921 5.034 0.00 0.00 +0.000 C +ATOM 439 HE2 LYS 197 -37.346 -18.024 5.233 0.00 0.00 +0.000 HD +ATOM 440 HE3 LYS 197 -36.021 -18.775 4.645 0.00 0.00 +0.000 HD +ATOM 441 NZ LYS 197 -37.781 -19.638 4.047 0.00 0.00 +0.000 N +ATOM 442 HZ1 LYS 197 -37.836 -19.103 3.203 0.00 0.00 +0.000 HD +ATOM 443 HZ2 LYS 197 -37.377 -20.532 3.849 0.00 0.00 +0.000 HD +ATOM 444 HZ3 LYS 197 -38.700 -19.763 4.422 0.00 0.00 +0.000 HD +ATOM 445 C LYS 197 -32.235 -17.999 7.066 0.00 0.00 +0.000 C +ATOM 446 O LYS 197 -31.797 -17.352 6.116 0.00 0.00 +0.000 OA +ATOM 447 N PRO 198 -31.498 -18.937 7.693 0.00 0.00 +0.000 N +ATOM 448 CD PRO 198 -31.793 -19.679 8.933 0.00 0.00 +0.000 C +ATOM 449 HD2 PRO 198 -32.731 -20.015 8.924 0.00 0.00 +0.000 HD +ATOM 450 HD3 PRO 198 -31.646 -19.099 9.731 0.00 0.00 +0.000 HD +ATOM 451 CG PRO 198 -30.801 -20.803 8.874 0.00 0.00 +0.000 C +ATOM 452 HG2 PRO 198 -31.115 -21.527 8.265 0.00 0.00 +0.000 HD +ATOM 453 HG3 PRO 198 -30.624 -21.173 9.782 0.00 0.00 +0.000 HD +ATOM 454 CB PRO 198 -29.581 -20.144 8.326 0.00 0.00 +0.000 C +ATOM 455 HB2 PRO 198 -28.955 -20.816 7.932 0.00 0.00 +0.000 HD +ATOM 456 HB3 PRO 198 -29.107 -19.620 9.032 0.00 0.00 +0.000 HD +ATOM 457 CA PRO 198 -30.132 -19.217 7.241 0.00 0.00 +0.000 C +ATOM 458 HA PRO 198 -29.578 -18.369 7.242 0.00 0.00 +0.000 HD +ATOM 459 C PRO 198 -30.105 -19.878 5.874 0.00 0.00 +0.000 C +ATOM 460 O PRO 198 -31.050 -20.558 5.479 0.00 0.00 +0.000 OA +ATOM 461 N MET 199 -29.018 -19.659 5.146 0.00 0.00 +0.000 N +ATOM 462 H MET 199 -28.313 -19.040 5.584 0.00 0.00 +0.000 HD +ATOM 463 CA MET 199 -28.864 -20.261 3.834 0.00 0.00 +0.000 C +ATOM 464 HA MET 199 -29.708 -20.131 3.324 0.00 0.00 +0.000 HD +ATOM 465 CB MET 199 -27.650 -19.656 3.126 0.00 0.00 +0.000 C +ATOM 466 HB2 MET 199 -26.845 -19.720 3.736 0.00 0.00 +0.000 HD +ATOM 467 HB3 MET 199 -27.449 -20.196 2.295 0.00 0.00 +0.000 HD +ATOM 468 CG MET 199 -27.807 -18.184 2.705 0.00 0.00 +0.000 C +ATOM 469 HG2 MET 199 -28.163 -17.663 3.515 0.00 0.00 +0.000 HD +ATOM 470 HG3 MET 199 -26.869 -17.806 2.530 0.00 0.00 +0.000 HD +ATOM 471 SD MET 199 -28.869 -17.976 1.279 0.00 0.00 +0.000 S +ATOM 472 CE MET 199 -29.039 -16.192 1.184 0.00 0.00 +0.000 C +ATOM 473 HE1 MET 199 -28.557 -15.769 1.952 0.00 0.00 +0.000 HD +ATOM 474 HE2 MET 199 -28.647 -15.864 0.324 0.00 0.00 +0.000 HD +ATOM 475 HE3 MET 199 -30.008 -15.946 1.223 0.00 0.00 +0.000 HD +ATOM 476 C MET 199 -28.659 -21.757 4.034 0.00 0.00 +0.000 C +ATOM 477 O MET 199 -28.502 -22.222 5.167 0.00 0.00 +0.000 OA +ATOM 478 N GLY 200 -28.675 -22.519 2.944 0.00 0.00 +0.000 N +ATOM 479 H GLY 200 -28.837 -22.025 2.059 0.00 0.00 +0.000 HD +ATOM 480 CA GLY 200 -28.471 -23.950 3.064 0.00 0.00 +0.000 C +ATOM 481 HA2 GLY 200 -29.090 -24.324 3.751 0.00 0.00 +0.000 HD +ATOM 482 HA3 GLY 200 -28.639 -24.391 2.185 0.00 0.00 +0.000 HD +ATOM 483 C GLY 200 -27.036 -24.195 3.488 0.00 0.00 +0.000 C +ATOM 484 O GLY 200 -26.294 -23.225 3.695 0.00 0.00 +0.000 OA +ATOM 485 N SER 202 -22.146 -24.130 3.748 0.00 0.00 +0.000 NA +ATOM 486 H SER 202 -22.234 -23.719 4.664 0.00 0.00 +0.000 HD +ATOM 487 CA SER 202 -22.622 -23.510 2.517 0.00 0.00 +0.000 C +ATOM 488 HA SER 202 -21.830 -23.349 1.919 0.00 0.00 +0.000 HD +ATOM 489 CB SER 202 -23.636 -24.435 1.814 0.00 0.00 +0.000 C +ATOM 490 HB2 SER 202 -24.414 -24.578 2.423 0.00 0.00 +0.000 HD +ATOM 491 HB3 SER 202 -23.943 -23.992 0.974 0.00 0.00 +0.000 HD +ATOM 492 OG SER 202 -23.074 -25.710 1.481 0.00 0.00 +0.000 OA +ATOM 493 HG SER 202 -22.978 -25.775 0.491 0.00 0.00 +0.000 HD +ATOM 494 C SER 202 -23.272 -22.153 2.804 0.00 0.00 +0.000 C +ATOM 495 O SER 202 -23.310 -21.276 1.936 0.00 0.00 +0.000 OA +ATOM 496 N GLY 203 -23.777 -21.984 4.021 0.00 0.00 +0.000 N +ATOM 497 H GLY 203 -23.655 -22.788 4.661 0.00 0.00 +0.000 HD +ATOM 498 CA GLY 203 -24.441 -20.751 4.383 0.00 0.00 +0.000 C +ATOM 499 HA2 GLY 203 -25.256 -20.613 3.746 0.00 0.00 +0.000 HD +ATOM 500 HA3 GLY 203 -24.892 -20.877 5.315 0.00 0.00 +0.000 HD +ATOM 501 C GLY 203 -23.633 -19.469 4.412 0.00 0.00 +0.000 C +ATOM 502 O GLY 203 -24.079 -18.443 3.888 0.00 0.00 +0.000 OA +ATOM 503 N ALA 204 -22.455 -19.505 5.029 0.00 0.00 +0.000 N +ATOM 504 H ALA 204 -22.188 -20.427 5.414 0.00 0.00 +0.000 HD +ATOM 505 CA ALA 204 -21.620 -18.309 5.138 0.00 0.00 +0.000 C +ATOM 506 HA ALA 204 -22.069 -17.664 5.793 0.00 0.00 +0.000 HD +ATOM 507 CB ALA 204 -20.295 -18.660 5.774 0.00 0.00 +0.000 C +ATOM 508 HB1 ALA 204 -19.693 -19.083 5.094 0.00 0.00 +0.000 HD +ATOM 509 HB2 ALA 204 -19.858 -17.831 6.128 0.00 0.00 +0.000 HD +ATOM 510 HB3 ALA 204 -20.440 -19.302 6.529 0.00 0.00 +0.000 HD +ATOM 511 C ALA 204 -21.387 -17.579 3.827 0.00 0.00 +0.000 C +ATOM 512 O ALA 204 -21.739 -16.404 3.713 0.00 0.00 +0.000 OA +ATOM 513 N THR 205 -20.775 -18.251 2.859 0.00 0.00 +0.000 N +ATOM 514 H THR 205 -20.498 -19.217 3.100 0.00 0.00 +0.000 HD +ATOM 515 CA THR 205 -20.532 -17.633 1.568 0.00 0.00 +0.000 C +ATOM 516 HA THR 205 -19.930 -16.829 1.705 0.00 0.00 +0.000 HD +ATOM 517 CB THR 205 -19.838 -18.600 0.603 0.00 0.00 +0.000 C +ATOM 518 HB THR 205 -20.388 -19.459 0.541 0.00 0.00 +0.000 HD +ATOM 519 CG2 THR 205 -19.688 -17.969 -0.767 0.00 0.00 +0.000 C +ATOM 520 HG21 THR 205 -18.922 -18.393 -1.258 0.00 0.00 +0.000 HD +ATOM 521 HG22 THR 205 -20.529 -18.100 -1.299 0.00 0.00 +0.000 HD +ATOM 522 HG23 THR 205 -19.511 -16.986 -0.674 0.00 0.00 +0.000 HD +ATOM 523 OG1 THR 205 -18.539 -18.940 1.106 0.00 0.00 +0.000 OA +ATOM 524 HG1 THR 205 -17.858 -18.903 0.367 0.00 0.00 +0.000 HD +ATOM 525 C THR 205 -21.813 -17.161 0.908 0.00 0.00 +0.000 C +ATOM 526 O THR 205 -21.870 -16.049 0.377 0.00 0.00 +0.000 OA +ATOM 527 N SER 206 -22.849 -17.987 0.930 0.00 0.00 +0.000 N +ATOM 528 H SER 206 -22.712 -18.880 1.388 0.00 0.00 +0.000 HD +ATOM 529 CA SER 206 -24.082 -17.545 0.301 0.00 0.00 +0.000 C +ATOM 530 HA SER 206 -23.894 -17.344 -0.664 0.00 0.00 +0.000 HD +ATOM 531 CB SER 206 -25.163 -18.627 0.400 0.00 0.00 +0.000 C +ATOM 532 HB2 SER 206 -25.271 -18.884 1.360 0.00 0.00 +0.000 HD +ATOM 533 HB3 SER 206 -26.023 -18.250 0.057 0.00 0.00 +0.000 HD +ATOM 534 OG SER 206 -24.833 -19.780 -0.352 0.00 0.00 +0.000 OA +ATOM 535 HG SER 206 -24.317 -20.416 0.221 0.00 0.00 +0.000 HD +ATOM 536 C SER 206 -24.580 -16.241 0.955 0.00 0.00 +0.000 C +ATOM 537 O SER 206 -25.060 -15.346 0.260 0.00 0.00 +0.000 OA +ATOM 538 N ARG 207 -24.463 -16.128 2.280 0.00 0.00 +0.000 N +ATOM 539 H ARG 207 -24.026 -16.932 2.753 0.00 0.00 +0.000 HD +ATOM 540 CA ARG 207 -24.935 -14.931 2.966 0.00 0.00 +0.000 C +ATOM 541 HA ARG 207 -25.912 -14.791 2.736 0.00 0.00 +0.000 HD +ATOM 542 CB ARG 207 -24.870 -15.099 4.487 0.00 0.00 +0.000 C +ATOM 543 HB2 ARG 207 -25.449 -15.865 4.741 0.00 0.00 +0.000 HD +ATOM 544 HB3 ARG 207 -23.926 -15.277 4.741 0.00 0.00 +0.000 HD +ATOM 545 CG ARG 207 -25.343 -13.873 5.257 0.00 0.00 +0.000 C +ATOM 546 HG2 ARG 207 -24.726 -13.107 5.076 0.00 0.00 +0.000 HD +ATOM 547 HG3 ARG 207 -26.268 -13.633 4.965 0.00 0.00 +0.000 HD +ATOM 548 CD ARG 207 -25.374 -14.106 6.768 0.00 0.00 +0.000 C +ATOM 549 HD2 ARG 207 -25.475 -13.222 7.213 0.00 0.00 +0.000 HD +ATOM 550 HD3 ARG 207 -26.156 -14.687 6.972 0.00 0.00 +0.000 HD +ATOM 551 NE ARG 207 -24.150 -14.753 7.248 0.00 0.00 +0.000 N +ATOM 552 HE ARG 207 -23.369 -14.165 7.482 0.00 0.00 +0.000 HD +ATOM 553 CZ ARG 207 -24.008 -16.068 7.394 0.00 0.00 +0.000 C +ATOM 554 NH1 ARG 207 -25.010 -16.887 7.093 0.00 0.00 +0.000 N +ATOM 555 HH11 ARG 207 -25.871 -16.536 6.737 0.00 0.00 +0.000 HD +ATOM 556 HH12 ARG 207 -24.897 -17.879 7.226 0.00 0.00 +0.000 HD +ATOM 557 NH2 ARG 207 -22.882 -16.570 7.876 0.00 0.00 +0.000 N +ATOM 558 HH21 ARG 207 -22.127 -15.951 8.113 0.00 0.00 +0.000 HD +ATOM 559 HH22 ARG 207 -22.779 -17.553 8.003 0.00 0.00 +0.000 HD +ATOM 560 C ARG 207 -24.159 -13.691 2.565 0.00 0.00 +0.000 C +ATOM 561 O ARG 207 -24.739 -12.622 2.380 0.00 0.00 +0.000 OA +ATOM 562 N LYS 208 -22.847 -13.824 2.452 0.00 0.00 +0.000 N +ATOM 563 H LYS 208 -22.477 -14.764 2.651 0.00 0.00 +0.000 HD +ATOM 564 CA LYS 208 -22.031 -12.689 2.070 0.00 0.00 +0.000 C +ATOM 565 HA LYS 208 -22.285 -11.895 2.630 0.00 0.00 +0.000 HD +ATOM 566 CB LYS 208 -20.548 -12.995 2.327 0.00 0.00 +0.000 C +ATOM 567 HB2 LYS 208 -20.249 -13.677 1.671 0.00 0.00 +0.000 HD +ATOM 568 HB3 LYS 208 -20.030 -12.155 2.219 0.00 0.00 +0.000 HD +ATOM 569 CG LYS 208 -20.272 -13.545 3.743 0.00 0.00 +0.000 C +ATOM 570 HG2 LYS 208 -20.522 -12.847 4.412 0.00 0.00 +0.000 HD +ATOM 571 HG3 LYS 208 -20.829 -14.361 3.884 0.00 0.00 +0.000 HD +ATOM 572 CD LYS 208 -18.793 -13.913 3.941 0.00 0.00 +0.000 C +ATOM 573 HD2 LYS 208 -18.726 -14.565 4.691 0.00 0.00 +0.000 HD +ATOM 574 HD3 LYS 208 -18.451 -14.319 3.099 0.00 0.00 +0.000 HD +ATOM 575 CE LYS 208 -17.930 -12.693 4.278 0.00 0.00 +0.000 C +ATOM 576 HE2 LYS 208 -16.968 -12.964 4.247 0.00 0.00 +0.000 HD +ATOM 577 HE3 LYS 208 -18.098 -11.984 3.594 0.00 0.00 +0.000 HD +ATOM 578 NZ LYS 208 -18.254 -12.166 5.628 0.00 0.00 +0.000 N +ATOM 579 HZ1 LYS 208 -18.502 -12.924 6.231 0.00 0.00 +0.000 HD +ATOM 580 HZ2 LYS 208 -17.457 -11.691 6.000 0.00 0.00 +0.000 HD +ATOM 581 HZ3 LYS 208 -19.022 -11.528 5.561 0.00 0.00 +0.000 HD +ATOM 582 C LYS 208 -22.269 -12.344 0.603 0.00 0.00 +0.000 C +ATOM 583 O LYS 208 -22.216 -11.180 0.220 0.00 0.00 +0.000 OA +ATOM 584 N ALA 209 -22.535 -13.358 -0.219 0.00 0.00 +0.000 N +ATOM 585 H ALA 209 -22.551 -14.292 0.224 0.00 0.00 +0.000 HD +ATOM 586 CA ALA 209 -22.784 -13.136 -1.649 0.00 0.00 +0.000 C +ATOM 587 HA ALA 209 -22.020 -12.620 -2.033 0.00 0.00 +0.000 HD +ATOM 588 CB ALA 209 -22.907 -14.491 -2.387 0.00 0.00 +0.000 C +ATOM 589 HB1 ALA 209 -23.859 -14.782 -2.368 0.00 0.00 +0.000 HD +ATOM 590 HB2 ALA 209 -22.604 -14.373 -3.328 0.00 0.00 +0.000 HD +ATOM 591 HB3 ALA 209 -22.335 -15.162 -1.925 0.00 0.00 +0.000 HD +ATOM 592 C ALA 209 -24.065 -12.313 -1.817 0.00 0.00 +0.000 C +ATOM 593 O ALA 209 -24.118 -11.411 -2.654 0.00 0.00 +0.000 OA +ATOM 594 N LEU 210 -25.086 -12.614 -1.014 0.00 0.00 +0.000 N +ATOM 595 H LEU 210 -24.914 -13.393 -0.359 0.00 0.00 +0.000 HD +ATOM 596 CA LEU 210 -26.340 -11.872 -1.086 0.00 0.00 +0.000 C +ATOM 597 HA LEU 210 -26.663 -11.880 -2.037 0.00 0.00 +0.000 HD +ATOM 598 CB LEU 210 -27.393 -12.512 -0.177 0.00 0.00 +0.000 C +ATOM 599 HB2 LEU 210 -27.535 -13.450 -0.489 0.00 0.00 +0.000 HD +ATOM 600 HB3 LEU 210 -27.031 -12.517 0.753 0.00 0.00 +0.000 HD +ATOM 601 CG LEU 210 -28.766 -11.836 -0.129 0.00 0.00 +0.000 C +ATOM 602 HG LEU 210 -28.666 -10.918 0.234 0.00 0.00 +0.000 HD +ATOM 603 CD1 LEU 210 -29.339 -11.757 -1.551 0.00 0.00 +0.000 C +ATOM 604 HD11 LEU 210 -29.430 -12.680 -1.919 0.00 0.00 +0.000 HD +ATOM 605 HD12 LEU 210 -30.234 -11.316 -1.520 0.00 0.00 +0.000 HD +ATOM 606 HD13 LEU 210 -28.720 -11.224 -2.125 0.00 0.00 +0.000 HD +ATOM 607 CD2 LEU 210 -29.717 -12.614 0.785 0.00 0.00 +0.000 C +ATOM 608 HD21 LEU 210 -29.336 -12.644 1.708 0.00 0.00 +0.000 HD +ATOM 609 HD22 LEU 210 -30.605 -12.157 0.802 0.00 0.00 +0.000 HD +ATOM 610 HD23 LEU 210 -29.824 -13.544 0.435 0.00 0.00 +0.000 HD +ATOM 611 C LEU 210 -26.126 -10.426 -0.661 0.00 0.00 +0.000 C +ATOM 612 O LEU 210 -26.672 -9.500 -1.267 0.00 0.00 +0.000 OA +ATOM 613 N GLU 211 -25.336 -10.239 0.392 0.00 0.00 +0.000 N +ATOM 614 H GLU 211 -24.941 -11.106 0.802 0.00 0.00 +0.000 HD +ATOM 615 CA GLU 211 -25.060 -8.902 0.914 0.00 0.00 +0.000 C +ATOM 616 HA GLU 211 -25.921 -8.451 1.161 0.00 0.00 +0.000 HD +ATOM 617 CB GLU 211 -24.248 -9.010 2.216 0.00 0.00 +0.000 C +ATOM 618 HB2 GLU 211 -23.607 -9.734 2.109 0.00 0.00 +0.000 HD +ATOM 619 HB3 GLU 211 -23.845 -8.143 2.390 0.00 0.00 +0.000 HD +ATOM 620 CG GLU 211 -25.141 -9.355 3.414 0.00 0.00 +0.000 C +ATOM 621 HG2 GLU 211 -25.576 -8.524 3.721 0.00 0.00 +0.000 HD +ATOM 622 HG3 GLU 211 -25.805 -10.024 3.121 0.00 0.00 +0.000 HD +ATOM 623 CD GLU 211 -24.396 -9.950 4.615 0.00 0.00 +0.000 C +ATOM 624 OE1 GLU 211 -23.160 -10.134 4.545 0.00 0.00 +0.000 OA +ATOM 625 OE2 GLU 211 -25.066 -10.236 5.638 0.00 0.00 +0.000 OA +ATOM 626 C GLU 211 -24.331 -8.066 -0.137 0.00 0.00 +0.000 C +ATOM 627 O GLU 211 -24.606 -6.878 -0.308 0.00 0.00 +0.000 OA +ATOM 628 N THR 212 -23.403 -8.695 -0.850 0.00 0.00 +0.000 N +ATOM 629 H THR 212 -23.261 -9.693 -0.597 0.00 0.00 +0.000 HD +ATOM 630 CA THR 212 -22.652 -8.019 -1.903 0.00 0.00 +0.000 C +ATOM 631 HA THR 212 -22.234 -7.197 -1.521 0.00 0.00 +0.000 HD +ATOM 632 CB THR 212 -21.593 -8.951 -2.489 0.00 0.00 +0.000 C +ATOM 633 HB THR 212 -22.050 -9.782 -2.864 0.00 0.00 +0.000 HD +ATOM 634 CG2 THR 212 -20.804 -8.250 -3.592 0.00 0.00 +0.000 C +ATOM 635 HG21 THR 212 -20.406 -8.932 -4.208 0.00 0.00 +0.000 HD +ATOM 636 HG22 THR 212 -21.413 -7.649 -4.113 0.00 0.00 +0.000 HD +ATOM 637 HG23 THR 212 -20.069 -7.704 -3.186 0.00 0.00 +0.000 HD +ATOM 638 OG1 THR 212 -20.707 -9.364 -1.445 0.00 0.00 +0.000 OA +ATOM 639 HG1 THR 212 -21.163 -10.025 -0.839 0.00 0.00 +0.000 HD +ATOM 640 C THR 212 -23.621 -7.598 -3.006 0.00 0.00 +0.000 C +ATOM 641 O THR 212 -23.522 -6.497 -3.545 0.00 0.00 +0.000 OA +ATOM 642 N LEU 213 -24.557 -8.483 -3.353 0.00 0.00 +0.000 N +ATOM 643 H LEU 213 -24.524 -9.381 -2.857 0.00 0.00 +0.000 HD +ATOM 644 CA LEU 213 -25.546 -8.147 -4.381 0.00 0.00 +0.000 C +ATOM 645 HA LEU 213 -25.055 -7.882 -5.224 0.00 0.00 +0.000 HD +ATOM 646 CB LEU 213 -26.428 -9.358 -4.726 0.00 0.00 +0.000 C +ATOM 647 HB2 LEU 213 -26.596 -9.861 -3.876 0.00 0.00 +0.000 HD +ATOM 648 HB3 LEU 213 -27.295 -9.008 -5.081 0.00 0.00 +0.000 HD +ATOM 649 CG LEU 213 -25.884 -10.357 -5.747 0.00 0.00 +0.000 C +ATOM 650 HG LEU 213 -24.983 -10.658 -5.458 0.00 0.00 +0.000 HD +ATOM 651 CD1 LEU 213 -26.821 -11.552 -5.819 0.00 0.00 +0.000 C +ATOM 652 HD11 LEU 213 -27.732 -11.247 -6.099 0.00 0.00 +0.000 HD +ATOM 653 HD12 LEU 213 -26.472 -12.212 -6.486 0.00 0.00 +0.000 HD +ATOM 654 HD13 LEU 213 -26.878 -11.987 -4.920 0.00 0.00 +0.000 HD +ATOM 655 CD2 LEU 213 -25.750 -9.692 -7.117 0.00 0.00 +0.000 C +ATOM 656 HD21 LEU 213 -25.122 -8.917 -7.049 0.00 0.00 +0.000 HD +ATOM 657 HD22 LEU 213 -25.394 -10.356 -7.774 0.00 0.00 +0.000 HD +ATOM 658 HD23 LEU 213 -26.647 -9.371 -7.418 0.00 0.00 +0.000 HD +ATOM 659 C LEU 213 -26.448 -6.975 -3.966 0.00 0.00 +0.000 C +ATOM 660 O LEU 213 -26.835 -6.171 -4.802 0.00 0.00 +0.000 OA +ATOM 661 N ARG 214 -26.796 -6.887 -2.684 0.00 0.00 +0.000 N +ATOM 662 H ARG 214 -26.430 -7.627 -2.072 0.00 0.00 +0.000 HD +ATOM 663 CA ARG 214 -27.649 -5.788 -2.220 0.00 0.00 +0.000 C +ATOM 664 HA ARG 214 -28.475 -5.762 -2.789 0.00 0.00 +0.000 HD +ATOM 665 CB ARG 214 -28.025 -5.958 -0.756 0.00 0.00 +0.000 C +ATOM 666 HB2 ARG 214 -27.182 -6.127 -0.238 0.00 0.00 +0.000 HD +ATOM 667 HB3 ARG 214 -28.433 -5.097 -0.439 0.00 0.00 +0.000 HD +ATOM 668 CG ARG 214 -28.986 -7.069 -0.472 0.00 0.00 +0.000 C +ATOM 669 HG2 ARG 214 -29.854 -6.889 -0.908 0.00 0.00 +0.000 HD +ATOM 670 HG3 ARG 214 -28.606 -7.932 -0.769 0.00 0.00 +0.000 HD +ATOM 671 CD ARG 214 -29.212 -7.141 1.020 0.00 0.00 +0.000 C +ATOM 672 HD2 ARG 214 -28.324 -7.169 1.469 0.00 0.00 +0.000 HD +ATOM 673 HD3 ARG 214 -29.714 -6.327 1.299 0.00 0.00 +0.000 HD +ATOM 674 NE ARG 214 -29.974 -8.325 1.382 0.00 0.00 +0.000 N +ATOM 675 HE ARG 214 -30.629 -8.690 0.709 0.00 0.00 +0.000 HD +ATOM 676 CZ ARG 214 -29.859 -8.952 2.541 0.00 0.00 +0.000 C +ATOM 677 NH1 ARG 214 -29.010 -8.502 3.450 0.00 0.00 +0.000 N +ATOM 678 HH11 ARG 214 -28.462 -7.685 3.296 0.00 0.00 +0.000 HD +ATOM 679 HH12 ARG 214 -28.912 -8.997 4.327 0.00 0.00 +0.000 HD +ATOM 680 NH2 ARG 214 -30.589 -10.032 2.782 0.00 0.00 +0.000 N +ATOM 681 HH21 ARG 214 -31.240 -10.358 2.092 0.00 0.00 +0.000 HD +ATOM 682 HH22 ARG 214 -30.494 -10.521 3.648 0.00 0.00 +0.000 HD +ATOM 683 C ARG 214 -26.916 -4.468 -2.353 0.00 0.00 +0.000 C +ATOM 684 O ARG 214 -27.527 -3.411 -2.529 0.00 0.00 +0.000 OA +ATOM 685 N ARG 215 -25.598 -4.531 -2.240 0.00 0.00 +0.000 N +ATOM 686 H ARG 215 -25.218 -5.484 -2.074 0.00 0.00 +0.000 HD +ATOM 687 CA ARG 215 -24.772 -3.343 -2.344 0.00 0.00 +0.000 C +ATOM 688 HA ARG 215 -25.251 -2.571 -1.903 0.00 0.00 +0.000 HD +ATOM 689 CB ARG 215 -23.456 -3.579 -1.595 0.00 0.00 +0.000 C +ATOM 690 HB2 ARG 215 -23.668 -3.684 -0.620 0.00 0.00 +0.000 HD +ATOM 691 HB3 ARG 215 -23.054 -4.433 -1.934 0.00 0.00 +0.000 HD +ATOM 692 CG ARG 215 -22.404 -2.483 -1.729 0.00 0.00 +0.000 C +ATOM 693 HG2 ARG 215 -21.960 -2.554 -2.610 0.00 0.00 +0.000 HD +ATOM 694 HG3 ARG 215 -22.830 -1.598 -1.612 0.00 0.00 +0.000 HD +ATOM 695 CD ARG 215 -21.336 -2.642 -0.644 0.00 0.00 +0.000 C +ATOM 696 HD2 ARG 215 -20.586 -2.020 -0.858 0.00 0.00 +0.000 HD +ATOM 697 HD3 ARG 215 -21.748 -2.390 0.229 0.00 0.00 +0.000 HD +ATOM 698 NE ARG 215 -20.817 -4.012 -0.557 0.00 0.00 +0.000 N +ATOM 699 HE ARG 215 -21.280 -4.645 0.082 0.00 0.00 +0.000 HD +ATOM 700 CZ ARG 215 -19.786 -4.485 -1.253 0.00 0.00 +0.000 C +ATOM 701 NH1 ARG 215 -19.136 -3.710 -2.101 0.00 0.00 +0.000 N +ATOM 702 HH11 ARG 215 -19.389 -2.752 -2.223 0.00 0.00 +0.000 HD +ATOM 703 HH12 ARG 215 -18.369 -4.086 -2.636 0.00 0.00 +0.000 HD +ATOM 704 NH2 ARG 215 -19.408 -5.743 -1.095 0.00 0.00 +0.000 N +ATOM 705 HH21 ARG 215 -19.886 -6.331 -0.437 0.00 0.00 +0.000 HD +ATOM 706 HH22 ARG 215 -18.646 -6.112 -1.627 0.00 0.00 +0.000 HD +ATOM 707 C ARG 215 -24.504 -2.978 -3.798 0.00 0.00 +0.000 C +ATOM 708 O ARG 215 -24.844 -1.875 -4.230 0.00 0.00 +0.000 OA +ATOM 709 N VAL 216 -23.937 -3.911 -4.560 0.00 0.00 +0.000 N +ATOM 710 H VAL 216 -23.767 -4.818 -4.080 0.00 0.00 +0.000 HD +ATOM 711 CA VAL 216 -23.588 -3.665 -5.956 0.00 0.00 +0.000 C +ATOM 712 HA VAL 216 -23.173 -2.734 -6.016 0.00 0.00 +0.000 HD +ATOM 713 CB VAL 216 -22.501 -4.669 -6.424 0.00 0.00 +0.000 C +ATOM 714 HB VAL 216 -22.904 -5.579 -6.390 0.00 0.00 +0.000 HD +ATOM 715 CG1 VAL 216 -22.107 -4.403 -7.864 0.00 0.00 +0.000 C +ATOM 716 HG11 VAL 216 -21.477 -5.115 -8.178 0.00 0.00 +0.000 HD +ATOM 717 HG12 VAL 216 -22.924 -4.406 -8.443 0.00 0.00 +0.000 HD +ATOM 718 HG13 VAL 216 -21.658 -3.511 -7.931 0.00 0.00 +0.000 HD +ATOM 719 CG2 VAL 216 -21.285 -4.550 -5.521 0.00 0.00 +0.000 C +ATOM 720 HG21 VAL 216 -21.276 -5.314 -4.875 0.00 0.00 +0.000 HD +ATOM 721 HG22 VAL 216 -20.455 -4.572 -6.079 0.00 0.00 +0.000 HD +ATOM 722 HG23 VAL 216 -21.329 -3.686 -5.018 0.00 0.00 +0.000 HD +ATOM 723 C VAL 216 -24.770 -3.707 -6.922 0.00 0.00 +0.000 C +ATOM 724 O VAL 216 -24.858 -2.883 -7.834 0.00 0.00 +0.000 OA +ATOM 725 N GLY 217 -25.667 -4.672 -6.741 0.00 0.00 +0.000 N +ATOM 726 H GLY 217 -25.482 -5.307 -5.955 0.00 0.00 +0.000 HD +ATOM 727 CA GLY 217 -26.813 -4.773 -7.627 0.00 0.00 +0.000 C +ATOM 728 HA2 GLY 217 -26.491 -4.980 -8.572 0.00 0.00 +0.000 HD +ATOM 729 HA3 GLY 217 -27.391 -5.563 -7.341 0.00 0.00 +0.000 HD +ATOM 730 C GLY 217 -27.671 -3.518 -7.660 0.00 0.00 +0.000 C +ATOM 731 O GLY 217 -28.157 -3.111 -8.712 0.00 0.00 +0.000 OA +ATOM 732 N ASP 218 -27.863 -2.905 -6.500 0.00 0.00 +0.000 N +ATOM 733 H ASP 218 -27.396 -3.356 -5.686 0.00 0.00 +0.000 HD +ATOM 734 CA ASP 218 -28.667 -1.695 -6.391 0.00 0.00 +0.000 C +ATOM 735 HA ASP 218 -29.551 -1.881 -6.844 0.00 0.00 +0.000 HD +ATOM 736 CB ASP 218 -28.881 -1.366 -4.912 0.00 0.00 +0.000 C +ATOM 737 HB2 ASP 218 -27.995 -1.323 -4.472 0.00 0.00 +0.000 HD +ATOM 738 HB3 ASP 218 -29.351 -0.498 -4.852 0.00 0.00 +0.000 HD +ATOM 739 CG ASP 218 -29.725 -2.426 -4.199 0.00 0.00 +0.000 C +ATOM 740 OD1 ASP 218 -29.671 -3.617 -4.593 0.00 0.00 +0.000 OA +ATOM 741 OD2 ASP 218 -30.443 -2.080 -3.231 0.00 0.00 +0.000 OA +ATOM 742 C ASP 218 -28.031 -0.518 -7.125 0.00 0.00 +0.000 C +ATOM 743 O ASP 218 -28.728 0.302 -7.718 0.00 0.00 +0.000 OA +ATOM 744 N GLY 219 -26.705 -0.442 -7.097 0.00 0.00 +0.000 N +ATOM 745 H GLY 219 -26.229 -1.187 -6.572 0.00 0.00 +0.000 HD +ATOM 746 CA GLY 219 -26.027 0.643 -7.780 0.00 0.00 +0.000 C +ATOM 747 HA2 GLY 219 -26.419 1.527 -7.483 0.00 0.00 +0.000 HD +ATOM 748 HA3 GLY 219 -25.048 0.643 -7.527 0.00 0.00 +0.000 HD +ATOM 749 C GLY 219 -26.152 0.524 -9.291 0.00 0.00 +0.000 C +ATOM 750 O GLY 219 -26.279 1.531 -9.995 0.00 0.00 +0.000 OA +ATOM 751 N VAL 220 -26.126 -0.709 -9.786 0.00 0.00 +0.000 N +ATOM 752 H VAL 220 -26.028 -1.462 -9.075 0.00 0.00 +0.000 HD +ATOM 753 CA VAL 220 -26.228 -0.966 -11.217 0.00 0.00 +0.000 C +ATOM 754 HA VAL 220 -25.505 -0.431 -11.685 0.00 0.00 +0.000 HD +ATOM 755 CB VAL 220 -26.008 -2.470 -11.526 0.00 0.00 +0.000 C +ATOM 756 HB VAL 220 -26.700 -2.979 -11.027 0.00 0.00 +0.000 HD +ATOM 757 CG1 VAL 220 -26.224 -2.738 -13.001 0.00 0.00 +0.000 C +ATOM 758 HG11 VAL 220 -25.631 -3.488 -13.298 0.00 0.00 +0.000 HD +ATOM 759 HG12 VAL 220 -27.180 -2.990 -13.162 0.00 0.00 +0.000 HD +ATOM 760 HG13 VAL 220 -26.006 -1.916 -13.529 0.00 0.00 +0.000 HD +ATOM 761 CG2 VAL 220 -24.601 -2.884 -11.109 0.00 0.00 +0.000 C +ATOM 762 HG21 VAL 220 -24.131 -2.097 -10.711 0.00 0.00 +0.000 HD +ATOM 763 HG22 VAL 220 -24.661 -3.618 -10.434 0.00 0.00 +0.000 HD +ATOM 764 HG23 VAL 220 -24.101 -3.205 -11.913 0.00 0.00 +0.000 HD +ATOM 765 C VAL 220 -27.572 -0.539 -11.796 0.00 0.00 +0.000 C +ATOM 766 O VAL 220 -27.629 0.062 -12.865 0.00 0.00 +0.000 OA +ATOM 767 N GLN 221 -28.653 -0.860 -11.092 0.00 0.00 +0.000 N +ATOM 768 H GLN 221 -28.465 -1.365 -10.207 0.00 0.00 +0.000 HD +ATOM 769 CA GLN 221 -29.991 -0.514 -11.556 0.00 0.00 +0.000 C +ATOM 770 HA GLN 221 -30.109 -0.894 -12.482 0.00 0.00 +0.000 HD +ATOM 771 CB GLN 221 -31.044 -1.094 -10.606 0.00 0.00 +0.000 C +ATOM 772 HB2 GLN 221 -30.895 -0.710 -9.689 0.00 0.00 +0.000 HD +ATOM 773 HB3 GLN 221 -31.955 -0.815 -10.928 0.00 0.00 +0.000 HD +ATOM 774 CG GLN 221 -31.032 -2.613 -10.488 0.00 0.00 +0.000 C +ATOM 775 HG2 GLN 221 -31.214 -3.006 -11.385 0.00 0.00 +0.000 HD +ATOM 776 HG3 GLN 221 -30.136 -2.903 -10.163 0.00 0.00 +0.000 HD +ATOM 777 CD GLN 221 -32.088 -3.121 -9.514 0.00 0.00 +0.000 C +ATOM 778 OE1 GLN 221 -31.765 -3.778 -8.530 0.00 0.00 +0.000 OA +ATOM 779 NE2 GLN 221 -33.352 -2.822 -9.790 0.00 0.00 +0.000 N +ATOM 780 HE21 GLN 221 -34.106 -3.139 -9.194 0.00 0.00 +0.000 HD +ATOM 781 HE22 GLN 221 -33.552 -2.262 -10.620 0.00 0.00 +0.000 HD +ATOM 782 C GLN 221 -30.175 1.002 -11.652 0.00 0.00 +0.000 C +ATOM 783 O GLN 221 -30.936 1.487 -12.489 0.00 0.00 +0.000 OA +ATOM 784 N ARG 222 -29.482 1.740 -10.785 0.00 0.00 +0.000 N +ATOM 785 H ARG 222 -28.895 1.194 -10.123 0.00 0.00 +0.000 HD +ATOM 786 CA ARG 222 -29.554 3.198 -10.780 0.00 0.00 +0.000 C +ATOM 787 HA ARG 222 -30.497 3.478 -10.985 0.00 0.00 +0.000 HD +ATOM 788 CB ARG 222 -29.146 3.743 -9.411 0.00 0.00 +0.000 C +ATOM 789 HB2 ARG 222 -28.240 3.386 -9.190 0.00 0.00 +0.000 HD +ATOM 790 HB3 ARG 222 -29.110 4.739 -9.469 0.00 0.00 +0.000 HD +ATOM 791 CG ARG 222 -30.087 3.373 -8.273 0.00 0.00 +0.000 C +ATOM 792 HG2 ARG 222 -30.510 2.489 -8.463 0.00 0.00 +0.000 HD +ATOM 793 HG3 ARG 222 -29.574 3.324 -7.418 0.00 0.00 +0.000 HD +ATOM 794 CD ARG 222 -31.205 4.401 -8.091 0.00 0.00 +0.000 C +ATOM 795 HD2 ARG 222 -31.701 4.164 -7.261 0.00 0.00 +0.000 HD +ATOM 796 HD3 ARG 222 -30.779 5.296 -7.994 0.00 0.00 +0.000 HD +ATOM 797 NE ARG 222 -32.111 4.409 -9.220 0.00 0.00 +0.000 N +ATOM 798 HE ARG 222 -32.021 3.673 -9.908 0.00 0.00 +0.000 HD +ATOM 799 CZ ARG 222 -33.062 5.320 -9.423 0.00 0.00 +0.000 C +ATOM 800 NH1 ARG 222 -33.254 6.320 -8.557 0.00 0.00 +0.000 N +ATOM 801 HH11 ARG 222 -32.669 6.405 -7.754 0.00 0.00 +0.000 HD +ATOM 802 HH12 ARG 222 -33.986 6.982 -8.719 0.00 0.00 +0.000 HD +ATOM 803 NH2 ARG 222 -33.795 5.265 -10.528 0.00 0.00 +0.000 N +ATOM 804 HH21 ARG 222 -33.618 4.554 -11.211 0.00 0.00 +0.000 HD +ATOM 805 HH22 ARG 222 -34.523 5.933 -10.681 0.00 0.00 +0.000 HD +ATOM 806 C ARG 222 -28.630 3.781 -11.846 0.00 0.00 +0.000 C +ATOM 807 O ARG 222 -29.035 4.643 -12.633 0.00 0.00 +0.000 OA +ATOM 808 N ASN 223 -27.386 3.304 -11.867 0.00 0.00 +0.000 N +ATOM 809 H ASN 223 -27.178 2.587 -11.153 0.00 0.00 +0.000 HD +ATOM 810 CA ASN 223 -26.412 3.784 -12.845 0.00 0.00 +0.000 C +ATOM 811 HA ASN 223 -26.346 4.788 -12.729 0.00 0.00 +0.000 HD +ATOM 812 CB ASN 223 -25.052 3.121 -12.625 0.00 0.00 +0.000 C +ATOM 813 HB2 ASN 223 -25.205 2.158 -12.418 0.00 0.00 +0.000 HD +ATOM 814 HB3 ASN 223 -24.523 3.209 -13.466 0.00 0.00 +0.000 HD +ATOM 815 CG ASN 223 -24.284 3.747 -11.496 0.00 0.00 +0.000 C +ATOM 816 OD1 ASN 223 -24.321 4.960 -11.310 0.00 0.00 +0.000 OA +ATOM 817 ND2 ASN 223 -23.569 2.929 -10.741 0.00 0.00 +0.000 N +ATOM 818 HD21 ASN 223 -23.040 3.287 -9.970 0.00 0.00 +0.000 HD +ATOM 819 HD22 ASN 223 -23.554 1.946 -10.939 0.00 0.00 +0.000 HD +ATOM 820 C ASN 223 -26.845 3.528 -14.280 0.00 0.00 +0.000 C +ATOM 821 O ASN 223 -26.482 4.267 -15.189 0.00 0.00 +0.000 OA +ATOM 822 N HIE 224 -27.626 2.479 -14.479 0.00 0.00 +0.000 N +ATOM 823 H HIE 224 -27.882 1.952 -13.625 0.00 0.00 +0.000 HD +ATOM 824 CA HIE 224 -28.068 2.127 -15.810 0.00 0.00 +0.000 C +ATOM 825 HA HIE 224 -27.697 2.802 -16.464 0.00 0.00 +0.000 HD +ATOM 826 CB HIE 224 -27.465 0.762 -16.162 0.00 0.00 +0.000 C +ATOM 827 HB2 HIE 224 -27.749 0.092 -15.474 0.00 0.00 +0.000 HD +ATOM 828 HB3 HIE 224 -27.804 0.478 -17.060 0.00 0.00 +0.000 HD +ATOM 829 CG HIE 224 -25.966 0.787 -16.208 0.00 0.00 +0.000 A +ATOM 830 ND1 HIE 224 -25.278 1.419 -17.219 0.00 0.00 +0.000 NA +ATOM 831 CE1 HIE 224 -23.982 1.395 -16.948 0.00 0.00 +0.000 A +ATOM 832 HE1 HIE 224 -23.263 1.785 -17.515 0.00 0.00 +0.000 HD +ATOM 833 NE2 HIE 224 -23.808 0.766 -15.803 0.00 0.00 +0.000 N +ATOM 834 HE2 HIE 224 -22.922 0.599 -15.348 0.00 0.00 +0.000 HD +ATOM 835 CD2 HIE 224 -25.033 0.367 -15.317 0.00 0.00 +0.000 A +ATOM 836 HD2 HIE 224 -25.199 -0.133 -14.475 0.00 0.00 +0.000 HD +ATOM 837 C HIE 224 -29.589 2.151 -15.920 0.00 0.00 +0.000 C +ATOM 838 O HIE 224 -30.184 1.417 -16.696 0.00 0.00 +0.000 OA +ATOM 839 N GLU 225 -30.198 3.056 -15.157 0.00 0.00 +0.000 N +ATOM 840 H GLU 225 -29.545 3.640 -14.582 0.00 0.00 +0.000 HD +ATOM 841 CA GLU 225 -31.647 3.223 -15.122 0.00 0.00 +0.000 C +ATOM 842 HA GLU 225 -32.064 2.437 -14.627 0.00 0.00 +0.000 HD +ATOM 843 CB GLU 225 -32.009 4.470 -14.313 0.00 0.00 +0.000 C +ATOM 844 HB2 GLU 225 -31.779 4.294 -13.373 0.00 0.00 +0.000 HD +ATOM 845 HB3 GLU 225 -31.502 5.226 -14.684 0.00 0.00 +0.000 HD +ATOM 846 CG GLU 225 -33.485 4.834 -14.366 0.00 0.00 +0.000 C +ATOM 847 HG2 GLU 225 -33.750 4.902 -15.307 0.00 0.00 +0.000 HD +ATOM 848 HG3 GLU 225 -33.989 4.148 -13.879 0.00 0.00 +0.000 HD +ATOM 849 CD GLU 225 -33.767 6.167 -13.709 0.00 0.00 +0.000 C +ATOM 850 OE1 GLU 225 -34.384 6.172 -12.627 0.00 0.00 +0.000 OA +ATOM 851 OE2 GLU 225 -33.367 7.211 -14.275 0.00 0.00 +0.000 OA +ATOM 852 C GLU 225 -32.279 3.340 -16.501 0.00 0.00 +0.000 C +ATOM 853 O GLU 225 -33.199 2.598 -16.844 0.00 0.00 +0.000 OA +ATOM 854 N THR 226 -31.799 4.295 -17.283 0.00 0.00 +0.000 N +ATOM 855 H THR 226 -31.027 4.852 -16.875 0.00 0.00 +0.000 HD +ATOM 856 CA THR 226 -32.340 4.519 -18.614 0.00 0.00 +0.000 C +ATOM 857 HA THR 226 -33.312 4.798 -18.524 0.00 0.00 +0.000 HD +ATOM 858 CB THR 226 -31.601 5.678 -19.321 0.00 0.00 +0.000 C +ATOM 859 HB THR 226 -30.630 5.406 -19.466 0.00 0.00 +0.000 HD +ATOM 860 CG2 THR 226 -32.278 6.016 -20.645 0.00 0.00 +0.000 C +ATOM 861 HG21 THR 226 -33.265 5.859 -20.570 0.00 0.00 +0.000 HD +ATOM 862 HG22 THR 226 -32.114 6.978 -20.873 0.00 0.00 +0.000 HD +ATOM 863 HG23 THR 226 -31.906 5.437 -21.373 0.00 0.00 +0.000 HD +ATOM 864 OG1 THR 226 -31.622 6.837 -18.478 0.00 0.00 +0.000 OA +ATOM 865 HG1 THR 226 -32.024 6.612 -17.584 0.00 0.00 +0.000 HD +ATOM 866 C THR 226 -32.285 3.274 -19.493 0.00 0.00 +0.000 C +ATOM 867 O THR 226 -33.275 2.921 -20.132 0.00 0.00 +0.000 OA +ATOM 868 N VAL 227 -31.140 2.604 -19.535 0.00 0.00 +0.000 N +ATOM 869 H VAL 227 -30.377 2.985 -18.965 0.00 0.00 +0.000 HD +ATOM 870 CA VAL 227 -31.030 1.404 -20.360 0.00 0.00 +0.000 C +ATOM 871 HA VAL 227 -31.313 1.626 -21.299 0.00 0.00 +0.000 HD +ATOM 872 CB VAL 227 -29.587 0.923 -20.403 0.00 0.00 +0.000 C +ATOM 873 HB VAL 227 -28.953 1.710 -20.812 0.00 0.00 +0.000 HD +ATOM 874 CG1 VAL 227 -29.123 0.580 -18.991 0.00 0.00 +0.000 C +ATOM 875 HG11 VAL 227 -29.756 -0.207 -18.582 0.00 0.00 +0.000 HD +ATOM 876 HG12 VAL 227 -28.090 0.235 -19.022 0.00 0.00 +0.000 HD +ATOM 877 HG13 VAL 227 -29.192 1.466 -18.360 0.00 0.00 +0.000 HD +ATOM 878 CG2 VAL 227 -29.491 -0.317 -21.285 0.00 0.00 +0.000 C +ATOM 879 HG21 VAL 227 -29.822 -0.073 -22.294 0.00 0.00 +0.000 HD +ATOM 880 HG22 VAL 227 -28.457 -0.662 -21.316 0.00 0.00 +0.000 HD +ATOM 881 HG23 VAL 227 -30.124 -1.105 -20.876 0.00 0.00 +0.000 HD +ATOM 882 C VAL 227 -31.946 0.291 -19.831 0.00 0.00 +0.000 C +ATOM 883 O VAL 227 -32.558 -0.445 -20.607 0.00 0.00 +0.000 OA +ATOM 884 N PHE 228 -32.040 0.180 -18.508 0.00 0.00 +0.000 N +ATOM 885 H PHE 228 -31.483 0.867 -17.970 0.00 0.00 +0.000 HD +ATOM 886 CA PHE 228 -32.875 -0.845 -17.894 0.00 0.00 +0.000 C +ATOM 887 HA PHE 228 -32.609 -1.726 -18.303 0.00 0.00 +0.000 HD +ATOM 888 CB PHE 228 -32.657 -0.863 -16.376 0.00 0.00 +0.000 C +ATOM 889 HB2 PHE 228 -32.453 0.057 -16.087 0.00 0.00 +0.000 HD +ATOM 890 HB3 PHE 228 -33.480 -1.206 -15.955 0.00 0.00 +0.000 HD +ATOM 891 CG PHE 228 -31.509 -1.751 -15.940 0.00 0.00 +0.000 A +ATOM 892 CD1 PHE 228 -30.329 -1.796 -16.678 0.00 0.00 +0.000 A +ATOM 893 HD1 PHE 228 -30.236 -1.239 -17.499 0.00 0.00 +0.000 HD +ATOM 894 CE1 PHE 228 -29.267 -2.610 -16.286 0.00 0.00 +0.000 A +ATOM 895 HE1 PHE 228 -28.428 -2.631 -16.841 0.00 0.00 +0.000 HD +ATOM 896 CZ PHE 228 -29.369 -3.390 -15.134 0.00 0.00 +0.000 A +ATOM 897 HZ PHE 228 -28.607 -3.965 -14.854 0.00 0.00 +0.000 HD +ATOM 898 CE2 PHE 228 -30.542 -3.356 -14.382 0.00 0.00 +0.000 A +ATOM 899 HE2 PHE 228 -30.638 -3.918 -13.551 0.00 0.00 +0.000 HD +ATOM 900 CD2 PHE 228 -31.606 -2.531 -14.785 0.00 0.00 +0.000 A +ATOM 901 HD2 PHE 228 -32.438 -2.504 -14.237 0.00 0.00 +0.000 HD +ATOM 902 C PHE 228 -34.346 -0.630 -18.234 0.00 0.00 +0.000 C +ATOM 903 O PHE 228 -35.036 -1.576 -18.613 0.00 0.00 +0.000 OA +ATOM 904 N GLN 229 -34.822 0.609 -18.104 0.00 0.00 +0.000 N +ATOM 905 H GLN 229 -34.143 1.306 -17.757 0.00 0.00 +0.000 HD +ATOM 906 CA GLN 229 -36.212 0.925 -18.437 0.00 0.00 +0.000 C +ATOM 907 HA GLN 229 -36.802 0.315 -17.914 0.00 0.00 +0.000 HD +ATOM 908 CB GLN 229 -36.517 2.409 -18.220 0.00 0.00 +0.000 C +ATOM 909 HB2 GLN 229 -35.962 2.948 -18.880 0.00 0.00 +0.000 HD +ATOM 910 HB3 GLN 229 -37.494 2.572 -18.458 0.00 0.00 +0.000 HD +ATOM 911 CG GLN 229 -36.275 2.978 -16.835 0.00 0.00 +0.000 C +ATOM 912 HG2 GLN 229 -36.906 2.557 -16.194 0.00 0.00 +0.000 HD +ATOM 913 HG3 GLN 229 -35.335 2.800 -16.569 0.00 0.00 +0.000 HD +ATOM 914 CD GLN 229 -36.503 4.493 -16.807 0.00 0.00 +0.000 C +ATOM 915 OE1 GLN 229 -37.320 4.990 -16.022 0.00 0.00 +0.000 OA +ATOM 916 NE2 GLN 229 -35.779 5.232 -17.659 0.00 0.00 +0.000 N +ATOM 917 HE21 GLN 229 -35.892 6.229 -17.699 0.00 0.00 +0.000 HD +ATOM 918 HE22 GLN 229 -35.111 4.755 -18.263 0.00 0.00 +0.000 HD +ATOM 919 C GLN 229 -36.435 0.633 -19.922 0.00 0.00 +0.000 C +ATOM 920 O GLN 229 -37.483 0.135 -20.321 0.00 0.00 +0.000 OA +ATOM 921 N GLY 230 -35.441 0.976 -20.732 0.00 0.00 +0.000 N +ATOM 922 H GLY 230 -34.618 1.394 -20.266 0.00 0.00 +0.000 HD +ATOM 923 CA GLY 230 -35.540 0.763 -22.165 0.00 0.00 +0.000 C +ATOM 924 HA2 GLY 230 -36.349 1.273 -22.524 0.00 0.00 +0.000 HD +ATOM 925 HA3 GLY 230 -34.723 1.173 -22.621 0.00 0.00 +0.000 HD +ATOM 926 C GLY 230 -35.654 -0.692 -22.564 0.00 0.00 +0.000 C +ATOM 927 O GLY 230 -36.481 -1.049 -23.410 0.00 0.00 +0.000 OA +ATOM 928 N MET 231 -34.824 -1.535 -21.957 0.00 0.00 +0.000 N +ATOM 929 H MET 231 -34.183 -1.102 -21.270 0.00 0.00 +0.000 HD +ATOM 930 CA MET 231 -34.844 -2.958 -22.262 0.00 0.00 +0.000 C +ATOM 931 HA MET 231 -34.808 -3.069 -23.257 0.00 0.00 +0.000 HD +ATOM 932 CB MET 231 -33.647 -3.666 -21.615 0.00 0.00 +0.000 C +ATOM 933 HB2 MET 231 -32.797 -3.241 -21.947 0.00 0.00 +0.000 HD +ATOM 934 HB3 MET 231 -33.695 -3.543 -20.617 0.00 0.00 +0.000 HD +ATOM 935 CG MET 231 -33.583 -5.163 -21.911 0.00 0.00 +0.000 C +ATOM 936 HG2 MET 231 -32.788 -5.561 -21.399 0.00 0.00 +0.000 HD +ATOM 937 HG3 MET 231 -34.416 -5.610 -21.511 0.00 0.00 +0.000 HD +ATOM 938 SD MET 231 -33.450 -5.539 -23.685 0.00 0.00 +0.000 S +ATOM 939 CE MET 231 -32.706 -7.161 -23.630 0.00 0.00 +0.000 C +ATOM 940 HE1 MET 231 -32.654 -7.541 -24.556 0.00 0.00 +0.000 HD +ATOM 941 HE2 MET 231 -31.782 -7.097 -23.248 0.00 0.00 +0.000 HD +ATOM 942 HE3 MET 231 -33.259 -7.768 -23.055 0.00 0.00 +0.000 HD +ATOM 943 C MET 231 -36.150 -3.574 -21.767 0.00 0.00 +0.000 C +ATOM 944 O MET 231 -36.762 -4.372 -22.472 0.00 0.00 +0.000 OA +ATOM 945 N LEU 232 -36.589 -3.202 -20.565 0.00 0.00 +0.000 N +ATOM 946 H LEU 232 -36.000 -2.524 -20.067 0.00 0.00 +0.000 HD +ATOM 947 CA LEU 232 -37.835 -3.753 -20.035 0.00 0.00 +0.000 C +ATOM 948 HA LEU 232 -37.737 -4.753 -19.955 0.00 0.00 +0.000 HD +ATOM 949 CB LEU 232 -38.108 -3.214 -18.619 0.00 0.00 +0.000 C +ATOM 950 HB2 LEU 232 -37.344 -3.478 -18.041 0.00 0.00 +0.000 HD +ATOM 951 HB3 LEU 232 -38.178 -2.226 -18.678 0.00 0.00 +0.000 HD +ATOM 952 CG LEU 232 -39.392 -3.726 -17.941 0.00 0.00 +0.000 C +ATOM 953 HG LEU 232 -40.171 -3.491 -18.518 0.00 0.00 +0.000 HD +ATOM 954 CD1 LEU 232 -39.318 -5.224 -17.761 0.00 0.00 +0.000 C +ATOM 955 HD11 LEU 232 -38.530 -5.459 -17.188 0.00 0.00 +0.000 HD +ATOM 956 HD12 LEU 232 -40.155 -5.555 -17.320 0.00 0.00 +0.000 HD +ATOM 957 HD13 LEU 232 -39.220 -5.669 -18.653 0.00 0.00 +0.000 HD +ATOM 958 CD2 LEU 232 -39.595 -3.050 -16.608 0.00 0.00 +0.000 C +ATOM 959 HD21 LEU 232 -39.673 -2.058 -16.737 0.00 0.00 +0.000 HD +ATOM 960 HD22 LEU 232 -40.434 -3.391 -16.176 0.00 0.00 +0.000 HD +ATOM 961 HD23 LEU 232 -38.816 -3.241 -16.006 0.00 0.00 +0.000 HD +ATOM 962 C LEU 232 -39.024 -3.463 -20.965 0.00 0.00 +0.000 C +ATOM 963 O LEU 232 -39.825 -4.358 -21.258 0.00 0.00 +0.000 OA +ATOM 964 N ARG 233 -39.128 -2.222 -21.441 0.00 0.00 +0.000 N +ATOM 965 H ARG 233 -38.392 -1.567 -21.116 0.00 0.00 +0.000 HD +ATOM 966 CA ARG 233 -40.209 -1.829 -22.355 0.00 0.00 +0.000 C +ATOM 967 HA ARG 233 -41.088 -1.993 -21.902 0.00 0.00 +0.000 HD +ATOM 968 CB ARG 233 -40.090 -0.339 -22.721 0.00 0.00 +0.000 C +ATOM 969 HB2 ARG 233 -40.217 0.195 -21.889 0.00 0.00 +0.000 HD +ATOM 970 HB3 ARG 233 -39.178 -0.183 -23.090 0.00 0.00 +0.000 HD +ATOM 971 CG ARG 233 -41.106 0.149 -23.754 0.00 0.00 +0.000 C +ATOM 972 HG2 ARG 233 -40.816 -0.134 -24.658 0.00 0.00 +0.000 HD +ATOM 973 HG3 ARG 233 -41.999 -0.219 -23.534 0.00 0.00 +0.000 HD +ATOM 974 CD ARG 233 -41.191 1.664 -23.727 0.00 0.00 +0.000 C +ATOM 975 HD2 ARG 233 -40.826 1.981 -22.864 0.00 0.00 +0.000 HD +ATOM 976 HD3 ARG 233 -40.667 2.018 -24.489 0.00 0.00 +0.000 HD +ATOM 977 NE ARG 233 -42.583 2.097 -23.853 0.00 0.00 +0.000 N +ATOM 978 HE ARG 233 -43.096 2.270 -22.997 0.00 0.00 +0.000 HD +ATOM 979 CZ ARG 233 -43.223 2.280 -25.000 0.00 0.00 +0.000 C +ATOM 980 NH1 ARG 233 -42.604 2.085 -26.154 0.00 0.00 +0.000 N +ATOM 981 HH11 ARG 233 -41.655 1.779 -26.184 0.00 0.00 +0.000 HD +ATOM 982 HH12 ARG 233 -43.096 2.246 -27.018 0.00 0.00 +0.000 HD +ATOM 983 NH2 ARG 233 -44.495 2.646 -24.990 0.00 0.00 +0.000 N +ATOM 984 HH21 ARG 233 -44.976 2.765 -24.118 0.00 0.00 +0.000 HD +ATOM 985 HH22 ARG 233 -44.981 2.804 -25.850 0.00 0.00 +0.000 HD +ATOM 986 C ARG 233 -40.147 -2.669 -23.628 0.00 0.00 +0.000 C +ATOM 987 O ARG 233 -41.156 -3.186 -24.111 0.00 0.00 +0.000 OA +ATOM 988 N LYS 234 -38.945 -2.788 -24.172 0.00 0.00 +0.000 N +ATOM 989 H LYS 234 -38.187 -2.283 -23.661 0.00 0.00 +0.000 HD +ATOM 990 CA LYS 234 -38.717 -3.558 -25.377 0.00 0.00 +0.000 C +ATOM 991 HA LYS 234 -39.224 -3.132 -26.142 0.00 0.00 +0.000 HD +ATOM 992 CB LYS 234 -37.226 -3.516 -25.701 0.00 0.00 +0.000 C +ATOM 993 HB2 LYS 234 -36.952 -2.545 -25.764 0.00 0.00 +0.000 HD +ATOM 994 HB3 LYS 234 -36.730 -3.924 -24.920 0.00 0.00 +0.000 HD +ATOM 995 CG LYS 234 -36.794 -4.215 -26.958 0.00 0.00 +0.000 C +ATOM 996 HG2 LYS 234 -36.765 -5.192 -26.806 0.00 0.00 +0.000 HD +ATOM 997 HG3 LYS 234 -37.406 -3.984 -27.699 0.00 0.00 +0.000 HD +ATOM 998 CD LYS 234 -35.391 -3.735 -27.315 0.00 0.00 +0.000 C +ATOM 999 HD2 LYS 234 -35.458 -3.070 -28.053 0.00 0.00 +0.000 HD +ATOM 1000 HD3 LYS 234 -34.980 -3.316 -26.511 0.00 0.00 +0.000 HD +ATOM 1001 CE LYS 234 -34.497 -4.881 -27.774 0.00 0.00 +0.000 C +ATOM 1002 HE2 LYS 234 -34.432 -5.562 -27.035 0.00 0.00 +0.000 HD +ATOM 1003 HE3 LYS 234 -34.916 -5.324 -28.576 0.00 0.00 +0.000 HD +ATOM 1004 NZ LYS 234 -33.104 -4.438 -28.144 0.00 0.00 +0.000 N +ATOM 1005 HZ1 LYS 234 -32.517 -4.519 -27.343 0.00 0.00 +0.000 HD +ATOM 1006 HZ2 LYS 234 -32.765 -5.022 -28.877 0.00 0.00 +0.000 HD +ATOM 1007 HZ3 LYS 234 -33.138 -3.490 -28.449 0.00 0.00 +0.000 HD +ATOM 1008 C LYS 234 -39.192 -4.997 -25.225 0.00 0.00 +0.000 C +ATOM 1009 O LYS 234 -39.803 -5.550 -26.143 0.00 0.00 +0.000 OA +ATOM 1010 N LEU 235 -38.898 -5.594 -24.072 0.00 0.00 +0.000 N +ATOM 1011 H LEU 235 -38.370 -4.992 -23.399 0.00 0.00 +0.000 HD +ATOM 1012 CA LEU 235 -39.280 -6.971 -23.774 0.00 0.00 +0.000 C +ATOM 1013 HA LEU 235 -38.951 -7.565 -24.526 0.00 0.00 +0.000 HD +ATOM 1014 CB LEU 235 -38.581 -7.431 -22.494 0.00 0.00 +0.000 C +ATOM 1015 HB2 LEU 235 -38.735 -6.749 -21.799 0.00 0.00 +0.000 HD +ATOM 1016 HB3 LEU 235 -38.953 -8.307 -22.239 0.00 0.00 +0.000 HD +ATOM 1017 CG LEU 235 -37.066 -7.599 -22.646 0.00 0.00 +0.000 C +ATOM 1018 HG LEU 235 -36.686 -6.758 -23.029 0.00 0.00 +0.000 HD +ATOM 1019 CD1 LEU 235 -36.429 -7.880 -21.301 0.00 0.00 +0.000 C +ATOM 1020 HD11 LEU 235 -36.811 -8.721 -20.915 0.00 0.00 +0.000 HD +ATOM 1021 HD12 LEU 235 -35.439 -7.988 -21.412 0.00 0.00 +0.000 HD +ATOM 1022 HD13 LEU 235 -36.610 -7.119 -20.676 0.00 0.00 +0.000 HD +ATOM 1023 CD2 LEU 235 -36.785 -8.737 -23.619 0.00 0.00 +0.000 C +ATOM 1024 HD21 LEU 235 -37.190 -8.524 -24.508 0.00 0.00 +0.000 HD +ATOM 1025 HD22 LEU 235 -35.796 -8.851 -23.722 0.00 0.00 +0.000 HD +ATOM 1026 HD23 LEU 235 -37.183 -9.584 -23.266 0.00 0.00 +0.000 HD +ATOM 1027 C LEU 235 -40.790 -7.151 -23.649 0.00 0.00 +0.000 C +ATOM 1028 O LEU 235 -41.312 -8.244 -23.864 0.00 0.00 +0.000 OA +ATOM 1029 N ASP 236 -41.479 -6.078 -23.281 0.00 0.00 +0.000 N +ATOM 1030 H ASP 236 -40.897 -5.237 -23.078 0.00 0.00 +0.000 HD +ATOM 1031 CA ASP 236 -42.930 -6.089 -23.174 0.00 0.00 +0.000 C +ATOM 1032 HA ASP 236 -43.198 -5.284 -22.612 0.00 0.00 +0.000 HD +ATOM 1033 CB ASP 236 -43.512 -5.955 -24.582 0.00 0.00 +0.000 C +ATOM 1034 HB2 ASP 236 -43.130 -5.134 -24.994 0.00 0.00 +0.000 HD +ATOM 1035 HB3 ASP 236 -43.244 -6.759 -25.102 0.00 0.00 +0.000 HD +ATOM 1036 CG ASP 236 -45.020 -5.848 -24.587 0.00 0.00 +0.000 C +ATOM 1037 OD1 ASP 236 -45.614 -5.551 -23.527 0.00 0.00 +0.000 OA +ATOM 1038 OD2 ASP 236 -45.595 -6.052 -25.673 0.00 0.00 +0.000 OA +ATOM 1039 C ASP 236 -43.492 -7.326 -22.464 0.00 0.00 +0.000 C +ATOM 1040 O ASP 236 -44.227 -8.124 -23.049 0.00 0.00 +0.000 OA +ATOM 1041 N ILE 237 -43.153 -7.458 -21.184 0.00 0.00 +0.000 N +ATOM 1042 H ILE 237 -42.562 -6.680 -20.813 0.00 0.00 +0.000 HD +ATOM 1043 CA ILE 237 -43.573 -8.593 -20.373 0.00 0.00 +0.000 C +ATOM 1044 HA ILE 237 -43.630 -9.385 -21.002 0.00 0.00 +0.000 HD +ATOM 1045 CB ILE 237 -42.572 -8.834 -19.239 0.00 0.00 +0.000 C +ATOM 1046 HB ILE 237 -42.634 -8.076 -18.604 0.00 0.00 +0.000 HD +ATOM 1047 CG2 ILE 237 -42.882 -10.158 -18.555 0.00 0.00 +0.000 C +ATOM 1048 HG21 ILE 237 -42.233 -10.309 -17.812 0.00 0.00 +0.000 HD +ATOM 1049 HG22 ILE 237 -43.810 -10.134 -18.186 0.00 0.00 +0.000 HD +ATOM 1050 HG23 ILE 237 -42.808 -10.901 -19.218 0.00 0.00 +0.000 HD +ATOM 1051 CG1 ILE 237 -41.151 -8.856 -19.811 0.00 0.00 +0.000 C +ATOM 1052 HG12 ILE 237 -41.034 -9.703 -20.330 0.00 0.00 +0.000 HD +ATOM 1053 HG13 ILE 237 -41.058 -8.085 -20.443 0.00 0.00 +0.000 HD +ATOM 1054 CD1 ILE 237 -40.061 -8.763 -18.768 0.00 0.00 +0.000 C +ATOM 1055 HD11 ILE 237 -40.136 -9.536 -18.139 0.00 0.00 +0.000 HD +ATOM 1056 HD12 ILE 237 -39.169 -8.784 -19.217 0.00 0.00 +0.000 HD +ATOM 1057 HD13 ILE 237 -40.160 -7.908 -18.260 0.00 0.00 +0.000 HD +ATOM 1058 C ILE 237 -44.960 -8.419 -19.768 0.00 0.00 +0.000 C +ATOM 1059 O ILE 237 -45.183 -7.546 -18.917 0.00 0.00 +0.000 OA +ATOM 1060 N LYS 238 -45.884 -9.273 -20.199 0.00 0.00 +0.000 N +ATOM 1061 H LYS 238 -45.540 -9.973 -20.889 0.00 0.00 +0.000 HD +ATOM 1062 CA LYS 238 -47.262 -9.218 -19.732 0.00 0.00 +0.000 C +ATOM 1063 HA LYS 238 -47.355 -8.439 -19.081 0.00 0.00 +0.000 HD +ATOM 1064 CB LYS 238 -48.179 -8.957 -20.924 0.00 0.00 +0.000 C +ATOM 1065 HB2 LYS 238 -48.145 -9.754 -21.526 0.00 0.00 +0.000 HD +ATOM 1066 HB3 LYS 238 -49.111 -8.837 -20.582 0.00 0.00 +0.000 HD +ATOM 1067 CG LYS 238 -47.810 -7.728 -21.741 0.00 0.00 +0.000 C +ATOM 1068 HG2 LYS 238 -48.003 -6.906 -21.206 0.00 0.00 +0.000 HD +ATOM 1069 HG3 LYS 238 -46.837 -7.760 -21.966 0.00 0.00 +0.000 HD +ATOM 1070 CD LYS 238 -48.610 -7.654 -23.052 0.00 0.00 +0.000 C +ATOM 1071 HD2 LYS 238 -49.480 -8.117 -22.922 0.00 0.00 +0.000 HD +ATOM 1072 HD3 LYS 238 -48.756 -6.699 -23.285 0.00 0.00 +0.000 HD +ATOM 1073 CE LYS 238 -47.874 -8.330 -24.227 0.00 0.00 +0.000 C +ATOM 1074 HE2 LYS 238 -48.518 -8.438 -24.988 0.00 0.00 +0.000 HD +ATOM 1075 HE3 LYS 238 -47.121 -7.735 -24.517 0.00 0.00 +0.000 HD +ATOM 1076 NZ LYS 238 -47.318 -9.681 -23.860 0.00 0.00 +0.000 N +ATOM 1077 HZ1 LYS 238 -47.680 -10.361 -24.492 0.00 0.00 +0.000 HD +ATOM 1078 HZ2 LYS 238 -46.324 -9.649 -23.925 0.00 0.00 +0.000 HD +ATOM 1079 HZ3 LYS 238 -47.593 -9.900 -22.927 0.00 0.00 +0.000 HD +ATOM 1080 C LYS 238 -47.726 -10.489 -19.030 0.00 0.00 +0.000 C +ATOM 1081 O LYS 238 -48.572 -10.441 -18.132 0.00 0.00 +0.000 OA +ATOM 1082 N ASN 239 -47.178 -11.625 -19.441 0.00 0.00 +0.000 N +ATOM 1083 H ASN 239 -46.461 -11.534 -20.173 0.00 0.00 +0.000 HD +ATOM 1084 CA ASN 239 -47.600 -12.889 -18.861 0.00 0.00 +0.000 C +ATOM 1085 HA ASN 239 -47.917 -12.691 -17.910 0.00 0.00 +0.000 HD +ATOM 1086 CB ASN 239 -48.744 -13.446 -19.706 0.00 0.00 +0.000 C +ATOM 1087 HB2 ASN 239 -48.927 -14.379 -19.418 0.00 0.00 +0.000 HD +ATOM 1088 HB3 ASN 239 -49.546 -12.875 -19.570 0.00 0.00 +0.000 HD +ATOM 1089 CG ASN 239 -48.407 -13.458 -21.193 0.00 0.00 +0.000 C +ATOM 1090 OD1 ASN 239 -47.492 -14.166 -21.637 0.00 0.00 +0.000 OA +ATOM 1091 ND2 ASN 239 -49.138 -12.669 -21.970 0.00 0.00 +0.000 N +ATOM 1092 HD21 ASN 239 -48.969 -12.636 -22.955 0.00 0.00 +0.000 HD +ATOM 1093 HD22 ASN 239 -49.861 -12.103 -21.569 0.00 0.00 +0.000 HD +ATOM 1094 C ASN 239 -46.506 -13.939 -18.750 0.00 0.00 +0.000 C +ATOM 1095 O ASN 239 -45.313 -13.666 -18.947 0.00 0.00 +0.000 OA +ATOM 1096 N GLU 240 -46.952 -15.156 -18.459 0.00 0.00 +0.000 N +ATOM 1097 H GLU 240 -48.000 -15.208 -18.353 0.00 0.00 +0.000 HD +ATOM 1098 CA GLU 240 -46.091 -16.315 -18.299 0.00 0.00 +0.000 C +ATOM 1099 HA GLU 240 -45.426 -16.146 -17.552 0.00 0.00 +0.000 HD +ATOM 1100 CB GLU 240 -46.957 -17.490 -17.848 0.00 0.00 +0.000 C +ATOM 1101 HB2 GLU 240 -47.330 -17.258 -16.955 0.00 0.00 +0.000 HD +ATOM 1102 HB3 GLU 240 -47.690 -17.591 -18.512 0.00 0.00 +0.000 HD +ATOM 1103 CG GLU 240 -46.262 -18.822 -17.724 0.00 0.00 +0.000 C +ATOM 1104 HG2 GLU 240 -46.068 -19.159 -18.621 0.00 0.00 +0.000 HD +ATOM 1105 HG3 GLU 240 -45.463 -18.710 -17.173 0.00 0.00 +0.000 HD +ATOM 1106 CD GLU 240 -47.151 -19.838 -17.037 0.00 0.00 +0.000 C +ATOM 1107 OE1 GLU 240 -48.271 -20.067 -17.540 0.00 0.00 +0.000 OA +ATOM 1108 OE2 GLU 240 -46.731 -20.397 -15.997 0.00 0.00 +0.000 OA +ATOM 1109 C GLU 240 -45.330 -16.660 -19.577 0.00 0.00 +0.000 C +ATOM 1110 O GLU 240 -44.142 -16.980 -19.526 0.00 0.00 +0.000 OA +ATOM 1111 N ASP 241 -46.003 -16.593 -20.721 0.00 0.00 +0.000 N +ATOM 1112 H ASP 241 -46.986 -16.316 -20.645 0.00 0.00 +0.000 HD +ATOM 1113 CA ASP 241 -45.327 -16.906 -21.970 0.00 0.00 +0.000 C +ATOM 1114 HA ASP 241 -44.904 -17.812 -21.866 0.00 0.00 +0.000 HD +ATOM 1115 CB ASP 241 -46.316 -16.953 -23.145 0.00 0.00 +0.000 C +ATOM 1116 HB2 ASP 241 -46.894 -16.152 -23.094 0.00 0.00 +0.000 HD +ATOM 1117 HB3 ASP 241 -45.796 -16.967 -23.985 0.00 0.00 +0.000 HD +ATOM 1118 CG ASP 241 -47.208 -18.199 -23.103 0.00 0.00 +0.000 C +ATOM 1119 OD1 ASP 241 -46.773 -19.234 -22.538 0.00 0.00 +0.000 OA +ATOM 1120 OD2 ASP 241 -48.335 -18.158 -23.643 0.00 0.00 +0.000 OA +ATOM 1121 C ASP 241 -44.188 -15.913 -22.229 0.00 0.00 +0.000 C +ATOM 1122 O ASP 241 -43.108 -16.313 -22.680 0.00 0.00 +0.000 OA +ATOM 1123 N ASP 242 -44.404 -14.628 -21.944 0.00 0.00 +0.000 N +ATOM 1124 H ASP 242 -45.338 -14.393 -21.607 0.00 0.00 +0.000 HD +ATOM 1125 CA ASP 242 -43.319 -13.655 -22.126 0.00 0.00 +0.000 C +ATOM 1126 HA ASP 242 -42.953 -13.790 -23.048 0.00 0.00 +0.000 HD +ATOM 1127 CB ASP 242 -43.792 -12.217 -21.884 0.00 0.00 +0.000 C +ATOM 1128 HB2 ASP 242 -44.008 -12.126 -20.917 0.00 0.00 +0.000 HD +ATOM 1129 HB3 ASP 242 -43.047 -11.606 -22.130 0.00 0.00 +0.000 HD +ATOM 1130 CG ASP 242 -45.015 -11.852 -22.695 0.00 0.00 +0.000 C +ATOM 1131 OD1 ASP 242 -45.044 -12.127 -23.907 0.00 0.00 +0.000 OA +ATOM 1132 OD2 ASP 242 -45.950 -11.279 -22.106 0.00 0.00 +0.000 OA +ATOM 1133 C ASP 242 -42.181 -13.949 -21.144 0.00 0.00 +0.000 C +ATOM 1134 O ASP 242 -41.015 -13.758 -21.470 0.00 0.00 +0.000 OA +ATOM 1135 N VAL 243 -42.505 -14.396 -19.934 0.00 0.00 +0.000 N +ATOM 1136 H VAL 243 -43.506 -14.513 -19.754 0.00 0.00 +0.000 HD +ATOM 1137 CA VAL 243 -41.453 -14.684 -18.965 0.00 0.00 +0.000 C +ATOM 1138 HA VAL 243 -40.864 -13.877 -18.892 0.00 0.00 +0.000 HD +ATOM 1139 CB VAL 243 -42.030 -15.023 -17.558 0.00 0.00 +0.000 C +ATOM 1140 HB VAL 243 -42.661 -15.780 -17.672 0.00 0.00 +0.000 HD +ATOM 1141 CG1 VAL 243 -40.915 -15.500 -16.632 0.00 0.00 +0.000 C +ATOM 1142 HG11 VAL 243 -40.495 -16.322 -17.014 0.00 0.00 +0.000 HD +ATOM 1143 HG12 VAL 243 -40.225 -14.782 -16.546 0.00 0.00 +0.000 HD +ATOM 1144 HG13 VAL 243 -41.297 -15.707 -15.732 0.00 0.00 +0.000 HD +ATOM 1145 CG2 VAL 243 -42.699 -13.795 -16.959 0.00 0.00 +0.000 C +ATOM 1146 HG21 VAL 243 -43.686 -13.851 -17.107 0.00 0.00 +0.000 HD +ATOM 1147 HG22 VAL 243 -42.507 -13.760 -15.978 0.00 0.00 +0.000 HD +ATOM 1148 HG23 VAL 243 -42.339 -12.974 -17.402 0.00 0.00 +0.000 HD +ATOM 1149 C VAL 243 -40.604 -15.844 -19.465 0.00 0.00 +0.000 C +ATOM 1150 O VAL 243 -39.394 -15.845 -19.300 0.00 0.00 +0.000 OA +ATOM 1151 N LYS 244 -41.241 -16.828 -20.091 0.00 0.00 +0.000 N +ATOM 1152 H LYS 244 -42.262 -16.706 -20.180 0.00 0.00 +0.000 HD +ATOM 1153 CA LYS 244 -40.512 -17.979 -20.600 0.00 0.00 +0.000 C +ATOM 1154 HA LYS 244 -39.925 -18.344 -19.871 0.00 0.00 +0.000 HD +ATOM 1155 CB LYS 244 -41.491 -19.072 -21.035 0.00 0.00 +0.000 C +ATOM 1156 HB2 LYS 244 -42.115 -18.680 -21.705 0.00 0.00 +0.000 HD +ATOM 1157 HB3 LYS 244 -40.966 -19.811 -21.449 0.00 0.00 +0.000 HD +ATOM 1158 CG LYS 244 -42.307 -19.641 -19.892 0.00 0.00 +0.000 C +ATOM 1159 HG2 LYS 244 -41.711 -19.784 -19.101 0.00 0.00 +0.000 HD +ATOM 1160 HG3 LYS 244 -43.032 -18.997 -19.652 0.00 0.00 +0.000 HD +ATOM 1161 CD LYS 244 -42.940 -20.971 -20.274 0.00 0.00 +0.000 C +ATOM 1162 HD2 LYS 244 -43.713 -20.800 -20.869 0.00 0.00 +0.000 HD +ATOM 1163 HD3 LYS 244 -42.261 -21.534 -20.723 0.00 0.00 +0.000 HD +ATOM 1164 CE LYS 244 -43.432 -21.698 -19.032 0.00 0.00 +0.000 C +ATOM 1165 HE2 LYS 244 -42.715 -21.672 -18.334 0.00 0.00 +0.000 HD +ATOM 1166 HE3 LYS 244 -44.248 -21.234 -18.684 0.00 0.00 +0.000 HD +ATOM 1167 NZ LYS 244 -43.770 -23.120 -19.332 0.00 0.00 +0.000 N +ATOM 1168 HZ1 LYS 244 -44.005 -23.589 -18.482 0.00 0.00 +0.000 HD +ATOM 1169 HZ2 LYS 244 -44.548 -23.149 -19.958 0.00 0.00 +0.000 HD +ATOM 1170 HZ3 LYS 244 -42.981 -23.564 -19.755 0.00 0.00 +0.000 HD +ATOM 1171 C LYS 244 -39.634 -17.566 -21.772 0.00 0.00 +0.000 C +ATOM 1172 O LYS 244 -38.559 -18.126 -21.990 0.00 0.00 +0.000 OA +ATOM 1173 N SER 245 -40.084 -16.571 -22.522 0.00 0.00 +0.000 N +ATOM 1174 H SER 245 -40.986 -16.165 -22.226 0.00 0.00 +0.000 HD +ATOM 1175 CA SER 245 -39.327 -16.110 -23.679 0.00 0.00 +0.000 C +ATOM 1176 HA SER 245 -39.098 -16.917 -24.247 0.00 0.00 +0.000 HD +ATOM 1177 CB SER 245 -40.176 -15.146 -24.509 0.00 0.00 +0.000 C +ATOM 1178 HB2 SER 245 -39.747 -15.025 -25.399 0.00 0.00 +0.000 HD +ATOM 1179 HB3 SER 245 -41.087 -15.533 -24.617 0.00 0.00 +0.000 HD +ATOM 1180 OG SER 245 -40.283 -13.886 -23.872 0.00 0.00 +0.000 OA +ATOM 1181 HG SER 245 -40.573 -14.015 -22.924 0.00 0.00 +0.000 HD +ATOM 1182 C SER 245 -38.014 -15.430 -23.290 0.00 0.00 +0.000 C +ATOM 1183 O SER 245 -37.148 -15.217 -24.137 0.00 0.00 +0.000 OA +ATOM 1184 N LEU 246 -37.859 -15.104 -22.010 0.00 0.00 +0.000 N +ATOM 1185 H LEU 246 -38.642 -15.366 -21.390 0.00 0.00 +0.000 HD +ATOM 1186 CA LEU 246 -36.651 -14.423 -21.551 0.00 0.00 +0.000 C +ATOM 1187 HA LEU 246 -36.510 -13.595 -22.137 0.00 0.00 +0.000 HD +ATOM 1188 CB LEU 246 -36.860 -13.871 -20.137 0.00 0.00 +0.000 C +ATOM 1189 HB2 LEU 246 -37.135 -14.618 -19.557 0.00 0.00 +0.000 HD +ATOM 1190 HB3 LEU 246 -36.015 -13.464 -19.841 0.00 0.00 +0.000 HD +ATOM 1191 CG LEU 246 -37.946 -12.798 -20.057 0.00 0.00 +0.000 C +ATOM 1192 HG LEU 246 -38.782 -13.150 -20.467 0.00 0.00 +0.000 HD +ATOM 1193 CD1 LEU 246 -38.209 -12.441 -18.599 0.00 0.00 +0.000 C +ATOM 1194 HD11 LEU 246 -37.368 -12.093 -18.184 0.00 0.00 +0.000 HD +ATOM 1195 HD12 LEU 246 -38.920 -11.739 -18.551 0.00 0.00 +0.000 HD +ATOM 1196 HD13 LEU 246 -38.512 -13.256 -18.106 0.00 0.00 +0.000 HD +ATOM 1197 CD2 LEU 246 -37.526 -11.581 -20.857 0.00 0.00 +0.000 C +ATOM 1198 HD21 LEU 246 -37.387 -11.838 -21.815 0.00 0.00 +0.000 HD +ATOM 1199 HD22 LEU 246 -38.239 -10.879 -20.803 0.00 0.00 +0.000 HD +ATOM 1200 HD23 LEU 246 -36.671 -11.212 -20.487 0.00 0.00 +0.000 HD +ATOM 1201 C LEU 246 -35.376 -15.259 -21.598 0.00 0.00 +0.000 C +ATOM 1202 O LEU 246 -34.285 -14.711 -21.756 0.00 0.00 +0.000 OA +ATOM 1203 N SER 247 -35.501 -16.575 -21.463 0.00 0.00 +0.000 N +ATOM 1204 H SER 247 -36.463 -16.918 -21.330 0.00 0.00 +0.000 HD +ATOM 1205 CA SER 247 -34.326 -17.438 -21.507 0.00 0.00 +0.000 C +ATOM 1206 HA SER 247 -33.723 -17.189 -20.738 0.00 0.00 +0.000 HD +ATOM 1207 CB SER 247 -34.731 -18.912 -21.372 0.00 0.00 +0.000 C +ATOM 1208 HB2 SER 247 -35.345 -19.144 -22.121 0.00 0.00 +0.000 HD +ATOM 1209 HB3 SER 247 -33.909 -19.473 -21.418 0.00 0.00 +0.000 HD +ATOM 1210 OG SER 247 -35.389 -19.155 -20.141 0.00 0.00 +0.000 OA +ATOM 1211 HG SER 247 -35.365 -18.328 -19.581 0.00 0.00 +0.000 HD +ATOM 1212 C SER 247 -33.530 -17.243 -22.802 0.00 0.00 +0.000 C +ATOM 1213 O SER 247 -32.311 -17.108 -22.768 0.00 0.00 +0.000 OA +ATOM 1214 N ARG 248 -34.227 -17.231 -23.938 0.00 0.00 +0.000 N +ATOM 1215 H ARG 248 -35.254 -17.356 -23.817 0.00 0.00 +0.000 HD +ATOM 1216 CA ARG 248 -33.593 -17.055 -25.249 0.00 0.00 +0.000 C +ATOM 1217 HA ARG 248 -32.956 -17.818 -25.404 0.00 0.00 +0.000 HD +ATOM 1218 CB ARG 248 -34.660 -17.078 -26.367 0.00 0.00 +0.000 C +ATOM 1219 HB2 ARG 248 -35.156 -17.940 -26.306 0.00 0.00 +0.000 HD +ATOM 1220 HB3 ARG 248 -35.284 -16.315 -26.218 0.00 0.00 +0.000 HD +ATOM 1221 CG ARG 248 -34.111 -16.956 -27.809 0.00 0.00 +0.000 C +ATOM 1222 HG2 ARG 248 -33.851 -16.014 -27.980 0.00 0.00 +0.000 HD +ATOM 1223 HG3 ARG 248 -33.332 -17.561 -27.913 0.00 0.00 +0.000 HD +ATOM 1224 CD ARG 248 -35.170 -17.358 -28.856 0.00 0.00 +0.000 C +ATOM 1225 HD2 ARG 248 -35.648 -18.160 -28.508 0.00 0.00 +0.000 HD +ATOM 1226 HD3 ARG 248 -35.805 -16.595 -28.949 0.00 0.00 +0.000 HD +ATOM 1227 NE ARG 248 -34.584 -17.668 -30.165 0.00 0.00 +0.000 N +ATOM 1228 HE ARG 248 -34.342 -18.638 -30.345 0.00 0.00 +0.000 HD +ATOM 1229 CZ ARG 248 -34.344 -16.789 -31.132 0.00 0.00 +0.000 C +ATOM 1230 NH1 ARG 248 -34.645 -15.504 -30.966 0.00 0.00 +0.000 N +ATOM 1231 HH11 ARG 248 -35.035 -15.178 -30.109 0.00 0.00 +0.000 HD +ATOM 1232 HH12 ARG 248 -34.475 -14.854 -31.714 0.00 0.00 +0.000 HD +ATOM 1233 NH2 ARG 248 -33.783 -17.199 -32.267 0.00 0.00 +0.000 N +ATOM 1234 HH21 ARG 248 -33.528 -18.161 -32.377 0.00 0.00 +0.000 HD +ATOM 1235 HH22 ARG 248 -33.616 -16.549 -33.006 0.00 0.00 +0.000 HD +ATOM 1236 C ARG 248 -32.810 -15.746 -25.304 0.00 0.00 +0.000 C +ATOM 1237 O ARG 248 -31.688 -15.699 -25.813 0.00 0.00 +0.000 OA +ATOM 1238 N VAL 249 -33.405 -14.683 -24.773 0.00 0.00 +0.000 N +ATOM 1239 H VAL 249 -34.342 -14.858 -24.373 0.00 0.00 +0.000 HD +ATOM 1240 CA VAL 249 -32.753 -13.381 -24.773 0.00 0.00 +0.000 C +ATOM 1241 HA VAL 249 -32.458 -13.175 -25.719 0.00 0.00 +0.000 HD +ATOM 1242 CB VAL 249 -33.716 -12.262 -24.314 0.00 0.00 +0.000 C +ATOM 1243 HB VAL 249 -33.921 -12.417 -23.357 0.00 0.00 +0.000 HD +ATOM 1244 CG1 VAL 249 -33.018 -10.911 -24.410 0.00 0.00 +0.000 C +ATOM 1245 HG11 VAL 249 -32.036 -11.033 -24.272 0.00 0.00 +0.000 HD +ATOM 1246 HG12 VAL 249 -33.181 -10.515 -25.313 0.00 0.00 +0.000 HD +ATOM 1247 HG13 VAL 249 -33.380 -10.298 -23.708 0.00 0.00 +0.000 HD +ATOM 1248 CG2 VAL 249 -34.972 -12.268 -25.166 0.00 0.00 +0.000 C +ATOM 1249 HG21 VAL 249 -34.718 -12.223 -26.133 0.00 0.00 +0.000 HD +ATOM 1250 HG22 VAL 249 -35.486 -13.109 -24.994 0.00 0.00 +0.000 HD +ATOM 1251 HG23 VAL 249 -35.537 -11.476 -24.931 0.00 0.00 +0.000 HD +ATOM 1252 C VAL 249 -31.510 -13.350 -23.882 0.00 0.00 +0.000 C +ATOM 1253 O VAL 249 -30.495 -12.756 -24.245 0.00 0.00 +0.000 OA +ATOM 1254 N MET 250 -31.575 -13.993 -22.717 0.00 0.00 +0.000 N +ATOM 1255 H MET 250 -32.471 -14.450 -22.509 0.00 0.00 +0.000 HD +ATOM 1256 CA MET 250 -30.413 -14.021 -21.817 0.00 0.00 +0.000 C +ATOM 1257 HA MET 250 -30.108 -13.073 -21.675 0.00 0.00 +0.000 HD +ATOM 1258 CB MET 250 -30.767 -14.652 -20.462 0.00 0.00 +0.000 C +ATOM 1259 HB2 MET 250 -31.159 -15.570 -20.623 0.00 0.00 +0.000 HD +ATOM 1260 HB3 MET 250 -29.917 -14.770 -19.927 0.00 0.00 +0.000 HD +ATOM 1261 CG MET 250 -31.756 -13.851 -19.619 0.00 0.00 +0.000 C +ATOM 1262 HG2 MET 250 -31.425 -12.878 -19.564 0.00 0.00 +0.000 HD +ATOM 1263 HG3 MET 250 -32.651 -13.799 -20.124 0.00 0.00 +0.000 HD +ATOM 1264 SD MET 250 -32.022 -14.522 -17.935 0.00 0.00 +0.000 S +ATOM 1265 CE MET 250 -33.303 -15.728 -18.230 0.00 0.00 +0.000 C +ATOM 1266 HE1 MET 250 -33.057 -16.597 -17.796 0.00 0.00 +0.000 HD +ATOM 1267 HE2 MET 250 -34.170 -15.403 -17.847 0.00 0.00 +0.000 HD +ATOM 1268 HE3 MET 250 -33.413 -15.872 -19.216 0.00 0.00 +0.000 HD +ATOM 1269 C MET 250 -29.254 -14.805 -22.431 0.00 0.00 +0.000 C +ATOM 1270 O MET 250 -28.099 -14.462 -22.220 0.00 0.00 +0.000 OA +ATOM 1271 N ILE 251 -29.562 -15.866 -23.169 0.00 0.00 +0.000 N +ATOM 1272 H ILE 251 -30.571 -16.073 -23.244 0.00 0.00 +0.000 HD +ATOM 1273 CA ILE 251 -28.520 -16.659 -23.813 0.00 0.00 +0.000 C +ATOM 1274 HA ILE 251 -27.814 -16.802 -23.131 0.00 0.00 +0.000 HD +ATOM 1275 CB ILE 251 -29.122 -17.962 -24.439 0.00 0.00 +0.000 C +ATOM 1276 HB ILE 251 -29.942 -17.701 -24.933 0.00 0.00 +0.000 HD +ATOM 1277 CG2 ILE 251 -28.130 -18.591 -25.407 0.00 0.00 +0.000 C +ATOM 1278 HG21 ILE 251 -28.544 -19.393 -25.834 0.00 0.00 +0.000 HD +ATOM 1279 HG22 ILE 251 -27.886 -17.928 -26.113 0.00 0.00 +0.000 HD +ATOM 1280 HG23 ILE 251 -27.308 -18.865 -24.911 0.00 0.00 +0.000 HD +ATOM 1281 CG1 ILE 251 -29.514 -18.960 -23.343 0.00 0.00 +0.000 C +ATOM 1282 HG12 ILE 251 -30.052 -18.475 -22.652 0.00 0.00 +0.000 HD +ATOM 1283 HG13 ILE 251 -30.096 -19.664 -23.755 0.00 0.00 +0.000 HD +ATOM 1284 CD1 ILE 251 -28.341 -19.644 -22.658 0.00 0.00 +0.000 C +ATOM 1285 HD11 ILE 251 -27.763 -18.952 -22.230 0.00 0.00 +0.000 HD +ATOM 1286 HD12 ILE 251 -28.688 -20.272 -21.964 0.00 0.00 +0.000 HD +ATOM 1287 HD13 ILE 251 -27.814 -20.150 -23.338 0.00 0.00 +0.000 HD +ATOM 1288 C ILE 251 -27.899 -15.796 -24.909 0.00 0.00 +0.000 C +ATOM 1289 O ILE 251 -26.686 -15.713 -25.061 0.00 0.00 +0.000 OA +ATOM 1290 N HIE 252 -28.766 -15.125 -25.655 0.00 0.00 +0.000 N +ATOM 1291 H HIE 252 -29.766 -15.260 -25.388 0.00 0.00 +0.000 HD +ATOM 1292 CA HIE 252 -28.349 -14.265 -26.763 0.00 0.00 +0.000 C +ATOM 1293 HA HIE 252 -27.828 -14.831 -27.425 0.00 0.00 +0.000 HD +ATOM 1294 CB HIE 252 -29.595 -13.708 -27.470 0.00 0.00 +0.000 C +ATOM 1295 HB2 HIE 252 -30.203 -14.475 -27.706 0.00 0.00 +0.000 HD +ATOM 1296 HB3 HIE 252 -30.083 -13.101 -26.832 0.00 0.00 +0.000 HD +ATOM 1297 CG HIE 252 -29.293 -12.942 -28.716 0.00 0.00 +0.000 A +ATOM 1298 ND1 HIE 252 -28.674 -11.718 -28.707 0.00 0.00 +0.000 NA +ATOM 1299 CE1 HIE 252 -28.569 -11.272 -29.952 0.00 0.00 +0.000 A +ATOM 1300 HE1 HIE 252 -28.162 -10.408 -30.226 0.00 0.00 +0.000 HD +ATOM 1301 NE2 HIE 252 -29.099 -12.171 -30.756 0.00 0.00 +0.000 N +ATOM 1302 HE2 HIE 252 -29.160 -12.100 -31.762 0.00 0.00 +0.000 HD +ATOM 1303 CD2 HIE 252 -29.559 -13.231 -30.011 0.00 0.00 +0.000 A +ATOM 1304 HD2 HIE 252 -30.002 -14.049 -30.359 0.00 0.00 +0.000 HD +ATOM 1305 C HIE 252 -27.455 -13.107 -26.323 0.00 0.00 +0.000 C +ATOM 1306 O HIE 252 -26.403 -12.851 -26.914 0.00 0.00 +0.000 OA +ATOM 1307 N VAL 253 -27.868 -12.431 -25.260 0.00 0.00 +0.000 N +ATOM 1308 H VAL 253 -28.738 -12.802 -24.820 0.00 0.00 +0.000 HD +ATOM 1309 CA VAL 253 -27.155 -11.263 -24.755 0.00 0.00 +0.000 C +ATOM 1310 HA VAL 253 -26.718 -10.791 -25.553 0.00 0.00 +0.000 HD +ATOM 1311 CB VAL 253 -28.172 -10.255 -24.143 0.00 0.00 +0.000 C +ATOM 1312 HB VAL 253 -28.626 -10.716 -23.390 0.00 0.00 +0.000 HD +ATOM 1313 CG1 VAL 253 -27.444 -9.054 -23.567 0.00 0.00 +0.000 C +ATOM 1314 HG11 VAL 253 -26.951 -8.579 -24.296 0.00 0.00 +0.000 HD +ATOM 1315 HG12 VAL 253 -28.105 -8.428 -23.152 0.00 0.00 +0.000 HD +ATOM 1316 HG13 VAL 253 -26.793 -9.358 -22.870 0.00 0.00 +0.000 HD +ATOM 1317 CG2 VAL 253 -29.170 -9.822 -25.214 0.00 0.00 +0.000 C +ATOM 1318 HG21 VAL 253 -29.979 -10.407 -25.164 0.00 0.00 +0.000 HD +ATOM 1319 HG22 VAL 253 -29.430 -8.871 -25.054 0.00 0.00 +0.000 HD +ATOM 1320 HG23 VAL 253 -28.744 -9.910 -26.113 0.00 0.00 +0.000 HD +ATOM 1321 C VAL 253 -26.048 -11.549 -23.730 0.00 0.00 +0.000 C +ATOM 1322 O VAL 253 -24.956 -10.985 -23.811 0.00 0.00 +0.000 OA +ATOM 1323 N PHE 254 -26.328 -12.408 -22.759 0.00 0.00 +0.000 N +ATOM 1324 H PHE 254 -27.266 -12.822 -22.785 0.00 0.00 +0.000 HD +ATOM 1325 CA PHE 254 -25.325 -12.707 -21.744 0.00 0.00 +0.000 C +ATOM 1326 HA PHE 254 -24.774 -11.854 -21.612 0.00 0.00 +0.000 HD +ATOM 1327 CB PHE 254 -25.989 -13.057 -20.407 0.00 0.00 +0.000 C +ATOM 1328 HB2 PHE 254 -26.372 -12.229 -20.033 0.00 0.00 +0.000 HD +ATOM 1329 HB3 PHE 254 -26.683 -13.735 -20.582 0.00 0.00 +0.000 HD +ATOM 1330 CG PHE 254 -25.029 -13.626 -19.389 0.00 0.00 +0.000 A +ATOM 1331 CD1 PHE 254 -24.147 -12.797 -18.690 0.00 0.00 +0.000 A +ATOM 1332 HD1 PHE 254 -24.181 -11.814 -18.825 0.00 0.00 +0.000 HD +ATOM 1333 CE1 PHE 254 -23.221 -13.337 -17.803 0.00 0.00 +0.000 A +ATOM 1334 HE1 PHE 254 -22.601 -12.726 -17.299 0.00 0.00 +0.000 HD +ATOM 1335 CZ PHE 254 -23.155 -14.716 -17.618 0.00 0.00 +0.000 A +ATOM 1336 HZ PHE 254 -22.481 -15.100 -16.991 0.00 0.00 +0.000 HD +ATOM 1337 CE2 PHE 254 -24.029 -15.548 -18.308 0.00 0.00 +0.000 A +ATOM 1338 HE2 PHE 254 -23.994 -16.551 -18.171 0.00 0.00 +0.000 HD +ATOM 1339 CD2 PHE 254 -24.952 -15.006 -19.189 0.00 0.00 +0.000 A +ATOM 1340 HD2 PHE 254 -25.574 -15.609 -19.690 0.00 0.00 +0.000 HD +ATOM 1341 C PHE 254 -24.328 -13.814 -22.100 0.00 0.00 +0.000 C +ATOM 1342 O PHE 254 -23.119 -13.620 -22.006 0.00 0.00 +0.000 OA +ATOM 1343 N SER 255 -24.824 -14.984 -22.489 0.00 0.00 +0.000 N +ATOM 1344 H SER 255 -25.846 -15.043 -22.539 0.00 0.00 +0.000 HD +ATOM 1345 CA SER 255 -23.919 -16.088 -22.814 0.00 0.00 +0.000 C +ATOM 1346 HA SER 255 -23.308 -16.236 -22.009 0.00 0.00 +0.000 HD +ATOM 1347 CB SER 255 -24.706 -17.379 -23.015 0.00 0.00 +0.000 C +ATOM 1348 HB2 SER 255 -25.312 -17.270 -23.792 0.00 0.00 +0.000 HD +ATOM 1349 HB3 SER 255 -24.070 -18.125 -23.165 0.00 0.00 +0.000 HD +ATOM 1350 OG SER 255 -25.481 -17.658 -21.860 0.00 0.00 +0.000 OA +ATOM 1351 HG SER 255 -26.173 -16.947 -21.744 0.00 0.00 +0.000 HD +ATOM 1352 C SER 255 -23.028 -15.853 -24.033 0.00 0.00 +0.000 C +ATOM 1353 O SER 255 -21.872 -16.284 -24.046 0.00 0.00 +0.000 OA +ATOM 1354 N ASP 256 -23.562 -15.187 -25.054 0.00 0.00 +0.000 N +ATOM 1355 H ASP 256 -24.538 -14.876 -24.914 0.00 0.00 +0.000 HD +ATOM 1356 CA ASP 256 -22.796 -14.929 -26.274 0.00 0.00 +0.000 C +ATOM 1357 HA ASP 256 -22.166 -15.700 -26.396 0.00 0.00 +0.000 HD +ATOM 1358 CB ASP 256 -23.747 -14.753 -27.466 0.00 0.00 +0.000 C +ATOM 1359 HB2 ASP 256 -24.491 -15.403 -27.360 0.00 0.00 +0.000 HD +ATOM 1360 HB3 ASP 256 -24.092 -13.822 -27.446 0.00 0.00 +0.000 HD +ATOM 1361 CG ASP 256 -23.067 -14.997 -28.796 0.00 0.00 +0.000 C +ATOM 1362 OD1 ASP 256 -21.899 -15.441 -28.789 0.00 0.00 +0.000 OA +ATOM 1363 OD2 ASP 256 -23.705 -14.759 -29.840 0.00 0.00 +0.000 OA +ATOM 1364 C ASP 256 -21.950 -13.679 -26.100 0.00 0.00 +0.000 C +ATOM 1365 O ASP 256 -22.237 -12.639 -26.691 0.00 0.00 +0.000 OA +ATOM 1366 N GLY 257 -20.903 -13.787 -25.291 0.00 0.00 +0.000 N +ATOM 1367 H GLY 257 -20.767 -14.718 -24.867 0.00 0.00 +0.000 HD +ATOM 1368 CA GLY 257 -20.035 -12.647 -25.048 0.00 0.00 +0.000 C +ATOM 1369 HA2 GLY 257 -19.568 -12.390 -25.896 0.00 0.00 +0.000 HD +ATOM 1370 HA3 GLY 257 -20.579 -11.870 -24.726 0.00 0.00 +0.000 HD +ATOM 1371 C GLY 257 -18.999 -13.009 -23.992 0.00 0.00 +0.000 C +ATOM 1372 O GLY 257 -19.096 -14.059 -23.348 0.00 0.00 +0.000 OA +ATOM 1373 N VAL 258 -18.008 -12.147 -23.794 0.00 0.00 +0.000 N +ATOM 1374 H VAL 258 -18.029 -11.305 -24.384 0.00 0.00 +0.000 HD +ATOM 1375 CA VAL 258 -16.993 -12.427 -22.800 0.00 0.00 +0.000 C +ATOM 1376 HA VAL 258 -16.642 -13.351 -22.958 0.00 0.00 +0.000 HD +ATOM 1377 CB VAL 258 -15.803 -11.420 -22.883 0.00 0.00 +0.000 C +ATOM 1378 HB VAL 258 -16.082 -10.596 -22.417 0.00 0.00 +0.000 HD +ATOM 1379 CG1 VAL 258 -14.611 -11.992 -22.117 0.00 0.00 +0.000 C +ATOM 1380 HG11 VAL 258 -14.588 -12.984 -22.234 0.00 0.00 +0.000 HD +ATOM 1381 HG12 VAL 258 -13.767 -11.593 -22.472 0.00 0.00 +0.000 HD +ATOM 1382 HG13 VAL 258 -14.704 -11.771 -21.147 0.00 0.00 +0.000 HD +ATOM 1383 CG2 VAL 258 -15.418 -11.159 -24.334 0.00 0.00 +0.000 C +ATOM 1384 HG21 VAL 258 -14.941 -11.959 -24.697 0.00 0.00 +0.000 HD +ATOM 1385 HG22 VAL 258 -16.245 -10.989 -24.869 0.00 0.00 +0.000 HD +ATOM 1386 HG23 VAL 258 -14.819 -10.360 -24.377 0.00 0.00 +0.000 HD +ATOM 1387 C VAL 258 -17.632 -12.393 -21.429 0.00 0.00 +0.000 C +ATOM 1388 O VAL 258 -18.617 -11.691 -21.193 0.00 0.00 +0.000 OA +ATOM 1389 N THR 259 -17.055 -13.166 -20.524 0.00 0.00 +0.000 N +ATOM 1390 H THR 259 -16.219 -13.685 -20.861 0.00 0.00 +0.000 HD +ATOM 1391 CA THR 259 -17.570 -13.262 -19.175 0.00 0.00 +0.000 C +ATOM 1392 HA THR 259 -18.481 -12.817 -19.143 0.00 0.00 +0.000 HD +ATOM 1393 CB THR 259 -17.698 -14.742 -18.757 0.00 0.00 +0.000 C +ATOM 1394 HB THR 259 -16.764 -15.138 -18.663 0.00 0.00 +0.000 HD +ATOM 1395 CG2 THR 259 -18.450 -14.851 -17.455 0.00 0.00 +0.000 C +ATOM 1396 HG21 THR 259 -19.421 -14.635 -17.596 0.00 0.00 +0.000 HD +ATOM 1397 HG22 THR 259 -18.377 -15.784 -17.089 0.00 0.00 +0.000 HD +ATOM 1398 HG23 THR 259 -18.072 -14.209 -16.781 0.00 0.00 +0.000 HD +ATOM 1399 OG1 THR 259 -18.391 -15.469 -19.785 0.00 0.00 +0.000 OA +ATOM 1400 HG1 THR 259 -18.425 -14.928 -20.631 0.00 0.00 +0.000 HD +ATOM 1401 C THR 259 -16.670 -12.569 -18.162 0.00 0.00 +0.000 C +ATOM 1402 O THR 259 -15.458 -12.745 -18.180 0.00 0.00 +0.000 OA +ATOM 1403 N ASN 260 -17.278 -11.789 -17.279 0.00 0.00 +0.000 N +ATOM 1404 H ASN 260 -18.307 -11.683 -17.432 0.00 0.00 +0.000 HD +ATOM 1405 CA ASN 260 -16.568 -11.135 -16.186 0.00 0.00 +0.000 C +ATOM 1406 HA ASN 260 -15.902 -11.776 -15.842 0.00 0.00 +0.000 HD +ATOM 1407 CB ASN 260 -15.905 -9.805 -16.602 0.00 0.00 +0.000 C +ATOM 1408 HB2 ASN 260 -15.574 -9.352 -15.775 0.00 0.00 +0.000 HD +ATOM 1409 HB3 ASN 260 -15.133 -10.018 -17.200 0.00 0.00 +0.000 HD +ATOM 1410 CG ASN 260 -16.841 -8.858 -17.334 0.00 0.00 +0.000 C +ATOM 1411 OD1 ASN 260 -17.905 -8.490 -16.837 0.00 0.00 +0.000 OA +ATOM 1412 ND2 ASN 260 -16.428 -8.445 -18.529 0.00 0.00 +0.000 N +ATOM 1413 HD21 ASN 260 -16.996 -7.815 -19.063 0.00 0.00 +0.000 HD +ATOM 1414 HD22 ASN 260 -15.555 -8.760 -18.898 0.00 0.00 +0.000 HD +ATOM 1415 C ASN 260 -17.607 -10.938 -15.098 0.00 0.00 +0.000 C +ATOM 1416 O ASN 260 -18.800 -11.075 -15.362 0.00 0.00 +0.000 OA +ATOM 1417 N TRP 261 -17.170 -10.647 -13.877 0.00 0.00 +0.000 N +ATOM 1418 H TRP 261 -16.152 -10.550 -13.781 0.00 0.00 +0.000 HD +ATOM 1419 CA TRP 261 -18.117 -10.488 -12.788 0.00 0.00 +0.000 C +ATOM 1420 HA TRP 261 -18.642 -11.351 -12.705 0.00 0.00 +0.000 HD +ATOM 1421 CB TRP 261 -17.375 -10.282 -11.458 0.00 0.00 +0.000 C +ATOM 1422 HB2 TRP 261 -16.612 -9.673 -11.604 0.00 0.00 +0.000 HD +ATOM 1423 HB3 TRP 261 -18.005 -9.923 -10.788 0.00 0.00 +0.000 HD +ATOM 1424 CG TRP 261 -16.810 -11.573 -10.890 0.00 0.00 +0.000 A +ATOM 1425 CD1 TRP 261 -15.501 -11.850 -10.618 0.00 0.00 +0.000 A +ATOM 1426 HD1 TRP 261 -14.739 -11.221 -10.750 0.00 0.00 +0.000 HD +ATOM 1427 NE1 TRP 261 -15.379 -13.137 -10.129 0.00 0.00 +0.000 N +ATOM 1428 HE1 TRP 261 -14.522 -13.574 -9.861 0.00 0.00 +0.000 HD +ATOM 1429 CE2 TRP 261 -16.620 -13.712 -10.073 0.00 0.00 +0.000 A +ATOM 1430 CZ2 TRP 261 -17.006 -14.995 -9.651 0.00 0.00 +0.000 A +ATOM 1431 HZ2 TRP 261 -16.315 -15.646 -9.327 0.00 0.00 +0.000 HD +ATOM 1432 CH2 TRP 261 -18.340 -15.306 -9.703 0.00 0.00 +0.000 A +ATOM 1433 HH2 TRP 261 -18.655 -16.207 -9.405 0.00 0.00 +0.000 HD +ATOM 1434 CZ3 TRP 261 -19.289 -14.382 -10.169 0.00 0.00 +0.000 A +ATOM 1435 HZ3 TRP 261 -20.249 -14.631 -10.204 0.00 0.00 +0.000 HD +ATOM 1436 CE3 TRP 261 -18.906 -13.105 -10.590 0.00 0.00 +0.000 A +ATOM 1437 HE3 TRP 261 -19.592 -12.461 -10.911 0.00 0.00 +0.000 HD +ATOM 1438 CD2 TRP 261 -17.549 -12.761 -10.547 0.00 0.00 +0.000 A +ATOM 1439 C TRP 261 -19.123 -9.367 -13.037 0.00 0.00 +0.000 C +ATOM 1440 O TRP 261 -20.273 -9.459 -12.611 0.00 0.00 +0.000 OA +ATOM 1441 N GLY 262 -18.696 -8.325 -13.748 0.00 0.00 +0.000 N +ATOM 1442 H GLY 262 -17.715 -8.379 -14.061 0.00 0.00 +0.000 HD +ATOM 1443 CA GLY 262 -19.586 -7.214 -14.037 0.00 0.00 +0.000 C +ATOM 1444 HA2 GLY 262 -19.918 -6.812 -13.169 0.00 0.00 +0.000 HD +ATOM 1445 HA3 GLY 262 -19.075 -6.492 -14.529 0.00 0.00 +0.000 HD +ATOM 1446 C GLY 262 -20.780 -7.641 -14.877 0.00 0.00 +0.000 C +ATOM 1447 O GLY 262 -21.913 -7.225 -14.620 0.00 0.00 +0.000 OA +ATOM 1448 N ARG 263 -20.539 -8.488 -15.875 0.00 0.00 +0.000 N +ATOM 1449 H ARG 263 -19.560 -8.777 -15.986 0.00 0.00 +0.000 HD +ATOM 1450 CA ARG 263 -21.633 -8.947 -16.729 0.00 0.00 +0.000 C +ATOM 1451 HA ARG 263 -22.156 -8.144 -17.044 0.00 0.00 +0.000 HD +ATOM 1452 CB ARG 263 -21.092 -9.657 -17.976 0.00 0.00 +0.000 C +ATOM 1453 HB2 ARG 263 -20.407 -10.313 -17.688 0.00 0.00 +0.000 HD +ATOM 1454 HB3 ARG 263 -21.848 -10.112 -18.428 0.00 0.00 +0.000 HD +ATOM 1455 CG ARG 263 -20.444 -8.706 -18.979 0.00 0.00 +0.000 C +ATOM 1456 HG2 ARG 263 -21.127 -8.065 -19.323 0.00 0.00 +0.000 HD +ATOM 1457 HG3 ARG 263 -19.704 -8.205 -18.535 0.00 0.00 +0.000 HD +ATOM 1458 CD ARG 263 -19.846 -9.447 -20.189 0.00 0.00 +0.000 C +ATOM 1459 HD2 ARG 263 -19.412 -8.769 -20.774 0.00 0.00 +0.000 HD +ATOM 1460 HD3 ARG 263 -19.170 -10.090 -19.844 0.00 0.00 +0.000 HD +ATOM 1461 NE ARG 263 -20.865 -10.172 -20.953 0.00 0.00 +0.000 N +ATOM 1462 HE ARG 263 -20.922 -11.166 -20.833 0.00 0.00 +0.000 HD +ATOM 1463 CZ ARG 263 -21.712 -9.588 -21.790 0.00 0.00 +0.000 C +ATOM 1464 NH1 ARG 263 -21.642 -8.290 -21.971 0.00 0.00 +0.000 N +ATOM 1465 HH11 ARG 263 -20.961 -7.721 -21.518 0.00 0.00 +0.000 HD +ATOM 1466 HH12 ARG 263 -22.304 -7.837 -22.598 0.00 0.00 +0.000 HD +ATOM 1467 NH2 ARG 263 -22.642 -10.290 -22.413 0.00 0.00 +0.000 N +ATOM 1468 HH21 ARG 263 -22.690 -11.284 -22.261 0.00 0.00 +0.000 HD +ATOM 1469 HH22 ARG 263 -23.288 -9.848 -23.027 0.00 0.00 +0.000 HD +ATOM 1470 C ARG 263 -22.575 -9.876 -15.974 0.00 0.00 +0.000 C +ATOM 1471 O ARG 263 -23.756 -9.949 -16.291 0.00 0.00 +0.000 OA +ATOM 1472 N ILE 264 -22.050 -10.595 -14.985 0.00 0.00 +0.000 N +ATOM 1473 H ILE 264 -21.039 -10.459 -14.830 0.00 0.00 +0.000 HD +ATOM 1474 CA ILE 264 -22.880 -11.500 -14.199 0.00 0.00 +0.000 C +ATOM 1475 HA ILE 264 -23.483 -11.964 -14.843 0.00 0.00 +0.000 HD +ATOM 1476 CB ILE 264 -21.985 -12.465 -13.384 0.00 0.00 +0.000 C +ATOM 1477 HB ILE 264 -21.293 -11.928 -12.933 0.00 0.00 +0.000 HD +ATOM 1478 CG2 ILE 264 -22.805 -13.230 -12.339 0.00 0.00 +0.000 C +ATOM 1479 HG21 ILE 264 -22.199 -13.828 -11.821 0.00 0.00 +0.000 HD +ATOM 1480 HG22 ILE 264 -23.242 -12.579 -11.724 0.00 0.00 +0.000 HD +ATOM 1481 HG23 ILE 264 -23.500 -13.774 -12.802 0.00 0.00 +0.000 HD +ATOM 1482 CG1 ILE 264 -21.291 -13.423 -14.357 0.00 0.00 +0.000 C +ATOM 1483 HG12 ILE 264 -21.995 -13.994 -14.788 0.00 0.00 +0.000 HD +ATOM 1484 HG13 ILE 264 -20.858 -12.872 -15.076 0.00 0.00 +0.000 HD +ATOM 1485 CD1 ILE 264 -20.253 -14.307 -13.729 0.00 0.00 +0.000 C +ATOM 1486 HD11 ILE 264 -20.676 -14.873 -13.020 0.00 0.00 +0.000 HD +ATOM 1487 HD12 ILE 264 -19.848 -14.900 -14.427 0.00 0.00 +0.000 HD +ATOM 1488 HD13 ILE 264 -19.535 -13.744 -13.317 0.00 0.00 +0.000 HD +ATOM 1489 C ILE 264 -23.782 -10.670 -13.282 0.00 0.00 +0.000 C +ATOM 1490 O ILE 264 -24.956 -10.986 -13.084 0.00 0.00 +0.000 OA +ATOM 1491 N VAL 265 -23.231 -9.590 -12.741 0.00 0.00 +0.000 N +ATOM 1492 H VAL 265 -22.236 -9.436 -12.982 0.00 0.00 +0.000 HD +ATOM 1493 CA VAL 265 -23.999 -8.703 -11.874 0.00 0.00 +0.000 C +ATOM 1494 HA VAL 265 -24.442 -9.254 -11.169 0.00 0.00 +0.000 HD +ATOM 1495 CB VAL 265 -23.098 -7.632 -11.234 0.00 0.00 +0.000 C +ATOM 1496 HB VAL 265 -22.575 -7.203 -11.962 0.00 0.00 +0.000 HD +ATOM 1497 CG1 VAL 265 -23.949 -6.547 -10.596 0.00 0.00 +0.000 C +ATOM 1498 HG11 VAL 265 -23.364 -5.926 -10.073 0.00 0.00 +0.000 HD +ATOM 1499 HG12 VAL 265 -24.425 -6.032 -11.309 0.00 0.00 +0.000 HD +ATOM 1500 HG13 VAL 265 -24.621 -6.965 -9.984 0.00 0.00 +0.000 HD +ATOM 1501 CG2 VAL 265 -22.187 -8.274 -10.192 0.00 0.00 +0.000 C +ATOM 1502 HG21 VAL 265 -22.288 -9.267 -10.235 0.00 0.00 +0.000 HD +ATOM 1503 HG22 VAL 265 -21.239 -8.022 -10.385 0.00 0.00 +0.000 HD +ATOM 1504 HG23 VAL 265 -22.446 -7.947 -9.284 0.00 0.00 +0.000 HD +ATOM 1505 C VAL 265 -25.106 -8.024 -12.699 0.00 0.00 +0.000 C +ATOM 1506 O VAL 265 -26.230 -7.866 -12.228 0.00 0.00 +0.000 OA +ATOM 1507 N THR 266 -24.797 -7.645 -13.937 0.00 0.00 +0.000 N +ATOM 1508 H THR 266 -23.827 -7.828 -14.227 0.00 0.00 +0.000 HD +ATOM 1509 CA THR 266 -25.802 -7.015 -14.791 0.00 0.00 +0.000 C +ATOM 1510 HA THR 266 -26.195 -6.237 -14.302 0.00 0.00 +0.000 HD +ATOM 1511 CB THR 266 -25.192 -6.544 -16.125 0.00 0.00 +0.000 C +ATOM 1512 HB THR 266 -24.752 -7.338 -16.584 0.00 0.00 +0.000 HD +ATOM 1513 CG2 THR 266 -26.275 -5.935 -17.034 0.00 0.00 +0.000 C +ATOM 1514 HG21 THR 266 -27.172 -6.277 -16.755 0.00 0.00 +0.000 HD +ATOM 1515 HG22 THR 266 -26.255 -4.939 -16.951 0.00 0.00 +0.000 HD +ATOM 1516 HG23 THR 266 -26.097 -6.196 -17.982 0.00 0.00 +0.000 HD +ATOM 1517 OG1 THR 266 -24.177 -5.563 -15.857 0.00 0.00 +0.000 OA +ATOM 1518 HG1 THR 266 -23.376 -5.998 -15.434 0.00 0.00 +0.000 HD +ATOM 1519 C THR 266 -26.919 -8.016 -15.079 0.00 0.00 +0.000 C +ATOM 1520 O THR 266 -28.102 -7.673 -15.065 0.00 0.00 +0.000 OA +ATOM 1521 N LEU 267 -26.537 -9.259 -15.345 0.00 0.00 +0.000 N +ATOM 1522 H LEU 267 -25.512 -9.412 -15.348 0.00 0.00 +0.000 HD +ATOM 1523 CA LEU 267 -27.511 -10.311 -15.610 0.00 0.00 +0.000 C +ATOM 1524 HA LEU 267 -28.040 -10.063 -16.429 0.00 0.00 +0.000 HD +ATOM 1525 CB LEU 267 -26.791 -11.643 -15.839 0.00 0.00 +0.000 C +ATOM 1526 HB2 LEU 267 -26.350 -11.603 -16.734 0.00 0.00 +0.000 HD +ATOM 1527 HB3 LEU 267 -26.101 -11.745 -15.126 0.00 0.00 +0.000 HD +ATOM 1528 CG LEU 267 -27.658 -12.908 -15.817 0.00 0.00 +0.000 C +ATOM 1529 HG LEU 267 -28.287 -12.856 -15.047 0.00 0.00 +0.000 HD +ATOM 1530 CD1 LEU 267 -28.450 -13.011 -17.114 0.00 0.00 +0.000 C +ATOM 1531 HD11 LEU 267 -27.818 -13.056 -17.888 0.00 0.00 +0.000 HD +ATOM 1532 HD12 LEU 267 -29.014 -13.837 -17.096 0.00 0.00 +0.000 HD +ATOM 1533 HD13 LEU 267 -29.038 -12.208 -17.210 0.00 0.00 +0.000 HD +ATOM 1534 CD2 LEU 267 -26.769 -14.138 -15.637 0.00 0.00 +0.000 C +ATOM 1535 HD21 LEU 267 -26.269 -14.062 -14.775 0.00 0.00 +0.000 HD +ATOM 1536 HD22 LEU 267 -27.339 -14.959 -15.623 0.00 0.00 +0.000 HD +ATOM 1537 HD23 LEU 267 -26.121 -14.192 -16.396 0.00 0.00 +0.000 HD +ATOM 1538 C LEU 267 -28.486 -10.466 -14.440 0.00 0.00 +0.000 C +ATOM 1539 O LEU 267 -29.704 -10.525 -14.630 0.00 0.00 +0.000 OA +ATOM 1540 N ILE 268 -27.937 -10.531 -13.232 0.00 0.00 +0.000 N +ATOM 1541 H ILE 268 -26.899 -10.447 -13.221 0.00 0.00 +0.000 HD +ATOM 1542 CA ILE 268 -28.737 -10.707 -12.023 0.00 0.00 +0.000 C +ATOM 1543 HA ILE 268 -29.429 -11.406 -12.241 0.00 0.00 +0.000 HD +ATOM 1544 CB ILE 268 -27.836 -11.130 -10.830 0.00 0.00 +0.000 C +ATOM 1545 HB ILE 268 -27.096 -10.477 -10.765 0.00 0.00 +0.000 HD +ATOM 1546 CG2 ILE 268 -28.635 -11.125 -9.524 0.00 0.00 +0.000 C +ATOM 1547 HG21 ILE 268 -28.031 -11.365 -8.768 0.00 0.00 +0.000 HD +ATOM 1548 HG22 ILE 268 -29.015 -10.215 -9.374 0.00 0.00 +0.000 HD +ATOM 1549 HG23 ILE 268 -29.374 -11.791 -9.588 0.00 0.00 +0.000 HD +ATOM 1550 CG1 ILE 268 -27.232 -12.514 -11.101 0.00 0.00 +0.000 C +ATOM 1551 HG12 ILE 268 -27.963 -13.193 -11.050 0.00 0.00 +0.000 HD +ATOM 1552 HG13 ILE 268 -26.860 -12.516 -12.029 0.00 0.00 +0.000 HD +ATOM 1553 CD1 ILE 268 -26.127 -12.908 -10.135 0.00 0.00 +0.000 C +ATOM 1554 HD11 ILE 268 -26.492 -12.921 -9.206 0.00 0.00 +0.000 HD +ATOM 1555 HD12 ILE 268 -25.788 -13.815 -10.377 0.00 0.00 +0.000 HD +ATOM 1556 HD13 ILE 268 -25.385 -12.243 -10.197 0.00 0.00 +0.000 HD +ATOM 1557 C ILE 268 -29.503 -9.437 -11.658 0.00 0.00 +0.000 C +ATOM 1558 O ILE 268 -30.666 -9.494 -11.258 0.00 0.00 +0.000 OA +ATOM 1559 N SER 269 -28.850 -8.293 -11.829 0.00 0.00 +0.000 N +ATOM 1560 H SER 269 -27.887 -8.395 -12.209 0.00 0.00 +0.000 HD +ATOM 1561 CA SER 269 -29.452 -7.007 -11.504 0.00 0.00 +0.000 C +ATOM 1562 HA SER 269 -29.763 -7.043 -10.539 0.00 0.00 +0.000 HD +ATOM 1563 CB SER 269 -28.413 -5.898 -11.641 0.00 0.00 +0.000 C +ATOM 1564 HB2 SER 269 -28.046 -5.913 -12.562 0.00 0.00 +0.000 HD +ATOM 1565 HB3 SER 269 -28.846 -5.026 -11.449 0.00 0.00 +0.000 HD +ATOM 1566 OG SER 269 -27.359 -6.104 -10.719 0.00 0.00 +0.000 OA +ATOM 1567 HG SER 269 -26.715 -6.772 -11.091 0.00 0.00 +0.000 HD +ATOM 1568 C SER 269 -30.657 -6.687 -12.371 0.00 0.00 +0.000 C +ATOM 1569 O SER 269 -31.663 -6.161 -11.887 0.00 0.00 +0.000 OA +ATOM 1570 N PHE 270 -30.554 -6.970 -13.660 0.00 0.00 +0.000 N +ATOM 1571 H PHE 270 -29.662 -7.363 -13.966 0.00 0.00 +0.000 HD +ATOM 1572 CA PHE 270 -31.685 -6.709 -14.524 0.00 0.00 +0.000 C +ATOM 1573 HA PHE 270 -32.057 -5.822 -14.269 0.00 0.00 +0.000 HD +ATOM 1574 CB PHE 270 -31.292 -6.802 -16.000 0.00 0.00 +0.000 C +ATOM 1575 HB2 PHE 270 -30.548 -6.174 -16.155 0.00 0.00 +0.000 HD +ATOM 1576 HB3 PHE 270 -31.029 -7.734 -16.185 0.00 0.00 +0.000 HD +ATOM 1577 CG PHE 270 -32.412 -6.439 -16.935 0.00 0.00 +0.000 A +ATOM 1578 CD1 PHE 270 -32.845 -5.119 -17.043 0.00 0.00 +0.000 A +ATOM 1579 HD1 PHE 270 -32.389 -4.402 -16.529 0.00 0.00 +0.000 HD +ATOM 1580 CE1 PHE 270 -33.919 -4.787 -17.873 0.00 0.00 +0.000 A +ATOM 1581 HE1 PHE 270 -34.218 -3.831 -17.935 0.00 0.00 +0.000 HD +ATOM 1582 CZ PHE 270 -34.560 -5.781 -18.600 0.00 0.00 +0.000 A +ATOM 1583 HZ PHE 270 -35.328 -5.548 -19.194 0.00 0.00 +0.000 HD +ATOM 1584 CE2 PHE 270 -34.130 -7.102 -18.499 0.00 0.00 +0.000 A +ATOM 1585 HE2 PHE 270 -34.593 -7.831 -19.025 0.00 0.00 +0.000 HD +ATOM 1586 CD2 PHE 270 -33.062 -7.419 -17.670 0.00 0.00 +0.000 A +ATOM 1587 HD2 PHE 270 -32.756 -8.372 -17.603 0.00 0.00 +0.000 HD +ATOM 1588 C PHE 270 -32.759 -7.742 -14.201 0.00 0.00 +0.000 C +ATOM 1589 O PHE 270 -33.948 -7.482 -14.363 0.00 0.00 +0.000 OA +ATOM 1590 N GLY 271 -32.330 -8.919 -13.752 0.00 0.00 +0.000 N +ATOM 1591 H GLY 271 -31.308 -9.025 -13.696 0.00 0.00 +0.000 HD +ATOM 1592 CA GLY 271 -33.283 -9.951 -13.379 0.00 0.00 +0.000 C +ATOM 1593 HA2 GLY 271 -33.873 -10.163 -14.156 0.00 0.00 +0.000 HD +ATOM 1594 HA3 GLY 271 -32.796 -10.774 -13.093 0.00 0.00 +0.000 HD +ATOM 1595 C GLY 271 -34.130 -9.437 -12.226 0.00 0.00 +0.000 C +ATOM 1596 O GLY 271 -35.335 -9.677 -12.173 0.00 0.00 +0.000 OA +ATOM 1597 N ALA 272 -33.489 -8.730 -11.298 0.00 0.00 +0.000 N +ATOM 1598 H ALA 272 -32.467 -8.624 -11.461 0.00 0.00 +0.000 HD +ATOM 1599 CA ALA 272 -34.182 -8.156 -10.149 0.00 0.00 +0.000 C +ATOM 1600 HA ALA 272 -34.733 -8.872 -9.712 0.00 0.00 +0.000 HD +ATOM 1601 CB ALA 272 -33.182 -7.617 -9.146 0.00 0.00 +0.000 C +ATOM 1602 HB1 ALA 272 -32.392 -8.229 -9.095 0.00 0.00 +0.000 HD +ATOM 1603 HB2 ALA 272 -32.876 -6.707 -9.430 0.00 0.00 +0.000 HD +ATOM 1604 HB3 ALA 272 -33.610 -7.555 -8.243 0.00 0.00 +0.000 HD +ATOM 1605 C ALA 272 -35.109 -7.037 -10.606 0.00 0.00 +0.000 C +ATOM 1606 O ALA 272 -36.184 -6.845 -10.039 0.00 0.00 +0.000 OA +ATOM 1607 N PHE 273 -34.682 -6.304 -11.634 0.00 0.00 +0.000 N +ATOM 1608 H PHE 273 -33.748 -6.581 -12.004 0.00 0.00 +0.000 HD +ATOM 1609 CA PHE 273 -35.467 -5.203 -12.191 0.00 0.00 +0.000 C +ATOM 1610 HA PHE 273 -35.743 -4.625 -11.428 0.00 0.00 +0.000 HD +ATOM 1611 CB PHE 273 -34.648 -4.478 -13.270 0.00 0.00 +0.000 C +ATOM 1612 HB2 PHE 273 -33.740 -4.323 -12.905 0.00 0.00 +0.000 HD +ATOM 1613 HB3 PHE 273 -34.614 -5.066 -14.067 0.00 0.00 +0.000 HD +ATOM 1614 CG PHE 273 -35.212 -3.149 -13.695 0.00 0.00 +0.000 A +ATOM 1615 CD1 PHE 273 -35.122 -2.036 -12.863 0.00 0.00 +0.000 A +ATOM 1616 HD1 PHE 273 -34.711 -2.117 -11.963 0.00 0.00 +0.000 HD +ATOM 1617 CE1 PHE 273 -35.607 -0.788 -13.281 0.00 0.00 +0.000 A +ATOM 1618 HE1 PHE 273 -35.534 0.000 -12.666 0.00 0.00 +0.000 HD +ATOM 1619 CZ PHE 273 -36.184 -0.659 -14.540 0.00 0.00 +0.000 A +ATOM 1620 HZ PHE 273 -36.527 0.227 -14.843 0.00 0.00 +0.000 HD +ATOM 1621 CE2 PHE 273 -36.279 -1.772 -15.373 0.00 0.00 +0.000 A +ATOM 1622 HE2 PHE 273 -36.701 -1.687 -16.289 0.00 0.00 +0.000 HD +ATOM 1623 CD2 PHE 273 -35.796 -3.002 -14.947 0.00 0.00 +0.000 A +ATOM 1624 HD2 PHE 273 -35.869 -3.797 -15.553 0.00 0.00 +0.000 HD +ATOM 1625 C PHE 273 -36.748 -5.778 -12.794 0.00 0.00 +0.000 C +ATOM 1626 O PHE 273 -37.816 -5.187 -12.683 0.00 0.00 +0.000 OA +ATOM 1627 N VAL 274 -36.633 -6.931 -13.447 0.00 0.00 +0.000 N +ATOM 1628 H VAL 274 -35.676 -7.316 -13.494 0.00 0.00 +0.000 HD +ATOM 1629 CA VAL 274 -37.798 -7.571 -14.039 0.00 0.00 +0.000 C +ATOM 1630 HA VAL 274 -38.326 -6.879 -14.527 0.00 0.00 +0.000 HD +ATOM 1631 CB VAL 274 -37.387 -8.720 -14.996 0.00 0.00 +0.000 C +ATOM 1632 HB VAL 274 -36.832 -9.358 -14.475 0.00 0.00 +0.000 HD +ATOM 1633 CG1 VAL 274 -38.619 -9.480 -15.471 0.00 0.00 +0.000 C +ATOM 1634 HG11 VAL 274 -38.340 -10.211 -16.093 0.00 0.00 +0.000 HD +ATOM 1635 HG12 VAL 274 -39.091 -9.875 -14.683 0.00 0.00 +0.000 HD +ATOM 1636 HG13 VAL 274 -39.234 -8.853 -15.948 0.00 0.00 +0.000 HD +ATOM 1637 CG2 VAL 274 -36.637 -8.154 -16.194 0.00 0.00 +0.000 C +ATOM 1638 HG21 VAL 274 -36.840 -7.179 -16.279 0.00 0.00 +0.000 HD +ATOM 1639 HG22 VAL 274 -35.655 -8.283 -16.059 0.00 0.00 +0.000 HD +ATOM 1640 HG23 VAL 274 -36.929 -8.632 -17.022 0.00 0.00 +0.000 HD +ATOM 1641 C VAL 274 -38.679 -8.128 -12.918 0.00 0.00 +0.000 C +ATOM 1642 O VAL 274 -39.900 -8.053 -12.989 0.00 0.00 +0.000 OA +ATOM 1643 N ALA 275 -38.051 -8.685 -11.885 0.00 0.00 +0.000 N +ATOM 1644 H ALA 275 -37.017 -8.693 -11.956 0.00 0.00 +0.000 HD +ATOM 1645 CA ALA 275 -38.788 -9.234 -10.754 0.00 0.00 +0.000 C +ATOM 1646 HA ALA 275 -39.379 -9.977 -11.078 0.00 0.00 +0.000 HD +ATOM 1647 CB ALA 275 -37.819 -9.798 -9.703 0.00 0.00 +0.000 C +ATOM 1648 HB1 ALA 275 -38.106 -9.494 -8.798 0.00 0.00 +0.000 HD +ATOM 1649 HB2 ALA 275 -37.834 -10.794 -9.746 0.00 0.00 +0.000 HD +ATOM 1650 HB3 ALA 275 -36.899 -9.465 -9.895 0.00 0.00 +0.000 HD +ATOM 1651 C ALA 275 -39.671 -8.149 -10.132 0.00 0.00 +0.000 C +ATOM 1652 O ALA 275 -40.813 -8.413 -9.743 0.00 0.00 +0.000 OA +ATOM 1653 N LYS 276 -39.140 -6.933 -10.027 0.00 0.00 +0.000 N +ATOM 1654 H LYS 276 -38.168 -6.846 -10.365 0.00 0.00 +0.000 HD +ATOM 1655 CA LYS 276 -39.909 -5.821 -9.467 0.00 0.00 +0.000 C +ATOM 1656 HA LYS 276 -40.239 -6.082 -8.559 0.00 0.00 +0.000 HD +ATOM 1657 CB LYS 276 -39.056 -4.558 -9.365 0.00 0.00 +0.000 C +ATOM 1658 HB2 LYS 276 -38.563 -4.446 -10.230 0.00 0.00 +0.000 HD +ATOM 1659 HB3 LYS 276 -39.672 -3.778 -9.236 0.00 0.00 +0.000 HD +ATOM 1660 CG LYS 276 -38.051 -4.567 -8.238 0.00 0.00 +0.000 C +ATOM 1661 HG2 LYS 276 -38.533 -4.481 -7.367 0.00 0.00 +0.000 HD +ATOM 1662 HG3 LYS 276 -37.542 -5.425 -8.258 0.00 0.00 +0.000 HD +ATOM 1663 CD LYS 276 -37.085 -3.417 -8.382 0.00 0.00 +0.000 C +ATOM 1664 HD2 LYS 276 -36.546 -3.546 -9.210 0.00 0.00 +0.000 HD +ATOM 1665 HD3 LYS 276 -37.597 -2.565 -8.435 0.00 0.00 +0.000 HD +ATOM 1666 CE LYS 276 -36.143 -3.341 -7.200 0.00 0.00 +0.000 C +ATOM 1667 HE2 LYS 276 -36.662 -3.100 -6.384 0.00 0.00 +0.000 HD +ATOM 1668 HE3 LYS 276 -35.705 -4.228 -7.074 0.00 0.00 +0.000 HD +ATOM 1669 NZ LYS 276 -35.107 -2.311 -7.446 0.00 0.00 +0.000 N +ATOM 1670 HZ1 LYS 276 -35.246 -1.905 -8.350 0.00 0.00 +0.000 HD +ATOM 1671 HZ2 LYS 276 -35.172 -1.597 -6.748 0.00 0.00 +0.000 HD +ATOM 1672 HZ3 LYS 276 -34.200 -2.732 -7.407 0.00 0.00 +0.000 HD +ATOM 1673 C LYS 276 -41.100 -5.536 -10.363 0.00 0.00 +0.000 C +ATOM 1674 O LYS 276 -42.215 -5.319 -9.885 0.00 0.00 +0.000 OA +ATOM 1675 N HIE 277 -40.853 -5.525 -11.670 0.00 0.00 +0.000 N +ATOM 1676 H HIE 277 -39.863 -5.706 -11.927 0.00 0.00 +0.000 HD +ATOM 1677 CA HIE 277 -41.905 -5.277 -12.645 0.00 0.00 +0.000 C +ATOM 1678 HA HIE 277 -42.322 -4.384 -12.449 0.00 0.00 +0.000 HD +ATOM 1679 CB HIE 277 -41.314 -5.289 -14.054 0.00 0.00 +0.000 C +ATOM 1680 HB2 HIE 277 -40.784 -4.446 -14.194 0.00 0.00 +0.000 HD +ATOM 1681 HB3 HIE 277 -40.693 -6.075 -14.141 0.00 0.00 +0.000 HD +ATOM 1682 CG HIE 277 -42.344 -5.382 -15.135 0.00 0.00 +0.000 A +ATOM 1683 ND1 HIE 277 -43.132 -4.316 -15.507 0.00 0.00 +0.000 NA +ATOM 1684 CE1 HIE 277 -43.967 -4.701 -16.457 0.00 0.00 +0.000 A +ATOM 1685 HE1 HIE 277 -44.647 -4.126 -16.903 0.00 0.00 +0.000 HD +ATOM 1686 NE2 HIE 277 -43.748 -5.977 -16.712 0.00 0.00 +0.000 N +ATOM 1687 HE2 HIE 277 -44.239 -6.529 -17.389 0.00 0.00 +0.000 HD +ATOM 1688 CD2 HIE 277 -42.735 -6.427 -15.899 0.00 0.00 +0.000 A +ATOM 1689 HD2 HIE 277 -42.362 -7.350 -15.878 0.00 0.00 +0.000 HD +ATOM 1690 C HIE 277 -43.002 -6.344 -12.545 0.00 0.00 +0.000 C +ATOM 1691 O HIE 277 -44.191 -6.039 -12.682 0.00 0.00 +0.000 OA +ATOM 1692 N LEU 278 -42.592 -7.592 -12.312 0.00 0.00 +0.000 N +ATOM 1693 H LEU 278 -41.560 -7.698 -12.221 0.00 0.00 +0.000 HD +ATOM 1694 CA LEU 278 -43.526 -8.711 -12.196 0.00 0.00 +0.000 C +ATOM 1695 HA LEU 278 -44.096 -8.740 -13.030 0.00 0.00 +0.000 HD +ATOM 1696 CB LEU 278 -42.762 -10.033 -12.087 0.00 0.00 +0.000 C +ATOM 1697 HB2 LEU 278 -42.036 -9.911 -11.434 0.00 0.00 +0.000 HD +ATOM 1698 HB3 LEU 278 -43.398 -10.730 -11.812 0.00 0.00 +0.000 HD +ATOM 1699 CG LEU 278 -42.133 -10.470 -13.405 0.00 0.00 +0.000 C +ATOM 1700 HG LEU 278 -41.482 -9.772 -13.703 0.00 0.00 +0.000 HD +ATOM 1701 CD1 LEU 278 -41.411 -11.794 -13.236 0.00 0.00 +0.000 C +ATOM 1702 HD11 LEU 278 -42.060 -12.496 -12.939 0.00 0.00 +0.000 HD +ATOM 1703 HD12 LEU 278 -41.003 -12.069 -14.108 0.00 0.00 +0.000 HD +ATOM 1704 HD13 LEU 278 -40.689 -11.698 -12.549 0.00 0.00 +0.000 HD +ATOM 1705 CD2 LEU 278 -43.222 -10.602 -14.452 0.00 0.00 +0.000 C +ATOM 1706 HD21 LEU 278 -43.681 -9.720 -14.575 0.00 0.00 +0.000 HD +ATOM 1707 HD22 LEU 278 -42.819 -10.889 -15.323 0.00 0.00 +0.000 HD +ATOM 1708 HD23 LEU 278 -43.893 -11.285 -14.157 0.00 0.00 +0.000 HD +ATOM 1709 C LEU 278 -44.450 -8.569 -10.989 0.00 0.00 +0.000 C +ATOM 1710 O LEU 278 -45.623 -8.954 -11.051 0.00 0.00 +0.000 OA +ATOM 1711 N LYS 279 -43.920 -8.030 -9.896 0.00 0.00 +0.000 N +ATOM 1712 H LYS 279 -42.923 -7.764 -9.975 0.00 0.00 +0.000 HD +ATOM 1713 CA LYS 279 -44.715 -7.840 -8.686 0.00 0.00 +0.000 C +ATOM 1714 HA LYS 279 -45.225 -8.680 -8.498 0.00 0.00 +0.000 HD +ATOM 1715 CB LYS 279 -43.805 -7.482 -7.512 0.00 0.00 +0.000 C +ATOM 1716 HB2 LYS 279 -43.176 -8.246 -7.362 0.00 0.00 +0.000 HD +ATOM 1717 HB3 LYS 279 -43.279 -6.667 -7.764 0.00 0.00 +0.000 HD +ATOM 1718 CG LYS 279 -44.532 -7.200 -6.214 0.00 0.00 +0.000 C +ATOM 1719 HG2 LYS 279 -43.874 -6.876 -5.534 0.00 0.00 +0.000 HD +ATOM 1720 HG3 LYS 279 -45.224 -6.497 -6.372 0.00 0.00 +0.000 HD +ATOM 1721 CD LYS 279 -45.207 -8.448 -5.691 0.00 0.00 +0.000 C +ATOM 1722 HD2 LYS 279 -45.969 -8.688 -6.296 0.00 0.00 +0.000 HD +ATOM 1723 HD3 LYS 279 -44.546 -9.201 -5.681 0.00 0.00 +0.000 HD +ATOM 1724 CE LYS 279 -45.763 -8.288 -4.271 0.00 0.00 +0.000 C +ATOM 1725 HE2 LYS 279 -46.090 -9.184 -3.949 0.00 0.00 +0.000 HD +ATOM 1726 HE3 LYS 279 -45.018 -7.987 -3.664 0.00 0.00 +0.000 HD +ATOM 1727 NZ LYS 279 -46.892 -7.298 -4.182 0.00 0.00 +0.000 N +ATOM 1728 HZ1 LYS 279 -47.093 -6.953 -5.096 0.00 0.00 +0.000 HD +ATOM 1729 HZ2 LYS 279 -47.694 -7.755 -3.806 0.00 0.00 +0.000 HD +ATOM 1730 HZ3 LYS 279 -46.618 -6.547 -3.586 0.00 0.00 +0.000 HD +ATOM 1731 C LYS 279 -45.696 -6.706 -8.913 0.00 0.00 +0.000 C +ATOM 1732 O LYS 279 -46.876 -6.795 -8.559 0.00 0.00 +0.000 OA +ATOM 1733 N THR 280 -45.177 -5.634 -9.503 0.00 0.00 +0.000 N +ATOM 1734 H THR 280 -44.158 -5.730 -9.741 0.00 0.00 +0.000 HD +ATOM 1735 CA THR 280 -45.943 -4.432 -9.797 0.00 0.00 +0.000 C +ATOM 1736 HA THR 280 -46.245 -4.020 -8.924 0.00 0.00 +0.000 HD +ATOM 1737 CB THR 280 -45.039 -3.414 -10.528 0.00 0.00 +0.000 C +ATOM 1738 HB THR 280 -44.638 -3.862 -11.348 0.00 0.00 +0.000 HD +ATOM 1739 CG2 THR 280 -45.819 -2.186 -10.931 0.00 0.00 +0.000 C +ATOM 1740 HG21 THR 280 -46.797 -2.404 -10.999 0.00 0.00 +0.000 HD +ATOM 1741 HG22 THR 280 -45.696 -1.459 -10.249 0.00 0.00 +0.000 HD +ATOM 1742 HG23 THR 280 -45.500 -1.850 -11.822 0.00 0.00 +0.000 HD +ATOM 1743 OG1 THR 280 -43.962 -3.031 -9.655 0.00 0.00 +0.000 OA +ATOM 1744 HG1 THR 280 -43.250 -3.740 -9.651 0.00 0.00 +0.000 HD +ATOM 1745 C THR 280 -47.187 -4.732 -10.634 0.00 0.00 +0.000 C +ATOM 1746 O THR 280 -48.260 -4.173 -10.379 0.00 0.00 +0.000 OA +ATOM 1747 N ILE 281 -47.040 -5.618 -11.619 0.00 0.00 +0.000 N +ATOM 1748 H ILE 281 -46.090 -6.016 -11.711 0.00 0.00 +0.000 HD +ATOM 1749 CA ILE 281 -48.158 -5.979 -12.487 0.00 0.00 +0.000 C +ATOM 1750 HA ILE 281 -48.818 -5.212 -12.429 0.00 0.00 +0.000 HD +ATOM 1751 CB ILE 281 -47.723 -6.197 -13.963 0.00 0.00 +0.000 C +ATOM 1752 HB ILE 281 -48.546 -6.348 -14.500 0.00 0.00 +0.000 HD +ATOM 1753 CG2 ILE 281 -46.986 -4.959 -14.477 0.00 0.00 +0.000 C +ATOM 1754 HG21 ILE 281 -46.747 -5.092 -15.436 0.00 0.00 +0.000 HD +ATOM 1755 HG22 ILE 281 -47.578 -4.162 -14.387 0.00 0.00 +0.000 HD +ATOM 1756 HG23 ILE 281 -46.156 -4.823 -13.941 0.00 0.00 +0.000 HD +ATOM 1757 CG1 ILE 281 -46.832 -7.434 -14.092 0.00 0.00 +0.000 C +ATOM 1758 HG12 ILE 281 -45.954 -7.234 -13.667 0.00 0.00 +0.000 HD +ATOM 1759 HG13 ILE 281 -47.268 -8.183 -13.599 0.00 0.00 +0.000 HD +ATOM 1760 CD1 ILE 281 -46.609 -7.851 -15.520 0.00 0.00 +0.000 C +ATOM 1761 HD11 ILE 281 -46.168 -7.106 -16.022 0.00 0.00 +0.000 HD +ATOM 1762 HD12 ILE 281 -46.022 -8.661 -15.545 0.00 0.00 +0.000 HD +ATOM 1763 HD13 ILE 281 -47.488 -8.065 -15.948 0.00 0.00 +0.000 HD +ATOM 1764 C ILE 281 -48.899 -7.226 -12.028 0.00 0.00 +0.000 C +ATOM 1765 O ILE 281 -49.607 -7.858 -12.817 0.00 0.00 +0.000 OA +ATOM 1766 N ASN 282 -48.731 -7.578 -10.754 0.00 0.00 +0.000 N +ATOM 1767 H ASN 282 -48.101 -6.948 -10.211 0.00 0.00 +0.000 HD +ATOM 1768 CA ASN 282 -49.380 -8.755 -10.167 0.00 0.00 +0.000 C +ATOM 1769 HA ASN 282 -49.008 -8.849 -9.211 0.00 0.00 +0.000 HD +ATOM 1770 CB ASN 282 -50.877 -8.523 -9.987 0.00 0.00 +0.000 C +ATOM 1771 HB2 ASN 282 -51.158 -7.797 -10.605 0.00 0.00 +0.000 HD +ATOM 1772 HB3 ASN 282 -51.352 -9.369 -10.204 0.00 0.00 +0.000 HD +ATOM 1773 CG ASN 282 -51.208 -8.122 -8.579 0.00 0.00 +0.000 C +ATOM 1774 OD1 ASN 282 -51.177 -6.936 -8.252 0.00 0.00 +0.000 OA +ATOM 1775 ND2 ASN 282 -51.493 -9.099 -7.724 0.00 0.00 +0.000 N +ATOM 1776 HD21 ASN 282 -51.725 -8.889 -6.778 0.00 0.00 +0.000 HD +ATOM 1777 HD22 ASN 282 -51.472 -10.051 -8.039 0.00 0.00 +0.000 HD +ATOM 1778 C ASN 282 -49.157 -10.096 -10.859 0.00 0.00 +0.000 C +ATOM 1779 O ASN 282 -50.109 -10.831 -11.162 0.00 0.00 +0.000 OA +ATOM 1780 N GLN 283 -47.888 -10.398 -11.128 0.00 0.00 +0.000 N +ATOM 1781 H GLN 283 -47.203 -9.656 -10.878 0.00 0.00 +0.000 HD +ATOM 1782 CA GLN 283 -47.501 -11.677 -11.728 0.00 0.00 +0.000 C +ATOM 1783 HA GLN 283 -48.270 -12.287 -11.668 0.00 0.00 +0.000 HD +ATOM 1784 CB GLN 283 -46.992 -11.472 -13.156 0.00 0.00 +0.000 C +ATOM 1785 HB2 GLN 283 -46.424 -10.653 -13.183 0.00 0.00 +0.000 HD +ATOM 1786 HB3 GLN 283 -46.453 -12.268 -13.425 0.00 0.00 +0.000 HD +ATOM 1787 CG GLN 283 -48.118 -11.299 -14.177 0.00 0.00 +0.000 C +ATOM 1788 HG2 GLN 283 -48.852 -10.767 -13.754 0.00 0.00 +0.000 HD +ATOM 1789 HG3 GLN 283 -47.758 -10.800 -14.966 0.00 0.00 +0.000 HD +ATOM 1790 CD GLN 283 -48.696 -12.621 -14.661 0.00 0.00 +0.000 C +ATOM 1791 OE1 GLN 283 -48.563 -13.663 -14.011 0.00 0.00 +0.000 OA +ATOM 1792 NE2 GLN 283 -49.364 -12.576 -15.803 0.00 0.00 +0.000 N +ATOM 1793 HE21 GLN 283 -49.771 -13.424 -16.202 0.00 0.00 +0.000 HD +ATOM 1794 HE22 GLN 283 -49.470 -11.685 -16.282 0.00 0.00 +0.000 HD +ATOM 1795 C GLN 283 -46.402 -12.207 -10.825 0.00 0.00 +0.000 C +ATOM 1796 O GLN 283 -45.402 -12.743 -11.289 0.00 0.00 +0.000 OA +ATOM 1797 N GLU 284 -46.614 -12.047 -9.522 0.00 0.00 +0.000 N +ATOM 1798 H GLU 284 -47.524 -11.591 -9.286 0.00 0.00 +0.000 HD +ATOM 1799 CA GLU 284 -45.653 -12.474 -8.508 0.00 0.00 +0.000 C +ATOM 1800 HA GLU 284 -44.825 -11.868 -8.554 0.00 0.00 +0.000 HD +ATOM 1801 CB GLU 284 -46.227 -12.220 -7.116 0.00 0.00 +0.000 C +ATOM 1802 HB2 GLU 284 -46.836 -11.454 -7.181 0.00 0.00 +0.000 HD +ATOM 1803 HB3 GLU 284 -46.681 -13.040 -6.827 0.00 0.00 +0.000 HD +ATOM 1804 CG GLU 284 -45.167 -11.889 -6.099 0.00 0.00 +0.000 C +ATOM 1805 HG2 GLU 284 -44.517 -12.628 -6.074 0.00 0.00 +0.000 HD +ATOM 1806 HG3 GLU 284 -44.746 -11.036 -6.351 0.00 0.00 +0.000 HD +ATOM 1807 CD GLU 284 -45.729 -11.727 -4.711 0.00 0.00 +0.000 C +ATOM 1808 OE1 GLU 284 -46.883 -11.254 -4.595 0.00 0.00 +0.000 OA +ATOM 1809 OE2 GLU 284 -45.005 -12.055 -3.750 0.00 0.00 +0.000 OA +ATOM 1810 C GLU 284 -45.204 -13.933 -8.594 0.00 0.00 +0.000 C +ATOM 1811 O GLU 284 -44.051 -14.254 -8.288 0.00 0.00 +0.000 OA +ATOM 1812 N SER 285 -46.099 -14.826 -9.001 0.00 0.00 +0.000 N +ATOM 1813 H SER 285 -47.022 -14.453 -9.249 0.00 0.00 +0.000 HD +ATOM 1814 CA SER 285 -45.736 -16.237 -9.071 0.00 0.00 +0.000 C +ATOM 1815 HA SER 285 -45.328 -16.499 -8.178 0.00 0.00 +0.000 HD +ATOM 1816 CB SER 285 -46.978 -17.107 -9.289 0.00 0.00 +0.000 C +ATOM 1817 HB2 SER 285 -46.721 -18.065 -9.180 0.00 0.00 +0.000 HD +ATOM 1818 HB3 SER 285 -47.664 -16.861 -8.607 0.00 0.00 +0.000 HD +ATOM 1819 OG SER 285 -47.529 -16.922 -10.583 0.00 0.00 +0.000 OA +ATOM 1820 HG SER 285 -48.009 -16.047 -10.618 0.00 0.00 +0.000 HD +ATOM 1821 C SER 285 -44.711 -16.547 -10.158 0.00 0.00 +0.000 C +ATOM 1822 O SER 285 -44.196 -17.662 -10.224 0.00 0.00 +0.000 OA +ATOM 1823 N CYS 286 -44.415 -15.567 -11.006 0.00 0.00 +0.000 N +ATOM 1824 H CYS 286 -44.905 -14.674 -10.836 0.00 0.00 +0.000 HD +ATOM 1825 CA CYS 286 -43.460 -15.778 -12.088 0.00 0.00 +0.000 C +ATOM 1826 HA CYS 286 -43.531 -16.747 -12.387 0.00 0.00 +0.000 HD +ATOM 1827 CB CYS 286 -43.816 -14.888 -13.282 0.00 0.00 +0.000 C +ATOM 1828 HB2 CYS 286 -43.878 -13.941 -12.951 0.00 0.00 +0.000 HD +ATOM 1829 HB3 CYS 286 -43.062 -14.947 -13.944 0.00 0.00 +0.000 HD +ATOM 1830 SG CYS 286 -45.353 -15.297 -14.132 0.00 0.00 +0.000 S +ATOM 1831 HG CYS 286 -45.691 -14.491 -14.619 0.00 0.00 +0.000 HD +ATOM 1832 C CYS 286 -42.018 -15.518 -11.677 0.00 0.00 +0.000 C +ATOM 1833 O CYS 286 -41.087 -15.868 -12.400 0.00 0.00 +0.000 OA +ATOM 1834 N ILE 287 -41.841 -14.909 -10.510 0.00 0.00 +0.000 N +ATOM 1835 H ILE 287 -42.715 -14.693 -9.994 0.00 0.00 +0.000 HD +ATOM 1836 CA ILE 287 -40.513 -14.583 -10.019 0.00 0.00 +0.000 C +ATOM 1837 HA ILE 287 -40.056 -14.056 -10.766 0.00 0.00 +0.000 HD +ATOM 1838 CB ILE 287 -40.600 -13.656 -8.774 0.00 0.00 +0.000 C +ATOM 1839 HB ILE 287 -41.148 -14.114 -8.094 0.00 0.00 +0.000 HD +ATOM 1840 CG2 ILE 287 -39.195 -13.338 -8.249 0.00 0.00 +0.000 C +ATOM 1841 HG21 ILE 287 -39.270 -12.748 -7.449 0.00 0.00 +0.000 HD +ATOM 1842 HG22 ILE 287 -38.738 -14.188 -7.999 0.00 0.00 +0.000 HD +ATOM 1843 HG23 ILE 287 -38.676 -12.874 -8.962 0.00 0.00 +0.000 HD +ATOM 1844 CG1 ILE 287 -41.317 -12.348 -9.164 0.00 0.00 +0.000 C +ATOM 1845 HG12 ILE 287 -40.728 -11.846 -9.800 0.00 0.00 +0.000 HD +ATOM 1846 HG13 ILE 287 -42.162 -12.590 -9.647 0.00 0.00 +0.000 HD +ATOM 1847 CD1 ILE 287 -41.672 -11.434 -7.997 0.00 0.00 +0.000 C +ATOM 1848 HD11 ILE 287 -40.835 -11.174 -7.521 0.00 0.00 +0.000 HD +ATOM 1849 HD12 ILE 287 -42.129 -10.620 -8.348 0.00 0.00 +0.000 HD +ATOM 1850 HD13 ILE 287 -42.279 -11.922 -7.374 0.00 0.00 +0.000 HD +ATOM 1851 C ILE 287 -39.618 -15.775 -9.723 0.00 0.00 +0.000 C +ATOM 1852 O ILE 287 -38.500 -15.831 -10.211 0.00 0.00 +0.000 OA +ATOM 1853 N GLU 288 -40.099 -16.733 -8.941 0.00 0.00 +0.000 N +ATOM 1854 H GLU 288 -41.052 -16.591 -8.590 0.00 0.00 +0.000 HD +ATOM 1855 CA GLU 288 -39.275 -17.902 -8.630 0.00 0.00 +0.000 C +ATOM 1856 HA GLU 288 -38.451 -17.615 -8.134 0.00 0.00 +0.000 HD +ATOM 1857 CB GLU 288 -40.025 -18.823 -7.677 0.00 0.00 +0.000 C +ATOM 1858 HB2 GLU 288 -40.347 -18.280 -6.921 0.00 0.00 +0.000 HD +ATOM 1859 HB3 GLU 288 -40.765 -19.239 -8.175 0.00 0.00 +0.000 HD +ATOM 1860 CG GLU 288 -39.173 -19.947 -7.101 0.00 0.00 +0.000 C +ATOM 1861 HG2 GLU 288 -39.013 -20.608 -7.809 0.00 0.00 +0.000 HD +ATOM 1862 HG3 GLU 288 -38.341 -19.560 -6.753 0.00 0.00 +0.000 HD +ATOM 1863 CD GLU 288 -39.856 -20.673 -5.944 0.00 0.00 +0.000 C +ATOM 1864 OE1 GLU 288 -39.451 -20.469 -4.775 0.00 0.00 +0.000 OA +ATOM 1865 OE2 GLU 288 -40.804 -21.433 -6.218 0.00 0.00 +0.000 OA +ATOM 1866 C GLU 288 -38.859 -18.634 -9.919 0.00 0.00 +0.000 C +ATOM 1867 O GLU 288 -37.709 -19.041 -10.060 0.00 0.00 +0.000 OA +ATOM 1868 N PRO 289 -39.785 -18.801 -10.879 0.00 0.00 +0.000 N +ATOM 1869 CD PRO 289 -41.247 -18.648 -10.751 0.00 0.00 +0.000 C +ATOM 1870 HD2 PRO 289 -41.522 -17.719 -10.984 0.00 0.00 +0.000 HD +ATOM 1871 HD3 PRO 289 -41.541 -18.866 -9.823 0.00 0.00 +0.000 HD +ATOM 1872 CG PRO 289 -41.764 -19.645 -11.745 0.00 0.00 +0.000 C +ATOM 1873 HG2 PRO 289 -42.678 -19.407 -12.055 0.00 0.00 +0.000 HD +ATOM 1874 HG3 PRO 289 -41.753 -20.566 -11.372 0.00 0.00 +0.000 HD +ATOM 1875 CB PRO 289 -40.780 -19.528 -12.878 0.00 0.00 +0.000 C +ATOM 1876 HB2 PRO 289 -40.935 -18.694 -13.394 0.00 0.00 +0.000 HD +ATOM 1877 HB3 PRO 289 -40.829 -20.321 -13.472 0.00 0.00 +0.000 HD +ATOM 1878 CA PRO 289 -39.443 -19.476 -12.140 0.00 0.00 +0.000 C +ATOM 1879 HA PRO 289 -39.121 -20.408 -11.970 0.00 0.00 +0.000 HD +ATOM 1880 C PRO 289 -38.387 -18.666 -12.901 0.00 0.00 +0.000 C +ATOM 1881 O PRO 289 -37.498 -19.231 -13.534 0.00 0.00 +0.000 OA +ATOM 1882 N LEU 290 -38.485 -17.340 -12.828 0.00 0.00 +0.000 N +ATOM 1883 H LEU 290 -39.281 -16.987 -12.273 0.00 0.00 +0.000 HD +ATOM 1884 CA LEU 290 -37.515 -16.476 -13.500 0.00 0.00 +0.000 C +ATOM 1885 HA LEU 290 -37.463 -16.744 -14.466 0.00 0.00 +0.000 HD +ATOM 1886 CB LEU 290 -37.923 -15.009 -13.387 0.00 0.00 +0.000 C +ATOM 1887 HB2 LEU 290 -38.773 -14.889 -13.868 0.00 0.00 +0.000 HD +ATOM 1888 HB3 LEU 290 -37.998 -14.783 -12.434 0.00 0.00 +0.000 HD +ATOM 1889 CG LEU 290 -36.903 -14.052 -14.009 0.00 0.00 +0.000 C +ATOM 1890 HG LEU 290 -36.003 -14.241 -13.620 0.00 0.00 +0.000 HD +ATOM 1891 CD1 LEU 290 -36.856 -14.244 -15.514 0.00 0.00 +0.000 C +ATOM 1892 HD11 LEU 290 -37.759 -14.059 -15.905 0.00 0.00 +0.000 HD +ATOM 1893 HD12 LEU 290 -36.187 -13.615 -15.913 0.00 0.00 +0.000 HD +ATOM 1894 HD13 LEU 290 -36.591 -15.186 -15.725 0.00 0.00 +0.000 HD +ATOM 1895 CD2 LEU 290 -37.269 -12.634 -13.665 0.00 0.00 +0.000 C +ATOM 1896 HD21 LEU 290 -37.271 -12.512 -12.669 0.00 0.00 +0.000 HD +ATOM 1897 HD22 LEU 290 -36.604 -12.000 -14.070 0.00 0.00 +0.000 HD +ATOM 1898 HD23 LEU 290 -38.182 -12.419 -14.021 0.00 0.00 +0.000 HD +ATOM 1899 C LEU 290 -36.131 -16.644 -12.878 0.00 0.00 +0.000 C +ATOM 1900 O LEU 290 -35.124 -16.698 -13.586 0.00 0.00 +0.000 OA +ATOM 1901 N ALA 291 -36.087 -16.709 -11.550 0.00 0.00 +0.000 N +ATOM 1902 H ALA 291 -37.001 -16.638 -11.075 0.00 0.00 +0.000 HD +ATOM 1903 CA ALA 291 -34.817 -16.870 -10.849 0.00 0.00 +0.000 C +ATOM 1904 HA ALA 291 -34.208 -16.116 -11.104 0.00 0.00 +0.000 HD +ATOM 1905 CB ALA 291 -35.032 -16.836 -9.329 0.00 0.00 +0.000 C +ATOM 1906 HB1 ALA 291 -35.841 -16.289 -9.125 0.00 0.00 +0.000 HD +ATOM 1907 HB2 ALA 291 -35.161 -17.767 -8.996 0.00 0.00 +0.000 HD +ATOM 1908 HB3 ALA 291 -34.231 -16.430 -8.894 0.00 0.00 +0.000 HD +ATOM 1909 C ALA 291 -34.166 -18.185 -11.261 0.00 0.00 +0.000 C +ATOM 1910 O ALA 291 -32.949 -18.275 -11.381 0.00 0.00 +0.000 OA +ATOM 1911 N GLU 292 -34.989 -19.204 -11.477 0.00 0.00 +0.000 N +ATOM 1912 H GLU 292 -35.994 -18.993 -11.330 0.00 0.00 +0.000 HD +ATOM 1913 CA GLU 292 -34.487 -20.500 -11.887 0.00 0.00 +0.000 C +ATOM 1914 HA GLU 292 -33.766 -20.804 -11.261 0.00 0.00 +0.000 HD +ATOM 1915 CB GLU 292 -35.612 -21.538 -11.847 0.00 0.00 +0.000 C +ATOM 1916 HB2 GLU 292 -36.072 -21.445 -10.981 0.00 0.00 +0.000 HD +ATOM 1917 HB3 GLU 292 -36.212 -21.357 -12.606 0.00 0.00 +0.000 HD +ATOM 1918 CG GLU 292 -35.134 -22.972 -11.966 0.00 0.00 +0.000 C +ATOM 1919 HG2 GLU 292 -34.917 -23.149 -12.905 0.00 0.00 +0.000 HD +ATOM 1920 HG3 GLU 292 -34.367 -23.095 -11.369 0.00 0.00 +0.000 HD +ATOM 1921 CD GLU 292 -36.204 -23.960 -11.547 0.00 0.00 +0.000 C +ATOM 1922 OE1 GLU 292 -36.975 -23.633 -10.618 0.00 0.00 +0.000 OA +ATOM 1923 OE2 GLU 292 -36.262 -25.059 -12.129 0.00 0.00 +0.000 OA +ATOM 1924 C GLU 292 -33.919 -20.405 -13.302 0.00 0.00 +0.000 C +ATOM 1925 O GLU 292 -32.898 -21.015 -13.600 0.00 0.00 +0.000 OA +ATOM 1926 N SER 293 -34.587 -19.641 -14.168 0.00 0.00 +0.000 N +ATOM 1927 H SER 293 -35.438 -19.189 -13.786 0.00 0.00 +0.000 HD +ATOM 1928 CA SER 293 -34.133 -19.468 -15.552 0.00 0.00 +0.000 C +ATOM 1929 HA SER 293 -34.007 -20.383 -15.953 0.00 0.00 +0.000 HD +ATOM 1930 CB SER 293 -35.161 -18.677 -16.365 0.00 0.00 +0.000 C +ATOM 1931 HB2 SER 293 -35.388 -17.844 -15.872 0.00 0.00 +0.000 HD +ATOM 1932 HB3 SER 293 -34.768 -18.458 -17.252 0.00 0.00 +0.000 HD +ATOM 1933 OG SER 293 -36.342 -19.437 -16.558 0.00 0.00 +0.000 OA +ATOM 1934 HG SER 293 -36.848 -19.490 -15.698 0.00 0.00 +0.000 HD +ATOM 1935 C SER 293 -32.793 -18.743 -15.604 0.00 0.00 +0.000 C +ATOM 1936 O SER 293 -31.915 -19.092 -16.394 0.00 0.00 +0.000 OA +ATOM 1937 N ILE 294 -32.644 -17.729 -14.760 0.00 0.00 +0.000 N +ATOM 1938 H ILE 294 -33.460 -17.532 -14.158 0.00 0.00 +0.000 HD +ATOM 1939 CA ILE 294 -31.398 -16.965 -14.712 0.00 0.00 +0.000 C +ATOM 1940 HA ILE 294 -31.183 -16.718 -15.657 0.00 0.00 +0.000 HD +ATOM 1941 CB ILE 294 -31.517 -15.748 -13.765 0.00 0.00 +0.000 C +ATOM 1942 HB ILE 294 -31.826 -16.078 -12.882 0.00 0.00 +0.000 HD +ATOM 1943 CG2 ILE 294 -30.166 -15.058 -13.630 0.00 0.00 +0.000 C +ATOM 1944 HG21 ILE 294 -30.246 -14.291 -12.996 0.00 0.00 +0.000 HD +ATOM 1945 HG22 ILE 294 -29.493 -15.709 -13.283 0.00 0.00 +0.000 HD +ATOM 1946 HG23 ILE 294 -29.873 -14.722 -14.523 0.00 0.00 +0.000 HD +ATOM 1947 CG1 ILE 294 -32.565 -14.763 -14.298 0.00 0.00 +0.000 C +ATOM 1948 HG12 ILE 294 -32.268 -14.440 -15.194 0.00 0.00 +0.000 HD +ATOM 1949 HG13 ILE 294 -33.429 -15.253 -14.404 0.00 0.00 +0.000 HD +ATOM 1950 CD1 ILE 294 -32.797 -13.561 -13.395 0.00 0.00 +0.000 C +ATOM 1951 HD11 ILE 294 -31.941 -13.059 -13.292 0.00 0.00 +0.000 HD +ATOM 1952 HD12 ILE 294 -33.488 -12.971 -13.807 0.00 0.00 +0.000 HD +ATOM 1953 HD13 ILE 294 -33.112 -13.878 -12.503 0.00 0.00 +0.000 HD +ATOM 1954 C ILE 294 -30.263 -17.863 -14.226 0.00 0.00 +0.000 C +ATOM 1955 O ILE 294 -29.157 -17.838 -14.768 0.00 0.00 +0.000 OA +ATOM 1956 N THR 295 -30.545 -18.657 -13.198 0.00 0.00 +0.000 N +ATOM 1957 H THR 295 -31.511 -18.575 -12.833 0.00 0.00 +0.000 HD +ATOM 1958 CA THR 295 -29.547 -19.564 -12.648 0.00 0.00 +0.000 C +ATOM 1959 HA THR 295 -28.737 -19.030 -12.387 0.00 0.00 +0.000 HD +ATOM 1960 CB THR 295 -30.079 -20.312 -11.406 0.00 0.00 +0.000 C +ATOM 1961 HB THR 295 -30.869 -20.891 -11.687 0.00 0.00 +0.000 HD +ATOM 1962 CG2 THR 295 -28.976 -21.162 -10.787 0.00 0.00 +0.000 C +ATOM 1963 HG21 THR 295 -28.350 -20.578 -10.266 0.00 0.00 +0.000 HD +ATOM 1964 HG22 THR 295 -29.378 -21.844 -10.172 0.00 0.00 +0.000 HD +ATOM 1965 HG23 THR 295 -28.464 -21.631 -11.509 0.00 0.00 +0.000 HD +ATOM 1966 OG1 THR 295 -30.539 -19.361 -10.441 0.00 0.00 +0.000 OA +ATOM 1967 HG1 THR 295 -31.401 -18.941 -10.746 0.00 0.00 +0.000 HD +ATOM 1968 C THR 295 -29.129 -20.588 -13.697 0.00 0.00 +0.000 C +ATOM 1969 O THR 295 -27.951 -20.909 -13.808 0.00 0.00 +0.000 OA +ATOM 1970 N ASP 296 -30.092 -21.093 -14.469 0.00 0.00 +0.000 N +ATOM 1971 H ASP 296 -31.041 -20.749 -14.276 0.00 0.00 +0.000 HD +ATOM 1972 CA ASP 296 -29.769 -22.070 -15.510 0.00 0.00 +0.000 C +ATOM 1973 HA ASP 296 -29.272 -22.822 -15.064 0.00 0.00 +0.000 HD +ATOM 1974 CB ASP 296 -31.028 -22.577 -16.218 0.00 0.00 +0.000 C +ATOM 1975 HB2 ASP 296 -31.595 -21.788 -16.432 0.00 0.00 +0.000 HD +ATOM 1976 HB3 ASP 296 -30.744 -23.035 -17.054 0.00 0.00 +0.000 HD +ATOM 1977 CG ASP 296 -31.823 -23.540 -15.375 0.00 0.00 +0.000 C +ATOM 1978 OD1 ASP 296 -31.238 -24.168 -14.466 0.00 0.00 +0.000 OA +ATOM 1979 OD2 ASP 296 -33.035 -23.683 -15.635 0.00 0.00 +0.000 OA +ATOM 1980 C ASP 296 -28.836 -21.464 -16.544 0.00 0.00 +0.000 C +ATOM 1981 O ASP 296 -27.879 -22.103 -16.968 0.00 0.00 +0.000 OA +ATOM 1982 N VAL 297 -29.112 -20.227 -16.948 0.00 0.00 +0.000 N +ATOM 1983 H VAL 297 -29.944 -19.797 -16.515 0.00 0.00 +0.000 HD +ATOM 1984 CA VAL 297 -28.271 -19.561 -17.936 0.00 0.00 +0.000 C +ATOM 1985 HA VAL 297 -28.191 -20.165 -18.739 0.00 0.00 +0.000 HD +ATOM 1986 CB VAL 297 -28.898 -18.220 -18.388 0.00 0.00 +0.000 C +ATOM 1987 HB VAL 297 -29.063 -17.675 -17.576 0.00 0.00 +0.000 HD +ATOM 1988 CG1 VAL 297 -27.904 -17.436 -19.256 0.00 0.00 +0.000 C +ATOM 1989 HG11 VAL 297 -28.385 -16.690 -19.711 0.00 0.00 +0.000 HD +ATOM 1990 HG12 VAL 297 -27.181 -17.068 -18.675 0.00 0.00 +0.000 HD +ATOM 1991 HG13 VAL 297 -27.510 -18.049 -19.937 0.00 0.00 +0.000 HD +ATOM 1992 CG2 VAL 297 -30.184 -18.490 -19.161 0.00 0.00 +0.000 C +ATOM 1993 HG21 VAL 297 -30.804 -19.028 -18.590 0.00 0.00 +0.000 HD +ATOM 1994 HG22 VAL 297 -30.614 -17.620 -19.399 0.00 0.00 +0.000 HD +ATOM 1995 HG23 VAL 297 -29.966 -18.998 -19.994 0.00 0.00 +0.000 HD +ATOM 1996 C VAL 297 -26.868 -19.315 -17.393 0.00 0.00 +0.000 C +ATOM 1997 O VAL 297 -25.877 -19.574 -18.071 0.00 0.00 +0.000 OA +ATOM 1998 N LEU 298 -26.787 -18.828 -16.159 0.00 0.00 +0.000 N +ATOM 1999 H LEU 298 -27.691 -18.665 -15.687 0.00 0.00 +0.000 HD +ATOM 2000 CA LEU 298 -25.487 -18.551 -15.537 0.00 0.00 +0.000 C +ATOM 2001 HA LEU 298 -24.962 -17.940 -16.154 0.00 0.00 +0.000 HD +ATOM 2002 CB LEU 298 -25.674 -17.814 -14.206 0.00 0.00 +0.000 C +ATOM 2003 HB2 LEU 298 -26.062 -16.920 -14.406 0.00 0.00 +0.000 HD +ATOM 2004 HB3 LEU 298 -26.299 -18.348 -13.649 0.00 0.00 +0.000 HD +ATOM 2005 CG LEU 298 -24.404 -17.591 -13.390 0.00 0.00 +0.000 C +ATOM 2006 HG LEU 298 -23.978 -18.472 -13.199 0.00 0.00 +0.000 HD +ATOM 2007 CD1 LEU 298 -23.426 -16.719 -14.175 0.00 0.00 +0.000 C +ATOM 2008 HD11 LEU 298 -23.852 -15.836 -14.370 0.00 0.00 +0.000 HD +ATOM 2009 HD12 LEU 298 -22.598 -16.579 -13.633 0.00 0.00 +0.000 HD +ATOM 2010 HD13 LEU 298 -23.191 -17.174 -15.033 0.00 0.00 +0.000 HD +ATOM 2011 CD2 LEU 298 -24.747 -16.911 -12.069 0.00 0.00 +0.000 C +ATOM 2012 HD21 LEU 298 -25.375 -17.490 -11.549 0.00 0.00 +0.000 HD +ATOM 2013 HD22 LEU 298 -23.910 -16.769 -11.540 0.00 0.00 +0.000 HD +ATOM 2014 HD23 LEU 298 -25.181 -16.028 -12.251 0.00 0.00 +0.000 HD +ATOM 2015 C LEU 298 -24.646 -19.810 -15.285 0.00 0.00 +0.000 C +ATOM 2016 O LEU 298 -23.514 -19.923 -15.764 0.00 0.00 +0.000 OA +ATOM 2017 N VAL 299 -25.210 -20.758 -14.545 0.00 0.00 +0.000 N +ATOM 2018 H VAL 299 -26.179 -20.563 -14.244 0.00 0.00 +0.000 HD +ATOM 2019 CA VAL 299 -24.480 -21.965 -14.208 0.00 0.00 +0.000 C +ATOM 2020 HA VAL 299 -23.540 -21.688 -13.894 0.00 0.00 +0.000 HD +ATOM 2021 CB VAL 299 -25.121 -22.663 -12.966 0.00 0.00 +0.000 C +ATOM 2022 HB VAL 299 -26.039 -22.940 -13.228 0.00 0.00 +0.000 HD +ATOM 2023 CG1 VAL 299 -24.354 -23.921 -12.597 0.00 0.00 +0.000 C +ATOM 2024 HG11 VAL 299 -24.502 -24.133 -11.630 0.00 0.00 +0.000 HD +ATOM 2025 HG12 VAL 299 -24.675 -24.686 -13.157 0.00 0.00 +0.000 HD +ATOM 2026 HG13 VAL 299 -23.377 -23.778 -12.759 0.00 0.00 +0.000 HD +ATOM 2027 CG2 VAL 299 -25.133 -21.702 -11.781 0.00 0.00 +0.000 C +ATOM 2028 HG21 VAL 299 -25.080 -20.763 -12.119 0.00 0.00 +0.000 HD +ATOM 2029 HG22 VAL 299 -25.979 -21.828 -11.265 0.00 0.00 +0.000 HD +ATOM 2030 HG23 VAL 299 -24.348 -21.895 -11.194 0.00 0.00 +0.000 HD +ATOM 2031 C VAL 299 -24.305 -22.980 -15.332 0.00 0.00 +0.000 C +ATOM 2032 O VAL 299 -23.236 -23.584 -15.445 0.00 0.00 +0.000 OA +ATOM 2033 N ARG 300 -25.322 -23.160 -16.172 0.00 0.00 +0.000 N +ATOM 2034 H ARG 300 -26.144 -22.561 -16.006 0.00 0.00 +0.000 HD +ATOM 2035 CA ARG 300 -25.236 -24.151 -17.242 0.00 0.00 +0.000 C +ATOM 2036 HA ARG 300 -24.816 -25.000 -16.861 0.00 0.00 +0.000 HD +ATOM 2037 CB ARG 300 -26.636 -24.560 -17.707 0.00 0.00 +0.000 C +ATOM 2038 HB2 ARG 300 -27.022 -23.808 -18.242 0.00 0.00 +0.000 HD +ATOM 2039 HB3 ARG 300 -26.551 -25.370 -18.287 0.00 0.00 +0.000 HD +ATOM 2040 CG ARG 300 -27.633 -24.894 -16.588 0.00 0.00 +0.000 C +ATOM 2041 HG2 ARG 300 -27.621 -24.150 -15.906 0.00 0.00 +0.000 HD +ATOM 2042 HG3 ARG 300 -28.562 -24.940 -16.981 0.00 0.00 +0.000 HD +ATOM 2043 CD ARG 300 -27.369 -26.208 -15.855 0.00 0.00 +0.000 C +ATOM 2044 HD2 ARG 300 -27.318 -26.931 -16.523 0.00 0.00 +0.000 HD +ATOM 2045 HD3 ARG 300 -26.528 -26.116 -15.348 0.00 0.00 +0.000 HD +ATOM 2046 NE ARG 300 -28.473 -26.492 -14.916 0.00 0.00 +0.000 N +ATOM 2047 HE ARG 300 -29.244 -25.837 -14.901 0.00 0.00 +0.000 HD +ATOM 2048 CZ ARG 300 -28.533 -27.537 -14.093 0.00 0.00 +0.000 C +ATOM 2049 NH1 ARG 300 -27.546 -28.413 -14.078 0.00 0.00 +0.000 N +ATOM 2050 HH11 ARG 300 -26.740 -28.308 -14.653 0.00 0.00 +0.000 HD +ATOM 2051 HH12 ARG 300 -27.604 -29.218 -13.465 0.00 0.00 +0.000 HD +ATOM 2052 NH2 ARG 300 -29.593 -27.723 -13.305 0.00 0.00 +0.000 N +ATOM 2053 HH21 ARG 300 -30.337 -27.049 -13.330 0.00 0.00 +0.000 HD +ATOM 2054 HH22 ARG 300 -29.643 -28.511 -12.706 0.00 0.00 +0.000 HD +ATOM 2055 C ARG 300 -24.416 -23.705 -18.443 0.00 0.00 +0.000 C +ATOM 2056 O ARG 300 -23.952 -24.554 -19.191 0.00 0.00 +0.000 OA +ATOM 2057 N THR 301 -24.238 -22.398 -18.647 0.00 0.00 +0.000 N +ATOM 2058 H THR 301 -24.694 -21.774 -17.981 0.00 0.00 +0.000 HD +ATOM 2059 CA THR 301 -23.423 -21.951 -19.781 0.00 0.00 +0.000 C +ATOM 2060 HA THR 301 -23.268 -22.748 -20.395 0.00 0.00 +0.000 HD +ATOM 2061 CB THR 301 -24.154 -20.889 -20.679 0.00 0.00 +0.000 C +ATOM 2062 HB THR 301 -23.608 -20.770 -21.533 0.00 0.00 +0.000 HD +ATOM 2063 CG2 THR 301 -25.556 -21.360 -21.005 0.00 0.00 +0.000 C +ATOM 2064 HG21 THR 301 -25.521 -22.100 -21.682 0.00 0.00 +0.000 HD +ATOM 2065 HG22 THR 301 -26.006 -21.699 -20.175 0.00 0.00 +0.000 HD +ATOM 2066 HG23 THR 301 -26.095 -20.601 -21.380 0.00 0.00 +0.000 HD +ATOM 2067 OG1 THR 301 -24.228 -19.629 -20.004 0.00 0.00 +0.000 OA +ATOM 2068 HG1 THR 301 -24.915 -19.664 -19.270 0.00 0.00 +0.000 HD +ATOM 2069 C THR 301 -22.053 -21.387 -19.382 0.00 0.00 +0.000 C +ATOM 2070 O THR 301 -21.204 -21.174 -20.242 0.00 0.00 +0.000 OA +ATOM 2071 N LYS 302 -21.823 -21.154 -18.093 0.00 0.00 +0.000 N +ATOM 2072 H LYS 302 -22.586 -21.387 -17.452 0.00 0.00 +0.000 HD +ATOM 2073 CA LYS 302 -20.535 -20.595 -17.674 0.00 0.00 +0.000 C +ATOM 2074 HA LYS 302 -19.895 -20.627 -18.471 0.00 0.00 +0.000 HD +ATOM 2075 CB LYS 302 -20.686 -19.101 -17.320 0.00 0.00 +0.000 C +ATOM 2076 HB2 LYS 302 -21.279 -19.036 -16.517 0.00 0.00 +0.000 HD +ATOM 2077 HB3 LYS 302 -19.778 -18.749 -17.091 0.00 0.00 +0.000 HD +ATOM 2078 CG LYS 302 -21.274 -18.240 -18.425 0.00 0.00 +0.000 C +ATOM 2079 HG2 LYS 302 -22.184 -18.595 -18.668 0.00 0.00 +0.000 HD +ATOM 2080 HG3 LYS 302 -21.379 -17.298 -18.087 0.00 0.00 +0.000 HD +ATOM 2081 CD LYS 302 -20.412 -18.213 -19.681 0.00 0.00 +0.000 C +ATOM 2082 HD2 LYS 302 -19.526 -17.824 -19.459 0.00 0.00 +0.000 HD +ATOM 2083 HD3 LYS 302 -20.313 -19.137 -20.028 0.00 0.00 +0.000 HD +ATOM 2084 CE LYS 302 -21.052 -17.352 -20.782 0.00 0.00 +0.000 C +ATOM 2085 HE2 LYS 302 -21.978 -17.698 -20.960 0.00 0.00 +0.000 HD +ATOM 2086 HE3 LYS 302 -21.119 -16.406 -20.450 0.00 0.00 +0.000 HD +ATOM 2087 NZ LYS 302 -20.267 -17.370 -22.056 0.00 0.00 +0.000 N +ATOM 2088 HZ1 LYS 302 -19.328 -17.089 -21.866 0.00 0.00 +0.000 HD +ATOM 2089 HZ2 LYS 302 -20.274 -18.295 -22.432 0.00 0.00 +0.000 HD +ATOM 2090 HZ3 LYS 302 -20.684 -16.738 -22.707 0.00 0.00 +0.000 HD +ATOM 2091 C LYS 302 -19.875 -21.312 -16.498 0.00 0.00 +0.000 C +ATOM 2092 O LYS 302 -19.105 -20.698 -15.763 0.00 0.00 +0.000 OA +ATOM 2093 N ARG 303 -20.147 -22.604 -16.328 0.00 0.00 +0.000 N +ATOM 2094 H ARG 303 -20.771 -23.023 -17.027 0.00 0.00 +0.000 HD +ATOM 2095 CA ARG 303 -19.568 -23.337 -15.200 0.00 0.00 +0.000 C +ATOM 2096 HA ARG 303 -19.917 -22.926 -14.337 0.00 0.00 +0.000 HD +ATOM 2097 CB ARG 303 -20.039 -24.794 -15.180 0.00 0.00 +0.000 C +ATOM 2098 HB2 ARG 303 -21.023 -24.809 -15.259 0.00 0.00 +0.000 HD +ATOM 2099 HB3 ARG 303 -19.609 -25.276 -15.927 0.00 0.00 +0.000 HD +ATOM 2100 CG ARG 303 -19.662 -25.522 -13.875 0.00 0.00 +0.000 C +ATOM 2101 HG2 ARG 303 -18.674 -25.478 -13.754 0.00 0.00 +0.000 HD +ATOM 2102 HG3 ARG 303 -20.121 -25.075 -13.112 0.00 0.00 +0.000 HD +ATOM 2103 CD ARG 303 -20.081 -26.981 -13.901 0.00 0.00 +0.000 C +ATOM 2104 HD2 ARG 303 -19.638 -27.418 -14.690 0.00 0.00 +0.000 HD +ATOM 2105 HD3 ARG 303 -19.741 -27.417 -13.060 0.00 0.00 +0.000 HD +ATOM 2106 NE ARG 303 -21.528 -27.189 -13.993 0.00 0.00 +0.000 N +ATOM 2107 HE ARG 303 -21.924 -27.307 -14.916 0.00 0.00 +0.000 HD +ATOM 2108 CZ ARG 303 -22.358 -27.234 -12.956 0.00 0.00 +0.000 C +ATOM 2109 NH1 ARG 303 -21.903 -27.077 -11.718 0.00 0.00 +0.000 N +ATOM 2110 HH11 ARG 303 -20.936 -26.903 -11.548 0.00 0.00 +0.000 HD +ATOM 2111 HH12 ARG 303 -22.540 -27.133 -10.943 0.00 0.00 +0.000 HD +ATOM 2112 NH2 ARG 303 -23.646 -27.480 -13.158 0.00 0.00 +0.000 N +ATOM 2113 HH21 ARG 303 -23.990 -27.611 -14.090 0.00 0.00 +0.000 HD +ATOM 2114 HH22 ARG 303 -24.275 -27.534 -12.383 0.00 0.00 +0.000 HD +ATOM 2115 C ARG 303 -18.046 -23.309 -15.169 0.00 0.00 +0.000 C +ATOM 2116 O ARG 303 -17.450 -23.016 -14.134 0.00 0.00 +0.000 OA +ATOM 2117 N ASP 304 -17.408 -23.618 -16.294 0.00 0.00 +0.000 N +ATOM 2118 H ASP 304 -18.010 -23.844 -17.098 0.00 0.00 +0.000 HD +ATOM 2119 CA ASP 304 -15.945 -23.624 -16.343 0.00 0.00 +0.000 C +ATOM 2120 HA ASP 304 -15.632 -24.350 -15.719 0.00 0.00 +0.000 HD +ATOM 2121 CB ASP 304 -15.438 -23.869 -17.767 0.00 0.00 +0.000 C +ATOM 2122 HB2 ASP 304 -15.813 -23.158 -18.351 0.00 0.00 +0.000 HD +ATOM 2123 HB3 ASP 304 -14.446 -23.818 -17.752 0.00 0.00 +0.000 HD +ATOM 2124 CG ASP 304 -15.852 -25.219 -18.310 0.00 0.00 +0.000 C +ATOM 2125 OD1 ASP 304 -15.508 -26.250 -17.690 0.00 0.00 +0.000 OA +ATOM 2126 OD2 ASP 304 -16.522 -25.239 -19.364 0.00 0.00 +0.000 OA +ATOM 2127 C ASP 304 -15.375 -22.313 -15.830 0.00 0.00 +0.000 C +ATOM 2128 O ASP 304 -14.464 -22.313 -15.010 0.00 0.00 +0.000 OA +ATOM 2129 N TRP 305 -15.908 -21.198 -16.320 0.00 0.00 +0.000 N +ATOM 2130 H TRP 305 -16.665 -21.343 -17.015 0.00 0.00 +0.000 HD +ATOM 2131 CA TRP 305 -15.447 -19.875 -15.898 0.00 0.00 +0.000 C +ATOM 2132 HA TRP 305 -14.455 -19.833 -16.050 0.00 0.00 +0.000 HD +ATOM 2133 CB TRP 305 -16.178 -18.769 -16.674 0.00 0.00 +0.000 C +ATOM 2134 HB2 TRP 305 -16.129 -18.965 -17.644 0.00 0.00 +0.000 HD +ATOM 2135 HB3 TRP 305 -17.119 -18.723 -16.367 0.00 0.00 +0.000 HD +ATOM 2136 CG TRP 305 -15.583 -17.381 -16.476 0.00 0.00 +0.000 A +ATOM 2137 CD1 TRP 305 -14.605 -16.794 -17.230 0.00 0.00 +0.000 A +ATOM 2138 HD1 TRP 305 -14.170 -17.210 -18.028 0.00 0.00 +0.000 HD +ATOM 2139 NE1 TRP 305 -14.305 -15.549 -16.734 0.00 0.00 +0.000 N +ATOM 2140 HE1 TRP 305 -13.624 -14.921 -17.112 0.00 0.00 +0.000 HD +ATOM 2141 CE2 TRP 305 -15.087 -15.304 -15.639 0.00 0.00 +0.000 A +ATOM 2142 CZ2 TRP 305 -15.143 -14.180 -14.801 0.00 0.00 +0.000 A +ATOM 2143 HZ2 TRP 305 -14.543 -13.394 -14.973 0.00 0.00 +0.000 HD +ATOM 2144 CH2 TRP 305 -16.036 -14.206 -13.758 0.00 0.00 +0.000 A +ATOM 2145 HH2 TRP 305 -16.103 -13.426 -13.138 0.00 0.00 +0.000 HD +ATOM 2146 CZ3 TRP 305 -16.871 -15.317 -13.538 0.00 0.00 +0.000 A +ATOM 2147 HZ3 TRP 305 -17.511 -15.313 -12.780 0.00 0.00 +0.000 HD +ATOM 2148 CE3 TRP 305 -16.817 -16.438 -14.373 0.00 0.00 +0.000 A +ATOM 2149 HE3 TRP 305 -17.412 -17.214 -14.203 0.00 0.00 +0.000 HD +ATOM 2150 CD2 TRP 305 -15.912 -16.433 -15.442 0.00 0.00 +0.000 A +ATOM 2151 C TRP 305 -15.692 -19.669 -14.402 0.00 0.00 +0.000 C +ATOM 2152 O TRP 305 -14.809 -19.222 -13.675 0.00 0.00 +0.000 OA +ATOM 2153 N LEU 306 -16.897 -19.995 -13.943 0.00 0.00 +0.000 N +ATOM 2154 H LEU 306 -17.551 -20.370 -14.647 0.00 0.00 +0.000 HD +ATOM 2155 CA LEU 306 -17.230 -19.819 -12.533 0.00 0.00 +0.000 C +ATOM 2156 HA LEU 306 -17.155 -18.836 -12.307 0.00 0.00 +0.000 HD +ATOM 2157 CB LEU 306 -18.679 -20.241 -12.273 0.00 0.00 +0.000 C +ATOM 2158 HB2 LEU 306 -18.811 -21.132 -12.666 0.00 0.00 +0.000 HD +ATOM 2159 HB3 LEU 306 -18.829 -20.232 -11.303 0.00 0.00 +0.000 HD +ATOM 2160 CG LEU 306 -19.695 -19.297 -12.911 0.00 0.00 +0.000 C +ATOM 2161 HG LEU 306 -19.384 -19.058 -13.830 0.00 0.00 +0.000 HD +ATOM 2162 CD1 LEU 306 -21.053 -19.967 -12.993 0.00 0.00 +0.000 C +ATOM 2163 HD11 LEU 306 -21.366 -20.209 -12.073 0.00 0.00 +0.000 HD +ATOM 2164 HD12 LEU 306 -21.713 -19.341 -13.412 0.00 0.00 +0.000 HD +ATOM 2165 HD13 LEU 306 -20.986 -20.797 -13.548 0.00 0.00 +0.000 HD +ATOM 2166 CD2 LEU 306 -19.769 -18.011 -12.098 0.00 0.00 +0.000 C +ATOM 2167 HD21 LEU 306 -18.869 -17.573 -12.083 0.00 0.00 +0.000 HD +ATOM 2168 HD22 LEU 306 -20.434 -17.391 -12.514 0.00 0.00 +0.000 HD +ATOM 2169 HD23 LEU 306 -20.052 -18.223 -11.162 0.00 0.00 +0.000 HD +ATOM 2170 C LEU 306 -16.291 -20.594 -11.618 0.00 0.00 +0.000 C +ATOM 2171 O LEU 306 -15.801 -20.061 -10.624 0.00 0.00 +0.000 OA +ATOM 2172 N VAL 307 -16.037 -21.850 -11.955 0.00 0.00 +0.000 N +ATOM 2173 H VAL 307 -16.500 -22.182 -12.814 0.00 0.00 +0.000 HD +ATOM 2174 CA VAL 307 -15.155 -22.673 -11.136 0.00 0.00 +0.000 C +ATOM 2175 HA VAL 307 -15.501 -22.661 -10.192 0.00 0.00 +0.000 HD +ATOM 2176 CB VAL 307 -15.143 -24.141 -11.644 0.00 0.00 +0.000 C +ATOM 2177 HB VAL 307 -14.859 -24.122 -12.597 0.00 0.00 +0.000 HD +ATOM 2178 CG1 VAL 307 -14.119 -24.965 -10.883 0.00 0.00 +0.000 C +ATOM 2179 HG11 VAL 307 -14.459 -25.899 -10.766 0.00 0.00 +0.000 HD +ATOM 2180 HG12 VAL 307 -13.259 -24.987 -11.394 0.00 0.00 +0.000 HD +ATOM 2181 HG13 VAL 307 -13.960 -24.556 -9.984 0.00 0.00 +0.000 HD +ATOM 2182 CG2 VAL 307 -16.537 -24.742 -11.481 0.00 0.00 +0.000 C +ATOM 2183 HG21 VAL 307 -16.594 -25.201 -10.595 0.00 0.00 +0.000 HD +ATOM 2184 HG22 VAL 307 -17.216 -24.011 -11.528 0.00 0.00 +0.000 HD +ATOM 2185 HG23 VAL 307 -16.697 -25.401 -12.215 0.00 0.00 +0.000 HD +ATOM 2186 C VAL 307 -13.741 -22.099 -11.125 0.00 0.00 +0.000 C +ATOM 2187 O VAL 307 -13.110 -21.996 -10.069 0.00 0.00 +0.000 OA +ATOM 2188 N LYS 308 -13.249 -21.704 -12.293 0.00 0.00 +0.000 N +ATOM 2189 H LYS 308 -13.872 -21.830 -13.103 0.00 0.00 +0.000 HD +ATOM 2190 CA LYS 308 -11.906 -21.133 -12.378 0.00 0.00 +0.000 C +ATOM 2191 HA LYS 308 -11.246 -21.792 -12.001 0.00 0.00 +0.000 HD +ATOM 2192 CB LYS 308 -11.521 -20.884 -13.844 0.00 0.00 +0.000 C +ATOM 2193 HB2 LYS 308 -11.676 -21.725 -14.353 0.00 0.00 +0.000 HD +ATOM 2194 HB3 LYS 308 -12.102 -20.157 -14.198 0.00 0.00 +0.000 HD +ATOM 2195 CG LYS 308 -10.063 -20.470 -14.035 0.00 0.00 +0.000 C +ATOM 2196 HG2 LYS 308 -9.967 -19.500 -13.791 0.00 0.00 +0.000 HD +ATOM 2197 HG3 LYS 308 -9.487 -21.017 -13.421 0.00 0.00 +0.000 HD +ATOM 2198 CD LYS 308 -9.578 -20.665 -15.467 0.00 0.00 +0.000 C +ATOM 2199 HD2 LYS 308 -9.666 -21.617 -15.710 0.00 0.00 +0.000 HD +ATOM 2200 HD3 LYS 308 -10.102 -20.084 -16.067 0.00 0.00 +0.000 HD +ATOM 2201 CE LYS 308 -8.105 -20.270 -15.570 0.00 0.00 +0.000 C +ATOM 2202 HE2 LYS 308 -7.729 -20.632 -16.413 0.00 0.00 +0.000 HD +ATOM 2203 HE3 LYS 308 -8.031 -19.281 -15.549 0.00 0.00 +0.000 HD +ATOM 2204 NZ LYS 308 -7.345 -20.845 -14.406 0.00 0.00 +0.000 N +ATOM 2205 HZ1 LYS 308 -6.403 -21.012 -14.685 0.00 0.00 +0.000 HD +ATOM 2206 HZ2 LYS 308 -7.367 -20.193 -13.652 0.00 0.00 +0.000 HD +ATOM 2207 HZ3 LYS 308 -7.775 -21.701 -14.130 0.00 0.00 +0.000 HD +ATOM 2208 C LYS 308 -11.812 -19.834 -11.569 0.00 0.00 +0.000 C +ATOM 2209 O LYS 308 -10.761 -19.522 -11.011 0.00 0.00 +0.000 OA +ATOM 2210 N GLN 309 -12.916 -19.093 -11.480 0.00 0.00 +0.000 N +ATOM 2211 H GLN 309 -13.738 -19.468 -11.979 0.00 0.00 +0.000 HD +ATOM 2212 CA GLN 309 -12.922 -17.846 -10.722 0.00 0.00 +0.000 C +ATOM 2213 HA GLN 309 -11.984 -17.463 -10.743 0.00 0.00 +0.000 HD +ATOM 2214 CB GLN 309 -13.872 -16.832 -11.364 0.00 0.00 +0.000 C +ATOM 2215 HB2 GLN 309 -14.777 -17.254 -11.456 0.00 0.00 +0.000 HD +ATOM 2216 HB3 GLN 309 -13.944 -16.033 -10.761 0.00 0.00 +0.000 HD +ATOM 2217 CG GLN 309 -13.433 -16.350 -12.736 0.00 0.00 +0.000 C +ATOM 2218 HG2 GLN 309 -13.461 -17.122 -13.371 0.00 0.00 +0.000 HD +ATOM 2219 HG3 GLN 309 -14.067 -15.641 -13.045 0.00 0.00 +0.000 HD +ATOM 2220 CD GLN 309 -12.032 -15.779 -12.731 0.00 0.00 +0.000 C +ATOM 2221 OE1 GLN 309 -11.704 -14.917 -11.908 0.00 0.00 +0.000 OA +ATOM 2222 NE2 GLN 309 -11.196 -16.252 -13.647 0.00 0.00 +0.000 N +ATOM 2223 HE21 GLN 309 -10.241 -15.906 -13.714 0.00 0.00 +0.000 HD +ATOM 2224 HE22 GLN 309 -11.525 -16.973 -14.288 0.00 0.00 +0.000 HD +ATOM 2225 C GLN 309 -13.304 -18.048 -9.253 0.00 0.00 +0.000 C +ATOM 2226 O GLN 309 -13.660 -17.099 -8.564 0.00 0.00 +0.000 OA +ATOM 2227 N ARG 310 -13.260 -19.298 -8.798 0.00 0.00 +0.000 N +ATOM 2228 H ARG 310 -12.992 -20.009 -9.518 0.00 0.00 +0.000 HD +ATOM 2229 CA ARG 310 -13.561 -19.655 -7.407 0.00 0.00 +0.000 C +ATOM 2230 HA ARG 310 -13.294 -20.640 -7.265 0.00 0.00 +0.000 HD +ATOM 2231 CB ARG 310 -12.605 -18.913 -6.455 0.00 0.00 +0.000 C +ATOM 2232 HB2 ARG 310 -12.560 -17.965 -6.736 0.00 0.00 +0.000 HD +ATOM 2233 HB3 ARG 310 -12.956 -18.996 -5.534 0.00 0.00 +0.000 HD +ATOM 2234 CG ARG 310 -11.176 -19.478 -6.468 0.00 0.00 +0.000 C +ATOM 2235 HG2 ARG 310 -11.160 -20.344 -5.969 0.00 0.00 +0.000 HD +ATOM 2236 HG3 ARG 310 -10.892 -19.632 -7.414 0.00 0.00 +0.000 HD +ATOM 2237 CD ARG 310 -10.153 -18.538 -5.816 0.00 0.00 +0.000 C +ATOM 2238 HD2 ARG 310 -9.293 -19.041 -5.725 0.00 0.00 +0.000 HD +ATOM 2239 HD3 ARG 310 -10.021 -17.760 -6.432 0.00 0.00 +0.000 HD +ATOM 2240 NE ARG 310 -10.570 -18.050 -4.501 0.00 0.00 +0.000 N +ATOM 2241 HE ARG 310 -10.736 -17.054 -4.406 0.00 0.00 +0.000 HD +ATOM 2242 CZ ARG 310 -10.749 -18.806 -3.424 0.00 0.00 +0.000 C +ATOM 2243 NH1 ARG 310 -10.551 -20.116 -3.478 0.00 0.00 +0.000 N +ATOM 2244 HH11 ARG 310 -10.245 -20.553 -4.321 0.00 0.00 +0.000 HD +ATOM 2245 HH12 ARG 310 -10.709 -20.678 -2.659 0.00 0.00 +0.000 HD +ATOM 2246 NH2 ARG 310 -11.135 -18.238 -2.288 0.00 0.00 +0.000 N +ATOM 2247 HH21 ARG 310 -11.270 -17.247 -2.242 0.00 0.00 +0.000 HD +ATOM 2248 HH22 ARG 310 -11.291 -18.800 -1.475 0.00 0.00 +0.000 HD +ATOM 2249 C ARG 310 -15.009 -19.484 -6.950 0.00 0.00 +0.000 C +ATOM 2250 O ARG 310 -15.268 -19.281 -5.769 0.00 0.00 +0.000 OA +ATOM 2251 N GLY 311 -15.940 -19.577 -7.895 0.00 0.00 +0.000 N +ATOM 2252 H GLY 311 -15.578 -19.721 -8.854 0.00 0.00 +0.000 HD +ATOM 2253 CA GLY 311 -17.353 -19.479 -7.568 0.00 0.00 +0.000 C +ATOM 2254 HA2 GLY 311 -17.898 -19.492 -8.441 0.00 0.00 +0.000 HD +ATOM 2255 HA3 GLY 311 -17.638 -20.331 -7.066 0.00 0.00 +0.000 HD +ATOM 2256 C GLY 311 -17.759 -18.269 -6.753 0.00 0.00 +0.000 C +ATOM 2257 O GLY 311 -17.192 -17.194 -6.911 0.00 0.00 +0.000 OA +ATOM 2258 N TRP 312 -18.734 -18.445 -5.866 0.00 0.00 +0.000 N +ATOM 2259 H TRP 312 -19.110 -19.405 -5.810 0.00 0.00 +0.000 HD +ATOM 2260 CA TRP 312 -19.204 -17.337 -5.056 0.00 0.00 +0.000 C +ATOM 2261 HA TRP 312 -19.419 -16.563 -5.681 0.00 0.00 +0.000 HD +ATOM 2262 CB TRP 312 -20.528 -17.714 -4.385 0.00 0.00 +0.000 C +ATOM 2263 HB2 TRP 312 -20.415 -18.561 -3.904 0.00 0.00 +0.000 HD +ATOM 2264 HB3 TRP 312 -20.812 -16.981 -3.798 0.00 0.00 +0.000 HD +ATOM 2265 CG TRP 312 -21.611 -17.918 -5.408 0.00 0.00 +0.000 A +ATOM 2266 CD1 TRP 312 -22.114 -19.110 -5.855 0.00 0.00 +0.000 A +ATOM 2267 HD1 TRP 312 -21.844 -20.009 -5.517 0.00 0.00 +0.000 HD +ATOM 2268 NE1 TRP 312 -23.050 -18.891 -6.843 0.00 0.00 +0.000 N +ATOM 2269 HE1 TRP 312 -23.559 -19.598 -7.327 0.00 0.00 +0.000 HD +ATOM 2270 CE2 TRP 312 -23.165 -17.541 -7.050 0.00 0.00 +0.000 A +ATOM 2271 CZ2 TRP 312 -23.979 -16.829 -7.943 0.00 0.00 +0.000 A +ATOM 2272 HZ2 TRP 312 -24.602 -17.321 -8.557 0.00 0.00 +0.000 HD +ATOM 2273 CH2 TRP 312 -23.884 -15.462 -7.937 0.00 0.00 +0.000 A +ATOM 2274 HH2 TRP 312 -24.446 -14.917 -8.558 0.00 0.00 +0.000 HD +ATOM 2275 CZ3 TRP 312 -23.001 -14.790 -7.064 0.00 0.00 +0.000 A +ATOM 2276 HZ3 TRP 312 -22.953 -13.799 -7.082 0.00 0.00 +0.000 HD +ATOM 2277 CE3 TRP 312 -22.194 -15.496 -6.178 0.00 0.00 +0.000 A +ATOM 2278 HE3 TRP 312 -21.575 -15.010 -5.568 0.00 0.00 +0.000 HD +ATOM 2279 CD2 TRP 312 -22.273 -16.895 -6.162 0.00 0.00 +0.000 A +ATOM 2280 C TRP 312 -18.173 -16.830 -4.049 0.00 0.00 +0.000 C +ATOM 2281 O TRP 312 -18.248 -15.684 -3.600 0.00 0.00 +0.000 OA +ATOM 2282 N ASP 313 -17.200 -17.662 -3.693 0.00 0.00 +0.000 N +ATOM 2283 H ASP 313 -17.237 -18.598 -4.090 0.00 0.00 +0.000 HD +ATOM 2284 CA ASP 313 -16.167 -17.185 -2.776 0.00 0.00 +0.000 C +ATOM 2285 HA ASP 313 -16.623 -16.709 -2.041 0.00 0.00 +0.000 HD +ATOM 2286 CB ASP 313 -15.235 -18.307 -2.338 0.00 0.00 +0.000 C +ATOM 2287 HB2 ASP 313 -14.914 -18.779 -3.151 0.00 0.00 +0.000 HD +ATOM 2288 HB3 ASP 313 -14.473 -17.903 -1.846 0.00 0.00 +0.000 HD +ATOM 2289 CG ASP 313 -15.921 -19.311 -1.433 0.00 0.00 +0.000 C +ATOM 2290 OD1 ASP 313 -16.655 -18.880 -0.517 0.00 0.00 +0.000 OA +ATOM 2291 OD2 ASP 313 -15.721 -20.525 -1.634 0.00 0.00 +0.000 OA +ATOM 2292 C ASP 313 -15.376 -16.151 -3.561 0.00 0.00 +0.000 C +ATOM 2293 O ASP 313 -14.967 -15.123 -3.014 0.00 0.00 +0.000 OA +ATOM 2294 N GLY 314 -15.181 -16.427 -4.850 0.00 0.00 +0.000 N +ATOM 2295 H GLY 314 -15.578 -17.322 -5.173 0.00 0.00 +0.000 HD +ATOM 2296 CA GLY 314 -14.453 -15.501 -5.703 0.00 0.00 +0.000 C +ATOM 2297 HA2 GLY 314 -13.563 -15.285 -5.285 0.00 0.00 +0.000 HD +ATOM 2298 HA3 GLY 314 -14.285 -15.929 -6.599 0.00 0.00 +0.000 HD +ATOM 2299 C GLY 314 -15.239 -14.212 -5.902 0.00 0.00 +0.000 C +ATOM 2300 O GLY 314 -14.670 -13.125 -5.933 0.00 0.00 +0.000 OA +ATOM 2301 N PHE 315 -16.550 -14.349 -6.055 0.00 0.00 +0.000 N +ATOM 2302 H PHE 315 -16.884 -15.342 -6.033 0.00 0.00 +0.000 HD +ATOM 2303 CA PHE 315 -17.450 -13.216 -6.238 0.00 0.00 +0.000 C +ATOM 2304 HA PHE 315 -17.134 -12.716 -7.046 0.00 0.00 +0.000 HD +ATOM 2305 CB PHE 315 -18.892 -13.727 -6.340 0.00 0.00 +0.000 C +ATOM 2306 HB2 PHE 315 -18.956 -14.288 -7.155 0.00 0.00 +0.000 HD +ATOM 2307 HB3 PHE 315 -19.080 -14.264 -5.527 0.00 0.00 +0.000 HD +ATOM 2308 CG PHE 315 -19.936 -12.648 -6.435 0.00 0.00 +0.000 A +ATOM 2309 CD1 PHE 315 -20.142 -11.951 -7.624 0.00 0.00 +0.000 A +ATOM 2310 HD1 PHE 315 -19.563 -12.131 -8.412 0.00 0.00 +0.000 HD +ATOM 2311 CE1 PHE 315 -21.157 -10.998 -7.728 0.00 0.00 +0.000 A +ATOM 2312 HE1 PHE 315 -21.297 -10.515 -8.595 0.00 0.00 +0.000 HD +ATOM 2313 CZ PHE 315 -21.963 -10.728 -6.626 0.00 0.00 +0.000 A +ATOM 2314 HZ PHE 315 -22.686 -10.044 -6.694 0.00 0.00 +0.000 HD +ATOM 2315 CE2 PHE 315 -21.756 -11.415 -5.433 0.00 0.00 +0.000 A +ATOM 2316 HE2 PHE 315 -22.341 -11.225 -4.628 0.00 0.00 +0.000 HD +ATOM 2317 CD2 PHE 315 -20.746 -12.361 -5.342 0.00 0.00 +0.000 A +ATOM 2318 HD2 PHE 315 -20.598 -12.845 -4.478 0.00 0.00 +0.000 HD +ATOM 2319 C PHE 315 -17.323 -12.260 -5.052 0.00 0.00 +0.000 C +ATOM 2320 O PHE 315 -17.168 -11.053 -5.223 0.00 0.00 +0.000 OA +ATOM 2321 N VAL 316 -17.398 -12.819 -3.850 0.00 0.00 +0.000 N +ATOM 2322 H VAL 316 -17.527 -13.853 -3.859 0.00 0.00 +0.000 HD +ATOM 2323 CA VAL 316 -17.305 -12.036 -2.627 0.00 0.00 +0.000 C +ATOM 2324 HA VAL 316 -18.019 -11.319 -2.655 0.00 0.00 +0.000 HD +ATOM 2325 CB VAL 316 -17.572 -12.943 -1.391 0.00 0.00 +0.000 C +ATOM 2326 HB VAL 316 -16.970 -13.732 -1.470 0.00 0.00 +0.000 HD +ATOM 2327 CG1 VAL 316 -17.214 -12.225 -0.108 0.00 0.00 +0.000 C +ATOM 2328 HG11 VAL 316 -16.431 -12.675 0.324 0.00 0.00 +0.000 HD +ATOM 2329 HG12 VAL 316 -16.978 -11.273 -0.308 0.00 0.00 +0.000 HD +ATOM 2330 HG13 VAL 316 -17.993 -12.246 0.520 0.00 0.00 +0.000 HD +ATOM 2331 CG2 VAL 316 -19.034 -13.352 -1.366 0.00 0.00 +0.000 C +ATOM 2332 HG21 VAL 316 -19.224 -13.853 -0.521 0.00 0.00 +0.000 HD +ATOM 2333 HG22 VAL 316 -19.608 -12.534 -1.407 0.00 0.00 +0.000 HD +ATOM 2334 HG23 VAL 316 -19.228 -13.938 -2.153 0.00 0.00 +0.000 HD +ATOM 2335 C VAL 316 -15.951 -11.338 -2.486 0.00 0.00 +0.000 C +ATOM 2336 O VAL 316 -15.879 -10.180 -2.059 0.00 0.00 +0.000 OA +ATOM 2337 N GLU 317 -14.883 -12.042 -2.854 0.00 0.00 +0.000 N +ATOM 2338 H GLU 317 -15.092 -13.000 -3.199 0.00 0.00 +0.000 HD +ATOM 2339 CA GLU 317 -13.536 -11.493 -2.772 0.00 0.00 +0.000 C +ATOM 2340 HA GLU 317 -13.370 -11.138 -1.844 0.00 0.00 +0.000 HD +ATOM 2341 CB GLU 317 -12.481 -12.571 -3.051 0.00 0.00 +0.000 C +ATOM 2342 HB2 GLU 317 -12.613 -12.880 -3.983 0.00 0.00 +0.000 HD +ATOM 2343 HB3 GLU 317 -11.592 -12.152 -2.938 0.00 0.00 +0.000 HD +ATOM 2344 CG GLU 317 -12.538 -13.785 -2.149 0.00 0.00 +0.000 C +ATOM 2345 HG2 GLU 317 -12.380 -13.497 -1.226 0.00 0.00 +0.000 HD +ATOM 2346 HG3 GLU 317 -13.405 -14.225 -2.268 0.00 0.00 +0.000 HD +ATOM 2347 CD GLU 317 -11.460 -14.806 -2.497 0.00 0.00 +0.000 C +ATOM 2348 OE1 GLU 317 -11.286 -15.099 -3.704 0.00 0.00 +0.000 OA +ATOM 2349 OE2 GLU 317 -10.791 -15.314 -1.570 0.00 0.00 +0.000 OA +ATOM 2350 C GLU 317 -13.347 -10.373 -3.785 0.00 0.00 +0.000 C +ATOM 2351 O GLU 317 -12.708 -9.370 -3.488 0.00 0.00 +0.000 OA +ATOM 2352 N PHE 318 -13.903 -10.554 -4.982 0.00 0.00 +0.000 N +ATOM 2353 H PHE 318 -14.429 -11.445 -5.085 0.00 0.00 +0.000 HD +ATOM 2354 CA PHE 318 -13.772 -9.570 -6.046 0.00 0.00 +0.000 C +ATOM 2355 HA PHE 318 -12.782 -9.417 -6.185 0.00 0.00 +0.000 HD +ATOM 2356 CB PHE 318 -14.452 -10.090 -7.317 0.00 0.00 +0.000 C +ATOM 2357 HB2 PHE 318 -14.103 -10.997 -7.496 0.00 0.00 +0.000 HD +ATOM 2358 HB3 PHE 318 -15.427 -10.104 -7.153 0.00 0.00 +0.000 HD +ATOM 2359 CG PHE 318 -14.196 -9.244 -8.532 0.00 0.00 +0.000 A +ATOM 2360 CD1 PHE 318 -12.948 -9.247 -9.151 0.00 0.00 +0.000 A +ATOM 2361 HD1 PHE 318 -12.214 -9.809 -8.785 0.00 0.00 +0.000 HD +ATOM 2362 CE1 PHE 318 -12.711 -8.470 -10.285 0.00 0.00 +0.000 A +ATOM 2363 HE1 PHE 318 -11.806 -8.485 -10.717 0.00 0.00 +0.000 HD +ATOM 2364 CZ PHE 318 -13.733 -7.679 -10.806 0.00 0.00 +0.000 A +ATOM 2365 HZ PHE 318 -13.569 -7.123 -11.616 0.00 0.00 +0.000 HD +ATOM 2366 CE2 PHE 318 -14.986 -7.671 -10.188 0.00 0.00 +0.000 A +ATOM 2367 HE2 PHE 318 -15.731 -7.098 -10.559 0.00 0.00 +0.000 HD +ATOM 2368 CD2 PHE 318 -15.206 -8.450 -9.061 0.00 0.00 +0.000 A +ATOM 2369 HD2 PHE 318 -16.107 -8.441 -8.622 0.00 0.00 +0.000 HD +ATOM 2370 C PHE 318 -14.374 -8.229 -5.662 0.00 0.00 +0.000 C +ATOM 2371 O PHE 318 -13.821 -7.177 -5.980 0.00 0.00 +0.000 OA +ATOM 2372 N PHE 319 -15.495 -8.275 -4.950 0.00 0.00 +0.000 N +ATOM 2373 H PHE 319 -15.820 -9.231 -4.708 0.00 0.00 +0.000 HD +ATOM 2374 CA PHE 319 -16.196 -7.061 -4.551 0.00 0.00 +0.000 C +ATOM 2375 HA PHE 319 -15.856 -6.310 -5.159 0.00 0.00 +0.000 HD +ATOM 2376 CB PHE 319 -17.685 -7.247 -4.792 0.00 0.00 +0.000 C +ATOM 2377 HB2 PHE 319 -17.942 -8.144 -4.459 0.00 0.00 +0.000 HD +ATOM 2378 HB3 PHE 319 -18.168 -6.534 -4.303 0.00 0.00 +0.000 HD +ATOM 2379 CG PHE 319 -18.090 -7.163 -6.243 0.00 0.00 +0.000 A +ATOM 2380 CD1 PHE 319 -18.040 -5.950 -6.913 0.00 0.00 +0.000 A +ATOM 2381 HD1 PHE 319 -17.728 -5.131 -6.441 0.00 0.00 +0.000 HD +ATOM 2382 CE1 PHE 319 -18.422 -5.856 -8.254 0.00 0.00 +0.000 A +ATOM 2383 HE1 PHE 319 -18.436 -4.956 -8.701 0.00 0.00 +0.000 HD +ATOM 2384 CZ PHE 319 -18.780 -7.001 -8.956 0.00 0.00 +0.000 A +ATOM 2385 HZ PHE 319 -19.001 -6.942 -9.925 0.00 0.00 +0.000 HD +ATOM 2386 CE2 PHE 319 -18.824 -8.218 -8.294 0.00 0.00 +0.000 A +ATOM 2387 HE2 PHE 319 -19.135 -9.053 -8.780 0.00 0.00 +0.000 HD +ATOM 2388 CD2 PHE 319 -18.445 -8.302 -6.964 0.00 0.00 +0.000 A +ATOM 2389 HD2 PHE 319 -18.424 -9.195 -6.510 0.00 0.00 +0.000 HD +ATOM 2390 C PHE 319 -15.959 -6.591 -3.113 0.00 0.00 +0.000 C +ATOM 2391 O PHE 319 -16.508 -5.563 -2.702 0.00 0.00 +0.000 OA +ATOM 2392 N HIE 320 -15.142 -7.327 -2.360 0.00 0.00 +0.000 N +ATOM 2393 H HIE 320 -14.746 -8.163 -2.844 0.00 0.00 +0.000 HD +ATOM 2394 CA HIE 320 -14.827 -6.989 -0.970 0.00 0.00 +0.000 C +ATOM 2395 HA HIE 320 -15.658 -7.155 -0.409 0.00 0.00 +0.000 HD +ATOM 2396 CB HIE 320 -13.721 -7.908 -0.459 0.00 0.00 +0.000 C +ATOM 2397 HB2 HIE 320 -14.045 -8.860 -0.483 0.00 0.00 +0.000 HD +ATOM 2398 HB3 HIE 320 -12.921 -7.827 -1.063 0.00 0.00 +0.000 HD +ATOM 2399 CG HIE 320 -13.281 -7.599 0.943 0.00 0.00 +0.000 A +ATOM 2400 ND1 HIE 320 -12.082 -7.001 1.233 0.00 0.00 +0.000 NA +ATOM 2401 CE1 HIE 320 -11.992 -6.810 2.544 0.00 0.00 +0.000 A +ATOM 2402 HE1 HIE 320 -11.224 -6.395 3.018 0.00 0.00 +0.000 HD +ATOM 2403 NE2 HIE 320 -13.094 -7.268 3.099 0.00 0.00 +0.000 N +ATOM 2404 HE2 HIE 320 -13.305 -7.253 4.087 0.00 0.00 +0.000 HD +ATOM 2405 CD2 HIE 320 -13.922 -7.773 2.122 0.00 0.00 +0.000 A +ATOM 2406 HD2 HIE 320 -14.814 -8.185 2.260 0.00 0.00 +0.000 HD +ATOM 2407 C HIE 320 -14.408 -5.537 -0.782 0.00 0.00 +0.000 C +ATOM 2408 O HIE 320 -13.615 -5.004 -1.559 0.00 0.00 +0.000 OA +ATOM 2409 N VAL 321 -14.952 -4.910 0.258 0.00 0.00 +0.000 N +ATOM 2410 H VAL 321 -15.604 -5.489 0.824 0.00 0.00 +0.000 HD +ATOM 2411 CA VAL 321 -14.645 -3.513 0.566 0.00 0.00 +0.000 C +ATOM 2412 HA VAL 321 -14.327 -3.069 -0.278 0.00 0.00 +0.000 HD +ATOM 2413 CB VAL 321 -15.896 -2.762 1.098 0.00 0.00 +0.000 C +ATOM 2414 HB VAL 321 -15.663 -1.800 1.156 0.00 0.00 +0.000 HD +ATOM 2415 CG1 VAL 321 -17.041 -2.889 0.101 0.00 0.00 +0.000 C +ATOM 2416 HG11 VAL 321 -16.676 -2.876 -0.829 0.00 0.00 +0.000 HD +ATOM 2417 HG12 VAL 321 -17.525 -3.750 0.257 0.00 0.00 +0.000 HD +ATOM 2418 HG13 VAL 321 -17.674 -2.125 0.221 0.00 0.00 +0.000 HD +ATOM 2419 CG2 VAL 321 -16.310 -3.320 2.445 0.00 0.00 +0.000 C +ATOM 2420 HG21 VAL 321 -16.918 -4.103 2.309 0.00 0.00 +0.000 HD +ATOM 2421 HG22 VAL 321 -15.496 -3.613 2.949 0.00 0.00 +0.000 HD +ATOM 2422 HG23 VAL 321 -16.789 -2.612 2.966 0.00 0.00 +0.000 HD +ATOM 2423 C VAL 321 -13.520 -3.423 1.597 0.00 0.00 +0.000 C +ATOM 2424 O VAL 321 -12.468 -2.832 1.254 0.00 0.00 +0.000 OA +ATOM 2425 OXT VAL 321 -13.431 -3.824 2.731 0.00 0.00 +0.000 OA +TER diff --git a/receptor/pdbqt_files/6o6f_K234R_H.pdbqt b/receptor/pdbqt_files/6o6f_K234R_H.pdbqt new file mode 100644 index 0000000..98222a5 --- /dev/null +++ b/receptor/pdbqt_files/6o6f_K234R_H.pdbqt @@ -0,0 +1,2425 @@ +REMARK Name = ../receptor/6o6f_K234R_H.pdb +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ATOM 1 N SER 171 -23.840 -34.508 -6.167 0.00 0.00 +0.000 NA +ATOM 2 H1 SER 171 -24.073 -34.914 -5.272 0.00 0.00 +0.000 HD +ATOM 3 H2 SER 171 -23.979 -34.837 -5.236 0.00 0.00 +0.000 HD +ATOM 4 H3 SER 171 -23.978 -35.254 -6.813 0.00 0.00 +0.000 HD +ATOM 5 CA SER 171 -24.823 -33.425 -6.454 0.00 0.00 +0.000 C +ATOM 6 HA SER 171 -25.412 -33.750 -7.212 0.00 0.00 +0.000 HD +ATOM 7 CB SER 171 -25.708 -33.194 -5.243 0.00 0.00 +0.000 C +ATOM 8 HB2 SER 171 -26.374 -32.476 -5.458 0.00 0.00 +0.000 HD +ATOM 9 HB3 SER 171 -26.200 -34.043 -5.033 0.00 0.00 +0.000 HD +ATOM 10 OG SER 171 -24.971 -32.802 -4.100 0.00 0.00 +0.000 OA +ATOM 11 HG SER 171 -24.797 -31.818 -4.136 0.00 0.00 +0.000 HD +ATOM 12 C SER 171 -24.177 -32.110 -6.883 0.00 0.00 +0.000 C +ATOM 13 O SER 171 -22.964 -31.912 -6.751 0.00 0.00 +0.000 OA +ATOM 14 N ASP 172 -25.017 -31.207 -7.377 0.00 0.00 +0.000 N +ATOM 15 H ASP 172 -26.019 -31.507 -7.379 0.00 0.00 +0.000 HD +ATOM 16 CA ASP 172 -24.576 -29.909 -7.873 0.00 0.00 +0.000 C +ATOM 17 HA ASP 172 -23.602 -30.008 -8.149 0.00 0.00 +0.000 HD +ATOM 18 CB ASP 172 -25.432 -29.532 -9.076 0.00 0.00 +0.000 C +ATOM 19 HB2 ASP 172 -25.664 -30.370 -9.561 0.00 0.00 +0.000 HD +ATOM 20 HB3 ASP 172 -26.258 -29.091 -8.739 0.00 0.00 +0.000 HD +ATOM 21 CG ASP 172 -24.727 -28.599 -10.018 0.00 0.00 +0.000 C +ATOM 22 OD1 ASP 172 -23.703 -27.997 -9.623 0.00 0.00 +0.000 OA +ATOM 23 OD2 ASP 172 -25.214 -28.470 -11.157 0.00 0.00 +0.000 OA +ATOM 24 C ASP 172 -24.625 -28.796 -6.824 0.00 0.00 +0.000 C +ATOM 25 O ASP 172 -25.612 -28.057 -6.729 0.00 0.00 +0.000 OA +ATOM 26 N GLU 173 -23.548 -28.683 -6.049 0.00 0.00 +0.000 N +ATOM 27 H GLU 173 -22.790 -29.365 -6.257 0.00 0.00 +0.000 HD +ATOM 28 CA GLU 173 -23.453 -27.676 -4.995 0.00 0.00 +0.000 C +ATOM 29 HA GLU 173 -24.232 -27.772 -4.359 0.00 0.00 +0.000 HD +ATOM 30 CB GLU 173 -22.200 -27.947 -4.155 0.00 0.00 +0.000 C +ATOM 31 HB2 GLU 173 -22.347 -28.794 -3.669 0.00 0.00 +0.000 HD +ATOM 32 HB3 GLU 173 -21.435 -28.012 -4.775 0.00 0.00 +0.000 HD +ATOM 33 CG GLU 173 -21.879 -26.877 -3.134 0.00 0.00 +0.000 C +ATOM 34 HG2 GLU 173 -21.026 -27.114 -2.693 0.00 0.00 +0.000 HD +ATOM 35 HG3 GLU 173 -21.810 -26.008 -3.602 0.00 0.00 +0.000 HD +ATOM 36 CD GLU 173 -22.924 -26.721 -2.045 0.00 0.00 +0.000 C +ATOM 37 OE1 GLU 173 -23.943 -27.446 -2.041 0.00 0.00 +0.000 OA +ATOM 38 OE2 GLU 173 -22.734 -25.830 -1.194 0.00 0.00 +0.000 OA +ATOM 39 C GLU 173 -23.443 -26.240 -5.559 0.00 0.00 +0.000 C +ATOM 40 O GLU 173 -24.129 -25.350 -5.049 0.00 0.00 +0.000 OA +ATOM 41 N LEU 174 -22.675 -26.019 -6.620 0.00 0.00 +0.000 N +ATOM 42 H LEU 174 -22.143 -26.835 -6.959 0.00 0.00 +0.000 HD +ATOM 43 CA LEU 174 -22.619 -24.699 -7.230 0.00 0.00 +0.000 C +ATOM 44 HA LEU 174 -22.328 -24.032 -6.531 0.00 0.00 +0.000 HD +ATOM 45 CB LEU 174 -21.586 -24.661 -8.357 0.00 0.00 +0.000 C +ATOM 46 HB2 LEU 174 -20.686 -24.796 -7.952 0.00 0.00 +0.000 HD +ATOM 47 HB3 LEU 174 -21.794 -25.401 -8.988 0.00 0.00 +0.000 HD +ATOM 48 CG LEU 174 -21.530 -23.367 -9.171 0.00 0.00 +0.000 C +ATOM 49 HG LEU 174 -22.441 -23.160 -9.522 0.00 0.00 +0.000 HD +ATOM 50 CD1 LEU 174 -21.054 -22.201 -8.293 0.00 0.00 +0.000 C +ATOM 51 HD11 LEU 174 -20.143 -22.406 -7.942 0.00 0.00 +0.000 HD +ATOM 52 HD12 LEU 174 -21.025 -21.368 -8.842 0.00 0.00 +0.000 HD +ATOM 53 HD13 LEU 174 -21.690 -22.082 -7.533 0.00 0.00 +0.000 HD +ATOM 54 CD2 LEU 174 -20.605 -23.568 -10.350 0.00 0.00 +0.000 C +ATOM 55 HD21 LEU 174 -20.947 -24.313 -10.927 0.00 0.00 +0.000 HD +ATOM 56 HD22 LEU 174 -20.559 -22.727 -10.893 0.00 0.00 +0.000 HD +ATOM 57 HD23 LEU 174 -19.686 -23.800 -10.025 0.00 0.00 +0.000 HD +ATOM 58 C LEU 174 -23.982 -24.270 -7.762 0.00 0.00 +0.000 C +ATOM 59 O LEU 174 -24.374 -23.103 -7.633 0.00 0.00 +0.000 OA +ATOM 60 N TYR 175 -24.715 -25.192 -8.372 0.00 0.00 +0.000 N +ATOM 61 H TYR 175 -24.296 -26.118 -8.460 0.00 0.00 +0.000 HD +ATOM 62 CA TYR 175 -26.039 -24.830 -8.864 0.00 0.00 +0.000 C +ATOM 63 HA TYR 175 -25.951 -24.004 -9.436 0.00 0.00 +0.000 HD +ATOM 64 CB TYR 175 -26.649 -25.942 -9.716 0.00 0.00 +0.000 C +ATOM 65 HB2 TYR 175 -26.023 -26.152 -10.448 0.00 0.00 +0.000 HD +ATOM 66 HB3 TYR 175 -26.811 -26.724 -9.137 0.00 0.00 +0.000 HD +ATOM 67 CG TYR 175 -27.958 -25.506 -10.312 0.00 0.00 +0.000 A +ATOM 68 CD1 TYR 175 -27.995 -24.770 -11.495 0.00 0.00 +0.000 A +ATOM 69 HD1 TYR 175 -27.147 -24.606 -12.002 0.00 0.00 +0.000 HD +ATOM 70 CE1 TYR 175 -29.191 -24.255 -11.988 0.00 0.00 +0.000 A +ATOM 71 HE1 TYR 175 -29.198 -23.731 -12.840 0.00 0.00 +0.000 HD +ATOM 72 CZ TYR 175 -30.369 -24.474 -11.292 0.00 0.00 +0.000 A +ATOM 73 OH TYR 175 -31.551 -23.926 -11.754 0.00 0.00 +0.000 OA +ATOM 74 HH TYR 175 -31.551 -23.947 -12.751 0.00 0.00 +0.000 HD +ATOM 75 CE2 TYR 175 -30.358 -25.213 -10.119 0.00 0.00 +0.000 A +ATOM 76 HE2 TYR 175 -31.208 -25.379 -9.621 0.00 0.00 +0.000 HD +ATOM 77 CD2 TYR 175 -29.155 -25.724 -9.637 0.00 0.00 +0.000 A +ATOM 78 HD2 TYR 175 -29.154 -26.257 -8.793 0.00 0.00 +0.000 HD +ATOM 79 C TYR 175 -26.995 -24.507 -7.714 0.00 0.00 +0.000 C +ATOM 80 O TYR 175 -27.704 -23.510 -7.775 0.00 0.00 +0.000 OA +ATOM 81 N ARG 176 -27.007 -25.346 -6.679 0.00 0.00 +0.000 N +ATOM 82 H ARG 176 -26.357 -26.148 -6.760 0.00 0.00 +0.000 HD +ATOM 83 CA ARG 176 -27.880 -25.122 -5.538 0.00 0.00 +0.000 C +ATOM 84 HA ARG 176 -28.838 -25.126 -5.855 0.00 0.00 +0.000 HD +ATOM 85 CB ARG 176 -27.703 -26.232 -4.499 0.00 0.00 +0.000 C +ATOM 86 HB2 ARG 176 -27.919 -27.104 -4.934 0.00 0.00 +0.000 HD +ATOM 87 HB3 ARG 176 -26.751 -26.231 -4.201 0.00 0.00 +0.000 HD +ATOM 88 CG ARG 176 -28.582 -26.093 -3.263 0.00 0.00 +0.000 C +ATOM 89 HG2 ARG 176 -28.651 -25.127 -3.013 0.00 0.00 +0.000 HD +ATOM 90 HG3 ARG 176 -29.494 -26.450 -3.465 0.00 0.00 +0.000 HD +ATOM 91 CD ARG 176 -28.029 -26.853 -2.073 0.00 0.00 +0.000 C +ATOM 92 HD2 ARG 176 -28.698 -26.811 -1.338 0.00 0.00 +0.000 HD +ATOM 93 HD3 ARG 176 -27.879 -27.797 -2.350 0.00 0.00 +0.000 HD +ATOM 94 NE ARG 176 -26.768 -26.279 -1.611 0.00 0.00 +0.000 N +ATOM 95 HE ARG 176 -25.931 -26.828 -1.727 0.00 0.00 +0.000 HD +ATOM 96 CZ ARG 176 -26.649 -25.079 -1.047 0.00 0.00 +0.000 C +ATOM 97 NH1 ARG 176 -25.462 -24.636 -0.662 0.00 0.00 +0.000 N +ATOM 98 HH11 ARG 176 -24.638 -25.179 -0.804 0.00 0.00 +0.000 HD +ATOM 99 HH12 ARG 176 -25.387 -23.734 -0.219 0.00 0.00 +0.000 HD +ATOM 100 NH2 ARG 176 -27.717 -24.321 -0.856 0.00 0.00 +0.000 N +ATOM 101 HH21 ARG 176 -28.617 -24.651 -1.158 0.00 0.00 +0.000 HD +ATOM 102 HH22 ARG 176 -27.634 -23.430 -0.418 0.00 0.00 +0.000 HD +ATOM 103 C ARG 176 -27.593 -23.783 -4.878 0.00 0.00 +0.000 C +ATOM 104 O ARG 176 -28.505 -23.016 -4.554 0.00 0.00 +0.000 OA +ATOM 105 N GLN 177 -26.313 -23.517 -4.660 0.00 0.00 +0.000 N +ATOM 106 H GLN 177 -25.654 -24.258 -4.972 0.00 0.00 +0.000 HD +ATOM 107 CA GLN 177 -25.894 -22.281 -4.034 0.00 0.00 +0.000 C +ATOM 108 HA GLN 177 -26.375 -22.196 -3.149 0.00 0.00 +0.000 HD +ATOM 109 CB GLN 177 -24.390 -22.315 -3.808 0.00 0.00 +0.000 C +ATOM 110 HB2 GLN 177 -24.174 -23.066 -3.180 0.00 0.00 +0.000 HD +ATOM 111 HB3 GLN 177 -23.935 -22.483 -4.686 0.00 0.00 +0.000 HD +ATOM 112 CG GLN 177 -23.831 -21.036 -3.224 0.00 0.00 +0.000 C +ATOM 113 HG2 GLN 177 -23.923 -20.309 -3.898 0.00 0.00 +0.000 HD +ATOM 114 HG3 GLN 177 -24.344 -20.808 -2.401 0.00 0.00 +0.000 HD +ATOM 115 CD GLN 177 -22.379 -21.189 -2.867 0.00 0.00 +0.000 C +ATOM 116 OE1 GLN 177 -21.604 -21.751 -3.639 0.00 0.00 +0.000 OA +ATOM 117 NE2 GLN 177 -21.996 -20.691 -1.694 0.00 0.00 +0.000 N +ATOM 118 HE21 GLN 177 -21.032 -20.769 -1.378 0.00 0.00 +0.000 HD +ATOM 119 HE22 GLN 177 -22.690 -20.224 -1.110 0.00 0.00 +0.000 HD +ATOM 120 C GLN 177 -26.268 -21.070 -4.879 0.00 0.00 +0.000 C +ATOM 121 O GLN 177 -26.763 -20.074 -4.355 0.00 0.00 +0.000 OA +ATOM 122 N SER 178 -26.034 -21.158 -6.184 0.00 0.00 +0.000 N +ATOM 123 H SER 178 -25.612 -22.049 -6.496 0.00 0.00 +0.000 HD +ATOM 124 CA SER 178 -26.362 -20.057 -7.081 0.00 0.00 +0.000 C +ATOM 125 HA SER 178 -25.897 -19.228 -6.744 0.00 0.00 +0.000 HD +ATOM 126 CB SER 178 -25.888 -20.374 -8.504 0.00 0.00 +0.000 C +ATOM 127 HB2 SER 178 -26.337 -21.208 -8.813 0.00 0.00 +0.000 HD +ATOM 128 HB3 SER 178 -26.132 -19.613 -9.099 0.00 0.00 +0.000 HD +ATOM 129 OG SER 178 -24.482 -20.562 -8.549 0.00 0.00 +0.000 OA +ATOM 130 HG SER 178 -24.258 -21.476 -8.214 0.00 0.00 +0.000 HD +ATOM 131 C SER 178 -27.863 -19.774 -7.098 0.00 0.00 +0.000 C +ATOM 132 O SER 178 -28.285 -18.616 -7.152 0.00 0.00 +0.000 OA +ATOM 133 N LEU 179 -28.669 -20.829 -7.054 0.00 0.00 +0.000 N +ATOM 134 H LEU 179 -28.201 -21.744 -7.001 0.00 0.00 +0.000 HD +ATOM 135 CA LEU 179 -30.117 -20.652 -7.082 0.00 0.00 +0.000 C +ATOM 136 HA LEU 179 -30.355 -20.079 -7.882 0.00 0.00 +0.000 HD +ATOM 137 CB LEU 179 -30.823 -21.998 -7.275 0.00 0.00 +0.000 C +ATOM 138 HB2 LEU 179 -30.510 -22.388 -8.129 0.00 0.00 +0.000 HD +ATOM 139 HB3 LEU 179 -30.592 -22.578 -6.509 0.00 0.00 +0.000 HD +ATOM 140 CG LEU 179 -32.355 -21.915 -7.344 0.00 0.00 +0.000 C +ATOM 141 HG LEU 179 -32.701 -21.589 -6.466 0.00 0.00 +0.000 HD +ATOM 142 CD1 LEU 179 -32.793 -20.955 -8.449 0.00 0.00 +0.000 C +ATOM 143 HD11 LEU 179 -32.446 -21.281 -9.328 0.00 0.00 +0.000 HD +ATOM 144 HD12 LEU 179 -33.791 -20.915 -8.477 0.00 0.00 +0.000 HD +ATOM 145 HD13 LEU 179 -32.427 -20.044 -8.261 0.00 0.00 +0.000 HD +ATOM 146 CD2 LEU 179 -32.923 -23.296 -7.579 0.00 0.00 +0.000 C +ATOM 147 HD21 LEU 179 -32.657 -23.905 -6.828 0.00 0.00 +0.000 HD +ATOM 148 HD22 LEU 179 -33.923 -23.249 -7.625 0.00 0.00 +0.000 HD +ATOM 149 HD23 LEU 179 -32.572 -23.666 -8.442 0.00 0.00 +0.000 HD +ATOM 150 C LEU 179 -30.643 -19.964 -5.827 0.00 0.00 +0.000 C +ATOM 151 O LEU 179 -31.515 -19.100 -5.916 0.00 0.00 +0.000 OA +ATOM 152 N GLU 180 -30.114 -20.332 -4.664 0.00 0.00 +0.000 N +ATOM 153 H GLU 180 -29.384 -21.055 -4.720 0.00 0.00 +0.000 HD +ATOM 154 CA GLU 180 -30.573 -19.723 -3.431 0.00 0.00 +0.000 C +ATOM 155 HA GLU 180 -31.571 -19.818 -3.350 0.00 0.00 +0.000 HD +ATOM 156 CB GLU 180 -29.980 -20.469 -2.231 0.00 0.00 +0.000 C +ATOM 157 HB2 GLU 180 -30.326 -21.392 -2.254 0.00 0.00 +0.000 HD +ATOM 158 HB3 GLU 180 -28.999 -20.442 -2.318 0.00 0.00 +0.000 HD +ATOM 159 CG GLU 180 -30.342 -19.873 -0.882 0.00 0.00 +0.000 C +ATOM 160 HG2 GLU 180 -29.648 -19.218 -0.637 0.00 0.00 +0.000 HD +ATOM 161 HG3 GLU 180 -31.231 -19.455 -0.955 0.00 0.00 +0.000 HD +ATOM 162 CD GLU 180 -30.412 -20.902 0.231 0.00 0.00 +0.000 C +ATOM 163 OE1 GLU 180 -29.479 -21.732 0.342 0.00 0.00 +0.000 OA +ATOM 164 OE2 GLU 180 -31.405 -20.868 1.003 0.00 0.00 +0.000 OA +ATOM 165 C GLU 180 -30.206 -18.237 -3.394 0.00 0.00 +0.000 C +ATOM 166 O GLU 180 -31.022 -17.410 -3.014 0.00 0.00 +0.000 OA +ATOM 167 N ILE 181 -28.991 -17.898 -3.817 0.00 0.00 +0.000 N +ATOM 168 H ILE 181 -28.400 -18.686 -4.133 0.00 0.00 +0.000 HD +ATOM 169 CA ILE 181 -28.557 -16.506 -3.821 0.00 0.00 +0.000 C +ATOM 170 HA ILE 181 -28.724 -16.153 -2.890 0.00 0.00 +0.000 HD +ATOM 171 CB ILE 181 -27.079 -16.406 -4.239 0.00 0.00 +0.000 C +ATOM 172 HB ILE 181 -26.977 -16.860 -5.115 0.00 0.00 +0.000 HD +ATOM 173 CG2 ILE 181 -26.670 -14.946 -4.374 0.00 0.00 +0.000 C +ATOM 174 HG21 ILE 181 -25.720 -14.892 -4.676 0.00 0.00 +0.000 HD +ATOM 175 HG22 ILE 181 -27.257 -14.496 -5.045 0.00 0.00 +0.000 HD +ATOM 176 HG23 ILE 181 -26.764 -14.490 -3.491 0.00 0.00 +0.000 HD +ATOM 177 CG1 ILE 181 -26.205 -17.135 -3.221 0.00 0.00 +0.000 C +ATOM 178 HG12 ILE 181 -26.169 -16.593 -2.387 0.00 0.00 +0.000 HD +ATOM 179 HG13 ILE 181 -26.625 -18.016 -3.019 0.00 0.00 +0.000 HD +ATOM 180 CD1 ILE 181 -24.790 -17.375 -3.713 0.00 0.00 +0.000 C +ATOM 181 HD11 ILE 181 -24.357 -16.498 -3.912 0.00 0.00 +0.000 HD +ATOM 182 HD12 ILE 181 -24.272 -17.853 -3.006 0.00 0.00 +0.000 HD +ATOM 183 HD13 ILE 181 -24.819 -17.931 -4.542 0.00 0.00 +0.000 HD +ATOM 184 C ILE 181 -29.390 -15.639 -4.768 0.00 0.00 +0.000 C +ATOM 185 O ILE 181 -29.881 -14.570 -4.388 0.00 0.00 +0.000 OA +ATOM 186 N ILE 182 -29.538 -16.098 -6.006 0.00 0.00 +0.000 N +ATOM 187 H ILE 182 -29.087 -17.009 -6.196 0.00 0.00 +0.000 HD +ATOM 188 CA ILE 182 -30.293 -15.344 -7.008 0.00 0.00 +0.000 C +ATOM 189 HA ILE 182 -29.944 -14.397 -6.971 0.00 0.00 +0.000 HD +ATOM 190 CB ILE 182 -30.077 -15.948 -8.418 0.00 0.00 +0.000 C +ATOM 191 HB ILE 182 -30.270 -16.917 -8.367 0.00 0.00 +0.000 HD +ATOM 192 CG2 ILE 182 -31.002 -15.272 -9.432 0.00 0.00 +0.000 C +ATOM 193 HG21 ILE 182 -30.867 -15.687 -10.329 0.00 0.00 +0.000 HD +ATOM 194 HG22 ILE 182 -31.950 -15.393 -9.146 0.00 0.00 +0.000 HD +ATOM 195 HG23 ILE 182 -30.787 -14.299 -9.477 0.00 0.00 +0.000 HD +ATOM 196 CG1 ILE 182 -28.607 -15.776 -8.836 0.00 0.00 +0.000 C +ATOM 197 HG12 ILE 182 -28.430 -14.805 -8.974 0.00 0.00 +0.000 HD +ATOM 198 HG13 ILE 182 -28.030 -16.107 -8.092 0.00 0.00 +0.000 HD +ATOM 199 CD1 ILE 182 -28.233 -16.529 -10.110 0.00 0.00 +0.000 C +ATOM 200 HD11 ILE 182 -28.798 -16.197 -10.861 0.00 0.00 +0.000 HD +ATOM 201 HD12 ILE 182 -27.270 -16.367 -10.312 0.00 0.00 +0.000 HD +ATOM 202 HD13 ILE 182 -28.392 -17.503 -9.970 0.00 0.00 +0.000 HD +ATOM 203 C ILE 182 -31.792 -15.266 -6.690 0.00 0.00 +0.000 C +ATOM 204 O ILE 182 -32.411 -14.222 -6.884 0.00 0.00 +0.000 OA +ATOM 205 N SER 183 -32.364 -16.364 -6.197 0.00 0.00 +0.000 N +ATOM 206 H SER 183 -31.726 -17.177 -6.091 0.00 0.00 +0.000 HD +ATOM 207 CA SER 183 -33.785 -16.407 -5.836 0.00 0.00 +0.000 C +ATOM 208 HA SER 183 -34.316 -16.106 -6.633 0.00 0.00 +0.000 HD +ATOM 209 CB SER 183 -34.195 -17.822 -5.410 0.00 0.00 +0.000 C +ATOM 210 HB2 SER 183 -33.678 -18.068 -4.594 0.00 0.00 +0.000 HD +ATOM 211 HB3 SER 183 -35.171 -17.819 -5.206 0.00 0.00 +0.000 HD +ATOM 212 OG SER 183 -33.934 -18.750 -6.427 0.00 0.00 +0.000 OA +ATOM 213 HG SER 183 -32.968 -19.016 -6.406 0.00 0.00 +0.000 HD +ATOM 214 C SER 183 -34.077 -15.447 -4.686 0.00 0.00 +0.000 C +ATOM 215 O SER 183 -35.054 -14.693 -4.717 0.00 0.00 +0.000 OA +ATOM 216 N ARG 184 -33.228 -15.485 -3.665 0.00 0.00 +0.000 N +ATOM 217 H ARG 184 -32.460 -16.164 -3.751 0.00 0.00 +0.000 HD +ATOM 218 CA ARG 184 -33.417 -14.602 -2.522 0.00 0.00 +0.000 C +ATOM 219 HA ARG 184 -34.340 -14.751 -2.143 0.00 0.00 +0.000 HD +ATOM 220 CB ARG 184 -32.406 -14.909 -1.415 0.00 0.00 +0.000 C +ATOM 221 HB2 ARG 184 -31.495 -14.916 -1.821 0.00 0.00 +0.000 HD +ATOM 222 HB3 ARG 184 -32.467 -14.186 -0.731 0.00 0.00 +0.000 HD +ATOM 223 CG ARG 184 -32.626 -16.236 -0.722 0.00 0.00 +0.000 C +ATOM 224 HG2 ARG 184 -33.580 -16.493 -0.787 0.00 0.00 +0.000 HD +ATOM 225 HG3 ARG 184 -32.043 -16.926 -1.128 0.00 0.00 +0.000 HD +ATOM 226 CD ARG 184 -32.264 -16.113 0.746 0.00 0.00 +0.000 C +ATOM 227 HD2 ARG 184 -31.310 -15.829 0.808 0.00 0.00 +0.000 HD +ATOM 228 HD3 ARG 184 -32.853 -15.418 1.153 0.00 0.00 +0.000 HD +ATOM 229 NE ARG 184 -32.439 -17.372 1.459 0.00 0.00 +0.000 N +ATOM 230 HE ARG 184 -32.645 -18.196 0.918 0.00 0.00 +0.000 HD +ATOM 231 CZ ARG 184 -32.344 -17.503 2.777 0.00 0.00 +0.000 C +ATOM 232 NH1 ARG 184 -32.079 -16.447 3.533 0.00 0.00 +0.000 N +ATOM 233 HH11 ARG 184 -31.967 -15.541 3.135 0.00 0.00 +0.000 HD +ATOM 234 HH12 ARG 184 -31.990 -16.561 4.531 0.00 0.00 +0.000 HD +ATOM 235 NH2 ARG 184 -32.508 -18.695 3.339 0.00 0.00 +0.000 N +ATOM 236 HH21 ARG 184 -32.723 -19.488 2.764 0.00 0.00 +0.000 HD +ATOM 237 HH22 ARG 184 -32.420 -18.802 4.326 0.00 0.00 +0.000 HD +ATOM 238 C ARG 184 -33.290 -13.134 -2.923 0.00 0.00 +0.000 C +ATOM 239 O ARG 184 -34.059 -12.283 -2.466 0.00 0.00 +0.000 OA +ATOM 240 N TYR 185 -32.320 -12.830 -3.777 0.00 0.00 +0.000 N +ATOM 241 H TYR 185 -31.741 -13.617 -4.093 0.00 0.00 +0.000 HD +ATOM 242 CA TYR 185 -32.137 -11.452 -4.202 0.00 0.00 +0.000 C +ATOM 243 HA TYR 185 -32.029 -10.877 -3.383 0.00 0.00 +0.000 HD +ATOM 244 CB TYR 185 -30.880 -11.310 -5.074 0.00 0.00 +0.000 C +ATOM 245 HB2 TYR 185 -30.112 -11.686 -4.573 0.00 0.00 +0.000 HD +ATOM 246 HB3 TYR 185 -31.031 -11.809 -5.917 0.00 0.00 +0.000 HD +ATOM 247 CG TYR 185 -30.570 -9.871 -5.419 0.00 0.00 +0.000 A +ATOM 248 CD1 TYR 185 -30.431 -8.910 -4.413 0.00 0.00 +0.000 A +ATOM 249 HD1 TYR 185 -30.515 -9.183 -3.455 0.00 0.00 +0.000 HD +ATOM 250 CE1 TYR 185 -30.178 -7.574 -4.723 0.00 0.00 +0.000 A +ATOM 251 HE1 TYR 185 -30.077 -6.899 -3.995 0.00 0.00 +0.000 HD +ATOM 252 CZ TYR 185 -30.066 -7.189 -6.058 0.00 0.00 +0.000 A +ATOM 253 OH TYR 185 -29.845 -5.870 -6.376 0.00 0.00 +0.000 OA +ATOM 254 HH TYR 185 -29.842 -5.326 -5.538 0.00 0.00 +0.000 HD +ATOM 255 CE2 TYR 185 -30.197 -8.120 -7.069 0.00 0.00 +0.000 A +ATOM 256 HE2 TYR 185 -30.117 -7.847 -8.025 0.00 0.00 +0.000 HD +ATOM 257 CD2 TYR 185 -30.445 -9.460 -6.746 0.00 0.00 +0.000 A +ATOM 258 HD2 TYR 185 -30.532 -10.128 -7.480 0.00 0.00 +0.000 HD +ATOM 259 C TYR 185 -33.360 -10.955 -4.969 0.00 0.00 +0.000 C +ATOM 260 O TYR 185 -33.872 -9.872 -4.690 0.00 0.00 +0.000 OA +ATOM 261 N LEU 186 -33.840 -11.739 -5.933 0.00 0.00 +0.000 N +ATOM 262 H LEU 186 -33.347 -12.629 -6.071 0.00 0.00 +0.000 HD +ATOM 263 CA LEU 186 -35.002 -11.314 -6.721 0.00 0.00 +0.000 C +ATOM 264 HA LEU 186 -34.796 -10.410 -7.129 0.00 0.00 +0.000 HD +ATOM 265 CB LEU 186 -35.257 -12.282 -7.881 0.00 0.00 +0.000 C +ATOM 266 HB2 LEU 186 -34.873 -13.166 -7.630 0.00 0.00 +0.000 HD +ATOM 267 HB3 LEU 186 -36.241 -12.357 -8.005 0.00 0.00 +0.000 HD +ATOM 268 CG LEU 186 -34.654 -11.889 -9.231 0.00 0.00 +0.000 C +ATOM 269 HG LEU 186 -35.038 -11.015 -9.515 0.00 0.00 +0.000 HD +ATOM 270 CD1 LEU 186 -33.146 -11.763 -9.099 0.00 0.00 +0.000 C +ATOM 271 HD11 LEU 186 -32.760 -12.639 -8.806 0.00 0.00 +0.000 HD +ATOM 272 HD12 LEU 186 -32.752 -11.506 -9.982 0.00 0.00 +0.000 HD +ATOM 273 HD13 LEU 186 -32.926 -11.061 -8.421 0.00 0.00 +0.000 HD +ATOM 274 CD2 LEU 186 -35.024 -12.920 -10.294 0.00 0.00 +0.000 C +ATOM 275 HD21 LEU 186 -36.019 -12.966 -10.380 0.00 0.00 +0.000 HD +ATOM 276 HD22 LEU 186 -34.624 -12.652 -11.170 0.00 0.00 +0.000 HD +ATOM 277 HD23 LEU 186 -34.670 -13.816 -10.025 0.00 0.00 +0.000 HD +ATOM 278 C LEU 186 -36.268 -11.184 -5.879 0.00 0.00 +0.000 C +ATOM 279 O LEU 186 -37.076 -10.276 -6.093 0.00 0.00 +0.000 OA +ATOM 280 N ARG 187 -36.440 -12.076 -4.913 0.00 0.00 +0.000 N +ATOM 281 H ARG 187 -35.706 -12.783 -4.821 0.00 0.00 +0.000 HD +ATOM 282 CA ARG 187 -37.615 -11.988 -4.085 0.00 0.00 +0.000 C +ATOM 283 HA ARG 187 -38.439 -11.913 -4.678 0.00 0.00 +0.000 HD +ATOM 284 CB ARG 187 -37.800 -13.281 -3.308 0.00 0.00 +0.000 C +ATOM 285 HB2 ARG 187 -37.759 -14.036 -3.941 0.00 0.00 +0.000 HD +ATOM 286 HB3 ARG 187 -37.094 -13.340 -2.623 0.00 0.00 +0.000 HD +ATOM 287 CG ARG 187 -39.143 -13.318 -2.610 0.00 0.00 +0.000 C +ATOM 288 HG2 ARG 187 -39.139 -12.689 -1.827 0.00 0.00 +0.000 HD +ATOM 289 HG3 ARG 187 -39.867 -13.037 -3.247 0.00 0.00 +0.000 HD +ATOM 290 CD ARG 187 -39.527 -14.716 -2.071 0.00 0.00 +0.000 C +ATOM 291 HD2 ARG 187 -39.428 -15.360 -2.826 0.00 0.00 +0.000 HD +ATOM 292 HD3 ARG 187 -38.879 -14.939 -1.346 0.00 0.00 +0.000 HD +ATOM 293 NE ARG 187 -40.880 -14.758 -1.558 0.00 0.00 +0.000 N +ATOM 294 HE ARG 187 -41.022 -15.060 -0.606 0.00 0.00 +0.000 HD +ATOM 295 CZ ARG 187 -41.962 -14.422 -2.263 0.00 0.00 +0.000 C +ATOM 296 NH1 ARG 187 -41.866 -14.026 -3.524 0.00 0.00 +0.000 N +ATOM 297 HH11 ARG 187 -40.975 -13.992 -3.976 0.00 0.00 +0.000 HD +ATOM 298 HH12 ARG 187 -42.689 -13.760 -4.030 0.00 0.00 +0.000 HD +ATOM 299 NH2 ARG 187 -43.169 -14.421 -1.700 0.00 0.00 +0.000 N +ATOM 300 HH21 ARG 187 -43.253 -14.698 -0.737 0.00 0.00 +0.000 HD +ATOM 301 HH22 ARG 187 -43.969 -14.154 -2.221 0.00 0.00 +0.000 HD +ATOM 302 C ARG 187 -37.607 -10.776 -3.138 0.00 0.00 +0.000 C +ATOM 303 O ARG 187 -38.623 -10.082 -2.999 0.00 0.00 +0.000 OA +ATOM 304 N GLU 188 -36.486 -10.498 -2.479 0.00 0.00 +0.000 N +ATOM 305 H GLU 188 -35.700 -11.122 -2.635 0.00 0.00 +0.000 HD +ATOM 306 CA GLU 188 -36.463 -9.332 -1.590 0.00 0.00 +0.000 C +ATOM 307 HA GLU 188 -37.257 -9.366 -0.968 0.00 0.00 +0.000 HD +ATOM 308 CB GLU 188 -35.257 -9.375 -0.649 0.00 0.00 +0.000 C +ATOM 309 HB2 GLU 188 -35.354 -8.607 -0.018 0.00 0.00 +0.000 HD +ATOM 310 HB3 GLU 188 -35.314 -10.234 -0.143 0.00 0.00 +0.000 HD +ATOM 311 CG GLU 188 -33.914 -9.293 -1.280 0.00 0.00 +0.000 C +ATOM 312 HG2 GLU 188 -33.715 -10.144 -1.726 0.00 0.00 +0.000 HD +ATOM 313 HG3 GLU 188 -33.892 -8.530 -1.896 0.00 0.00 +0.000 HD +ATOM 314 CD GLU 188 -32.836 -9.065 -0.246 0.00 0.00 +0.000 C +ATOM 315 OE1 GLU 188 -32.857 -9.773 0.778 0.00 0.00 +0.000 OA +ATOM 316 OE2 GLU 188 -31.959 -8.199 -0.446 0.00 0.00 +0.000 OA +ATOM 317 C GLU 188 -36.491 -8.010 -2.371 0.00 0.00 +0.000 C +ATOM 318 O GLU 188 -36.955 -6.991 -1.860 0.00 0.00 +0.000 OA +ATOM 319 N GLN 189 -35.996 -8.024 -3.606 0.00 0.00 +0.000 N +ATOM 320 H GLN 189 -35.603 -8.921 -3.916 0.00 0.00 +0.000 HD +ATOM 321 CA GLN 189 -36.035 -6.818 -4.421 0.00 0.00 +0.000 C +ATOM 322 HA GLN 189 -35.710 -6.055 -3.868 0.00 0.00 +0.000 HD +ATOM 323 CB GLN 189 -35.194 -7.003 -5.691 0.00 0.00 +0.000 C +ATOM 324 HB2 GLN 189 -35.385 -7.912 -6.070 0.00 0.00 +0.000 HD +ATOM 325 HB3 GLN 189 -35.471 -6.308 -6.361 0.00 0.00 +0.000 HD +ATOM 326 CG GLN 189 -33.694 -6.884 -5.479 0.00 0.00 +0.000 C +ATOM 327 HG2 GLN 189 -33.455 -7.324 -4.617 0.00 0.00 +0.000 HD +ATOM 328 HG3 GLN 189 -33.226 -7.337 -6.234 0.00 0.00 +0.000 HD +ATOM 329 CD GLN 189 -33.241 -5.437 -5.425 0.00 0.00 +0.000 C +ATOM 330 OE1 GLN 189 -33.468 -4.676 -6.366 0.00 0.00 +0.000 OA +ATOM 331 NE2 GLN 189 -32.601 -5.047 -4.324 0.00 0.00 +0.000 N +ATOM 332 HE21 GLN 189 -32.259 -4.100 -4.226 0.00 0.00 +0.000 HD +ATOM 333 HE22 GLN 189 -32.462 -5.726 -3.575 0.00 0.00 +0.000 HD +ATOM 334 C GLN 189 -37.491 -6.535 -4.794 0.00 0.00 +0.000 C +ATOM 335 O GLN 189 -37.945 -5.398 -4.771 0.00 0.00 +0.000 OA +ATOM 336 N ALA 190 -38.227 -7.591 -5.125 0.00 0.00 +0.000 N +ATOM 337 H ALA 190 -37.734 -8.501 -5.082 0.00 0.00 +0.000 HD +ATOM 338 CA ALA 190 -39.628 -7.450 -5.517 0.00 0.00 +0.000 C +ATOM 339 HA ALA 190 -39.696 -6.704 -6.210 0.00 0.00 +0.000 HD +ATOM 340 CB ALA 190 -40.105 -8.721 -6.222 0.00 0.00 +0.000 C +ATOM 341 HB1 ALA 190 -39.426 -9.442 -6.098 0.00 0.00 +0.000 HD +ATOM 342 HB2 ALA 190 -40.976 -9.010 -5.829 0.00 0.00 +0.000 HD +ATOM 343 HB3 ALA 190 -40.222 -8.534 -7.196 0.00 0.00 +0.000 HD +ATOM 344 C ALA 190 -40.575 -7.118 -4.363 0.00 0.00 +0.000 C +ATOM 345 O ALA 190 -41.540 -6.361 -4.534 0.00 0.00 +0.000 OA +ATOM 346 N THR 191 -40.291 -7.670 -3.188 0.00 0.00 +0.000 N +ATOM 347 H THR 191 -39.428 -8.249 -3.176 0.00 0.00 +0.000 HD +ATOM 348 CA THR 191 -41.137 -7.467 -2.017 0.00 0.00 +0.000 C +ATOM 349 HA THR 191 -42.084 -7.255 -2.340 0.00 0.00 +0.000 HD +ATOM 350 CB THR 191 -41.212 -8.756 -1.190 0.00 0.00 +0.000 C +ATOM 351 HB THR 191 -41.899 -8.633 -0.445 0.00 0.00 +0.000 HD +ATOM 352 CG2 THR 191 -41.579 -9.934 -2.094 0.00 0.00 +0.000 C +ATOM 353 HG21 THR 191 -40.796 -10.553 -2.174 0.00 0.00 +0.000 HD +ATOM 354 HG22 THR 191 -42.355 -10.430 -1.701 0.00 0.00 +0.000 HD +ATOM 355 HG23 THR 191 -41.828 -9.595 -3.003 0.00 0.00 +0.000 HD +ATOM 356 OG1 THR 191 -39.938 -9.010 -0.582 0.00 0.00 +0.000 OA +ATOM 357 HG1 THR 191 -39.291 -9.367 -1.264 0.00 0.00 +0.000 HD +ATOM 358 C THR 191 -40.690 -6.337 -1.095 0.00 0.00 +0.000 C +ATOM 359 O THR 191 -41.528 -5.627 -0.535 0.00 0.00 +0.000 OA +ATOM 360 N GLY 192 -39.380 -6.175 -0.932 0.00 0.00 +0.000 N +ATOM 361 H GLY 192 -38.786 -6.840 -1.450 0.00 0.00 +0.000 HD +ATOM 362 CA GLY 192 -38.866 -5.120 -0.073 0.00 0.00 +0.000 C +ATOM 363 HA2 GLY 192 -38.083 -4.662 -0.540 0.00 0.00 +0.000 HD +ATOM 364 HA3 GLY 192 -39.585 -4.405 0.045 0.00 0.00 +0.000 HD +ATOM 365 C GLY 192 -38.419 -5.605 1.289 0.00 0.00 +0.000 C +ATOM 366 O GLY 192 -38.015 -4.815 2.149 0.00 0.00 +0.000 OA +ATOM 367 N ALA 193 -38.481 -6.913 1.503 0.00 0.00 +0.000 N +ATOM 368 H ALA 193 -38.812 -7.479 0.708 0.00 0.00 +0.000 HD +ATOM 369 CA ALA 193 -38.095 -7.481 2.800 0.00 0.00 +0.000 C +ATOM 370 HA ALA 193 -37.816 -6.717 3.416 0.00 0.00 +0.000 HD +ATOM 371 CB ALA 193 -39.311 -8.131 3.428 0.00 0.00 +0.000 C +ATOM 372 HB1 ALA 193 -39.671 -8.836 2.816 0.00 0.00 +0.000 HD +ATOM 373 HB2 ALA 193 -39.057 -8.551 4.300 0.00 0.00 +0.000 HD +ATOM 374 HB3 ALA 193 -40.018 -7.441 3.588 0.00 0.00 +0.000 HD +ATOM 375 C ALA 193 -36.941 -8.491 2.737 0.00 0.00 +0.000 C +ATOM 376 O ALA 193 -36.797 -9.218 1.764 0.00 0.00 +0.000 OA +ATOM 377 N LYS 194 -36.137 -8.521 3.792 0.00 0.00 +0.000 N +ATOM 378 H LYS 194 -36.399 -7.834 4.546 0.00 0.00 +0.000 HD +ATOM 379 CA LYS 194 -35.000 -9.414 3.905 0.00 0.00 +0.000 C +ATOM 380 HA LYS 194 -34.637 -9.608 2.994 0.00 0.00 +0.000 HD +ATOM 381 CB LYS 194 -33.962 -8.782 4.828 0.00 0.00 +0.000 C +ATOM 382 HB2 LYS 194 -34.314 -7.891 5.142 0.00 0.00 +0.000 HD +ATOM 383 HB3 LYS 194 -33.850 -9.376 5.637 0.00 0.00 +0.000 HD +ATOM 384 CG LYS 194 -32.552 -8.537 4.238 0.00 0.00 +0.000 C +ATOM 385 HG2 LYS 194 -32.228 -9.382 3.836 0.00 0.00 +0.000 HD +ATOM 386 HG3 LYS 194 -32.614 -7.819 3.560 0.00 0.00 +0.000 HD +ATOM 387 CD LYS 194 -31.598 -8.106 5.345 0.00 0.00 +0.000 C +ATOM 388 HD2 LYS 194 -30.683 -8.034 4.977 0.00 0.00 +0.000 HD +ATOM 389 HD3 LYS 194 -31.904 -7.246 5.723 0.00 0.00 +0.000 HD +ATOM 390 CE LYS 194 -31.578 -9.150 6.480 0.00 0.00 +0.000 C +ATOM 391 HE2 LYS 194 -31.475 -8.660 7.367 0.00 0.00 +0.000 HD +ATOM 392 HE3 LYS 194 -32.485 -9.612 6.509 0.00 0.00 +0.000 HD +ATOM 393 NZ LYS 194 -30.502 -10.219 6.399 0.00 0.00 +0.000 N +ATOM 394 HZ1 LYS 194 -29.673 -9.866 6.821 0.00 0.00 +0.000 HD +ATOM 395 HZ2 LYS 194 -30.821 -11.027 6.884 0.00 0.00 +0.000 HD +ATOM 396 HZ3 LYS 194 -30.339 -10.432 5.441 0.00 0.00 +0.000 HD +ATOM 397 C LYS 194 -35.461 -10.736 4.534 0.00 0.00 +0.000 C +ATOM 398 O LYS 194 -36.205 -10.719 5.517 0.00 0.00 +0.000 OA +ATOM 399 N ASP 195 -35.042 -11.872 3.975 0.00 0.00 +0.000 N +ATOM 400 H ASP 195 -34.456 -11.759 3.133 0.00 0.00 +0.000 HD +ATOM 401 CA ASP 195 -35.407 -13.175 4.543 0.00 0.00 +0.000 C +ATOM 402 HA ASP 195 -36.292 -13.075 4.961 0.00 0.00 +0.000 HD +ATOM 403 CB ASP 195 -35.264 -14.296 3.512 0.00 0.00 +0.000 C +ATOM 404 HB2 ASP 195 -35.753 -14.024 2.693 0.00 0.00 +0.000 HD +ATOM 405 HB3 ASP 195 -34.299 -14.418 3.323 0.00 0.00 +0.000 HD +ATOM 406 CG ASP 195 -35.836 -15.608 4.010 0.00 0.00 +0.000 C +ATOM 407 OD1 ASP 195 -35.806 -15.841 5.242 0.00 0.00 +0.000 OA +ATOM 408 OD2 ASP 195 -36.306 -16.414 3.179 0.00 0.00 +0.000 OA +ATOM 409 C ASP 195 -34.400 -13.409 5.671 0.00 0.00 +0.000 C +ATOM 410 O ASP 195 -33.192 -13.293 5.460 0.00 0.00 +0.000 OA +ATOM 411 N THR 196 -34.881 -13.764 6.859 0.00 0.00 +0.000 N +ATOM 412 H THR 196 -35.908 -13.876 6.902 0.00 0.00 +0.000 HD +ATOM 413 CA THR 196 -33.995 -13.974 8.004 0.00 0.00 +0.000 C +ATOM 414 HA THR 196 -33.160 -13.396 7.871 0.00 0.00 +0.000 HD +ATOM 415 CB THR 196 -34.663 -13.462 9.298 0.00 0.00 +0.000 C +ATOM 416 HB THR 196 -34.741 -12.447 9.246 0.00 0.00 +0.000 HD +ATOM 417 CG2 THR 196 -36.039 -14.081 9.476 0.00 0.00 +0.000 C +ATOM 418 HG21 THR 196 -36.744 -13.372 9.400 0.00 0.00 +0.000 HD +ATOM 419 HG22 THR 196 -36.195 -14.775 8.769 0.00 0.00 +0.000 HD +ATOM 420 HG23 THR 196 -36.105 -14.513 10.379 0.00 0.00 +0.000 HD +ATOM 421 OG1 THR 196 -33.838 -13.793 10.419 0.00 0.00 +0.000 OA +ATOM 422 HG1 THR 196 -33.244 -14.575 10.199 0.00 0.00 +0.000 HD +ATOM 423 C THR 196 -33.533 -15.420 8.225 0.00 0.00 +0.000 C +ATOM 424 O THR 196 -32.717 -15.686 9.106 0.00 0.00 +0.000 OA +ATOM 425 N LYS 197 -34.047 -16.354 7.436 0.00 0.00 +0.000 N +ATOM 426 H LYS 197 -34.728 -16.019 6.736 0.00 0.00 +0.000 HD +ATOM 427 CA LYS 197 -33.653 -17.761 7.574 0.00 0.00 +0.000 C +ATOM 428 HA LYS 197 -33.695 -18.013 8.550 0.00 0.00 +0.000 HD +ATOM 429 CB LYS 197 -34.582 -18.672 6.768 0.00 0.00 +0.000 C +ATOM 430 HB2 LYS 197 -34.700 -18.260 5.855 0.00 0.00 +0.000 HD +ATOM 431 HB3 LYS 197 -34.116 -19.560 6.652 0.00 0.00 +0.000 HD +ATOM 432 CG LYS 197 -35.945 -18.920 7.360 0.00 0.00 +0.000 C +ATOM 433 HG2 LYS 197 -35.859 -19.468 8.180 0.00 0.00 +0.000 HD +ATOM 434 HG3 LYS 197 -36.390 -18.057 7.552 0.00 0.00 +0.000 HD +ATOM 435 CD LYS 197 -36.792 -19.691 6.345 0.00 0.00 +0.000 C +ATOM 436 HD2 LYS 197 -36.349 -20.560 6.155 0.00 0.00 +0.000 HD +ATOM 437 HD3 LYS 197 -37.697 -19.837 6.728 0.00 0.00 +0.000 HD +ATOM 438 CE LYS 197 -36.937 -18.921 5.034 0.00 0.00 +0.000 C +ATOM 439 HE2 LYS 197 -37.346 -18.024 5.233 0.00 0.00 +0.000 HD +ATOM 440 HE3 LYS 197 -36.021 -18.775 4.645 0.00 0.00 +0.000 HD +ATOM 441 NZ LYS 197 -37.781 -19.638 4.047 0.00 0.00 +0.000 N +ATOM 442 HZ1 LYS 197 -37.836 -19.103 3.203 0.00 0.00 +0.000 HD +ATOM 443 HZ2 LYS 197 -37.377 -20.532 3.849 0.00 0.00 +0.000 HD +ATOM 444 HZ3 LYS 197 -38.700 -19.763 4.422 0.00 0.00 +0.000 HD +ATOM 445 C LYS 197 -32.235 -17.999 7.066 0.00 0.00 +0.000 C +ATOM 446 O LYS 197 -31.797 -17.352 6.116 0.00 0.00 +0.000 OA +ATOM 447 N PRO 198 -31.498 -18.937 7.693 0.00 0.00 +0.000 N +ATOM 448 CD PRO 198 -31.793 -19.679 8.933 0.00 0.00 +0.000 C +ATOM 449 HD2 PRO 198 -32.731 -20.015 8.924 0.00 0.00 +0.000 HD +ATOM 450 HD3 PRO 198 -31.646 -19.099 9.731 0.00 0.00 +0.000 HD +ATOM 451 CG PRO 198 -30.801 -20.803 8.874 0.00 0.00 +0.000 C +ATOM 452 HG2 PRO 198 -31.115 -21.527 8.265 0.00 0.00 +0.000 HD +ATOM 453 HG3 PRO 198 -30.624 -21.173 9.782 0.00 0.00 +0.000 HD +ATOM 454 CB PRO 198 -29.581 -20.144 8.326 0.00 0.00 +0.000 C +ATOM 455 HB2 PRO 198 -28.955 -20.816 7.932 0.00 0.00 +0.000 HD +ATOM 456 HB3 PRO 198 -29.107 -19.620 9.032 0.00 0.00 +0.000 HD +ATOM 457 CA PRO 198 -30.132 -19.217 7.241 0.00 0.00 +0.000 C +ATOM 458 HA PRO 198 -29.578 -18.369 7.242 0.00 0.00 +0.000 HD +ATOM 459 C PRO 198 -30.105 -19.878 5.874 0.00 0.00 +0.000 C +ATOM 460 O PRO 198 -31.050 -20.558 5.479 0.00 0.00 +0.000 OA +ATOM 461 N MET 199 -29.018 -19.659 5.146 0.00 0.00 +0.000 N +ATOM 462 H MET 199 -28.313 -19.040 5.584 0.00 0.00 +0.000 HD +ATOM 463 CA MET 199 -28.864 -20.261 3.834 0.00 0.00 +0.000 C +ATOM 464 HA MET 199 -29.708 -20.131 3.324 0.00 0.00 +0.000 HD +ATOM 465 CB MET 199 -27.650 -19.656 3.126 0.00 0.00 +0.000 C +ATOM 466 HB2 MET 199 -26.845 -19.720 3.736 0.00 0.00 +0.000 HD +ATOM 467 HB3 MET 199 -27.449 -20.196 2.295 0.00 0.00 +0.000 HD +ATOM 468 CG MET 199 -27.807 -18.184 2.705 0.00 0.00 +0.000 C +ATOM 469 HG2 MET 199 -28.163 -17.663 3.515 0.00 0.00 +0.000 HD +ATOM 470 HG3 MET 199 -26.869 -17.806 2.530 0.00 0.00 +0.000 HD +ATOM 471 SD MET 199 -28.869 -17.976 1.279 0.00 0.00 +0.000 S +ATOM 472 CE MET 199 -29.039 -16.192 1.184 0.00 0.00 +0.000 C +ATOM 473 HE1 MET 199 -28.557 -15.769 1.952 0.00 0.00 +0.000 HD +ATOM 474 HE2 MET 199 -28.647 -15.864 0.324 0.00 0.00 +0.000 HD +ATOM 475 HE3 MET 199 -30.008 -15.946 1.223 0.00 0.00 +0.000 HD +ATOM 476 C MET 199 -28.659 -21.757 4.034 0.00 0.00 +0.000 C +ATOM 477 O MET 199 -28.502 -22.222 5.167 0.00 0.00 +0.000 OA +ATOM 478 N GLY 200 -28.675 -22.519 2.944 0.00 0.00 +0.000 N +ATOM 479 H GLY 200 -28.837 -22.025 2.059 0.00 0.00 +0.000 HD +ATOM 480 CA GLY 200 -28.471 -23.950 3.064 0.00 0.00 +0.000 C +ATOM 481 HA2 GLY 200 -29.090 -24.324 3.751 0.00 0.00 +0.000 HD +ATOM 482 HA3 GLY 200 -28.639 -24.391 2.185 0.00 0.00 +0.000 HD +ATOM 483 C GLY 200 -27.036 -24.195 3.488 0.00 0.00 +0.000 C +ATOM 484 O GLY 200 -26.294 -23.225 3.695 0.00 0.00 +0.000 OA +ATOM 485 N SER 202 -22.146 -24.130 3.748 0.00 0.00 +0.000 NA +ATOM 486 H SER 202 -22.234 -23.719 4.664 0.00 0.00 +0.000 HD +ATOM 487 CA SER 202 -22.622 -23.510 2.517 0.00 0.00 +0.000 C +ATOM 488 HA SER 202 -21.830 -23.349 1.919 0.00 0.00 +0.000 HD +ATOM 489 CB SER 202 -23.636 -24.435 1.814 0.00 0.00 +0.000 C +ATOM 490 HB2 SER 202 -24.414 -24.578 2.423 0.00 0.00 +0.000 HD +ATOM 491 HB3 SER 202 -23.943 -23.992 0.974 0.00 0.00 +0.000 HD +ATOM 492 OG SER 202 -23.074 -25.710 1.481 0.00 0.00 +0.000 OA +ATOM 493 HG SER 202 -22.978 -25.775 0.491 0.00 0.00 +0.000 HD +ATOM 494 C SER 202 -23.272 -22.153 2.804 0.00 0.00 +0.000 C +ATOM 495 O SER 202 -23.310 -21.276 1.936 0.00 0.00 +0.000 OA +ATOM 496 N GLY 203 -23.777 -21.984 4.021 0.00 0.00 +0.000 N +ATOM 497 H GLY 203 -23.655 -22.788 4.661 0.00 0.00 +0.000 HD +ATOM 498 CA GLY 203 -24.441 -20.751 4.383 0.00 0.00 +0.000 C +ATOM 499 HA2 GLY 203 -25.256 -20.613 3.746 0.00 0.00 +0.000 HD +ATOM 500 HA3 GLY 203 -24.892 -20.877 5.315 0.00 0.00 +0.000 HD +ATOM 501 C GLY 203 -23.633 -19.469 4.412 0.00 0.00 +0.000 C +ATOM 502 O GLY 203 -24.079 -18.443 3.888 0.00 0.00 +0.000 OA +ATOM 503 N ALA 204 -22.455 -19.505 5.029 0.00 0.00 +0.000 N +ATOM 504 H ALA 204 -22.188 -20.427 5.414 0.00 0.00 +0.000 HD +ATOM 505 CA ALA 204 -21.620 -18.309 5.138 0.00 0.00 +0.000 C +ATOM 506 HA ALA 204 -22.069 -17.664 5.793 0.00 0.00 +0.000 HD +ATOM 507 CB ALA 204 -20.295 -18.660 5.774 0.00 0.00 +0.000 C +ATOM 508 HB1 ALA 204 -19.693 -19.083 5.094 0.00 0.00 +0.000 HD +ATOM 509 HB2 ALA 204 -19.858 -17.831 6.128 0.00 0.00 +0.000 HD +ATOM 510 HB3 ALA 204 -20.440 -19.302 6.529 0.00 0.00 +0.000 HD +ATOM 511 C ALA 204 -21.387 -17.579 3.827 0.00 0.00 +0.000 C +ATOM 512 O ALA 204 -21.739 -16.404 3.713 0.00 0.00 +0.000 OA +ATOM 513 N THR 205 -20.775 -18.251 2.859 0.00 0.00 +0.000 N +ATOM 514 H THR 205 -20.498 -19.217 3.100 0.00 0.00 +0.000 HD +ATOM 515 CA THR 205 -20.532 -17.633 1.568 0.00 0.00 +0.000 C +ATOM 516 HA THR 205 -19.930 -16.829 1.705 0.00 0.00 +0.000 HD +ATOM 517 CB THR 205 -19.838 -18.600 0.603 0.00 0.00 +0.000 C +ATOM 518 HB THR 205 -20.388 -19.459 0.541 0.00 0.00 +0.000 HD +ATOM 519 CG2 THR 205 -19.688 -17.969 -0.767 0.00 0.00 +0.000 C +ATOM 520 HG21 THR 205 -18.922 -18.393 -1.258 0.00 0.00 +0.000 HD +ATOM 521 HG22 THR 205 -20.529 -18.100 -1.299 0.00 0.00 +0.000 HD +ATOM 522 HG23 THR 205 -19.511 -16.986 -0.674 0.00 0.00 +0.000 HD +ATOM 523 OG1 THR 205 -18.539 -18.940 1.106 0.00 0.00 +0.000 OA +ATOM 524 HG1 THR 205 -17.858 -18.903 0.367 0.00 0.00 +0.000 HD +ATOM 525 C THR 205 -21.813 -17.161 0.908 0.00 0.00 +0.000 C +ATOM 526 O THR 205 -21.870 -16.049 0.377 0.00 0.00 +0.000 OA +ATOM 527 N SER 206 -22.849 -17.987 0.930 0.00 0.00 +0.000 N +ATOM 528 H SER 206 -22.712 -18.880 1.388 0.00 0.00 +0.000 HD +ATOM 529 CA SER 206 -24.082 -17.545 0.301 0.00 0.00 +0.000 C +ATOM 530 HA SER 206 -23.894 -17.344 -0.664 0.00 0.00 +0.000 HD +ATOM 531 CB SER 206 -25.163 -18.627 0.400 0.00 0.00 +0.000 C +ATOM 532 HB2 SER 206 -25.271 -18.884 1.360 0.00 0.00 +0.000 HD +ATOM 533 HB3 SER 206 -26.023 -18.250 0.057 0.00 0.00 +0.000 HD +ATOM 534 OG SER 206 -24.833 -19.780 -0.352 0.00 0.00 +0.000 OA +ATOM 535 HG SER 206 -24.317 -20.416 0.221 0.00 0.00 +0.000 HD +ATOM 536 C SER 206 -24.580 -16.241 0.955 0.00 0.00 +0.000 C +ATOM 537 O SER 206 -25.060 -15.346 0.260 0.00 0.00 +0.000 OA +ATOM 538 N ARG 207 -24.463 -16.128 2.280 0.00 0.00 +0.000 N +ATOM 539 H ARG 207 -24.026 -16.932 2.753 0.00 0.00 +0.000 HD +ATOM 540 CA ARG 207 -24.935 -14.931 2.966 0.00 0.00 +0.000 C +ATOM 541 HA ARG 207 -25.912 -14.791 2.736 0.00 0.00 +0.000 HD +ATOM 542 CB ARG 207 -24.870 -15.099 4.487 0.00 0.00 +0.000 C +ATOM 543 HB2 ARG 207 -25.449 -15.865 4.741 0.00 0.00 +0.000 HD +ATOM 544 HB3 ARG 207 -23.926 -15.277 4.741 0.00 0.00 +0.000 HD +ATOM 545 CG ARG 207 -25.343 -13.873 5.257 0.00 0.00 +0.000 C +ATOM 546 HG2 ARG 207 -24.726 -13.107 5.076 0.00 0.00 +0.000 HD +ATOM 547 HG3 ARG 207 -26.268 -13.633 4.965 0.00 0.00 +0.000 HD +ATOM 548 CD ARG 207 -25.374 -14.106 6.768 0.00 0.00 +0.000 C +ATOM 549 HD2 ARG 207 -25.475 -13.222 7.213 0.00 0.00 +0.000 HD +ATOM 550 HD3 ARG 207 -26.156 -14.687 6.972 0.00 0.00 +0.000 HD +ATOM 551 NE ARG 207 -24.150 -14.753 7.248 0.00 0.00 +0.000 N +ATOM 552 HE ARG 207 -23.369 -14.165 7.482 0.00 0.00 +0.000 HD +ATOM 553 CZ ARG 207 -24.008 -16.068 7.394 0.00 0.00 +0.000 C +ATOM 554 NH1 ARG 207 -25.010 -16.887 7.093 0.00 0.00 +0.000 N +ATOM 555 HH11 ARG 207 -25.871 -16.536 6.737 0.00 0.00 +0.000 HD +ATOM 556 HH12 ARG 207 -24.897 -17.879 7.226 0.00 0.00 +0.000 HD +ATOM 557 NH2 ARG 207 -22.882 -16.570 7.876 0.00 0.00 +0.000 N +ATOM 558 HH21 ARG 207 -22.127 -15.951 8.113 0.00 0.00 +0.000 HD +ATOM 559 HH22 ARG 207 -22.779 -17.553 8.003 0.00 0.00 +0.000 HD +ATOM 560 C ARG 207 -24.159 -13.691 2.565 0.00 0.00 +0.000 C +ATOM 561 O ARG 207 -24.739 -12.622 2.380 0.00 0.00 +0.000 OA +ATOM 562 N LYS 208 -22.847 -13.824 2.452 0.00 0.00 +0.000 N +ATOM 563 H LYS 208 -22.477 -14.764 2.651 0.00 0.00 +0.000 HD +ATOM 564 CA LYS 208 -22.031 -12.689 2.070 0.00 0.00 +0.000 C +ATOM 565 HA LYS 208 -22.285 -11.895 2.630 0.00 0.00 +0.000 HD +ATOM 566 CB LYS 208 -20.548 -12.995 2.327 0.00 0.00 +0.000 C +ATOM 567 HB2 LYS 208 -20.249 -13.677 1.671 0.00 0.00 +0.000 HD +ATOM 568 HB3 LYS 208 -20.030 -12.155 2.219 0.00 0.00 +0.000 HD +ATOM 569 CG LYS 208 -20.272 -13.545 3.743 0.00 0.00 +0.000 C +ATOM 570 HG2 LYS 208 -20.522 -12.847 4.412 0.00 0.00 +0.000 HD +ATOM 571 HG3 LYS 208 -20.829 -14.361 3.884 0.00 0.00 +0.000 HD +ATOM 572 CD LYS 208 -18.793 -13.913 3.941 0.00 0.00 +0.000 C +ATOM 573 HD2 LYS 208 -18.726 -14.565 4.691 0.00 0.00 +0.000 HD +ATOM 574 HD3 LYS 208 -18.451 -14.319 3.099 0.00 0.00 +0.000 HD +ATOM 575 CE LYS 208 -17.930 -12.693 4.278 0.00 0.00 +0.000 C +ATOM 576 HE2 LYS 208 -16.968 -12.964 4.247 0.00 0.00 +0.000 HD +ATOM 577 HE3 LYS 208 -18.098 -11.984 3.594 0.00 0.00 +0.000 HD +ATOM 578 NZ LYS 208 -18.254 -12.166 5.628 0.00 0.00 +0.000 N +ATOM 579 HZ1 LYS 208 -18.502 -12.924 6.231 0.00 0.00 +0.000 HD +ATOM 580 HZ2 LYS 208 -17.457 -11.691 6.000 0.00 0.00 +0.000 HD +ATOM 581 HZ3 LYS 208 -19.022 -11.528 5.561 0.00 0.00 +0.000 HD +ATOM 582 C LYS 208 -22.269 -12.344 0.603 0.00 0.00 +0.000 C +ATOM 583 O LYS 208 -22.216 -11.180 0.220 0.00 0.00 +0.000 OA +ATOM 584 N ALA 209 -22.535 -13.358 -0.219 0.00 0.00 +0.000 N +ATOM 585 H ALA 209 -22.551 -14.292 0.224 0.00 0.00 +0.000 HD +ATOM 586 CA ALA 209 -22.784 -13.136 -1.649 0.00 0.00 +0.000 C +ATOM 587 HA ALA 209 -22.020 -12.620 -2.033 0.00 0.00 +0.000 HD +ATOM 588 CB ALA 209 -22.907 -14.491 -2.387 0.00 0.00 +0.000 C +ATOM 589 HB1 ALA 209 -23.859 -14.782 -2.368 0.00 0.00 +0.000 HD +ATOM 590 HB2 ALA 209 -22.604 -14.373 -3.328 0.00 0.00 +0.000 HD +ATOM 591 HB3 ALA 209 -22.335 -15.162 -1.925 0.00 0.00 +0.000 HD +ATOM 592 C ALA 209 -24.065 -12.313 -1.817 0.00 0.00 +0.000 C +ATOM 593 O ALA 209 -24.118 -11.411 -2.654 0.00 0.00 +0.000 OA +ATOM 594 N LEU 210 -25.086 -12.614 -1.014 0.00 0.00 +0.000 N +ATOM 595 H LEU 210 -24.914 -13.393 -0.359 0.00 0.00 +0.000 HD +ATOM 596 CA LEU 210 -26.340 -11.872 -1.086 0.00 0.00 +0.000 C +ATOM 597 HA LEU 210 -26.663 -11.880 -2.037 0.00 0.00 +0.000 HD +ATOM 598 CB LEU 210 -27.393 -12.512 -0.177 0.00 0.00 +0.000 C +ATOM 599 HB2 LEU 210 -27.535 -13.450 -0.489 0.00 0.00 +0.000 HD +ATOM 600 HB3 LEU 210 -27.031 -12.517 0.753 0.00 0.00 +0.000 HD +ATOM 601 CG LEU 210 -28.766 -11.836 -0.129 0.00 0.00 +0.000 C +ATOM 602 HG LEU 210 -28.666 -10.918 0.234 0.00 0.00 +0.000 HD +ATOM 603 CD1 LEU 210 -29.339 -11.757 -1.551 0.00 0.00 +0.000 C +ATOM 604 HD11 LEU 210 -29.430 -12.680 -1.919 0.00 0.00 +0.000 HD +ATOM 605 HD12 LEU 210 -30.234 -11.316 -1.520 0.00 0.00 +0.000 HD +ATOM 606 HD13 LEU 210 -28.720 -11.224 -2.125 0.00 0.00 +0.000 HD +ATOM 607 CD2 LEU 210 -29.717 -12.614 0.785 0.00 0.00 +0.000 C +ATOM 608 HD21 LEU 210 -29.336 -12.644 1.708 0.00 0.00 +0.000 HD +ATOM 609 HD22 LEU 210 -30.605 -12.157 0.802 0.00 0.00 +0.000 HD +ATOM 610 HD23 LEU 210 -29.824 -13.544 0.435 0.00 0.00 +0.000 HD +ATOM 611 C LEU 210 -26.126 -10.426 -0.661 0.00 0.00 +0.000 C +ATOM 612 O LEU 210 -26.672 -9.500 -1.267 0.00 0.00 +0.000 OA +ATOM 613 N GLU 211 -25.336 -10.239 0.392 0.00 0.00 +0.000 N +ATOM 614 H GLU 211 -24.941 -11.106 0.802 0.00 0.00 +0.000 HD +ATOM 615 CA GLU 211 -25.060 -8.902 0.914 0.00 0.00 +0.000 C +ATOM 616 HA GLU 211 -25.921 -8.451 1.161 0.00 0.00 +0.000 HD +ATOM 617 CB GLU 211 -24.248 -9.010 2.216 0.00 0.00 +0.000 C +ATOM 618 HB2 GLU 211 -23.607 -9.734 2.109 0.00 0.00 +0.000 HD +ATOM 619 HB3 GLU 211 -23.845 -8.143 2.390 0.00 0.00 +0.000 HD +ATOM 620 CG GLU 211 -25.141 -9.355 3.414 0.00 0.00 +0.000 C +ATOM 621 HG2 GLU 211 -25.576 -8.524 3.721 0.00 0.00 +0.000 HD +ATOM 622 HG3 GLU 211 -25.805 -10.024 3.121 0.00 0.00 +0.000 HD +ATOM 623 CD GLU 211 -24.396 -9.950 4.615 0.00 0.00 +0.000 C +ATOM 624 OE1 GLU 211 -23.160 -10.134 4.545 0.00 0.00 +0.000 OA +ATOM 625 OE2 GLU 211 -25.066 -10.236 5.638 0.00 0.00 +0.000 OA +ATOM 626 C GLU 211 -24.331 -8.066 -0.137 0.00 0.00 +0.000 C +ATOM 627 O GLU 211 -24.606 -6.878 -0.308 0.00 0.00 +0.000 OA +ATOM 628 N THR 212 -23.403 -8.695 -0.850 0.00 0.00 +0.000 N +ATOM 629 H THR 212 -23.261 -9.693 -0.597 0.00 0.00 +0.000 HD +ATOM 630 CA THR 212 -22.652 -8.019 -1.903 0.00 0.00 +0.000 C +ATOM 631 HA THR 212 -22.234 -7.197 -1.521 0.00 0.00 +0.000 HD +ATOM 632 CB THR 212 -21.593 -8.951 -2.489 0.00 0.00 +0.000 C +ATOM 633 HB THR 212 -22.050 -9.782 -2.864 0.00 0.00 +0.000 HD +ATOM 634 CG2 THR 212 -20.804 -8.250 -3.592 0.00 0.00 +0.000 C +ATOM 635 HG21 THR 212 -20.406 -8.932 -4.208 0.00 0.00 +0.000 HD +ATOM 636 HG22 THR 212 -21.413 -7.649 -4.113 0.00 0.00 +0.000 HD +ATOM 637 HG23 THR 212 -20.069 -7.704 -3.186 0.00 0.00 +0.000 HD +ATOM 638 OG1 THR 212 -20.707 -9.364 -1.445 0.00 0.00 +0.000 OA +ATOM 639 HG1 THR 212 -21.163 -10.025 -0.839 0.00 0.00 +0.000 HD +ATOM 640 C THR 212 -23.621 -7.598 -3.006 0.00 0.00 +0.000 C +ATOM 641 O THR 212 -23.522 -6.497 -3.545 0.00 0.00 +0.000 OA +ATOM 642 N LEU 213 -24.557 -8.483 -3.353 0.00 0.00 +0.000 N +ATOM 643 H LEU 213 -24.524 -9.381 -2.857 0.00 0.00 +0.000 HD +ATOM 644 CA LEU 213 -25.546 -8.147 -4.381 0.00 0.00 +0.000 C +ATOM 645 HA LEU 213 -25.055 -7.882 -5.224 0.00 0.00 +0.000 HD +ATOM 646 CB LEU 213 -26.428 -9.358 -4.726 0.00 0.00 +0.000 C +ATOM 647 HB2 LEU 213 -26.596 -9.861 -3.876 0.00 0.00 +0.000 HD +ATOM 648 HB3 LEU 213 -27.295 -9.008 -5.081 0.00 0.00 +0.000 HD +ATOM 649 CG LEU 213 -25.884 -10.357 -5.747 0.00 0.00 +0.000 C +ATOM 650 HG LEU 213 -24.983 -10.658 -5.458 0.00 0.00 +0.000 HD +ATOM 651 CD1 LEU 213 -26.821 -11.552 -5.819 0.00 0.00 +0.000 C +ATOM 652 HD11 LEU 213 -27.732 -11.247 -6.099 0.00 0.00 +0.000 HD +ATOM 653 HD12 LEU 213 -26.472 -12.212 -6.486 0.00 0.00 +0.000 HD +ATOM 654 HD13 LEU 213 -26.878 -11.987 -4.920 0.00 0.00 +0.000 HD +ATOM 655 CD2 LEU 213 -25.750 -9.692 -7.117 0.00 0.00 +0.000 C +ATOM 656 HD21 LEU 213 -25.122 -8.917 -7.049 0.00 0.00 +0.000 HD +ATOM 657 HD22 LEU 213 -25.394 -10.356 -7.774 0.00 0.00 +0.000 HD +ATOM 658 HD23 LEU 213 -26.647 -9.371 -7.418 0.00 0.00 +0.000 HD +ATOM 659 C LEU 213 -26.448 -6.975 -3.966 0.00 0.00 +0.000 C +ATOM 660 O LEU 213 -26.835 -6.171 -4.802 0.00 0.00 +0.000 OA +ATOM 661 N ARG 214 -26.796 -6.887 -2.684 0.00 0.00 +0.000 N +ATOM 662 H ARG 214 -26.430 -7.627 -2.072 0.00 0.00 +0.000 HD +ATOM 663 CA ARG 214 -27.649 -5.788 -2.220 0.00 0.00 +0.000 C +ATOM 664 HA ARG 214 -28.475 -5.762 -2.789 0.00 0.00 +0.000 HD +ATOM 665 CB ARG 214 -28.025 -5.958 -0.756 0.00 0.00 +0.000 C +ATOM 666 HB2 ARG 214 -27.182 -6.127 -0.238 0.00 0.00 +0.000 HD +ATOM 667 HB3 ARG 214 -28.433 -5.097 -0.439 0.00 0.00 +0.000 HD +ATOM 668 CG ARG 214 -28.986 -7.069 -0.472 0.00 0.00 +0.000 C +ATOM 669 HG2 ARG 214 -29.854 -6.889 -0.908 0.00 0.00 +0.000 HD +ATOM 670 HG3 ARG 214 -28.606 -7.932 -0.769 0.00 0.00 +0.000 HD +ATOM 671 CD ARG 214 -29.212 -7.141 1.020 0.00 0.00 +0.000 C +ATOM 672 HD2 ARG 214 -28.324 -7.169 1.469 0.00 0.00 +0.000 HD +ATOM 673 HD3 ARG 214 -29.714 -6.327 1.299 0.00 0.00 +0.000 HD +ATOM 674 NE ARG 214 -29.974 -8.325 1.382 0.00 0.00 +0.000 N +ATOM 675 HE ARG 214 -30.629 -8.690 0.709 0.00 0.00 +0.000 HD +ATOM 676 CZ ARG 214 -29.859 -8.952 2.541 0.00 0.00 +0.000 C +ATOM 677 NH1 ARG 214 -29.010 -8.502 3.450 0.00 0.00 +0.000 N +ATOM 678 HH11 ARG 214 -28.462 -7.685 3.296 0.00 0.00 +0.000 HD +ATOM 679 HH12 ARG 214 -28.912 -8.997 4.327 0.00 0.00 +0.000 HD +ATOM 680 NH2 ARG 214 -30.589 -10.032 2.782 0.00 0.00 +0.000 N +ATOM 681 HH21 ARG 214 -31.240 -10.358 2.092 0.00 0.00 +0.000 HD +ATOM 682 HH22 ARG 214 -30.494 -10.521 3.648 0.00 0.00 +0.000 HD +ATOM 683 C ARG 214 -26.916 -4.468 -2.353 0.00 0.00 +0.000 C +ATOM 684 O ARG 214 -27.527 -3.411 -2.529 0.00 0.00 +0.000 OA +ATOM 685 N ARG 215 -25.598 -4.531 -2.240 0.00 0.00 +0.000 N +ATOM 686 H ARG 215 -25.218 -5.484 -2.074 0.00 0.00 +0.000 HD +ATOM 687 CA ARG 215 -24.772 -3.343 -2.344 0.00 0.00 +0.000 C +ATOM 688 HA ARG 215 -25.251 -2.571 -1.903 0.00 0.00 +0.000 HD +ATOM 689 CB ARG 215 -23.456 -3.579 -1.595 0.00 0.00 +0.000 C +ATOM 690 HB2 ARG 215 -23.668 -3.684 -0.620 0.00 0.00 +0.000 HD +ATOM 691 HB3 ARG 215 -23.054 -4.433 -1.934 0.00 0.00 +0.000 HD +ATOM 692 CG ARG 215 -22.404 -2.483 -1.729 0.00 0.00 +0.000 C +ATOM 693 HG2 ARG 215 -21.960 -2.554 -2.610 0.00 0.00 +0.000 HD +ATOM 694 HG3 ARG 215 -22.830 -1.598 -1.612 0.00 0.00 +0.000 HD +ATOM 695 CD ARG 215 -21.336 -2.642 -0.644 0.00 0.00 +0.000 C +ATOM 696 HD2 ARG 215 -20.586 -2.020 -0.858 0.00 0.00 +0.000 HD +ATOM 697 HD3 ARG 215 -21.748 -2.390 0.229 0.00 0.00 +0.000 HD +ATOM 698 NE ARG 215 -20.817 -4.012 -0.557 0.00 0.00 +0.000 N +ATOM 699 HE ARG 215 -21.280 -4.645 0.082 0.00 0.00 +0.000 HD +ATOM 700 CZ ARG 215 -19.786 -4.485 -1.253 0.00 0.00 +0.000 C +ATOM 701 NH1 ARG 215 -19.136 -3.710 -2.101 0.00 0.00 +0.000 N +ATOM 702 HH11 ARG 215 -19.389 -2.752 -2.223 0.00 0.00 +0.000 HD +ATOM 703 HH12 ARG 215 -18.369 -4.086 -2.636 0.00 0.00 +0.000 HD +ATOM 704 NH2 ARG 215 -19.408 -5.743 -1.095 0.00 0.00 +0.000 N +ATOM 705 HH21 ARG 215 -19.886 -6.331 -0.437 0.00 0.00 +0.000 HD +ATOM 706 HH22 ARG 215 -18.646 -6.112 -1.627 0.00 0.00 +0.000 HD +ATOM 707 C ARG 215 -24.504 -2.978 -3.798 0.00 0.00 +0.000 C +ATOM 708 O ARG 215 -24.844 -1.875 -4.230 0.00 0.00 +0.000 OA +ATOM 709 N VAL 216 -23.937 -3.911 -4.560 0.00 0.00 +0.000 N +ATOM 710 H VAL 216 -23.767 -4.818 -4.080 0.00 0.00 +0.000 HD +ATOM 711 CA VAL 216 -23.588 -3.665 -5.956 0.00 0.00 +0.000 C +ATOM 712 HA VAL 216 -23.173 -2.734 -6.016 0.00 0.00 +0.000 HD +ATOM 713 CB VAL 216 -22.501 -4.669 -6.424 0.00 0.00 +0.000 C +ATOM 714 HB VAL 216 -22.904 -5.579 -6.390 0.00 0.00 +0.000 HD +ATOM 715 CG1 VAL 216 -22.107 -4.403 -7.864 0.00 0.00 +0.000 C +ATOM 716 HG11 VAL 216 -21.477 -5.115 -8.178 0.00 0.00 +0.000 HD +ATOM 717 HG12 VAL 216 -22.924 -4.406 -8.443 0.00 0.00 +0.000 HD +ATOM 718 HG13 VAL 216 -21.658 -3.511 -7.931 0.00 0.00 +0.000 HD +ATOM 719 CG2 VAL 216 -21.285 -4.550 -5.521 0.00 0.00 +0.000 C +ATOM 720 HG21 VAL 216 -21.276 -5.314 -4.875 0.00 0.00 +0.000 HD +ATOM 721 HG22 VAL 216 -20.455 -4.572 -6.079 0.00 0.00 +0.000 HD +ATOM 722 HG23 VAL 216 -21.329 -3.686 -5.018 0.00 0.00 +0.000 HD +ATOM 723 C VAL 216 -24.770 -3.707 -6.922 0.00 0.00 +0.000 C +ATOM 724 O VAL 216 -24.858 -2.883 -7.834 0.00 0.00 +0.000 OA +ATOM 725 N GLY 217 -25.667 -4.672 -6.741 0.00 0.00 +0.000 N +ATOM 726 H GLY 217 -25.482 -5.307 -5.955 0.00 0.00 +0.000 HD +ATOM 727 CA GLY 217 -26.813 -4.773 -7.627 0.00 0.00 +0.000 C +ATOM 728 HA2 GLY 217 -26.491 -4.980 -8.572 0.00 0.00 +0.000 HD +ATOM 729 HA3 GLY 217 -27.391 -5.563 -7.341 0.00 0.00 +0.000 HD +ATOM 730 C GLY 217 -27.671 -3.518 -7.660 0.00 0.00 +0.000 C +ATOM 731 O GLY 217 -28.157 -3.111 -8.712 0.00 0.00 +0.000 OA +ATOM 732 N ASP 218 -27.863 -2.905 -6.500 0.00 0.00 +0.000 N +ATOM 733 H ASP 218 -27.396 -3.356 -5.686 0.00 0.00 +0.000 HD +ATOM 734 CA ASP 218 -28.667 -1.695 -6.391 0.00 0.00 +0.000 C +ATOM 735 HA ASP 218 -29.551 -1.881 -6.844 0.00 0.00 +0.000 HD +ATOM 736 CB ASP 218 -28.881 -1.366 -4.912 0.00 0.00 +0.000 C +ATOM 737 HB2 ASP 218 -27.995 -1.323 -4.472 0.00 0.00 +0.000 HD +ATOM 738 HB3 ASP 218 -29.351 -0.498 -4.852 0.00 0.00 +0.000 HD +ATOM 739 CG ASP 218 -29.725 -2.426 -4.199 0.00 0.00 +0.000 C +ATOM 740 OD1 ASP 218 -29.671 -3.617 -4.593 0.00 0.00 +0.000 OA +ATOM 741 OD2 ASP 218 -30.443 -2.080 -3.231 0.00 0.00 +0.000 OA +ATOM 742 C ASP 218 -28.031 -0.518 -7.125 0.00 0.00 +0.000 C +ATOM 743 O ASP 218 -28.728 0.302 -7.718 0.00 0.00 +0.000 OA +ATOM 744 N GLY 219 -26.705 -0.442 -7.097 0.00 0.00 +0.000 N +ATOM 745 H GLY 219 -26.229 -1.187 -6.572 0.00 0.00 +0.000 HD +ATOM 746 CA GLY 219 -26.027 0.643 -7.780 0.00 0.00 +0.000 C +ATOM 747 HA2 GLY 219 -26.419 1.527 -7.483 0.00 0.00 +0.000 HD +ATOM 748 HA3 GLY 219 -25.048 0.643 -7.527 0.00 0.00 +0.000 HD +ATOM 749 C GLY 219 -26.152 0.524 -9.291 0.00 0.00 +0.000 C +ATOM 750 O GLY 219 -26.279 1.531 -9.995 0.00 0.00 +0.000 OA +ATOM 751 N VAL 220 -26.126 -0.709 -9.786 0.00 0.00 +0.000 N +ATOM 752 H VAL 220 -26.028 -1.462 -9.075 0.00 0.00 +0.000 HD +ATOM 753 CA VAL 220 -26.228 -0.966 -11.217 0.00 0.00 +0.000 C +ATOM 754 HA VAL 220 -25.505 -0.431 -11.685 0.00 0.00 +0.000 HD +ATOM 755 CB VAL 220 -26.008 -2.470 -11.526 0.00 0.00 +0.000 C +ATOM 756 HB VAL 220 -26.700 -2.979 -11.027 0.00 0.00 +0.000 HD +ATOM 757 CG1 VAL 220 -26.224 -2.738 -13.001 0.00 0.00 +0.000 C +ATOM 758 HG11 VAL 220 -25.631 -3.488 -13.298 0.00 0.00 +0.000 HD +ATOM 759 HG12 VAL 220 -27.180 -2.990 -13.162 0.00 0.00 +0.000 HD +ATOM 760 HG13 VAL 220 -26.006 -1.916 -13.529 0.00 0.00 +0.000 HD +ATOM 761 CG2 VAL 220 -24.601 -2.884 -11.109 0.00 0.00 +0.000 C +ATOM 762 HG21 VAL 220 -24.131 -2.097 -10.711 0.00 0.00 +0.000 HD +ATOM 763 HG22 VAL 220 -24.661 -3.618 -10.434 0.00 0.00 +0.000 HD +ATOM 764 HG23 VAL 220 -24.101 -3.205 -11.913 0.00 0.00 +0.000 HD +ATOM 765 C VAL 220 -27.572 -0.539 -11.796 0.00 0.00 +0.000 C +ATOM 766 O VAL 220 -27.629 0.062 -12.865 0.00 0.00 +0.000 OA +ATOM 767 N GLN 221 -28.653 -0.860 -11.092 0.00 0.00 +0.000 N +ATOM 768 H GLN 221 -28.465 -1.365 -10.207 0.00 0.00 +0.000 HD +ATOM 769 CA GLN 221 -29.991 -0.514 -11.556 0.00 0.00 +0.000 C +ATOM 770 HA GLN 221 -30.109 -0.894 -12.482 0.00 0.00 +0.000 HD +ATOM 771 CB GLN 221 -31.044 -1.094 -10.606 0.00 0.00 +0.000 C +ATOM 772 HB2 GLN 221 -30.895 -0.710 -9.689 0.00 0.00 +0.000 HD +ATOM 773 HB3 GLN 221 -31.955 -0.815 -10.928 0.00 0.00 +0.000 HD +ATOM 774 CG GLN 221 -31.032 -2.613 -10.488 0.00 0.00 +0.000 C +ATOM 775 HG2 GLN 221 -31.214 -3.006 -11.385 0.00 0.00 +0.000 HD +ATOM 776 HG3 GLN 221 -30.136 -2.903 -10.163 0.00 0.00 +0.000 HD +ATOM 777 CD GLN 221 -32.088 -3.121 -9.514 0.00 0.00 +0.000 C +ATOM 778 OE1 GLN 221 -31.765 -3.778 -8.530 0.00 0.00 +0.000 OA +ATOM 779 NE2 GLN 221 -33.352 -2.822 -9.790 0.00 0.00 +0.000 N +ATOM 780 HE21 GLN 221 -34.106 -3.139 -9.194 0.00 0.00 +0.000 HD +ATOM 781 HE22 GLN 221 -33.552 -2.262 -10.620 0.00 0.00 +0.000 HD +ATOM 782 C GLN 221 -30.175 1.002 -11.652 0.00 0.00 +0.000 C +ATOM 783 O GLN 221 -30.936 1.487 -12.489 0.00 0.00 +0.000 OA +ATOM 784 N ARG 222 -29.482 1.740 -10.785 0.00 0.00 +0.000 N +ATOM 785 H ARG 222 -28.895 1.194 -10.123 0.00 0.00 +0.000 HD +ATOM 786 CA ARG 222 -29.554 3.198 -10.780 0.00 0.00 +0.000 C +ATOM 787 HA ARG 222 -30.497 3.478 -10.985 0.00 0.00 +0.000 HD +ATOM 788 CB ARG 222 -29.146 3.743 -9.411 0.00 0.00 +0.000 C +ATOM 789 HB2 ARG 222 -28.240 3.386 -9.190 0.00 0.00 +0.000 HD +ATOM 790 HB3 ARG 222 -29.110 4.739 -9.469 0.00 0.00 +0.000 HD +ATOM 791 CG ARG 222 -30.087 3.373 -8.273 0.00 0.00 +0.000 C +ATOM 792 HG2 ARG 222 -30.510 2.489 -8.463 0.00 0.00 +0.000 HD +ATOM 793 HG3 ARG 222 -29.574 3.324 -7.418 0.00 0.00 +0.000 HD +ATOM 794 CD ARG 222 -31.205 4.401 -8.091 0.00 0.00 +0.000 C +ATOM 795 HD2 ARG 222 -31.701 4.164 -7.261 0.00 0.00 +0.000 HD +ATOM 796 HD3 ARG 222 -30.779 5.296 -7.994 0.00 0.00 +0.000 HD +ATOM 797 NE ARG 222 -32.111 4.409 -9.220 0.00 0.00 +0.000 N +ATOM 798 HE ARG 222 -32.021 3.673 -9.908 0.00 0.00 +0.000 HD +ATOM 799 CZ ARG 222 -33.062 5.320 -9.423 0.00 0.00 +0.000 C +ATOM 800 NH1 ARG 222 -33.254 6.320 -8.557 0.00 0.00 +0.000 N +ATOM 801 HH11 ARG 222 -32.669 6.405 -7.754 0.00 0.00 +0.000 HD +ATOM 802 HH12 ARG 222 -33.986 6.982 -8.719 0.00 0.00 +0.000 HD +ATOM 803 NH2 ARG 222 -33.795 5.265 -10.528 0.00 0.00 +0.000 N +ATOM 804 HH21 ARG 222 -33.618 4.554 -11.211 0.00 0.00 +0.000 HD +ATOM 805 HH22 ARG 222 -34.523 5.933 -10.681 0.00 0.00 +0.000 HD +ATOM 806 C ARG 222 -28.630 3.781 -11.846 0.00 0.00 +0.000 C +ATOM 807 O ARG 222 -29.035 4.643 -12.633 0.00 0.00 +0.000 OA +ATOM 808 N ASN 223 -27.386 3.304 -11.867 0.00 0.00 +0.000 N +ATOM 809 H ASN 223 -27.178 2.587 -11.153 0.00 0.00 +0.000 HD +ATOM 810 CA ASN 223 -26.412 3.784 -12.845 0.00 0.00 +0.000 C +ATOM 811 HA ASN 223 -26.346 4.788 -12.729 0.00 0.00 +0.000 HD +ATOM 812 CB ASN 223 -25.052 3.121 -12.625 0.00 0.00 +0.000 C +ATOM 813 HB2 ASN 223 -25.205 2.158 -12.418 0.00 0.00 +0.000 HD +ATOM 814 HB3 ASN 223 -24.523 3.209 -13.466 0.00 0.00 +0.000 HD +ATOM 815 CG ASN 223 -24.284 3.747 -11.496 0.00 0.00 +0.000 C +ATOM 816 OD1 ASN 223 -24.321 4.960 -11.310 0.00 0.00 +0.000 OA +ATOM 817 ND2 ASN 223 -23.569 2.929 -10.741 0.00 0.00 +0.000 N +ATOM 818 HD21 ASN 223 -23.040 3.287 -9.970 0.00 0.00 +0.000 HD +ATOM 819 HD22 ASN 223 -23.554 1.946 -10.939 0.00 0.00 +0.000 HD +ATOM 820 C ASN 223 -26.845 3.528 -14.280 0.00 0.00 +0.000 C +ATOM 821 O ASN 223 -26.482 4.267 -15.189 0.00 0.00 +0.000 OA +ATOM 822 N HIE 224 -27.626 2.479 -14.479 0.00 0.00 +0.000 N +ATOM 823 H HIE 224 -27.882 1.952 -13.625 0.00 0.00 +0.000 HD +ATOM 824 CA HIE 224 -28.068 2.127 -15.810 0.00 0.00 +0.000 C +ATOM 825 HA HIE 224 -27.697 2.802 -16.464 0.00 0.00 +0.000 HD +ATOM 826 CB HIE 224 -27.465 0.762 -16.162 0.00 0.00 +0.000 C +ATOM 827 HB2 HIE 224 -27.749 0.092 -15.474 0.00 0.00 +0.000 HD +ATOM 828 HB3 HIE 224 -27.804 0.478 -17.060 0.00 0.00 +0.000 HD +ATOM 829 CG HIE 224 -25.966 0.787 -16.208 0.00 0.00 +0.000 A +ATOM 830 ND1 HIE 224 -25.278 1.419 -17.219 0.00 0.00 +0.000 NA +ATOM 831 CE1 HIE 224 -23.982 1.395 -16.948 0.00 0.00 +0.000 A +ATOM 832 HE1 HIE 224 -23.263 1.785 -17.515 0.00 0.00 +0.000 HD +ATOM 833 NE2 HIE 224 -23.808 0.766 -15.803 0.00 0.00 +0.000 N +ATOM 834 HE2 HIE 224 -22.922 0.599 -15.348 0.00 0.00 +0.000 HD +ATOM 835 CD2 HIE 224 -25.033 0.367 -15.317 0.00 0.00 +0.000 A +ATOM 836 HD2 HIE 224 -25.199 -0.133 -14.475 0.00 0.00 +0.000 HD +ATOM 837 C HIE 224 -29.589 2.151 -15.920 0.00 0.00 +0.000 C +ATOM 838 O HIE 224 -30.184 1.417 -16.696 0.00 0.00 +0.000 OA +ATOM 839 N GLU 225 -30.198 3.056 -15.157 0.00 0.00 +0.000 N +ATOM 840 H GLU 225 -29.545 3.640 -14.582 0.00 0.00 +0.000 HD +ATOM 841 CA GLU 225 -31.647 3.223 -15.122 0.00 0.00 +0.000 C +ATOM 842 HA GLU 225 -32.064 2.437 -14.627 0.00 0.00 +0.000 HD +ATOM 843 CB GLU 225 -32.009 4.470 -14.313 0.00 0.00 +0.000 C +ATOM 844 HB2 GLU 225 -31.779 4.294 -13.373 0.00 0.00 +0.000 HD +ATOM 845 HB3 GLU 225 -31.502 5.226 -14.684 0.00 0.00 +0.000 HD +ATOM 846 CG GLU 225 -33.485 4.834 -14.366 0.00 0.00 +0.000 C +ATOM 847 HG2 GLU 225 -33.750 4.902 -15.307 0.00 0.00 +0.000 HD +ATOM 848 HG3 GLU 225 -33.989 4.148 -13.879 0.00 0.00 +0.000 HD +ATOM 849 CD GLU 225 -33.767 6.167 -13.709 0.00 0.00 +0.000 C +ATOM 850 OE1 GLU 225 -34.384 6.172 -12.627 0.00 0.00 +0.000 OA +ATOM 851 OE2 GLU 225 -33.367 7.211 -14.275 0.00 0.00 +0.000 OA +ATOM 852 C GLU 225 -32.279 3.340 -16.501 0.00 0.00 +0.000 C +ATOM 853 O GLU 225 -33.199 2.598 -16.844 0.00 0.00 +0.000 OA +ATOM 854 N THR 226 -31.799 4.295 -17.283 0.00 0.00 +0.000 N +ATOM 855 H THR 226 -31.027 4.852 -16.875 0.00 0.00 +0.000 HD +ATOM 856 CA THR 226 -32.340 4.519 -18.614 0.00 0.00 +0.000 C +ATOM 857 HA THR 226 -33.312 4.798 -18.524 0.00 0.00 +0.000 HD +ATOM 858 CB THR 226 -31.601 5.678 -19.321 0.00 0.00 +0.000 C +ATOM 859 HB THR 226 -30.630 5.406 -19.466 0.00 0.00 +0.000 HD +ATOM 860 CG2 THR 226 -32.278 6.016 -20.645 0.00 0.00 +0.000 C +ATOM 861 HG21 THR 226 -33.265 5.859 -20.570 0.00 0.00 +0.000 HD +ATOM 862 HG22 THR 226 -32.114 6.978 -20.873 0.00 0.00 +0.000 HD +ATOM 863 HG23 THR 226 -31.906 5.437 -21.373 0.00 0.00 +0.000 HD +ATOM 864 OG1 THR 226 -31.622 6.837 -18.478 0.00 0.00 +0.000 OA +ATOM 865 HG1 THR 226 -32.024 6.612 -17.584 0.00 0.00 +0.000 HD +ATOM 866 C THR 226 -32.285 3.274 -19.493 0.00 0.00 +0.000 C +ATOM 867 O THR 226 -33.275 2.921 -20.132 0.00 0.00 +0.000 OA +ATOM 868 N ALA 227 -31.140 2.604 -19.535 0.00 0.00 +0.000 N +ATOM 869 H ALA 227 -30.377 2.985 -18.965 0.00 0.00 +0.000 HD +ATOM 870 CA ALA 227 -31.030 1.404 -20.360 0.00 0.00 +0.000 C +ATOM 871 HA ALA 227 -31.313 1.626 -21.299 0.00 0.00 +0.000 HD +ATOM 872 CB ALA 227 -29.587 0.923 -20.403 0.00 0.00 +0.000 C +ATOM 873 HB1 ALA 227 -29.545 0.033 -20.856 0.00 0.00 +0.000 HD +ATOM 874 HB2 ALA 227 -29.030 1.580 -20.910 0.00 0.00 +0.000 HD +ATOM 875 HB3 ALA 227 -29.235 0.839 -19.471 0.00 0.00 +0.000 HD +ATOM 876 C ALA 227 -31.946 0.291 -19.831 0.00 0.00 +0.000 C +ATOM 877 O ALA 227 -32.558 -0.445 -20.607 0.00 0.00 +0.000 OA +ATOM 878 N PHE 228 -32.040 0.180 -18.508 0.00 0.00 +0.000 N +ATOM 879 H PHE 228 -31.483 0.867 -17.970 0.00 0.00 +0.000 HD +ATOM 880 CA PHE 228 -32.875 -0.845 -17.894 0.00 0.00 +0.000 C +ATOM 881 HA PHE 228 -32.609 -1.726 -18.303 0.00 0.00 +0.000 HD +ATOM 882 CB PHE 228 -32.657 -0.863 -16.376 0.00 0.00 +0.000 C +ATOM 883 HB2 PHE 228 -32.453 0.057 -16.087 0.00 0.00 +0.000 HD +ATOM 884 HB3 PHE 228 -33.480 -1.206 -15.955 0.00 0.00 +0.000 HD +ATOM 885 CG PHE 228 -31.509 -1.751 -15.940 0.00 0.00 +0.000 A +ATOM 886 CD1 PHE 228 -30.329 -1.796 -16.678 0.00 0.00 +0.000 A +ATOM 887 HD1 PHE 228 -30.236 -1.239 -17.499 0.00 0.00 +0.000 HD +ATOM 888 CE1 PHE 228 -29.267 -2.610 -16.286 0.00 0.00 +0.000 A +ATOM 889 HE1 PHE 228 -28.428 -2.631 -16.841 0.00 0.00 +0.000 HD +ATOM 890 CZ PHE 228 -29.369 -3.390 -15.134 0.00 0.00 +0.000 A +ATOM 891 HZ PHE 228 -28.607 -3.965 -14.854 0.00 0.00 +0.000 HD +ATOM 892 CE2 PHE 228 -30.542 -3.356 -14.382 0.00 0.00 +0.000 A +ATOM 893 HE2 PHE 228 -30.638 -3.918 -13.551 0.00 0.00 +0.000 HD +ATOM 894 CD2 PHE 228 -31.606 -2.531 -14.785 0.00 0.00 +0.000 A +ATOM 895 HD2 PHE 228 -32.438 -2.504 -14.237 0.00 0.00 +0.000 HD +ATOM 896 C PHE 228 -34.346 -0.630 -18.234 0.00 0.00 +0.000 C +ATOM 897 O PHE 228 -35.036 -1.576 -18.613 0.00 0.00 +0.000 OA +ATOM 898 N GLN 229 -34.822 0.609 -18.104 0.00 0.00 +0.000 N +ATOM 899 H GLN 229 -34.143 1.306 -17.757 0.00 0.00 +0.000 HD +ATOM 900 CA GLN 229 -36.212 0.925 -18.437 0.00 0.00 +0.000 C +ATOM 901 HA GLN 229 -36.802 0.315 -17.914 0.00 0.00 +0.000 HD +ATOM 902 CB GLN 229 -36.517 2.409 -18.220 0.00 0.00 +0.000 C +ATOM 903 HB2 GLN 229 -35.962 2.948 -18.880 0.00 0.00 +0.000 HD +ATOM 904 HB3 GLN 229 -37.494 2.572 -18.458 0.00 0.00 +0.000 HD +ATOM 905 CG GLN 229 -36.275 2.978 -16.835 0.00 0.00 +0.000 C +ATOM 906 HG2 GLN 229 -36.906 2.557 -16.194 0.00 0.00 +0.000 HD +ATOM 907 HG3 GLN 229 -35.335 2.800 -16.569 0.00 0.00 +0.000 HD +ATOM 908 CD GLN 229 -36.503 4.493 -16.807 0.00 0.00 +0.000 C +ATOM 909 OE1 GLN 229 -37.320 4.990 -16.022 0.00 0.00 +0.000 OA +ATOM 910 NE2 GLN 229 -35.779 5.232 -17.659 0.00 0.00 +0.000 N +ATOM 911 HE21 GLN 229 -35.892 6.229 -17.699 0.00 0.00 +0.000 HD +ATOM 912 HE22 GLN 229 -35.111 4.755 -18.263 0.00 0.00 +0.000 HD +ATOM 913 C GLN 229 -36.435 0.633 -19.922 0.00 0.00 +0.000 C +ATOM 914 O GLN 229 -37.483 0.135 -20.321 0.00 0.00 +0.000 OA +ATOM 915 N GLY 230 -35.441 0.976 -20.732 0.00 0.00 +0.000 N +ATOM 916 H GLY 230 -34.618 1.394 -20.266 0.00 0.00 +0.000 HD +ATOM 917 CA GLY 230 -35.540 0.763 -22.165 0.00 0.00 +0.000 C +ATOM 918 HA2 GLY 230 -36.349 1.273 -22.524 0.00 0.00 +0.000 HD +ATOM 919 HA3 GLY 230 -34.723 1.173 -22.621 0.00 0.00 +0.000 HD +ATOM 920 C GLY 230 -35.654 -0.692 -22.564 0.00 0.00 +0.000 C +ATOM 921 O GLY 230 -36.481 -1.049 -23.410 0.00 0.00 +0.000 OA +ATOM 922 N MET 231 -34.824 -1.535 -21.957 0.00 0.00 +0.000 N +ATOM 923 H MET 231 -34.183 -1.102 -21.270 0.00 0.00 +0.000 HD +ATOM 924 CA MET 231 -34.844 -2.958 -22.262 0.00 0.00 +0.000 C +ATOM 925 HA MET 231 -34.808 -3.069 -23.257 0.00 0.00 +0.000 HD +ATOM 926 CB MET 231 -33.647 -3.666 -21.615 0.00 0.00 +0.000 C +ATOM 927 HB2 MET 231 -32.797 -3.241 -21.947 0.00 0.00 +0.000 HD +ATOM 928 HB3 MET 231 -33.695 -3.543 -20.617 0.00 0.00 +0.000 HD +ATOM 929 CG MET 231 -33.583 -5.163 -21.911 0.00 0.00 +0.000 C +ATOM 930 HG2 MET 231 -32.788 -5.561 -21.399 0.00 0.00 +0.000 HD +ATOM 931 HG3 MET 231 -34.416 -5.610 -21.511 0.00 0.00 +0.000 HD +ATOM 932 SD MET 231 -33.450 -5.539 -23.685 0.00 0.00 +0.000 S +ATOM 933 CE MET 231 -32.706 -7.161 -23.630 0.00 0.00 +0.000 C +ATOM 934 HE1 MET 231 -32.654 -7.541 -24.556 0.00 0.00 +0.000 HD +ATOM 935 HE2 MET 231 -31.782 -7.097 -23.248 0.00 0.00 +0.000 HD +ATOM 936 HE3 MET 231 -33.259 -7.768 -23.055 0.00 0.00 +0.000 HD +ATOM 937 C MET 231 -36.150 -3.574 -21.767 0.00 0.00 +0.000 C +ATOM 938 O MET 231 -36.762 -4.372 -22.472 0.00 0.00 +0.000 OA +ATOM 939 N LEU 232 -36.589 -3.202 -20.565 0.00 0.00 +0.000 N +ATOM 940 H LEU 232 -36.000 -2.524 -20.067 0.00 0.00 +0.000 HD +ATOM 941 CA LEU 232 -37.835 -3.753 -20.035 0.00 0.00 +0.000 C +ATOM 942 HA LEU 232 -37.737 -4.753 -19.955 0.00 0.00 +0.000 HD +ATOM 943 CB LEU 232 -38.108 -3.214 -18.619 0.00 0.00 +0.000 C +ATOM 944 HB2 LEU 232 -37.344 -3.478 -18.041 0.00 0.00 +0.000 HD +ATOM 945 HB3 LEU 232 -38.178 -2.226 -18.678 0.00 0.00 +0.000 HD +ATOM 946 CG LEU 232 -39.392 -3.726 -17.941 0.00 0.00 +0.000 C +ATOM 947 HG LEU 232 -40.171 -3.491 -18.518 0.00 0.00 +0.000 HD +ATOM 948 CD1 LEU 232 -39.318 -5.224 -17.761 0.00 0.00 +0.000 C +ATOM 949 HD11 LEU 232 -38.530 -5.459 -17.188 0.00 0.00 +0.000 HD +ATOM 950 HD12 LEU 232 -40.155 -5.555 -17.320 0.00 0.00 +0.000 HD +ATOM 951 HD13 LEU 232 -39.220 -5.669 -18.653 0.00 0.00 +0.000 HD +ATOM 952 CD2 LEU 232 -39.595 -3.050 -16.608 0.00 0.00 +0.000 C +ATOM 953 HD21 LEU 232 -39.673 -2.058 -16.737 0.00 0.00 +0.000 HD +ATOM 954 HD22 LEU 232 -40.434 -3.391 -16.176 0.00 0.00 +0.000 HD +ATOM 955 HD23 LEU 232 -38.816 -3.241 -16.006 0.00 0.00 +0.000 HD +ATOM 956 C LEU 232 -39.024 -3.463 -20.965 0.00 0.00 +0.000 C +ATOM 957 O LEU 232 -39.825 -4.358 -21.258 0.00 0.00 +0.000 OA +ATOM 958 N ARG 233 -39.128 -2.222 -21.441 0.00 0.00 +0.000 N +ATOM 959 H ARG 233 -38.392 -1.567 -21.116 0.00 0.00 +0.000 HD +ATOM 960 CA ARG 233 -40.209 -1.829 -22.355 0.00 0.00 +0.000 C +ATOM 961 HA ARG 233 -41.088 -1.993 -21.902 0.00 0.00 +0.000 HD +ATOM 962 CB ARG 233 -40.090 -0.339 -22.721 0.00 0.00 +0.000 C +ATOM 963 HB2 ARG 233 -40.217 0.195 -21.889 0.00 0.00 +0.000 HD +ATOM 964 HB3 ARG 233 -39.178 -0.183 -23.090 0.00 0.00 +0.000 HD +ATOM 965 CG ARG 233 -41.106 0.149 -23.754 0.00 0.00 +0.000 C +ATOM 966 HG2 ARG 233 -40.816 -0.134 -24.658 0.00 0.00 +0.000 HD +ATOM 967 HG3 ARG 233 -41.999 -0.219 -23.534 0.00 0.00 +0.000 HD +ATOM 968 CD ARG 233 -41.191 1.664 -23.727 0.00 0.00 +0.000 C +ATOM 969 HD2 ARG 233 -40.826 1.981 -22.864 0.00 0.00 +0.000 HD +ATOM 970 HD3 ARG 233 -40.667 2.018 -24.489 0.00 0.00 +0.000 HD +ATOM 971 NE ARG 233 -42.583 2.097 -23.853 0.00 0.00 +0.000 N +ATOM 972 HE ARG 233 -43.096 2.270 -22.997 0.00 0.00 +0.000 HD +ATOM 973 CZ ARG 233 -43.223 2.280 -25.000 0.00 0.00 +0.000 C +ATOM 974 NH1 ARG 233 -42.604 2.085 -26.154 0.00 0.00 +0.000 N +ATOM 975 HH11 ARG 233 -41.655 1.779 -26.184 0.00 0.00 +0.000 HD +ATOM 976 HH12 ARG 233 -43.096 2.246 -27.018 0.00 0.00 +0.000 HD +ATOM 977 NH2 ARG 233 -44.495 2.646 -24.990 0.00 0.00 +0.000 N +ATOM 978 HH21 ARG 233 -44.976 2.765 -24.118 0.00 0.00 +0.000 HD +ATOM 979 HH22 ARG 233 -44.981 2.804 -25.850 0.00 0.00 +0.000 HD +ATOM 980 C ARG 233 -40.147 -2.669 -23.628 0.00 0.00 +0.000 C +ATOM 981 O ARG 233 -41.156 -3.186 -24.111 0.00 0.00 +0.000 OA +ATOM 982 N ARG 234 -38.945 -2.788 -24.172 0.00 0.00 +0.000 N +ATOM 983 H ARG 234 -38.161 -2.304 -23.758 0.00 0.00 +0.000 HD +ATOM 984 CA ARG 234 -38.717 -3.558 -25.377 0.00 0.00 +0.000 C +ATOM 985 HA ARG 234 -39.267 -3.121 -26.210 0.00 0.00 +0.000 HD +ATOM 986 CB ARG 234 -37.226 -3.516 -25.701 0.00 0.00 +0.000 C +ATOM 987 HB2 ARG 234 -36.913 -2.481 -25.840 0.00 0.00 +0.000 HD +ATOM 988 HB3 ARG 234 -36.663 -3.958 -24.880 0.00 0.00 +0.000 HD +ATOM 989 CG ARG 234 -36.961 -4.303 -26.980 0.00 0.00 +0.000 C +ATOM 990 HG2 ARG 234 -37.274 -5.338 -26.842 0.00 0.00 +0.000 HD +ATOM 991 HG3 ARG 234 -37.524 -3.861 -27.802 0.00 0.00 +0.000 HD +ATOM 992 CD ARG 234 -35.472 -4.261 -27.304 0.00 0.00 +0.000 C +ATOM 993 HD2 ARG 234 -35.159 -3.226 -27.443 0.00 0.00 +0.000 HD +ATOM 994 HD3 ARG 234 -34.908 -4.703 -26.483 0.00 0.00 +0.000 HD +ATOM 995 NE ARG 234 -35.177 -5.016 -28.542 0.00 0.00 +0.000 N +ATOM 996 HE ARG 234 -35.941 -5.462 -29.029 0.00 0.00 +0.000 HD +ATOM 997 CZ ARG 234 -33.950 -5.134 -29.044 0.00 0.00 +0.000 C +ATOM 998 NH1 ARG 234 -32.894 -4.576 -28.460 0.00 0.00 +0.000 N +ATOM 999 HH11 ARG 234 -33.012 -4.043 -27.610 0.00 0.00 +0.000 HD +ATOM 1000 HH12 ARG 234 -31.977 -4.687 -28.870 0.00 0.00 +0.000 HD +ATOM 1001 NH2 ARG 234 -33.799 -5.836 -30.163 0.00 0.00 +0.000 N +ATOM 1002 HH21 ARG 234 -34.603 -6.259 -30.604 0.00 0.00 +0.000 HD +ATOM 1003 HH22 ARG 234 -32.879 -5.943 -30.568 0.00 0.00 +0.000 HD +ATOM 1004 C ARG 234 -39.192 -4.997 -25.225 0.00 0.00 +0.000 C +ATOM 1005 O ARG 234 -39.803 -5.550 -26.143 0.00 0.00 +0.000 OA +ATOM 1006 N LEU 235 -38.898 -5.594 -24.072 0.00 0.00 +0.000 N +ATOM 1007 H LEU 235 -38.370 -4.992 -23.399 0.00 0.00 +0.000 HD +ATOM 1008 CA LEU 235 -39.280 -6.971 -23.774 0.00 0.00 +0.000 C +ATOM 1009 HA LEU 235 -38.951 -7.565 -24.526 0.00 0.00 +0.000 HD +ATOM 1010 CB LEU 235 -38.581 -7.431 -22.494 0.00 0.00 +0.000 C +ATOM 1011 HB2 LEU 235 -38.735 -6.749 -21.799 0.00 0.00 +0.000 HD +ATOM 1012 HB3 LEU 235 -38.953 -8.307 -22.239 0.00 0.00 +0.000 HD +ATOM 1013 CG LEU 235 -37.066 -7.599 -22.646 0.00 0.00 +0.000 C +ATOM 1014 HG LEU 235 -36.686 -6.758 -23.029 0.00 0.00 +0.000 HD +ATOM 1015 CD1 LEU 235 -36.429 -7.880 -21.301 0.00 0.00 +0.000 C +ATOM 1016 HD11 LEU 235 -36.811 -8.721 -20.915 0.00 0.00 +0.000 HD +ATOM 1017 HD12 LEU 235 -35.439 -7.988 -21.412 0.00 0.00 +0.000 HD +ATOM 1018 HD13 LEU 235 -36.610 -7.119 -20.676 0.00 0.00 +0.000 HD +ATOM 1019 CD2 LEU 235 -36.785 -8.737 -23.619 0.00 0.00 +0.000 C +ATOM 1020 HD21 LEU 235 -37.190 -8.524 -24.508 0.00 0.00 +0.000 HD +ATOM 1021 HD22 LEU 235 -35.796 -8.851 -23.722 0.00 0.00 +0.000 HD +ATOM 1022 HD23 LEU 235 -37.183 -9.584 -23.266 0.00 0.00 +0.000 HD +ATOM 1023 C LEU 235 -40.790 -7.151 -23.649 0.00 0.00 +0.000 C +ATOM 1024 O LEU 235 -41.312 -8.244 -23.864 0.00 0.00 +0.000 OA +ATOM 1025 N ASP 236 -41.479 -6.078 -23.281 0.00 0.00 +0.000 N +ATOM 1026 H ASP 236 -40.897 -5.237 -23.078 0.00 0.00 +0.000 HD +ATOM 1027 CA ASP 236 -42.930 -6.089 -23.174 0.00 0.00 +0.000 C +ATOM 1028 HA ASP 236 -43.198 -5.284 -22.612 0.00 0.00 +0.000 HD +ATOM 1029 CB ASP 236 -43.512 -5.955 -24.582 0.00 0.00 +0.000 C +ATOM 1030 HB2 ASP 236 -43.130 -5.134 -24.994 0.00 0.00 +0.000 HD +ATOM 1031 HB3 ASP 236 -43.244 -6.759 -25.102 0.00 0.00 +0.000 HD +ATOM 1032 CG ASP 236 -45.020 -5.848 -24.587 0.00 0.00 +0.000 C +ATOM 1033 OD1 ASP 236 -45.614 -5.551 -23.527 0.00 0.00 +0.000 OA +ATOM 1034 OD2 ASP 236 -45.595 -6.052 -25.673 0.00 0.00 +0.000 OA +ATOM 1035 C ASP 236 -43.492 -7.326 -22.464 0.00 0.00 +0.000 C +ATOM 1036 O ASP 236 -44.227 -8.124 -23.049 0.00 0.00 +0.000 OA +ATOM 1037 N ILE 237 -43.153 -7.458 -21.184 0.00 0.00 +0.000 N +ATOM 1038 H ILE 237 -42.562 -6.680 -20.813 0.00 0.00 +0.000 HD +ATOM 1039 CA ILE 237 -43.573 -8.593 -20.373 0.00 0.00 +0.000 C +ATOM 1040 HA ILE 237 -43.630 -9.385 -21.002 0.00 0.00 +0.000 HD +ATOM 1041 CB ILE 237 -42.572 -8.834 -19.239 0.00 0.00 +0.000 C +ATOM 1042 HB ILE 237 -42.634 -8.076 -18.604 0.00 0.00 +0.000 HD +ATOM 1043 CG2 ILE 237 -42.882 -10.158 -18.555 0.00 0.00 +0.000 C +ATOM 1044 HG21 ILE 237 -42.233 -10.309 -17.812 0.00 0.00 +0.000 HD +ATOM 1045 HG22 ILE 237 -43.810 -10.134 -18.186 0.00 0.00 +0.000 HD +ATOM 1046 HG23 ILE 237 -42.808 -10.901 -19.218 0.00 0.00 +0.000 HD +ATOM 1047 CG1 ILE 237 -41.151 -8.856 -19.811 0.00 0.00 +0.000 C +ATOM 1048 HG12 ILE 237 -41.034 -9.703 -20.330 0.00 0.00 +0.000 HD +ATOM 1049 HG13 ILE 237 -41.058 -8.085 -20.443 0.00 0.00 +0.000 HD +ATOM 1050 CD1 ILE 237 -40.061 -8.763 -18.768 0.00 0.00 +0.000 C +ATOM 1051 HD11 ILE 237 -40.136 -9.536 -18.139 0.00 0.00 +0.000 HD +ATOM 1052 HD12 ILE 237 -39.169 -8.784 -19.217 0.00 0.00 +0.000 HD +ATOM 1053 HD13 ILE 237 -40.160 -7.908 -18.260 0.00 0.00 +0.000 HD +ATOM 1054 C ILE 237 -44.960 -8.419 -19.768 0.00 0.00 +0.000 C +ATOM 1055 O ILE 237 -45.183 -7.546 -18.917 0.00 0.00 +0.000 OA +ATOM 1056 N LYS 238 -45.884 -9.273 -20.199 0.00 0.00 +0.000 N +ATOM 1057 H LYS 238 -45.540 -9.973 -20.889 0.00 0.00 +0.000 HD +ATOM 1058 CA LYS 238 -47.262 -9.218 -19.732 0.00 0.00 +0.000 C +ATOM 1059 HA LYS 238 -47.355 -8.439 -19.081 0.00 0.00 +0.000 HD +ATOM 1060 CB LYS 238 -48.179 -8.957 -20.924 0.00 0.00 +0.000 C +ATOM 1061 HB2 LYS 238 -48.145 -9.754 -21.526 0.00 0.00 +0.000 HD +ATOM 1062 HB3 LYS 238 -49.111 -8.837 -20.582 0.00 0.00 +0.000 HD +ATOM 1063 CG LYS 238 -47.810 -7.728 -21.741 0.00 0.00 +0.000 C +ATOM 1064 HG2 LYS 238 -48.003 -6.906 -21.206 0.00 0.00 +0.000 HD +ATOM 1065 HG3 LYS 238 -46.837 -7.760 -21.966 0.00 0.00 +0.000 HD +ATOM 1066 CD LYS 238 -48.610 -7.654 -23.052 0.00 0.00 +0.000 C +ATOM 1067 HD2 LYS 238 -49.480 -8.117 -22.922 0.00 0.00 +0.000 HD +ATOM 1068 HD3 LYS 238 -48.756 -6.699 -23.285 0.00 0.00 +0.000 HD +ATOM 1069 CE LYS 238 -47.874 -8.330 -24.227 0.00 0.00 +0.000 C +ATOM 1070 HE2 LYS 238 -48.518 -8.438 -24.988 0.00 0.00 +0.000 HD +ATOM 1071 HE3 LYS 238 -47.121 -7.735 -24.517 0.00 0.00 +0.000 HD +ATOM 1072 NZ LYS 238 -47.318 -9.681 -23.860 0.00 0.00 +0.000 N +ATOM 1073 HZ1 LYS 238 -47.680 -10.361 -24.492 0.00 0.00 +0.000 HD +ATOM 1074 HZ2 LYS 238 -46.324 -9.649 -23.925 0.00 0.00 +0.000 HD +ATOM 1075 HZ3 LYS 238 -47.593 -9.900 -22.927 0.00 0.00 +0.000 HD +ATOM 1076 C LYS 238 -47.726 -10.489 -19.030 0.00 0.00 +0.000 C +ATOM 1077 O LYS 238 -48.572 -10.441 -18.132 0.00 0.00 +0.000 OA +ATOM 1078 N ASN 239 -47.178 -11.625 -19.441 0.00 0.00 +0.000 N +ATOM 1079 H ASN 239 -46.461 -11.534 -20.173 0.00 0.00 +0.000 HD +ATOM 1080 CA ASN 239 -47.600 -12.889 -18.861 0.00 0.00 +0.000 C +ATOM 1081 HA ASN 239 -47.917 -12.691 -17.910 0.00 0.00 +0.000 HD +ATOM 1082 CB ASN 239 -48.744 -13.446 -19.706 0.00 0.00 +0.000 C +ATOM 1083 HB2 ASN 239 -48.927 -14.379 -19.418 0.00 0.00 +0.000 HD +ATOM 1084 HB3 ASN 239 -49.546 -12.875 -19.570 0.00 0.00 +0.000 HD +ATOM 1085 CG ASN 239 -48.407 -13.458 -21.193 0.00 0.00 +0.000 C +ATOM 1086 OD1 ASN 239 -47.492 -14.166 -21.637 0.00 0.00 +0.000 OA +ATOM 1087 ND2 ASN 239 -49.138 -12.669 -21.970 0.00 0.00 +0.000 N +ATOM 1088 HD21 ASN 239 -48.969 -12.636 -22.955 0.00 0.00 +0.000 HD +ATOM 1089 HD22 ASN 239 -49.861 -12.103 -21.569 0.00 0.00 +0.000 HD +ATOM 1090 C ASN 239 -46.506 -13.939 -18.750 0.00 0.00 +0.000 C +ATOM 1091 O ASN 239 -45.313 -13.666 -18.947 0.00 0.00 +0.000 OA +ATOM 1092 N GLU 240 -46.952 -15.156 -18.459 0.00 0.00 +0.000 N +ATOM 1093 H GLU 240 -48.000 -15.208 -18.353 0.00 0.00 +0.000 HD +ATOM 1094 CA GLU 240 -46.091 -16.315 -18.299 0.00 0.00 +0.000 C +ATOM 1095 HA GLU 240 -45.426 -16.146 -17.552 0.00 0.00 +0.000 HD +ATOM 1096 CB GLU 240 -46.957 -17.490 -17.848 0.00 0.00 +0.000 C +ATOM 1097 HB2 GLU 240 -47.330 -17.258 -16.955 0.00 0.00 +0.000 HD +ATOM 1098 HB3 GLU 240 -47.690 -17.591 -18.512 0.00 0.00 +0.000 HD +ATOM 1099 CG GLU 240 -46.262 -18.822 -17.724 0.00 0.00 +0.000 C +ATOM 1100 HG2 GLU 240 -46.068 -19.159 -18.621 0.00 0.00 +0.000 HD +ATOM 1101 HG3 GLU 240 -45.463 -18.710 -17.173 0.00 0.00 +0.000 HD +ATOM 1102 CD GLU 240 -47.151 -19.838 -17.037 0.00 0.00 +0.000 C +ATOM 1103 OE1 GLU 240 -48.271 -20.067 -17.540 0.00 0.00 +0.000 OA +ATOM 1104 OE2 GLU 240 -46.731 -20.397 -15.997 0.00 0.00 +0.000 OA +ATOM 1105 C GLU 240 -45.330 -16.660 -19.577 0.00 0.00 +0.000 C +ATOM 1106 O GLU 240 -44.142 -16.980 -19.526 0.00 0.00 +0.000 OA +ATOM 1107 N ASP 241 -46.003 -16.593 -20.721 0.00 0.00 +0.000 N +ATOM 1108 H ASP 241 -46.986 -16.316 -20.645 0.00 0.00 +0.000 HD +ATOM 1109 CA ASP 241 -45.327 -16.906 -21.970 0.00 0.00 +0.000 C +ATOM 1110 HA ASP 241 -44.904 -17.812 -21.866 0.00 0.00 +0.000 HD +ATOM 1111 CB ASP 241 -46.316 -16.953 -23.145 0.00 0.00 +0.000 C +ATOM 1112 HB2 ASP 241 -46.894 -16.152 -23.094 0.00 0.00 +0.000 HD +ATOM 1113 HB3 ASP 241 -45.796 -16.967 -23.985 0.00 0.00 +0.000 HD +ATOM 1114 CG ASP 241 -47.208 -18.199 -23.103 0.00 0.00 +0.000 C +ATOM 1115 OD1 ASP 241 -46.773 -19.234 -22.538 0.00 0.00 +0.000 OA +ATOM 1116 OD2 ASP 241 -48.335 -18.158 -23.643 0.00 0.00 +0.000 OA +ATOM 1117 C ASP 241 -44.188 -15.913 -22.229 0.00 0.00 +0.000 C +ATOM 1118 O ASP 241 -43.108 -16.313 -22.680 0.00 0.00 +0.000 OA +ATOM 1119 N ASP 242 -44.404 -14.628 -21.944 0.00 0.00 +0.000 N +ATOM 1120 H ASP 242 -45.338 -14.393 -21.607 0.00 0.00 +0.000 HD +ATOM 1121 CA ASP 242 -43.319 -13.655 -22.126 0.00 0.00 +0.000 C +ATOM 1122 HA ASP 242 -42.953 -13.790 -23.048 0.00 0.00 +0.000 HD +ATOM 1123 CB ASP 242 -43.792 -12.217 -21.884 0.00 0.00 +0.000 C +ATOM 1124 HB2 ASP 242 -44.008 -12.126 -20.917 0.00 0.00 +0.000 HD +ATOM 1125 HB3 ASP 242 -43.047 -11.606 -22.130 0.00 0.00 +0.000 HD +ATOM 1126 CG ASP 242 -45.015 -11.852 -22.695 0.00 0.00 +0.000 C +ATOM 1127 OD1 ASP 242 -45.044 -12.127 -23.907 0.00 0.00 +0.000 OA +ATOM 1128 OD2 ASP 242 -45.950 -11.279 -22.106 0.00 0.00 +0.000 OA +ATOM 1129 C ASP 242 -42.181 -13.949 -21.144 0.00 0.00 +0.000 C +ATOM 1130 O ASP 242 -41.015 -13.758 -21.470 0.00 0.00 +0.000 OA +ATOM 1131 N VAL 243 -42.505 -14.396 -19.934 0.00 0.00 +0.000 N +ATOM 1132 H VAL 243 -43.506 -14.513 -19.754 0.00 0.00 +0.000 HD +ATOM 1133 CA VAL 243 -41.453 -14.684 -18.965 0.00 0.00 +0.000 C +ATOM 1134 HA VAL 243 -40.864 -13.877 -18.892 0.00 0.00 +0.000 HD +ATOM 1135 CB VAL 243 -42.030 -15.023 -17.558 0.00 0.00 +0.000 C +ATOM 1136 HB VAL 243 -42.661 -15.780 -17.672 0.00 0.00 +0.000 HD +ATOM 1137 CG1 VAL 243 -40.915 -15.500 -16.632 0.00 0.00 +0.000 C +ATOM 1138 HG11 VAL 243 -40.495 -16.322 -17.014 0.00 0.00 +0.000 HD +ATOM 1139 HG12 VAL 243 -40.225 -14.782 -16.546 0.00 0.00 +0.000 HD +ATOM 1140 HG13 VAL 243 -41.297 -15.707 -15.732 0.00 0.00 +0.000 HD +ATOM 1141 CG2 VAL 243 -42.699 -13.795 -16.959 0.00 0.00 +0.000 C +ATOM 1142 HG21 VAL 243 -43.686 -13.851 -17.107 0.00 0.00 +0.000 HD +ATOM 1143 HG22 VAL 243 -42.507 -13.760 -15.978 0.00 0.00 +0.000 HD +ATOM 1144 HG23 VAL 243 -42.339 -12.974 -17.402 0.00 0.00 +0.000 HD +ATOM 1145 C VAL 243 -40.604 -15.844 -19.465 0.00 0.00 +0.000 C +ATOM 1146 O VAL 243 -39.394 -15.845 -19.300 0.00 0.00 +0.000 OA +ATOM 1147 N LYS 244 -41.241 -16.828 -20.091 0.00 0.00 +0.000 N +ATOM 1148 H LYS 244 -42.262 -16.706 -20.180 0.00 0.00 +0.000 HD +ATOM 1149 CA LYS 244 -40.512 -17.979 -20.600 0.00 0.00 +0.000 C +ATOM 1150 HA LYS 244 -39.925 -18.344 -19.871 0.00 0.00 +0.000 HD +ATOM 1151 CB LYS 244 -41.491 -19.072 -21.035 0.00 0.00 +0.000 C +ATOM 1152 HB2 LYS 244 -42.115 -18.680 -21.705 0.00 0.00 +0.000 HD +ATOM 1153 HB3 LYS 244 -40.966 -19.811 -21.449 0.00 0.00 +0.000 HD +ATOM 1154 CG LYS 244 -42.307 -19.641 -19.892 0.00 0.00 +0.000 C +ATOM 1155 HG2 LYS 244 -41.711 -19.784 -19.101 0.00 0.00 +0.000 HD +ATOM 1156 HG3 LYS 244 -43.032 -18.997 -19.652 0.00 0.00 +0.000 HD +ATOM 1157 CD LYS 244 -42.940 -20.971 -20.274 0.00 0.00 +0.000 C +ATOM 1158 HD2 LYS 244 -43.713 -20.800 -20.869 0.00 0.00 +0.000 HD +ATOM 1159 HD3 LYS 244 -42.261 -21.534 -20.723 0.00 0.00 +0.000 HD +ATOM 1160 CE LYS 244 -43.432 -21.698 -19.032 0.00 0.00 +0.000 C +ATOM 1161 HE2 LYS 244 -42.715 -21.672 -18.334 0.00 0.00 +0.000 HD +ATOM 1162 HE3 LYS 244 -44.248 -21.234 -18.684 0.00 0.00 +0.000 HD +ATOM 1163 NZ LYS 244 -43.770 -23.120 -19.332 0.00 0.00 +0.000 N +ATOM 1164 HZ1 LYS 244 -44.005 -23.589 -18.482 0.00 0.00 +0.000 HD +ATOM 1165 HZ2 LYS 244 -44.548 -23.149 -19.958 0.00 0.00 +0.000 HD +ATOM 1166 HZ3 LYS 244 -42.981 -23.564 -19.755 0.00 0.00 +0.000 HD +ATOM 1167 C LYS 244 -39.634 -17.566 -21.772 0.00 0.00 +0.000 C +ATOM 1168 O LYS 244 -38.559 -18.126 -21.990 0.00 0.00 +0.000 OA +ATOM 1169 N SER 245 -40.084 -16.571 -22.522 0.00 0.00 +0.000 N +ATOM 1170 H SER 245 -40.986 -16.165 -22.226 0.00 0.00 +0.000 HD +ATOM 1171 CA SER 245 -39.327 -16.110 -23.679 0.00 0.00 +0.000 C +ATOM 1172 HA SER 245 -39.098 -16.917 -24.247 0.00 0.00 +0.000 HD +ATOM 1173 CB SER 245 -40.176 -15.146 -24.509 0.00 0.00 +0.000 C +ATOM 1174 HB2 SER 245 -39.747 -15.025 -25.399 0.00 0.00 +0.000 HD +ATOM 1175 HB3 SER 245 -41.087 -15.533 -24.617 0.00 0.00 +0.000 HD +ATOM 1176 OG SER 245 -40.283 -13.886 -23.872 0.00 0.00 +0.000 OA +ATOM 1177 HG SER 245 -40.573 -14.015 -22.924 0.00 0.00 +0.000 HD +ATOM 1178 C SER 245 -38.014 -15.430 -23.290 0.00 0.00 +0.000 C +ATOM 1179 O SER 245 -37.148 -15.217 -24.137 0.00 0.00 +0.000 OA +ATOM 1180 N LEU 246 -37.859 -15.104 -22.010 0.00 0.00 +0.000 N +ATOM 1181 H LEU 246 -38.642 -15.366 -21.390 0.00 0.00 +0.000 HD +ATOM 1182 CA LEU 246 -36.651 -14.423 -21.551 0.00 0.00 +0.000 C +ATOM 1183 HA LEU 246 -36.510 -13.595 -22.137 0.00 0.00 +0.000 HD +ATOM 1184 CB LEU 246 -36.860 -13.871 -20.137 0.00 0.00 +0.000 C +ATOM 1185 HB2 LEU 246 -37.135 -14.618 -19.557 0.00 0.00 +0.000 HD +ATOM 1186 HB3 LEU 246 -36.015 -13.464 -19.841 0.00 0.00 +0.000 HD +ATOM 1187 CG LEU 246 -37.946 -12.798 -20.057 0.00 0.00 +0.000 C +ATOM 1188 HG LEU 246 -38.782 -13.150 -20.467 0.00 0.00 +0.000 HD +ATOM 1189 CD1 LEU 246 -38.209 -12.441 -18.599 0.00 0.00 +0.000 C +ATOM 1190 HD11 LEU 246 -37.368 -12.093 -18.184 0.00 0.00 +0.000 HD +ATOM 1191 HD12 LEU 246 -38.920 -11.739 -18.551 0.00 0.00 +0.000 HD +ATOM 1192 HD13 LEU 246 -38.512 -13.256 -18.106 0.00 0.00 +0.000 HD +ATOM 1193 CD2 LEU 246 -37.526 -11.581 -20.857 0.00 0.00 +0.000 C +ATOM 1194 HD21 LEU 246 -37.387 -11.838 -21.815 0.00 0.00 +0.000 HD +ATOM 1195 HD22 LEU 246 -38.239 -10.879 -20.803 0.00 0.00 +0.000 HD +ATOM 1196 HD23 LEU 246 -36.671 -11.212 -20.487 0.00 0.00 +0.000 HD +ATOM 1197 C LEU 246 -35.376 -15.259 -21.598 0.00 0.00 +0.000 C +ATOM 1198 O LEU 246 -34.285 -14.711 -21.756 0.00 0.00 +0.000 OA +ATOM 1199 N SER 247 -35.501 -16.575 -21.463 0.00 0.00 +0.000 N +ATOM 1200 H SER 247 -36.463 -16.918 -21.330 0.00 0.00 +0.000 HD +ATOM 1201 CA SER 247 -34.326 -17.438 -21.507 0.00 0.00 +0.000 C +ATOM 1202 HA SER 247 -33.723 -17.189 -20.738 0.00 0.00 +0.000 HD +ATOM 1203 CB SER 247 -34.731 -18.912 -21.372 0.00 0.00 +0.000 C +ATOM 1204 HB2 SER 247 -35.345 -19.144 -22.121 0.00 0.00 +0.000 HD +ATOM 1205 HB3 SER 247 -33.909 -19.473 -21.418 0.00 0.00 +0.000 HD +ATOM 1206 OG SER 247 -35.389 -19.155 -20.141 0.00 0.00 +0.000 OA +ATOM 1207 HG SER 247 -35.365 -18.328 -19.581 0.00 0.00 +0.000 HD +ATOM 1208 C SER 247 -33.530 -17.243 -22.802 0.00 0.00 +0.000 C +ATOM 1209 O SER 247 -32.311 -17.108 -22.768 0.00 0.00 +0.000 OA +ATOM 1210 N ARG 248 -34.227 -17.231 -23.938 0.00 0.00 +0.000 N +ATOM 1211 H ARG 248 -35.254 -17.356 -23.817 0.00 0.00 +0.000 HD +ATOM 1212 CA ARG 248 -33.593 -17.055 -25.249 0.00 0.00 +0.000 C +ATOM 1213 HA ARG 248 -32.956 -17.818 -25.404 0.00 0.00 +0.000 HD +ATOM 1214 CB ARG 248 -34.660 -17.078 -26.367 0.00 0.00 +0.000 C +ATOM 1215 HB2 ARG 248 -35.156 -17.940 -26.306 0.00 0.00 +0.000 HD +ATOM 1216 HB3 ARG 248 -35.284 -16.315 -26.218 0.00 0.00 +0.000 HD +ATOM 1217 CG ARG 248 -34.111 -16.956 -27.809 0.00 0.00 +0.000 C +ATOM 1218 HG2 ARG 248 -33.851 -16.014 -27.980 0.00 0.00 +0.000 HD +ATOM 1219 HG3 ARG 248 -33.332 -17.561 -27.913 0.00 0.00 +0.000 HD +ATOM 1220 CD ARG 248 -35.170 -17.358 -28.856 0.00 0.00 +0.000 C +ATOM 1221 HD2 ARG 248 -35.648 -18.160 -28.508 0.00 0.00 +0.000 HD +ATOM 1222 HD3 ARG 248 -35.805 -16.595 -28.949 0.00 0.00 +0.000 HD +ATOM 1223 NE ARG 248 -34.584 -17.668 -30.165 0.00 0.00 +0.000 N +ATOM 1224 HE ARG 248 -34.342 -18.638 -30.345 0.00 0.00 +0.000 HD +ATOM 1225 CZ ARG 248 -34.344 -16.789 -31.132 0.00 0.00 +0.000 C +ATOM 1226 NH1 ARG 248 -34.645 -15.504 -30.966 0.00 0.00 +0.000 N +ATOM 1227 HH11 ARG 248 -35.035 -15.178 -30.109 0.00 0.00 +0.000 HD +ATOM 1228 HH12 ARG 248 -34.475 -14.854 -31.714 0.00 0.00 +0.000 HD +ATOM 1229 NH2 ARG 248 -33.783 -17.199 -32.267 0.00 0.00 +0.000 N +ATOM 1230 HH21 ARG 248 -33.528 -18.161 -32.377 0.00 0.00 +0.000 HD +ATOM 1231 HH22 ARG 248 -33.616 -16.549 -33.006 0.00 0.00 +0.000 HD +ATOM 1232 C ARG 248 -32.810 -15.746 -25.304 0.00 0.00 +0.000 C +ATOM 1233 O ARG 248 -31.688 -15.699 -25.813 0.00 0.00 +0.000 OA +ATOM 1234 N VAL 249 -33.405 -14.683 -24.773 0.00 0.00 +0.000 N +ATOM 1235 H VAL 249 -34.342 -14.858 -24.373 0.00 0.00 +0.000 HD +ATOM 1236 CA VAL 249 -32.753 -13.381 -24.773 0.00 0.00 +0.000 C +ATOM 1237 HA VAL 249 -32.458 -13.175 -25.719 0.00 0.00 +0.000 HD +ATOM 1238 CB VAL 249 -33.716 -12.262 -24.314 0.00 0.00 +0.000 C +ATOM 1239 HB VAL 249 -33.921 -12.417 -23.357 0.00 0.00 +0.000 HD +ATOM 1240 CG1 VAL 249 -33.018 -10.911 -24.410 0.00 0.00 +0.000 C +ATOM 1241 HG11 VAL 249 -32.036 -11.033 -24.272 0.00 0.00 +0.000 HD +ATOM 1242 HG12 VAL 249 -33.181 -10.515 -25.313 0.00 0.00 +0.000 HD +ATOM 1243 HG13 VAL 249 -33.380 -10.298 -23.708 0.00 0.00 +0.000 HD +ATOM 1244 CG2 VAL 249 -34.972 -12.268 -25.166 0.00 0.00 +0.000 C +ATOM 1245 HG21 VAL 249 -34.718 -12.223 -26.133 0.00 0.00 +0.000 HD +ATOM 1246 HG22 VAL 249 -35.486 -13.109 -24.994 0.00 0.00 +0.000 HD +ATOM 1247 HG23 VAL 249 -35.537 -11.476 -24.931 0.00 0.00 +0.000 HD +ATOM 1248 C VAL 249 -31.510 -13.350 -23.882 0.00 0.00 +0.000 C +ATOM 1249 O VAL 249 -30.495 -12.756 -24.245 0.00 0.00 +0.000 OA +ATOM 1250 N MET 250 -31.575 -13.993 -22.717 0.00 0.00 +0.000 N +ATOM 1251 H MET 250 -32.471 -14.450 -22.509 0.00 0.00 +0.000 HD +ATOM 1252 CA MET 250 -30.413 -14.021 -21.817 0.00 0.00 +0.000 C +ATOM 1253 HA MET 250 -30.108 -13.073 -21.675 0.00 0.00 +0.000 HD +ATOM 1254 CB MET 250 -30.767 -14.652 -20.462 0.00 0.00 +0.000 C +ATOM 1255 HB2 MET 250 -31.159 -15.570 -20.623 0.00 0.00 +0.000 HD +ATOM 1256 HB3 MET 250 -29.917 -14.770 -19.927 0.00 0.00 +0.000 HD +ATOM 1257 CG MET 250 -31.756 -13.851 -19.619 0.00 0.00 +0.000 C +ATOM 1258 HG2 MET 250 -31.425 -12.878 -19.564 0.00 0.00 +0.000 HD +ATOM 1259 HG3 MET 250 -32.651 -13.799 -20.124 0.00 0.00 +0.000 HD +ATOM 1260 SD MET 250 -32.022 -14.522 -17.935 0.00 0.00 +0.000 S +ATOM 1261 CE MET 250 -33.303 -15.728 -18.230 0.00 0.00 +0.000 C +ATOM 1262 HE1 MET 250 -33.057 -16.597 -17.796 0.00 0.00 +0.000 HD +ATOM 1263 HE2 MET 250 -34.170 -15.403 -17.847 0.00 0.00 +0.000 HD +ATOM 1264 HE3 MET 250 -33.413 -15.872 -19.216 0.00 0.00 +0.000 HD +ATOM 1265 C MET 250 -29.254 -14.805 -22.431 0.00 0.00 +0.000 C +ATOM 1266 O MET 250 -28.099 -14.462 -22.220 0.00 0.00 +0.000 OA +ATOM 1267 N ILE 251 -29.562 -15.866 -23.169 0.00 0.00 +0.000 N +ATOM 1268 H ILE 251 -30.571 -16.073 -23.244 0.00 0.00 +0.000 HD +ATOM 1269 CA ILE 251 -28.520 -16.659 -23.813 0.00 0.00 +0.000 C +ATOM 1270 HA ILE 251 -27.814 -16.802 -23.131 0.00 0.00 +0.000 HD +ATOM 1271 CB ILE 251 -29.122 -17.962 -24.439 0.00 0.00 +0.000 C +ATOM 1272 HB ILE 251 -29.942 -17.701 -24.933 0.00 0.00 +0.000 HD +ATOM 1273 CG2 ILE 251 -28.130 -18.591 -25.407 0.00 0.00 +0.000 C +ATOM 1274 HG21 ILE 251 -28.544 -19.393 -25.834 0.00 0.00 +0.000 HD +ATOM 1275 HG22 ILE 251 -27.886 -17.928 -26.113 0.00 0.00 +0.000 HD +ATOM 1276 HG23 ILE 251 -27.308 -18.865 -24.911 0.00 0.00 +0.000 HD +ATOM 1277 CG1 ILE 251 -29.514 -18.960 -23.343 0.00 0.00 +0.000 C +ATOM 1278 HG12 ILE 251 -30.052 -18.475 -22.652 0.00 0.00 +0.000 HD +ATOM 1279 HG13 ILE 251 -30.096 -19.664 -23.755 0.00 0.00 +0.000 HD +ATOM 1280 CD1 ILE 251 -28.341 -19.644 -22.658 0.00 0.00 +0.000 C +ATOM 1281 HD11 ILE 251 -27.763 -18.952 -22.230 0.00 0.00 +0.000 HD +ATOM 1282 HD12 ILE 251 -28.688 -20.272 -21.964 0.00 0.00 +0.000 HD +ATOM 1283 HD13 ILE 251 -27.814 -20.150 -23.338 0.00 0.00 +0.000 HD +ATOM 1284 C ILE 251 -27.899 -15.796 -24.909 0.00 0.00 +0.000 C +ATOM 1285 O ILE 251 -26.686 -15.713 -25.061 0.00 0.00 +0.000 OA +ATOM 1286 N HIE 252 -28.766 -15.125 -25.655 0.00 0.00 +0.000 N +ATOM 1287 H HIE 252 -29.766 -15.260 -25.388 0.00 0.00 +0.000 HD +ATOM 1288 CA HIE 252 -28.349 -14.265 -26.763 0.00 0.00 +0.000 C +ATOM 1289 HA HIE 252 -27.828 -14.831 -27.425 0.00 0.00 +0.000 HD +ATOM 1290 CB HIE 252 -29.595 -13.708 -27.470 0.00 0.00 +0.000 C +ATOM 1291 HB2 HIE 252 -30.203 -14.475 -27.706 0.00 0.00 +0.000 HD +ATOM 1292 HB3 HIE 252 -30.083 -13.101 -26.832 0.00 0.00 +0.000 HD +ATOM 1293 CG HIE 252 -29.293 -12.942 -28.716 0.00 0.00 +0.000 A +ATOM 1294 ND1 HIE 252 -28.674 -11.718 -28.707 0.00 0.00 +0.000 NA +ATOM 1295 CE1 HIE 252 -28.569 -11.272 -29.952 0.00 0.00 +0.000 A +ATOM 1296 HE1 HIE 252 -28.162 -10.408 -30.226 0.00 0.00 +0.000 HD +ATOM 1297 NE2 HIE 252 -29.099 -12.171 -30.756 0.00 0.00 +0.000 N +ATOM 1298 HE2 HIE 252 -29.160 -12.100 -31.762 0.00 0.00 +0.000 HD +ATOM 1299 CD2 HIE 252 -29.559 -13.231 -30.011 0.00 0.00 +0.000 A +ATOM 1300 HD2 HIE 252 -30.002 -14.049 -30.359 0.00 0.00 +0.000 HD +ATOM 1301 C HIE 252 -27.455 -13.107 -26.323 0.00 0.00 +0.000 C +ATOM 1302 O HIE 252 -26.403 -12.851 -26.914 0.00 0.00 +0.000 OA +ATOM 1303 N VAL 253 -27.868 -12.431 -25.260 0.00 0.00 +0.000 N +ATOM 1304 H VAL 253 -28.738 -12.802 -24.820 0.00 0.00 +0.000 HD +ATOM 1305 CA VAL 253 -27.155 -11.263 -24.755 0.00 0.00 +0.000 C +ATOM 1306 HA VAL 253 -26.718 -10.791 -25.553 0.00 0.00 +0.000 HD +ATOM 1307 CB VAL 253 -28.172 -10.255 -24.143 0.00 0.00 +0.000 C +ATOM 1308 HB VAL 253 -28.626 -10.716 -23.390 0.00 0.00 +0.000 HD +ATOM 1309 CG1 VAL 253 -27.444 -9.054 -23.567 0.00 0.00 +0.000 C +ATOM 1310 HG11 VAL 253 -26.951 -8.579 -24.296 0.00 0.00 +0.000 HD +ATOM 1311 HG12 VAL 253 -28.105 -8.428 -23.152 0.00 0.00 +0.000 HD +ATOM 1312 HG13 VAL 253 -26.793 -9.358 -22.870 0.00 0.00 +0.000 HD +ATOM 1313 CG2 VAL 253 -29.170 -9.822 -25.214 0.00 0.00 +0.000 C +ATOM 1314 HG21 VAL 253 -29.979 -10.407 -25.164 0.00 0.00 +0.000 HD +ATOM 1315 HG22 VAL 253 -29.430 -8.871 -25.054 0.00 0.00 +0.000 HD +ATOM 1316 HG23 VAL 253 -28.744 -9.910 -26.113 0.00 0.00 +0.000 HD +ATOM 1317 C VAL 253 -26.048 -11.549 -23.730 0.00 0.00 +0.000 C +ATOM 1318 O VAL 253 -24.956 -10.985 -23.811 0.00 0.00 +0.000 OA +ATOM 1319 N PHE 254 -26.328 -12.408 -22.759 0.00 0.00 +0.000 N +ATOM 1320 H PHE 254 -27.266 -12.822 -22.785 0.00 0.00 +0.000 HD +ATOM 1321 CA PHE 254 -25.325 -12.707 -21.744 0.00 0.00 +0.000 C +ATOM 1322 HA PHE 254 -24.774 -11.854 -21.612 0.00 0.00 +0.000 HD +ATOM 1323 CB PHE 254 -25.989 -13.057 -20.407 0.00 0.00 +0.000 C +ATOM 1324 HB2 PHE 254 -26.372 -12.229 -20.033 0.00 0.00 +0.000 HD +ATOM 1325 HB3 PHE 254 -26.683 -13.735 -20.582 0.00 0.00 +0.000 HD +ATOM 1326 CG PHE 254 -25.029 -13.626 -19.389 0.00 0.00 +0.000 A +ATOM 1327 CD1 PHE 254 -24.147 -12.797 -18.690 0.00 0.00 +0.000 A +ATOM 1328 HD1 PHE 254 -24.181 -11.814 -18.825 0.00 0.00 +0.000 HD +ATOM 1329 CE1 PHE 254 -23.221 -13.337 -17.803 0.00 0.00 +0.000 A +ATOM 1330 HE1 PHE 254 -22.601 -12.726 -17.299 0.00 0.00 +0.000 HD +ATOM 1331 CZ PHE 254 -23.155 -14.716 -17.618 0.00 0.00 +0.000 A +ATOM 1332 HZ PHE 254 -22.481 -15.100 -16.991 0.00 0.00 +0.000 HD +ATOM 1333 CE2 PHE 254 -24.029 -15.548 -18.308 0.00 0.00 +0.000 A +ATOM 1334 HE2 PHE 254 -23.994 -16.551 -18.171 0.00 0.00 +0.000 HD +ATOM 1335 CD2 PHE 254 -24.952 -15.006 -19.189 0.00 0.00 +0.000 A +ATOM 1336 HD2 PHE 254 -25.574 -15.609 -19.690 0.00 0.00 +0.000 HD +ATOM 1337 C PHE 254 -24.328 -13.814 -22.100 0.00 0.00 +0.000 C +ATOM 1338 O PHE 254 -23.119 -13.620 -22.006 0.00 0.00 +0.000 OA +ATOM 1339 N SER 255 -24.824 -14.984 -22.489 0.00 0.00 +0.000 N +ATOM 1340 H SER 255 -25.846 -15.043 -22.539 0.00 0.00 +0.000 HD +ATOM 1341 CA SER 255 -23.919 -16.088 -22.814 0.00 0.00 +0.000 C +ATOM 1342 HA SER 255 -23.308 -16.236 -22.009 0.00 0.00 +0.000 HD +ATOM 1343 CB SER 255 -24.706 -17.379 -23.015 0.00 0.00 +0.000 C +ATOM 1344 HB2 SER 255 -25.312 -17.270 -23.792 0.00 0.00 +0.000 HD +ATOM 1345 HB3 SER 255 -24.070 -18.125 -23.165 0.00 0.00 +0.000 HD +ATOM 1346 OG SER 255 -25.481 -17.658 -21.860 0.00 0.00 +0.000 OA +ATOM 1347 HG SER 255 -26.173 -16.947 -21.744 0.00 0.00 +0.000 HD +ATOM 1348 C SER 255 -23.028 -15.853 -24.033 0.00 0.00 +0.000 C +ATOM 1349 O SER 255 -21.872 -16.284 -24.046 0.00 0.00 +0.000 OA +ATOM 1350 N ASP 256 -23.562 -15.187 -25.054 0.00 0.00 +0.000 N +ATOM 1351 H ASP 256 -24.538 -14.876 -24.914 0.00 0.00 +0.000 HD +ATOM 1352 CA ASP 256 -22.796 -14.929 -26.274 0.00 0.00 +0.000 C +ATOM 1353 HA ASP 256 -22.166 -15.700 -26.396 0.00 0.00 +0.000 HD +ATOM 1354 CB ASP 256 -23.747 -14.753 -27.466 0.00 0.00 +0.000 C +ATOM 1355 HB2 ASP 256 -24.491 -15.403 -27.360 0.00 0.00 +0.000 HD +ATOM 1356 HB3 ASP 256 -24.092 -13.822 -27.446 0.00 0.00 +0.000 HD +ATOM 1357 CG ASP 256 -23.067 -14.997 -28.796 0.00 0.00 +0.000 C +ATOM 1358 OD1 ASP 256 -21.899 -15.441 -28.789 0.00 0.00 +0.000 OA +ATOM 1359 OD2 ASP 256 -23.705 -14.759 -29.840 0.00 0.00 +0.000 OA +ATOM 1360 C ASP 256 -21.950 -13.679 -26.100 0.00 0.00 +0.000 C +ATOM 1361 O ASP 256 -22.237 -12.639 -26.691 0.00 0.00 +0.000 OA +ATOM 1362 N GLY 257 -20.903 -13.787 -25.291 0.00 0.00 +0.000 N +ATOM 1363 H GLY 257 -20.767 -14.718 -24.867 0.00 0.00 +0.000 HD +ATOM 1364 CA GLY 257 -20.035 -12.647 -25.048 0.00 0.00 +0.000 C +ATOM 1365 HA2 GLY 257 -19.568 -12.390 -25.896 0.00 0.00 +0.000 HD +ATOM 1366 HA3 GLY 257 -20.579 -11.870 -24.726 0.00 0.00 +0.000 HD +ATOM 1367 C GLY 257 -18.999 -13.009 -23.992 0.00 0.00 +0.000 C +ATOM 1368 O GLY 257 -19.096 -14.059 -23.348 0.00 0.00 +0.000 OA +ATOM 1369 N VAL 258 -18.008 -12.147 -23.794 0.00 0.00 +0.000 N +ATOM 1370 H VAL 258 -18.029 -11.305 -24.384 0.00 0.00 +0.000 HD +ATOM 1371 CA VAL 258 -16.993 -12.427 -22.800 0.00 0.00 +0.000 C +ATOM 1372 HA VAL 258 -16.642 -13.351 -22.958 0.00 0.00 +0.000 HD +ATOM 1373 CB VAL 258 -15.803 -11.420 -22.883 0.00 0.00 +0.000 C +ATOM 1374 HB VAL 258 -16.082 -10.596 -22.417 0.00 0.00 +0.000 HD +ATOM 1375 CG1 VAL 258 -14.611 -11.992 -22.117 0.00 0.00 +0.000 C +ATOM 1376 HG11 VAL 258 -14.588 -12.984 -22.234 0.00 0.00 +0.000 HD +ATOM 1377 HG12 VAL 258 -13.767 -11.593 -22.472 0.00 0.00 +0.000 HD +ATOM 1378 HG13 VAL 258 -14.704 -11.771 -21.147 0.00 0.00 +0.000 HD +ATOM 1379 CG2 VAL 258 -15.418 -11.159 -24.334 0.00 0.00 +0.000 C +ATOM 1380 HG21 VAL 258 -14.941 -11.959 -24.697 0.00 0.00 +0.000 HD +ATOM 1381 HG22 VAL 258 -16.245 -10.989 -24.869 0.00 0.00 +0.000 HD +ATOM 1382 HG23 VAL 258 -14.819 -10.360 -24.377 0.00 0.00 +0.000 HD +ATOM 1383 C VAL 258 -17.632 -12.393 -21.429 0.00 0.00 +0.000 C +ATOM 1384 O VAL 258 -18.617 -11.691 -21.193 0.00 0.00 +0.000 OA +ATOM 1385 N THR 259 -17.055 -13.166 -20.524 0.00 0.00 +0.000 N +ATOM 1386 H THR 259 -16.219 -13.685 -20.861 0.00 0.00 +0.000 HD +ATOM 1387 CA THR 259 -17.570 -13.262 -19.175 0.00 0.00 +0.000 C +ATOM 1388 HA THR 259 -18.481 -12.817 -19.143 0.00 0.00 +0.000 HD +ATOM 1389 CB THR 259 -17.698 -14.742 -18.757 0.00 0.00 +0.000 C +ATOM 1390 HB THR 259 -16.764 -15.138 -18.663 0.00 0.00 +0.000 HD +ATOM 1391 CG2 THR 259 -18.450 -14.851 -17.455 0.00 0.00 +0.000 C +ATOM 1392 HG21 THR 259 -19.421 -14.635 -17.596 0.00 0.00 +0.000 HD +ATOM 1393 HG22 THR 259 -18.377 -15.784 -17.089 0.00 0.00 +0.000 HD +ATOM 1394 HG23 THR 259 -18.072 -14.209 -16.781 0.00 0.00 +0.000 HD +ATOM 1395 OG1 THR 259 -18.391 -15.469 -19.785 0.00 0.00 +0.000 OA +ATOM 1396 HG1 THR 259 -18.425 -14.928 -20.631 0.00 0.00 +0.000 HD +ATOM 1397 C THR 259 -16.670 -12.569 -18.162 0.00 0.00 +0.000 C +ATOM 1398 O THR 259 -15.458 -12.745 -18.180 0.00 0.00 +0.000 OA +ATOM 1399 N ASN 260 -17.278 -11.789 -17.279 0.00 0.00 +0.000 N +ATOM 1400 H ASN 260 -18.307 -11.683 -17.432 0.00 0.00 +0.000 HD +ATOM 1401 CA ASN 260 -16.568 -11.135 -16.186 0.00 0.00 +0.000 C +ATOM 1402 HA ASN 260 -15.902 -11.776 -15.842 0.00 0.00 +0.000 HD +ATOM 1403 CB ASN 260 -15.905 -9.805 -16.602 0.00 0.00 +0.000 C +ATOM 1404 HB2 ASN 260 -15.574 -9.352 -15.775 0.00 0.00 +0.000 HD +ATOM 1405 HB3 ASN 260 -15.133 -10.018 -17.200 0.00 0.00 +0.000 HD +ATOM 1406 CG ASN 260 -16.841 -8.858 -17.334 0.00 0.00 +0.000 C +ATOM 1407 OD1 ASN 260 -17.905 -8.490 -16.837 0.00 0.00 +0.000 OA +ATOM 1408 ND2 ASN 260 -16.428 -8.445 -18.529 0.00 0.00 +0.000 N +ATOM 1409 HD21 ASN 260 -16.996 -7.815 -19.063 0.00 0.00 +0.000 HD +ATOM 1410 HD22 ASN 260 -15.555 -8.760 -18.898 0.00 0.00 +0.000 HD +ATOM 1411 C ASN 260 -17.607 -10.938 -15.098 0.00 0.00 +0.000 C +ATOM 1412 O ASN 260 -18.800 -11.075 -15.362 0.00 0.00 +0.000 OA +ATOM 1413 N TRP 261 -17.170 -10.647 -13.877 0.00 0.00 +0.000 N +ATOM 1414 H TRP 261 -16.152 -10.550 -13.781 0.00 0.00 +0.000 HD +ATOM 1415 CA TRP 261 -18.117 -10.488 -12.788 0.00 0.00 +0.000 C +ATOM 1416 HA TRP 261 -18.642 -11.351 -12.705 0.00 0.00 +0.000 HD +ATOM 1417 CB TRP 261 -17.375 -10.282 -11.458 0.00 0.00 +0.000 C +ATOM 1418 HB2 TRP 261 -16.612 -9.673 -11.604 0.00 0.00 +0.000 HD +ATOM 1419 HB3 TRP 261 -18.005 -9.923 -10.788 0.00 0.00 +0.000 HD +ATOM 1420 CG TRP 261 -16.810 -11.573 -10.890 0.00 0.00 +0.000 A +ATOM 1421 CD1 TRP 261 -15.501 -11.850 -10.618 0.00 0.00 +0.000 A +ATOM 1422 HD1 TRP 261 -14.739 -11.221 -10.750 0.00 0.00 +0.000 HD +ATOM 1423 NE1 TRP 261 -15.379 -13.137 -10.129 0.00 0.00 +0.000 N +ATOM 1424 HE1 TRP 261 -14.522 -13.574 -9.861 0.00 0.00 +0.000 HD +ATOM 1425 CE2 TRP 261 -16.620 -13.712 -10.073 0.00 0.00 +0.000 A +ATOM 1426 CZ2 TRP 261 -17.006 -14.995 -9.651 0.00 0.00 +0.000 A +ATOM 1427 HZ2 TRP 261 -16.315 -15.646 -9.327 0.00 0.00 +0.000 HD +ATOM 1428 CH2 TRP 261 -18.340 -15.306 -9.703 0.00 0.00 +0.000 A +ATOM 1429 HH2 TRP 261 -18.655 -16.207 -9.405 0.00 0.00 +0.000 HD +ATOM 1430 CZ3 TRP 261 -19.289 -14.382 -10.169 0.00 0.00 +0.000 A +ATOM 1431 HZ3 TRP 261 -20.249 -14.631 -10.204 0.00 0.00 +0.000 HD +ATOM 1432 CE3 TRP 261 -18.906 -13.105 -10.590 0.00 0.00 +0.000 A +ATOM 1433 HE3 TRP 261 -19.592 -12.461 -10.911 0.00 0.00 +0.000 HD +ATOM 1434 CD2 TRP 261 -17.549 -12.761 -10.547 0.00 0.00 +0.000 A +ATOM 1435 C TRP 261 -19.123 -9.367 -13.037 0.00 0.00 +0.000 C +ATOM 1436 O TRP 261 -20.273 -9.459 -12.611 0.00 0.00 +0.000 OA +ATOM 1437 N GLY 262 -18.696 -8.325 -13.748 0.00 0.00 +0.000 N +ATOM 1438 H GLY 262 -17.715 -8.379 -14.061 0.00 0.00 +0.000 HD +ATOM 1439 CA GLY 262 -19.586 -7.214 -14.037 0.00 0.00 +0.000 C +ATOM 1440 HA2 GLY 262 -19.918 -6.812 -13.169 0.00 0.00 +0.000 HD +ATOM 1441 HA3 GLY 262 -19.075 -6.492 -14.529 0.00 0.00 +0.000 HD +ATOM 1442 C GLY 262 -20.780 -7.641 -14.877 0.00 0.00 +0.000 C +ATOM 1443 O GLY 262 -21.913 -7.225 -14.620 0.00 0.00 +0.000 OA +ATOM 1444 N ARG 263 -20.539 -8.488 -15.875 0.00 0.00 +0.000 N +ATOM 1445 H ARG 263 -19.560 -8.777 -15.986 0.00 0.00 +0.000 HD +ATOM 1446 CA ARG 263 -21.633 -8.947 -16.729 0.00 0.00 +0.000 C +ATOM 1447 HA ARG 263 -22.156 -8.144 -17.044 0.00 0.00 +0.000 HD +ATOM 1448 CB ARG 263 -21.092 -9.657 -17.976 0.00 0.00 +0.000 C +ATOM 1449 HB2 ARG 263 -20.407 -10.313 -17.688 0.00 0.00 +0.000 HD +ATOM 1450 HB3 ARG 263 -21.848 -10.112 -18.428 0.00 0.00 +0.000 HD +ATOM 1451 CG ARG 263 -20.444 -8.706 -18.979 0.00 0.00 +0.000 C +ATOM 1452 HG2 ARG 263 -21.127 -8.065 -19.323 0.00 0.00 +0.000 HD +ATOM 1453 HG3 ARG 263 -19.704 -8.205 -18.535 0.00 0.00 +0.000 HD +ATOM 1454 CD ARG 263 -19.846 -9.447 -20.189 0.00 0.00 +0.000 C +ATOM 1455 HD2 ARG 263 -19.412 -8.769 -20.774 0.00 0.00 +0.000 HD +ATOM 1456 HD3 ARG 263 -19.170 -10.090 -19.844 0.00 0.00 +0.000 HD +ATOM 1457 NE ARG 263 -20.865 -10.172 -20.953 0.00 0.00 +0.000 N +ATOM 1458 HE ARG 263 -20.922 -11.166 -20.833 0.00 0.00 +0.000 HD +ATOM 1459 CZ ARG 263 -21.712 -9.588 -21.790 0.00 0.00 +0.000 C +ATOM 1460 NH1 ARG 263 -21.642 -8.290 -21.971 0.00 0.00 +0.000 N +ATOM 1461 HH11 ARG 263 -20.961 -7.721 -21.518 0.00 0.00 +0.000 HD +ATOM 1462 HH12 ARG 263 -22.304 -7.837 -22.598 0.00 0.00 +0.000 HD +ATOM 1463 NH2 ARG 263 -22.642 -10.290 -22.413 0.00 0.00 +0.000 N +ATOM 1464 HH21 ARG 263 -22.690 -11.284 -22.261 0.00 0.00 +0.000 HD +ATOM 1465 HH22 ARG 263 -23.288 -9.848 -23.027 0.00 0.00 +0.000 HD +ATOM 1466 C ARG 263 -22.575 -9.876 -15.974 0.00 0.00 +0.000 C +ATOM 1467 O ARG 263 -23.756 -9.949 -16.291 0.00 0.00 +0.000 OA +ATOM 1468 N ILE 264 -22.050 -10.595 -14.985 0.00 0.00 +0.000 N +ATOM 1469 H ILE 264 -21.039 -10.459 -14.830 0.00 0.00 +0.000 HD +ATOM 1470 CA ILE 264 -22.880 -11.500 -14.199 0.00 0.00 +0.000 C +ATOM 1471 HA ILE 264 -23.483 -11.964 -14.843 0.00 0.00 +0.000 HD +ATOM 1472 CB ILE 264 -21.985 -12.465 -13.384 0.00 0.00 +0.000 C +ATOM 1473 HB ILE 264 -21.293 -11.928 -12.933 0.00 0.00 +0.000 HD +ATOM 1474 CG2 ILE 264 -22.805 -13.230 -12.339 0.00 0.00 +0.000 C +ATOM 1475 HG21 ILE 264 -22.199 -13.828 -11.821 0.00 0.00 +0.000 HD +ATOM 1476 HG22 ILE 264 -23.242 -12.579 -11.724 0.00 0.00 +0.000 HD +ATOM 1477 HG23 ILE 264 -23.500 -13.774 -12.802 0.00 0.00 +0.000 HD +ATOM 1478 CG1 ILE 264 -21.291 -13.423 -14.357 0.00 0.00 +0.000 C +ATOM 1479 HG12 ILE 264 -21.995 -13.994 -14.788 0.00 0.00 +0.000 HD +ATOM 1480 HG13 ILE 264 -20.858 -12.872 -15.076 0.00 0.00 +0.000 HD +ATOM 1481 CD1 ILE 264 -20.253 -14.307 -13.729 0.00 0.00 +0.000 C +ATOM 1482 HD11 ILE 264 -20.676 -14.873 -13.020 0.00 0.00 +0.000 HD +ATOM 1483 HD12 ILE 264 -19.848 -14.900 -14.427 0.00 0.00 +0.000 HD +ATOM 1484 HD13 ILE 264 -19.535 -13.744 -13.317 0.00 0.00 +0.000 HD +ATOM 1485 C ILE 264 -23.782 -10.670 -13.282 0.00 0.00 +0.000 C +ATOM 1486 O ILE 264 -24.956 -10.986 -13.084 0.00 0.00 +0.000 OA +ATOM 1487 N VAL 265 -23.231 -9.590 -12.741 0.00 0.00 +0.000 N +ATOM 1488 H VAL 265 -22.236 -9.436 -12.982 0.00 0.00 +0.000 HD +ATOM 1489 CA VAL 265 -23.999 -8.703 -11.874 0.00 0.00 +0.000 C +ATOM 1490 HA VAL 265 -24.442 -9.254 -11.169 0.00 0.00 +0.000 HD +ATOM 1491 CB VAL 265 -23.098 -7.632 -11.234 0.00 0.00 +0.000 C +ATOM 1492 HB VAL 265 -22.575 -7.203 -11.962 0.00 0.00 +0.000 HD +ATOM 1493 CG1 VAL 265 -23.949 -6.547 -10.596 0.00 0.00 +0.000 C +ATOM 1494 HG11 VAL 265 -23.364 -5.926 -10.073 0.00 0.00 +0.000 HD +ATOM 1495 HG12 VAL 265 -24.425 -6.032 -11.309 0.00 0.00 +0.000 HD +ATOM 1496 HG13 VAL 265 -24.621 -6.965 -9.984 0.00 0.00 +0.000 HD +ATOM 1497 CG2 VAL 265 -22.187 -8.274 -10.192 0.00 0.00 +0.000 C +ATOM 1498 HG21 VAL 265 -22.288 -9.267 -10.235 0.00 0.00 +0.000 HD +ATOM 1499 HG22 VAL 265 -21.239 -8.022 -10.385 0.00 0.00 +0.000 HD +ATOM 1500 HG23 VAL 265 -22.446 -7.947 -9.284 0.00 0.00 +0.000 HD +ATOM 1501 C VAL 265 -25.106 -8.024 -12.699 0.00 0.00 +0.000 C +ATOM 1502 O VAL 265 -26.230 -7.866 -12.228 0.00 0.00 +0.000 OA +ATOM 1503 N THR 266 -24.797 -7.645 -13.937 0.00 0.00 +0.000 N +ATOM 1504 H THR 266 -23.827 -7.828 -14.227 0.00 0.00 +0.000 HD +ATOM 1505 CA THR 266 -25.802 -7.015 -14.791 0.00 0.00 +0.000 C +ATOM 1506 HA THR 266 -26.195 -6.237 -14.302 0.00 0.00 +0.000 HD +ATOM 1507 CB THR 266 -25.192 -6.544 -16.125 0.00 0.00 +0.000 C +ATOM 1508 HB THR 266 -24.752 -7.338 -16.584 0.00 0.00 +0.000 HD +ATOM 1509 CG2 THR 266 -26.275 -5.935 -17.034 0.00 0.00 +0.000 C +ATOM 1510 HG21 THR 266 -27.172 -6.277 -16.755 0.00 0.00 +0.000 HD +ATOM 1511 HG22 THR 266 -26.255 -4.939 -16.951 0.00 0.00 +0.000 HD +ATOM 1512 HG23 THR 266 -26.097 -6.196 -17.982 0.00 0.00 +0.000 HD +ATOM 1513 OG1 THR 266 -24.177 -5.563 -15.857 0.00 0.00 +0.000 OA +ATOM 1514 HG1 THR 266 -23.376 -5.998 -15.434 0.00 0.00 +0.000 HD +ATOM 1515 C THR 266 -26.919 -8.016 -15.079 0.00 0.00 +0.000 C +ATOM 1516 O THR 266 -28.102 -7.673 -15.065 0.00 0.00 +0.000 OA +ATOM 1517 N LEU 267 -26.537 -9.259 -15.345 0.00 0.00 +0.000 N +ATOM 1518 H LEU 267 -25.512 -9.412 -15.348 0.00 0.00 +0.000 HD +ATOM 1519 CA LEU 267 -27.511 -10.311 -15.610 0.00 0.00 +0.000 C +ATOM 1520 HA LEU 267 -28.040 -10.063 -16.429 0.00 0.00 +0.000 HD +ATOM 1521 CB LEU 267 -26.791 -11.643 -15.839 0.00 0.00 +0.000 C +ATOM 1522 HB2 LEU 267 -26.350 -11.603 -16.734 0.00 0.00 +0.000 HD +ATOM 1523 HB3 LEU 267 -26.101 -11.745 -15.126 0.00 0.00 +0.000 HD +ATOM 1524 CG LEU 267 -27.658 -12.908 -15.817 0.00 0.00 +0.000 C +ATOM 1525 HG LEU 267 -28.287 -12.856 -15.047 0.00 0.00 +0.000 HD +ATOM 1526 CD1 LEU 267 -28.450 -13.011 -17.114 0.00 0.00 +0.000 C +ATOM 1527 HD11 LEU 267 -27.818 -13.056 -17.888 0.00 0.00 +0.000 HD +ATOM 1528 HD12 LEU 267 -29.014 -13.837 -17.096 0.00 0.00 +0.000 HD +ATOM 1529 HD13 LEU 267 -29.038 -12.208 -17.210 0.00 0.00 +0.000 HD +ATOM 1530 CD2 LEU 267 -26.769 -14.138 -15.637 0.00 0.00 +0.000 C +ATOM 1531 HD21 LEU 267 -26.269 -14.062 -14.775 0.00 0.00 +0.000 HD +ATOM 1532 HD22 LEU 267 -27.339 -14.959 -15.623 0.00 0.00 +0.000 HD +ATOM 1533 HD23 LEU 267 -26.121 -14.192 -16.396 0.00 0.00 +0.000 HD +ATOM 1534 C LEU 267 -28.486 -10.466 -14.440 0.00 0.00 +0.000 C +ATOM 1535 O LEU 267 -29.704 -10.525 -14.630 0.00 0.00 +0.000 OA +ATOM 1536 N ILE 268 -27.937 -10.531 -13.232 0.00 0.00 +0.000 N +ATOM 1537 H ILE 268 -26.899 -10.447 -13.221 0.00 0.00 +0.000 HD +ATOM 1538 CA ILE 268 -28.737 -10.707 -12.023 0.00 0.00 +0.000 C +ATOM 1539 HA ILE 268 -29.429 -11.406 -12.241 0.00 0.00 +0.000 HD +ATOM 1540 CB ILE 268 -27.836 -11.130 -10.830 0.00 0.00 +0.000 C +ATOM 1541 HB ILE 268 -27.096 -10.477 -10.765 0.00 0.00 +0.000 HD +ATOM 1542 CG2 ILE 268 -28.635 -11.125 -9.524 0.00 0.00 +0.000 C +ATOM 1543 HG21 ILE 268 -28.031 -11.365 -8.768 0.00 0.00 +0.000 HD +ATOM 1544 HG22 ILE 268 -29.015 -10.215 -9.374 0.00 0.00 +0.000 HD +ATOM 1545 HG23 ILE 268 -29.374 -11.791 -9.588 0.00 0.00 +0.000 HD +ATOM 1546 CG1 ILE 268 -27.232 -12.514 -11.101 0.00 0.00 +0.000 C +ATOM 1547 HG12 ILE 268 -27.963 -13.193 -11.050 0.00 0.00 +0.000 HD +ATOM 1548 HG13 ILE 268 -26.860 -12.516 -12.029 0.00 0.00 +0.000 HD +ATOM 1549 CD1 ILE 268 -26.127 -12.908 -10.135 0.00 0.00 +0.000 C +ATOM 1550 HD11 ILE 268 -26.492 -12.921 -9.206 0.00 0.00 +0.000 HD +ATOM 1551 HD12 ILE 268 -25.788 -13.815 -10.377 0.00 0.00 +0.000 HD +ATOM 1552 HD13 ILE 268 -25.385 -12.243 -10.197 0.00 0.00 +0.000 HD +ATOM 1553 C ILE 268 -29.503 -9.437 -11.658 0.00 0.00 +0.000 C +ATOM 1554 O ILE 268 -30.666 -9.494 -11.258 0.00 0.00 +0.000 OA +ATOM 1555 N SER 269 -28.850 -8.293 -11.829 0.00 0.00 +0.000 N +ATOM 1556 H SER 269 -27.887 -8.395 -12.209 0.00 0.00 +0.000 HD +ATOM 1557 CA SER 269 -29.452 -7.007 -11.504 0.00 0.00 +0.000 C +ATOM 1558 HA SER 269 -29.763 -7.043 -10.539 0.00 0.00 +0.000 HD +ATOM 1559 CB SER 269 -28.413 -5.898 -11.641 0.00 0.00 +0.000 C +ATOM 1560 HB2 SER 269 -28.046 -5.913 -12.562 0.00 0.00 +0.000 HD +ATOM 1561 HB3 SER 269 -28.846 -5.026 -11.449 0.00 0.00 +0.000 HD +ATOM 1562 OG SER 269 -27.359 -6.104 -10.719 0.00 0.00 +0.000 OA +ATOM 1563 HG SER 269 -26.715 -6.772 -11.091 0.00 0.00 +0.000 HD +ATOM 1564 C SER 269 -30.657 -6.687 -12.371 0.00 0.00 +0.000 C +ATOM 1565 O SER 269 -31.663 -6.161 -11.887 0.00 0.00 +0.000 OA +ATOM 1566 N PHE 270 -30.554 -6.970 -13.660 0.00 0.00 +0.000 N +ATOM 1567 H PHE 270 -29.662 -7.363 -13.966 0.00 0.00 +0.000 HD +ATOM 1568 CA PHE 270 -31.685 -6.709 -14.524 0.00 0.00 +0.000 C +ATOM 1569 HA PHE 270 -32.057 -5.822 -14.269 0.00 0.00 +0.000 HD +ATOM 1570 CB PHE 270 -31.292 -6.802 -16.000 0.00 0.00 +0.000 C +ATOM 1571 HB2 PHE 270 -30.548 -6.174 -16.155 0.00 0.00 +0.000 HD +ATOM 1572 HB3 PHE 270 -31.029 -7.734 -16.185 0.00 0.00 +0.000 HD +ATOM 1573 CG PHE 270 -32.412 -6.439 -16.935 0.00 0.00 +0.000 A +ATOM 1574 CD1 PHE 270 -32.845 -5.119 -17.043 0.00 0.00 +0.000 A +ATOM 1575 HD1 PHE 270 -32.389 -4.402 -16.529 0.00 0.00 +0.000 HD +ATOM 1576 CE1 PHE 270 -33.919 -4.787 -17.873 0.00 0.00 +0.000 A +ATOM 1577 HE1 PHE 270 -34.218 -3.831 -17.935 0.00 0.00 +0.000 HD +ATOM 1578 CZ PHE 270 -34.560 -5.781 -18.600 0.00 0.00 +0.000 A +ATOM 1579 HZ PHE 270 -35.328 -5.548 -19.194 0.00 0.00 +0.000 HD +ATOM 1580 CE2 PHE 270 -34.130 -7.102 -18.499 0.00 0.00 +0.000 A +ATOM 1581 HE2 PHE 270 -34.593 -7.831 -19.025 0.00 0.00 +0.000 HD +ATOM 1582 CD2 PHE 270 -33.062 -7.419 -17.670 0.00 0.00 +0.000 A +ATOM 1583 HD2 PHE 270 -32.756 -8.372 -17.603 0.00 0.00 +0.000 HD +ATOM 1584 C PHE 270 -32.759 -7.742 -14.201 0.00 0.00 +0.000 C +ATOM 1585 O PHE 270 -33.948 -7.482 -14.363 0.00 0.00 +0.000 OA +ATOM 1586 N GLY 271 -32.330 -8.919 -13.752 0.00 0.00 +0.000 N +ATOM 1587 H GLY 271 -31.308 -9.025 -13.696 0.00 0.00 +0.000 HD +ATOM 1588 CA GLY 271 -33.283 -9.951 -13.379 0.00 0.00 +0.000 C +ATOM 1589 HA2 GLY 271 -33.873 -10.163 -14.156 0.00 0.00 +0.000 HD +ATOM 1590 HA3 GLY 271 -32.796 -10.774 -13.093 0.00 0.00 +0.000 HD +ATOM 1591 C GLY 271 -34.130 -9.437 -12.226 0.00 0.00 +0.000 C +ATOM 1592 O GLY 271 -35.335 -9.677 -12.173 0.00 0.00 +0.000 OA +ATOM 1593 N ALA 272 -33.489 -8.730 -11.298 0.00 0.00 +0.000 N +ATOM 1594 H ALA 272 -32.467 -8.624 -11.461 0.00 0.00 +0.000 HD +ATOM 1595 CA ALA 272 -34.182 -8.156 -10.149 0.00 0.00 +0.000 C +ATOM 1596 HA ALA 272 -34.733 -8.872 -9.712 0.00 0.00 +0.000 HD +ATOM 1597 CB ALA 272 -33.182 -7.617 -9.146 0.00 0.00 +0.000 C +ATOM 1598 HB1 ALA 272 -32.392 -8.229 -9.095 0.00 0.00 +0.000 HD +ATOM 1599 HB2 ALA 272 -32.876 -6.707 -9.430 0.00 0.00 +0.000 HD +ATOM 1600 HB3 ALA 272 -33.610 -7.555 -8.243 0.00 0.00 +0.000 HD +ATOM 1601 C ALA 272 -35.109 -7.037 -10.606 0.00 0.00 +0.000 C +ATOM 1602 O ALA 272 -36.184 -6.845 -10.039 0.00 0.00 +0.000 OA +ATOM 1603 N PHE 273 -34.682 -6.304 -11.634 0.00 0.00 +0.000 N +ATOM 1604 H PHE 273 -33.748 -6.581 -12.004 0.00 0.00 +0.000 HD +ATOM 1605 CA PHE 273 -35.467 -5.203 -12.191 0.00 0.00 +0.000 C +ATOM 1606 HA PHE 273 -35.743 -4.625 -11.428 0.00 0.00 +0.000 HD +ATOM 1607 CB PHE 273 -34.648 -4.478 -13.270 0.00 0.00 +0.000 C +ATOM 1608 HB2 PHE 273 -33.740 -4.323 -12.905 0.00 0.00 +0.000 HD +ATOM 1609 HB3 PHE 273 -34.614 -5.066 -14.067 0.00 0.00 +0.000 HD +ATOM 1610 CG PHE 273 -35.212 -3.149 -13.695 0.00 0.00 +0.000 A +ATOM 1611 CD1 PHE 273 -35.122 -2.036 -12.863 0.00 0.00 +0.000 A +ATOM 1612 HD1 PHE 273 -34.711 -2.117 -11.963 0.00 0.00 +0.000 HD +ATOM 1613 CE1 PHE 273 -35.607 -0.788 -13.281 0.00 0.00 +0.000 A +ATOM 1614 HE1 PHE 273 -35.534 0.000 -12.666 0.00 0.00 +0.000 HD +ATOM 1615 CZ PHE 273 -36.184 -0.659 -14.540 0.00 0.00 +0.000 A +ATOM 1616 HZ PHE 273 -36.527 0.227 -14.843 0.00 0.00 +0.000 HD +ATOM 1617 CE2 PHE 273 -36.279 -1.772 -15.373 0.00 0.00 +0.000 A +ATOM 1618 HE2 PHE 273 -36.701 -1.687 -16.289 0.00 0.00 +0.000 HD +ATOM 1619 CD2 PHE 273 -35.796 -3.002 -14.947 0.00 0.00 +0.000 A +ATOM 1620 HD2 PHE 273 -35.869 -3.797 -15.553 0.00 0.00 +0.000 HD +ATOM 1621 C PHE 273 -36.748 -5.778 -12.794 0.00 0.00 +0.000 C +ATOM 1622 O PHE 273 -37.816 -5.187 -12.683 0.00 0.00 +0.000 OA +ATOM 1623 N VAL 274 -36.633 -6.931 -13.447 0.00 0.00 +0.000 N +ATOM 1624 H VAL 274 -35.676 -7.316 -13.494 0.00 0.00 +0.000 HD +ATOM 1625 CA VAL 274 -37.798 -7.571 -14.039 0.00 0.00 +0.000 C +ATOM 1626 HA VAL 274 -38.326 -6.879 -14.527 0.00 0.00 +0.000 HD +ATOM 1627 CB VAL 274 -37.387 -8.720 -14.996 0.00 0.00 +0.000 C +ATOM 1628 HB VAL 274 -36.832 -9.358 -14.475 0.00 0.00 +0.000 HD +ATOM 1629 CG1 VAL 274 -38.619 -9.480 -15.471 0.00 0.00 +0.000 C +ATOM 1630 HG11 VAL 274 -38.340 -10.211 -16.093 0.00 0.00 +0.000 HD +ATOM 1631 HG12 VAL 274 -39.091 -9.875 -14.683 0.00 0.00 +0.000 HD +ATOM 1632 HG13 VAL 274 -39.234 -8.853 -15.948 0.00 0.00 +0.000 HD +ATOM 1633 CG2 VAL 274 -36.637 -8.154 -16.194 0.00 0.00 +0.000 C +ATOM 1634 HG21 VAL 274 -36.840 -7.179 -16.279 0.00 0.00 +0.000 HD +ATOM 1635 HG22 VAL 274 -35.655 -8.283 -16.059 0.00 0.00 +0.000 HD +ATOM 1636 HG23 VAL 274 -36.929 -8.632 -17.022 0.00 0.00 +0.000 HD +ATOM 1637 C VAL 274 -38.679 -8.128 -12.918 0.00 0.00 +0.000 C +ATOM 1638 O VAL 274 -39.900 -8.053 -12.989 0.00 0.00 +0.000 OA +ATOM 1639 N ALA 275 -38.051 -8.685 -11.885 0.00 0.00 +0.000 N +ATOM 1640 H ALA 275 -37.017 -8.693 -11.956 0.00 0.00 +0.000 HD +ATOM 1641 CA ALA 275 -38.788 -9.234 -10.754 0.00 0.00 +0.000 C +ATOM 1642 HA ALA 275 -39.379 -9.977 -11.078 0.00 0.00 +0.000 HD +ATOM 1643 CB ALA 275 -37.819 -9.798 -9.703 0.00 0.00 +0.000 C +ATOM 1644 HB1 ALA 275 -38.106 -9.494 -8.798 0.00 0.00 +0.000 HD +ATOM 1645 HB2 ALA 275 -37.834 -10.794 -9.746 0.00 0.00 +0.000 HD +ATOM 1646 HB3 ALA 275 -36.899 -9.465 -9.895 0.00 0.00 +0.000 HD +ATOM 1647 C ALA 275 -39.671 -8.149 -10.132 0.00 0.00 +0.000 C +ATOM 1648 O ALA 275 -40.813 -8.413 -9.743 0.00 0.00 +0.000 OA +ATOM 1649 N LYS 276 -39.140 -6.933 -10.027 0.00 0.00 +0.000 N +ATOM 1650 H LYS 276 -38.168 -6.846 -10.365 0.00 0.00 +0.000 HD +ATOM 1651 CA LYS 276 -39.909 -5.821 -9.467 0.00 0.00 +0.000 C +ATOM 1652 HA LYS 276 -40.239 -6.082 -8.559 0.00 0.00 +0.000 HD +ATOM 1653 CB LYS 276 -39.056 -4.558 -9.365 0.00 0.00 +0.000 C +ATOM 1654 HB2 LYS 276 -38.563 -4.446 -10.230 0.00 0.00 +0.000 HD +ATOM 1655 HB3 LYS 276 -39.672 -3.778 -9.236 0.00 0.00 +0.000 HD +ATOM 1656 CG LYS 276 -38.051 -4.567 -8.238 0.00 0.00 +0.000 C +ATOM 1657 HG2 LYS 276 -38.533 -4.481 -7.367 0.00 0.00 +0.000 HD +ATOM 1658 HG3 LYS 276 -37.542 -5.425 -8.258 0.00 0.00 +0.000 HD +ATOM 1659 CD LYS 276 -37.085 -3.417 -8.382 0.00 0.00 +0.000 C +ATOM 1660 HD2 LYS 276 -36.546 -3.546 -9.210 0.00 0.00 +0.000 HD +ATOM 1661 HD3 LYS 276 -37.597 -2.565 -8.435 0.00 0.00 +0.000 HD +ATOM 1662 CE LYS 276 -36.143 -3.341 -7.200 0.00 0.00 +0.000 C +ATOM 1663 HE2 LYS 276 -36.662 -3.100 -6.384 0.00 0.00 +0.000 HD +ATOM 1664 HE3 LYS 276 -35.705 -4.228 -7.074 0.00 0.00 +0.000 HD +ATOM 1665 NZ LYS 276 -35.107 -2.311 -7.446 0.00 0.00 +0.000 N +ATOM 1666 HZ1 LYS 276 -35.246 -1.905 -8.350 0.00 0.00 +0.000 HD +ATOM 1667 HZ2 LYS 276 -35.172 -1.597 -6.748 0.00 0.00 +0.000 HD +ATOM 1668 HZ3 LYS 276 -34.200 -2.732 -7.407 0.00 0.00 +0.000 HD +ATOM 1669 C LYS 276 -41.100 -5.536 -10.363 0.00 0.00 +0.000 C +ATOM 1670 O LYS 276 -42.215 -5.319 -9.885 0.00 0.00 +0.000 OA +ATOM 1671 N HIE 277 -40.853 -5.525 -11.670 0.00 0.00 +0.000 N +ATOM 1672 H HIE 277 -39.863 -5.706 -11.927 0.00 0.00 +0.000 HD +ATOM 1673 CA HIE 277 -41.905 -5.277 -12.645 0.00 0.00 +0.000 C +ATOM 1674 HA HIE 277 -42.322 -4.384 -12.449 0.00 0.00 +0.000 HD +ATOM 1675 CB HIE 277 -41.314 -5.289 -14.054 0.00 0.00 +0.000 C +ATOM 1676 HB2 HIE 277 -40.784 -4.446 -14.194 0.00 0.00 +0.000 HD +ATOM 1677 HB3 HIE 277 -40.693 -6.075 -14.141 0.00 0.00 +0.000 HD +ATOM 1678 CG HIE 277 -42.344 -5.382 -15.135 0.00 0.00 +0.000 A +ATOM 1679 ND1 HIE 277 -43.132 -4.316 -15.507 0.00 0.00 +0.000 NA +ATOM 1680 CE1 HIE 277 -43.967 -4.701 -16.457 0.00 0.00 +0.000 A +ATOM 1681 HE1 HIE 277 -44.647 -4.126 -16.903 0.00 0.00 +0.000 HD +ATOM 1682 NE2 HIE 277 -43.748 -5.977 -16.712 0.00 0.00 +0.000 N +ATOM 1683 HE2 HIE 277 -44.239 -6.529 -17.389 0.00 0.00 +0.000 HD +ATOM 1684 CD2 HIE 277 -42.735 -6.427 -15.899 0.00 0.00 +0.000 A +ATOM 1685 HD2 HIE 277 -42.362 -7.350 -15.878 0.00 0.00 +0.000 HD +ATOM 1686 C HIE 277 -43.002 -6.344 -12.545 0.00 0.00 +0.000 C +ATOM 1687 O HIE 277 -44.191 -6.039 -12.682 0.00 0.00 +0.000 OA +ATOM 1688 N LEU 278 -42.592 -7.592 -12.312 0.00 0.00 +0.000 N +ATOM 1689 H LEU 278 -41.560 -7.698 -12.221 0.00 0.00 +0.000 HD +ATOM 1690 CA LEU 278 -43.526 -8.711 -12.196 0.00 0.00 +0.000 C +ATOM 1691 HA LEU 278 -44.096 -8.740 -13.030 0.00 0.00 +0.000 HD +ATOM 1692 CB LEU 278 -42.762 -10.033 -12.087 0.00 0.00 +0.000 C +ATOM 1693 HB2 LEU 278 -42.036 -9.911 -11.434 0.00 0.00 +0.000 HD +ATOM 1694 HB3 LEU 278 -43.398 -10.730 -11.812 0.00 0.00 +0.000 HD +ATOM 1695 CG LEU 278 -42.133 -10.470 -13.405 0.00 0.00 +0.000 C +ATOM 1696 HG LEU 278 -41.482 -9.772 -13.703 0.00 0.00 +0.000 HD +ATOM 1697 CD1 LEU 278 -41.411 -11.794 -13.236 0.00 0.00 +0.000 C +ATOM 1698 HD11 LEU 278 -42.060 -12.496 -12.939 0.00 0.00 +0.000 HD +ATOM 1699 HD12 LEU 278 -41.003 -12.069 -14.108 0.00 0.00 +0.000 HD +ATOM 1700 HD13 LEU 278 -40.689 -11.698 -12.549 0.00 0.00 +0.000 HD +ATOM 1701 CD2 LEU 278 -43.222 -10.602 -14.452 0.00 0.00 +0.000 C +ATOM 1702 HD21 LEU 278 -43.681 -9.720 -14.575 0.00 0.00 +0.000 HD +ATOM 1703 HD22 LEU 278 -42.819 -10.889 -15.323 0.00 0.00 +0.000 HD +ATOM 1704 HD23 LEU 278 -43.893 -11.285 -14.157 0.00 0.00 +0.000 HD +ATOM 1705 C LEU 278 -44.450 -8.569 -10.989 0.00 0.00 +0.000 C +ATOM 1706 O LEU 278 -45.623 -8.954 -11.051 0.00 0.00 +0.000 OA +ATOM 1707 N LYS 279 -43.920 -8.030 -9.896 0.00 0.00 +0.000 N +ATOM 1708 H LYS 279 -42.923 -7.764 -9.975 0.00 0.00 +0.000 HD +ATOM 1709 CA LYS 279 -44.715 -7.840 -8.686 0.00 0.00 +0.000 C +ATOM 1710 HA LYS 279 -45.225 -8.680 -8.498 0.00 0.00 +0.000 HD +ATOM 1711 CB LYS 279 -43.805 -7.482 -7.512 0.00 0.00 +0.000 C +ATOM 1712 HB2 LYS 279 -43.176 -8.246 -7.362 0.00 0.00 +0.000 HD +ATOM 1713 HB3 LYS 279 -43.279 -6.667 -7.764 0.00 0.00 +0.000 HD +ATOM 1714 CG LYS 279 -44.532 -7.200 -6.214 0.00 0.00 +0.000 C +ATOM 1715 HG2 LYS 279 -43.874 -6.876 -5.534 0.00 0.00 +0.000 HD +ATOM 1716 HG3 LYS 279 -45.224 -6.497 -6.372 0.00 0.00 +0.000 HD +ATOM 1717 CD LYS 279 -45.207 -8.448 -5.691 0.00 0.00 +0.000 C +ATOM 1718 HD2 LYS 279 -45.969 -8.688 -6.296 0.00 0.00 +0.000 HD +ATOM 1719 HD3 LYS 279 -44.546 -9.201 -5.681 0.00 0.00 +0.000 HD +ATOM 1720 CE LYS 279 -45.763 -8.288 -4.271 0.00 0.00 +0.000 C +ATOM 1721 HE2 LYS 279 -46.090 -9.184 -3.949 0.00 0.00 +0.000 HD +ATOM 1722 HE3 LYS 279 -45.018 -7.987 -3.664 0.00 0.00 +0.000 HD +ATOM 1723 NZ LYS 279 -46.892 -7.298 -4.182 0.00 0.00 +0.000 N +ATOM 1724 HZ1 LYS 279 -47.093 -6.953 -5.096 0.00 0.00 +0.000 HD +ATOM 1725 HZ2 LYS 279 -47.694 -7.755 -3.806 0.00 0.00 +0.000 HD +ATOM 1726 HZ3 LYS 279 -46.618 -6.547 -3.586 0.00 0.00 +0.000 HD +ATOM 1727 C LYS 279 -45.696 -6.706 -8.913 0.00 0.00 +0.000 C +ATOM 1728 O LYS 279 -46.876 -6.795 -8.559 0.00 0.00 +0.000 OA +ATOM 1729 N THR 280 -45.177 -5.634 -9.503 0.00 0.00 +0.000 N +ATOM 1730 H THR 280 -44.158 -5.730 -9.741 0.00 0.00 +0.000 HD +ATOM 1731 CA THR 280 -45.943 -4.432 -9.797 0.00 0.00 +0.000 C +ATOM 1732 HA THR 280 -46.245 -4.020 -8.924 0.00 0.00 +0.000 HD +ATOM 1733 CB THR 280 -45.039 -3.414 -10.528 0.00 0.00 +0.000 C +ATOM 1734 HB THR 280 -44.638 -3.862 -11.348 0.00 0.00 +0.000 HD +ATOM 1735 CG2 THR 280 -45.819 -2.186 -10.931 0.00 0.00 +0.000 C +ATOM 1736 HG21 THR 280 -46.797 -2.404 -10.999 0.00 0.00 +0.000 HD +ATOM 1737 HG22 THR 280 -45.696 -1.459 -10.249 0.00 0.00 +0.000 HD +ATOM 1738 HG23 THR 280 -45.500 -1.850 -11.822 0.00 0.00 +0.000 HD +ATOM 1739 OG1 THR 280 -43.962 -3.031 -9.655 0.00 0.00 +0.000 OA +ATOM 1740 HG1 THR 280 -43.250 -3.740 -9.651 0.00 0.00 +0.000 HD +ATOM 1741 C THR 280 -47.187 -4.732 -10.634 0.00 0.00 +0.000 C +ATOM 1742 O THR 280 -48.260 -4.173 -10.379 0.00 0.00 +0.000 OA +ATOM 1743 N ILE 281 -47.040 -5.618 -11.619 0.00 0.00 +0.000 N +ATOM 1744 H ILE 281 -46.090 -6.016 -11.711 0.00 0.00 +0.000 HD +ATOM 1745 CA ILE 281 -48.158 -5.979 -12.487 0.00 0.00 +0.000 C +ATOM 1746 HA ILE 281 -48.818 -5.212 -12.429 0.00 0.00 +0.000 HD +ATOM 1747 CB ILE 281 -47.723 -6.197 -13.963 0.00 0.00 +0.000 C +ATOM 1748 HB ILE 281 -48.546 -6.348 -14.500 0.00 0.00 +0.000 HD +ATOM 1749 CG2 ILE 281 -46.986 -4.959 -14.477 0.00 0.00 +0.000 C +ATOM 1750 HG21 ILE 281 -46.747 -5.092 -15.436 0.00 0.00 +0.000 HD +ATOM 1751 HG22 ILE 281 -47.578 -4.162 -14.387 0.00 0.00 +0.000 HD +ATOM 1752 HG23 ILE 281 -46.156 -4.823 -13.941 0.00 0.00 +0.000 HD +ATOM 1753 CG1 ILE 281 -46.832 -7.434 -14.092 0.00 0.00 +0.000 C +ATOM 1754 HG12 ILE 281 -45.954 -7.234 -13.667 0.00 0.00 +0.000 HD +ATOM 1755 HG13 ILE 281 -47.268 -8.183 -13.599 0.00 0.00 +0.000 HD +ATOM 1756 CD1 ILE 281 -46.609 -7.851 -15.520 0.00 0.00 +0.000 C +ATOM 1757 HD11 ILE 281 -46.168 -7.106 -16.022 0.00 0.00 +0.000 HD +ATOM 1758 HD12 ILE 281 -46.022 -8.661 -15.545 0.00 0.00 +0.000 HD +ATOM 1759 HD13 ILE 281 -47.488 -8.065 -15.948 0.00 0.00 +0.000 HD +ATOM 1760 C ILE 281 -48.899 -7.226 -12.028 0.00 0.00 +0.000 C +ATOM 1761 O ILE 281 -49.607 -7.858 -12.817 0.00 0.00 +0.000 OA +ATOM 1762 N ASN 282 -48.731 -7.578 -10.754 0.00 0.00 +0.000 N +ATOM 1763 H ASN 282 -48.101 -6.948 -10.211 0.00 0.00 +0.000 HD +ATOM 1764 CA ASN 282 -49.380 -8.755 -10.167 0.00 0.00 +0.000 C +ATOM 1765 HA ASN 282 -49.008 -8.849 -9.211 0.00 0.00 +0.000 HD +ATOM 1766 CB ASN 282 -50.877 -8.523 -9.987 0.00 0.00 +0.000 C +ATOM 1767 HB2 ASN 282 -51.158 -7.797 -10.605 0.00 0.00 +0.000 HD +ATOM 1768 HB3 ASN 282 -51.352 -9.369 -10.204 0.00 0.00 +0.000 HD +ATOM 1769 CG ASN 282 -51.208 -8.122 -8.579 0.00 0.00 +0.000 C +ATOM 1770 OD1 ASN 282 -51.177 -6.936 -8.252 0.00 0.00 +0.000 OA +ATOM 1771 ND2 ASN 282 -51.493 -9.099 -7.724 0.00 0.00 +0.000 N +ATOM 1772 HD21 ASN 282 -51.725 -8.889 -6.778 0.00 0.00 +0.000 HD +ATOM 1773 HD22 ASN 282 -51.472 -10.051 -8.039 0.00 0.00 +0.000 HD +ATOM 1774 C ASN 282 -49.157 -10.096 -10.859 0.00 0.00 +0.000 C +ATOM 1775 O ASN 282 -50.109 -10.831 -11.162 0.00 0.00 +0.000 OA +ATOM 1776 N GLN 283 -47.888 -10.398 -11.128 0.00 0.00 +0.000 N +ATOM 1777 H GLN 283 -47.203 -9.656 -10.878 0.00 0.00 +0.000 HD +ATOM 1778 CA GLN 283 -47.501 -11.677 -11.728 0.00 0.00 +0.000 C +ATOM 1779 HA GLN 283 -48.270 -12.287 -11.668 0.00 0.00 +0.000 HD +ATOM 1780 CB GLN 283 -46.992 -11.472 -13.156 0.00 0.00 +0.000 C +ATOM 1781 HB2 GLN 283 -46.424 -10.653 -13.183 0.00 0.00 +0.000 HD +ATOM 1782 HB3 GLN 283 -46.453 -12.268 -13.425 0.00 0.00 +0.000 HD +ATOM 1783 CG GLN 283 -48.118 -11.299 -14.177 0.00 0.00 +0.000 C +ATOM 1784 HG2 GLN 283 -48.852 -10.767 -13.754 0.00 0.00 +0.000 HD +ATOM 1785 HG3 GLN 283 -47.758 -10.800 -14.966 0.00 0.00 +0.000 HD +ATOM 1786 CD GLN 283 -48.696 -12.621 -14.661 0.00 0.00 +0.000 C +ATOM 1787 OE1 GLN 283 -48.563 -13.663 -14.011 0.00 0.00 +0.000 OA +ATOM 1788 NE2 GLN 283 -49.364 -12.576 -15.803 0.00 0.00 +0.000 N +ATOM 1789 HE21 GLN 283 -49.771 -13.424 -16.202 0.00 0.00 +0.000 HD +ATOM 1790 HE22 GLN 283 -49.470 -11.685 -16.282 0.00 0.00 +0.000 HD +ATOM 1791 C GLN 283 -46.402 -12.207 -10.825 0.00 0.00 +0.000 C +ATOM 1792 O GLN 283 -45.402 -12.743 -11.289 0.00 0.00 +0.000 OA +ATOM 1793 N GLU 284 -46.614 -12.047 -9.522 0.00 0.00 +0.000 N +ATOM 1794 H GLU 284 -47.524 -11.591 -9.286 0.00 0.00 +0.000 HD +ATOM 1795 CA GLU 284 -45.653 -12.474 -8.508 0.00 0.00 +0.000 C +ATOM 1796 HA GLU 284 -44.825 -11.868 -8.554 0.00 0.00 +0.000 HD +ATOM 1797 CB GLU 284 -46.227 -12.220 -7.116 0.00 0.00 +0.000 C +ATOM 1798 HB2 GLU 284 -46.836 -11.454 -7.181 0.00 0.00 +0.000 HD +ATOM 1799 HB3 GLU 284 -46.681 -13.040 -6.827 0.00 0.00 +0.000 HD +ATOM 1800 CG GLU 284 -45.167 -11.889 -6.099 0.00 0.00 +0.000 C +ATOM 1801 HG2 GLU 284 -44.517 -12.628 -6.074 0.00 0.00 +0.000 HD +ATOM 1802 HG3 GLU 284 -44.746 -11.036 -6.351 0.00 0.00 +0.000 HD +ATOM 1803 CD GLU 284 -45.729 -11.727 -4.711 0.00 0.00 +0.000 C +ATOM 1804 OE1 GLU 284 -46.883 -11.254 -4.595 0.00 0.00 +0.000 OA +ATOM 1805 OE2 GLU 284 -45.005 -12.055 -3.750 0.00 0.00 +0.000 OA +ATOM 1806 C GLU 284 -45.204 -13.933 -8.594 0.00 0.00 +0.000 C +ATOM 1807 O GLU 284 -44.051 -14.254 -8.288 0.00 0.00 +0.000 OA +ATOM 1808 N SER 285 -46.099 -14.826 -9.001 0.00 0.00 +0.000 N +ATOM 1809 H SER 285 -47.022 -14.453 -9.249 0.00 0.00 +0.000 HD +ATOM 1810 CA SER 285 -45.736 -16.237 -9.071 0.00 0.00 +0.000 C +ATOM 1811 HA SER 285 -45.328 -16.499 -8.178 0.00 0.00 +0.000 HD +ATOM 1812 CB SER 285 -46.978 -17.107 -9.289 0.00 0.00 +0.000 C +ATOM 1813 HB2 SER 285 -46.721 -18.065 -9.180 0.00 0.00 +0.000 HD +ATOM 1814 HB3 SER 285 -47.664 -16.861 -8.607 0.00 0.00 +0.000 HD +ATOM 1815 OG SER 285 -47.529 -16.922 -10.583 0.00 0.00 +0.000 OA +ATOM 1816 HG SER 285 -48.009 -16.047 -10.618 0.00 0.00 +0.000 HD +ATOM 1817 C SER 285 -44.711 -16.547 -10.158 0.00 0.00 +0.000 C +ATOM 1818 O SER 285 -44.196 -17.662 -10.224 0.00 0.00 +0.000 OA +ATOM 1819 N CYS 286 -44.415 -15.567 -11.006 0.00 0.00 +0.000 N +ATOM 1820 H CYS 286 -44.905 -14.674 -10.836 0.00 0.00 +0.000 HD +ATOM 1821 CA CYS 286 -43.460 -15.778 -12.088 0.00 0.00 +0.000 C +ATOM 1822 HA CYS 286 -43.531 -16.747 -12.387 0.00 0.00 +0.000 HD +ATOM 1823 CB CYS 286 -43.816 -14.888 -13.282 0.00 0.00 +0.000 C +ATOM 1824 HB2 CYS 286 -43.878 -13.941 -12.951 0.00 0.00 +0.000 HD +ATOM 1825 HB3 CYS 286 -43.062 -14.947 -13.944 0.00 0.00 +0.000 HD +ATOM 1826 SG CYS 286 -45.353 -15.297 -14.132 0.00 0.00 +0.000 S +ATOM 1827 HG CYS 286 -45.691 -14.491 -14.619 0.00 0.00 +0.000 HD +ATOM 1828 C CYS 286 -42.018 -15.518 -11.677 0.00 0.00 +0.000 C +ATOM 1829 O CYS 286 -41.087 -15.868 -12.400 0.00 0.00 +0.000 OA +ATOM 1830 N ILE 287 -41.841 -14.909 -10.510 0.00 0.00 +0.000 N +ATOM 1831 H ILE 287 -42.715 -14.693 -9.994 0.00 0.00 +0.000 HD +ATOM 1832 CA ILE 287 -40.513 -14.583 -10.019 0.00 0.00 +0.000 C +ATOM 1833 HA ILE 287 -40.056 -14.056 -10.766 0.00 0.00 +0.000 HD +ATOM 1834 CB ILE 287 -40.600 -13.656 -8.774 0.00 0.00 +0.000 C +ATOM 1835 HB ILE 287 -41.148 -14.114 -8.094 0.00 0.00 +0.000 HD +ATOM 1836 CG2 ILE 287 -39.195 -13.338 -8.249 0.00 0.00 +0.000 C +ATOM 1837 HG21 ILE 287 -39.270 -12.748 -7.449 0.00 0.00 +0.000 HD +ATOM 1838 HG22 ILE 287 -38.738 -14.188 -7.999 0.00 0.00 +0.000 HD +ATOM 1839 HG23 ILE 287 -38.676 -12.874 -8.962 0.00 0.00 +0.000 HD +ATOM 1840 CG1 ILE 287 -41.317 -12.348 -9.164 0.00 0.00 +0.000 C +ATOM 1841 HG12 ILE 287 -40.728 -11.846 -9.800 0.00 0.00 +0.000 HD +ATOM 1842 HG13 ILE 287 -42.162 -12.590 -9.647 0.00 0.00 +0.000 HD +ATOM 1843 CD1 ILE 287 -41.672 -11.434 -7.997 0.00 0.00 +0.000 C +ATOM 1844 HD11 ILE 287 -40.835 -11.174 -7.521 0.00 0.00 +0.000 HD +ATOM 1845 HD12 ILE 287 -42.129 -10.620 -8.348 0.00 0.00 +0.000 HD +ATOM 1846 HD13 ILE 287 -42.279 -11.922 -7.374 0.00 0.00 +0.000 HD +ATOM 1847 C ILE 287 -39.618 -15.775 -9.723 0.00 0.00 +0.000 C +ATOM 1848 O ILE 287 -38.500 -15.831 -10.211 0.00 0.00 +0.000 OA +ATOM 1849 N GLU 288 -40.099 -16.733 -8.941 0.00 0.00 +0.000 N +ATOM 1850 H GLU 288 -41.052 -16.591 -8.590 0.00 0.00 +0.000 HD +ATOM 1851 CA GLU 288 -39.275 -17.902 -8.630 0.00 0.00 +0.000 C +ATOM 1852 HA GLU 288 -38.451 -17.615 -8.134 0.00 0.00 +0.000 HD +ATOM 1853 CB GLU 288 -40.025 -18.823 -7.677 0.00 0.00 +0.000 C +ATOM 1854 HB2 GLU 288 -40.347 -18.280 -6.921 0.00 0.00 +0.000 HD +ATOM 1855 HB3 GLU 288 -40.765 -19.239 -8.175 0.00 0.00 +0.000 HD +ATOM 1856 CG GLU 288 -39.173 -19.947 -7.101 0.00 0.00 +0.000 C +ATOM 1857 HG2 GLU 288 -39.013 -20.608 -7.809 0.00 0.00 +0.000 HD +ATOM 1858 HG3 GLU 288 -38.341 -19.560 -6.753 0.00 0.00 +0.000 HD +ATOM 1859 CD GLU 288 -39.856 -20.673 -5.944 0.00 0.00 +0.000 C +ATOM 1860 OE1 GLU 288 -39.451 -20.469 -4.775 0.00 0.00 +0.000 OA +ATOM 1861 OE2 GLU 288 -40.804 -21.433 -6.218 0.00 0.00 +0.000 OA +ATOM 1862 C GLU 288 -38.859 -18.634 -9.919 0.00 0.00 +0.000 C +ATOM 1863 O GLU 288 -37.709 -19.041 -10.060 0.00 0.00 +0.000 OA +ATOM 1864 N PRO 289 -39.785 -18.801 -10.879 0.00 0.00 +0.000 N +ATOM 1865 CD PRO 289 -41.247 -18.648 -10.751 0.00 0.00 +0.000 C +ATOM 1866 HD2 PRO 289 -41.522 -17.719 -10.984 0.00 0.00 +0.000 HD +ATOM 1867 HD3 PRO 289 -41.541 -18.866 -9.823 0.00 0.00 +0.000 HD +ATOM 1868 CG PRO 289 -41.764 -19.645 -11.745 0.00 0.00 +0.000 C +ATOM 1869 HG2 PRO 289 -42.678 -19.407 -12.055 0.00 0.00 +0.000 HD +ATOM 1870 HG3 PRO 289 -41.753 -20.566 -11.372 0.00 0.00 +0.000 HD +ATOM 1871 CB PRO 289 -40.780 -19.528 -12.878 0.00 0.00 +0.000 C +ATOM 1872 HB2 PRO 289 -40.935 -18.694 -13.394 0.00 0.00 +0.000 HD +ATOM 1873 HB3 PRO 289 -40.829 -20.321 -13.472 0.00 0.00 +0.000 HD +ATOM 1874 CA PRO 289 -39.443 -19.476 -12.140 0.00 0.00 +0.000 C +ATOM 1875 HA PRO 289 -39.121 -20.408 -11.970 0.00 0.00 +0.000 HD +ATOM 1876 C PRO 289 -38.387 -18.666 -12.901 0.00 0.00 +0.000 C +ATOM 1877 O PRO 289 -37.498 -19.231 -13.534 0.00 0.00 +0.000 OA +ATOM 1878 N LEU 290 -38.485 -17.340 -12.828 0.00 0.00 +0.000 N +ATOM 1879 H LEU 290 -39.281 -16.987 -12.273 0.00 0.00 +0.000 HD +ATOM 1880 CA LEU 290 -37.515 -16.476 -13.500 0.00 0.00 +0.000 C +ATOM 1881 HA LEU 290 -37.463 -16.744 -14.466 0.00 0.00 +0.000 HD +ATOM 1882 CB LEU 290 -37.923 -15.009 -13.387 0.00 0.00 +0.000 C +ATOM 1883 HB2 LEU 290 -38.773 -14.889 -13.868 0.00 0.00 +0.000 HD +ATOM 1884 HB3 LEU 290 -37.998 -14.783 -12.434 0.00 0.00 +0.000 HD +ATOM 1885 CG LEU 290 -36.903 -14.052 -14.009 0.00 0.00 +0.000 C +ATOM 1886 HG LEU 290 -36.003 -14.241 -13.620 0.00 0.00 +0.000 HD +ATOM 1887 CD1 LEU 290 -36.856 -14.244 -15.514 0.00 0.00 +0.000 C +ATOM 1888 HD11 LEU 290 -37.759 -14.059 -15.905 0.00 0.00 +0.000 HD +ATOM 1889 HD12 LEU 290 -36.187 -13.615 -15.913 0.00 0.00 +0.000 HD +ATOM 1890 HD13 LEU 290 -36.591 -15.186 -15.725 0.00 0.00 +0.000 HD +ATOM 1891 CD2 LEU 290 -37.269 -12.634 -13.665 0.00 0.00 +0.000 C +ATOM 1892 HD21 LEU 290 -37.271 -12.512 -12.669 0.00 0.00 +0.000 HD +ATOM 1893 HD22 LEU 290 -36.604 -12.000 -14.070 0.00 0.00 +0.000 HD +ATOM 1894 HD23 LEU 290 -38.182 -12.419 -14.021 0.00 0.00 +0.000 HD +ATOM 1895 C LEU 290 -36.131 -16.644 -12.878 0.00 0.00 +0.000 C +ATOM 1896 O LEU 290 -35.124 -16.698 -13.586 0.00 0.00 +0.000 OA +ATOM 1897 N ALA 291 -36.087 -16.709 -11.550 0.00 0.00 +0.000 N +ATOM 1898 H ALA 291 -37.001 -16.638 -11.075 0.00 0.00 +0.000 HD +ATOM 1899 CA ALA 291 -34.817 -16.870 -10.849 0.00 0.00 +0.000 C +ATOM 1900 HA ALA 291 -34.208 -16.116 -11.104 0.00 0.00 +0.000 HD +ATOM 1901 CB ALA 291 -35.032 -16.836 -9.329 0.00 0.00 +0.000 C +ATOM 1902 HB1 ALA 291 -35.841 -16.289 -9.125 0.00 0.00 +0.000 HD +ATOM 1903 HB2 ALA 291 -35.161 -17.767 -8.996 0.00 0.00 +0.000 HD +ATOM 1904 HB3 ALA 291 -34.231 -16.430 -8.894 0.00 0.00 +0.000 HD +ATOM 1905 C ALA 291 -34.166 -18.185 -11.261 0.00 0.00 +0.000 C +ATOM 1906 O ALA 291 -32.949 -18.275 -11.381 0.00 0.00 +0.000 OA +ATOM 1907 N GLU 292 -34.989 -19.204 -11.477 0.00 0.00 +0.000 N +ATOM 1908 H GLU 292 -35.994 -18.993 -11.330 0.00 0.00 +0.000 HD +ATOM 1909 CA GLU 292 -34.487 -20.500 -11.887 0.00 0.00 +0.000 C +ATOM 1910 HA GLU 292 -33.766 -20.804 -11.261 0.00 0.00 +0.000 HD +ATOM 1911 CB GLU 292 -35.612 -21.538 -11.847 0.00 0.00 +0.000 C +ATOM 1912 HB2 GLU 292 -36.072 -21.445 -10.981 0.00 0.00 +0.000 HD +ATOM 1913 HB3 GLU 292 -36.212 -21.357 -12.606 0.00 0.00 +0.000 HD +ATOM 1914 CG GLU 292 -35.134 -22.972 -11.966 0.00 0.00 +0.000 C +ATOM 1915 HG2 GLU 292 -34.917 -23.149 -12.905 0.00 0.00 +0.000 HD +ATOM 1916 HG3 GLU 292 -34.367 -23.095 -11.369 0.00 0.00 +0.000 HD +ATOM 1917 CD GLU 292 -36.204 -23.960 -11.547 0.00 0.00 +0.000 C +ATOM 1918 OE1 GLU 292 -36.975 -23.633 -10.618 0.00 0.00 +0.000 OA +ATOM 1919 OE2 GLU 292 -36.262 -25.059 -12.129 0.00 0.00 +0.000 OA +ATOM 1920 C GLU 292 -33.919 -20.405 -13.302 0.00 0.00 +0.000 C +ATOM 1921 O GLU 292 -32.898 -21.015 -13.600 0.00 0.00 +0.000 OA +ATOM 1922 N SER 293 -34.587 -19.641 -14.168 0.00 0.00 +0.000 N +ATOM 1923 H SER 293 -35.438 -19.189 -13.786 0.00 0.00 +0.000 HD +ATOM 1924 CA SER 293 -34.133 -19.468 -15.552 0.00 0.00 +0.000 C +ATOM 1925 HA SER 293 -34.007 -20.383 -15.953 0.00 0.00 +0.000 HD +ATOM 1926 CB SER 293 -35.161 -18.677 -16.365 0.00 0.00 +0.000 C +ATOM 1927 HB2 SER 293 -35.388 -17.844 -15.872 0.00 0.00 +0.000 HD +ATOM 1928 HB3 SER 293 -34.768 -18.458 -17.252 0.00 0.00 +0.000 HD +ATOM 1929 OG SER 293 -36.342 -19.437 -16.558 0.00 0.00 +0.000 OA +ATOM 1930 HG SER 293 -36.848 -19.490 -15.698 0.00 0.00 +0.000 HD +ATOM 1931 C SER 293 -32.793 -18.743 -15.604 0.00 0.00 +0.000 C +ATOM 1932 O SER 293 -31.915 -19.092 -16.394 0.00 0.00 +0.000 OA +ATOM 1933 N ILE 294 -32.644 -17.729 -14.760 0.00 0.00 +0.000 N +ATOM 1934 H ILE 294 -33.460 -17.532 -14.158 0.00 0.00 +0.000 HD +ATOM 1935 CA ILE 294 -31.398 -16.965 -14.712 0.00 0.00 +0.000 C +ATOM 1936 HA ILE 294 -31.183 -16.718 -15.657 0.00 0.00 +0.000 HD +ATOM 1937 CB ILE 294 -31.517 -15.748 -13.765 0.00 0.00 +0.000 C +ATOM 1938 HB ILE 294 -31.826 -16.078 -12.882 0.00 0.00 +0.000 HD +ATOM 1939 CG2 ILE 294 -30.166 -15.058 -13.630 0.00 0.00 +0.000 C +ATOM 1940 HG21 ILE 294 -30.246 -14.291 -12.996 0.00 0.00 +0.000 HD +ATOM 1941 HG22 ILE 294 -29.493 -15.709 -13.283 0.00 0.00 +0.000 HD +ATOM 1942 HG23 ILE 294 -29.873 -14.722 -14.523 0.00 0.00 +0.000 HD +ATOM 1943 CG1 ILE 294 -32.565 -14.763 -14.298 0.00 0.00 +0.000 C +ATOM 1944 HG12 ILE 294 -32.268 -14.440 -15.194 0.00 0.00 +0.000 HD +ATOM 1945 HG13 ILE 294 -33.429 -15.253 -14.404 0.00 0.00 +0.000 HD +ATOM 1946 CD1 ILE 294 -32.797 -13.561 -13.395 0.00 0.00 +0.000 C +ATOM 1947 HD11 ILE 294 -31.941 -13.059 -13.292 0.00 0.00 +0.000 HD +ATOM 1948 HD12 ILE 294 -33.488 -12.971 -13.807 0.00 0.00 +0.000 HD +ATOM 1949 HD13 ILE 294 -33.112 -13.878 -12.503 0.00 0.00 +0.000 HD +ATOM 1950 C ILE 294 -30.263 -17.863 -14.226 0.00 0.00 +0.000 C +ATOM 1951 O ILE 294 -29.157 -17.838 -14.768 0.00 0.00 +0.000 OA +ATOM 1952 N THR 295 -30.545 -18.657 -13.198 0.00 0.00 +0.000 N +ATOM 1953 H THR 295 -31.511 -18.575 -12.833 0.00 0.00 +0.000 HD +ATOM 1954 CA THR 295 -29.547 -19.564 -12.648 0.00 0.00 +0.000 C +ATOM 1955 HA THR 295 -28.737 -19.030 -12.387 0.00 0.00 +0.000 HD +ATOM 1956 CB THR 295 -30.079 -20.312 -11.406 0.00 0.00 +0.000 C +ATOM 1957 HB THR 295 -30.869 -20.891 -11.687 0.00 0.00 +0.000 HD +ATOM 1958 CG2 THR 295 -28.976 -21.162 -10.787 0.00 0.00 +0.000 C +ATOM 1959 HG21 THR 295 -28.350 -20.578 -10.266 0.00 0.00 +0.000 HD +ATOM 1960 HG22 THR 295 -29.378 -21.844 -10.172 0.00 0.00 +0.000 HD +ATOM 1961 HG23 THR 295 -28.464 -21.631 -11.509 0.00 0.00 +0.000 HD +ATOM 1962 OG1 THR 295 -30.539 -19.361 -10.441 0.00 0.00 +0.000 OA +ATOM 1963 HG1 THR 295 -31.401 -18.941 -10.746 0.00 0.00 +0.000 HD +ATOM 1964 C THR 295 -29.129 -20.588 -13.697 0.00 0.00 +0.000 C +ATOM 1965 O THR 295 -27.951 -20.909 -13.808 0.00 0.00 +0.000 OA +ATOM 1966 N ASP 296 -30.092 -21.093 -14.469 0.00 0.00 +0.000 N +ATOM 1967 H ASP 296 -31.041 -20.749 -14.276 0.00 0.00 +0.000 HD +ATOM 1968 CA ASP 296 -29.769 -22.070 -15.510 0.00 0.00 +0.000 C +ATOM 1969 HA ASP 296 -29.272 -22.822 -15.064 0.00 0.00 +0.000 HD +ATOM 1970 CB ASP 296 -31.028 -22.577 -16.218 0.00 0.00 +0.000 C +ATOM 1971 HB2 ASP 296 -31.595 -21.788 -16.432 0.00 0.00 +0.000 HD +ATOM 1972 HB3 ASP 296 -30.744 -23.035 -17.054 0.00 0.00 +0.000 HD +ATOM 1973 CG ASP 296 -31.823 -23.540 -15.375 0.00 0.00 +0.000 C +ATOM 1974 OD1 ASP 296 -31.238 -24.168 -14.466 0.00 0.00 +0.000 OA +ATOM 1975 OD2 ASP 296 -33.035 -23.683 -15.635 0.00 0.00 +0.000 OA +ATOM 1976 C ASP 296 -28.836 -21.464 -16.544 0.00 0.00 +0.000 C +ATOM 1977 O ASP 296 -27.879 -22.103 -16.968 0.00 0.00 +0.000 OA +ATOM 1978 N VAL 297 -29.112 -20.227 -16.948 0.00 0.00 +0.000 N +ATOM 1979 H VAL 297 -29.944 -19.797 -16.515 0.00 0.00 +0.000 HD +ATOM 1980 CA VAL 297 -28.271 -19.561 -17.936 0.00 0.00 +0.000 C +ATOM 1981 HA VAL 297 -28.191 -20.165 -18.739 0.00 0.00 +0.000 HD +ATOM 1982 CB VAL 297 -28.898 -18.220 -18.388 0.00 0.00 +0.000 C +ATOM 1983 HB VAL 297 -29.063 -17.675 -17.576 0.00 0.00 +0.000 HD +ATOM 1984 CG1 VAL 297 -27.904 -17.436 -19.256 0.00 0.00 +0.000 C +ATOM 1985 HG11 VAL 297 -28.385 -16.690 -19.711 0.00 0.00 +0.000 HD +ATOM 1986 HG12 VAL 297 -27.181 -17.068 -18.675 0.00 0.00 +0.000 HD +ATOM 1987 HG13 VAL 297 -27.510 -18.049 -19.937 0.00 0.00 +0.000 HD +ATOM 1988 CG2 VAL 297 -30.184 -18.490 -19.161 0.00 0.00 +0.000 C +ATOM 1989 HG21 VAL 297 -30.804 -19.028 -18.590 0.00 0.00 +0.000 HD +ATOM 1990 HG22 VAL 297 -30.614 -17.620 -19.399 0.00 0.00 +0.000 HD +ATOM 1991 HG23 VAL 297 -29.966 -18.998 -19.994 0.00 0.00 +0.000 HD +ATOM 1992 C VAL 297 -26.868 -19.315 -17.393 0.00 0.00 +0.000 C +ATOM 1993 O VAL 297 -25.877 -19.574 -18.071 0.00 0.00 +0.000 OA +ATOM 1994 N LEU 298 -26.787 -18.828 -16.159 0.00 0.00 +0.000 N +ATOM 1995 H LEU 298 -27.691 -18.665 -15.687 0.00 0.00 +0.000 HD +ATOM 1996 CA LEU 298 -25.487 -18.551 -15.537 0.00 0.00 +0.000 C +ATOM 1997 HA LEU 298 -24.962 -17.940 -16.154 0.00 0.00 +0.000 HD +ATOM 1998 CB LEU 298 -25.674 -17.814 -14.206 0.00 0.00 +0.000 C +ATOM 1999 HB2 LEU 298 -26.062 -16.920 -14.406 0.00 0.00 +0.000 HD +ATOM 2000 HB3 LEU 298 -26.299 -18.348 -13.649 0.00 0.00 +0.000 HD +ATOM 2001 CG LEU 298 -24.404 -17.591 -13.390 0.00 0.00 +0.000 C +ATOM 2002 HG LEU 298 -23.978 -18.472 -13.199 0.00 0.00 +0.000 HD +ATOM 2003 CD1 LEU 298 -23.426 -16.719 -14.175 0.00 0.00 +0.000 C +ATOM 2004 HD11 LEU 298 -23.852 -15.836 -14.370 0.00 0.00 +0.000 HD +ATOM 2005 HD12 LEU 298 -22.598 -16.579 -13.633 0.00 0.00 +0.000 HD +ATOM 2006 HD13 LEU 298 -23.191 -17.174 -15.033 0.00 0.00 +0.000 HD +ATOM 2007 CD2 LEU 298 -24.747 -16.911 -12.069 0.00 0.00 +0.000 C +ATOM 2008 HD21 LEU 298 -25.375 -17.490 -11.549 0.00 0.00 +0.000 HD +ATOM 2009 HD22 LEU 298 -23.910 -16.769 -11.540 0.00 0.00 +0.000 HD +ATOM 2010 HD23 LEU 298 -25.181 -16.028 -12.251 0.00 0.00 +0.000 HD +ATOM 2011 C LEU 298 -24.646 -19.810 -15.285 0.00 0.00 +0.000 C +ATOM 2012 O LEU 298 -23.514 -19.923 -15.764 0.00 0.00 +0.000 OA +ATOM 2013 N VAL 299 -25.210 -20.758 -14.545 0.00 0.00 +0.000 N +ATOM 2014 H VAL 299 -26.179 -20.563 -14.244 0.00 0.00 +0.000 HD +ATOM 2015 CA VAL 299 -24.480 -21.965 -14.208 0.00 0.00 +0.000 C +ATOM 2016 HA VAL 299 -23.540 -21.688 -13.894 0.00 0.00 +0.000 HD +ATOM 2017 CB VAL 299 -25.121 -22.663 -12.966 0.00 0.00 +0.000 C +ATOM 2018 HB VAL 299 -26.039 -22.940 -13.228 0.00 0.00 +0.000 HD +ATOM 2019 CG1 VAL 299 -24.354 -23.921 -12.597 0.00 0.00 +0.000 C +ATOM 2020 HG11 VAL 299 -24.502 -24.133 -11.630 0.00 0.00 +0.000 HD +ATOM 2021 HG12 VAL 299 -24.675 -24.686 -13.157 0.00 0.00 +0.000 HD +ATOM 2022 HG13 VAL 299 -23.377 -23.778 -12.759 0.00 0.00 +0.000 HD +ATOM 2023 CG2 VAL 299 -25.133 -21.702 -11.781 0.00 0.00 +0.000 C +ATOM 2024 HG21 VAL 299 -25.080 -20.763 -12.119 0.00 0.00 +0.000 HD +ATOM 2025 HG22 VAL 299 -25.979 -21.828 -11.265 0.00 0.00 +0.000 HD +ATOM 2026 HG23 VAL 299 -24.348 -21.895 -11.194 0.00 0.00 +0.000 HD +ATOM 2027 C VAL 299 -24.305 -22.980 -15.332 0.00 0.00 +0.000 C +ATOM 2028 O VAL 299 -23.236 -23.584 -15.445 0.00 0.00 +0.000 OA +ATOM 2029 N ARG 300 -25.322 -23.160 -16.172 0.00 0.00 +0.000 N +ATOM 2030 H ARG 300 -26.144 -22.561 -16.006 0.00 0.00 +0.000 HD +ATOM 2031 CA ARG 300 -25.236 -24.151 -17.242 0.00 0.00 +0.000 C +ATOM 2032 HA ARG 300 -24.816 -25.000 -16.861 0.00 0.00 +0.000 HD +ATOM 2033 CB ARG 300 -26.636 -24.560 -17.707 0.00 0.00 +0.000 C +ATOM 2034 HB2 ARG 300 -27.022 -23.808 -18.242 0.00 0.00 +0.000 HD +ATOM 2035 HB3 ARG 300 -26.551 -25.370 -18.287 0.00 0.00 +0.000 HD +ATOM 2036 CG ARG 300 -27.633 -24.894 -16.588 0.00 0.00 +0.000 C +ATOM 2037 HG2 ARG 300 -27.621 -24.150 -15.906 0.00 0.00 +0.000 HD +ATOM 2038 HG3 ARG 300 -28.562 -24.940 -16.981 0.00 0.00 +0.000 HD +ATOM 2039 CD ARG 300 -27.369 -26.208 -15.855 0.00 0.00 +0.000 C +ATOM 2040 HD2 ARG 300 -27.318 -26.931 -16.523 0.00 0.00 +0.000 HD +ATOM 2041 HD3 ARG 300 -26.528 -26.116 -15.348 0.00 0.00 +0.000 HD +ATOM 2042 NE ARG 300 -28.473 -26.492 -14.916 0.00 0.00 +0.000 N +ATOM 2043 HE ARG 300 -29.244 -25.837 -14.901 0.00 0.00 +0.000 HD +ATOM 2044 CZ ARG 300 -28.533 -27.537 -14.093 0.00 0.00 +0.000 C +ATOM 2045 NH1 ARG 300 -27.546 -28.413 -14.078 0.00 0.00 +0.000 N +ATOM 2046 HH11 ARG 300 -26.740 -28.308 -14.653 0.00 0.00 +0.000 HD +ATOM 2047 HH12 ARG 300 -27.604 -29.218 -13.465 0.00 0.00 +0.000 HD +ATOM 2048 NH2 ARG 300 -29.593 -27.723 -13.305 0.00 0.00 +0.000 N +ATOM 2049 HH21 ARG 300 -30.337 -27.049 -13.330 0.00 0.00 +0.000 HD +ATOM 2050 HH22 ARG 300 -29.643 -28.511 -12.706 0.00 0.00 +0.000 HD +ATOM 2051 C ARG 300 -24.416 -23.705 -18.443 0.00 0.00 +0.000 C +ATOM 2052 O ARG 300 -23.952 -24.554 -19.191 0.00 0.00 +0.000 OA +ATOM 2053 N THR 301 -24.238 -22.398 -18.647 0.00 0.00 +0.000 N +ATOM 2054 H THR 301 -24.694 -21.774 -17.981 0.00 0.00 +0.000 HD +ATOM 2055 CA THR 301 -23.423 -21.951 -19.781 0.00 0.00 +0.000 C +ATOM 2056 HA THR 301 -23.268 -22.748 -20.395 0.00 0.00 +0.000 HD +ATOM 2057 CB THR 301 -24.154 -20.889 -20.679 0.00 0.00 +0.000 C +ATOM 2058 HB THR 301 -23.608 -20.770 -21.533 0.00 0.00 +0.000 HD +ATOM 2059 CG2 THR 301 -25.556 -21.360 -21.005 0.00 0.00 +0.000 C +ATOM 2060 HG21 THR 301 -25.521 -22.100 -21.682 0.00 0.00 +0.000 HD +ATOM 2061 HG22 THR 301 -26.006 -21.699 -20.175 0.00 0.00 +0.000 HD +ATOM 2062 HG23 THR 301 -26.095 -20.601 -21.380 0.00 0.00 +0.000 HD +ATOM 2063 OG1 THR 301 -24.228 -19.629 -20.004 0.00 0.00 +0.000 OA +ATOM 2064 HG1 THR 301 -24.915 -19.664 -19.270 0.00 0.00 +0.000 HD +ATOM 2065 C THR 301 -22.053 -21.387 -19.382 0.00 0.00 +0.000 C +ATOM 2066 O THR 301 -21.204 -21.174 -20.242 0.00 0.00 +0.000 OA +ATOM 2067 N LYS 302 -21.823 -21.154 -18.093 0.00 0.00 +0.000 N +ATOM 2068 H LYS 302 -22.586 -21.387 -17.452 0.00 0.00 +0.000 HD +ATOM 2069 CA LYS 302 -20.535 -20.595 -17.674 0.00 0.00 +0.000 C +ATOM 2070 HA LYS 302 -19.895 -20.627 -18.471 0.00 0.00 +0.000 HD +ATOM 2071 CB LYS 302 -20.686 -19.101 -17.320 0.00 0.00 +0.000 C +ATOM 2072 HB2 LYS 302 -21.279 -19.036 -16.517 0.00 0.00 +0.000 HD +ATOM 2073 HB3 LYS 302 -19.778 -18.749 -17.091 0.00 0.00 +0.000 HD +ATOM 2074 CG LYS 302 -21.274 -18.240 -18.425 0.00 0.00 +0.000 C +ATOM 2075 HG2 LYS 302 -22.184 -18.595 -18.668 0.00 0.00 +0.000 HD +ATOM 2076 HG3 LYS 302 -21.379 -17.298 -18.087 0.00 0.00 +0.000 HD +ATOM 2077 CD LYS 302 -20.412 -18.213 -19.681 0.00 0.00 +0.000 C +ATOM 2078 HD2 LYS 302 -19.526 -17.824 -19.459 0.00 0.00 +0.000 HD +ATOM 2079 HD3 LYS 302 -20.313 -19.137 -20.028 0.00 0.00 +0.000 HD +ATOM 2080 CE LYS 302 -21.052 -17.352 -20.782 0.00 0.00 +0.000 C +ATOM 2081 HE2 LYS 302 -21.978 -17.698 -20.960 0.00 0.00 +0.000 HD +ATOM 2082 HE3 LYS 302 -21.119 -16.406 -20.450 0.00 0.00 +0.000 HD +ATOM 2083 NZ LYS 302 -20.267 -17.370 -22.056 0.00 0.00 +0.000 N +ATOM 2084 HZ1 LYS 302 -19.328 -17.089 -21.866 0.00 0.00 +0.000 HD +ATOM 2085 HZ2 LYS 302 -20.274 -18.295 -22.432 0.00 0.00 +0.000 HD +ATOM 2086 HZ3 LYS 302 -20.684 -16.738 -22.707 0.00 0.00 +0.000 HD +ATOM 2087 C LYS 302 -19.875 -21.312 -16.498 0.00 0.00 +0.000 C +ATOM 2088 O LYS 302 -19.105 -20.698 -15.763 0.00 0.00 +0.000 OA +ATOM 2089 N ARG 303 -20.147 -22.604 -16.328 0.00 0.00 +0.000 N +ATOM 2090 H ARG 303 -20.771 -23.023 -17.027 0.00 0.00 +0.000 HD +ATOM 2091 CA ARG 303 -19.568 -23.337 -15.200 0.00 0.00 +0.000 C +ATOM 2092 HA ARG 303 -19.917 -22.926 -14.337 0.00 0.00 +0.000 HD +ATOM 2093 CB ARG 303 -20.039 -24.794 -15.180 0.00 0.00 +0.000 C +ATOM 2094 HB2 ARG 303 -21.023 -24.809 -15.259 0.00 0.00 +0.000 HD +ATOM 2095 HB3 ARG 303 -19.609 -25.276 -15.927 0.00 0.00 +0.000 HD +ATOM 2096 CG ARG 303 -19.662 -25.522 -13.875 0.00 0.00 +0.000 C +ATOM 2097 HG2 ARG 303 -18.674 -25.478 -13.754 0.00 0.00 +0.000 HD +ATOM 2098 HG3 ARG 303 -20.121 -25.075 -13.112 0.00 0.00 +0.000 HD +ATOM 2099 CD ARG 303 -20.081 -26.981 -13.901 0.00 0.00 +0.000 C +ATOM 2100 HD2 ARG 303 -19.638 -27.418 -14.690 0.00 0.00 +0.000 HD +ATOM 2101 HD3 ARG 303 -19.741 -27.417 -13.060 0.00 0.00 +0.000 HD +ATOM 2102 NE ARG 303 -21.528 -27.189 -13.993 0.00 0.00 +0.000 N +ATOM 2103 HE ARG 303 -21.924 -27.307 -14.916 0.00 0.00 +0.000 HD +ATOM 2104 CZ ARG 303 -22.358 -27.234 -12.956 0.00 0.00 +0.000 C +ATOM 2105 NH1 ARG 303 -21.903 -27.077 -11.718 0.00 0.00 +0.000 N +ATOM 2106 HH11 ARG 303 -20.936 -26.903 -11.548 0.00 0.00 +0.000 HD +ATOM 2107 HH12 ARG 303 -22.540 -27.133 -10.943 0.00 0.00 +0.000 HD +ATOM 2108 NH2 ARG 303 -23.646 -27.480 -13.158 0.00 0.00 +0.000 N +ATOM 2109 HH21 ARG 303 -23.990 -27.611 -14.090 0.00 0.00 +0.000 HD +ATOM 2110 HH22 ARG 303 -24.275 -27.534 -12.383 0.00 0.00 +0.000 HD +ATOM 2111 C ARG 303 -18.046 -23.309 -15.169 0.00 0.00 +0.000 C +ATOM 2112 O ARG 303 -17.450 -23.016 -14.134 0.00 0.00 +0.000 OA +ATOM 2113 N ASP 304 -17.408 -23.618 -16.294 0.00 0.00 +0.000 N +ATOM 2114 H ASP 304 -18.010 -23.844 -17.098 0.00 0.00 +0.000 HD +ATOM 2115 CA ASP 304 -15.945 -23.624 -16.343 0.00 0.00 +0.000 C +ATOM 2116 HA ASP 304 -15.632 -24.350 -15.719 0.00 0.00 +0.000 HD +ATOM 2117 CB ASP 304 -15.438 -23.869 -17.767 0.00 0.00 +0.000 C +ATOM 2118 HB2 ASP 304 -15.813 -23.158 -18.351 0.00 0.00 +0.000 HD +ATOM 2119 HB3 ASP 304 -14.446 -23.818 -17.752 0.00 0.00 +0.000 HD +ATOM 2120 CG ASP 304 -15.852 -25.219 -18.310 0.00 0.00 +0.000 C +ATOM 2121 OD1 ASP 304 -15.508 -26.250 -17.690 0.00 0.00 +0.000 OA +ATOM 2122 OD2 ASP 304 -16.522 -25.239 -19.364 0.00 0.00 +0.000 OA +ATOM 2123 C ASP 304 -15.375 -22.313 -15.830 0.00 0.00 +0.000 C +ATOM 2124 O ASP 304 -14.464 -22.313 -15.010 0.00 0.00 +0.000 OA +ATOM 2125 N TRP 305 -15.908 -21.198 -16.320 0.00 0.00 +0.000 N +ATOM 2126 H TRP 305 -16.665 -21.343 -17.015 0.00 0.00 +0.000 HD +ATOM 2127 CA TRP 305 -15.447 -19.875 -15.898 0.00 0.00 +0.000 C +ATOM 2128 HA TRP 305 -14.455 -19.833 -16.050 0.00 0.00 +0.000 HD +ATOM 2129 CB TRP 305 -16.178 -18.769 -16.674 0.00 0.00 +0.000 C +ATOM 2130 HB2 TRP 305 -16.129 -18.965 -17.644 0.00 0.00 +0.000 HD +ATOM 2131 HB3 TRP 305 -17.119 -18.723 -16.367 0.00 0.00 +0.000 HD +ATOM 2132 CG TRP 305 -15.583 -17.381 -16.476 0.00 0.00 +0.000 A +ATOM 2133 CD1 TRP 305 -14.605 -16.794 -17.230 0.00 0.00 +0.000 A +ATOM 2134 HD1 TRP 305 -14.170 -17.210 -18.028 0.00 0.00 +0.000 HD +ATOM 2135 NE1 TRP 305 -14.305 -15.549 -16.734 0.00 0.00 +0.000 N +ATOM 2136 HE1 TRP 305 -13.624 -14.921 -17.112 0.00 0.00 +0.000 HD +ATOM 2137 CE2 TRP 305 -15.087 -15.304 -15.639 0.00 0.00 +0.000 A +ATOM 2138 CZ2 TRP 305 -15.143 -14.180 -14.801 0.00 0.00 +0.000 A +ATOM 2139 HZ2 TRP 305 -14.543 -13.394 -14.973 0.00 0.00 +0.000 HD +ATOM 2140 CH2 TRP 305 -16.036 -14.206 -13.758 0.00 0.00 +0.000 A +ATOM 2141 HH2 TRP 305 -16.103 -13.426 -13.138 0.00 0.00 +0.000 HD +ATOM 2142 CZ3 TRP 305 -16.871 -15.317 -13.538 0.00 0.00 +0.000 A +ATOM 2143 HZ3 TRP 305 -17.511 -15.313 -12.780 0.00 0.00 +0.000 HD +ATOM 2144 CE3 TRP 305 -16.817 -16.438 -14.373 0.00 0.00 +0.000 A +ATOM 2145 HE3 TRP 305 -17.412 -17.214 -14.203 0.00 0.00 +0.000 HD +ATOM 2146 CD2 TRP 305 -15.912 -16.433 -15.442 0.00 0.00 +0.000 A +ATOM 2147 C TRP 305 -15.692 -19.669 -14.402 0.00 0.00 +0.000 C +ATOM 2148 O TRP 305 -14.809 -19.222 -13.675 0.00 0.00 +0.000 OA +ATOM 2149 N LEU 306 -16.897 -19.995 -13.943 0.00 0.00 +0.000 N +ATOM 2150 H LEU 306 -17.551 -20.370 -14.647 0.00 0.00 +0.000 HD +ATOM 2151 CA LEU 306 -17.230 -19.819 -12.533 0.00 0.00 +0.000 C +ATOM 2152 HA LEU 306 -17.155 -18.836 -12.307 0.00 0.00 +0.000 HD +ATOM 2153 CB LEU 306 -18.679 -20.241 -12.273 0.00 0.00 +0.000 C +ATOM 2154 HB2 LEU 306 -18.811 -21.132 -12.666 0.00 0.00 +0.000 HD +ATOM 2155 HB3 LEU 306 -18.829 -20.232 -11.303 0.00 0.00 +0.000 HD +ATOM 2156 CG LEU 306 -19.695 -19.297 -12.911 0.00 0.00 +0.000 C +ATOM 2157 HG LEU 306 -19.384 -19.058 -13.830 0.00 0.00 +0.000 HD +ATOM 2158 CD1 LEU 306 -21.053 -19.967 -12.993 0.00 0.00 +0.000 C +ATOM 2159 HD11 LEU 306 -21.366 -20.209 -12.073 0.00 0.00 +0.000 HD +ATOM 2160 HD12 LEU 306 -21.713 -19.341 -13.412 0.00 0.00 +0.000 HD +ATOM 2161 HD13 LEU 306 -20.986 -20.797 -13.548 0.00 0.00 +0.000 HD +ATOM 2162 CD2 LEU 306 -19.769 -18.011 -12.098 0.00 0.00 +0.000 C +ATOM 2163 HD21 LEU 306 -18.869 -17.573 -12.083 0.00 0.00 +0.000 HD +ATOM 2164 HD22 LEU 306 -20.434 -17.391 -12.514 0.00 0.00 +0.000 HD +ATOM 2165 HD23 LEU 306 -20.052 -18.223 -11.162 0.00 0.00 +0.000 HD +ATOM 2166 C LEU 306 -16.291 -20.594 -11.618 0.00 0.00 +0.000 C +ATOM 2167 O LEU 306 -15.801 -20.061 -10.624 0.00 0.00 +0.000 OA +ATOM 2168 N VAL 307 -16.037 -21.850 -11.955 0.00 0.00 +0.000 N +ATOM 2169 H VAL 307 -16.500 -22.182 -12.814 0.00 0.00 +0.000 HD +ATOM 2170 CA VAL 307 -15.155 -22.673 -11.136 0.00 0.00 +0.000 C +ATOM 2171 HA VAL 307 -15.501 -22.661 -10.192 0.00 0.00 +0.000 HD +ATOM 2172 CB VAL 307 -15.143 -24.141 -11.644 0.00 0.00 +0.000 C +ATOM 2173 HB VAL 307 -14.859 -24.122 -12.597 0.00 0.00 +0.000 HD +ATOM 2174 CG1 VAL 307 -14.119 -24.965 -10.883 0.00 0.00 +0.000 C +ATOM 2175 HG11 VAL 307 -14.459 -25.899 -10.766 0.00 0.00 +0.000 HD +ATOM 2176 HG12 VAL 307 -13.259 -24.987 -11.394 0.00 0.00 +0.000 HD +ATOM 2177 HG13 VAL 307 -13.960 -24.556 -9.984 0.00 0.00 +0.000 HD +ATOM 2178 CG2 VAL 307 -16.537 -24.742 -11.481 0.00 0.00 +0.000 C +ATOM 2179 HG21 VAL 307 -16.594 -25.201 -10.595 0.00 0.00 +0.000 HD +ATOM 2180 HG22 VAL 307 -17.216 -24.011 -11.528 0.00 0.00 +0.000 HD +ATOM 2181 HG23 VAL 307 -16.697 -25.401 -12.215 0.00 0.00 +0.000 HD +ATOM 2182 C VAL 307 -13.741 -22.099 -11.125 0.00 0.00 +0.000 C +ATOM 2183 O VAL 307 -13.110 -21.996 -10.069 0.00 0.00 +0.000 OA +ATOM 2184 N LYS 308 -13.249 -21.704 -12.293 0.00 0.00 +0.000 N +ATOM 2185 H LYS 308 -13.872 -21.830 -13.103 0.00 0.00 +0.000 HD +ATOM 2186 CA LYS 308 -11.906 -21.133 -12.378 0.00 0.00 +0.000 C +ATOM 2187 HA LYS 308 -11.246 -21.792 -12.001 0.00 0.00 +0.000 HD +ATOM 2188 CB LYS 308 -11.521 -20.884 -13.844 0.00 0.00 +0.000 C +ATOM 2189 HB2 LYS 308 -11.676 -21.725 -14.353 0.00 0.00 +0.000 HD +ATOM 2190 HB3 LYS 308 -12.102 -20.157 -14.198 0.00 0.00 +0.000 HD +ATOM 2191 CG LYS 308 -10.063 -20.470 -14.035 0.00 0.00 +0.000 C +ATOM 2192 HG2 LYS 308 -9.967 -19.500 -13.791 0.00 0.00 +0.000 HD +ATOM 2193 HG3 LYS 308 -9.487 -21.017 -13.421 0.00 0.00 +0.000 HD +ATOM 2194 CD LYS 308 -9.578 -20.665 -15.467 0.00 0.00 +0.000 C +ATOM 2195 HD2 LYS 308 -9.666 -21.617 -15.710 0.00 0.00 +0.000 HD +ATOM 2196 HD3 LYS 308 -10.102 -20.084 -16.067 0.00 0.00 +0.000 HD +ATOM 2197 CE LYS 308 -8.105 -20.270 -15.570 0.00 0.00 +0.000 C +ATOM 2198 HE2 LYS 308 -7.729 -20.632 -16.413 0.00 0.00 +0.000 HD +ATOM 2199 HE3 LYS 308 -8.031 -19.281 -15.549 0.00 0.00 +0.000 HD +ATOM 2200 NZ LYS 308 -7.345 -20.845 -14.406 0.00 0.00 +0.000 N +ATOM 2201 HZ1 LYS 308 -6.403 -21.012 -14.685 0.00 0.00 +0.000 HD +ATOM 2202 HZ2 LYS 308 -7.367 -20.193 -13.652 0.00 0.00 +0.000 HD +ATOM 2203 HZ3 LYS 308 -7.775 -21.701 -14.130 0.00 0.00 +0.000 HD +ATOM 2204 C LYS 308 -11.812 -19.834 -11.569 0.00 0.00 +0.000 C +ATOM 2205 O LYS 308 -10.761 -19.522 -11.011 0.00 0.00 +0.000 OA +ATOM 2206 N GLN 309 -12.916 -19.093 -11.480 0.00 0.00 +0.000 N +ATOM 2207 H GLN 309 -13.738 -19.468 -11.979 0.00 0.00 +0.000 HD +ATOM 2208 CA GLN 309 -12.922 -17.846 -10.722 0.00 0.00 +0.000 C +ATOM 2209 HA GLN 309 -11.984 -17.463 -10.743 0.00 0.00 +0.000 HD +ATOM 2210 CB GLN 309 -13.872 -16.832 -11.364 0.00 0.00 +0.000 C +ATOM 2211 HB2 GLN 309 -14.777 -17.254 -11.456 0.00 0.00 +0.000 HD +ATOM 2212 HB3 GLN 309 -13.944 -16.033 -10.761 0.00 0.00 +0.000 HD +ATOM 2213 CG GLN 309 -13.433 -16.350 -12.736 0.00 0.00 +0.000 C +ATOM 2214 HG2 GLN 309 -13.461 -17.122 -13.371 0.00 0.00 +0.000 HD +ATOM 2215 HG3 GLN 309 -14.067 -15.641 -13.045 0.00 0.00 +0.000 HD +ATOM 2216 CD GLN 309 -12.032 -15.779 -12.731 0.00 0.00 +0.000 C +ATOM 2217 OE1 GLN 309 -11.704 -14.917 -11.908 0.00 0.00 +0.000 OA +ATOM 2218 NE2 GLN 309 -11.196 -16.252 -13.647 0.00 0.00 +0.000 N +ATOM 2219 HE21 GLN 309 -10.241 -15.906 -13.714 0.00 0.00 +0.000 HD +ATOM 2220 HE22 GLN 309 -11.525 -16.973 -14.288 0.00 0.00 +0.000 HD +ATOM 2221 C GLN 309 -13.304 -18.048 -9.253 0.00 0.00 +0.000 C +ATOM 2222 O GLN 309 -13.660 -17.099 -8.564 0.00 0.00 +0.000 OA +ATOM 2223 N ARG 310 -13.260 -19.298 -8.798 0.00 0.00 +0.000 N +ATOM 2224 H ARG 310 -12.992 -20.009 -9.518 0.00 0.00 +0.000 HD +ATOM 2225 CA ARG 310 -13.561 -19.655 -7.407 0.00 0.00 +0.000 C +ATOM 2226 HA ARG 310 -13.294 -20.640 -7.265 0.00 0.00 +0.000 HD +ATOM 2227 CB ARG 310 -12.605 -18.913 -6.455 0.00 0.00 +0.000 C +ATOM 2228 HB2 ARG 310 -12.560 -17.965 -6.736 0.00 0.00 +0.000 HD +ATOM 2229 HB3 ARG 310 -12.956 -18.996 -5.534 0.00 0.00 +0.000 HD +ATOM 2230 CG ARG 310 -11.176 -19.478 -6.468 0.00 0.00 +0.000 C +ATOM 2231 HG2 ARG 310 -11.160 -20.344 -5.969 0.00 0.00 +0.000 HD +ATOM 2232 HG3 ARG 310 -10.892 -19.632 -7.414 0.00 0.00 +0.000 HD +ATOM 2233 CD ARG 310 -10.153 -18.538 -5.816 0.00 0.00 +0.000 C +ATOM 2234 HD2 ARG 310 -9.293 -19.041 -5.725 0.00 0.00 +0.000 HD +ATOM 2235 HD3 ARG 310 -10.021 -17.760 -6.432 0.00 0.00 +0.000 HD +ATOM 2236 NE ARG 310 -10.570 -18.050 -4.501 0.00 0.00 +0.000 N +ATOM 2237 HE ARG 310 -10.736 -17.054 -4.406 0.00 0.00 +0.000 HD +ATOM 2238 CZ ARG 310 -10.749 -18.806 -3.424 0.00 0.00 +0.000 C +ATOM 2239 NH1 ARG 310 -10.551 -20.116 -3.478 0.00 0.00 +0.000 N +ATOM 2240 HH11 ARG 310 -10.245 -20.553 -4.321 0.00 0.00 +0.000 HD +ATOM 2241 HH12 ARG 310 -10.709 -20.678 -2.659 0.00 0.00 +0.000 HD +ATOM 2242 NH2 ARG 310 -11.135 -18.238 -2.288 0.00 0.00 +0.000 N +ATOM 2243 HH21 ARG 310 -11.270 -17.247 -2.242 0.00 0.00 +0.000 HD +ATOM 2244 HH22 ARG 310 -11.291 -18.800 -1.475 0.00 0.00 +0.000 HD +ATOM 2245 C ARG 310 -15.009 -19.484 -6.950 0.00 0.00 +0.000 C +ATOM 2246 O ARG 310 -15.268 -19.281 -5.769 0.00 0.00 +0.000 OA +ATOM 2247 N GLY 311 -15.940 -19.577 -7.895 0.00 0.00 +0.000 N +ATOM 2248 H GLY 311 -15.578 -19.721 -8.854 0.00 0.00 +0.000 HD +ATOM 2249 CA GLY 311 -17.353 -19.479 -7.568 0.00 0.00 +0.000 C +ATOM 2250 HA2 GLY 311 -17.898 -19.492 -8.441 0.00 0.00 +0.000 HD +ATOM 2251 HA3 GLY 311 -17.638 -20.331 -7.066 0.00 0.00 +0.000 HD +ATOM 2252 C GLY 311 -17.759 -18.269 -6.753 0.00 0.00 +0.000 C +ATOM 2253 O GLY 311 -17.192 -17.194 -6.911 0.00 0.00 +0.000 OA +ATOM 2254 N TRP 312 -18.734 -18.445 -5.866 0.00 0.00 +0.000 N +ATOM 2255 H TRP 312 -19.110 -19.405 -5.810 0.00 0.00 +0.000 HD +ATOM 2256 CA TRP 312 -19.204 -17.337 -5.056 0.00 0.00 +0.000 C +ATOM 2257 HA TRP 312 -19.419 -16.563 -5.681 0.00 0.00 +0.000 HD +ATOM 2258 CB TRP 312 -20.528 -17.714 -4.385 0.00 0.00 +0.000 C +ATOM 2259 HB2 TRP 312 -20.415 -18.561 -3.904 0.00 0.00 +0.000 HD +ATOM 2260 HB3 TRP 312 -20.812 -16.981 -3.798 0.00 0.00 +0.000 HD +ATOM 2261 CG TRP 312 -21.611 -17.918 -5.408 0.00 0.00 +0.000 A +ATOM 2262 CD1 TRP 312 -22.114 -19.110 -5.855 0.00 0.00 +0.000 A +ATOM 2263 HD1 TRP 312 -21.844 -20.009 -5.517 0.00 0.00 +0.000 HD +ATOM 2264 NE1 TRP 312 -23.050 -18.891 -6.843 0.00 0.00 +0.000 N +ATOM 2265 HE1 TRP 312 -23.559 -19.598 -7.327 0.00 0.00 +0.000 HD +ATOM 2266 CE2 TRP 312 -23.165 -17.541 -7.050 0.00 0.00 +0.000 A +ATOM 2267 CZ2 TRP 312 -23.979 -16.829 -7.943 0.00 0.00 +0.000 A +ATOM 2268 HZ2 TRP 312 -24.602 -17.321 -8.557 0.00 0.00 +0.000 HD +ATOM 2269 CH2 TRP 312 -23.884 -15.462 -7.937 0.00 0.00 +0.000 A +ATOM 2270 HH2 TRP 312 -24.446 -14.917 -8.558 0.00 0.00 +0.000 HD +ATOM 2271 CZ3 TRP 312 -23.001 -14.790 -7.064 0.00 0.00 +0.000 A +ATOM 2272 HZ3 TRP 312 -22.953 -13.799 -7.082 0.00 0.00 +0.000 HD +ATOM 2273 CE3 TRP 312 -22.194 -15.496 -6.178 0.00 0.00 +0.000 A +ATOM 2274 HE3 TRP 312 -21.575 -15.010 -5.568 0.00 0.00 +0.000 HD +ATOM 2275 CD2 TRP 312 -22.273 -16.895 -6.162 0.00 0.00 +0.000 A +ATOM 2276 C TRP 312 -18.173 -16.830 -4.049 0.00 0.00 +0.000 C +ATOM 2277 O TRP 312 -18.248 -15.684 -3.600 0.00 0.00 +0.000 OA +ATOM 2278 N ASP 313 -17.200 -17.662 -3.693 0.00 0.00 +0.000 N +ATOM 2279 H ASP 313 -17.237 -18.598 -4.090 0.00 0.00 +0.000 HD +ATOM 2280 CA ASP 313 -16.167 -17.185 -2.776 0.00 0.00 +0.000 C +ATOM 2281 HA ASP 313 -16.623 -16.709 -2.041 0.00 0.00 +0.000 HD +ATOM 2282 CB ASP 313 -15.235 -18.307 -2.338 0.00 0.00 +0.000 C +ATOM 2283 HB2 ASP 313 -14.914 -18.779 -3.151 0.00 0.00 +0.000 HD +ATOM 2284 HB3 ASP 313 -14.473 -17.903 -1.846 0.00 0.00 +0.000 HD +ATOM 2285 CG ASP 313 -15.921 -19.311 -1.433 0.00 0.00 +0.000 C +ATOM 2286 OD1 ASP 313 -16.655 -18.880 -0.517 0.00 0.00 +0.000 OA +ATOM 2287 OD2 ASP 313 -15.721 -20.525 -1.634 0.00 0.00 +0.000 OA +ATOM 2288 C ASP 313 -15.376 -16.151 -3.561 0.00 0.00 +0.000 C +ATOM 2289 O ASP 313 -14.967 -15.123 -3.014 0.00 0.00 +0.000 OA +ATOM 2290 N GLY 314 -15.181 -16.427 -4.850 0.00 0.00 +0.000 N +ATOM 2291 H GLY 314 -15.578 -17.322 -5.173 0.00 0.00 +0.000 HD +ATOM 2292 CA GLY 314 -14.453 -15.501 -5.703 0.00 0.00 +0.000 C +ATOM 2293 HA2 GLY 314 -13.563 -15.285 -5.285 0.00 0.00 +0.000 HD +ATOM 2294 HA3 GLY 314 -14.285 -15.929 -6.599 0.00 0.00 +0.000 HD +ATOM 2295 C GLY 314 -15.239 -14.212 -5.902 0.00 0.00 +0.000 C +ATOM 2296 O GLY 314 -14.670 -13.125 -5.933 0.00 0.00 +0.000 OA +ATOM 2297 N PHE 315 -16.550 -14.349 -6.055 0.00 0.00 +0.000 N +ATOM 2298 H PHE 315 -16.884 -15.342 -6.033 0.00 0.00 +0.000 HD +ATOM 2299 CA PHE 315 -17.450 -13.216 -6.238 0.00 0.00 +0.000 C +ATOM 2300 HA PHE 315 -17.134 -12.716 -7.046 0.00 0.00 +0.000 HD +ATOM 2301 CB PHE 315 -18.892 -13.727 -6.340 0.00 0.00 +0.000 C +ATOM 2302 HB2 PHE 315 -18.956 -14.288 -7.155 0.00 0.00 +0.000 HD +ATOM 2303 HB3 PHE 315 -19.080 -14.264 -5.527 0.00 0.00 +0.000 HD +ATOM 2304 CG PHE 315 -19.936 -12.648 -6.435 0.00 0.00 +0.000 A +ATOM 2305 CD1 PHE 315 -20.142 -11.951 -7.624 0.00 0.00 +0.000 A +ATOM 2306 HD1 PHE 315 -19.563 -12.131 -8.412 0.00 0.00 +0.000 HD +ATOM 2307 CE1 PHE 315 -21.157 -10.998 -7.728 0.00 0.00 +0.000 A +ATOM 2308 HE1 PHE 315 -21.297 -10.515 -8.595 0.00 0.00 +0.000 HD +ATOM 2309 CZ PHE 315 -21.963 -10.728 -6.626 0.00 0.00 +0.000 A +ATOM 2310 HZ PHE 315 -22.686 -10.044 -6.694 0.00 0.00 +0.000 HD +ATOM 2311 CE2 PHE 315 -21.756 -11.415 -5.433 0.00 0.00 +0.000 A +ATOM 2312 HE2 PHE 315 -22.341 -11.225 -4.628 0.00 0.00 +0.000 HD +ATOM 2313 CD2 PHE 315 -20.746 -12.361 -5.342 0.00 0.00 +0.000 A +ATOM 2314 HD2 PHE 315 -20.598 -12.845 -4.478 0.00 0.00 +0.000 HD +ATOM 2315 C PHE 315 -17.323 -12.260 -5.052 0.00 0.00 +0.000 C +ATOM 2316 O PHE 315 -17.168 -11.053 -5.223 0.00 0.00 +0.000 OA +ATOM 2317 N VAL 316 -17.398 -12.819 -3.850 0.00 0.00 +0.000 N +ATOM 2318 H VAL 316 -17.527 -13.853 -3.859 0.00 0.00 +0.000 HD +ATOM 2319 CA VAL 316 -17.305 -12.036 -2.627 0.00 0.00 +0.000 C +ATOM 2320 HA VAL 316 -18.019 -11.319 -2.655 0.00 0.00 +0.000 HD +ATOM 2321 CB VAL 316 -17.572 -12.943 -1.391 0.00 0.00 +0.000 C +ATOM 2322 HB VAL 316 -16.970 -13.732 -1.470 0.00 0.00 +0.000 HD +ATOM 2323 CG1 VAL 316 -17.214 -12.225 -0.108 0.00 0.00 +0.000 C +ATOM 2324 HG11 VAL 316 -16.431 -12.675 0.324 0.00 0.00 +0.000 HD +ATOM 2325 HG12 VAL 316 -16.978 -11.273 -0.308 0.00 0.00 +0.000 HD +ATOM 2326 HG13 VAL 316 -17.993 -12.246 0.520 0.00 0.00 +0.000 HD +ATOM 2327 CG2 VAL 316 -19.034 -13.352 -1.366 0.00 0.00 +0.000 C +ATOM 2328 HG21 VAL 316 -19.224 -13.853 -0.521 0.00 0.00 +0.000 HD +ATOM 2329 HG22 VAL 316 -19.608 -12.534 -1.407 0.00 0.00 +0.000 HD +ATOM 2330 HG23 VAL 316 -19.228 -13.938 -2.153 0.00 0.00 +0.000 HD +ATOM 2331 C VAL 316 -15.951 -11.338 -2.486 0.00 0.00 +0.000 C +ATOM 2332 O VAL 316 -15.879 -10.180 -2.059 0.00 0.00 +0.000 OA +ATOM 2333 N GLU 317 -14.883 -12.042 -2.854 0.00 0.00 +0.000 N +ATOM 2334 H GLU 317 -15.092 -13.000 -3.199 0.00 0.00 +0.000 HD +ATOM 2335 CA GLU 317 -13.536 -11.493 -2.772 0.00 0.00 +0.000 C +ATOM 2336 HA GLU 317 -13.370 -11.138 -1.844 0.00 0.00 +0.000 HD +ATOM 2337 CB GLU 317 -12.481 -12.571 -3.051 0.00 0.00 +0.000 C +ATOM 2338 HB2 GLU 317 -12.613 -12.880 -3.983 0.00 0.00 +0.000 HD +ATOM 2339 HB3 GLU 317 -11.592 -12.152 -2.938 0.00 0.00 +0.000 HD +ATOM 2340 CG GLU 317 -12.538 -13.785 -2.149 0.00 0.00 +0.000 C +ATOM 2341 HG2 GLU 317 -12.380 -13.497 -1.226 0.00 0.00 +0.000 HD +ATOM 2342 HG3 GLU 317 -13.405 -14.225 -2.268 0.00 0.00 +0.000 HD +ATOM 2343 CD GLU 317 -11.460 -14.806 -2.497 0.00 0.00 +0.000 C +ATOM 2344 OE1 GLU 317 -11.286 -15.099 -3.704 0.00 0.00 +0.000 OA +ATOM 2345 OE2 GLU 317 -10.791 -15.314 -1.570 0.00 0.00 +0.000 OA +ATOM 2346 C GLU 317 -13.347 -10.373 -3.785 0.00 0.00 +0.000 C +ATOM 2347 O GLU 317 -12.708 -9.370 -3.488 0.00 0.00 +0.000 OA +ATOM 2348 N PHE 318 -13.903 -10.554 -4.982 0.00 0.00 +0.000 N +ATOM 2349 H PHE 318 -14.429 -11.445 -5.085 0.00 0.00 +0.000 HD +ATOM 2350 CA PHE 318 -13.772 -9.570 -6.046 0.00 0.00 +0.000 C +ATOM 2351 HA PHE 318 -12.782 -9.417 -6.185 0.00 0.00 +0.000 HD +ATOM 2352 CB PHE 318 -14.452 -10.090 -7.317 0.00 0.00 +0.000 C +ATOM 2353 HB2 PHE 318 -14.103 -10.997 -7.496 0.00 0.00 +0.000 HD +ATOM 2354 HB3 PHE 318 -15.427 -10.104 -7.153 0.00 0.00 +0.000 HD +ATOM 2355 CG PHE 318 -14.196 -9.244 -8.532 0.00 0.00 +0.000 A +ATOM 2356 CD1 PHE 318 -12.948 -9.247 -9.151 0.00 0.00 +0.000 A +ATOM 2357 HD1 PHE 318 -12.214 -9.809 -8.785 0.00 0.00 +0.000 HD +ATOM 2358 CE1 PHE 318 -12.711 -8.470 -10.285 0.00 0.00 +0.000 A +ATOM 2359 HE1 PHE 318 -11.806 -8.485 -10.717 0.00 0.00 +0.000 HD +ATOM 2360 CZ PHE 318 -13.733 -7.679 -10.806 0.00 0.00 +0.000 A +ATOM 2361 HZ PHE 318 -13.569 -7.123 -11.616 0.00 0.00 +0.000 HD +ATOM 2362 CE2 PHE 318 -14.986 -7.671 -10.188 0.00 0.00 +0.000 A +ATOM 2363 HE2 PHE 318 -15.731 -7.098 -10.559 0.00 0.00 +0.000 HD +ATOM 2364 CD2 PHE 318 -15.206 -8.450 -9.061 0.00 0.00 +0.000 A +ATOM 2365 HD2 PHE 318 -16.107 -8.441 -8.622 0.00 0.00 +0.000 HD +ATOM 2366 C PHE 318 -14.374 -8.229 -5.662 0.00 0.00 +0.000 C +ATOM 2367 O PHE 318 -13.821 -7.177 -5.980 0.00 0.00 +0.000 OA +ATOM 2368 N PHE 319 -15.495 -8.275 -4.950 0.00 0.00 +0.000 N +ATOM 2369 H PHE 319 -15.820 -9.231 -4.708 0.00 0.00 +0.000 HD +ATOM 2370 CA PHE 319 -16.196 -7.061 -4.551 0.00 0.00 +0.000 C +ATOM 2371 HA PHE 319 -15.856 -6.310 -5.159 0.00 0.00 +0.000 HD +ATOM 2372 CB PHE 319 -17.685 -7.247 -4.792 0.00 0.00 +0.000 C +ATOM 2373 HB2 PHE 319 -17.942 -8.144 -4.459 0.00 0.00 +0.000 HD +ATOM 2374 HB3 PHE 319 -18.168 -6.534 -4.303 0.00 0.00 +0.000 HD +ATOM 2375 CG PHE 319 -18.090 -7.163 -6.243 0.00 0.00 +0.000 A +ATOM 2376 CD1 PHE 319 -18.040 -5.950 -6.913 0.00 0.00 +0.000 A +ATOM 2377 HD1 PHE 319 -17.728 -5.131 -6.441 0.00 0.00 +0.000 HD +ATOM 2378 CE1 PHE 319 -18.422 -5.856 -8.254 0.00 0.00 +0.000 A +ATOM 2379 HE1 PHE 319 -18.436 -4.956 -8.701 0.00 0.00 +0.000 HD +ATOM 2380 CZ PHE 319 -18.780 -7.001 -8.956 0.00 0.00 +0.000 A +ATOM 2381 HZ PHE 319 -19.001 -6.942 -9.925 0.00 0.00 +0.000 HD +ATOM 2382 CE2 PHE 319 -18.824 -8.218 -8.294 0.00 0.00 +0.000 A +ATOM 2383 HE2 PHE 319 -19.135 -9.053 -8.780 0.00 0.00 +0.000 HD +ATOM 2384 CD2 PHE 319 -18.445 -8.302 -6.964 0.00 0.00 +0.000 A +ATOM 2385 HD2 PHE 319 -18.424 -9.195 -6.510 0.00 0.00 +0.000 HD +ATOM 2386 C PHE 319 -15.959 -6.591 -3.113 0.00 0.00 +0.000 C +ATOM 2387 O PHE 319 -16.508 -5.563 -2.702 0.00 0.00 +0.000 OA +ATOM 2388 N HIE 320 -15.142 -7.327 -2.360 0.00 0.00 +0.000 N +ATOM 2389 H HIE 320 -14.746 -8.163 -2.844 0.00 0.00 +0.000 HD +ATOM 2390 CA HIE 320 -14.827 -6.989 -0.970 0.00 0.00 +0.000 C +ATOM 2391 HA HIE 320 -15.658 -7.155 -0.409 0.00 0.00 +0.000 HD +ATOM 2392 CB HIE 320 -13.721 -7.908 -0.459 0.00 0.00 +0.000 C +ATOM 2393 HB2 HIE 320 -14.045 -8.860 -0.483 0.00 0.00 +0.000 HD +ATOM 2394 HB3 HIE 320 -12.921 -7.827 -1.063 0.00 0.00 +0.000 HD +ATOM 2395 CG HIE 320 -13.281 -7.599 0.943 0.00 0.00 +0.000 A +ATOM 2396 ND1 HIE 320 -12.082 -7.001 1.233 0.00 0.00 +0.000 NA +ATOM 2397 CE1 HIE 320 -11.992 -6.810 2.544 0.00 0.00 +0.000 A +ATOM 2398 HE1 HIE 320 -11.224 -6.395 3.018 0.00 0.00 +0.000 HD +ATOM 2399 NE2 HIE 320 -13.094 -7.268 3.099 0.00 0.00 +0.000 N +ATOM 2400 HE2 HIE 320 -13.305 -7.253 4.087 0.00 0.00 +0.000 HD +ATOM 2401 CD2 HIE 320 -13.922 -7.773 2.122 0.00 0.00 +0.000 A +ATOM 2402 HD2 HIE 320 -14.814 -8.185 2.260 0.00 0.00 +0.000 HD +ATOM 2403 C HIE 320 -14.408 -5.537 -0.782 0.00 0.00 +0.000 C +ATOM 2404 O HIE 320 -13.615 -5.004 -1.559 0.00 0.00 +0.000 OA +ATOM 2405 N VAL 321 -14.952 -4.910 0.258 0.00 0.00 +0.000 N +ATOM 2406 H VAL 321 -15.604 -5.489 0.824 0.00 0.00 +0.000 HD +ATOM 2407 CA VAL 321 -14.645 -3.513 0.566 0.00 0.00 +0.000 C +ATOM 2408 HA VAL 321 -14.327 -3.069 -0.278 0.00 0.00 +0.000 HD +ATOM 2409 CB VAL 321 -15.896 -2.762 1.098 0.00 0.00 +0.000 C +ATOM 2410 HB VAL 321 -15.663 -1.800 1.156 0.00 0.00 +0.000 HD +ATOM 2411 CG1 VAL 321 -17.041 -2.889 0.101 0.00 0.00 +0.000 C +ATOM 2412 HG11 VAL 321 -16.676 -2.876 -0.829 0.00 0.00 +0.000 HD +ATOM 2413 HG12 VAL 321 -17.525 -3.750 0.257 0.00 0.00 +0.000 HD +ATOM 2414 HG13 VAL 321 -17.674 -2.125 0.221 0.00 0.00 +0.000 HD +ATOM 2415 CG2 VAL 321 -16.310 -3.320 2.445 0.00 0.00 +0.000 C +ATOM 2416 HG21 VAL 321 -16.918 -4.103 2.309 0.00 0.00 +0.000 HD +ATOM 2417 HG22 VAL 321 -15.496 -3.613 2.949 0.00 0.00 +0.000 HD +ATOM 2418 HG23 VAL 321 -16.789 -2.612 2.966 0.00 0.00 +0.000 HD +ATOM 2419 C VAL 321 -13.520 -3.423 1.597 0.00 0.00 +0.000 C +ATOM 2420 O VAL 321 -12.468 -2.832 1.254 0.00 0.00 +0.000 OA +ATOM 2421 OXT VAL 321 -13.431 -3.824 2.731 0.00 0.00 +0.000 OA +TER diff --git a/receptor/pdbqt_files/6o6f_M231L_H.pdbqt b/receptor/pdbqt_files/6o6f_M231L_H.pdbqt new file mode 100644 index 0000000..76b5446 --- /dev/null +++ b/receptor/pdbqt_files/6o6f_M231L_H.pdbqt @@ -0,0 +1,2425 @@ +REMARK Name = ../receptor/6o6f_M231L_H.pdb +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ATOM 1 N SER 171 -23.840 -34.508 -6.167 0.00 0.00 +0.000 NA +ATOM 2 H1 SER 171 -24.073 -34.914 -5.272 0.00 0.00 +0.000 HD +ATOM 3 H2 SER 171 -23.979 -34.837 -5.236 0.00 0.00 +0.000 HD +ATOM 4 H3 SER 171 -23.978 -35.254 -6.813 0.00 0.00 +0.000 HD +ATOM 5 CA SER 171 -24.823 -33.425 -6.454 0.00 0.00 +0.000 C +ATOM 6 HA SER 171 -25.412 -33.750 -7.212 0.00 0.00 +0.000 HD +ATOM 7 CB SER 171 -25.708 -33.194 -5.243 0.00 0.00 +0.000 C +ATOM 8 HB2 SER 171 -26.374 -32.476 -5.458 0.00 0.00 +0.000 HD +ATOM 9 HB3 SER 171 -26.200 -34.043 -5.033 0.00 0.00 +0.000 HD +ATOM 10 OG SER 171 -24.971 -32.802 -4.100 0.00 0.00 +0.000 OA +ATOM 11 HG SER 171 -24.797 -31.818 -4.136 0.00 0.00 +0.000 HD +ATOM 12 C SER 171 -24.177 -32.110 -6.883 0.00 0.00 +0.000 C +ATOM 13 O SER 171 -22.964 -31.912 -6.751 0.00 0.00 +0.000 OA +ATOM 14 N ASP 172 -25.017 -31.207 -7.377 0.00 0.00 +0.000 N +ATOM 15 H ASP 172 -26.019 -31.507 -7.379 0.00 0.00 +0.000 HD +ATOM 16 CA ASP 172 -24.576 -29.909 -7.873 0.00 0.00 +0.000 C +ATOM 17 HA ASP 172 -23.602 -30.008 -8.149 0.00 0.00 +0.000 HD +ATOM 18 CB ASP 172 -25.432 -29.532 -9.076 0.00 0.00 +0.000 C +ATOM 19 HB2 ASP 172 -25.664 -30.370 -9.561 0.00 0.00 +0.000 HD +ATOM 20 HB3 ASP 172 -26.258 -29.091 -8.739 0.00 0.00 +0.000 HD +ATOM 21 CG ASP 172 -24.727 -28.599 -10.018 0.00 0.00 +0.000 C +ATOM 22 OD1 ASP 172 -23.703 -27.997 -9.623 0.00 0.00 +0.000 OA +ATOM 23 OD2 ASP 172 -25.214 -28.470 -11.157 0.00 0.00 +0.000 OA +ATOM 24 C ASP 172 -24.625 -28.796 -6.824 0.00 0.00 +0.000 C +ATOM 25 O ASP 172 -25.612 -28.057 -6.729 0.00 0.00 +0.000 OA +ATOM 26 N GLU 173 -23.548 -28.683 -6.049 0.00 0.00 +0.000 N +ATOM 27 H GLU 173 -22.790 -29.365 -6.257 0.00 0.00 +0.000 HD +ATOM 28 CA GLU 173 -23.453 -27.676 -4.995 0.00 0.00 +0.000 C +ATOM 29 HA GLU 173 -24.232 -27.772 -4.359 0.00 0.00 +0.000 HD +ATOM 30 CB GLU 173 -22.200 -27.947 -4.155 0.00 0.00 +0.000 C +ATOM 31 HB2 GLU 173 -22.347 -28.794 -3.669 0.00 0.00 +0.000 HD +ATOM 32 HB3 GLU 173 -21.435 -28.012 -4.775 0.00 0.00 +0.000 HD +ATOM 33 CG GLU 173 -21.879 -26.877 -3.134 0.00 0.00 +0.000 C +ATOM 34 HG2 GLU 173 -21.026 -27.114 -2.693 0.00 0.00 +0.000 HD +ATOM 35 HG3 GLU 173 -21.810 -26.008 -3.602 0.00 0.00 +0.000 HD +ATOM 36 CD GLU 173 -22.924 -26.721 -2.045 0.00 0.00 +0.000 C +ATOM 37 OE1 GLU 173 -23.943 -27.446 -2.041 0.00 0.00 +0.000 OA +ATOM 38 OE2 GLU 173 -22.734 -25.830 -1.194 0.00 0.00 +0.000 OA +ATOM 39 C GLU 173 -23.443 -26.240 -5.559 0.00 0.00 +0.000 C +ATOM 40 O GLU 173 -24.129 -25.350 -5.049 0.00 0.00 +0.000 OA +ATOM 41 N LEU 174 -22.675 -26.019 -6.620 0.00 0.00 +0.000 N +ATOM 42 H LEU 174 -22.143 -26.835 -6.959 0.00 0.00 +0.000 HD +ATOM 43 CA LEU 174 -22.619 -24.699 -7.230 0.00 0.00 +0.000 C +ATOM 44 HA LEU 174 -22.328 -24.032 -6.531 0.00 0.00 +0.000 HD +ATOM 45 CB LEU 174 -21.586 -24.661 -8.357 0.00 0.00 +0.000 C +ATOM 46 HB2 LEU 174 -20.686 -24.796 -7.952 0.00 0.00 +0.000 HD +ATOM 47 HB3 LEU 174 -21.794 -25.401 -8.988 0.00 0.00 +0.000 HD +ATOM 48 CG LEU 174 -21.530 -23.367 -9.171 0.00 0.00 +0.000 C +ATOM 49 HG LEU 174 -22.441 -23.160 -9.522 0.00 0.00 +0.000 HD +ATOM 50 CD1 LEU 174 -21.054 -22.201 -8.293 0.00 0.00 +0.000 C +ATOM 51 HD11 LEU 174 -20.143 -22.406 -7.942 0.00 0.00 +0.000 HD +ATOM 52 HD12 LEU 174 -21.025 -21.368 -8.842 0.00 0.00 +0.000 HD +ATOM 53 HD13 LEU 174 -21.690 -22.082 -7.533 0.00 0.00 +0.000 HD +ATOM 54 CD2 LEU 174 -20.605 -23.568 -10.350 0.00 0.00 +0.000 C +ATOM 55 HD21 LEU 174 -20.947 -24.313 -10.927 0.00 0.00 +0.000 HD +ATOM 56 HD22 LEU 174 -20.559 -22.727 -10.893 0.00 0.00 +0.000 HD +ATOM 57 HD23 LEU 174 -19.686 -23.800 -10.025 0.00 0.00 +0.000 HD +ATOM 58 C LEU 174 -23.982 -24.270 -7.762 0.00 0.00 +0.000 C +ATOM 59 O LEU 174 -24.374 -23.103 -7.633 0.00 0.00 +0.000 OA +ATOM 60 N TYR 175 -24.715 -25.192 -8.372 0.00 0.00 +0.000 N +ATOM 61 H TYR 175 -24.296 -26.118 -8.460 0.00 0.00 +0.000 HD +ATOM 62 CA TYR 175 -26.039 -24.830 -8.864 0.00 0.00 +0.000 C +ATOM 63 HA TYR 175 -25.951 -24.004 -9.436 0.00 0.00 +0.000 HD +ATOM 64 CB TYR 175 -26.649 -25.942 -9.716 0.00 0.00 +0.000 C +ATOM 65 HB2 TYR 175 -26.023 -26.152 -10.448 0.00 0.00 +0.000 HD +ATOM 66 HB3 TYR 175 -26.811 -26.724 -9.137 0.00 0.00 +0.000 HD +ATOM 67 CG TYR 175 -27.958 -25.506 -10.312 0.00 0.00 +0.000 A +ATOM 68 CD1 TYR 175 -27.995 -24.770 -11.495 0.00 0.00 +0.000 A +ATOM 69 HD1 TYR 175 -27.147 -24.606 -12.002 0.00 0.00 +0.000 HD +ATOM 70 CE1 TYR 175 -29.191 -24.255 -11.988 0.00 0.00 +0.000 A +ATOM 71 HE1 TYR 175 -29.198 -23.731 -12.840 0.00 0.00 +0.000 HD +ATOM 72 CZ TYR 175 -30.369 -24.474 -11.292 0.00 0.00 +0.000 A +ATOM 73 OH TYR 175 -31.551 -23.926 -11.754 0.00 0.00 +0.000 OA +ATOM 74 HH TYR 175 -31.551 -23.947 -12.751 0.00 0.00 +0.000 HD +ATOM 75 CE2 TYR 175 -30.358 -25.213 -10.119 0.00 0.00 +0.000 A +ATOM 76 HE2 TYR 175 -31.208 -25.379 -9.621 0.00 0.00 +0.000 HD +ATOM 77 CD2 TYR 175 -29.155 -25.724 -9.637 0.00 0.00 +0.000 A +ATOM 78 HD2 TYR 175 -29.154 -26.257 -8.793 0.00 0.00 +0.000 HD +ATOM 79 C TYR 175 -26.995 -24.507 -7.714 0.00 0.00 +0.000 C +ATOM 80 O TYR 175 -27.704 -23.510 -7.775 0.00 0.00 +0.000 OA +ATOM 81 N ARG 176 -27.007 -25.346 -6.679 0.00 0.00 +0.000 N +ATOM 82 H ARG 176 -26.357 -26.148 -6.760 0.00 0.00 +0.000 HD +ATOM 83 CA ARG 176 -27.880 -25.122 -5.538 0.00 0.00 +0.000 C +ATOM 84 HA ARG 176 -28.838 -25.126 -5.855 0.00 0.00 +0.000 HD +ATOM 85 CB ARG 176 -27.703 -26.232 -4.499 0.00 0.00 +0.000 C +ATOM 86 HB2 ARG 176 -27.919 -27.104 -4.934 0.00 0.00 +0.000 HD +ATOM 87 HB3 ARG 176 -26.751 -26.231 -4.201 0.00 0.00 +0.000 HD +ATOM 88 CG ARG 176 -28.582 -26.093 -3.263 0.00 0.00 +0.000 C +ATOM 89 HG2 ARG 176 -28.651 -25.127 -3.013 0.00 0.00 +0.000 HD +ATOM 90 HG3 ARG 176 -29.494 -26.450 -3.465 0.00 0.00 +0.000 HD +ATOM 91 CD ARG 176 -28.029 -26.853 -2.073 0.00 0.00 +0.000 C +ATOM 92 HD2 ARG 176 -28.698 -26.811 -1.338 0.00 0.00 +0.000 HD +ATOM 93 HD3 ARG 176 -27.879 -27.797 -2.350 0.00 0.00 +0.000 HD +ATOM 94 NE ARG 176 -26.768 -26.279 -1.611 0.00 0.00 +0.000 N +ATOM 95 HE ARG 176 -25.931 -26.828 -1.727 0.00 0.00 +0.000 HD +ATOM 96 CZ ARG 176 -26.649 -25.079 -1.047 0.00 0.00 +0.000 C +ATOM 97 NH1 ARG 176 -25.462 -24.636 -0.662 0.00 0.00 +0.000 N +ATOM 98 HH11 ARG 176 -24.638 -25.179 -0.804 0.00 0.00 +0.000 HD +ATOM 99 HH12 ARG 176 -25.387 -23.734 -0.219 0.00 0.00 +0.000 HD +ATOM 100 NH2 ARG 176 -27.717 -24.321 -0.856 0.00 0.00 +0.000 N +ATOM 101 HH21 ARG 176 -28.617 -24.651 -1.158 0.00 0.00 +0.000 HD +ATOM 102 HH22 ARG 176 -27.634 -23.430 -0.418 0.00 0.00 +0.000 HD +ATOM 103 C ARG 176 -27.593 -23.783 -4.878 0.00 0.00 +0.000 C +ATOM 104 O ARG 176 -28.505 -23.016 -4.554 0.00 0.00 +0.000 OA +ATOM 105 N GLN 177 -26.313 -23.517 -4.660 0.00 0.00 +0.000 N +ATOM 106 H GLN 177 -25.654 -24.258 -4.972 0.00 0.00 +0.000 HD +ATOM 107 CA GLN 177 -25.894 -22.281 -4.034 0.00 0.00 +0.000 C +ATOM 108 HA GLN 177 -26.375 -22.196 -3.149 0.00 0.00 +0.000 HD +ATOM 109 CB GLN 177 -24.390 -22.315 -3.808 0.00 0.00 +0.000 C +ATOM 110 HB2 GLN 177 -24.174 -23.066 -3.180 0.00 0.00 +0.000 HD +ATOM 111 HB3 GLN 177 -23.935 -22.483 -4.686 0.00 0.00 +0.000 HD +ATOM 112 CG GLN 177 -23.831 -21.036 -3.224 0.00 0.00 +0.000 C +ATOM 113 HG2 GLN 177 -23.923 -20.309 -3.898 0.00 0.00 +0.000 HD +ATOM 114 HG3 GLN 177 -24.344 -20.808 -2.401 0.00 0.00 +0.000 HD +ATOM 115 CD GLN 177 -22.379 -21.189 -2.867 0.00 0.00 +0.000 C +ATOM 116 OE1 GLN 177 -21.604 -21.751 -3.639 0.00 0.00 +0.000 OA +ATOM 117 NE2 GLN 177 -21.996 -20.691 -1.694 0.00 0.00 +0.000 N +ATOM 118 HE21 GLN 177 -21.032 -20.769 -1.378 0.00 0.00 +0.000 HD +ATOM 119 HE22 GLN 177 -22.690 -20.224 -1.110 0.00 0.00 +0.000 HD +ATOM 120 C GLN 177 -26.268 -21.070 -4.879 0.00 0.00 +0.000 C +ATOM 121 O GLN 177 -26.763 -20.074 -4.355 0.00 0.00 +0.000 OA +ATOM 122 N SER 178 -26.034 -21.158 -6.184 0.00 0.00 +0.000 N +ATOM 123 H SER 178 -25.612 -22.049 -6.496 0.00 0.00 +0.000 HD +ATOM 124 CA SER 178 -26.362 -20.057 -7.081 0.00 0.00 +0.000 C +ATOM 125 HA SER 178 -25.897 -19.228 -6.744 0.00 0.00 +0.000 HD +ATOM 126 CB SER 178 -25.888 -20.374 -8.504 0.00 0.00 +0.000 C +ATOM 127 HB2 SER 178 -26.337 -21.208 -8.813 0.00 0.00 +0.000 HD +ATOM 128 HB3 SER 178 -26.132 -19.613 -9.099 0.00 0.00 +0.000 HD +ATOM 129 OG SER 178 -24.482 -20.562 -8.549 0.00 0.00 +0.000 OA +ATOM 130 HG SER 178 -24.258 -21.476 -8.214 0.00 0.00 +0.000 HD +ATOM 131 C SER 178 -27.863 -19.774 -7.098 0.00 0.00 +0.000 C +ATOM 132 O SER 178 -28.285 -18.616 -7.152 0.00 0.00 +0.000 OA +ATOM 133 N LEU 179 -28.669 -20.829 -7.054 0.00 0.00 +0.000 N +ATOM 134 H LEU 179 -28.201 -21.744 -7.001 0.00 0.00 +0.000 HD +ATOM 135 CA LEU 179 -30.117 -20.652 -7.082 0.00 0.00 +0.000 C +ATOM 136 HA LEU 179 -30.355 -20.079 -7.882 0.00 0.00 +0.000 HD +ATOM 137 CB LEU 179 -30.823 -21.998 -7.275 0.00 0.00 +0.000 C +ATOM 138 HB2 LEU 179 -30.510 -22.388 -8.129 0.00 0.00 +0.000 HD +ATOM 139 HB3 LEU 179 -30.592 -22.578 -6.509 0.00 0.00 +0.000 HD +ATOM 140 CG LEU 179 -32.355 -21.915 -7.344 0.00 0.00 +0.000 C +ATOM 141 HG LEU 179 -32.701 -21.589 -6.466 0.00 0.00 +0.000 HD +ATOM 142 CD1 LEU 179 -32.793 -20.955 -8.449 0.00 0.00 +0.000 C +ATOM 143 HD11 LEU 179 -32.446 -21.281 -9.328 0.00 0.00 +0.000 HD +ATOM 144 HD12 LEU 179 -33.791 -20.915 -8.477 0.00 0.00 +0.000 HD +ATOM 145 HD13 LEU 179 -32.427 -20.044 -8.261 0.00 0.00 +0.000 HD +ATOM 146 CD2 LEU 179 -32.923 -23.296 -7.579 0.00 0.00 +0.000 C +ATOM 147 HD21 LEU 179 -32.657 -23.905 -6.828 0.00 0.00 +0.000 HD +ATOM 148 HD22 LEU 179 -33.923 -23.249 -7.625 0.00 0.00 +0.000 HD +ATOM 149 HD23 LEU 179 -32.572 -23.666 -8.442 0.00 0.00 +0.000 HD +ATOM 150 C LEU 179 -30.643 -19.964 -5.827 0.00 0.00 +0.000 C +ATOM 151 O LEU 179 -31.515 -19.100 -5.916 0.00 0.00 +0.000 OA +ATOM 152 N GLU 180 -30.114 -20.332 -4.664 0.00 0.00 +0.000 N +ATOM 153 H GLU 180 -29.384 -21.055 -4.720 0.00 0.00 +0.000 HD +ATOM 154 CA GLU 180 -30.573 -19.723 -3.431 0.00 0.00 +0.000 C +ATOM 155 HA GLU 180 -31.571 -19.818 -3.350 0.00 0.00 +0.000 HD +ATOM 156 CB GLU 180 -29.980 -20.469 -2.231 0.00 0.00 +0.000 C +ATOM 157 HB2 GLU 180 -30.326 -21.392 -2.254 0.00 0.00 +0.000 HD +ATOM 158 HB3 GLU 180 -28.999 -20.442 -2.318 0.00 0.00 +0.000 HD +ATOM 159 CG GLU 180 -30.342 -19.873 -0.882 0.00 0.00 +0.000 C +ATOM 160 HG2 GLU 180 -29.648 -19.218 -0.637 0.00 0.00 +0.000 HD +ATOM 161 HG3 GLU 180 -31.231 -19.455 -0.955 0.00 0.00 +0.000 HD +ATOM 162 CD GLU 180 -30.412 -20.902 0.231 0.00 0.00 +0.000 C +ATOM 163 OE1 GLU 180 -29.479 -21.732 0.342 0.00 0.00 +0.000 OA +ATOM 164 OE2 GLU 180 -31.405 -20.868 1.003 0.00 0.00 +0.000 OA +ATOM 165 C GLU 180 -30.206 -18.237 -3.394 0.00 0.00 +0.000 C +ATOM 166 O GLU 180 -31.022 -17.410 -3.014 0.00 0.00 +0.000 OA +ATOM 167 N ILE 181 -28.991 -17.898 -3.817 0.00 0.00 +0.000 N +ATOM 168 H ILE 181 -28.400 -18.686 -4.133 0.00 0.00 +0.000 HD +ATOM 169 CA ILE 181 -28.557 -16.506 -3.821 0.00 0.00 +0.000 C +ATOM 170 HA ILE 181 -28.724 -16.153 -2.890 0.00 0.00 +0.000 HD +ATOM 171 CB ILE 181 -27.079 -16.406 -4.239 0.00 0.00 +0.000 C +ATOM 172 HB ILE 181 -26.977 -16.860 -5.115 0.00 0.00 +0.000 HD +ATOM 173 CG2 ILE 181 -26.670 -14.946 -4.374 0.00 0.00 +0.000 C +ATOM 174 HG21 ILE 181 -25.720 -14.892 -4.676 0.00 0.00 +0.000 HD +ATOM 175 HG22 ILE 181 -27.257 -14.496 -5.045 0.00 0.00 +0.000 HD +ATOM 176 HG23 ILE 181 -26.764 -14.490 -3.491 0.00 0.00 +0.000 HD +ATOM 177 CG1 ILE 181 -26.205 -17.135 -3.221 0.00 0.00 +0.000 C +ATOM 178 HG12 ILE 181 -26.169 -16.593 -2.387 0.00 0.00 +0.000 HD +ATOM 179 HG13 ILE 181 -26.625 -18.016 -3.019 0.00 0.00 +0.000 HD +ATOM 180 CD1 ILE 181 -24.790 -17.375 -3.713 0.00 0.00 +0.000 C +ATOM 181 HD11 ILE 181 -24.357 -16.498 -3.912 0.00 0.00 +0.000 HD +ATOM 182 HD12 ILE 181 -24.272 -17.853 -3.006 0.00 0.00 +0.000 HD +ATOM 183 HD13 ILE 181 -24.819 -17.931 -4.542 0.00 0.00 +0.000 HD +ATOM 184 C ILE 181 -29.390 -15.639 -4.768 0.00 0.00 +0.000 C +ATOM 185 O ILE 181 -29.881 -14.570 -4.388 0.00 0.00 +0.000 OA +ATOM 186 N ILE 182 -29.538 -16.098 -6.006 0.00 0.00 +0.000 N +ATOM 187 H ILE 182 -29.087 -17.009 -6.196 0.00 0.00 +0.000 HD +ATOM 188 CA ILE 182 -30.293 -15.344 -7.008 0.00 0.00 +0.000 C +ATOM 189 HA ILE 182 -29.944 -14.397 -6.971 0.00 0.00 +0.000 HD +ATOM 190 CB ILE 182 -30.077 -15.948 -8.418 0.00 0.00 +0.000 C +ATOM 191 HB ILE 182 -30.270 -16.917 -8.367 0.00 0.00 +0.000 HD +ATOM 192 CG2 ILE 182 -31.002 -15.272 -9.432 0.00 0.00 +0.000 C +ATOM 193 HG21 ILE 182 -30.867 -15.687 -10.329 0.00 0.00 +0.000 HD +ATOM 194 HG22 ILE 182 -31.950 -15.393 -9.146 0.00 0.00 +0.000 HD +ATOM 195 HG23 ILE 182 -30.787 -14.299 -9.477 0.00 0.00 +0.000 HD +ATOM 196 CG1 ILE 182 -28.607 -15.776 -8.836 0.00 0.00 +0.000 C +ATOM 197 HG12 ILE 182 -28.430 -14.805 -8.974 0.00 0.00 +0.000 HD +ATOM 198 HG13 ILE 182 -28.030 -16.107 -8.092 0.00 0.00 +0.000 HD +ATOM 199 CD1 ILE 182 -28.233 -16.529 -10.110 0.00 0.00 +0.000 C +ATOM 200 HD11 ILE 182 -28.798 -16.197 -10.861 0.00 0.00 +0.000 HD +ATOM 201 HD12 ILE 182 -27.270 -16.367 -10.312 0.00 0.00 +0.000 HD +ATOM 202 HD13 ILE 182 -28.392 -17.503 -9.970 0.00 0.00 +0.000 HD +ATOM 203 C ILE 182 -31.792 -15.266 -6.690 0.00 0.00 +0.000 C +ATOM 204 O ILE 182 -32.411 -14.222 -6.884 0.00 0.00 +0.000 OA +ATOM 205 N SER 183 -32.364 -16.364 -6.197 0.00 0.00 +0.000 N +ATOM 206 H SER 183 -31.726 -17.177 -6.091 0.00 0.00 +0.000 HD +ATOM 207 CA SER 183 -33.785 -16.407 -5.836 0.00 0.00 +0.000 C +ATOM 208 HA SER 183 -34.316 -16.106 -6.633 0.00 0.00 +0.000 HD +ATOM 209 CB SER 183 -34.195 -17.822 -5.410 0.00 0.00 +0.000 C +ATOM 210 HB2 SER 183 -33.678 -18.068 -4.594 0.00 0.00 +0.000 HD +ATOM 211 HB3 SER 183 -35.171 -17.819 -5.206 0.00 0.00 +0.000 HD +ATOM 212 OG SER 183 -33.934 -18.750 -6.427 0.00 0.00 +0.000 OA +ATOM 213 HG SER 183 -32.968 -19.016 -6.406 0.00 0.00 +0.000 HD +ATOM 214 C SER 183 -34.077 -15.447 -4.686 0.00 0.00 +0.000 C +ATOM 215 O SER 183 -35.054 -14.693 -4.717 0.00 0.00 +0.000 OA +ATOM 216 N ARG 184 -33.228 -15.485 -3.665 0.00 0.00 +0.000 N +ATOM 217 H ARG 184 -32.460 -16.164 -3.751 0.00 0.00 +0.000 HD +ATOM 218 CA ARG 184 -33.417 -14.602 -2.522 0.00 0.00 +0.000 C +ATOM 219 HA ARG 184 -34.340 -14.751 -2.143 0.00 0.00 +0.000 HD +ATOM 220 CB ARG 184 -32.406 -14.909 -1.415 0.00 0.00 +0.000 C +ATOM 221 HB2 ARG 184 -31.495 -14.916 -1.821 0.00 0.00 +0.000 HD +ATOM 222 HB3 ARG 184 -32.467 -14.186 -0.731 0.00 0.00 +0.000 HD +ATOM 223 CG ARG 184 -32.626 -16.236 -0.722 0.00 0.00 +0.000 C +ATOM 224 HG2 ARG 184 -33.580 -16.493 -0.787 0.00 0.00 +0.000 HD +ATOM 225 HG3 ARG 184 -32.043 -16.926 -1.128 0.00 0.00 +0.000 HD +ATOM 226 CD ARG 184 -32.264 -16.113 0.746 0.00 0.00 +0.000 C +ATOM 227 HD2 ARG 184 -31.310 -15.829 0.808 0.00 0.00 +0.000 HD +ATOM 228 HD3 ARG 184 -32.853 -15.418 1.153 0.00 0.00 +0.000 HD +ATOM 229 NE ARG 184 -32.439 -17.372 1.459 0.00 0.00 +0.000 N +ATOM 230 HE ARG 184 -32.645 -18.196 0.918 0.00 0.00 +0.000 HD +ATOM 231 CZ ARG 184 -32.344 -17.503 2.777 0.00 0.00 +0.000 C +ATOM 232 NH1 ARG 184 -32.079 -16.447 3.533 0.00 0.00 +0.000 N +ATOM 233 HH11 ARG 184 -31.967 -15.541 3.135 0.00 0.00 +0.000 HD +ATOM 234 HH12 ARG 184 -31.990 -16.561 4.531 0.00 0.00 +0.000 HD +ATOM 235 NH2 ARG 184 -32.508 -18.695 3.339 0.00 0.00 +0.000 N +ATOM 236 HH21 ARG 184 -32.723 -19.488 2.764 0.00 0.00 +0.000 HD +ATOM 237 HH22 ARG 184 -32.420 -18.802 4.326 0.00 0.00 +0.000 HD +ATOM 238 C ARG 184 -33.290 -13.134 -2.923 0.00 0.00 +0.000 C +ATOM 239 O ARG 184 -34.059 -12.283 -2.466 0.00 0.00 +0.000 OA +ATOM 240 N TYR 185 -32.320 -12.830 -3.777 0.00 0.00 +0.000 N +ATOM 241 H TYR 185 -31.741 -13.617 -4.093 0.00 0.00 +0.000 HD +ATOM 242 CA TYR 185 -32.137 -11.452 -4.202 0.00 0.00 +0.000 C +ATOM 243 HA TYR 185 -32.029 -10.877 -3.383 0.00 0.00 +0.000 HD +ATOM 244 CB TYR 185 -30.880 -11.310 -5.074 0.00 0.00 +0.000 C +ATOM 245 HB2 TYR 185 -30.112 -11.686 -4.573 0.00 0.00 +0.000 HD +ATOM 246 HB3 TYR 185 -31.031 -11.809 -5.917 0.00 0.00 +0.000 HD +ATOM 247 CG TYR 185 -30.570 -9.871 -5.419 0.00 0.00 +0.000 A +ATOM 248 CD1 TYR 185 -30.431 -8.910 -4.413 0.00 0.00 +0.000 A +ATOM 249 HD1 TYR 185 -30.515 -9.183 -3.455 0.00 0.00 +0.000 HD +ATOM 250 CE1 TYR 185 -30.178 -7.574 -4.723 0.00 0.00 +0.000 A +ATOM 251 HE1 TYR 185 -30.077 -6.899 -3.995 0.00 0.00 +0.000 HD +ATOM 252 CZ TYR 185 -30.066 -7.189 -6.058 0.00 0.00 +0.000 A +ATOM 253 OH TYR 185 -29.845 -5.870 -6.376 0.00 0.00 +0.000 OA +ATOM 254 HH TYR 185 -29.842 -5.326 -5.538 0.00 0.00 +0.000 HD +ATOM 255 CE2 TYR 185 -30.197 -8.120 -7.069 0.00 0.00 +0.000 A +ATOM 256 HE2 TYR 185 -30.117 -7.847 -8.025 0.00 0.00 +0.000 HD +ATOM 257 CD2 TYR 185 -30.445 -9.460 -6.746 0.00 0.00 +0.000 A +ATOM 258 HD2 TYR 185 -30.532 -10.128 -7.480 0.00 0.00 +0.000 HD +ATOM 259 C TYR 185 -33.360 -10.955 -4.969 0.00 0.00 +0.000 C +ATOM 260 O TYR 185 -33.872 -9.872 -4.690 0.00 0.00 +0.000 OA +ATOM 261 N LEU 186 -33.840 -11.739 -5.933 0.00 0.00 +0.000 N +ATOM 262 H LEU 186 -33.347 -12.629 -6.071 0.00 0.00 +0.000 HD +ATOM 263 CA LEU 186 -35.002 -11.314 -6.721 0.00 0.00 +0.000 C +ATOM 264 HA LEU 186 -34.796 -10.410 -7.129 0.00 0.00 +0.000 HD +ATOM 265 CB LEU 186 -35.257 -12.282 -7.881 0.00 0.00 +0.000 C +ATOM 266 HB2 LEU 186 -34.873 -13.166 -7.630 0.00 0.00 +0.000 HD +ATOM 267 HB3 LEU 186 -36.241 -12.357 -8.005 0.00 0.00 +0.000 HD +ATOM 268 CG LEU 186 -34.654 -11.889 -9.231 0.00 0.00 +0.000 C +ATOM 269 HG LEU 186 -35.038 -11.015 -9.515 0.00 0.00 +0.000 HD +ATOM 270 CD1 LEU 186 -33.146 -11.763 -9.099 0.00 0.00 +0.000 C +ATOM 271 HD11 LEU 186 -32.760 -12.639 -8.806 0.00 0.00 +0.000 HD +ATOM 272 HD12 LEU 186 -32.752 -11.506 -9.982 0.00 0.00 +0.000 HD +ATOM 273 HD13 LEU 186 -32.926 -11.061 -8.421 0.00 0.00 +0.000 HD +ATOM 274 CD2 LEU 186 -35.024 -12.920 -10.294 0.00 0.00 +0.000 C +ATOM 275 HD21 LEU 186 -36.019 -12.966 -10.380 0.00 0.00 +0.000 HD +ATOM 276 HD22 LEU 186 -34.624 -12.652 -11.170 0.00 0.00 +0.000 HD +ATOM 277 HD23 LEU 186 -34.670 -13.816 -10.025 0.00 0.00 +0.000 HD +ATOM 278 C LEU 186 -36.268 -11.184 -5.879 0.00 0.00 +0.000 C +ATOM 279 O LEU 186 -37.076 -10.276 -6.093 0.00 0.00 +0.000 OA +ATOM 280 N ARG 187 -36.440 -12.076 -4.913 0.00 0.00 +0.000 N +ATOM 281 H ARG 187 -35.706 -12.783 -4.821 0.00 0.00 +0.000 HD +ATOM 282 CA ARG 187 -37.615 -11.988 -4.085 0.00 0.00 +0.000 C +ATOM 283 HA ARG 187 -38.439 -11.913 -4.678 0.00 0.00 +0.000 HD +ATOM 284 CB ARG 187 -37.800 -13.281 -3.308 0.00 0.00 +0.000 C +ATOM 285 HB2 ARG 187 -37.759 -14.036 -3.941 0.00 0.00 +0.000 HD +ATOM 286 HB3 ARG 187 -37.094 -13.340 -2.623 0.00 0.00 +0.000 HD +ATOM 287 CG ARG 187 -39.143 -13.318 -2.610 0.00 0.00 +0.000 C +ATOM 288 HG2 ARG 187 -39.139 -12.689 -1.827 0.00 0.00 +0.000 HD +ATOM 289 HG3 ARG 187 -39.867 -13.037 -3.247 0.00 0.00 +0.000 HD +ATOM 290 CD ARG 187 -39.527 -14.716 -2.071 0.00 0.00 +0.000 C +ATOM 291 HD2 ARG 187 -39.428 -15.360 -2.826 0.00 0.00 +0.000 HD +ATOM 292 HD3 ARG 187 -38.879 -14.939 -1.346 0.00 0.00 +0.000 HD +ATOM 293 NE ARG 187 -40.880 -14.758 -1.558 0.00 0.00 +0.000 N +ATOM 294 HE ARG 187 -41.022 -15.060 -0.606 0.00 0.00 +0.000 HD +ATOM 295 CZ ARG 187 -41.962 -14.422 -2.263 0.00 0.00 +0.000 C +ATOM 296 NH1 ARG 187 -41.866 -14.026 -3.524 0.00 0.00 +0.000 N +ATOM 297 HH11 ARG 187 -40.975 -13.992 -3.976 0.00 0.00 +0.000 HD +ATOM 298 HH12 ARG 187 -42.689 -13.760 -4.030 0.00 0.00 +0.000 HD +ATOM 299 NH2 ARG 187 -43.169 -14.421 -1.700 0.00 0.00 +0.000 N +ATOM 300 HH21 ARG 187 -43.253 -14.698 -0.737 0.00 0.00 +0.000 HD +ATOM 301 HH22 ARG 187 -43.969 -14.154 -2.221 0.00 0.00 +0.000 HD +ATOM 302 C ARG 187 -37.607 -10.776 -3.138 0.00 0.00 +0.000 C +ATOM 303 O ARG 187 -38.623 -10.082 -2.999 0.00 0.00 +0.000 OA +ATOM 304 N GLU 188 -36.486 -10.498 -2.479 0.00 0.00 +0.000 N +ATOM 305 H GLU 188 -35.700 -11.122 -2.635 0.00 0.00 +0.000 HD +ATOM 306 CA GLU 188 -36.463 -9.332 -1.590 0.00 0.00 +0.000 C +ATOM 307 HA GLU 188 -37.257 -9.366 -0.968 0.00 0.00 +0.000 HD +ATOM 308 CB GLU 188 -35.257 -9.375 -0.649 0.00 0.00 +0.000 C +ATOM 309 HB2 GLU 188 -35.354 -8.607 -0.018 0.00 0.00 +0.000 HD +ATOM 310 HB3 GLU 188 -35.314 -10.234 -0.143 0.00 0.00 +0.000 HD +ATOM 311 CG GLU 188 -33.914 -9.293 -1.280 0.00 0.00 +0.000 C +ATOM 312 HG2 GLU 188 -33.715 -10.144 -1.726 0.00 0.00 +0.000 HD +ATOM 313 HG3 GLU 188 -33.892 -8.530 -1.896 0.00 0.00 +0.000 HD +ATOM 314 CD GLU 188 -32.836 -9.065 -0.246 0.00 0.00 +0.000 C +ATOM 315 OE1 GLU 188 -32.857 -9.773 0.778 0.00 0.00 +0.000 OA +ATOM 316 OE2 GLU 188 -31.959 -8.199 -0.446 0.00 0.00 +0.000 OA +ATOM 317 C GLU 188 -36.491 -8.010 -2.371 0.00 0.00 +0.000 C +ATOM 318 O GLU 188 -36.955 -6.991 -1.860 0.00 0.00 +0.000 OA +ATOM 319 N GLN 189 -35.996 -8.024 -3.606 0.00 0.00 +0.000 N +ATOM 320 H GLN 189 -35.603 -8.921 -3.916 0.00 0.00 +0.000 HD +ATOM 321 CA GLN 189 -36.035 -6.818 -4.421 0.00 0.00 +0.000 C +ATOM 322 HA GLN 189 -35.710 -6.055 -3.868 0.00 0.00 +0.000 HD +ATOM 323 CB GLN 189 -35.194 -7.003 -5.691 0.00 0.00 +0.000 C +ATOM 324 HB2 GLN 189 -35.385 -7.912 -6.070 0.00 0.00 +0.000 HD +ATOM 325 HB3 GLN 189 -35.471 -6.308 -6.361 0.00 0.00 +0.000 HD +ATOM 326 CG GLN 189 -33.694 -6.884 -5.479 0.00 0.00 +0.000 C +ATOM 327 HG2 GLN 189 -33.455 -7.324 -4.617 0.00 0.00 +0.000 HD +ATOM 328 HG3 GLN 189 -33.226 -7.337 -6.234 0.00 0.00 +0.000 HD +ATOM 329 CD GLN 189 -33.241 -5.437 -5.425 0.00 0.00 +0.000 C +ATOM 330 OE1 GLN 189 -33.468 -4.676 -6.366 0.00 0.00 +0.000 OA +ATOM 331 NE2 GLN 189 -32.601 -5.047 -4.324 0.00 0.00 +0.000 N +ATOM 332 HE21 GLN 189 -32.259 -4.100 -4.226 0.00 0.00 +0.000 HD +ATOM 333 HE22 GLN 189 -32.462 -5.726 -3.575 0.00 0.00 +0.000 HD +ATOM 334 C GLN 189 -37.491 -6.535 -4.794 0.00 0.00 +0.000 C +ATOM 335 O GLN 189 -37.945 -5.398 -4.771 0.00 0.00 +0.000 OA +ATOM 336 N ALA 190 -38.227 -7.591 -5.125 0.00 0.00 +0.000 N +ATOM 337 H ALA 190 -37.734 -8.501 -5.082 0.00 0.00 +0.000 HD +ATOM 338 CA ALA 190 -39.628 -7.450 -5.517 0.00 0.00 +0.000 C +ATOM 339 HA ALA 190 -39.696 -6.704 -6.210 0.00 0.00 +0.000 HD +ATOM 340 CB ALA 190 -40.105 -8.721 -6.222 0.00 0.00 +0.000 C +ATOM 341 HB1 ALA 190 -39.426 -9.442 -6.098 0.00 0.00 +0.000 HD +ATOM 342 HB2 ALA 190 -40.976 -9.010 -5.829 0.00 0.00 +0.000 HD +ATOM 343 HB3 ALA 190 -40.222 -8.534 -7.196 0.00 0.00 +0.000 HD +ATOM 344 C ALA 190 -40.575 -7.118 -4.363 0.00 0.00 +0.000 C +ATOM 345 O ALA 190 -41.540 -6.361 -4.534 0.00 0.00 +0.000 OA +ATOM 346 N THR 191 -40.291 -7.670 -3.188 0.00 0.00 +0.000 N +ATOM 347 H THR 191 -39.428 -8.249 -3.176 0.00 0.00 +0.000 HD +ATOM 348 CA THR 191 -41.137 -7.467 -2.017 0.00 0.00 +0.000 C +ATOM 349 HA THR 191 -42.084 -7.255 -2.340 0.00 0.00 +0.000 HD +ATOM 350 CB THR 191 -41.212 -8.756 -1.190 0.00 0.00 +0.000 C +ATOM 351 HB THR 191 -41.899 -8.633 -0.445 0.00 0.00 +0.000 HD +ATOM 352 CG2 THR 191 -41.579 -9.934 -2.094 0.00 0.00 +0.000 C +ATOM 353 HG21 THR 191 -40.796 -10.553 -2.174 0.00 0.00 +0.000 HD +ATOM 354 HG22 THR 191 -42.355 -10.430 -1.701 0.00 0.00 +0.000 HD +ATOM 355 HG23 THR 191 -41.828 -9.595 -3.003 0.00 0.00 +0.000 HD +ATOM 356 OG1 THR 191 -39.938 -9.010 -0.582 0.00 0.00 +0.000 OA +ATOM 357 HG1 THR 191 -39.291 -9.367 -1.264 0.00 0.00 +0.000 HD +ATOM 358 C THR 191 -40.690 -6.337 -1.095 0.00 0.00 +0.000 C +ATOM 359 O THR 191 -41.528 -5.627 -0.535 0.00 0.00 +0.000 OA +ATOM 360 N GLY 192 -39.380 -6.175 -0.932 0.00 0.00 +0.000 N +ATOM 361 H GLY 192 -38.786 -6.840 -1.450 0.00 0.00 +0.000 HD +ATOM 362 CA GLY 192 -38.866 -5.120 -0.073 0.00 0.00 +0.000 C +ATOM 363 HA2 GLY 192 -38.083 -4.662 -0.540 0.00 0.00 +0.000 HD +ATOM 364 HA3 GLY 192 -39.585 -4.405 0.045 0.00 0.00 +0.000 HD +ATOM 365 C GLY 192 -38.419 -5.605 1.289 0.00 0.00 +0.000 C +ATOM 366 O GLY 192 -38.015 -4.815 2.149 0.00 0.00 +0.000 OA +ATOM 367 N ALA 193 -38.481 -6.913 1.503 0.00 0.00 +0.000 N +ATOM 368 H ALA 193 -38.812 -7.479 0.708 0.00 0.00 +0.000 HD +ATOM 369 CA ALA 193 -38.095 -7.481 2.800 0.00 0.00 +0.000 C +ATOM 370 HA ALA 193 -37.816 -6.717 3.416 0.00 0.00 +0.000 HD +ATOM 371 CB ALA 193 -39.311 -8.131 3.428 0.00 0.00 +0.000 C +ATOM 372 HB1 ALA 193 -39.671 -8.836 2.816 0.00 0.00 +0.000 HD +ATOM 373 HB2 ALA 193 -39.057 -8.551 4.300 0.00 0.00 +0.000 HD +ATOM 374 HB3 ALA 193 -40.018 -7.441 3.588 0.00 0.00 +0.000 HD +ATOM 375 C ALA 193 -36.941 -8.491 2.737 0.00 0.00 +0.000 C +ATOM 376 O ALA 193 -36.797 -9.218 1.764 0.00 0.00 +0.000 OA +ATOM 377 N LYS 194 -36.137 -8.521 3.792 0.00 0.00 +0.000 N +ATOM 378 H LYS 194 -36.399 -7.834 4.546 0.00 0.00 +0.000 HD +ATOM 379 CA LYS 194 -35.000 -9.414 3.905 0.00 0.00 +0.000 C +ATOM 380 HA LYS 194 -34.637 -9.608 2.994 0.00 0.00 +0.000 HD +ATOM 381 CB LYS 194 -33.962 -8.782 4.828 0.00 0.00 +0.000 C +ATOM 382 HB2 LYS 194 -34.314 -7.891 5.142 0.00 0.00 +0.000 HD +ATOM 383 HB3 LYS 194 -33.850 -9.376 5.637 0.00 0.00 +0.000 HD +ATOM 384 CG LYS 194 -32.552 -8.537 4.238 0.00 0.00 +0.000 C +ATOM 385 HG2 LYS 194 -32.228 -9.382 3.836 0.00 0.00 +0.000 HD +ATOM 386 HG3 LYS 194 -32.614 -7.819 3.560 0.00 0.00 +0.000 HD +ATOM 387 CD LYS 194 -31.598 -8.106 5.345 0.00 0.00 +0.000 C +ATOM 388 HD2 LYS 194 -30.683 -8.034 4.977 0.00 0.00 +0.000 HD +ATOM 389 HD3 LYS 194 -31.904 -7.246 5.723 0.00 0.00 +0.000 HD +ATOM 390 CE LYS 194 -31.578 -9.150 6.480 0.00 0.00 +0.000 C +ATOM 391 HE2 LYS 194 -31.475 -8.660 7.367 0.00 0.00 +0.000 HD +ATOM 392 HE3 LYS 194 -32.485 -9.612 6.509 0.00 0.00 +0.000 HD +ATOM 393 NZ LYS 194 -30.502 -10.219 6.399 0.00 0.00 +0.000 N +ATOM 394 HZ1 LYS 194 -29.673 -9.866 6.821 0.00 0.00 +0.000 HD +ATOM 395 HZ2 LYS 194 -30.821 -11.027 6.884 0.00 0.00 +0.000 HD +ATOM 396 HZ3 LYS 194 -30.339 -10.432 5.441 0.00 0.00 +0.000 HD +ATOM 397 C LYS 194 -35.461 -10.736 4.534 0.00 0.00 +0.000 C +ATOM 398 O LYS 194 -36.205 -10.719 5.517 0.00 0.00 +0.000 OA +ATOM 399 N ASP 195 -35.042 -11.872 3.975 0.00 0.00 +0.000 N +ATOM 400 H ASP 195 -34.456 -11.759 3.133 0.00 0.00 +0.000 HD +ATOM 401 CA ASP 195 -35.407 -13.175 4.543 0.00 0.00 +0.000 C +ATOM 402 HA ASP 195 -36.292 -13.075 4.961 0.00 0.00 +0.000 HD +ATOM 403 CB ASP 195 -35.264 -14.296 3.512 0.00 0.00 +0.000 C +ATOM 404 HB2 ASP 195 -35.753 -14.024 2.693 0.00 0.00 +0.000 HD +ATOM 405 HB3 ASP 195 -34.299 -14.418 3.323 0.00 0.00 +0.000 HD +ATOM 406 CG ASP 195 -35.836 -15.608 4.010 0.00 0.00 +0.000 C +ATOM 407 OD1 ASP 195 -35.806 -15.841 5.242 0.00 0.00 +0.000 OA +ATOM 408 OD2 ASP 195 -36.306 -16.414 3.179 0.00 0.00 +0.000 OA +ATOM 409 C ASP 195 -34.400 -13.409 5.671 0.00 0.00 +0.000 C +ATOM 410 O ASP 195 -33.192 -13.293 5.460 0.00 0.00 +0.000 OA +ATOM 411 N THR 196 -34.881 -13.764 6.859 0.00 0.00 +0.000 N +ATOM 412 H THR 196 -35.908 -13.876 6.902 0.00 0.00 +0.000 HD +ATOM 413 CA THR 196 -33.995 -13.974 8.004 0.00 0.00 +0.000 C +ATOM 414 HA THR 196 -33.160 -13.396 7.871 0.00 0.00 +0.000 HD +ATOM 415 CB THR 196 -34.663 -13.462 9.298 0.00 0.00 +0.000 C +ATOM 416 HB THR 196 -34.741 -12.447 9.246 0.00 0.00 +0.000 HD +ATOM 417 CG2 THR 196 -36.039 -14.081 9.476 0.00 0.00 +0.000 C +ATOM 418 HG21 THR 196 -36.744 -13.372 9.400 0.00 0.00 +0.000 HD +ATOM 419 HG22 THR 196 -36.195 -14.775 8.769 0.00 0.00 +0.000 HD +ATOM 420 HG23 THR 196 -36.105 -14.513 10.379 0.00 0.00 +0.000 HD +ATOM 421 OG1 THR 196 -33.838 -13.793 10.419 0.00 0.00 +0.000 OA +ATOM 422 HG1 THR 196 -33.244 -14.575 10.199 0.00 0.00 +0.000 HD +ATOM 423 C THR 196 -33.533 -15.420 8.225 0.00 0.00 +0.000 C +ATOM 424 O THR 196 -32.717 -15.686 9.106 0.00 0.00 +0.000 OA +ATOM 425 N LYS 197 -34.047 -16.354 7.436 0.00 0.00 +0.000 N +ATOM 426 H LYS 197 -34.728 -16.019 6.736 0.00 0.00 +0.000 HD +ATOM 427 CA LYS 197 -33.653 -17.761 7.574 0.00 0.00 +0.000 C +ATOM 428 HA LYS 197 -33.695 -18.013 8.550 0.00 0.00 +0.000 HD +ATOM 429 CB LYS 197 -34.582 -18.672 6.768 0.00 0.00 +0.000 C +ATOM 430 HB2 LYS 197 -34.700 -18.260 5.855 0.00 0.00 +0.000 HD +ATOM 431 HB3 LYS 197 -34.116 -19.560 6.652 0.00 0.00 +0.000 HD +ATOM 432 CG LYS 197 -35.945 -18.920 7.360 0.00 0.00 +0.000 C +ATOM 433 HG2 LYS 197 -35.859 -19.468 8.180 0.00 0.00 +0.000 HD +ATOM 434 HG3 LYS 197 -36.390 -18.057 7.552 0.00 0.00 +0.000 HD +ATOM 435 CD LYS 197 -36.792 -19.691 6.345 0.00 0.00 +0.000 C +ATOM 436 HD2 LYS 197 -36.349 -20.560 6.155 0.00 0.00 +0.000 HD +ATOM 437 HD3 LYS 197 -37.697 -19.837 6.728 0.00 0.00 +0.000 HD +ATOM 438 CE LYS 197 -36.937 -18.921 5.034 0.00 0.00 +0.000 C +ATOM 439 HE2 LYS 197 -37.346 -18.024 5.233 0.00 0.00 +0.000 HD +ATOM 440 HE3 LYS 197 -36.021 -18.775 4.645 0.00 0.00 +0.000 HD +ATOM 441 NZ LYS 197 -37.781 -19.638 4.047 0.00 0.00 +0.000 N +ATOM 442 HZ1 LYS 197 -37.836 -19.103 3.203 0.00 0.00 +0.000 HD +ATOM 443 HZ2 LYS 197 -37.377 -20.532 3.849 0.00 0.00 +0.000 HD +ATOM 444 HZ3 LYS 197 -38.700 -19.763 4.422 0.00 0.00 +0.000 HD +ATOM 445 C LYS 197 -32.235 -17.999 7.066 0.00 0.00 +0.000 C +ATOM 446 O LYS 197 -31.797 -17.352 6.116 0.00 0.00 +0.000 OA +ATOM 447 N PRO 198 -31.498 -18.937 7.693 0.00 0.00 +0.000 N +ATOM 448 CD PRO 198 -31.793 -19.679 8.933 0.00 0.00 +0.000 C +ATOM 449 HD2 PRO 198 -32.731 -20.015 8.924 0.00 0.00 +0.000 HD +ATOM 450 HD3 PRO 198 -31.646 -19.099 9.731 0.00 0.00 +0.000 HD +ATOM 451 CG PRO 198 -30.801 -20.803 8.874 0.00 0.00 +0.000 C +ATOM 452 HG2 PRO 198 -31.115 -21.527 8.265 0.00 0.00 +0.000 HD +ATOM 453 HG3 PRO 198 -30.624 -21.173 9.782 0.00 0.00 +0.000 HD +ATOM 454 CB PRO 198 -29.581 -20.144 8.326 0.00 0.00 +0.000 C +ATOM 455 HB2 PRO 198 -28.955 -20.816 7.932 0.00 0.00 +0.000 HD +ATOM 456 HB3 PRO 198 -29.107 -19.620 9.032 0.00 0.00 +0.000 HD +ATOM 457 CA PRO 198 -30.132 -19.217 7.241 0.00 0.00 +0.000 C +ATOM 458 HA PRO 198 -29.578 -18.369 7.242 0.00 0.00 +0.000 HD +ATOM 459 C PRO 198 -30.105 -19.878 5.874 0.00 0.00 +0.000 C +ATOM 460 O PRO 198 -31.050 -20.558 5.479 0.00 0.00 +0.000 OA +ATOM 461 N MET 199 -29.018 -19.659 5.146 0.00 0.00 +0.000 N +ATOM 462 H MET 199 -28.313 -19.040 5.584 0.00 0.00 +0.000 HD +ATOM 463 CA MET 199 -28.864 -20.261 3.834 0.00 0.00 +0.000 C +ATOM 464 HA MET 199 -29.708 -20.131 3.324 0.00 0.00 +0.000 HD +ATOM 465 CB MET 199 -27.650 -19.656 3.126 0.00 0.00 +0.000 C +ATOM 466 HB2 MET 199 -26.845 -19.720 3.736 0.00 0.00 +0.000 HD +ATOM 467 HB3 MET 199 -27.449 -20.196 2.295 0.00 0.00 +0.000 HD +ATOM 468 CG MET 199 -27.807 -18.184 2.705 0.00 0.00 +0.000 C +ATOM 469 HG2 MET 199 -28.163 -17.663 3.515 0.00 0.00 +0.000 HD +ATOM 470 HG3 MET 199 -26.869 -17.806 2.530 0.00 0.00 +0.000 HD +ATOM 471 SD MET 199 -28.869 -17.976 1.279 0.00 0.00 +0.000 S +ATOM 472 CE MET 199 -29.039 -16.192 1.184 0.00 0.00 +0.000 C +ATOM 473 HE1 MET 199 -28.557 -15.769 1.952 0.00 0.00 +0.000 HD +ATOM 474 HE2 MET 199 -28.647 -15.864 0.324 0.00 0.00 +0.000 HD +ATOM 475 HE3 MET 199 -30.008 -15.946 1.223 0.00 0.00 +0.000 HD +ATOM 476 C MET 199 -28.659 -21.757 4.034 0.00 0.00 +0.000 C +ATOM 477 O MET 199 -28.502 -22.222 5.167 0.00 0.00 +0.000 OA +ATOM 478 N GLY 200 -28.675 -22.519 2.944 0.00 0.00 +0.000 N +ATOM 479 H GLY 200 -28.837 -22.025 2.059 0.00 0.00 +0.000 HD +ATOM 480 CA GLY 200 -28.471 -23.950 3.064 0.00 0.00 +0.000 C +ATOM 481 HA2 GLY 200 -29.090 -24.324 3.751 0.00 0.00 +0.000 HD +ATOM 482 HA3 GLY 200 -28.639 -24.391 2.185 0.00 0.00 +0.000 HD +ATOM 483 C GLY 200 -27.036 -24.195 3.488 0.00 0.00 +0.000 C +ATOM 484 O GLY 200 -26.294 -23.225 3.695 0.00 0.00 +0.000 OA +ATOM 485 N SER 202 -22.146 -24.130 3.748 0.00 0.00 +0.000 NA +ATOM 486 H SER 202 -22.234 -23.719 4.664 0.00 0.00 +0.000 HD +ATOM 487 CA SER 202 -22.622 -23.510 2.517 0.00 0.00 +0.000 C +ATOM 488 HA SER 202 -21.830 -23.349 1.919 0.00 0.00 +0.000 HD +ATOM 489 CB SER 202 -23.636 -24.435 1.814 0.00 0.00 +0.000 C +ATOM 490 HB2 SER 202 -24.414 -24.578 2.423 0.00 0.00 +0.000 HD +ATOM 491 HB3 SER 202 -23.943 -23.992 0.974 0.00 0.00 +0.000 HD +ATOM 492 OG SER 202 -23.074 -25.710 1.481 0.00 0.00 +0.000 OA +ATOM 493 HG SER 202 -22.978 -25.775 0.491 0.00 0.00 +0.000 HD +ATOM 494 C SER 202 -23.272 -22.153 2.804 0.00 0.00 +0.000 C +ATOM 495 O SER 202 -23.310 -21.276 1.936 0.00 0.00 +0.000 OA +ATOM 496 N GLY 203 -23.777 -21.984 4.021 0.00 0.00 +0.000 N +ATOM 497 H GLY 203 -23.655 -22.788 4.661 0.00 0.00 +0.000 HD +ATOM 498 CA GLY 203 -24.441 -20.751 4.383 0.00 0.00 +0.000 C +ATOM 499 HA2 GLY 203 -25.256 -20.613 3.746 0.00 0.00 +0.000 HD +ATOM 500 HA3 GLY 203 -24.892 -20.877 5.315 0.00 0.00 +0.000 HD +ATOM 501 C GLY 203 -23.633 -19.469 4.412 0.00 0.00 +0.000 C +ATOM 502 O GLY 203 -24.079 -18.443 3.888 0.00 0.00 +0.000 OA +ATOM 503 N ALA 204 -22.455 -19.505 5.029 0.00 0.00 +0.000 N +ATOM 504 H ALA 204 -22.188 -20.427 5.414 0.00 0.00 +0.000 HD +ATOM 505 CA ALA 204 -21.620 -18.309 5.138 0.00 0.00 +0.000 C +ATOM 506 HA ALA 204 -22.069 -17.664 5.793 0.00 0.00 +0.000 HD +ATOM 507 CB ALA 204 -20.295 -18.660 5.774 0.00 0.00 +0.000 C +ATOM 508 HB1 ALA 204 -19.693 -19.083 5.094 0.00 0.00 +0.000 HD +ATOM 509 HB2 ALA 204 -19.858 -17.831 6.128 0.00 0.00 +0.000 HD +ATOM 510 HB3 ALA 204 -20.440 -19.302 6.529 0.00 0.00 +0.000 HD +ATOM 511 C ALA 204 -21.387 -17.579 3.827 0.00 0.00 +0.000 C +ATOM 512 O ALA 204 -21.739 -16.404 3.713 0.00 0.00 +0.000 OA +ATOM 513 N THR 205 -20.775 -18.251 2.859 0.00 0.00 +0.000 N +ATOM 514 H THR 205 -20.498 -19.217 3.100 0.00 0.00 +0.000 HD +ATOM 515 CA THR 205 -20.532 -17.633 1.568 0.00 0.00 +0.000 C +ATOM 516 HA THR 205 -19.930 -16.829 1.705 0.00 0.00 +0.000 HD +ATOM 517 CB THR 205 -19.838 -18.600 0.603 0.00 0.00 +0.000 C +ATOM 518 HB THR 205 -20.388 -19.459 0.541 0.00 0.00 +0.000 HD +ATOM 519 CG2 THR 205 -19.688 -17.969 -0.767 0.00 0.00 +0.000 C +ATOM 520 HG21 THR 205 -18.922 -18.393 -1.258 0.00 0.00 +0.000 HD +ATOM 521 HG22 THR 205 -20.529 -18.100 -1.299 0.00 0.00 +0.000 HD +ATOM 522 HG23 THR 205 -19.511 -16.986 -0.674 0.00 0.00 +0.000 HD +ATOM 523 OG1 THR 205 -18.539 -18.940 1.106 0.00 0.00 +0.000 OA +ATOM 524 HG1 THR 205 -17.858 -18.903 0.367 0.00 0.00 +0.000 HD +ATOM 525 C THR 205 -21.813 -17.161 0.908 0.00 0.00 +0.000 C +ATOM 526 O THR 205 -21.870 -16.049 0.377 0.00 0.00 +0.000 OA +ATOM 527 N SER 206 -22.849 -17.987 0.930 0.00 0.00 +0.000 N +ATOM 528 H SER 206 -22.712 -18.880 1.388 0.00 0.00 +0.000 HD +ATOM 529 CA SER 206 -24.082 -17.545 0.301 0.00 0.00 +0.000 C +ATOM 530 HA SER 206 -23.894 -17.344 -0.664 0.00 0.00 +0.000 HD +ATOM 531 CB SER 206 -25.163 -18.627 0.400 0.00 0.00 +0.000 C +ATOM 532 HB2 SER 206 -25.271 -18.884 1.360 0.00 0.00 +0.000 HD +ATOM 533 HB3 SER 206 -26.023 -18.250 0.057 0.00 0.00 +0.000 HD +ATOM 534 OG SER 206 -24.833 -19.780 -0.352 0.00 0.00 +0.000 OA +ATOM 535 HG SER 206 -24.317 -20.416 0.221 0.00 0.00 +0.000 HD +ATOM 536 C SER 206 -24.580 -16.241 0.955 0.00 0.00 +0.000 C +ATOM 537 O SER 206 -25.060 -15.346 0.260 0.00 0.00 +0.000 OA +ATOM 538 N ARG 207 -24.463 -16.128 2.280 0.00 0.00 +0.000 N +ATOM 539 H ARG 207 -24.026 -16.932 2.753 0.00 0.00 +0.000 HD +ATOM 540 CA ARG 207 -24.935 -14.931 2.966 0.00 0.00 +0.000 C +ATOM 541 HA ARG 207 -25.912 -14.791 2.736 0.00 0.00 +0.000 HD +ATOM 542 CB ARG 207 -24.870 -15.099 4.487 0.00 0.00 +0.000 C +ATOM 543 HB2 ARG 207 -25.449 -15.865 4.741 0.00 0.00 +0.000 HD +ATOM 544 HB3 ARG 207 -23.926 -15.277 4.741 0.00 0.00 +0.000 HD +ATOM 545 CG ARG 207 -25.343 -13.873 5.257 0.00 0.00 +0.000 C +ATOM 546 HG2 ARG 207 -24.726 -13.107 5.076 0.00 0.00 +0.000 HD +ATOM 547 HG3 ARG 207 -26.268 -13.633 4.965 0.00 0.00 +0.000 HD +ATOM 548 CD ARG 207 -25.374 -14.106 6.768 0.00 0.00 +0.000 C +ATOM 549 HD2 ARG 207 -25.475 -13.222 7.213 0.00 0.00 +0.000 HD +ATOM 550 HD3 ARG 207 -26.156 -14.687 6.972 0.00 0.00 +0.000 HD +ATOM 551 NE ARG 207 -24.150 -14.753 7.248 0.00 0.00 +0.000 N +ATOM 552 HE ARG 207 -23.369 -14.165 7.482 0.00 0.00 +0.000 HD +ATOM 553 CZ ARG 207 -24.008 -16.068 7.394 0.00 0.00 +0.000 C +ATOM 554 NH1 ARG 207 -25.010 -16.887 7.093 0.00 0.00 +0.000 N +ATOM 555 HH11 ARG 207 -25.871 -16.536 6.737 0.00 0.00 +0.000 HD +ATOM 556 HH12 ARG 207 -24.897 -17.879 7.226 0.00 0.00 +0.000 HD +ATOM 557 NH2 ARG 207 -22.882 -16.570 7.876 0.00 0.00 +0.000 N +ATOM 558 HH21 ARG 207 -22.127 -15.951 8.113 0.00 0.00 +0.000 HD +ATOM 559 HH22 ARG 207 -22.779 -17.553 8.003 0.00 0.00 +0.000 HD +ATOM 560 C ARG 207 -24.159 -13.691 2.565 0.00 0.00 +0.000 C +ATOM 561 O ARG 207 -24.739 -12.622 2.380 0.00 0.00 +0.000 OA +ATOM 562 N LYS 208 -22.847 -13.824 2.452 0.00 0.00 +0.000 N +ATOM 563 H LYS 208 -22.477 -14.764 2.651 0.00 0.00 +0.000 HD +ATOM 564 CA LYS 208 -22.031 -12.689 2.070 0.00 0.00 +0.000 C +ATOM 565 HA LYS 208 -22.285 -11.895 2.630 0.00 0.00 +0.000 HD +ATOM 566 CB LYS 208 -20.548 -12.995 2.327 0.00 0.00 +0.000 C +ATOM 567 HB2 LYS 208 -20.249 -13.677 1.671 0.00 0.00 +0.000 HD +ATOM 568 HB3 LYS 208 -20.030 -12.155 2.219 0.00 0.00 +0.000 HD +ATOM 569 CG LYS 208 -20.272 -13.545 3.743 0.00 0.00 +0.000 C +ATOM 570 HG2 LYS 208 -20.522 -12.847 4.412 0.00 0.00 +0.000 HD +ATOM 571 HG3 LYS 208 -20.829 -14.361 3.884 0.00 0.00 +0.000 HD +ATOM 572 CD LYS 208 -18.793 -13.913 3.941 0.00 0.00 +0.000 C +ATOM 573 HD2 LYS 208 -18.726 -14.565 4.691 0.00 0.00 +0.000 HD +ATOM 574 HD3 LYS 208 -18.451 -14.319 3.099 0.00 0.00 +0.000 HD +ATOM 575 CE LYS 208 -17.930 -12.693 4.278 0.00 0.00 +0.000 C +ATOM 576 HE2 LYS 208 -16.968 -12.964 4.247 0.00 0.00 +0.000 HD +ATOM 577 HE3 LYS 208 -18.098 -11.984 3.594 0.00 0.00 +0.000 HD +ATOM 578 NZ LYS 208 -18.254 -12.166 5.628 0.00 0.00 +0.000 N +ATOM 579 HZ1 LYS 208 -18.502 -12.924 6.231 0.00 0.00 +0.000 HD +ATOM 580 HZ2 LYS 208 -17.457 -11.691 6.000 0.00 0.00 +0.000 HD +ATOM 581 HZ3 LYS 208 -19.022 -11.528 5.561 0.00 0.00 +0.000 HD +ATOM 582 C LYS 208 -22.269 -12.344 0.603 0.00 0.00 +0.000 C +ATOM 583 O LYS 208 -22.216 -11.180 0.220 0.00 0.00 +0.000 OA +ATOM 584 N ALA 209 -22.535 -13.358 -0.219 0.00 0.00 +0.000 N +ATOM 585 H ALA 209 -22.551 -14.292 0.224 0.00 0.00 +0.000 HD +ATOM 586 CA ALA 209 -22.784 -13.136 -1.649 0.00 0.00 +0.000 C +ATOM 587 HA ALA 209 -22.020 -12.620 -2.033 0.00 0.00 +0.000 HD +ATOM 588 CB ALA 209 -22.907 -14.491 -2.387 0.00 0.00 +0.000 C +ATOM 589 HB1 ALA 209 -23.859 -14.782 -2.368 0.00 0.00 +0.000 HD +ATOM 590 HB2 ALA 209 -22.604 -14.373 -3.328 0.00 0.00 +0.000 HD +ATOM 591 HB3 ALA 209 -22.335 -15.162 -1.925 0.00 0.00 +0.000 HD +ATOM 592 C ALA 209 -24.065 -12.313 -1.817 0.00 0.00 +0.000 C +ATOM 593 O ALA 209 -24.118 -11.411 -2.654 0.00 0.00 +0.000 OA +ATOM 594 N LEU 210 -25.086 -12.614 -1.014 0.00 0.00 +0.000 N +ATOM 595 H LEU 210 -24.914 -13.393 -0.359 0.00 0.00 +0.000 HD +ATOM 596 CA LEU 210 -26.340 -11.872 -1.086 0.00 0.00 +0.000 C +ATOM 597 HA LEU 210 -26.663 -11.880 -2.037 0.00 0.00 +0.000 HD +ATOM 598 CB LEU 210 -27.393 -12.512 -0.177 0.00 0.00 +0.000 C +ATOM 599 HB2 LEU 210 -27.535 -13.450 -0.489 0.00 0.00 +0.000 HD +ATOM 600 HB3 LEU 210 -27.031 -12.517 0.753 0.00 0.00 +0.000 HD +ATOM 601 CG LEU 210 -28.766 -11.836 -0.129 0.00 0.00 +0.000 C +ATOM 602 HG LEU 210 -28.666 -10.918 0.234 0.00 0.00 +0.000 HD +ATOM 603 CD1 LEU 210 -29.339 -11.757 -1.551 0.00 0.00 +0.000 C +ATOM 604 HD11 LEU 210 -29.430 -12.680 -1.919 0.00 0.00 +0.000 HD +ATOM 605 HD12 LEU 210 -30.234 -11.316 -1.520 0.00 0.00 +0.000 HD +ATOM 606 HD13 LEU 210 -28.720 -11.224 -2.125 0.00 0.00 +0.000 HD +ATOM 607 CD2 LEU 210 -29.717 -12.614 0.785 0.00 0.00 +0.000 C +ATOM 608 HD21 LEU 210 -29.336 -12.644 1.708 0.00 0.00 +0.000 HD +ATOM 609 HD22 LEU 210 -30.605 -12.157 0.802 0.00 0.00 +0.000 HD +ATOM 610 HD23 LEU 210 -29.824 -13.544 0.435 0.00 0.00 +0.000 HD +ATOM 611 C LEU 210 -26.126 -10.426 -0.661 0.00 0.00 +0.000 C +ATOM 612 O LEU 210 -26.672 -9.500 -1.267 0.00 0.00 +0.000 OA +ATOM 613 N GLU 211 -25.336 -10.239 0.392 0.00 0.00 +0.000 N +ATOM 614 H GLU 211 -24.941 -11.106 0.802 0.00 0.00 +0.000 HD +ATOM 615 CA GLU 211 -25.060 -8.902 0.914 0.00 0.00 +0.000 C +ATOM 616 HA GLU 211 -25.921 -8.451 1.161 0.00 0.00 +0.000 HD +ATOM 617 CB GLU 211 -24.248 -9.010 2.216 0.00 0.00 +0.000 C +ATOM 618 HB2 GLU 211 -23.607 -9.734 2.109 0.00 0.00 +0.000 HD +ATOM 619 HB3 GLU 211 -23.845 -8.143 2.390 0.00 0.00 +0.000 HD +ATOM 620 CG GLU 211 -25.141 -9.355 3.414 0.00 0.00 +0.000 C +ATOM 621 HG2 GLU 211 -25.576 -8.524 3.721 0.00 0.00 +0.000 HD +ATOM 622 HG3 GLU 211 -25.805 -10.024 3.121 0.00 0.00 +0.000 HD +ATOM 623 CD GLU 211 -24.396 -9.950 4.615 0.00 0.00 +0.000 C +ATOM 624 OE1 GLU 211 -23.160 -10.134 4.545 0.00 0.00 +0.000 OA +ATOM 625 OE2 GLU 211 -25.066 -10.236 5.638 0.00 0.00 +0.000 OA +ATOM 626 C GLU 211 -24.331 -8.066 -0.137 0.00 0.00 +0.000 C +ATOM 627 O GLU 211 -24.606 -6.878 -0.308 0.00 0.00 +0.000 OA +ATOM 628 N THR 212 -23.403 -8.695 -0.850 0.00 0.00 +0.000 N +ATOM 629 H THR 212 -23.261 -9.693 -0.597 0.00 0.00 +0.000 HD +ATOM 630 CA THR 212 -22.652 -8.019 -1.903 0.00 0.00 +0.000 C +ATOM 631 HA THR 212 -22.234 -7.197 -1.521 0.00 0.00 +0.000 HD +ATOM 632 CB THR 212 -21.593 -8.951 -2.489 0.00 0.00 +0.000 C +ATOM 633 HB THR 212 -22.050 -9.782 -2.864 0.00 0.00 +0.000 HD +ATOM 634 CG2 THR 212 -20.804 -8.250 -3.592 0.00 0.00 +0.000 C +ATOM 635 HG21 THR 212 -20.406 -8.932 -4.208 0.00 0.00 +0.000 HD +ATOM 636 HG22 THR 212 -21.413 -7.649 -4.113 0.00 0.00 +0.000 HD +ATOM 637 HG23 THR 212 -20.069 -7.704 -3.186 0.00 0.00 +0.000 HD +ATOM 638 OG1 THR 212 -20.707 -9.364 -1.445 0.00 0.00 +0.000 OA +ATOM 639 HG1 THR 212 -21.163 -10.025 -0.839 0.00 0.00 +0.000 HD +ATOM 640 C THR 212 -23.621 -7.598 -3.006 0.00 0.00 +0.000 C +ATOM 641 O THR 212 -23.522 -6.497 -3.545 0.00 0.00 +0.000 OA +ATOM 642 N LEU 213 -24.557 -8.483 -3.353 0.00 0.00 +0.000 N +ATOM 643 H LEU 213 -24.524 -9.381 -2.857 0.00 0.00 +0.000 HD +ATOM 644 CA LEU 213 -25.546 -8.147 -4.381 0.00 0.00 +0.000 C +ATOM 645 HA LEU 213 -25.055 -7.882 -5.224 0.00 0.00 +0.000 HD +ATOM 646 CB LEU 213 -26.428 -9.358 -4.726 0.00 0.00 +0.000 C +ATOM 647 HB2 LEU 213 -26.596 -9.861 -3.876 0.00 0.00 +0.000 HD +ATOM 648 HB3 LEU 213 -27.295 -9.008 -5.081 0.00 0.00 +0.000 HD +ATOM 649 CG LEU 213 -25.884 -10.357 -5.747 0.00 0.00 +0.000 C +ATOM 650 HG LEU 213 -24.983 -10.658 -5.458 0.00 0.00 +0.000 HD +ATOM 651 CD1 LEU 213 -26.821 -11.552 -5.819 0.00 0.00 +0.000 C +ATOM 652 HD11 LEU 213 -27.732 -11.247 -6.099 0.00 0.00 +0.000 HD +ATOM 653 HD12 LEU 213 -26.472 -12.212 -6.486 0.00 0.00 +0.000 HD +ATOM 654 HD13 LEU 213 -26.878 -11.987 -4.920 0.00 0.00 +0.000 HD +ATOM 655 CD2 LEU 213 -25.750 -9.692 -7.117 0.00 0.00 +0.000 C +ATOM 656 HD21 LEU 213 -25.122 -8.917 -7.049 0.00 0.00 +0.000 HD +ATOM 657 HD22 LEU 213 -25.394 -10.356 -7.774 0.00 0.00 +0.000 HD +ATOM 658 HD23 LEU 213 -26.647 -9.371 -7.418 0.00 0.00 +0.000 HD +ATOM 659 C LEU 213 -26.448 -6.975 -3.966 0.00 0.00 +0.000 C +ATOM 660 O LEU 213 -26.835 -6.171 -4.802 0.00 0.00 +0.000 OA +ATOM 661 N ARG 214 -26.796 -6.887 -2.684 0.00 0.00 +0.000 N +ATOM 662 H ARG 214 -26.430 -7.627 -2.072 0.00 0.00 +0.000 HD +ATOM 663 CA ARG 214 -27.649 -5.788 -2.220 0.00 0.00 +0.000 C +ATOM 664 HA ARG 214 -28.475 -5.762 -2.789 0.00 0.00 +0.000 HD +ATOM 665 CB ARG 214 -28.025 -5.958 -0.756 0.00 0.00 +0.000 C +ATOM 666 HB2 ARG 214 -27.182 -6.127 -0.238 0.00 0.00 +0.000 HD +ATOM 667 HB3 ARG 214 -28.433 -5.097 -0.439 0.00 0.00 +0.000 HD +ATOM 668 CG ARG 214 -28.986 -7.069 -0.472 0.00 0.00 +0.000 C +ATOM 669 HG2 ARG 214 -29.854 -6.889 -0.908 0.00 0.00 +0.000 HD +ATOM 670 HG3 ARG 214 -28.606 -7.932 -0.769 0.00 0.00 +0.000 HD +ATOM 671 CD ARG 214 -29.212 -7.141 1.020 0.00 0.00 +0.000 C +ATOM 672 HD2 ARG 214 -28.324 -7.169 1.469 0.00 0.00 +0.000 HD +ATOM 673 HD3 ARG 214 -29.714 -6.327 1.299 0.00 0.00 +0.000 HD +ATOM 674 NE ARG 214 -29.974 -8.325 1.382 0.00 0.00 +0.000 N +ATOM 675 HE ARG 214 -30.629 -8.690 0.709 0.00 0.00 +0.000 HD +ATOM 676 CZ ARG 214 -29.859 -8.952 2.541 0.00 0.00 +0.000 C +ATOM 677 NH1 ARG 214 -29.010 -8.502 3.450 0.00 0.00 +0.000 N +ATOM 678 HH11 ARG 214 -28.462 -7.685 3.296 0.00 0.00 +0.000 HD +ATOM 679 HH12 ARG 214 -28.912 -8.997 4.327 0.00 0.00 +0.000 HD +ATOM 680 NH2 ARG 214 -30.589 -10.032 2.782 0.00 0.00 +0.000 N +ATOM 681 HH21 ARG 214 -31.240 -10.358 2.092 0.00 0.00 +0.000 HD +ATOM 682 HH22 ARG 214 -30.494 -10.521 3.648 0.00 0.00 +0.000 HD +ATOM 683 C ARG 214 -26.916 -4.468 -2.353 0.00 0.00 +0.000 C +ATOM 684 O ARG 214 -27.527 -3.411 -2.529 0.00 0.00 +0.000 OA +ATOM 685 N ARG 215 -25.598 -4.531 -2.240 0.00 0.00 +0.000 N +ATOM 686 H ARG 215 -25.218 -5.484 -2.074 0.00 0.00 +0.000 HD +ATOM 687 CA ARG 215 -24.772 -3.343 -2.344 0.00 0.00 +0.000 C +ATOM 688 HA ARG 215 -25.251 -2.571 -1.903 0.00 0.00 +0.000 HD +ATOM 689 CB ARG 215 -23.456 -3.579 -1.595 0.00 0.00 +0.000 C +ATOM 690 HB2 ARG 215 -23.668 -3.684 -0.620 0.00 0.00 +0.000 HD +ATOM 691 HB3 ARG 215 -23.054 -4.433 -1.934 0.00 0.00 +0.000 HD +ATOM 692 CG ARG 215 -22.404 -2.483 -1.729 0.00 0.00 +0.000 C +ATOM 693 HG2 ARG 215 -21.960 -2.554 -2.610 0.00 0.00 +0.000 HD +ATOM 694 HG3 ARG 215 -22.830 -1.598 -1.612 0.00 0.00 +0.000 HD +ATOM 695 CD ARG 215 -21.336 -2.642 -0.644 0.00 0.00 +0.000 C +ATOM 696 HD2 ARG 215 -20.586 -2.020 -0.858 0.00 0.00 +0.000 HD +ATOM 697 HD3 ARG 215 -21.748 -2.390 0.229 0.00 0.00 +0.000 HD +ATOM 698 NE ARG 215 -20.817 -4.012 -0.557 0.00 0.00 +0.000 N +ATOM 699 HE ARG 215 -21.280 -4.645 0.082 0.00 0.00 +0.000 HD +ATOM 700 CZ ARG 215 -19.786 -4.485 -1.253 0.00 0.00 +0.000 C +ATOM 701 NH1 ARG 215 -19.136 -3.710 -2.101 0.00 0.00 +0.000 N +ATOM 702 HH11 ARG 215 -19.389 -2.752 -2.223 0.00 0.00 +0.000 HD +ATOM 703 HH12 ARG 215 -18.369 -4.086 -2.636 0.00 0.00 +0.000 HD +ATOM 704 NH2 ARG 215 -19.408 -5.743 -1.095 0.00 0.00 +0.000 N +ATOM 705 HH21 ARG 215 -19.886 -6.331 -0.437 0.00 0.00 +0.000 HD +ATOM 706 HH22 ARG 215 -18.646 -6.112 -1.627 0.00 0.00 +0.000 HD +ATOM 707 C ARG 215 -24.504 -2.978 -3.798 0.00 0.00 +0.000 C +ATOM 708 O ARG 215 -24.844 -1.875 -4.230 0.00 0.00 +0.000 OA +ATOM 709 N VAL 216 -23.937 -3.911 -4.560 0.00 0.00 +0.000 N +ATOM 710 H VAL 216 -23.767 -4.818 -4.080 0.00 0.00 +0.000 HD +ATOM 711 CA VAL 216 -23.588 -3.665 -5.956 0.00 0.00 +0.000 C +ATOM 712 HA VAL 216 -23.173 -2.734 -6.016 0.00 0.00 +0.000 HD +ATOM 713 CB VAL 216 -22.501 -4.669 -6.424 0.00 0.00 +0.000 C +ATOM 714 HB VAL 216 -22.904 -5.579 -6.390 0.00 0.00 +0.000 HD +ATOM 715 CG1 VAL 216 -22.107 -4.403 -7.864 0.00 0.00 +0.000 C +ATOM 716 HG11 VAL 216 -21.477 -5.115 -8.178 0.00 0.00 +0.000 HD +ATOM 717 HG12 VAL 216 -22.924 -4.406 -8.443 0.00 0.00 +0.000 HD +ATOM 718 HG13 VAL 216 -21.658 -3.511 -7.931 0.00 0.00 +0.000 HD +ATOM 719 CG2 VAL 216 -21.285 -4.550 -5.521 0.00 0.00 +0.000 C +ATOM 720 HG21 VAL 216 -21.276 -5.314 -4.875 0.00 0.00 +0.000 HD +ATOM 721 HG22 VAL 216 -20.455 -4.572 -6.079 0.00 0.00 +0.000 HD +ATOM 722 HG23 VAL 216 -21.329 -3.686 -5.018 0.00 0.00 +0.000 HD +ATOM 723 C VAL 216 -24.770 -3.707 -6.922 0.00 0.00 +0.000 C +ATOM 724 O VAL 216 -24.858 -2.883 -7.834 0.00 0.00 +0.000 OA +ATOM 725 N GLY 217 -25.667 -4.672 -6.741 0.00 0.00 +0.000 N +ATOM 726 H GLY 217 -25.482 -5.307 -5.955 0.00 0.00 +0.000 HD +ATOM 727 CA GLY 217 -26.813 -4.773 -7.627 0.00 0.00 +0.000 C +ATOM 728 HA2 GLY 217 -26.491 -4.980 -8.572 0.00 0.00 +0.000 HD +ATOM 729 HA3 GLY 217 -27.391 -5.563 -7.341 0.00 0.00 +0.000 HD +ATOM 730 C GLY 217 -27.671 -3.518 -7.660 0.00 0.00 +0.000 C +ATOM 731 O GLY 217 -28.157 -3.111 -8.712 0.00 0.00 +0.000 OA +ATOM 732 N ASP 218 -27.863 -2.905 -6.500 0.00 0.00 +0.000 N +ATOM 733 H ASP 218 -27.396 -3.356 -5.686 0.00 0.00 +0.000 HD +ATOM 734 CA ASP 218 -28.667 -1.695 -6.391 0.00 0.00 +0.000 C +ATOM 735 HA ASP 218 -29.551 -1.881 -6.844 0.00 0.00 +0.000 HD +ATOM 736 CB ASP 218 -28.881 -1.366 -4.912 0.00 0.00 +0.000 C +ATOM 737 HB2 ASP 218 -27.995 -1.323 -4.472 0.00 0.00 +0.000 HD +ATOM 738 HB3 ASP 218 -29.351 -0.498 -4.852 0.00 0.00 +0.000 HD +ATOM 739 CG ASP 218 -29.725 -2.426 -4.199 0.00 0.00 +0.000 C +ATOM 740 OD1 ASP 218 -29.671 -3.617 -4.593 0.00 0.00 +0.000 OA +ATOM 741 OD2 ASP 218 -30.443 -2.080 -3.231 0.00 0.00 +0.000 OA +ATOM 742 C ASP 218 -28.031 -0.518 -7.125 0.00 0.00 +0.000 C +ATOM 743 O ASP 218 -28.728 0.302 -7.718 0.00 0.00 +0.000 OA +ATOM 744 N GLY 219 -26.705 -0.442 -7.097 0.00 0.00 +0.000 N +ATOM 745 H GLY 219 -26.229 -1.187 -6.572 0.00 0.00 +0.000 HD +ATOM 746 CA GLY 219 -26.027 0.643 -7.780 0.00 0.00 +0.000 C +ATOM 747 HA2 GLY 219 -26.419 1.527 -7.483 0.00 0.00 +0.000 HD +ATOM 748 HA3 GLY 219 -25.048 0.643 -7.527 0.00 0.00 +0.000 HD +ATOM 749 C GLY 219 -26.152 0.524 -9.291 0.00 0.00 +0.000 C +ATOM 750 O GLY 219 -26.279 1.531 -9.995 0.00 0.00 +0.000 OA +ATOM 751 N VAL 220 -26.126 -0.709 -9.786 0.00 0.00 +0.000 N +ATOM 752 H VAL 220 -26.028 -1.462 -9.075 0.00 0.00 +0.000 HD +ATOM 753 CA VAL 220 -26.228 -0.966 -11.217 0.00 0.00 +0.000 C +ATOM 754 HA VAL 220 -25.505 -0.431 -11.685 0.00 0.00 +0.000 HD +ATOM 755 CB VAL 220 -26.008 -2.470 -11.526 0.00 0.00 +0.000 C +ATOM 756 HB VAL 220 -26.700 -2.979 -11.027 0.00 0.00 +0.000 HD +ATOM 757 CG1 VAL 220 -26.224 -2.738 -13.001 0.00 0.00 +0.000 C +ATOM 758 HG11 VAL 220 -25.631 -3.488 -13.298 0.00 0.00 +0.000 HD +ATOM 759 HG12 VAL 220 -27.180 -2.990 -13.162 0.00 0.00 +0.000 HD +ATOM 760 HG13 VAL 220 -26.006 -1.916 -13.529 0.00 0.00 +0.000 HD +ATOM 761 CG2 VAL 220 -24.601 -2.884 -11.109 0.00 0.00 +0.000 C +ATOM 762 HG21 VAL 220 -24.131 -2.097 -10.711 0.00 0.00 +0.000 HD +ATOM 763 HG22 VAL 220 -24.661 -3.618 -10.434 0.00 0.00 +0.000 HD +ATOM 764 HG23 VAL 220 -24.101 -3.205 -11.913 0.00 0.00 +0.000 HD +ATOM 765 C VAL 220 -27.572 -0.539 -11.796 0.00 0.00 +0.000 C +ATOM 766 O VAL 220 -27.629 0.062 -12.865 0.00 0.00 +0.000 OA +ATOM 767 N GLN 221 -28.653 -0.860 -11.092 0.00 0.00 +0.000 N +ATOM 768 H GLN 221 -28.465 -1.365 -10.207 0.00 0.00 +0.000 HD +ATOM 769 CA GLN 221 -29.991 -0.514 -11.556 0.00 0.00 +0.000 C +ATOM 770 HA GLN 221 -30.109 -0.894 -12.482 0.00 0.00 +0.000 HD +ATOM 771 CB GLN 221 -31.044 -1.094 -10.606 0.00 0.00 +0.000 C +ATOM 772 HB2 GLN 221 -30.895 -0.710 -9.689 0.00 0.00 +0.000 HD +ATOM 773 HB3 GLN 221 -31.955 -0.815 -10.928 0.00 0.00 +0.000 HD +ATOM 774 CG GLN 221 -31.032 -2.613 -10.488 0.00 0.00 +0.000 C +ATOM 775 HG2 GLN 221 -31.214 -3.006 -11.385 0.00 0.00 +0.000 HD +ATOM 776 HG3 GLN 221 -30.136 -2.903 -10.163 0.00 0.00 +0.000 HD +ATOM 777 CD GLN 221 -32.088 -3.121 -9.514 0.00 0.00 +0.000 C +ATOM 778 OE1 GLN 221 -31.765 -3.778 -8.530 0.00 0.00 +0.000 OA +ATOM 779 NE2 GLN 221 -33.352 -2.822 -9.790 0.00 0.00 +0.000 N +ATOM 780 HE21 GLN 221 -34.106 -3.139 -9.194 0.00 0.00 +0.000 HD +ATOM 781 HE22 GLN 221 -33.552 -2.262 -10.620 0.00 0.00 +0.000 HD +ATOM 782 C GLN 221 -30.175 1.002 -11.652 0.00 0.00 +0.000 C +ATOM 783 O GLN 221 -30.936 1.487 -12.489 0.00 0.00 +0.000 OA +ATOM 784 N ARG 222 -29.482 1.740 -10.785 0.00 0.00 +0.000 N +ATOM 785 H ARG 222 -28.895 1.194 -10.123 0.00 0.00 +0.000 HD +ATOM 786 CA ARG 222 -29.554 3.198 -10.780 0.00 0.00 +0.000 C +ATOM 787 HA ARG 222 -30.497 3.478 -10.985 0.00 0.00 +0.000 HD +ATOM 788 CB ARG 222 -29.146 3.743 -9.411 0.00 0.00 +0.000 C +ATOM 789 HB2 ARG 222 -28.240 3.386 -9.190 0.00 0.00 +0.000 HD +ATOM 790 HB3 ARG 222 -29.110 4.739 -9.469 0.00 0.00 +0.000 HD +ATOM 791 CG ARG 222 -30.087 3.373 -8.273 0.00 0.00 +0.000 C +ATOM 792 HG2 ARG 222 -30.510 2.489 -8.463 0.00 0.00 +0.000 HD +ATOM 793 HG3 ARG 222 -29.574 3.324 -7.418 0.00 0.00 +0.000 HD +ATOM 794 CD ARG 222 -31.205 4.401 -8.091 0.00 0.00 +0.000 C +ATOM 795 HD2 ARG 222 -31.701 4.164 -7.261 0.00 0.00 +0.000 HD +ATOM 796 HD3 ARG 222 -30.779 5.296 -7.994 0.00 0.00 +0.000 HD +ATOM 797 NE ARG 222 -32.111 4.409 -9.220 0.00 0.00 +0.000 N +ATOM 798 HE ARG 222 -32.021 3.673 -9.908 0.00 0.00 +0.000 HD +ATOM 799 CZ ARG 222 -33.062 5.320 -9.423 0.00 0.00 +0.000 C +ATOM 800 NH1 ARG 222 -33.254 6.320 -8.557 0.00 0.00 +0.000 N +ATOM 801 HH11 ARG 222 -32.669 6.405 -7.754 0.00 0.00 +0.000 HD +ATOM 802 HH12 ARG 222 -33.986 6.982 -8.719 0.00 0.00 +0.000 HD +ATOM 803 NH2 ARG 222 -33.795 5.265 -10.528 0.00 0.00 +0.000 N +ATOM 804 HH21 ARG 222 -33.618 4.554 -11.211 0.00 0.00 +0.000 HD +ATOM 805 HH22 ARG 222 -34.523 5.933 -10.681 0.00 0.00 +0.000 HD +ATOM 806 C ARG 222 -28.630 3.781 -11.846 0.00 0.00 +0.000 C +ATOM 807 O ARG 222 -29.035 4.643 -12.633 0.00 0.00 +0.000 OA +ATOM 808 N ASN 223 -27.386 3.304 -11.867 0.00 0.00 +0.000 N +ATOM 809 H ASN 223 -27.178 2.587 -11.153 0.00 0.00 +0.000 HD +ATOM 810 CA ASN 223 -26.412 3.784 -12.845 0.00 0.00 +0.000 C +ATOM 811 HA ASN 223 -26.346 4.788 -12.729 0.00 0.00 +0.000 HD +ATOM 812 CB ASN 223 -25.052 3.121 -12.625 0.00 0.00 +0.000 C +ATOM 813 HB2 ASN 223 -25.205 2.158 -12.418 0.00 0.00 +0.000 HD +ATOM 814 HB3 ASN 223 -24.523 3.209 -13.466 0.00 0.00 +0.000 HD +ATOM 815 CG ASN 223 -24.284 3.747 -11.496 0.00 0.00 +0.000 C +ATOM 816 OD1 ASN 223 -24.321 4.960 -11.310 0.00 0.00 +0.000 OA +ATOM 817 ND2 ASN 223 -23.569 2.929 -10.741 0.00 0.00 +0.000 N +ATOM 818 HD21 ASN 223 -23.040 3.287 -9.970 0.00 0.00 +0.000 HD +ATOM 819 HD22 ASN 223 -23.554 1.946 -10.939 0.00 0.00 +0.000 HD +ATOM 820 C ASN 223 -26.845 3.528 -14.280 0.00 0.00 +0.000 C +ATOM 821 O ASN 223 -26.482 4.267 -15.189 0.00 0.00 +0.000 OA +ATOM 822 N HIE 224 -27.626 2.479 -14.479 0.00 0.00 +0.000 N +ATOM 823 H HIE 224 -27.882 1.952 -13.625 0.00 0.00 +0.000 HD +ATOM 824 CA HIE 224 -28.068 2.127 -15.810 0.00 0.00 +0.000 C +ATOM 825 HA HIE 224 -27.697 2.802 -16.464 0.00 0.00 +0.000 HD +ATOM 826 CB HIE 224 -27.465 0.762 -16.162 0.00 0.00 +0.000 C +ATOM 827 HB2 HIE 224 -27.749 0.092 -15.474 0.00 0.00 +0.000 HD +ATOM 828 HB3 HIE 224 -27.804 0.478 -17.060 0.00 0.00 +0.000 HD +ATOM 829 CG HIE 224 -25.966 0.787 -16.208 0.00 0.00 +0.000 A +ATOM 830 ND1 HIE 224 -25.278 1.419 -17.219 0.00 0.00 +0.000 NA +ATOM 831 CE1 HIE 224 -23.982 1.395 -16.948 0.00 0.00 +0.000 A +ATOM 832 HE1 HIE 224 -23.263 1.785 -17.515 0.00 0.00 +0.000 HD +ATOM 833 NE2 HIE 224 -23.808 0.766 -15.803 0.00 0.00 +0.000 N +ATOM 834 HE2 HIE 224 -22.922 0.599 -15.348 0.00 0.00 +0.000 HD +ATOM 835 CD2 HIE 224 -25.033 0.367 -15.317 0.00 0.00 +0.000 A +ATOM 836 HD2 HIE 224 -25.199 -0.133 -14.475 0.00 0.00 +0.000 HD +ATOM 837 C HIE 224 -29.589 2.151 -15.920 0.00 0.00 +0.000 C +ATOM 838 O HIE 224 -30.184 1.417 -16.696 0.00 0.00 +0.000 OA +ATOM 839 N GLU 225 -30.198 3.056 -15.157 0.00 0.00 +0.000 N +ATOM 840 H GLU 225 -29.545 3.640 -14.582 0.00 0.00 +0.000 HD +ATOM 841 CA GLU 225 -31.647 3.223 -15.122 0.00 0.00 +0.000 C +ATOM 842 HA GLU 225 -32.064 2.437 -14.627 0.00 0.00 +0.000 HD +ATOM 843 CB GLU 225 -32.009 4.470 -14.313 0.00 0.00 +0.000 C +ATOM 844 HB2 GLU 225 -31.779 4.294 -13.373 0.00 0.00 +0.000 HD +ATOM 845 HB3 GLU 225 -31.502 5.226 -14.684 0.00 0.00 +0.000 HD +ATOM 846 CG GLU 225 -33.485 4.834 -14.366 0.00 0.00 +0.000 C +ATOM 847 HG2 GLU 225 -33.750 4.902 -15.307 0.00 0.00 +0.000 HD +ATOM 848 HG3 GLU 225 -33.989 4.148 -13.879 0.00 0.00 +0.000 HD +ATOM 849 CD GLU 225 -33.767 6.167 -13.709 0.00 0.00 +0.000 C +ATOM 850 OE1 GLU 225 -34.384 6.172 -12.627 0.00 0.00 +0.000 OA +ATOM 851 OE2 GLU 225 -33.367 7.211 -14.275 0.00 0.00 +0.000 OA +ATOM 852 C GLU 225 -32.279 3.340 -16.501 0.00 0.00 +0.000 C +ATOM 853 O GLU 225 -33.199 2.598 -16.844 0.00 0.00 +0.000 OA +ATOM 854 N THR 226 -31.799 4.295 -17.283 0.00 0.00 +0.000 N +ATOM 855 H THR 226 -31.027 4.852 -16.875 0.00 0.00 +0.000 HD +ATOM 856 CA THR 226 -32.340 4.519 -18.614 0.00 0.00 +0.000 C +ATOM 857 HA THR 226 -33.312 4.798 -18.524 0.00 0.00 +0.000 HD +ATOM 858 CB THR 226 -31.601 5.678 -19.321 0.00 0.00 +0.000 C +ATOM 859 HB THR 226 -30.630 5.406 -19.466 0.00 0.00 +0.000 HD +ATOM 860 CG2 THR 226 -32.278 6.016 -20.645 0.00 0.00 +0.000 C +ATOM 861 HG21 THR 226 -33.265 5.859 -20.570 0.00 0.00 +0.000 HD +ATOM 862 HG22 THR 226 -32.114 6.978 -20.873 0.00 0.00 +0.000 HD +ATOM 863 HG23 THR 226 -31.906 5.437 -21.373 0.00 0.00 +0.000 HD +ATOM 864 OG1 THR 226 -31.622 6.837 -18.478 0.00 0.00 +0.000 OA +ATOM 865 HG1 THR 226 -32.024 6.612 -17.584 0.00 0.00 +0.000 HD +ATOM 866 C THR 226 -32.285 3.274 -19.493 0.00 0.00 +0.000 C +ATOM 867 O THR 226 -33.275 2.921 -20.132 0.00 0.00 +0.000 OA +ATOM 868 N ALA 227 -31.140 2.604 -19.535 0.00 0.00 +0.000 N +ATOM 869 H ALA 227 -30.377 2.985 -18.965 0.00 0.00 +0.000 HD +ATOM 870 CA ALA 227 -31.030 1.404 -20.360 0.00 0.00 +0.000 C +ATOM 871 HA ALA 227 -31.313 1.626 -21.299 0.00 0.00 +0.000 HD +ATOM 872 CB ALA 227 -29.587 0.923 -20.403 0.00 0.00 +0.000 C +ATOM 873 HB1 ALA 227 -29.545 0.033 -20.856 0.00 0.00 +0.000 HD +ATOM 874 HB2 ALA 227 -29.030 1.580 -20.910 0.00 0.00 +0.000 HD +ATOM 875 HB3 ALA 227 -29.235 0.839 -19.471 0.00 0.00 +0.000 HD +ATOM 876 C ALA 227 -31.946 0.291 -19.831 0.00 0.00 +0.000 C +ATOM 877 O ALA 227 -32.558 -0.445 -20.607 0.00 0.00 +0.000 OA +ATOM 878 N PHE 228 -32.040 0.180 -18.508 0.00 0.00 +0.000 N +ATOM 879 H PHE 228 -31.483 0.867 -17.970 0.00 0.00 +0.000 HD +ATOM 880 CA PHE 228 -32.875 -0.845 -17.894 0.00 0.00 +0.000 C +ATOM 881 HA PHE 228 -32.609 -1.726 -18.303 0.00 0.00 +0.000 HD +ATOM 882 CB PHE 228 -32.657 -0.863 -16.376 0.00 0.00 +0.000 C +ATOM 883 HB2 PHE 228 -32.453 0.057 -16.087 0.00 0.00 +0.000 HD +ATOM 884 HB3 PHE 228 -33.480 -1.206 -15.955 0.00 0.00 +0.000 HD +ATOM 885 CG PHE 228 -31.509 -1.751 -15.940 0.00 0.00 +0.000 A +ATOM 886 CD1 PHE 228 -30.329 -1.796 -16.678 0.00 0.00 +0.000 A +ATOM 887 HD1 PHE 228 -30.236 -1.239 -17.499 0.00 0.00 +0.000 HD +ATOM 888 CE1 PHE 228 -29.267 -2.610 -16.286 0.00 0.00 +0.000 A +ATOM 889 HE1 PHE 228 -28.428 -2.631 -16.841 0.00 0.00 +0.000 HD +ATOM 890 CZ PHE 228 -29.369 -3.390 -15.134 0.00 0.00 +0.000 A +ATOM 891 HZ PHE 228 -28.607 -3.965 -14.854 0.00 0.00 +0.000 HD +ATOM 892 CE2 PHE 228 -30.542 -3.356 -14.382 0.00 0.00 +0.000 A +ATOM 893 HE2 PHE 228 -30.638 -3.918 -13.551 0.00 0.00 +0.000 HD +ATOM 894 CD2 PHE 228 -31.606 -2.531 -14.785 0.00 0.00 +0.000 A +ATOM 895 HD2 PHE 228 -32.438 -2.504 -14.237 0.00 0.00 +0.000 HD +ATOM 896 C PHE 228 -34.346 -0.630 -18.234 0.00 0.00 +0.000 C +ATOM 897 O PHE 228 -35.036 -1.576 -18.613 0.00 0.00 +0.000 OA +ATOM 898 N GLN 229 -34.822 0.609 -18.104 0.00 0.00 +0.000 N +ATOM 899 H GLN 229 -34.143 1.306 -17.757 0.00 0.00 +0.000 HD +ATOM 900 CA GLN 229 -36.212 0.925 -18.437 0.00 0.00 +0.000 C +ATOM 901 HA GLN 229 -36.802 0.315 -17.914 0.00 0.00 +0.000 HD +ATOM 902 CB GLN 229 -36.517 2.409 -18.220 0.00 0.00 +0.000 C +ATOM 903 HB2 GLN 229 -35.962 2.948 -18.880 0.00 0.00 +0.000 HD +ATOM 904 HB3 GLN 229 -37.494 2.572 -18.458 0.00 0.00 +0.000 HD +ATOM 905 CG GLN 229 -36.275 2.978 -16.835 0.00 0.00 +0.000 C +ATOM 906 HG2 GLN 229 -36.906 2.557 -16.194 0.00 0.00 +0.000 HD +ATOM 907 HG3 GLN 229 -35.335 2.800 -16.569 0.00 0.00 +0.000 HD +ATOM 908 CD GLN 229 -36.503 4.493 -16.807 0.00 0.00 +0.000 C +ATOM 909 OE1 GLN 229 -37.320 4.990 -16.022 0.00 0.00 +0.000 OA +ATOM 910 NE2 GLN 229 -35.779 5.232 -17.659 0.00 0.00 +0.000 N +ATOM 911 HE21 GLN 229 -35.892 6.229 -17.699 0.00 0.00 +0.000 HD +ATOM 912 HE22 GLN 229 -35.111 4.755 -18.263 0.00 0.00 +0.000 HD +ATOM 913 C GLN 229 -36.435 0.633 -19.922 0.00 0.00 +0.000 C +ATOM 914 O GLN 229 -37.483 0.135 -20.321 0.00 0.00 +0.000 OA +ATOM 915 N GLY 230 -35.441 0.976 -20.732 0.00 0.00 +0.000 N +ATOM 916 H GLY 230 -34.618 1.394 -20.266 0.00 0.00 +0.000 HD +ATOM 917 CA GLY 230 -35.540 0.763 -22.165 0.00 0.00 +0.000 C +ATOM 918 HA2 GLY 230 -36.349 1.273 -22.524 0.00 0.00 +0.000 HD +ATOM 919 HA3 GLY 230 -34.723 1.173 -22.621 0.00 0.00 +0.000 HD +ATOM 920 C GLY 230 -35.654 -0.692 -22.564 0.00 0.00 +0.000 C +ATOM 921 O GLY 230 -36.481 -1.049 -23.410 0.00 0.00 +0.000 OA +ATOM 922 N LEU 231 -34.824 -1.535 -21.957 0.00 0.00 +0.000 N +ATOM 923 H LEU 231 -34.144 -1.198 -21.291 0.00 0.00 +0.000 HD +ATOM 924 CA LEU 231 -34.844 -2.958 -22.262 0.00 0.00 +0.000 C +ATOM 925 HA LEU 231 -34.797 -3.110 -23.340 0.00 0.00 +0.000 HD +ATOM 926 CB LEU 231 -33.647 -3.666 -21.615 0.00 0.00 +0.000 C +ATOM 927 HB2 LEU 231 -32.721 -3.241 -22.002 0.00 0.00 +0.000 HD +ATOM 928 HB3 LEU 231 -33.685 -3.531 -20.534 0.00 0.00 +0.000 HD +ATOM 929 CG LEU 231 -33.699 -5.154 -21.943 0.00 0.00 +0.000 C +ATOM 930 HG LEU 231 -34.625 -5.580 -21.556 0.00 0.00 +0.000 HD +ATOM 931 CD1 LEU 231 -33.645 -5.344 -23.455 0.00 0.00 +0.000 C +ATOM 932 HD11 LEU 231 -32.719 -4.919 -23.842 0.00 0.00 +0.000 HD +ATOM 933 HD12 LEU 231 -33.683 -6.408 -23.689 0.00 0.00 +0.000 HD +ATOM 934 HD13 LEU 231 -34.496 -4.841 -23.915 0.00 0.00 +0.000 HD +ATOM 935 CD2 LEU 231 -32.509 -5.858 -21.299 0.00 0.00 +0.000 C +ATOM 936 HD21 LEU 231 -32.547 -5.723 -20.218 0.00 0.00 +0.000 HD +ATOM 937 HD22 LEU 231 -32.546 -6.922 -21.533 0.00 0.00 +0.000 HD +ATOM 938 HD23 LEU 231 -31.583 -5.434 -21.686 0.00 0.00 +0.000 HD +ATOM 939 C LEU 231 -36.150 -3.574 -21.767 0.00 0.00 +0.000 C +ATOM 940 O LEU 231 -36.762 -4.372 -22.472 0.00 0.00 +0.000 OA +ATOM 941 N LEU 232 -36.589 -3.202 -20.565 0.00 0.00 +0.000 N +ATOM 942 H LEU 232 -36.000 -2.524 -20.067 0.00 0.00 +0.000 HD +ATOM 943 CA LEU 232 -37.835 -3.753 -20.035 0.00 0.00 +0.000 C +ATOM 944 HA LEU 232 -37.737 -4.753 -19.955 0.00 0.00 +0.000 HD +ATOM 945 CB LEU 232 -38.108 -3.214 -18.619 0.00 0.00 +0.000 C +ATOM 946 HB2 LEU 232 -37.344 -3.478 -18.041 0.00 0.00 +0.000 HD +ATOM 947 HB3 LEU 232 -38.178 -2.226 -18.678 0.00 0.00 +0.000 HD +ATOM 948 CG LEU 232 -39.392 -3.726 -17.941 0.00 0.00 +0.000 C +ATOM 949 HG LEU 232 -40.171 -3.491 -18.518 0.00 0.00 +0.000 HD +ATOM 950 CD1 LEU 232 -39.318 -5.224 -17.761 0.00 0.00 +0.000 C +ATOM 951 HD11 LEU 232 -38.530 -5.459 -17.188 0.00 0.00 +0.000 HD +ATOM 952 HD12 LEU 232 -40.155 -5.555 -17.320 0.00 0.00 +0.000 HD +ATOM 953 HD13 LEU 232 -39.220 -5.669 -18.653 0.00 0.00 +0.000 HD +ATOM 954 CD2 LEU 232 -39.595 -3.050 -16.608 0.00 0.00 +0.000 C +ATOM 955 HD21 LEU 232 -39.673 -2.058 -16.737 0.00 0.00 +0.000 HD +ATOM 956 HD22 LEU 232 -40.434 -3.391 -16.176 0.00 0.00 +0.000 HD +ATOM 957 HD23 LEU 232 -38.816 -3.241 -16.006 0.00 0.00 +0.000 HD +ATOM 958 C LEU 232 -39.024 -3.463 -20.965 0.00 0.00 +0.000 C +ATOM 959 O LEU 232 -39.825 -4.358 -21.258 0.00 0.00 +0.000 OA +ATOM 960 N ARG 233 -39.128 -2.222 -21.441 0.00 0.00 +0.000 N +ATOM 961 H ARG 233 -38.392 -1.567 -21.116 0.00 0.00 +0.000 HD +ATOM 962 CA ARG 233 -40.209 -1.829 -22.355 0.00 0.00 +0.000 C +ATOM 963 HA ARG 233 -41.088 -1.993 -21.902 0.00 0.00 +0.000 HD +ATOM 964 CB ARG 233 -40.090 -0.339 -22.721 0.00 0.00 +0.000 C +ATOM 965 HB2 ARG 233 -40.217 0.195 -21.889 0.00 0.00 +0.000 HD +ATOM 966 HB3 ARG 233 -39.178 -0.183 -23.090 0.00 0.00 +0.000 HD +ATOM 967 CG ARG 233 -41.106 0.149 -23.754 0.00 0.00 +0.000 C +ATOM 968 HG2 ARG 233 -40.816 -0.134 -24.658 0.00 0.00 +0.000 HD +ATOM 969 HG3 ARG 233 -41.999 -0.219 -23.534 0.00 0.00 +0.000 HD +ATOM 970 CD ARG 233 -41.191 1.664 -23.727 0.00 0.00 +0.000 C +ATOM 971 HD2 ARG 233 -40.826 1.981 -22.864 0.00 0.00 +0.000 HD +ATOM 972 HD3 ARG 233 -40.667 2.018 -24.489 0.00 0.00 +0.000 HD +ATOM 973 NE ARG 233 -42.583 2.097 -23.853 0.00 0.00 +0.000 N +ATOM 974 HE ARG 233 -43.096 2.270 -22.997 0.00 0.00 +0.000 HD +ATOM 975 CZ ARG 233 -43.223 2.280 -25.000 0.00 0.00 +0.000 C +ATOM 976 NH1 ARG 233 -42.604 2.085 -26.154 0.00 0.00 +0.000 N +ATOM 977 HH11 ARG 233 -41.655 1.779 -26.184 0.00 0.00 +0.000 HD +ATOM 978 HH12 ARG 233 -43.096 2.246 -27.018 0.00 0.00 +0.000 HD +ATOM 979 NH2 ARG 233 -44.495 2.646 -24.990 0.00 0.00 +0.000 N +ATOM 980 HH21 ARG 233 -44.976 2.765 -24.118 0.00 0.00 +0.000 HD +ATOM 981 HH22 ARG 233 -44.981 2.804 -25.850 0.00 0.00 +0.000 HD +ATOM 982 C ARG 233 -40.147 -2.669 -23.628 0.00 0.00 +0.000 C +ATOM 983 O ARG 233 -41.156 -3.186 -24.111 0.00 0.00 +0.000 OA +ATOM 984 N LYS 234 -38.945 -2.788 -24.172 0.00 0.00 +0.000 N +ATOM 985 H LYS 234 -38.187 -2.283 -23.661 0.00 0.00 +0.000 HD +ATOM 986 CA LYS 234 -38.717 -3.558 -25.377 0.00 0.00 +0.000 C +ATOM 987 HA LYS 234 -39.224 -3.132 -26.142 0.00 0.00 +0.000 HD +ATOM 988 CB LYS 234 -37.226 -3.516 -25.701 0.00 0.00 +0.000 C +ATOM 989 HB2 LYS 234 -36.952 -2.545 -25.764 0.00 0.00 +0.000 HD +ATOM 990 HB3 LYS 234 -36.730 -3.924 -24.920 0.00 0.00 +0.000 HD +ATOM 991 CG LYS 234 -36.794 -4.215 -26.958 0.00 0.00 +0.000 C +ATOM 992 HG2 LYS 234 -36.765 -5.192 -26.806 0.00 0.00 +0.000 HD +ATOM 993 HG3 LYS 234 -37.406 -3.984 -27.699 0.00 0.00 +0.000 HD +ATOM 994 CD LYS 234 -35.391 -3.735 -27.315 0.00 0.00 +0.000 C +ATOM 995 HD2 LYS 234 -35.458 -3.070 -28.053 0.00 0.00 +0.000 HD +ATOM 996 HD3 LYS 234 -34.980 -3.316 -26.511 0.00 0.00 +0.000 HD +ATOM 997 CE LYS 234 -34.497 -4.881 -27.774 0.00 0.00 +0.000 C +ATOM 998 HE2 LYS 234 -34.432 -5.562 -27.035 0.00 0.00 +0.000 HD +ATOM 999 HE3 LYS 234 -34.916 -5.324 -28.576 0.00 0.00 +0.000 HD +ATOM 1000 NZ LYS 234 -33.104 -4.438 -28.144 0.00 0.00 +0.000 N +ATOM 1001 HZ1 LYS 234 -32.517 -4.519 -27.343 0.00 0.00 +0.000 HD +ATOM 1002 HZ2 LYS 234 -32.765 -5.022 -28.877 0.00 0.00 +0.000 HD +ATOM 1003 HZ3 LYS 234 -33.138 -3.490 -28.449 0.00 0.00 +0.000 HD +ATOM 1004 C LYS 234 -39.192 -4.997 -25.225 0.00 0.00 +0.000 C +ATOM 1005 O LYS 234 -39.803 -5.550 -26.143 0.00 0.00 +0.000 OA +ATOM 1006 N LEU 235 -38.898 -5.594 -24.072 0.00 0.00 +0.000 N +ATOM 1007 H LEU 235 -38.370 -4.992 -23.399 0.00 0.00 +0.000 HD +ATOM 1008 CA LEU 235 -39.280 -6.971 -23.774 0.00 0.00 +0.000 C +ATOM 1009 HA LEU 235 -38.951 -7.565 -24.526 0.00 0.00 +0.000 HD +ATOM 1010 CB LEU 235 -38.581 -7.431 -22.494 0.00 0.00 +0.000 C +ATOM 1011 HB2 LEU 235 -38.735 -6.749 -21.799 0.00 0.00 +0.000 HD +ATOM 1012 HB3 LEU 235 -38.953 -8.307 -22.239 0.00 0.00 +0.000 HD +ATOM 1013 CG LEU 235 -37.066 -7.599 -22.646 0.00 0.00 +0.000 C +ATOM 1014 HG LEU 235 -36.686 -6.758 -23.029 0.00 0.00 +0.000 HD +ATOM 1015 CD1 LEU 235 -36.429 -7.880 -21.301 0.00 0.00 +0.000 C +ATOM 1016 HD11 LEU 235 -36.811 -8.721 -20.915 0.00 0.00 +0.000 HD +ATOM 1017 HD12 LEU 235 -35.439 -7.988 -21.412 0.00 0.00 +0.000 HD +ATOM 1018 HD13 LEU 235 -36.610 -7.119 -20.676 0.00 0.00 +0.000 HD +ATOM 1019 CD2 LEU 235 -36.785 -8.737 -23.619 0.00 0.00 +0.000 C +ATOM 1020 HD21 LEU 235 -37.190 -8.524 -24.508 0.00 0.00 +0.000 HD +ATOM 1021 HD22 LEU 235 -35.796 -8.851 -23.722 0.00 0.00 +0.000 HD +ATOM 1022 HD23 LEU 235 -37.183 -9.584 -23.266 0.00 0.00 +0.000 HD +ATOM 1023 C LEU 235 -40.790 -7.151 -23.649 0.00 0.00 +0.000 C +ATOM 1024 O LEU 235 -41.312 -8.244 -23.864 0.00 0.00 +0.000 OA +ATOM 1025 N ASP 236 -41.479 -6.078 -23.281 0.00 0.00 +0.000 N +ATOM 1026 H ASP 236 -40.897 -5.237 -23.078 0.00 0.00 +0.000 HD +ATOM 1027 CA ASP 236 -42.930 -6.089 -23.174 0.00 0.00 +0.000 C +ATOM 1028 HA ASP 236 -43.198 -5.284 -22.612 0.00 0.00 +0.000 HD +ATOM 1029 CB ASP 236 -43.512 -5.955 -24.582 0.00 0.00 +0.000 C +ATOM 1030 HB2 ASP 236 -43.130 -5.134 -24.994 0.00 0.00 +0.000 HD +ATOM 1031 HB3 ASP 236 -43.244 -6.759 -25.102 0.00 0.00 +0.000 HD +ATOM 1032 CG ASP 236 -45.020 -5.848 -24.587 0.00 0.00 +0.000 C +ATOM 1033 OD1 ASP 236 -45.614 -5.551 -23.527 0.00 0.00 +0.000 OA +ATOM 1034 OD2 ASP 236 -45.595 -6.052 -25.673 0.00 0.00 +0.000 OA +ATOM 1035 C ASP 236 -43.492 -7.326 -22.464 0.00 0.00 +0.000 C +ATOM 1036 O ASP 236 -44.227 -8.124 -23.049 0.00 0.00 +0.000 OA +ATOM 1037 N ILE 237 -43.153 -7.458 -21.184 0.00 0.00 +0.000 N +ATOM 1038 H ILE 237 -42.562 -6.680 -20.813 0.00 0.00 +0.000 HD +ATOM 1039 CA ILE 237 -43.573 -8.593 -20.373 0.00 0.00 +0.000 C +ATOM 1040 HA ILE 237 -43.630 -9.385 -21.002 0.00 0.00 +0.000 HD +ATOM 1041 CB ILE 237 -42.572 -8.834 -19.239 0.00 0.00 +0.000 C +ATOM 1042 HB ILE 237 -42.634 -8.076 -18.604 0.00 0.00 +0.000 HD +ATOM 1043 CG2 ILE 237 -42.882 -10.158 -18.555 0.00 0.00 +0.000 C +ATOM 1044 HG21 ILE 237 -42.233 -10.309 -17.812 0.00 0.00 +0.000 HD +ATOM 1045 HG22 ILE 237 -43.810 -10.134 -18.186 0.00 0.00 +0.000 HD +ATOM 1046 HG23 ILE 237 -42.808 -10.901 -19.218 0.00 0.00 +0.000 HD +ATOM 1047 CG1 ILE 237 -41.151 -8.856 -19.811 0.00 0.00 +0.000 C +ATOM 1048 HG12 ILE 237 -41.034 -9.703 -20.330 0.00 0.00 +0.000 HD +ATOM 1049 HG13 ILE 237 -41.058 -8.085 -20.443 0.00 0.00 +0.000 HD +ATOM 1050 CD1 ILE 237 -40.061 -8.763 -18.768 0.00 0.00 +0.000 C +ATOM 1051 HD11 ILE 237 -40.136 -9.536 -18.139 0.00 0.00 +0.000 HD +ATOM 1052 HD12 ILE 237 -39.169 -8.784 -19.217 0.00 0.00 +0.000 HD +ATOM 1053 HD13 ILE 237 -40.160 -7.908 -18.260 0.00 0.00 +0.000 HD +ATOM 1054 C ILE 237 -44.960 -8.419 -19.768 0.00 0.00 +0.000 C +ATOM 1055 O ILE 237 -45.183 -7.546 -18.917 0.00 0.00 +0.000 OA +ATOM 1056 N LYS 238 -45.884 -9.273 -20.199 0.00 0.00 +0.000 N +ATOM 1057 H LYS 238 -45.540 -9.973 -20.889 0.00 0.00 +0.000 HD +ATOM 1058 CA LYS 238 -47.262 -9.218 -19.732 0.00 0.00 +0.000 C +ATOM 1059 HA LYS 238 -47.355 -8.439 -19.081 0.00 0.00 +0.000 HD +ATOM 1060 CB LYS 238 -48.179 -8.957 -20.924 0.00 0.00 +0.000 C +ATOM 1061 HB2 LYS 238 -48.145 -9.754 -21.526 0.00 0.00 +0.000 HD +ATOM 1062 HB3 LYS 238 -49.111 -8.837 -20.582 0.00 0.00 +0.000 HD +ATOM 1063 CG LYS 238 -47.810 -7.728 -21.741 0.00 0.00 +0.000 C +ATOM 1064 HG2 LYS 238 -48.003 -6.906 -21.206 0.00 0.00 +0.000 HD +ATOM 1065 HG3 LYS 238 -46.837 -7.760 -21.966 0.00 0.00 +0.000 HD +ATOM 1066 CD LYS 238 -48.610 -7.654 -23.052 0.00 0.00 +0.000 C +ATOM 1067 HD2 LYS 238 -49.480 -8.117 -22.922 0.00 0.00 +0.000 HD +ATOM 1068 HD3 LYS 238 -48.756 -6.699 -23.285 0.00 0.00 +0.000 HD +ATOM 1069 CE LYS 238 -47.874 -8.330 -24.227 0.00 0.00 +0.000 C +ATOM 1070 HE2 LYS 238 -48.518 -8.438 -24.988 0.00 0.00 +0.000 HD +ATOM 1071 HE3 LYS 238 -47.121 -7.735 -24.517 0.00 0.00 +0.000 HD +ATOM 1072 NZ LYS 238 -47.318 -9.681 -23.860 0.00 0.00 +0.000 N +ATOM 1073 HZ1 LYS 238 -47.680 -10.361 -24.492 0.00 0.00 +0.000 HD +ATOM 1074 HZ2 LYS 238 -46.324 -9.649 -23.925 0.00 0.00 +0.000 HD +ATOM 1075 HZ3 LYS 238 -47.593 -9.900 -22.927 0.00 0.00 +0.000 HD +ATOM 1076 C LYS 238 -47.726 -10.489 -19.030 0.00 0.00 +0.000 C +ATOM 1077 O LYS 238 -48.572 -10.441 -18.132 0.00 0.00 +0.000 OA +ATOM 1078 N ASN 239 -47.178 -11.625 -19.441 0.00 0.00 +0.000 N +ATOM 1079 H ASN 239 -46.461 -11.534 -20.173 0.00 0.00 +0.000 HD +ATOM 1080 CA ASN 239 -47.600 -12.889 -18.861 0.00 0.00 +0.000 C +ATOM 1081 HA ASN 239 -47.917 -12.691 -17.910 0.00 0.00 +0.000 HD +ATOM 1082 CB ASN 239 -48.744 -13.446 -19.706 0.00 0.00 +0.000 C +ATOM 1083 HB2 ASN 239 -48.927 -14.379 -19.418 0.00 0.00 +0.000 HD +ATOM 1084 HB3 ASN 239 -49.546 -12.875 -19.570 0.00 0.00 +0.000 HD +ATOM 1085 CG ASN 239 -48.407 -13.458 -21.193 0.00 0.00 +0.000 C +ATOM 1086 OD1 ASN 239 -47.492 -14.166 -21.637 0.00 0.00 +0.000 OA +ATOM 1087 ND2 ASN 239 -49.138 -12.669 -21.970 0.00 0.00 +0.000 N +ATOM 1088 HD21 ASN 239 -48.969 -12.636 -22.955 0.00 0.00 +0.000 HD +ATOM 1089 HD22 ASN 239 -49.861 -12.103 -21.569 0.00 0.00 +0.000 HD +ATOM 1090 C ASN 239 -46.506 -13.939 -18.750 0.00 0.00 +0.000 C +ATOM 1091 O ASN 239 -45.313 -13.666 -18.947 0.00 0.00 +0.000 OA +ATOM 1092 N GLU 240 -46.952 -15.156 -18.459 0.00 0.00 +0.000 N +ATOM 1093 H GLU 240 -48.000 -15.208 -18.353 0.00 0.00 +0.000 HD +ATOM 1094 CA GLU 240 -46.091 -16.315 -18.299 0.00 0.00 +0.000 C +ATOM 1095 HA GLU 240 -45.426 -16.146 -17.552 0.00 0.00 +0.000 HD +ATOM 1096 CB GLU 240 -46.957 -17.490 -17.848 0.00 0.00 +0.000 C +ATOM 1097 HB2 GLU 240 -47.330 -17.258 -16.955 0.00 0.00 +0.000 HD +ATOM 1098 HB3 GLU 240 -47.690 -17.591 -18.512 0.00 0.00 +0.000 HD +ATOM 1099 CG GLU 240 -46.262 -18.822 -17.724 0.00 0.00 +0.000 C +ATOM 1100 HG2 GLU 240 -46.068 -19.159 -18.621 0.00 0.00 +0.000 HD +ATOM 1101 HG3 GLU 240 -45.463 -18.710 -17.173 0.00 0.00 +0.000 HD +ATOM 1102 CD GLU 240 -47.151 -19.838 -17.037 0.00 0.00 +0.000 C +ATOM 1103 OE1 GLU 240 -48.271 -20.067 -17.540 0.00 0.00 +0.000 OA +ATOM 1104 OE2 GLU 240 -46.731 -20.397 -15.997 0.00 0.00 +0.000 OA +ATOM 1105 C GLU 240 -45.330 -16.660 -19.577 0.00 0.00 +0.000 C +ATOM 1106 O GLU 240 -44.142 -16.980 -19.526 0.00 0.00 +0.000 OA +ATOM 1107 N ASP 241 -46.003 -16.593 -20.721 0.00 0.00 +0.000 N +ATOM 1108 H ASP 241 -46.986 -16.316 -20.645 0.00 0.00 +0.000 HD +ATOM 1109 CA ASP 241 -45.327 -16.906 -21.970 0.00 0.00 +0.000 C +ATOM 1110 HA ASP 241 -44.904 -17.812 -21.866 0.00 0.00 +0.000 HD +ATOM 1111 CB ASP 241 -46.316 -16.953 -23.145 0.00 0.00 +0.000 C +ATOM 1112 HB2 ASP 241 -46.894 -16.152 -23.094 0.00 0.00 +0.000 HD +ATOM 1113 HB3 ASP 241 -45.796 -16.967 -23.985 0.00 0.00 +0.000 HD +ATOM 1114 CG ASP 241 -47.208 -18.199 -23.103 0.00 0.00 +0.000 C +ATOM 1115 OD1 ASP 241 -46.773 -19.234 -22.538 0.00 0.00 +0.000 OA +ATOM 1116 OD2 ASP 241 -48.335 -18.158 -23.643 0.00 0.00 +0.000 OA +ATOM 1117 C ASP 241 -44.188 -15.913 -22.229 0.00 0.00 +0.000 C +ATOM 1118 O ASP 241 -43.108 -16.313 -22.680 0.00 0.00 +0.000 OA +ATOM 1119 N ASP 242 -44.404 -14.628 -21.944 0.00 0.00 +0.000 N +ATOM 1120 H ASP 242 -45.338 -14.393 -21.607 0.00 0.00 +0.000 HD +ATOM 1121 CA ASP 242 -43.319 -13.655 -22.126 0.00 0.00 +0.000 C +ATOM 1122 HA ASP 242 -42.953 -13.790 -23.048 0.00 0.00 +0.000 HD +ATOM 1123 CB ASP 242 -43.792 -12.217 -21.884 0.00 0.00 +0.000 C +ATOM 1124 HB2 ASP 242 -44.008 -12.126 -20.917 0.00 0.00 +0.000 HD +ATOM 1125 HB3 ASP 242 -43.047 -11.606 -22.130 0.00 0.00 +0.000 HD +ATOM 1126 CG ASP 242 -45.015 -11.852 -22.695 0.00 0.00 +0.000 C +ATOM 1127 OD1 ASP 242 -45.044 -12.127 -23.907 0.00 0.00 +0.000 OA +ATOM 1128 OD2 ASP 242 -45.950 -11.279 -22.106 0.00 0.00 +0.000 OA +ATOM 1129 C ASP 242 -42.181 -13.949 -21.144 0.00 0.00 +0.000 C +ATOM 1130 O ASP 242 -41.015 -13.758 -21.470 0.00 0.00 +0.000 OA +ATOM 1131 N VAL 243 -42.505 -14.396 -19.934 0.00 0.00 +0.000 N +ATOM 1132 H VAL 243 -43.506 -14.513 -19.754 0.00 0.00 +0.000 HD +ATOM 1133 CA VAL 243 -41.453 -14.684 -18.965 0.00 0.00 +0.000 C +ATOM 1134 HA VAL 243 -40.864 -13.877 -18.892 0.00 0.00 +0.000 HD +ATOM 1135 CB VAL 243 -42.030 -15.023 -17.558 0.00 0.00 +0.000 C +ATOM 1136 HB VAL 243 -42.661 -15.780 -17.672 0.00 0.00 +0.000 HD +ATOM 1137 CG1 VAL 243 -40.915 -15.500 -16.632 0.00 0.00 +0.000 C +ATOM 1138 HG11 VAL 243 -40.495 -16.322 -17.014 0.00 0.00 +0.000 HD +ATOM 1139 HG12 VAL 243 -40.225 -14.782 -16.546 0.00 0.00 +0.000 HD +ATOM 1140 HG13 VAL 243 -41.297 -15.707 -15.732 0.00 0.00 +0.000 HD +ATOM 1141 CG2 VAL 243 -42.699 -13.795 -16.959 0.00 0.00 +0.000 C +ATOM 1142 HG21 VAL 243 -43.686 -13.851 -17.107 0.00 0.00 +0.000 HD +ATOM 1143 HG22 VAL 243 -42.507 -13.760 -15.978 0.00 0.00 +0.000 HD +ATOM 1144 HG23 VAL 243 -42.339 -12.974 -17.402 0.00 0.00 +0.000 HD +ATOM 1145 C VAL 243 -40.604 -15.844 -19.465 0.00 0.00 +0.000 C +ATOM 1146 O VAL 243 -39.394 -15.845 -19.300 0.00 0.00 +0.000 OA +ATOM 1147 N LYS 244 -41.241 -16.828 -20.091 0.00 0.00 +0.000 N +ATOM 1148 H LYS 244 -42.262 -16.706 -20.180 0.00 0.00 +0.000 HD +ATOM 1149 CA LYS 244 -40.512 -17.979 -20.600 0.00 0.00 +0.000 C +ATOM 1150 HA LYS 244 -39.925 -18.344 -19.871 0.00 0.00 +0.000 HD +ATOM 1151 CB LYS 244 -41.491 -19.072 -21.035 0.00 0.00 +0.000 C +ATOM 1152 HB2 LYS 244 -42.115 -18.680 -21.705 0.00 0.00 +0.000 HD +ATOM 1153 HB3 LYS 244 -40.966 -19.811 -21.449 0.00 0.00 +0.000 HD +ATOM 1154 CG LYS 244 -42.307 -19.641 -19.892 0.00 0.00 +0.000 C +ATOM 1155 HG2 LYS 244 -41.711 -19.784 -19.101 0.00 0.00 +0.000 HD +ATOM 1156 HG3 LYS 244 -43.032 -18.997 -19.652 0.00 0.00 +0.000 HD +ATOM 1157 CD LYS 244 -42.940 -20.971 -20.274 0.00 0.00 +0.000 C +ATOM 1158 HD2 LYS 244 -43.713 -20.800 -20.869 0.00 0.00 +0.000 HD +ATOM 1159 HD3 LYS 244 -42.261 -21.534 -20.723 0.00 0.00 +0.000 HD +ATOM 1160 CE LYS 244 -43.432 -21.698 -19.032 0.00 0.00 +0.000 C +ATOM 1161 HE2 LYS 244 -42.715 -21.672 -18.334 0.00 0.00 +0.000 HD +ATOM 1162 HE3 LYS 244 -44.248 -21.234 -18.684 0.00 0.00 +0.000 HD +ATOM 1163 NZ LYS 244 -43.770 -23.120 -19.332 0.00 0.00 +0.000 N +ATOM 1164 HZ1 LYS 244 -44.005 -23.589 -18.482 0.00 0.00 +0.000 HD +ATOM 1165 HZ2 LYS 244 -44.548 -23.149 -19.958 0.00 0.00 +0.000 HD +ATOM 1166 HZ3 LYS 244 -42.981 -23.564 -19.755 0.00 0.00 +0.000 HD +ATOM 1167 C LYS 244 -39.634 -17.566 -21.772 0.00 0.00 +0.000 C +ATOM 1168 O LYS 244 -38.559 -18.126 -21.990 0.00 0.00 +0.000 OA +ATOM 1169 N SER 245 -40.084 -16.571 -22.522 0.00 0.00 +0.000 N +ATOM 1170 H SER 245 -40.986 -16.165 -22.226 0.00 0.00 +0.000 HD +ATOM 1171 CA SER 245 -39.327 -16.110 -23.679 0.00 0.00 +0.000 C +ATOM 1172 HA SER 245 -39.098 -16.917 -24.247 0.00 0.00 +0.000 HD +ATOM 1173 CB SER 245 -40.176 -15.146 -24.509 0.00 0.00 +0.000 C +ATOM 1174 HB2 SER 245 -39.747 -15.025 -25.399 0.00 0.00 +0.000 HD +ATOM 1175 HB3 SER 245 -41.087 -15.533 -24.617 0.00 0.00 +0.000 HD +ATOM 1176 OG SER 245 -40.283 -13.886 -23.872 0.00 0.00 +0.000 OA +ATOM 1177 HG SER 245 -40.573 -14.015 -22.924 0.00 0.00 +0.000 HD +ATOM 1178 C SER 245 -38.014 -15.430 -23.290 0.00 0.00 +0.000 C +ATOM 1179 O SER 245 -37.148 -15.217 -24.137 0.00 0.00 +0.000 OA +ATOM 1180 N LEU 246 -37.859 -15.104 -22.010 0.00 0.00 +0.000 N +ATOM 1181 H LEU 246 -38.642 -15.366 -21.390 0.00 0.00 +0.000 HD +ATOM 1182 CA LEU 246 -36.651 -14.423 -21.551 0.00 0.00 +0.000 C +ATOM 1183 HA LEU 246 -36.510 -13.595 -22.137 0.00 0.00 +0.000 HD +ATOM 1184 CB LEU 246 -36.860 -13.871 -20.137 0.00 0.00 +0.000 C +ATOM 1185 HB2 LEU 246 -37.135 -14.618 -19.557 0.00 0.00 +0.000 HD +ATOM 1186 HB3 LEU 246 -36.015 -13.464 -19.841 0.00 0.00 +0.000 HD +ATOM 1187 CG LEU 246 -37.946 -12.798 -20.057 0.00 0.00 +0.000 C +ATOM 1188 HG LEU 246 -38.782 -13.150 -20.467 0.00 0.00 +0.000 HD +ATOM 1189 CD1 LEU 246 -38.209 -12.441 -18.599 0.00 0.00 +0.000 C +ATOM 1190 HD11 LEU 246 -37.368 -12.093 -18.184 0.00 0.00 +0.000 HD +ATOM 1191 HD12 LEU 246 -38.920 -11.739 -18.551 0.00 0.00 +0.000 HD +ATOM 1192 HD13 LEU 246 -38.512 -13.256 -18.106 0.00 0.00 +0.000 HD +ATOM 1193 CD2 LEU 246 -37.526 -11.581 -20.857 0.00 0.00 +0.000 C +ATOM 1194 HD21 LEU 246 -37.387 -11.838 -21.815 0.00 0.00 +0.000 HD +ATOM 1195 HD22 LEU 246 -38.239 -10.879 -20.803 0.00 0.00 +0.000 HD +ATOM 1196 HD23 LEU 246 -36.671 -11.212 -20.487 0.00 0.00 +0.000 HD +ATOM 1197 C LEU 246 -35.376 -15.259 -21.598 0.00 0.00 +0.000 C +ATOM 1198 O LEU 246 -34.285 -14.711 -21.756 0.00 0.00 +0.000 OA +ATOM 1199 N SER 247 -35.501 -16.575 -21.463 0.00 0.00 +0.000 N +ATOM 1200 H SER 247 -36.463 -16.918 -21.330 0.00 0.00 +0.000 HD +ATOM 1201 CA SER 247 -34.326 -17.438 -21.507 0.00 0.00 +0.000 C +ATOM 1202 HA SER 247 -33.723 -17.189 -20.738 0.00 0.00 +0.000 HD +ATOM 1203 CB SER 247 -34.731 -18.912 -21.372 0.00 0.00 +0.000 C +ATOM 1204 HB2 SER 247 -35.345 -19.144 -22.121 0.00 0.00 +0.000 HD +ATOM 1205 HB3 SER 247 -33.909 -19.473 -21.418 0.00 0.00 +0.000 HD +ATOM 1206 OG SER 247 -35.389 -19.155 -20.141 0.00 0.00 +0.000 OA +ATOM 1207 HG SER 247 -35.365 -18.328 -19.581 0.00 0.00 +0.000 HD +ATOM 1208 C SER 247 -33.530 -17.243 -22.802 0.00 0.00 +0.000 C +ATOM 1209 O SER 247 -32.311 -17.108 -22.768 0.00 0.00 +0.000 OA +ATOM 1210 N ARG 248 -34.227 -17.231 -23.938 0.00 0.00 +0.000 N +ATOM 1211 H ARG 248 -35.254 -17.356 -23.817 0.00 0.00 +0.000 HD +ATOM 1212 CA ARG 248 -33.593 -17.055 -25.249 0.00 0.00 +0.000 C +ATOM 1213 HA ARG 248 -32.956 -17.818 -25.404 0.00 0.00 +0.000 HD +ATOM 1214 CB ARG 248 -34.660 -17.078 -26.367 0.00 0.00 +0.000 C +ATOM 1215 HB2 ARG 248 -35.156 -17.940 -26.306 0.00 0.00 +0.000 HD +ATOM 1216 HB3 ARG 248 -35.284 -16.315 -26.218 0.00 0.00 +0.000 HD +ATOM 1217 CG ARG 248 -34.111 -16.956 -27.809 0.00 0.00 +0.000 C +ATOM 1218 HG2 ARG 248 -33.851 -16.014 -27.980 0.00 0.00 +0.000 HD +ATOM 1219 HG3 ARG 248 -33.332 -17.561 -27.913 0.00 0.00 +0.000 HD +ATOM 1220 CD ARG 248 -35.170 -17.358 -28.856 0.00 0.00 +0.000 C +ATOM 1221 HD2 ARG 248 -35.648 -18.160 -28.508 0.00 0.00 +0.000 HD +ATOM 1222 HD3 ARG 248 -35.805 -16.595 -28.949 0.00 0.00 +0.000 HD +ATOM 1223 NE ARG 248 -34.584 -17.668 -30.165 0.00 0.00 +0.000 N +ATOM 1224 HE ARG 248 -34.342 -18.638 -30.345 0.00 0.00 +0.000 HD +ATOM 1225 CZ ARG 248 -34.344 -16.789 -31.132 0.00 0.00 +0.000 C +ATOM 1226 NH1 ARG 248 -34.645 -15.504 -30.966 0.00 0.00 +0.000 N +ATOM 1227 HH11 ARG 248 -35.035 -15.178 -30.109 0.00 0.00 +0.000 HD +ATOM 1228 HH12 ARG 248 -34.475 -14.854 -31.714 0.00 0.00 +0.000 HD +ATOM 1229 NH2 ARG 248 -33.783 -17.199 -32.267 0.00 0.00 +0.000 N +ATOM 1230 HH21 ARG 248 -33.528 -18.161 -32.377 0.00 0.00 +0.000 HD +ATOM 1231 HH22 ARG 248 -33.616 -16.549 -33.006 0.00 0.00 +0.000 HD +ATOM 1232 C ARG 248 -32.810 -15.746 -25.304 0.00 0.00 +0.000 C +ATOM 1233 O ARG 248 -31.688 -15.699 -25.813 0.00 0.00 +0.000 OA +ATOM 1234 N VAL 249 -33.405 -14.683 -24.773 0.00 0.00 +0.000 N +ATOM 1235 H VAL 249 -34.342 -14.858 -24.373 0.00 0.00 +0.000 HD +ATOM 1236 CA VAL 249 -32.753 -13.381 -24.773 0.00 0.00 +0.000 C +ATOM 1237 HA VAL 249 -32.458 -13.175 -25.719 0.00 0.00 +0.000 HD +ATOM 1238 CB VAL 249 -33.716 -12.262 -24.314 0.00 0.00 +0.000 C +ATOM 1239 HB VAL 249 -33.921 -12.417 -23.357 0.00 0.00 +0.000 HD +ATOM 1240 CG1 VAL 249 -33.018 -10.911 -24.410 0.00 0.00 +0.000 C +ATOM 1241 HG11 VAL 249 -32.036 -11.033 -24.272 0.00 0.00 +0.000 HD +ATOM 1242 HG12 VAL 249 -33.181 -10.515 -25.313 0.00 0.00 +0.000 HD +ATOM 1243 HG13 VAL 249 -33.380 -10.298 -23.708 0.00 0.00 +0.000 HD +ATOM 1244 CG2 VAL 249 -34.972 -12.268 -25.166 0.00 0.00 +0.000 C +ATOM 1245 HG21 VAL 249 -34.718 -12.223 -26.133 0.00 0.00 +0.000 HD +ATOM 1246 HG22 VAL 249 -35.486 -13.109 -24.994 0.00 0.00 +0.000 HD +ATOM 1247 HG23 VAL 249 -35.537 -11.476 -24.931 0.00 0.00 +0.000 HD +ATOM 1248 C VAL 249 -31.510 -13.350 -23.882 0.00 0.00 +0.000 C +ATOM 1249 O VAL 249 -30.495 -12.756 -24.245 0.00 0.00 +0.000 OA +ATOM 1250 N MET 250 -31.575 -13.993 -22.717 0.00 0.00 +0.000 N +ATOM 1251 H MET 250 -32.471 -14.450 -22.509 0.00 0.00 +0.000 HD +ATOM 1252 CA MET 250 -30.413 -14.021 -21.817 0.00 0.00 +0.000 C +ATOM 1253 HA MET 250 -30.108 -13.073 -21.675 0.00 0.00 +0.000 HD +ATOM 1254 CB MET 250 -30.767 -14.652 -20.462 0.00 0.00 +0.000 C +ATOM 1255 HB2 MET 250 -31.159 -15.570 -20.623 0.00 0.00 +0.000 HD +ATOM 1256 HB3 MET 250 -29.917 -14.770 -19.927 0.00 0.00 +0.000 HD +ATOM 1257 CG MET 250 -31.756 -13.851 -19.619 0.00 0.00 +0.000 C +ATOM 1258 HG2 MET 250 -31.425 -12.878 -19.564 0.00 0.00 +0.000 HD +ATOM 1259 HG3 MET 250 -32.651 -13.799 -20.124 0.00 0.00 +0.000 HD +ATOM 1260 SD MET 250 -32.022 -14.522 -17.935 0.00 0.00 +0.000 S +ATOM 1261 CE MET 250 -33.303 -15.728 -18.230 0.00 0.00 +0.000 C +ATOM 1262 HE1 MET 250 -33.057 -16.597 -17.796 0.00 0.00 +0.000 HD +ATOM 1263 HE2 MET 250 -34.170 -15.403 -17.847 0.00 0.00 +0.000 HD +ATOM 1264 HE3 MET 250 -33.413 -15.872 -19.216 0.00 0.00 +0.000 HD +ATOM 1265 C MET 250 -29.254 -14.805 -22.431 0.00 0.00 +0.000 C +ATOM 1266 O MET 250 -28.099 -14.462 -22.220 0.00 0.00 +0.000 OA +ATOM 1267 N ILE 251 -29.562 -15.866 -23.169 0.00 0.00 +0.000 N +ATOM 1268 H ILE 251 -30.571 -16.073 -23.244 0.00 0.00 +0.000 HD +ATOM 1269 CA ILE 251 -28.520 -16.659 -23.813 0.00 0.00 +0.000 C +ATOM 1270 HA ILE 251 -27.814 -16.802 -23.131 0.00 0.00 +0.000 HD +ATOM 1271 CB ILE 251 -29.122 -17.962 -24.439 0.00 0.00 +0.000 C +ATOM 1272 HB ILE 251 -29.942 -17.701 -24.933 0.00 0.00 +0.000 HD +ATOM 1273 CG2 ILE 251 -28.130 -18.591 -25.407 0.00 0.00 +0.000 C +ATOM 1274 HG21 ILE 251 -28.544 -19.393 -25.834 0.00 0.00 +0.000 HD +ATOM 1275 HG22 ILE 251 -27.886 -17.928 -26.113 0.00 0.00 +0.000 HD +ATOM 1276 HG23 ILE 251 -27.308 -18.865 -24.911 0.00 0.00 +0.000 HD +ATOM 1277 CG1 ILE 251 -29.514 -18.960 -23.343 0.00 0.00 +0.000 C +ATOM 1278 HG12 ILE 251 -30.052 -18.475 -22.652 0.00 0.00 +0.000 HD +ATOM 1279 HG13 ILE 251 -30.096 -19.664 -23.755 0.00 0.00 +0.000 HD +ATOM 1280 CD1 ILE 251 -28.341 -19.644 -22.658 0.00 0.00 +0.000 C +ATOM 1281 HD11 ILE 251 -27.763 -18.952 -22.230 0.00 0.00 +0.000 HD +ATOM 1282 HD12 ILE 251 -28.688 -20.272 -21.964 0.00 0.00 +0.000 HD +ATOM 1283 HD13 ILE 251 -27.814 -20.150 -23.338 0.00 0.00 +0.000 HD +ATOM 1284 C ILE 251 -27.899 -15.796 -24.909 0.00 0.00 +0.000 C +ATOM 1285 O ILE 251 -26.686 -15.713 -25.061 0.00 0.00 +0.000 OA +ATOM 1286 N HIE 252 -28.766 -15.125 -25.655 0.00 0.00 +0.000 N +ATOM 1287 H HIE 252 -29.766 -15.260 -25.388 0.00 0.00 +0.000 HD +ATOM 1288 CA HIE 252 -28.349 -14.265 -26.763 0.00 0.00 +0.000 C +ATOM 1289 HA HIE 252 -27.828 -14.831 -27.425 0.00 0.00 +0.000 HD +ATOM 1290 CB HIE 252 -29.595 -13.708 -27.470 0.00 0.00 +0.000 C +ATOM 1291 HB2 HIE 252 -30.203 -14.475 -27.706 0.00 0.00 +0.000 HD +ATOM 1292 HB3 HIE 252 -30.083 -13.101 -26.832 0.00 0.00 +0.000 HD +ATOM 1293 CG HIE 252 -29.293 -12.942 -28.716 0.00 0.00 +0.000 A +ATOM 1294 ND1 HIE 252 -28.674 -11.718 -28.707 0.00 0.00 +0.000 NA +ATOM 1295 CE1 HIE 252 -28.569 -11.272 -29.952 0.00 0.00 +0.000 A +ATOM 1296 HE1 HIE 252 -28.162 -10.408 -30.226 0.00 0.00 +0.000 HD +ATOM 1297 NE2 HIE 252 -29.099 -12.171 -30.756 0.00 0.00 +0.000 N +ATOM 1298 HE2 HIE 252 -29.160 -12.100 -31.762 0.00 0.00 +0.000 HD +ATOM 1299 CD2 HIE 252 -29.559 -13.231 -30.011 0.00 0.00 +0.000 A +ATOM 1300 HD2 HIE 252 -30.002 -14.049 -30.359 0.00 0.00 +0.000 HD +ATOM 1301 C HIE 252 -27.455 -13.107 -26.323 0.00 0.00 +0.000 C +ATOM 1302 O HIE 252 -26.403 -12.851 -26.914 0.00 0.00 +0.000 OA +ATOM 1303 N VAL 253 -27.868 -12.431 -25.260 0.00 0.00 +0.000 N +ATOM 1304 H VAL 253 -28.738 -12.802 -24.820 0.00 0.00 +0.000 HD +ATOM 1305 CA VAL 253 -27.155 -11.263 -24.755 0.00 0.00 +0.000 C +ATOM 1306 HA VAL 253 -26.718 -10.791 -25.553 0.00 0.00 +0.000 HD +ATOM 1307 CB VAL 253 -28.172 -10.255 -24.143 0.00 0.00 +0.000 C +ATOM 1308 HB VAL 253 -28.626 -10.716 -23.390 0.00 0.00 +0.000 HD +ATOM 1309 CG1 VAL 253 -27.444 -9.054 -23.567 0.00 0.00 +0.000 C +ATOM 1310 HG11 VAL 253 -26.951 -8.579 -24.296 0.00 0.00 +0.000 HD +ATOM 1311 HG12 VAL 253 -28.105 -8.428 -23.152 0.00 0.00 +0.000 HD +ATOM 1312 HG13 VAL 253 -26.793 -9.358 -22.870 0.00 0.00 +0.000 HD +ATOM 1313 CG2 VAL 253 -29.170 -9.822 -25.214 0.00 0.00 +0.000 C +ATOM 1314 HG21 VAL 253 -29.979 -10.407 -25.164 0.00 0.00 +0.000 HD +ATOM 1315 HG22 VAL 253 -29.430 -8.871 -25.054 0.00 0.00 +0.000 HD +ATOM 1316 HG23 VAL 253 -28.744 -9.910 -26.113 0.00 0.00 +0.000 HD +ATOM 1317 C VAL 253 -26.048 -11.549 -23.730 0.00 0.00 +0.000 C +ATOM 1318 O VAL 253 -24.956 -10.985 -23.811 0.00 0.00 +0.000 OA +ATOM 1319 N PHE 254 -26.328 -12.408 -22.759 0.00 0.00 +0.000 N +ATOM 1320 H PHE 254 -27.266 -12.822 -22.785 0.00 0.00 +0.000 HD +ATOM 1321 CA PHE 254 -25.325 -12.707 -21.744 0.00 0.00 +0.000 C +ATOM 1322 HA PHE 254 -24.774 -11.854 -21.612 0.00 0.00 +0.000 HD +ATOM 1323 CB PHE 254 -25.989 -13.057 -20.407 0.00 0.00 +0.000 C +ATOM 1324 HB2 PHE 254 -26.372 -12.229 -20.033 0.00 0.00 +0.000 HD +ATOM 1325 HB3 PHE 254 -26.683 -13.735 -20.582 0.00 0.00 +0.000 HD +ATOM 1326 CG PHE 254 -25.029 -13.626 -19.389 0.00 0.00 +0.000 A +ATOM 1327 CD1 PHE 254 -24.147 -12.797 -18.690 0.00 0.00 +0.000 A +ATOM 1328 HD1 PHE 254 -24.181 -11.814 -18.825 0.00 0.00 +0.000 HD +ATOM 1329 CE1 PHE 254 -23.221 -13.337 -17.803 0.00 0.00 +0.000 A +ATOM 1330 HE1 PHE 254 -22.601 -12.726 -17.299 0.00 0.00 +0.000 HD +ATOM 1331 CZ PHE 254 -23.155 -14.716 -17.618 0.00 0.00 +0.000 A +ATOM 1332 HZ PHE 254 -22.481 -15.100 -16.991 0.00 0.00 +0.000 HD +ATOM 1333 CE2 PHE 254 -24.029 -15.548 -18.308 0.00 0.00 +0.000 A +ATOM 1334 HE2 PHE 254 -23.994 -16.551 -18.171 0.00 0.00 +0.000 HD +ATOM 1335 CD2 PHE 254 -24.952 -15.006 -19.189 0.00 0.00 +0.000 A +ATOM 1336 HD2 PHE 254 -25.574 -15.609 -19.690 0.00 0.00 +0.000 HD +ATOM 1337 C PHE 254 -24.328 -13.814 -22.100 0.00 0.00 +0.000 C +ATOM 1338 O PHE 254 -23.119 -13.620 -22.006 0.00 0.00 +0.000 OA +ATOM 1339 N SER 255 -24.824 -14.984 -22.489 0.00 0.00 +0.000 N +ATOM 1340 H SER 255 -25.846 -15.043 -22.539 0.00 0.00 +0.000 HD +ATOM 1341 CA SER 255 -23.919 -16.088 -22.814 0.00 0.00 +0.000 C +ATOM 1342 HA SER 255 -23.308 -16.236 -22.009 0.00 0.00 +0.000 HD +ATOM 1343 CB SER 255 -24.706 -17.379 -23.015 0.00 0.00 +0.000 C +ATOM 1344 HB2 SER 255 -25.312 -17.270 -23.792 0.00 0.00 +0.000 HD +ATOM 1345 HB3 SER 255 -24.070 -18.125 -23.165 0.00 0.00 +0.000 HD +ATOM 1346 OG SER 255 -25.481 -17.658 -21.860 0.00 0.00 +0.000 OA +ATOM 1347 HG SER 255 -26.173 -16.947 -21.744 0.00 0.00 +0.000 HD +ATOM 1348 C SER 255 -23.028 -15.853 -24.033 0.00 0.00 +0.000 C +ATOM 1349 O SER 255 -21.872 -16.284 -24.046 0.00 0.00 +0.000 OA +ATOM 1350 N ASP 256 -23.562 -15.187 -25.054 0.00 0.00 +0.000 N +ATOM 1351 H ASP 256 -24.538 -14.876 -24.914 0.00 0.00 +0.000 HD +ATOM 1352 CA ASP 256 -22.796 -14.929 -26.274 0.00 0.00 +0.000 C +ATOM 1353 HA ASP 256 -22.166 -15.700 -26.396 0.00 0.00 +0.000 HD +ATOM 1354 CB ASP 256 -23.747 -14.753 -27.466 0.00 0.00 +0.000 C +ATOM 1355 HB2 ASP 256 -24.491 -15.403 -27.360 0.00 0.00 +0.000 HD +ATOM 1356 HB3 ASP 256 -24.092 -13.822 -27.446 0.00 0.00 +0.000 HD +ATOM 1357 CG ASP 256 -23.067 -14.997 -28.796 0.00 0.00 +0.000 C +ATOM 1358 OD1 ASP 256 -21.899 -15.441 -28.789 0.00 0.00 +0.000 OA +ATOM 1359 OD2 ASP 256 -23.705 -14.759 -29.840 0.00 0.00 +0.000 OA +ATOM 1360 C ASP 256 -21.950 -13.679 -26.100 0.00 0.00 +0.000 C +ATOM 1361 O ASP 256 -22.237 -12.639 -26.691 0.00 0.00 +0.000 OA +ATOM 1362 N GLY 257 -20.903 -13.787 -25.291 0.00 0.00 +0.000 N +ATOM 1363 H GLY 257 -20.767 -14.718 -24.867 0.00 0.00 +0.000 HD +ATOM 1364 CA GLY 257 -20.035 -12.647 -25.048 0.00 0.00 +0.000 C +ATOM 1365 HA2 GLY 257 -19.568 -12.390 -25.896 0.00 0.00 +0.000 HD +ATOM 1366 HA3 GLY 257 -20.579 -11.870 -24.726 0.00 0.00 +0.000 HD +ATOM 1367 C GLY 257 -18.999 -13.009 -23.992 0.00 0.00 +0.000 C +ATOM 1368 O GLY 257 -19.096 -14.059 -23.348 0.00 0.00 +0.000 OA +ATOM 1369 N VAL 258 -18.008 -12.147 -23.794 0.00 0.00 +0.000 N +ATOM 1370 H VAL 258 -18.029 -11.305 -24.384 0.00 0.00 +0.000 HD +ATOM 1371 CA VAL 258 -16.993 -12.427 -22.800 0.00 0.00 +0.000 C +ATOM 1372 HA VAL 258 -16.642 -13.351 -22.958 0.00 0.00 +0.000 HD +ATOM 1373 CB VAL 258 -15.803 -11.420 -22.883 0.00 0.00 +0.000 C +ATOM 1374 HB VAL 258 -16.082 -10.596 -22.417 0.00 0.00 +0.000 HD +ATOM 1375 CG1 VAL 258 -14.611 -11.992 -22.117 0.00 0.00 +0.000 C +ATOM 1376 HG11 VAL 258 -14.588 -12.984 -22.234 0.00 0.00 +0.000 HD +ATOM 1377 HG12 VAL 258 -13.767 -11.593 -22.472 0.00 0.00 +0.000 HD +ATOM 1378 HG13 VAL 258 -14.704 -11.771 -21.147 0.00 0.00 +0.000 HD +ATOM 1379 CG2 VAL 258 -15.418 -11.159 -24.334 0.00 0.00 +0.000 C +ATOM 1380 HG21 VAL 258 -14.941 -11.959 -24.697 0.00 0.00 +0.000 HD +ATOM 1381 HG22 VAL 258 -16.245 -10.989 -24.869 0.00 0.00 +0.000 HD +ATOM 1382 HG23 VAL 258 -14.819 -10.360 -24.377 0.00 0.00 +0.000 HD +ATOM 1383 C VAL 258 -17.632 -12.393 -21.429 0.00 0.00 +0.000 C +ATOM 1384 O VAL 258 -18.617 -11.691 -21.193 0.00 0.00 +0.000 OA +ATOM 1385 N THR 259 -17.055 -13.166 -20.524 0.00 0.00 +0.000 N +ATOM 1386 H THR 259 -16.219 -13.685 -20.861 0.00 0.00 +0.000 HD +ATOM 1387 CA THR 259 -17.570 -13.262 -19.175 0.00 0.00 +0.000 C +ATOM 1388 HA THR 259 -18.481 -12.817 -19.143 0.00 0.00 +0.000 HD +ATOM 1389 CB THR 259 -17.698 -14.742 -18.757 0.00 0.00 +0.000 C +ATOM 1390 HB THR 259 -16.764 -15.138 -18.663 0.00 0.00 +0.000 HD +ATOM 1391 CG2 THR 259 -18.450 -14.851 -17.455 0.00 0.00 +0.000 C +ATOM 1392 HG21 THR 259 -19.421 -14.635 -17.596 0.00 0.00 +0.000 HD +ATOM 1393 HG22 THR 259 -18.377 -15.784 -17.089 0.00 0.00 +0.000 HD +ATOM 1394 HG23 THR 259 -18.072 -14.209 -16.781 0.00 0.00 +0.000 HD +ATOM 1395 OG1 THR 259 -18.391 -15.469 -19.785 0.00 0.00 +0.000 OA +ATOM 1396 HG1 THR 259 -18.425 -14.928 -20.631 0.00 0.00 +0.000 HD +ATOM 1397 C THR 259 -16.670 -12.569 -18.162 0.00 0.00 +0.000 C +ATOM 1398 O THR 259 -15.458 -12.745 -18.180 0.00 0.00 +0.000 OA +ATOM 1399 N ASN 260 -17.278 -11.789 -17.279 0.00 0.00 +0.000 N +ATOM 1400 H ASN 260 -18.307 -11.683 -17.432 0.00 0.00 +0.000 HD +ATOM 1401 CA ASN 260 -16.568 -11.135 -16.186 0.00 0.00 +0.000 C +ATOM 1402 HA ASN 260 -15.902 -11.776 -15.842 0.00 0.00 +0.000 HD +ATOM 1403 CB ASN 260 -15.905 -9.805 -16.602 0.00 0.00 +0.000 C +ATOM 1404 HB2 ASN 260 -15.574 -9.352 -15.775 0.00 0.00 +0.000 HD +ATOM 1405 HB3 ASN 260 -15.133 -10.018 -17.200 0.00 0.00 +0.000 HD +ATOM 1406 CG ASN 260 -16.841 -8.858 -17.334 0.00 0.00 +0.000 C +ATOM 1407 OD1 ASN 260 -17.905 -8.490 -16.837 0.00 0.00 +0.000 OA +ATOM 1408 ND2 ASN 260 -16.428 -8.445 -18.529 0.00 0.00 +0.000 N +ATOM 1409 HD21 ASN 260 -16.996 -7.815 -19.063 0.00 0.00 +0.000 HD +ATOM 1410 HD22 ASN 260 -15.555 -8.760 -18.898 0.00 0.00 +0.000 HD +ATOM 1411 C ASN 260 -17.607 -10.938 -15.098 0.00 0.00 +0.000 C +ATOM 1412 O ASN 260 -18.800 -11.075 -15.362 0.00 0.00 +0.000 OA +ATOM 1413 N TRP 261 -17.170 -10.647 -13.877 0.00 0.00 +0.000 N +ATOM 1414 H TRP 261 -16.152 -10.550 -13.781 0.00 0.00 +0.000 HD +ATOM 1415 CA TRP 261 -18.117 -10.488 -12.788 0.00 0.00 +0.000 C +ATOM 1416 HA TRP 261 -18.642 -11.351 -12.705 0.00 0.00 +0.000 HD +ATOM 1417 CB TRP 261 -17.375 -10.282 -11.458 0.00 0.00 +0.000 C +ATOM 1418 HB2 TRP 261 -16.612 -9.673 -11.604 0.00 0.00 +0.000 HD +ATOM 1419 HB3 TRP 261 -18.005 -9.923 -10.788 0.00 0.00 +0.000 HD +ATOM 1420 CG TRP 261 -16.810 -11.573 -10.890 0.00 0.00 +0.000 A +ATOM 1421 CD1 TRP 261 -15.501 -11.850 -10.618 0.00 0.00 +0.000 A +ATOM 1422 HD1 TRP 261 -14.739 -11.221 -10.750 0.00 0.00 +0.000 HD +ATOM 1423 NE1 TRP 261 -15.379 -13.137 -10.129 0.00 0.00 +0.000 N +ATOM 1424 HE1 TRP 261 -14.522 -13.574 -9.861 0.00 0.00 +0.000 HD +ATOM 1425 CE2 TRP 261 -16.620 -13.712 -10.073 0.00 0.00 +0.000 A +ATOM 1426 CZ2 TRP 261 -17.006 -14.995 -9.651 0.00 0.00 +0.000 A +ATOM 1427 HZ2 TRP 261 -16.315 -15.646 -9.327 0.00 0.00 +0.000 HD +ATOM 1428 CH2 TRP 261 -18.340 -15.306 -9.703 0.00 0.00 +0.000 A +ATOM 1429 HH2 TRP 261 -18.655 -16.207 -9.405 0.00 0.00 +0.000 HD +ATOM 1430 CZ3 TRP 261 -19.289 -14.382 -10.169 0.00 0.00 +0.000 A +ATOM 1431 HZ3 TRP 261 -20.249 -14.631 -10.204 0.00 0.00 +0.000 HD +ATOM 1432 CE3 TRP 261 -18.906 -13.105 -10.590 0.00 0.00 +0.000 A +ATOM 1433 HE3 TRP 261 -19.592 -12.461 -10.911 0.00 0.00 +0.000 HD +ATOM 1434 CD2 TRP 261 -17.549 -12.761 -10.547 0.00 0.00 +0.000 A +ATOM 1435 C TRP 261 -19.123 -9.367 -13.037 0.00 0.00 +0.000 C +ATOM 1436 O TRP 261 -20.273 -9.459 -12.611 0.00 0.00 +0.000 OA +ATOM 1437 N GLY 262 -18.696 -8.325 -13.748 0.00 0.00 +0.000 N +ATOM 1438 H GLY 262 -17.715 -8.379 -14.061 0.00 0.00 +0.000 HD +ATOM 1439 CA GLY 262 -19.586 -7.214 -14.037 0.00 0.00 +0.000 C +ATOM 1440 HA2 GLY 262 -19.918 -6.812 -13.169 0.00 0.00 +0.000 HD +ATOM 1441 HA3 GLY 262 -19.075 -6.492 -14.529 0.00 0.00 +0.000 HD +ATOM 1442 C GLY 262 -20.780 -7.641 -14.877 0.00 0.00 +0.000 C +ATOM 1443 O GLY 262 -21.913 -7.225 -14.620 0.00 0.00 +0.000 OA +ATOM 1444 N ARG 263 -20.539 -8.488 -15.875 0.00 0.00 +0.000 N +ATOM 1445 H ARG 263 -19.560 -8.777 -15.986 0.00 0.00 +0.000 HD +ATOM 1446 CA ARG 263 -21.633 -8.947 -16.729 0.00 0.00 +0.000 C +ATOM 1447 HA ARG 263 -22.156 -8.144 -17.044 0.00 0.00 +0.000 HD +ATOM 1448 CB ARG 263 -21.092 -9.657 -17.976 0.00 0.00 +0.000 C +ATOM 1449 HB2 ARG 263 -20.407 -10.313 -17.688 0.00 0.00 +0.000 HD +ATOM 1450 HB3 ARG 263 -21.848 -10.112 -18.428 0.00 0.00 +0.000 HD +ATOM 1451 CG ARG 263 -20.444 -8.706 -18.979 0.00 0.00 +0.000 C +ATOM 1452 HG2 ARG 263 -21.127 -8.065 -19.323 0.00 0.00 +0.000 HD +ATOM 1453 HG3 ARG 263 -19.704 -8.205 -18.535 0.00 0.00 +0.000 HD +ATOM 1454 CD ARG 263 -19.846 -9.447 -20.189 0.00 0.00 +0.000 C +ATOM 1455 HD2 ARG 263 -19.412 -8.769 -20.774 0.00 0.00 +0.000 HD +ATOM 1456 HD3 ARG 263 -19.170 -10.090 -19.844 0.00 0.00 +0.000 HD +ATOM 1457 NE ARG 263 -20.865 -10.172 -20.953 0.00 0.00 +0.000 N +ATOM 1458 HE ARG 263 -20.922 -11.166 -20.833 0.00 0.00 +0.000 HD +ATOM 1459 CZ ARG 263 -21.712 -9.588 -21.790 0.00 0.00 +0.000 C +ATOM 1460 NH1 ARG 263 -21.642 -8.290 -21.971 0.00 0.00 +0.000 N +ATOM 1461 HH11 ARG 263 -20.961 -7.721 -21.518 0.00 0.00 +0.000 HD +ATOM 1462 HH12 ARG 263 -22.304 -7.837 -22.598 0.00 0.00 +0.000 HD +ATOM 1463 NH2 ARG 263 -22.642 -10.290 -22.413 0.00 0.00 +0.000 N +ATOM 1464 HH21 ARG 263 -22.690 -11.284 -22.261 0.00 0.00 +0.000 HD +ATOM 1465 HH22 ARG 263 -23.288 -9.848 -23.027 0.00 0.00 +0.000 HD +ATOM 1466 C ARG 263 -22.575 -9.876 -15.974 0.00 0.00 +0.000 C +ATOM 1467 O ARG 263 -23.756 -9.949 -16.291 0.00 0.00 +0.000 OA +ATOM 1468 N ILE 264 -22.050 -10.595 -14.985 0.00 0.00 +0.000 N +ATOM 1469 H ILE 264 -21.039 -10.459 -14.830 0.00 0.00 +0.000 HD +ATOM 1470 CA ILE 264 -22.880 -11.500 -14.199 0.00 0.00 +0.000 C +ATOM 1471 HA ILE 264 -23.483 -11.964 -14.843 0.00 0.00 +0.000 HD +ATOM 1472 CB ILE 264 -21.985 -12.465 -13.384 0.00 0.00 +0.000 C +ATOM 1473 HB ILE 264 -21.293 -11.928 -12.933 0.00 0.00 +0.000 HD +ATOM 1474 CG2 ILE 264 -22.805 -13.230 -12.339 0.00 0.00 +0.000 C +ATOM 1475 HG21 ILE 264 -22.199 -13.828 -11.821 0.00 0.00 +0.000 HD +ATOM 1476 HG22 ILE 264 -23.242 -12.579 -11.724 0.00 0.00 +0.000 HD +ATOM 1477 HG23 ILE 264 -23.500 -13.774 -12.802 0.00 0.00 +0.000 HD +ATOM 1478 CG1 ILE 264 -21.291 -13.423 -14.357 0.00 0.00 +0.000 C +ATOM 1479 HG12 ILE 264 -21.995 -13.994 -14.788 0.00 0.00 +0.000 HD +ATOM 1480 HG13 ILE 264 -20.858 -12.872 -15.076 0.00 0.00 +0.000 HD +ATOM 1481 CD1 ILE 264 -20.253 -14.307 -13.729 0.00 0.00 +0.000 C +ATOM 1482 HD11 ILE 264 -20.676 -14.873 -13.020 0.00 0.00 +0.000 HD +ATOM 1483 HD12 ILE 264 -19.848 -14.900 -14.427 0.00 0.00 +0.000 HD +ATOM 1484 HD13 ILE 264 -19.535 -13.744 -13.317 0.00 0.00 +0.000 HD +ATOM 1485 C ILE 264 -23.782 -10.670 -13.282 0.00 0.00 +0.000 C +ATOM 1486 O ILE 264 -24.956 -10.986 -13.084 0.00 0.00 +0.000 OA +ATOM 1487 N VAL 265 -23.231 -9.590 -12.741 0.00 0.00 +0.000 N +ATOM 1488 H VAL 265 -22.236 -9.436 -12.982 0.00 0.00 +0.000 HD +ATOM 1489 CA VAL 265 -23.999 -8.703 -11.874 0.00 0.00 +0.000 C +ATOM 1490 HA VAL 265 -24.442 -9.254 -11.169 0.00 0.00 +0.000 HD +ATOM 1491 CB VAL 265 -23.098 -7.632 -11.234 0.00 0.00 +0.000 C +ATOM 1492 HB VAL 265 -22.575 -7.203 -11.962 0.00 0.00 +0.000 HD +ATOM 1493 CG1 VAL 265 -23.949 -6.547 -10.596 0.00 0.00 +0.000 C +ATOM 1494 HG11 VAL 265 -23.364 -5.926 -10.073 0.00 0.00 +0.000 HD +ATOM 1495 HG12 VAL 265 -24.425 -6.032 -11.309 0.00 0.00 +0.000 HD +ATOM 1496 HG13 VAL 265 -24.621 -6.965 -9.984 0.00 0.00 +0.000 HD +ATOM 1497 CG2 VAL 265 -22.187 -8.274 -10.192 0.00 0.00 +0.000 C +ATOM 1498 HG21 VAL 265 -22.288 -9.267 -10.235 0.00 0.00 +0.000 HD +ATOM 1499 HG22 VAL 265 -21.239 -8.022 -10.385 0.00 0.00 +0.000 HD +ATOM 1500 HG23 VAL 265 -22.446 -7.947 -9.284 0.00 0.00 +0.000 HD +ATOM 1501 C VAL 265 -25.106 -8.024 -12.699 0.00 0.00 +0.000 C +ATOM 1502 O VAL 265 -26.230 -7.866 -12.228 0.00 0.00 +0.000 OA +ATOM 1503 N THR 266 -24.797 -7.645 -13.937 0.00 0.00 +0.000 N +ATOM 1504 H THR 266 -23.827 -7.828 -14.227 0.00 0.00 +0.000 HD +ATOM 1505 CA THR 266 -25.802 -7.015 -14.791 0.00 0.00 +0.000 C +ATOM 1506 HA THR 266 -26.195 -6.237 -14.302 0.00 0.00 +0.000 HD +ATOM 1507 CB THR 266 -25.192 -6.544 -16.125 0.00 0.00 +0.000 C +ATOM 1508 HB THR 266 -24.752 -7.338 -16.584 0.00 0.00 +0.000 HD +ATOM 1509 CG2 THR 266 -26.275 -5.935 -17.034 0.00 0.00 +0.000 C +ATOM 1510 HG21 THR 266 -27.172 -6.277 -16.755 0.00 0.00 +0.000 HD +ATOM 1511 HG22 THR 266 -26.255 -4.939 -16.951 0.00 0.00 +0.000 HD +ATOM 1512 HG23 THR 266 -26.097 -6.196 -17.982 0.00 0.00 +0.000 HD +ATOM 1513 OG1 THR 266 -24.177 -5.563 -15.857 0.00 0.00 +0.000 OA +ATOM 1514 HG1 THR 266 -23.376 -5.998 -15.434 0.00 0.00 +0.000 HD +ATOM 1515 C THR 266 -26.919 -8.016 -15.079 0.00 0.00 +0.000 C +ATOM 1516 O THR 266 -28.102 -7.673 -15.065 0.00 0.00 +0.000 OA +ATOM 1517 N LEU 267 -26.537 -9.259 -15.345 0.00 0.00 +0.000 N +ATOM 1518 H LEU 267 -25.512 -9.412 -15.348 0.00 0.00 +0.000 HD +ATOM 1519 CA LEU 267 -27.511 -10.311 -15.610 0.00 0.00 +0.000 C +ATOM 1520 HA LEU 267 -28.040 -10.063 -16.429 0.00 0.00 +0.000 HD +ATOM 1521 CB LEU 267 -26.791 -11.643 -15.839 0.00 0.00 +0.000 C +ATOM 1522 HB2 LEU 267 -26.350 -11.603 -16.734 0.00 0.00 +0.000 HD +ATOM 1523 HB3 LEU 267 -26.101 -11.745 -15.126 0.00 0.00 +0.000 HD +ATOM 1524 CG LEU 267 -27.658 -12.908 -15.817 0.00 0.00 +0.000 C +ATOM 1525 HG LEU 267 -28.287 -12.856 -15.047 0.00 0.00 +0.000 HD +ATOM 1526 CD1 LEU 267 -28.450 -13.011 -17.114 0.00 0.00 +0.000 C +ATOM 1527 HD11 LEU 267 -27.818 -13.056 -17.888 0.00 0.00 +0.000 HD +ATOM 1528 HD12 LEU 267 -29.014 -13.837 -17.096 0.00 0.00 +0.000 HD +ATOM 1529 HD13 LEU 267 -29.038 -12.208 -17.210 0.00 0.00 +0.000 HD +ATOM 1530 CD2 LEU 267 -26.769 -14.138 -15.637 0.00 0.00 +0.000 C +ATOM 1531 HD21 LEU 267 -26.269 -14.062 -14.775 0.00 0.00 +0.000 HD +ATOM 1532 HD22 LEU 267 -27.339 -14.959 -15.623 0.00 0.00 +0.000 HD +ATOM 1533 HD23 LEU 267 -26.121 -14.192 -16.396 0.00 0.00 +0.000 HD +ATOM 1534 C LEU 267 -28.486 -10.466 -14.440 0.00 0.00 +0.000 C +ATOM 1535 O LEU 267 -29.704 -10.525 -14.630 0.00 0.00 +0.000 OA +ATOM 1536 N ILE 268 -27.937 -10.531 -13.232 0.00 0.00 +0.000 N +ATOM 1537 H ILE 268 -26.899 -10.447 -13.221 0.00 0.00 +0.000 HD +ATOM 1538 CA ILE 268 -28.737 -10.707 -12.023 0.00 0.00 +0.000 C +ATOM 1539 HA ILE 268 -29.429 -11.406 -12.241 0.00 0.00 +0.000 HD +ATOM 1540 CB ILE 268 -27.836 -11.130 -10.830 0.00 0.00 +0.000 C +ATOM 1541 HB ILE 268 -27.096 -10.477 -10.765 0.00 0.00 +0.000 HD +ATOM 1542 CG2 ILE 268 -28.635 -11.125 -9.524 0.00 0.00 +0.000 C +ATOM 1543 HG21 ILE 268 -28.031 -11.365 -8.768 0.00 0.00 +0.000 HD +ATOM 1544 HG22 ILE 268 -29.015 -10.215 -9.374 0.00 0.00 +0.000 HD +ATOM 1545 HG23 ILE 268 -29.374 -11.791 -9.588 0.00 0.00 +0.000 HD +ATOM 1546 CG1 ILE 268 -27.232 -12.514 -11.101 0.00 0.00 +0.000 C +ATOM 1547 HG12 ILE 268 -27.963 -13.193 -11.050 0.00 0.00 +0.000 HD +ATOM 1548 HG13 ILE 268 -26.860 -12.516 -12.029 0.00 0.00 +0.000 HD +ATOM 1549 CD1 ILE 268 -26.127 -12.908 -10.135 0.00 0.00 +0.000 C +ATOM 1550 HD11 ILE 268 -26.492 -12.921 -9.206 0.00 0.00 +0.000 HD +ATOM 1551 HD12 ILE 268 -25.788 -13.815 -10.377 0.00 0.00 +0.000 HD +ATOM 1552 HD13 ILE 268 -25.385 -12.243 -10.197 0.00 0.00 +0.000 HD +ATOM 1553 C ILE 268 -29.503 -9.437 -11.658 0.00 0.00 +0.000 C +ATOM 1554 O ILE 268 -30.666 -9.494 -11.258 0.00 0.00 +0.000 OA +ATOM 1555 N SER 269 -28.850 -8.293 -11.829 0.00 0.00 +0.000 N +ATOM 1556 H SER 269 -27.887 -8.395 -12.209 0.00 0.00 +0.000 HD +ATOM 1557 CA SER 269 -29.452 -7.007 -11.504 0.00 0.00 +0.000 C +ATOM 1558 HA SER 269 -29.763 -7.043 -10.539 0.00 0.00 +0.000 HD +ATOM 1559 CB SER 269 -28.413 -5.898 -11.641 0.00 0.00 +0.000 C +ATOM 1560 HB2 SER 269 -28.046 -5.913 -12.562 0.00 0.00 +0.000 HD +ATOM 1561 HB3 SER 269 -28.846 -5.026 -11.449 0.00 0.00 +0.000 HD +ATOM 1562 OG SER 269 -27.359 -6.104 -10.719 0.00 0.00 +0.000 OA +ATOM 1563 HG SER 269 -26.715 -6.772 -11.091 0.00 0.00 +0.000 HD +ATOM 1564 C SER 269 -30.657 -6.687 -12.371 0.00 0.00 +0.000 C +ATOM 1565 O SER 269 -31.663 -6.161 -11.887 0.00 0.00 +0.000 OA +ATOM 1566 N PHE 270 -30.554 -6.970 -13.660 0.00 0.00 +0.000 N +ATOM 1567 H PHE 270 -29.662 -7.363 -13.966 0.00 0.00 +0.000 HD +ATOM 1568 CA PHE 270 -31.685 -6.709 -14.524 0.00 0.00 +0.000 C +ATOM 1569 HA PHE 270 -32.057 -5.822 -14.269 0.00 0.00 +0.000 HD +ATOM 1570 CB PHE 270 -31.292 -6.802 -16.000 0.00 0.00 +0.000 C +ATOM 1571 HB2 PHE 270 -30.548 -6.174 -16.155 0.00 0.00 +0.000 HD +ATOM 1572 HB3 PHE 270 -31.029 -7.734 -16.185 0.00 0.00 +0.000 HD +ATOM 1573 CG PHE 270 -32.412 -6.439 -16.935 0.00 0.00 +0.000 A +ATOM 1574 CD1 PHE 270 -32.845 -5.119 -17.043 0.00 0.00 +0.000 A +ATOM 1575 HD1 PHE 270 -32.389 -4.402 -16.529 0.00 0.00 +0.000 HD +ATOM 1576 CE1 PHE 270 -33.919 -4.787 -17.873 0.00 0.00 +0.000 A +ATOM 1577 HE1 PHE 270 -34.218 -3.831 -17.935 0.00 0.00 +0.000 HD +ATOM 1578 CZ PHE 270 -34.560 -5.781 -18.600 0.00 0.00 +0.000 A +ATOM 1579 HZ PHE 270 -35.328 -5.548 -19.194 0.00 0.00 +0.000 HD +ATOM 1580 CE2 PHE 270 -34.130 -7.102 -18.499 0.00 0.00 +0.000 A +ATOM 1581 HE2 PHE 270 -34.593 -7.831 -19.025 0.00 0.00 +0.000 HD +ATOM 1582 CD2 PHE 270 -33.062 -7.419 -17.670 0.00 0.00 +0.000 A +ATOM 1583 HD2 PHE 270 -32.756 -8.372 -17.603 0.00 0.00 +0.000 HD +ATOM 1584 C PHE 270 -32.759 -7.742 -14.201 0.00 0.00 +0.000 C +ATOM 1585 O PHE 270 -33.948 -7.482 -14.363 0.00 0.00 +0.000 OA +ATOM 1586 N GLY 271 -32.330 -8.919 -13.752 0.00 0.00 +0.000 N +ATOM 1587 H GLY 271 -31.308 -9.025 -13.696 0.00 0.00 +0.000 HD +ATOM 1588 CA GLY 271 -33.283 -9.951 -13.379 0.00 0.00 +0.000 C +ATOM 1589 HA2 GLY 271 -33.873 -10.163 -14.156 0.00 0.00 +0.000 HD +ATOM 1590 HA3 GLY 271 -32.796 -10.774 -13.093 0.00 0.00 +0.000 HD +ATOM 1591 C GLY 271 -34.130 -9.437 -12.226 0.00 0.00 +0.000 C +ATOM 1592 O GLY 271 -35.335 -9.677 -12.173 0.00 0.00 +0.000 OA +ATOM 1593 N ALA 272 -33.489 -8.730 -11.298 0.00 0.00 +0.000 N +ATOM 1594 H ALA 272 -32.467 -8.624 -11.461 0.00 0.00 +0.000 HD +ATOM 1595 CA ALA 272 -34.182 -8.156 -10.149 0.00 0.00 +0.000 C +ATOM 1596 HA ALA 272 -34.733 -8.872 -9.712 0.00 0.00 +0.000 HD +ATOM 1597 CB ALA 272 -33.182 -7.617 -9.146 0.00 0.00 +0.000 C +ATOM 1598 HB1 ALA 272 -32.392 -8.229 -9.095 0.00 0.00 +0.000 HD +ATOM 1599 HB2 ALA 272 -32.876 -6.707 -9.430 0.00 0.00 +0.000 HD +ATOM 1600 HB3 ALA 272 -33.610 -7.555 -8.243 0.00 0.00 +0.000 HD +ATOM 1601 C ALA 272 -35.109 -7.037 -10.606 0.00 0.00 +0.000 C +ATOM 1602 O ALA 272 -36.184 -6.845 -10.039 0.00 0.00 +0.000 OA +ATOM 1603 N PHE 273 -34.682 -6.304 -11.634 0.00 0.00 +0.000 N +ATOM 1604 H PHE 273 -33.748 -6.581 -12.004 0.00 0.00 +0.000 HD +ATOM 1605 CA PHE 273 -35.467 -5.203 -12.191 0.00 0.00 +0.000 C +ATOM 1606 HA PHE 273 -35.743 -4.625 -11.428 0.00 0.00 +0.000 HD +ATOM 1607 CB PHE 273 -34.648 -4.478 -13.270 0.00 0.00 +0.000 C +ATOM 1608 HB2 PHE 273 -33.740 -4.323 -12.905 0.00 0.00 +0.000 HD +ATOM 1609 HB3 PHE 273 -34.614 -5.066 -14.067 0.00 0.00 +0.000 HD +ATOM 1610 CG PHE 273 -35.212 -3.149 -13.695 0.00 0.00 +0.000 A +ATOM 1611 CD1 PHE 273 -35.122 -2.036 -12.863 0.00 0.00 +0.000 A +ATOM 1612 HD1 PHE 273 -34.711 -2.117 -11.963 0.00 0.00 +0.000 HD +ATOM 1613 CE1 PHE 273 -35.607 -0.788 -13.281 0.00 0.00 +0.000 A +ATOM 1614 HE1 PHE 273 -35.534 0.000 -12.666 0.00 0.00 +0.000 HD +ATOM 1615 CZ PHE 273 -36.184 -0.659 -14.540 0.00 0.00 +0.000 A +ATOM 1616 HZ PHE 273 -36.527 0.227 -14.843 0.00 0.00 +0.000 HD +ATOM 1617 CE2 PHE 273 -36.279 -1.772 -15.373 0.00 0.00 +0.000 A +ATOM 1618 HE2 PHE 273 -36.701 -1.687 -16.289 0.00 0.00 +0.000 HD +ATOM 1619 CD2 PHE 273 -35.796 -3.002 -14.947 0.00 0.00 +0.000 A +ATOM 1620 HD2 PHE 273 -35.869 -3.797 -15.553 0.00 0.00 +0.000 HD +ATOM 1621 C PHE 273 -36.748 -5.778 -12.794 0.00 0.00 +0.000 C +ATOM 1622 O PHE 273 -37.816 -5.187 -12.683 0.00 0.00 +0.000 OA +ATOM 1623 N VAL 274 -36.633 -6.931 -13.447 0.00 0.00 +0.000 N +ATOM 1624 H VAL 274 -35.676 -7.316 -13.494 0.00 0.00 +0.000 HD +ATOM 1625 CA VAL 274 -37.798 -7.571 -14.039 0.00 0.00 +0.000 C +ATOM 1626 HA VAL 274 -38.326 -6.879 -14.527 0.00 0.00 +0.000 HD +ATOM 1627 CB VAL 274 -37.387 -8.720 -14.996 0.00 0.00 +0.000 C +ATOM 1628 HB VAL 274 -36.832 -9.358 -14.475 0.00 0.00 +0.000 HD +ATOM 1629 CG1 VAL 274 -38.619 -9.480 -15.471 0.00 0.00 +0.000 C +ATOM 1630 HG11 VAL 274 -38.340 -10.211 -16.093 0.00 0.00 +0.000 HD +ATOM 1631 HG12 VAL 274 -39.091 -9.875 -14.683 0.00 0.00 +0.000 HD +ATOM 1632 HG13 VAL 274 -39.234 -8.853 -15.948 0.00 0.00 +0.000 HD +ATOM 1633 CG2 VAL 274 -36.637 -8.154 -16.194 0.00 0.00 +0.000 C +ATOM 1634 HG21 VAL 274 -36.840 -7.179 -16.279 0.00 0.00 +0.000 HD +ATOM 1635 HG22 VAL 274 -35.655 -8.283 -16.059 0.00 0.00 +0.000 HD +ATOM 1636 HG23 VAL 274 -36.929 -8.632 -17.022 0.00 0.00 +0.000 HD +ATOM 1637 C VAL 274 -38.679 -8.128 -12.918 0.00 0.00 +0.000 C +ATOM 1638 O VAL 274 -39.900 -8.053 -12.989 0.00 0.00 +0.000 OA +ATOM 1639 N ALA 275 -38.051 -8.685 -11.885 0.00 0.00 +0.000 N +ATOM 1640 H ALA 275 -37.017 -8.693 -11.956 0.00 0.00 +0.000 HD +ATOM 1641 CA ALA 275 -38.788 -9.234 -10.754 0.00 0.00 +0.000 C +ATOM 1642 HA ALA 275 -39.379 -9.977 -11.078 0.00 0.00 +0.000 HD +ATOM 1643 CB ALA 275 -37.819 -9.798 -9.703 0.00 0.00 +0.000 C +ATOM 1644 HB1 ALA 275 -38.106 -9.494 -8.798 0.00 0.00 +0.000 HD +ATOM 1645 HB2 ALA 275 -37.834 -10.794 -9.746 0.00 0.00 +0.000 HD +ATOM 1646 HB3 ALA 275 -36.899 -9.465 -9.895 0.00 0.00 +0.000 HD +ATOM 1647 C ALA 275 -39.671 -8.149 -10.132 0.00 0.00 +0.000 C +ATOM 1648 O ALA 275 -40.813 -8.413 -9.743 0.00 0.00 +0.000 OA +ATOM 1649 N LYS 276 -39.140 -6.933 -10.027 0.00 0.00 +0.000 N +ATOM 1650 H LYS 276 -38.168 -6.846 -10.365 0.00 0.00 +0.000 HD +ATOM 1651 CA LYS 276 -39.909 -5.821 -9.467 0.00 0.00 +0.000 C +ATOM 1652 HA LYS 276 -40.239 -6.082 -8.559 0.00 0.00 +0.000 HD +ATOM 1653 CB LYS 276 -39.056 -4.558 -9.365 0.00 0.00 +0.000 C +ATOM 1654 HB2 LYS 276 -38.563 -4.446 -10.230 0.00 0.00 +0.000 HD +ATOM 1655 HB3 LYS 276 -39.672 -3.778 -9.236 0.00 0.00 +0.000 HD +ATOM 1656 CG LYS 276 -38.051 -4.567 -8.238 0.00 0.00 +0.000 C +ATOM 1657 HG2 LYS 276 -38.533 -4.481 -7.367 0.00 0.00 +0.000 HD +ATOM 1658 HG3 LYS 276 -37.542 -5.425 -8.258 0.00 0.00 +0.000 HD +ATOM 1659 CD LYS 276 -37.085 -3.417 -8.382 0.00 0.00 +0.000 C +ATOM 1660 HD2 LYS 276 -36.546 -3.546 -9.210 0.00 0.00 +0.000 HD +ATOM 1661 HD3 LYS 276 -37.597 -2.565 -8.435 0.00 0.00 +0.000 HD +ATOM 1662 CE LYS 276 -36.143 -3.341 -7.200 0.00 0.00 +0.000 C +ATOM 1663 HE2 LYS 276 -36.662 -3.100 -6.384 0.00 0.00 +0.000 HD +ATOM 1664 HE3 LYS 276 -35.705 -4.228 -7.074 0.00 0.00 +0.000 HD +ATOM 1665 NZ LYS 276 -35.107 -2.311 -7.446 0.00 0.00 +0.000 N +ATOM 1666 HZ1 LYS 276 -35.246 -1.905 -8.350 0.00 0.00 +0.000 HD +ATOM 1667 HZ2 LYS 276 -35.172 -1.597 -6.748 0.00 0.00 +0.000 HD +ATOM 1668 HZ3 LYS 276 -34.200 -2.732 -7.407 0.00 0.00 +0.000 HD +ATOM 1669 C LYS 276 -41.100 -5.536 -10.363 0.00 0.00 +0.000 C +ATOM 1670 O LYS 276 -42.215 -5.319 -9.885 0.00 0.00 +0.000 OA +ATOM 1671 N HIE 277 -40.853 -5.525 -11.670 0.00 0.00 +0.000 N +ATOM 1672 H HIE 277 -39.863 -5.706 -11.927 0.00 0.00 +0.000 HD +ATOM 1673 CA HIE 277 -41.905 -5.277 -12.645 0.00 0.00 +0.000 C +ATOM 1674 HA HIE 277 -42.322 -4.384 -12.449 0.00 0.00 +0.000 HD +ATOM 1675 CB HIE 277 -41.314 -5.289 -14.054 0.00 0.00 +0.000 C +ATOM 1676 HB2 HIE 277 -40.784 -4.446 -14.194 0.00 0.00 +0.000 HD +ATOM 1677 HB3 HIE 277 -40.693 -6.075 -14.141 0.00 0.00 +0.000 HD +ATOM 1678 CG HIE 277 -42.344 -5.382 -15.135 0.00 0.00 +0.000 A +ATOM 1679 ND1 HIE 277 -43.132 -4.316 -15.507 0.00 0.00 +0.000 NA +ATOM 1680 CE1 HIE 277 -43.967 -4.701 -16.457 0.00 0.00 +0.000 A +ATOM 1681 HE1 HIE 277 -44.647 -4.126 -16.903 0.00 0.00 +0.000 HD +ATOM 1682 NE2 HIE 277 -43.748 -5.977 -16.712 0.00 0.00 +0.000 N +ATOM 1683 HE2 HIE 277 -44.239 -6.529 -17.389 0.00 0.00 +0.000 HD +ATOM 1684 CD2 HIE 277 -42.735 -6.427 -15.899 0.00 0.00 +0.000 A +ATOM 1685 HD2 HIE 277 -42.362 -7.350 -15.878 0.00 0.00 +0.000 HD +ATOM 1686 C HIE 277 -43.002 -6.344 -12.545 0.00 0.00 +0.000 C +ATOM 1687 O HIE 277 -44.191 -6.039 -12.682 0.00 0.00 +0.000 OA +ATOM 1688 N LEU 278 -42.592 -7.592 -12.312 0.00 0.00 +0.000 N +ATOM 1689 H LEU 278 -41.560 -7.698 -12.221 0.00 0.00 +0.000 HD +ATOM 1690 CA LEU 278 -43.526 -8.711 -12.196 0.00 0.00 +0.000 C +ATOM 1691 HA LEU 278 -44.096 -8.740 -13.030 0.00 0.00 +0.000 HD +ATOM 1692 CB LEU 278 -42.762 -10.033 -12.087 0.00 0.00 +0.000 C +ATOM 1693 HB2 LEU 278 -42.036 -9.911 -11.434 0.00 0.00 +0.000 HD +ATOM 1694 HB3 LEU 278 -43.398 -10.730 -11.812 0.00 0.00 +0.000 HD +ATOM 1695 CG LEU 278 -42.133 -10.470 -13.405 0.00 0.00 +0.000 C +ATOM 1696 HG LEU 278 -41.482 -9.772 -13.703 0.00 0.00 +0.000 HD +ATOM 1697 CD1 LEU 278 -41.411 -11.794 -13.236 0.00 0.00 +0.000 C +ATOM 1698 HD11 LEU 278 -42.060 -12.496 -12.939 0.00 0.00 +0.000 HD +ATOM 1699 HD12 LEU 278 -41.003 -12.069 -14.108 0.00 0.00 +0.000 HD +ATOM 1700 HD13 LEU 278 -40.689 -11.698 -12.549 0.00 0.00 +0.000 HD +ATOM 1701 CD2 LEU 278 -43.222 -10.602 -14.452 0.00 0.00 +0.000 C +ATOM 1702 HD21 LEU 278 -43.681 -9.720 -14.575 0.00 0.00 +0.000 HD +ATOM 1703 HD22 LEU 278 -42.819 -10.889 -15.323 0.00 0.00 +0.000 HD +ATOM 1704 HD23 LEU 278 -43.893 -11.285 -14.157 0.00 0.00 +0.000 HD +ATOM 1705 C LEU 278 -44.450 -8.569 -10.989 0.00 0.00 +0.000 C +ATOM 1706 O LEU 278 -45.623 -8.954 -11.051 0.00 0.00 +0.000 OA +ATOM 1707 N LYS 279 -43.920 -8.030 -9.896 0.00 0.00 +0.000 N +ATOM 1708 H LYS 279 -42.923 -7.764 -9.975 0.00 0.00 +0.000 HD +ATOM 1709 CA LYS 279 -44.715 -7.840 -8.686 0.00 0.00 +0.000 C +ATOM 1710 HA LYS 279 -45.225 -8.680 -8.498 0.00 0.00 +0.000 HD +ATOM 1711 CB LYS 279 -43.805 -7.482 -7.512 0.00 0.00 +0.000 C +ATOM 1712 HB2 LYS 279 -43.176 -8.246 -7.362 0.00 0.00 +0.000 HD +ATOM 1713 HB3 LYS 279 -43.279 -6.667 -7.764 0.00 0.00 +0.000 HD +ATOM 1714 CG LYS 279 -44.532 -7.200 -6.214 0.00 0.00 +0.000 C +ATOM 1715 HG2 LYS 279 -43.874 -6.876 -5.534 0.00 0.00 +0.000 HD +ATOM 1716 HG3 LYS 279 -45.224 -6.497 -6.372 0.00 0.00 +0.000 HD +ATOM 1717 CD LYS 279 -45.207 -8.448 -5.691 0.00 0.00 +0.000 C +ATOM 1718 HD2 LYS 279 -45.969 -8.688 -6.296 0.00 0.00 +0.000 HD +ATOM 1719 HD3 LYS 279 -44.546 -9.201 -5.681 0.00 0.00 +0.000 HD +ATOM 1720 CE LYS 279 -45.763 -8.288 -4.271 0.00 0.00 +0.000 C +ATOM 1721 HE2 LYS 279 -46.090 -9.184 -3.949 0.00 0.00 +0.000 HD +ATOM 1722 HE3 LYS 279 -45.018 -7.987 -3.664 0.00 0.00 +0.000 HD +ATOM 1723 NZ LYS 279 -46.892 -7.298 -4.182 0.00 0.00 +0.000 N +ATOM 1724 HZ1 LYS 279 -47.093 -6.953 -5.096 0.00 0.00 +0.000 HD +ATOM 1725 HZ2 LYS 279 -47.694 -7.755 -3.806 0.00 0.00 +0.000 HD +ATOM 1726 HZ3 LYS 279 -46.618 -6.547 -3.586 0.00 0.00 +0.000 HD +ATOM 1727 C LYS 279 -45.696 -6.706 -8.913 0.00 0.00 +0.000 C +ATOM 1728 O LYS 279 -46.876 -6.795 -8.559 0.00 0.00 +0.000 OA +ATOM 1729 N THR 280 -45.177 -5.634 -9.503 0.00 0.00 +0.000 N +ATOM 1730 H THR 280 -44.158 -5.730 -9.741 0.00 0.00 +0.000 HD +ATOM 1731 CA THR 280 -45.943 -4.432 -9.797 0.00 0.00 +0.000 C +ATOM 1732 HA THR 280 -46.245 -4.020 -8.924 0.00 0.00 +0.000 HD +ATOM 1733 CB THR 280 -45.039 -3.414 -10.528 0.00 0.00 +0.000 C +ATOM 1734 HB THR 280 -44.638 -3.862 -11.348 0.00 0.00 +0.000 HD +ATOM 1735 CG2 THR 280 -45.819 -2.186 -10.931 0.00 0.00 +0.000 C +ATOM 1736 HG21 THR 280 -46.797 -2.404 -10.999 0.00 0.00 +0.000 HD +ATOM 1737 HG22 THR 280 -45.696 -1.459 -10.249 0.00 0.00 +0.000 HD +ATOM 1738 HG23 THR 280 -45.500 -1.850 -11.822 0.00 0.00 +0.000 HD +ATOM 1739 OG1 THR 280 -43.962 -3.031 -9.655 0.00 0.00 +0.000 OA +ATOM 1740 HG1 THR 280 -43.250 -3.740 -9.651 0.00 0.00 +0.000 HD +ATOM 1741 C THR 280 -47.187 -4.732 -10.634 0.00 0.00 +0.000 C +ATOM 1742 O THR 280 -48.260 -4.173 -10.379 0.00 0.00 +0.000 OA +ATOM 1743 N ILE 281 -47.040 -5.618 -11.619 0.00 0.00 +0.000 N +ATOM 1744 H ILE 281 -46.090 -6.016 -11.711 0.00 0.00 +0.000 HD +ATOM 1745 CA ILE 281 -48.158 -5.979 -12.487 0.00 0.00 +0.000 C +ATOM 1746 HA ILE 281 -48.818 -5.212 -12.429 0.00 0.00 +0.000 HD +ATOM 1747 CB ILE 281 -47.723 -6.197 -13.963 0.00 0.00 +0.000 C +ATOM 1748 HB ILE 281 -48.546 -6.348 -14.500 0.00 0.00 +0.000 HD +ATOM 1749 CG2 ILE 281 -46.986 -4.959 -14.477 0.00 0.00 +0.000 C +ATOM 1750 HG21 ILE 281 -46.747 -5.092 -15.436 0.00 0.00 +0.000 HD +ATOM 1751 HG22 ILE 281 -47.578 -4.162 -14.387 0.00 0.00 +0.000 HD +ATOM 1752 HG23 ILE 281 -46.156 -4.823 -13.941 0.00 0.00 +0.000 HD +ATOM 1753 CG1 ILE 281 -46.832 -7.434 -14.092 0.00 0.00 +0.000 C +ATOM 1754 HG12 ILE 281 -45.954 -7.234 -13.667 0.00 0.00 +0.000 HD +ATOM 1755 HG13 ILE 281 -47.268 -8.183 -13.599 0.00 0.00 +0.000 HD +ATOM 1756 CD1 ILE 281 -46.609 -7.851 -15.520 0.00 0.00 +0.000 C +ATOM 1757 HD11 ILE 281 -46.168 -7.106 -16.022 0.00 0.00 +0.000 HD +ATOM 1758 HD12 ILE 281 -46.022 -8.661 -15.545 0.00 0.00 +0.000 HD +ATOM 1759 HD13 ILE 281 -47.488 -8.065 -15.948 0.00 0.00 +0.000 HD +ATOM 1760 C ILE 281 -48.899 -7.226 -12.028 0.00 0.00 +0.000 C +ATOM 1761 O ILE 281 -49.607 -7.858 -12.817 0.00 0.00 +0.000 OA +ATOM 1762 N ASN 282 -48.731 -7.578 -10.754 0.00 0.00 +0.000 N +ATOM 1763 H ASN 282 -48.101 -6.948 -10.211 0.00 0.00 +0.000 HD +ATOM 1764 CA ASN 282 -49.380 -8.755 -10.167 0.00 0.00 +0.000 C +ATOM 1765 HA ASN 282 -49.008 -8.849 -9.211 0.00 0.00 +0.000 HD +ATOM 1766 CB ASN 282 -50.877 -8.523 -9.987 0.00 0.00 +0.000 C +ATOM 1767 HB2 ASN 282 -51.158 -7.797 -10.605 0.00 0.00 +0.000 HD +ATOM 1768 HB3 ASN 282 -51.352 -9.369 -10.204 0.00 0.00 +0.000 HD +ATOM 1769 CG ASN 282 -51.208 -8.122 -8.579 0.00 0.00 +0.000 C +ATOM 1770 OD1 ASN 282 -51.177 -6.936 -8.252 0.00 0.00 +0.000 OA +ATOM 1771 ND2 ASN 282 -51.493 -9.099 -7.724 0.00 0.00 +0.000 N +ATOM 1772 HD21 ASN 282 -51.725 -8.889 -6.778 0.00 0.00 +0.000 HD +ATOM 1773 HD22 ASN 282 -51.472 -10.051 -8.039 0.00 0.00 +0.000 HD +ATOM 1774 C ASN 282 -49.157 -10.096 -10.859 0.00 0.00 +0.000 C +ATOM 1775 O ASN 282 -50.109 -10.831 -11.162 0.00 0.00 +0.000 OA +ATOM 1776 N GLN 283 -47.888 -10.398 -11.128 0.00 0.00 +0.000 N +ATOM 1777 H GLN 283 -47.203 -9.656 -10.878 0.00 0.00 +0.000 HD +ATOM 1778 CA GLN 283 -47.501 -11.677 -11.728 0.00 0.00 +0.000 C +ATOM 1779 HA GLN 283 -48.270 -12.287 -11.668 0.00 0.00 +0.000 HD +ATOM 1780 CB GLN 283 -46.992 -11.472 -13.156 0.00 0.00 +0.000 C +ATOM 1781 HB2 GLN 283 -46.424 -10.653 -13.183 0.00 0.00 +0.000 HD +ATOM 1782 HB3 GLN 283 -46.453 -12.268 -13.425 0.00 0.00 +0.000 HD +ATOM 1783 CG GLN 283 -48.118 -11.299 -14.177 0.00 0.00 +0.000 C +ATOM 1784 HG2 GLN 283 -48.852 -10.767 -13.754 0.00 0.00 +0.000 HD +ATOM 1785 HG3 GLN 283 -47.758 -10.800 -14.966 0.00 0.00 +0.000 HD +ATOM 1786 CD GLN 283 -48.696 -12.621 -14.661 0.00 0.00 +0.000 C +ATOM 1787 OE1 GLN 283 -48.563 -13.663 -14.011 0.00 0.00 +0.000 OA +ATOM 1788 NE2 GLN 283 -49.364 -12.576 -15.803 0.00 0.00 +0.000 N +ATOM 1789 HE21 GLN 283 -49.771 -13.424 -16.202 0.00 0.00 +0.000 HD +ATOM 1790 HE22 GLN 283 -49.470 -11.685 -16.282 0.00 0.00 +0.000 HD +ATOM 1791 C GLN 283 -46.402 -12.207 -10.825 0.00 0.00 +0.000 C +ATOM 1792 O GLN 283 -45.402 -12.743 -11.289 0.00 0.00 +0.000 OA +ATOM 1793 N GLU 284 -46.614 -12.047 -9.522 0.00 0.00 +0.000 N +ATOM 1794 H GLU 284 -47.524 -11.591 -9.286 0.00 0.00 +0.000 HD +ATOM 1795 CA GLU 284 -45.653 -12.474 -8.508 0.00 0.00 +0.000 C +ATOM 1796 HA GLU 284 -44.825 -11.868 -8.554 0.00 0.00 +0.000 HD +ATOM 1797 CB GLU 284 -46.227 -12.220 -7.116 0.00 0.00 +0.000 C +ATOM 1798 HB2 GLU 284 -46.836 -11.454 -7.181 0.00 0.00 +0.000 HD +ATOM 1799 HB3 GLU 284 -46.681 -13.040 -6.827 0.00 0.00 +0.000 HD +ATOM 1800 CG GLU 284 -45.167 -11.889 -6.099 0.00 0.00 +0.000 C +ATOM 1801 HG2 GLU 284 -44.517 -12.628 -6.074 0.00 0.00 +0.000 HD +ATOM 1802 HG3 GLU 284 -44.746 -11.036 -6.351 0.00 0.00 +0.000 HD +ATOM 1803 CD GLU 284 -45.729 -11.727 -4.711 0.00 0.00 +0.000 C +ATOM 1804 OE1 GLU 284 -46.883 -11.254 -4.595 0.00 0.00 +0.000 OA +ATOM 1805 OE2 GLU 284 -45.005 -12.055 -3.750 0.00 0.00 +0.000 OA +ATOM 1806 C GLU 284 -45.204 -13.933 -8.594 0.00 0.00 +0.000 C +ATOM 1807 O GLU 284 -44.051 -14.254 -8.288 0.00 0.00 +0.000 OA +ATOM 1808 N SER 285 -46.099 -14.826 -9.001 0.00 0.00 +0.000 N +ATOM 1809 H SER 285 -47.022 -14.453 -9.249 0.00 0.00 +0.000 HD +ATOM 1810 CA SER 285 -45.736 -16.237 -9.071 0.00 0.00 +0.000 C +ATOM 1811 HA SER 285 -45.328 -16.499 -8.178 0.00 0.00 +0.000 HD +ATOM 1812 CB SER 285 -46.978 -17.107 -9.289 0.00 0.00 +0.000 C +ATOM 1813 HB2 SER 285 -46.721 -18.065 -9.180 0.00 0.00 +0.000 HD +ATOM 1814 HB3 SER 285 -47.664 -16.861 -8.607 0.00 0.00 +0.000 HD +ATOM 1815 OG SER 285 -47.529 -16.922 -10.583 0.00 0.00 +0.000 OA +ATOM 1816 HG SER 285 -48.009 -16.047 -10.618 0.00 0.00 +0.000 HD +ATOM 1817 C SER 285 -44.711 -16.547 -10.158 0.00 0.00 +0.000 C +ATOM 1818 O SER 285 -44.196 -17.662 -10.224 0.00 0.00 +0.000 OA +ATOM 1819 N CYS 286 -44.415 -15.567 -11.006 0.00 0.00 +0.000 N +ATOM 1820 H CYS 286 -44.905 -14.674 -10.836 0.00 0.00 +0.000 HD +ATOM 1821 CA CYS 286 -43.460 -15.778 -12.088 0.00 0.00 +0.000 C +ATOM 1822 HA CYS 286 -43.531 -16.747 -12.387 0.00 0.00 +0.000 HD +ATOM 1823 CB CYS 286 -43.816 -14.888 -13.282 0.00 0.00 +0.000 C +ATOM 1824 HB2 CYS 286 -43.878 -13.941 -12.951 0.00 0.00 +0.000 HD +ATOM 1825 HB3 CYS 286 -43.062 -14.947 -13.944 0.00 0.00 +0.000 HD +ATOM 1826 SG CYS 286 -45.353 -15.297 -14.132 0.00 0.00 +0.000 S +ATOM 1827 HG CYS 286 -45.691 -14.491 -14.619 0.00 0.00 +0.000 HD +ATOM 1828 C CYS 286 -42.018 -15.518 -11.677 0.00 0.00 +0.000 C +ATOM 1829 O CYS 286 -41.087 -15.868 -12.400 0.00 0.00 +0.000 OA +ATOM 1830 N ILE 287 -41.841 -14.909 -10.510 0.00 0.00 +0.000 N +ATOM 1831 H ILE 287 -42.715 -14.693 -9.994 0.00 0.00 +0.000 HD +ATOM 1832 CA ILE 287 -40.513 -14.583 -10.019 0.00 0.00 +0.000 C +ATOM 1833 HA ILE 287 -40.056 -14.056 -10.766 0.00 0.00 +0.000 HD +ATOM 1834 CB ILE 287 -40.600 -13.656 -8.774 0.00 0.00 +0.000 C +ATOM 1835 HB ILE 287 -41.148 -14.114 -8.094 0.00 0.00 +0.000 HD +ATOM 1836 CG2 ILE 287 -39.195 -13.338 -8.249 0.00 0.00 +0.000 C +ATOM 1837 HG21 ILE 287 -39.270 -12.748 -7.449 0.00 0.00 +0.000 HD +ATOM 1838 HG22 ILE 287 -38.738 -14.188 -7.999 0.00 0.00 +0.000 HD +ATOM 1839 HG23 ILE 287 -38.676 -12.874 -8.962 0.00 0.00 +0.000 HD +ATOM 1840 CG1 ILE 287 -41.317 -12.348 -9.164 0.00 0.00 +0.000 C +ATOM 1841 HG12 ILE 287 -40.728 -11.846 -9.800 0.00 0.00 +0.000 HD +ATOM 1842 HG13 ILE 287 -42.162 -12.590 -9.647 0.00 0.00 +0.000 HD +ATOM 1843 CD1 ILE 287 -41.672 -11.434 -7.997 0.00 0.00 +0.000 C +ATOM 1844 HD11 ILE 287 -40.835 -11.174 -7.521 0.00 0.00 +0.000 HD +ATOM 1845 HD12 ILE 287 -42.129 -10.620 -8.348 0.00 0.00 +0.000 HD +ATOM 1846 HD13 ILE 287 -42.279 -11.922 -7.374 0.00 0.00 +0.000 HD +ATOM 1847 C ILE 287 -39.618 -15.775 -9.723 0.00 0.00 +0.000 C +ATOM 1848 O ILE 287 -38.500 -15.831 -10.211 0.00 0.00 +0.000 OA +ATOM 1849 N GLU 288 -40.099 -16.733 -8.941 0.00 0.00 +0.000 N +ATOM 1850 H GLU 288 -41.052 -16.591 -8.590 0.00 0.00 +0.000 HD +ATOM 1851 CA GLU 288 -39.275 -17.902 -8.630 0.00 0.00 +0.000 C +ATOM 1852 HA GLU 288 -38.451 -17.615 -8.134 0.00 0.00 +0.000 HD +ATOM 1853 CB GLU 288 -40.025 -18.823 -7.677 0.00 0.00 +0.000 C +ATOM 1854 HB2 GLU 288 -40.347 -18.280 -6.921 0.00 0.00 +0.000 HD +ATOM 1855 HB3 GLU 288 -40.765 -19.239 -8.175 0.00 0.00 +0.000 HD +ATOM 1856 CG GLU 288 -39.173 -19.947 -7.101 0.00 0.00 +0.000 C +ATOM 1857 HG2 GLU 288 -39.013 -20.608 -7.809 0.00 0.00 +0.000 HD +ATOM 1858 HG3 GLU 288 -38.341 -19.560 -6.753 0.00 0.00 +0.000 HD +ATOM 1859 CD GLU 288 -39.856 -20.673 -5.944 0.00 0.00 +0.000 C +ATOM 1860 OE1 GLU 288 -39.451 -20.469 -4.775 0.00 0.00 +0.000 OA +ATOM 1861 OE2 GLU 288 -40.804 -21.433 -6.218 0.00 0.00 +0.000 OA +ATOM 1862 C GLU 288 -38.859 -18.634 -9.919 0.00 0.00 +0.000 C +ATOM 1863 O GLU 288 -37.709 -19.041 -10.060 0.00 0.00 +0.000 OA +ATOM 1864 N PRO 289 -39.785 -18.801 -10.879 0.00 0.00 +0.000 N +ATOM 1865 CD PRO 289 -41.247 -18.648 -10.751 0.00 0.00 +0.000 C +ATOM 1866 HD2 PRO 289 -41.522 -17.719 -10.984 0.00 0.00 +0.000 HD +ATOM 1867 HD3 PRO 289 -41.541 -18.866 -9.823 0.00 0.00 +0.000 HD +ATOM 1868 CG PRO 289 -41.764 -19.645 -11.745 0.00 0.00 +0.000 C +ATOM 1869 HG2 PRO 289 -42.678 -19.407 -12.055 0.00 0.00 +0.000 HD +ATOM 1870 HG3 PRO 289 -41.753 -20.566 -11.372 0.00 0.00 +0.000 HD +ATOM 1871 CB PRO 289 -40.780 -19.528 -12.878 0.00 0.00 +0.000 C +ATOM 1872 HB2 PRO 289 -40.935 -18.694 -13.394 0.00 0.00 +0.000 HD +ATOM 1873 HB3 PRO 289 -40.829 -20.321 -13.472 0.00 0.00 +0.000 HD +ATOM 1874 CA PRO 289 -39.443 -19.476 -12.140 0.00 0.00 +0.000 C +ATOM 1875 HA PRO 289 -39.121 -20.408 -11.970 0.00 0.00 +0.000 HD +ATOM 1876 C PRO 289 -38.387 -18.666 -12.901 0.00 0.00 +0.000 C +ATOM 1877 O PRO 289 -37.498 -19.231 -13.534 0.00 0.00 +0.000 OA +ATOM 1878 N LEU 290 -38.485 -17.340 -12.828 0.00 0.00 +0.000 N +ATOM 1879 H LEU 290 -39.281 -16.987 -12.273 0.00 0.00 +0.000 HD +ATOM 1880 CA LEU 290 -37.515 -16.476 -13.500 0.00 0.00 +0.000 C +ATOM 1881 HA LEU 290 -37.463 -16.744 -14.466 0.00 0.00 +0.000 HD +ATOM 1882 CB LEU 290 -37.923 -15.009 -13.387 0.00 0.00 +0.000 C +ATOM 1883 HB2 LEU 290 -38.773 -14.889 -13.868 0.00 0.00 +0.000 HD +ATOM 1884 HB3 LEU 290 -37.998 -14.783 -12.434 0.00 0.00 +0.000 HD +ATOM 1885 CG LEU 290 -36.903 -14.052 -14.009 0.00 0.00 +0.000 C +ATOM 1886 HG LEU 290 -36.003 -14.241 -13.620 0.00 0.00 +0.000 HD +ATOM 1887 CD1 LEU 290 -36.856 -14.244 -15.514 0.00 0.00 +0.000 C +ATOM 1888 HD11 LEU 290 -37.759 -14.059 -15.905 0.00 0.00 +0.000 HD +ATOM 1889 HD12 LEU 290 -36.187 -13.615 -15.913 0.00 0.00 +0.000 HD +ATOM 1890 HD13 LEU 290 -36.591 -15.186 -15.725 0.00 0.00 +0.000 HD +ATOM 1891 CD2 LEU 290 -37.269 -12.634 -13.665 0.00 0.00 +0.000 C +ATOM 1892 HD21 LEU 290 -37.271 -12.512 -12.669 0.00 0.00 +0.000 HD +ATOM 1893 HD22 LEU 290 -36.604 -12.000 -14.070 0.00 0.00 +0.000 HD +ATOM 1894 HD23 LEU 290 -38.182 -12.419 -14.021 0.00 0.00 +0.000 HD +ATOM 1895 C LEU 290 -36.131 -16.644 -12.878 0.00 0.00 +0.000 C +ATOM 1896 O LEU 290 -35.124 -16.698 -13.586 0.00 0.00 +0.000 OA +ATOM 1897 N ALA 291 -36.087 -16.709 -11.550 0.00 0.00 +0.000 N +ATOM 1898 H ALA 291 -37.001 -16.638 -11.075 0.00 0.00 +0.000 HD +ATOM 1899 CA ALA 291 -34.817 -16.870 -10.849 0.00 0.00 +0.000 C +ATOM 1900 HA ALA 291 -34.208 -16.116 -11.104 0.00 0.00 +0.000 HD +ATOM 1901 CB ALA 291 -35.032 -16.836 -9.329 0.00 0.00 +0.000 C +ATOM 1902 HB1 ALA 291 -35.841 -16.289 -9.125 0.00 0.00 +0.000 HD +ATOM 1903 HB2 ALA 291 -35.161 -17.767 -8.996 0.00 0.00 +0.000 HD +ATOM 1904 HB3 ALA 291 -34.231 -16.430 -8.894 0.00 0.00 +0.000 HD +ATOM 1905 C ALA 291 -34.166 -18.185 -11.261 0.00 0.00 +0.000 C +ATOM 1906 O ALA 291 -32.949 -18.275 -11.381 0.00 0.00 +0.000 OA +ATOM 1907 N GLU 292 -34.989 -19.204 -11.477 0.00 0.00 +0.000 N +ATOM 1908 H GLU 292 -35.994 -18.993 -11.330 0.00 0.00 +0.000 HD +ATOM 1909 CA GLU 292 -34.487 -20.500 -11.887 0.00 0.00 +0.000 C +ATOM 1910 HA GLU 292 -33.766 -20.804 -11.261 0.00 0.00 +0.000 HD +ATOM 1911 CB GLU 292 -35.612 -21.538 -11.847 0.00 0.00 +0.000 C +ATOM 1912 HB2 GLU 292 -36.072 -21.445 -10.981 0.00 0.00 +0.000 HD +ATOM 1913 HB3 GLU 292 -36.212 -21.357 -12.606 0.00 0.00 +0.000 HD +ATOM 1914 CG GLU 292 -35.134 -22.972 -11.966 0.00 0.00 +0.000 C +ATOM 1915 HG2 GLU 292 -34.917 -23.149 -12.905 0.00 0.00 +0.000 HD +ATOM 1916 HG3 GLU 292 -34.367 -23.095 -11.369 0.00 0.00 +0.000 HD +ATOM 1917 CD GLU 292 -36.204 -23.960 -11.547 0.00 0.00 +0.000 C +ATOM 1918 OE1 GLU 292 -36.975 -23.633 -10.618 0.00 0.00 +0.000 OA +ATOM 1919 OE2 GLU 292 -36.262 -25.059 -12.129 0.00 0.00 +0.000 OA +ATOM 1920 C GLU 292 -33.919 -20.405 -13.302 0.00 0.00 +0.000 C +ATOM 1921 O GLU 292 -32.898 -21.015 -13.600 0.00 0.00 +0.000 OA +ATOM 1922 N SER 293 -34.587 -19.641 -14.168 0.00 0.00 +0.000 N +ATOM 1923 H SER 293 -35.438 -19.189 -13.786 0.00 0.00 +0.000 HD +ATOM 1924 CA SER 293 -34.133 -19.468 -15.552 0.00 0.00 +0.000 C +ATOM 1925 HA SER 293 -34.007 -20.383 -15.953 0.00 0.00 +0.000 HD +ATOM 1926 CB SER 293 -35.161 -18.677 -16.365 0.00 0.00 +0.000 C +ATOM 1927 HB2 SER 293 -35.388 -17.844 -15.872 0.00 0.00 +0.000 HD +ATOM 1928 HB3 SER 293 -34.768 -18.458 -17.252 0.00 0.00 +0.000 HD +ATOM 1929 OG SER 293 -36.342 -19.437 -16.558 0.00 0.00 +0.000 OA +ATOM 1930 HG SER 293 -36.848 -19.490 -15.698 0.00 0.00 +0.000 HD +ATOM 1931 C SER 293 -32.793 -18.743 -15.604 0.00 0.00 +0.000 C +ATOM 1932 O SER 293 -31.915 -19.092 -16.394 0.00 0.00 +0.000 OA +ATOM 1933 N ILE 294 -32.644 -17.729 -14.760 0.00 0.00 +0.000 N +ATOM 1934 H ILE 294 -33.460 -17.532 -14.158 0.00 0.00 +0.000 HD +ATOM 1935 CA ILE 294 -31.398 -16.965 -14.712 0.00 0.00 +0.000 C +ATOM 1936 HA ILE 294 -31.183 -16.718 -15.657 0.00 0.00 +0.000 HD +ATOM 1937 CB ILE 294 -31.517 -15.748 -13.765 0.00 0.00 +0.000 C +ATOM 1938 HB ILE 294 -31.826 -16.078 -12.882 0.00 0.00 +0.000 HD +ATOM 1939 CG2 ILE 294 -30.166 -15.058 -13.630 0.00 0.00 +0.000 C +ATOM 1940 HG21 ILE 294 -30.246 -14.291 -12.996 0.00 0.00 +0.000 HD +ATOM 1941 HG22 ILE 294 -29.493 -15.709 -13.283 0.00 0.00 +0.000 HD +ATOM 1942 HG23 ILE 294 -29.873 -14.722 -14.523 0.00 0.00 +0.000 HD +ATOM 1943 CG1 ILE 294 -32.565 -14.763 -14.298 0.00 0.00 +0.000 C +ATOM 1944 HG12 ILE 294 -32.268 -14.440 -15.194 0.00 0.00 +0.000 HD +ATOM 1945 HG13 ILE 294 -33.429 -15.253 -14.404 0.00 0.00 +0.000 HD +ATOM 1946 CD1 ILE 294 -32.797 -13.561 -13.395 0.00 0.00 +0.000 C +ATOM 1947 HD11 ILE 294 -31.941 -13.059 -13.292 0.00 0.00 +0.000 HD +ATOM 1948 HD12 ILE 294 -33.488 -12.971 -13.807 0.00 0.00 +0.000 HD +ATOM 1949 HD13 ILE 294 -33.112 -13.878 -12.503 0.00 0.00 +0.000 HD +ATOM 1950 C ILE 294 -30.263 -17.863 -14.226 0.00 0.00 +0.000 C +ATOM 1951 O ILE 294 -29.157 -17.838 -14.768 0.00 0.00 +0.000 OA +ATOM 1952 N THR 295 -30.545 -18.657 -13.198 0.00 0.00 +0.000 N +ATOM 1953 H THR 295 -31.511 -18.575 -12.833 0.00 0.00 +0.000 HD +ATOM 1954 CA THR 295 -29.547 -19.564 -12.648 0.00 0.00 +0.000 C +ATOM 1955 HA THR 295 -28.737 -19.030 -12.387 0.00 0.00 +0.000 HD +ATOM 1956 CB THR 295 -30.079 -20.312 -11.406 0.00 0.00 +0.000 C +ATOM 1957 HB THR 295 -30.869 -20.891 -11.687 0.00 0.00 +0.000 HD +ATOM 1958 CG2 THR 295 -28.976 -21.162 -10.787 0.00 0.00 +0.000 C +ATOM 1959 HG21 THR 295 -28.350 -20.578 -10.266 0.00 0.00 +0.000 HD +ATOM 1960 HG22 THR 295 -29.378 -21.844 -10.172 0.00 0.00 +0.000 HD +ATOM 1961 HG23 THR 295 -28.464 -21.631 -11.509 0.00 0.00 +0.000 HD +ATOM 1962 OG1 THR 295 -30.539 -19.361 -10.441 0.00 0.00 +0.000 OA +ATOM 1963 HG1 THR 295 -31.401 -18.941 -10.746 0.00 0.00 +0.000 HD +ATOM 1964 C THR 295 -29.129 -20.588 -13.697 0.00 0.00 +0.000 C +ATOM 1965 O THR 295 -27.951 -20.909 -13.808 0.00 0.00 +0.000 OA +ATOM 1966 N ASP 296 -30.092 -21.093 -14.469 0.00 0.00 +0.000 N +ATOM 1967 H ASP 296 -31.041 -20.749 -14.276 0.00 0.00 +0.000 HD +ATOM 1968 CA ASP 296 -29.769 -22.070 -15.510 0.00 0.00 +0.000 C +ATOM 1969 HA ASP 296 -29.272 -22.822 -15.064 0.00 0.00 +0.000 HD +ATOM 1970 CB ASP 296 -31.028 -22.577 -16.218 0.00 0.00 +0.000 C +ATOM 1971 HB2 ASP 296 -31.595 -21.788 -16.432 0.00 0.00 +0.000 HD +ATOM 1972 HB3 ASP 296 -30.744 -23.035 -17.054 0.00 0.00 +0.000 HD +ATOM 1973 CG ASP 296 -31.823 -23.540 -15.375 0.00 0.00 +0.000 C +ATOM 1974 OD1 ASP 296 -31.238 -24.168 -14.466 0.00 0.00 +0.000 OA +ATOM 1975 OD2 ASP 296 -33.035 -23.683 -15.635 0.00 0.00 +0.000 OA +ATOM 1976 C ASP 296 -28.836 -21.464 -16.544 0.00 0.00 +0.000 C +ATOM 1977 O ASP 296 -27.879 -22.103 -16.968 0.00 0.00 +0.000 OA +ATOM 1978 N VAL 297 -29.112 -20.227 -16.948 0.00 0.00 +0.000 N +ATOM 1979 H VAL 297 -29.944 -19.797 -16.515 0.00 0.00 +0.000 HD +ATOM 1980 CA VAL 297 -28.271 -19.561 -17.936 0.00 0.00 +0.000 C +ATOM 1981 HA VAL 297 -28.191 -20.165 -18.739 0.00 0.00 +0.000 HD +ATOM 1982 CB VAL 297 -28.898 -18.220 -18.388 0.00 0.00 +0.000 C +ATOM 1983 HB VAL 297 -29.063 -17.675 -17.576 0.00 0.00 +0.000 HD +ATOM 1984 CG1 VAL 297 -27.904 -17.436 -19.256 0.00 0.00 +0.000 C +ATOM 1985 HG11 VAL 297 -28.385 -16.690 -19.711 0.00 0.00 +0.000 HD +ATOM 1986 HG12 VAL 297 -27.181 -17.068 -18.675 0.00 0.00 +0.000 HD +ATOM 1987 HG13 VAL 297 -27.510 -18.049 -19.937 0.00 0.00 +0.000 HD +ATOM 1988 CG2 VAL 297 -30.184 -18.490 -19.161 0.00 0.00 +0.000 C +ATOM 1989 HG21 VAL 297 -30.804 -19.028 -18.590 0.00 0.00 +0.000 HD +ATOM 1990 HG22 VAL 297 -30.614 -17.620 -19.399 0.00 0.00 +0.000 HD +ATOM 1991 HG23 VAL 297 -29.966 -18.998 -19.994 0.00 0.00 +0.000 HD +ATOM 1992 C VAL 297 -26.868 -19.315 -17.393 0.00 0.00 +0.000 C +ATOM 1993 O VAL 297 -25.877 -19.574 -18.071 0.00 0.00 +0.000 OA +ATOM 1994 N LEU 298 -26.787 -18.828 -16.159 0.00 0.00 +0.000 N +ATOM 1995 H LEU 298 -27.691 -18.665 -15.687 0.00 0.00 +0.000 HD +ATOM 1996 CA LEU 298 -25.487 -18.551 -15.537 0.00 0.00 +0.000 C +ATOM 1997 HA LEU 298 -24.962 -17.940 -16.154 0.00 0.00 +0.000 HD +ATOM 1998 CB LEU 298 -25.674 -17.814 -14.206 0.00 0.00 +0.000 C +ATOM 1999 HB2 LEU 298 -26.062 -16.920 -14.406 0.00 0.00 +0.000 HD +ATOM 2000 HB3 LEU 298 -26.299 -18.348 -13.649 0.00 0.00 +0.000 HD +ATOM 2001 CG LEU 298 -24.404 -17.591 -13.390 0.00 0.00 +0.000 C +ATOM 2002 HG LEU 298 -23.978 -18.472 -13.199 0.00 0.00 +0.000 HD +ATOM 2003 CD1 LEU 298 -23.426 -16.719 -14.175 0.00 0.00 +0.000 C +ATOM 2004 HD11 LEU 298 -23.852 -15.836 -14.370 0.00 0.00 +0.000 HD +ATOM 2005 HD12 LEU 298 -22.598 -16.579 -13.633 0.00 0.00 +0.000 HD +ATOM 2006 HD13 LEU 298 -23.191 -17.174 -15.033 0.00 0.00 +0.000 HD +ATOM 2007 CD2 LEU 298 -24.747 -16.911 -12.069 0.00 0.00 +0.000 C +ATOM 2008 HD21 LEU 298 -25.375 -17.490 -11.549 0.00 0.00 +0.000 HD +ATOM 2009 HD22 LEU 298 -23.910 -16.769 -11.540 0.00 0.00 +0.000 HD +ATOM 2010 HD23 LEU 298 -25.181 -16.028 -12.251 0.00 0.00 +0.000 HD +ATOM 2011 C LEU 298 -24.646 -19.810 -15.285 0.00 0.00 +0.000 C +ATOM 2012 O LEU 298 -23.514 -19.923 -15.764 0.00 0.00 +0.000 OA +ATOM 2013 N VAL 299 -25.210 -20.758 -14.545 0.00 0.00 +0.000 N +ATOM 2014 H VAL 299 -26.179 -20.563 -14.244 0.00 0.00 +0.000 HD +ATOM 2015 CA VAL 299 -24.480 -21.965 -14.208 0.00 0.00 +0.000 C +ATOM 2016 HA VAL 299 -23.540 -21.688 -13.894 0.00 0.00 +0.000 HD +ATOM 2017 CB VAL 299 -25.121 -22.663 -12.966 0.00 0.00 +0.000 C +ATOM 2018 HB VAL 299 -26.039 -22.940 -13.228 0.00 0.00 +0.000 HD +ATOM 2019 CG1 VAL 299 -24.354 -23.921 -12.597 0.00 0.00 +0.000 C +ATOM 2020 HG11 VAL 299 -24.502 -24.133 -11.630 0.00 0.00 +0.000 HD +ATOM 2021 HG12 VAL 299 -24.675 -24.686 -13.157 0.00 0.00 +0.000 HD +ATOM 2022 HG13 VAL 299 -23.377 -23.778 -12.759 0.00 0.00 +0.000 HD +ATOM 2023 CG2 VAL 299 -25.133 -21.702 -11.781 0.00 0.00 +0.000 C +ATOM 2024 HG21 VAL 299 -25.080 -20.763 -12.119 0.00 0.00 +0.000 HD +ATOM 2025 HG22 VAL 299 -25.979 -21.828 -11.265 0.00 0.00 +0.000 HD +ATOM 2026 HG23 VAL 299 -24.348 -21.895 -11.194 0.00 0.00 +0.000 HD +ATOM 2027 C VAL 299 -24.305 -22.980 -15.332 0.00 0.00 +0.000 C +ATOM 2028 O VAL 299 -23.236 -23.584 -15.445 0.00 0.00 +0.000 OA +ATOM 2029 N ARG 300 -25.322 -23.160 -16.172 0.00 0.00 +0.000 N +ATOM 2030 H ARG 300 -26.144 -22.561 -16.006 0.00 0.00 +0.000 HD +ATOM 2031 CA ARG 300 -25.236 -24.151 -17.242 0.00 0.00 +0.000 C +ATOM 2032 HA ARG 300 -24.816 -25.000 -16.861 0.00 0.00 +0.000 HD +ATOM 2033 CB ARG 300 -26.636 -24.560 -17.707 0.00 0.00 +0.000 C +ATOM 2034 HB2 ARG 300 -27.022 -23.808 -18.242 0.00 0.00 +0.000 HD +ATOM 2035 HB3 ARG 300 -26.551 -25.370 -18.287 0.00 0.00 +0.000 HD +ATOM 2036 CG ARG 300 -27.633 -24.894 -16.588 0.00 0.00 +0.000 C +ATOM 2037 HG2 ARG 300 -27.621 -24.150 -15.906 0.00 0.00 +0.000 HD +ATOM 2038 HG3 ARG 300 -28.562 -24.940 -16.981 0.00 0.00 +0.000 HD +ATOM 2039 CD ARG 300 -27.369 -26.208 -15.855 0.00 0.00 +0.000 C +ATOM 2040 HD2 ARG 300 -27.318 -26.931 -16.523 0.00 0.00 +0.000 HD +ATOM 2041 HD3 ARG 300 -26.528 -26.116 -15.348 0.00 0.00 +0.000 HD +ATOM 2042 NE ARG 300 -28.473 -26.492 -14.916 0.00 0.00 +0.000 N +ATOM 2043 HE ARG 300 -29.244 -25.837 -14.901 0.00 0.00 +0.000 HD +ATOM 2044 CZ ARG 300 -28.533 -27.537 -14.093 0.00 0.00 +0.000 C +ATOM 2045 NH1 ARG 300 -27.546 -28.413 -14.078 0.00 0.00 +0.000 N +ATOM 2046 HH11 ARG 300 -26.740 -28.308 -14.653 0.00 0.00 +0.000 HD +ATOM 2047 HH12 ARG 300 -27.604 -29.218 -13.465 0.00 0.00 +0.000 HD +ATOM 2048 NH2 ARG 300 -29.593 -27.723 -13.305 0.00 0.00 +0.000 N +ATOM 2049 HH21 ARG 300 -30.337 -27.049 -13.330 0.00 0.00 +0.000 HD +ATOM 2050 HH22 ARG 300 -29.643 -28.511 -12.706 0.00 0.00 +0.000 HD +ATOM 2051 C ARG 300 -24.416 -23.705 -18.443 0.00 0.00 +0.000 C +ATOM 2052 O ARG 300 -23.952 -24.554 -19.191 0.00 0.00 +0.000 OA +ATOM 2053 N THR 301 -24.238 -22.398 -18.647 0.00 0.00 +0.000 N +ATOM 2054 H THR 301 -24.694 -21.774 -17.981 0.00 0.00 +0.000 HD +ATOM 2055 CA THR 301 -23.423 -21.951 -19.781 0.00 0.00 +0.000 C +ATOM 2056 HA THR 301 -23.268 -22.748 -20.395 0.00 0.00 +0.000 HD +ATOM 2057 CB THR 301 -24.154 -20.889 -20.679 0.00 0.00 +0.000 C +ATOM 2058 HB THR 301 -23.608 -20.770 -21.533 0.00 0.00 +0.000 HD +ATOM 2059 CG2 THR 301 -25.556 -21.360 -21.005 0.00 0.00 +0.000 C +ATOM 2060 HG21 THR 301 -25.521 -22.100 -21.682 0.00 0.00 +0.000 HD +ATOM 2061 HG22 THR 301 -26.006 -21.699 -20.175 0.00 0.00 +0.000 HD +ATOM 2062 HG23 THR 301 -26.095 -20.601 -21.380 0.00 0.00 +0.000 HD +ATOM 2063 OG1 THR 301 -24.228 -19.629 -20.004 0.00 0.00 +0.000 OA +ATOM 2064 HG1 THR 301 -24.915 -19.664 -19.270 0.00 0.00 +0.000 HD +ATOM 2065 C THR 301 -22.053 -21.387 -19.382 0.00 0.00 +0.000 C +ATOM 2066 O THR 301 -21.204 -21.174 -20.242 0.00 0.00 +0.000 OA +ATOM 2067 N LYS 302 -21.823 -21.154 -18.093 0.00 0.00 +0.000 N +ATOM 2068 H LYS 302 -22.586 -21.387 -17.452 0.00 0.00 +0.000 HD +ATOM 2069 CA LYS 302 -20.535 -20.595 -17.674 0.00 0.00 +0.000 C +ATOM 2070 HA LYS 302 -19.895 -20.627 -18.471 0.00 0.00 +0.000 HD +ATOM 2071 CB LYS 302 -20.686 -19.101 -17.320 0.00 0.00 +0.000 C +ATOM 2072 HB2 LYS 302 -21.279 -19.036 -16.517 0.00 0.00 +0.000 HD +ATOM 2073 HB3 LYS 302 -19.778 -18.749 -17.091 0.00 0.00 +0.000 HD +ATOM 2074 CG LYS 302 -21.274 -18.240 -18.425 0.00 0.00 +0.000 C +ATOM 2075 HG2 LYS 302 -22.184 -18.595 -18.668 0.00 0.00 +0.000 HD +ATOM 2076 HG3 LYS 302 -21.379 -17.298 -18.087 0.00 0.00 +0.000 HD +ATOM 2077 CD LYS 302 -20.412 -18.213 -19.681 0.00 0.00 +0.000 C +ATOM 2078 HD2 LYS 302 -19.526 -17.824 -19.459 0.00 0.00 +0.000 HD +ATOM 2079 HD3 LYS 302 -20.313 -19.137 -20.028 0.00 0.00 +0.000 HD +ATOM 2080 CE LYS 302 -21.052 -17.352 -20.782 0.00 0.00 +0.000 C +ATOM 2081 HE2 LYS 302 -21.978 -17.698 -20.960 0.00 0.00 +0.000 HD +ATOM 2082 HE3 LYS 302 -21.119 -16.406 -20.450 0.00 0.00 +0.000 HD +ATOM 2083 NZ LYS 302 -20.267 -17.370 -22.056 0.00 0.00 +0.000 N +ATOM 2084 HZ1 LYS 302 -19.328 -17.089 -21.866 0.00 0.00 +0.000 HD +ATOM 2085 HZ2 LYS 302 -20.274 -18.295 -22.432 0.00 0.00 +0.000 HD +ATOM 2086 HZ3 LYS 302 -20.684 -16.738 -22.707 0.00 0.00 +0.000 HD +ATOM 2087 C LYS 302 -19.875 -21.312 -16.498 0.00 0.00 +0.000 C +ATOM 2088 O LYS 302 -19.105 -20.698 -15.763 0.00 0.00 +0.000 OA +ATOM 2089 N ARG 303 -20.147 -22.604 -16.328 0.00 0.00 +0.000 N +ATOM 2090 H ARG 303 -20.771 -23.023 -17.027 0.00 0.00 +0.000 HD +ATOM 2091 CA ARG 303 -19.568 -23.337 -15.200 0.00 0.00 +0.000 C +ATOM 2092 HA ARG 303 -19.917 -22.926 -14.337 0.00 0.00 +0.000 HD +ATOM 2093 CB ARG 303 -20.039 -24.794 -15.180 0.00 0.00 +0.000 C +ATOM 2094 HB2 ARG 303 -21.023 -24.809 -15.259 0.00 0.00 +0.000 HD +ATOM 2095 HB3 ARG 303 -19.609 -25.276 -15.927 0.00 0.00 +0.000 HD +ATOM 2096 CG ARG 303 -19.662 -25.522 -13.875 0.00 0.00 +0.000 C +ATOM 2097 HG2 ARG 303 -18.674 -25.478 -13.754 0.00 0.00 +0.000 HD +ATOM 2098 HG3 ARG 303 -20.121 -25.075 -13.112 0.00 0.00 +0.000 HD +ATOM 2099 CD ARG 303 -20.081 -26.981 -13.901 0.00 0.00 +0.000 C +ATOM 2100 HD2 ARG 303 -19.638 -27.418 -14.690 0.00 0.00 +0.000 HD +ATOM 2101 HD3 ARG 303 -19.741 -27.417 -13.060 0.00 0.00 +0.000 HD +ATOM 2102 NE ARG 303 -21.528 -27.189 -13.993 0.00 0.00 +0.000 N +ATOM 2103 HE ARG 303 -21.924 -27.307 -14.916 0.00 0.00 +0.000 HD +ATOM 2104 CZ ARG 303 -22.358 -27.234 -12.956 0.00 0.00 +0.000 C +ATOM 2105 NH1 ARG 303 -21.903 -27.077 -11.718 0.00 0.00 +0.000 N +ATOM 2106 HH11 ARG 303 -20.936 -26.903 -11.548 0.00 0.00 +0.000 HD +ATOM 2107 HH12 ARG 303 -22.540 -27.133 -10.943 0.00 0.00 +0.000 HD +ATOM 2108 NH2 ARG 303 -23.646 -27.480 -13.158 0.00 0.00 +0.000 N +ATOM 2109 HH21 ARG 303 -23.990 -27.611 -14.090 0.00 0.00 +0.000 HD +ATOM 2110 HH22 ARG 303 -24.275 -27.534 -12.383 0.00 0.00 +0.000 HD +ATOM 2111 C ARG 303 -18.046 -23.309 -15.169 0.00 0.00 +0.000 C +ATOM 2112 O ARG 303 -17.450 -23.016 -14.134 0.00 0.00 +0.000 OA +ATOM 2113 N ASP 304 -17.408 -23.618 -16.294 0.00 0.00 +0.000 N +ATOM 2114 H ASP 304 -18.010 -23.844 -17.098 0.00 0.00 +0.000 HD +ATOM 2115 CA ASP 304 -15.945 -23.624 -16.343 0.00 0.00 +0.000 C +ATOM 2116 HA ASP 304 -15.632 -24.350 -15.719 0.00 0.00 +0.000 HD +ATOM 2117 CB ASP 304 -15.438 -23.869 -17.767 0.00 0.00 +0.000 C +ATOM 2118 HB2 ASP 304 -15.813 -23.158 -18.351 0.00 0.00 +0.000 HD +ATOM 2119 HB3 ASP 304 -14.446 -23.818 -17.752 0.00 0.00 +0.000 HD +ATOM 2120 CG ASP 304 -15.852 -25.219 -18.310 0.00 0.00 +0.000 C +ATOM 2121 OD1 ASP 304 -15.508 -26.250 -17.690 0.00 0.00 +0.000 OA +ATOM 2122 OD2 ASP 304 -16.522 -25.239 -19.364 0.00 0.00 +0.000 OA +ATOM 2123 C ASP 304 -15.375 -22.313 -15.830 0.00 0.00 +0.000 C +ATOM 2124 O ASP 304 -14.464 -22.313 -15.010 0.00 0.00 +0.000 OA +ATOM 2125 N TRP 305 -15.908 -21.198 -16.320 0.00 0.00 +0.000 N +ATOM 2126 H TRP 305 -16.665 -21.343 -17.015 0.00 0.00 +0.000 HD +ATOM 2127 CA TRP 305 -15.447 -19.875 -15.898 0.00 0.00 +0.000 C +ATOM 2128 HA TRP 305 -14.455 -19.833 -16.050 0.00 0.00 +0.000 HD +ATOM 2129 CB TRP 305 -16.178 -18.769 -16.674 0.00 0.00 +0.000 C +ATOM 2130 HB2 TRP 305 -16.129 -18.965 -17.644 0.00 0.00 +0.000 HD +ATOM 2131 HB3 TRP 305 -17.119 -18.723 -16.367 0.00 0.00 +0.000 HD +ATOM 2132 CG TRP 305 -15.583 -17.381 -16.476 0.00 0.00 +0.000 A +ATOM 2133 CD1 TRP 305 -14.605 -16.794 -17.230 0.00 0.00 +0.000 A +ATOM 2134 HD1 TRP 305 -14.170 -17.210 -18.028 0.00 0.00 +0.000 HD +ATOM 2135 NE1 TRP 305 -14.305 -15.549 -16.734 0.00 0.00 +0.000 N +ATOM 2136 HE1 TRP 305 -13.624 -14.921 -17.112 0.00 0.00 +0.000 HD +ATOM 2137 CE2 TRP 305 -15.087 -15.304 -15.639 0.00 0.00 +0.000 A +ATOM 2138 CZ2 TRP 305 -15.143 -14.180 -14.801 0.00 0.00 +0.000 A +ATOM 2139 HZ2 TRP 305 -14.543 -13.394 -14.973 0.00 0.00 +0.000 HD +ATOM 2140 CH2 TRP 305 -16.036 -14.206 -13.758 0.00 0.00 +0.000 A +ATOM 2141 HH2 TRP 305 -16.103 -13.426 -13.138 0.00 0.00 +0.000 HD +ATOM 2142 CZ3 TRP 305 -16.871 -15.317 -13.538 0.00 0.00 +0.000 A +ATOM 2143 HZ3 TRP 305 -17.511 -15.313 -12.780 0.00 0.00 +0.000 HD +ATOM 2144 CE3 TRP 305 -16.817 -16.438 -14.373 0.00 0.00 +0.000 A +ATOM 2145 HE3 TRP 305 -17.412 -17.214 -14.203 0.00 0.00 +0.000 HD +ATOM 2146 CD2 TRP 305 -15.912 -16.433 -15.442 0.00 0.00 +0.000 A +ATOM 2147 C TRP 305 -15.692 -19.669 -14.402 0.00 0.00 +0.000 C +ATOM 2148 O TRP 305 -14.809 -19.222 -13.675 0.00 0.00 +0.000 OA +ATOM 2149 N LEU 306 -16.897 -19.995 -13.943 0.00 0.00 +0.000 N +ATOM 2150 H LEU 306 -17.551 -20.370 -14.647 0.00 0.00 +0.000 HD +ATOM 2151 CA LEU 306 -17.230 -19.819 -12.533 0.00 0.00 +0.000 C +ATOM 2152 HA LEU 306 -17.155 -18.836 -12.307 0.00 0.00 +0.000 HD +ATOM 2153 CB LEU 306 -18.679 -20.241 -12.273 0.00 0.00 +0.000 C +ATOM 2154 HB2 LEU 306 -18.811 -21.132 -12.666 0.00 0.00 +0.000 HD +ATOM 2155 HB3 LEU 306 -18.829 -20.232 -11.303 0.00 0.00 +0.000 HD +ATOM 2156 CG LEU 306 -19.695 -19.297 -12.911 0.00 0.00 +0.000 C +ATOM 2157 HG LEU 306 -19.384 -19.058 -13.830 0.00 0.00 +0.000 HD +ATOM 2158 CD1 LEU 306 -21.053 -19.967 -12.993 0.00 0.00 +0.000 C +ATOM 2159 HD11 LEU 306 -21.366 -20.209 -12.073 0.00 0.00 +0.000 HD +ATOM 2160 HD12 LEU 306 -21.713 -19.341 -13.412 0.00 0.00 +0.000 HD +ATOM 2161 HD13 LEU 306 -20.986 -20.797 -13.548 0.00 0.00 +0.000 HD +ATOM 2162 CD2 LEU 306 -19.769 -18.011 -12.098 0.00 0.00 +0.000 C +ATOM 2163 HD21 LEU 306 -18.869 -17.573 -12.083 0.00 0.00 +0.000 HD +ATOM 2164 HD22 LEU 306 -20.434 -17.391 -12.514 0.00 0.00 +0.000 HD +ATOM 2165 HD23 LEU 306 -20.052 -18.223 -11.162 0.00 0.00 +0.000 HD +ATOM 2166 C LEU 306 -16.291 -20.594 -11.618 0.00 0.00 +0.000 C +ATOM 2167 O LEU 306 -15.801 -20.061 -10.624 0.00 0.00 +0.000 OA +ATOM 2168 N VAL 307 -16.037 -21.850 -11.955 0.00 0.00 +0.000 N +ATOM 2169 H VAL 307 -16.500 -22.182 -12.814 0.00 0.00 +0.000 HD +ATOM 2170 CA VAL 307 -15.155 -22.673 -11.136 0.00 0.00 +0.000 C +ATOM 2171 HA VAL 307 -15.501 -22.661 -10.192 0.00 0.00 +0.000 HD +ATOM 2172 CB VAL 307 -15.143 -24.141 -11.644 0.00 0.00 +0.000 C +ATOM 2173 HB VAL 307 -14.859 -24.122 -12.597 0.00 0.00 +0.000 HD +ATOM 2174 CG1 VAL 307 -14.119 -24.965 -10.883 0.00 0.00 +0.000 C +ATOM 2175 HG11 VAL 307 -14.459 -25.899 -10.766 0.00 0.00 +0.000 HD +ATOM 2176 HG12 VAL 307 -13.259 -24.987 -11.394 0.00 0.00 +0.000 HD +ATOM 2177 HG13 VAL 307 -13.960 -24.556 -9.984 0.00 0.00 +0.000 HD +ATOM 2178 CG2 VAL 307 -16.537 -24.742 -11.481 0.00 0.00 +0.000 C +ATOM 2179 HG21 VAL 307 -16.594 -25.201 -10.595 0.00 0.00 +0.000 HD +ATOM 2180 HG22 VAL 307 -17.216 -24.011 -11.528 0.00 0.00 +0.000 HD +ATOM 2181 HG23 VAL 307 -16.697 -25.401 -12.215 0.00 0.00 +0.000 HD +ATOM 2182 C VAL 307 -13.741 -22.099 -11.125 0.00 0.00 +0.000 C +ATOM 2183 O VAL 307 -13.110 -21.996 -10.069 0.00 0.00 +0.000 OA +ATOM 2184 N LYS 308 -13.249 -21.704 -12.293 0.00 0.00 +0.000 N +ATOM 2185 H LYS 308 -13.872 -21.830 -13.103 0.00 0.00 +0.000 HD +ATOM 2186 CA LYS 308 -11.906 -21.133 -12.378 0.00 0.00 +0.000 C +ATOM 2187 HA LYS 308 -11.246 -21.792 -12.001 0.00 0.00 +0.000 HD +ATOM 2188 CB LYS 308 -11.521 -20.884 -13.844 0.00 0.00 +0.000 C +ATOM 2189 HB2 LYS 308 -11.676 -21.725 -14.353 0.00 0.00 +0.000 HD +ATOM 2190 HB3 LYS 308 -12.102 -20.157 -14.198 0.00 0.00 +0.000 HD +ATOM 2191 CG LYS 308 -10.063 -20.470 -14.035 0.00 0.00 +0.000 C +ATOM 2192 HG2 LYS 308 -9.967 -19.500 -13.791 0.00 0.00 +0.000 HD +ATOM 2193 HG3 LYS 308 -9.487 -21.017 -13.421 0.00 0.00 +0.000 HD +ATOM 2194 CD LYS 308 -9.578 -20.665 -15.467 0.00 0.00 +0.000 C +ATOM 2195 HD2 LYS 308 -9.666 -21.617 -15.710 0.00 0.00 +0.000 HD +ATOM 2196 HD3 LYS 308 -10.102 -20.084 -16.067 0.00 0.00 +0.000 HD +ATOM 2197 CE LYS 308 -8.105 -20.270 -15.570 0.00 0.00 +0.000 C +ATOM 2198 HE2 LYS 308 -7.729 -20.632 -16.413 0.00 0.00 +0.000 HD +ATOM 2199 HE3 LYS 308 -8.031 -19.281 -15.549 0.00 0.00 +0.000 HD +ATOM 2200 NZ LYS 308 -7.345 -20.845 -14.406 0.00 0.00 +0.000 N +ATOM 2201 HZ1 LYS 308 -6.403 -21.012 -14.685 0.00 0.00 +0.000 HD +ATOM 2202 HZ2 LYS 308 -7.367 -20.193 -13.652 0.00 0.00 +0.000 HD +ATOM 2203 HZ3 LYS 308 -7.775 -21.701 -14.130 0.00 0.00 +0.000 HD +ATOM 2204 C LYS 308 -11.812 -19.834 -11.569 0.00 0.00 +0.000 C +ATOM 2205 O LYS 308 -10.761 -19.522 -11.011 0.00 0.00 +0.000 OA +ATOM 2206 N GLN 309 -12.916 -19.093 -11.480 0.00 0.00 +0.000 N +ATOM 2207 H GLN 309 -13.738 -19.468 -11.979 0.00 0.00 +0.000 HD +ATOM 2208 CA GLN 309 -12.922 -17.846 -10.722 0.00 0.00 +0.000 C +ATOM 2209 HA GLN 309 -11.984 -17.463 -10.743 0.00 0.00 +0.000 HD +ATOM 2210 CB GLN 309 -13.872 -16.832 -11.364 0.00 0.00 +0.000 C +ATOM 2211 HB2 GLN 309 -14.777 -17.254 -11.456 0.00 0.00 +0.000 HD +ATOM 2212 HB3 GLN 309 -13.944 -16.033 -10.761 0.00 0.00 +0.000 HD +ATOM 2213 CG GLN 309 -13.433 -16.350 -12.736 0.00 0.00 +0.000 C +ATOM 2214 HG2 GLN 309 -13.461 -17.122 -13.371 0.00 0.00 +0.000 HD +ATOM 2215 HG3 GLN 309 -14.067 -15.641 -13.045 0.00 0.00 +0.000 HD +ATOM 2216 CD GLN 309 -12.032 -15.779 -12.731 0.00 0.00 +0.000 C +ATOM 2217 OE1 GLN 309 -11.704 -14.917 -11.908 0.00 0.00 +0.000 OA +ATOM 2218 NE2 GLN 309 -11.196 -16.252 -13.647 0.00 0.00 +0.000 N +ATOM 2219 HE21 GLN 309 -10.241 -15.906 -13.714 0.00 0.00 +0.000 HD +ATOM 2220 HE22 GLN 309 -11.525 -16.973 -14.288 0.00 0.00 +0.000 HD +ATOM 2221 C GLN 309 -13.304 -18.048 -9.253 0.00 0.00 +0.000 C +ATOM 2222 O GLN 309 -13.660 -17.099 -8.564 0.00 0.00 +0.000 OA +ATOM 2223 N ARG 310 -13.260 -19.298 -8.798 0.00 0.00 +0.000 N +ATOM 2224 H ARG 310 -12.992 -20.009 -9.518 0.00 0.00 +0.000 HD +ATOM 2225 CA ARG 310 -13.561 -19.655 -7.407 0.00 0.00 +0.000 C +ATOM 2226 HA ARG 310 -13.294 -20.640 -7.265 0.00 0.00 +0.000 HD +ATOM 2227 CB ARG 310 -12.605 -18.913 -6.455 0.00 0.00 +0.000 C +ATOM 2228 HB2 ARG 310 -12.560 -17.965 -6.736 0.00 0.00 +0.000 HD +ATOM 2229 HB3 ARG 310 -12.956 -18.996 -5.534 0.00 0.00 +0.000 HD +ATOM 2230 CG ARG 310 -11.176 -19.478 -6.468 0.00 0.00 +0.000 C +ATOM 2231 HG2 ARG 310 -11.160 -20.344 -5.969 0.00 0.00 +0.000 HD +ATOM 2232 HG3 ARG 310 -10.892 -19.632 -7.414 0.00 0.00 +0.000 HD +ATOM 2233 CD ARG 310 -10.153 -18.538 -5.816 0.00 0.00 +0.000 C +ATOM 2234 HD2 ARG 310 -9.293 -19.041 -5.725 0.00 0.00 +0.000 HD +ATOM 2235 HD3 ARG 310 -10.021 -17.760 -6.432 0.00 0.00 +0.000 HD +ATOM 2236 NE ARG 310 -10.570 -18.050 -4.501 0.00 0.00 +0.000 N +ATOM 2237 HE ARG 310 -10.736 -17.054 -4.406 0.00 0.00 +0.000 HD +ATOM 2238 CZ ARG 310 -10.749 -18.806 -3.424 0.00 0.00 +0.000 C +ATOM 2239 NH1 ARG 310 -10.551 -20.116 -3.478 0.00 0.00 +0.000 N +ATOM 2240 HH11 ARG 310 -10.245 -20.553 -4.321 0.00 0.00 +0.000 HD +ATOM 2241 HH12 ARG 310 -10.709 -20.678 -2.659 0.00 0.00 +0.000 HD +ATOM 2242 NH2 ARG 310 -11.135 -18.238 -2.288 0.00 0.00 +0.000 N +ATOM 2243 HH21 ARG 310 -11.270 -17.247 -2.242 0.00 0.00 +0.000 HD +ATOM 2244 HH22 ARG 310 -11.291 -18.800 -1.475 0.00 0.00 +0.000 HD +ATOM 2245 C ARG 310 -15.009 -19.484 -6.950 0.00 0.00 +0.000 C +ATOM 2246 O ARG 310 -15.268 -19.281 -5.769 0.00 0.00 +0.000 OA +ATOM 2247 N GLY 311 -15.940 -19.577 -7.895 0.00 0.00 +0.000 N +ATOM 2248 H GLY 311 -15.578 -19.721 -8.854 0.00 0.00 +0.000 HD +ATOM 2249 CA GLY 311 -17.353 -19.479 -7.568 0.00 0.00 +0.000 C +ATOM 2250 HA2 GLY 311 -17.898 -19.492 -8.441 0.00 0.00 +0.000 HD +ATOM 2251 HA3 GLY 311 -17.638 -20.331 -7.066 0.00 0.00 +0.000 HD +ATOM 2252 C GLY 311 -17.759 -18.269 -6.753 0.00 0.00 +0.000 C +ATOM 2253 O GLY 311 -17.192 -17.194 -6.911 0.00 0.00 +0.000 OA +ATOM 2254 N TRP 312 -18.734 -18.445 -5.866 0.00 0.00 +0.000 N +ATOM 2255 H TRP 312 -19.110 -19.405 -5.810 0.00 0.00 +0.000 HD +ATOM 2256 CA TRP 312 -19.204 -17.337 -5.056 0.00 0.00 +0.000 C +ATOM 2257 HA TRP 312 -19.419 -16.563 -5.681 0.00 0.00 +0.000 HD +ATOM 2258 CB TRP 312 -20.528 -17.714 -4.385 0.00 0.00 +0.000 C +ATOM 2259 HB2 TRP 312 -20.415 -18.561 -3.904 0.00 0.00 +0.000 HD +ATOM 2260 HB3 TRP 312 -20.812 -16.981 -3.798 0.00 0.00 +0.000 HD +ATOM 2261 CG TRP 312 -21.611 -17.918 -5.408 0.00 0.00 +0.000 A +ATOM 2262 CD1 TRP 312 -22.114 -19.110 -5.855 0.00 0.00 +0.000 A +ATOM 2263 HD1 TRP 312 -21.844 -20.009 -5.517 0.00 0.00 +0.000 HD +ATOM 2264 NE1 TRP 312 -23.050 -18.891 -6.843 0.00 0.00 +0.000 N +ATOM 2265 HE1 TRP 312 -23.559 -19.598 -7.327 0.00 0.00 +0.000 HD +ATOM 2266 CE2 TRP 312 -23.165 -17.541 -7.050 0.00 0.00 +0.000 A +ATOM 2267 CZ2 TRP 312 -23.979 -16.829 -7.943 0.00 0.00 +0.000 A +ATOM 2268 HZ2 TRP 312 -24.602 -17.321 -8.557 0.00 0.00 +0.000 HD +ATOM 2269 CH2 TRP 312 -23.884 -15.462 -7.937 0.00 0.00 +0.000 A +ATOM 2270 HH2 TRP 312 -24.446 -14.917 -8.558 0.00 0.00 +0.000 HD +ATOM 2271 CZ3 TRP 312 -23.001 -14.790 -7.064 0.00 0.00 +0.000 A +ATOM 2272 HZ3 TRP 312 -22.953 -13.799 -7.082 0.00 0.00 +0.000 HD +ATOM 2273 CE3 TRP 312 -22.194 -15.496 -6.178 0.00 0.00 +0.000 A +ATOM 2274 HE3 TRP 312 -21.575 -15.010 -5.568 0.00 0.00 +0.000 HD +ATOM 2275 CD2 TRP 312 -22.273 -16.895 -6.162 0.00 0.00 +0.000 A +ATOM 2276 C TRP 312 -18.173 -16.830 -4.049 0.00 0.00 +0.000 C +ATOM 2277 O TRP 312 -18.248 -15.684 -3.600 0.00 0.00 +0.000 OA +ATOM 2278 N ASP 313 -17.200 -17.662 -3.693 0.00 0.00 +0.000 N +ATOM 2279 H ASP 313 -17.237 -18.598 -4.090 0.00 0.00 +0.000 HD +ATOM 2280 CA ASP 313 -16.167 -17.185 -2.776 0.00 0.00 +0.000 C +ATOM 2281 HA ASP 313 -16.623 -16.709 -2.041 0.00 0.00 +0.000 HD +ATOM 2282 CB ASP 313 -15.235 -18.307 -2.338 0.00 0.00 +0.000 C +ATOM 2283 HB2 ASP 313 -14.914 -18.779 -3.151 0.00 0.00 +0.000 HD +ATOM 2284 HB3 ASP 313 -14.473 -17.903 -1.846 0.00 0.00 +0.000 HD +ATOM 2285 CG ASP 313 -15.921 -19.311 -1.433 0.00 0.00 +0.000 C +ATOM 2286 OD1 ASP 313 -16.655 -18.880 -0.517 0.00 0.00 +0.000 OA +ATOM 2287 OD2 ASP 313 -15.721 -20.525 -1.634 0.00 0.00 +0.000 OA +ATOM 2288 C ASP 313 -15.376 -16.151 -3.561 0.00 0.00 +0.000 C +ATOM 2289 O ASP 313 -14.967 -15.123 -3.014 0.00 0.00 +0.000 OA +ATOM 2290 N GLY 314 -15.181 -16.427 -4.850 0.00 0.00 +0.000 N +ATOM 2291 H GLY 314 -15.578 -17.322 -5.173 0.00 0.00 +0.000 HD +ATOM 2292 CA GLY 314 -14.453 -15.501 -5.703 0.00 0.00 +0.000 C +ATOM 2293 HA2 GLY 314 -13.563 -15.285 -5.285 0.00 0.00 +0.000 HD +ATOM 2294 HA3 GLY 314 -14.285 -15.929 -6.599 0.00 0.00 +0.000 HD +ATOM 2295 C GLY 314 -15.239 -14.212 -5.902 0.00 0.00 +0.000 C +ATOM 2296 O GLY 314 -14.670 -13.125 -5.933 0.00 0.00 +0.000 OA +ATOM 2297 N PHE 315 -16.550 -14.349 -6.055 0.00 0.00 +0.000 N +ATOM 2298 H PHE 315 -16.884 -15.342 -6.033 0.00 0.00 +0.000 HD +ATOM 2299 CA PHE 315 -17.450 -13.216 -6.238 0.00 0.00 +0.000 C +ATOM 2300 HA PHE 315 -17.134 -12.716 -7.046 0.00 0.00 +0.000 HD +ATOM 2301 CB PHE 315 -18.892 -13.727 -6.340 0.00 0.00 +0.000 C +ATOM 2302 HB2 PHE 315 -18.956 -14.288 -7.155 0.00 0.00 +0.000 HD +ATOM 2303 HB3 PHE 315 -19.080 -14.264 -5.527 0.00 0.00 +0.000 HD +ATOM 2304 CG PHE 315 -19.936 -12.648 -6.435 0.00 0.00 +0.000 A +ATOM 2305 CD1 PHE 315 -20.142 -11.951 -7.624 0.00 0.00 +0.000 A +ATOM 2306 HD1 PHE 315 -19.563 -12.131 -8.412 0.00 0.00 +0.000 HD +ATOM 2307 CE1 PHE 315 -21.157 -10.998 -7.728 0.00 0.00 +0.000 A +ATOM 2308 HE1 PHE 315 -21.297 -10.515 -8.595 0.00 0.00 +0.000 HD +ATOM 2309 CZ PHE 315 -21.963 -10.728 -6.626 0.00 0.00 +0.000 A +ATOM 2310 HZ PHE 315 -22.686 -10.044 -6.694 0.00 0.00 +0.000 HD +ATOM 2311 CE2 PHE 315 -21.756 -11.415 -5.433 0.00 0.00 +0.000 A +ATOM 2312 HE2 PHE 315 -22.341 -11.225 -4.628 0.00 0.00 +0.000 HD +ATOM 2313 CD2 PHE 315 -20.746 -12.361 -5.342 0.00 0.00 +0.000 A +ATOM 2314 HD2 PHE 315 -20.598 -12.845 -4.478 0.00 0.00 +0.000 HD +ATOM 2315 C PHE 315 -17.323 -12.260 -5.052 0.00 0.00 +0.000 C +ATOM 2316 O PHE 315 -17.168 -11.053 -5.223 0.00 0.00 +0.000 OA +ATOM 2317 N VAL 316 -17.398 -12.819 -3.850 0.00 0.00 +0.000 N +ATOM 2318 H VAL 316 -17.527 -13.853 -3.859 0.00 0.00 +0.000 HD +ATOM 2319 CA VAL 316 -17.305 -12.036 -2.627 0.00 0.00 +0.000 C +ATOM 2320 HA VAL 316 -18.019 -11.319 -2.655 0.00 0.00 +0.000 HD +ATOM 2321 CB VAL 316 -17.572 -12.943 -1.391 0.00 0.00 +0.000 C +ATOM 2322 HB VAL 316 -16.970 -13.732 -1.470 0.00 0.00 +0.000 HD +ATOM 2323 CG1 VAL 316 -17.214 -12.225 -0.108 0.00 0.00 +0.000 C +ATOM 2324 HG11 VAL 316 -16.431 -12.675 0.324 0.00 0.00 +0.000 HD +ATOM 2325 HG12 VAL 316 -16.978 -11.273 -0.308 0.00 0.00 +0.000 HD +ATOM 2326 HG13 VAL 316 -17.993 -12.246 0.520 0.00 0.00 +0.000 HD +ATOM 2327 CG2 VAL 316 -19.034 -13.352 -1.366 0.00 0.00 +0.000 C +ATOM 2328 HG21 VAL 316 -19.224 -13.853 -0.521 0.00 0.00 +0.000 HD +ATOM 2329 HG22 VAL 316 -19.608 -12.534 -1.407 0.00 0.00 +0.000 HD +ATOM 2330 HG23 VAL 316 -19.228 -13.938 -2.153 0.00 0.00 +0.000 HD +ATOM 2331 C VAL 316 -15.951 -11.338 -2.486 0.00 0.00 +0.000 C +ATOM 2332 O VAL 316 -15.879 -10.180 -2.059 0.00 0.00 +0.000 OA +ATOM 2333 N GLU 317 -14.883 -12.042 -2.854 0.00 0.00 +0.000 N +ATOM 2334 H GLU 317 -15.092 -13.000 -3.199 0.00 0.00 +0.000 HD +ATOM 2335 CA GLU 317 -13.536 -11.493 -2.772 0.00 0.00 +0.000 C +ATOM 2336 HA GLU 317 -13.370 -11.138 -1.844 0.00 0.00 +0.000 HD +ATOM 2337 CB GLU 317 -12.481 -12.571 -3.051 0.00 0.00 +0.000 C +ATOM 2338 HB2 GLU 317 -12.613 -12.880 -3.983 0.00 0.00 +0.000 HD +ATOM 2339 HB3 GLU 317 -11.592 -12.152 -2.938 0.00 0.00 +0.000 HD +ATOM 2340 CG GLU 317 -12.538 -13.785 -2.149 0.00 0.00 +0.000 C +ATOM 2341 HG2 GLU 317 -12.380 -13.497 -1.226 0.00 0.00 +0.000 HD +ATOM 2342 HG3 GLU 317 -13.405 -14.225 -2.268 0.00 0.00 +0.000 HD +ATOM 2343 CD GLU 317 -11.460 -14.806 -2.497 0.00 0.00 +0.000 C +ATOM 2344 OE1 GLU 317 -11.286 -15.099 -3.704 0.00 0.00 +0.000 OA +ATOM 2345 OE2 GLU 317 -10.791 -15.314 -1.570 0.00 0.00 +0.000 OA +ATOM 2346 C GLU 317 -13.347 -10.373 -3.785 0.00 0.00 +0.000 C +ATOM 2347 O GLU 317 -12.708 -9.370 -3.488 0.00 0.00 +0.000 OA +ATOM 2348 N PHE 318 -13.903 -10.554 -4.982 0.00 0.00 +0.000 N +ATOM 2349 H PHE 318 -14.429 -11.445 -5.085 0.00 0.00 +0.000 HD +ATOM 2350 CA PHE 318 -13.772 -9.570 -6.046 0.00 0.00 +0.000 C +ATOM 2351 HA PHE 318 -12.782 -9.417 -6.185 0.00 0.00 +0.000 HD +ATOM 2352 CB PHE 318 -14.452 -10.090 -7.317 0.00 0.00 +0.000 C +ATOM 2353 HB2 PHE 318 -14.103 -10.997 -7.496 0.00 0.00 +0.000 HD +ATOM 2354 HB3 PHE 318 -15.427 -10.104 -7.153 0.00 0.00 +0.000 HD +ATOM 2355 CG PHE 318 -14.196 -9.244 -8.532 0.00 0.00 +0.000 A +ATOM 2356 CD1 PHE 318 -12.948 -9.247 -9.151 0.00 0.00 +0.000 A +ATOM 2357 HD1 PHE 318 -12.214 -9.809 -8.785 0.00 0.00 +0.000 HD +ATOM 2358 CE1 PHE 318 -12.711 -8.470 -10.285 0.00 0.00 +0.000 A +ATOM 2359 HE1 PHE 318 -11.806 -8.485 -10.717 0.00 0.00 +0.000 HD +ATOM 2360 CZ PHE 318 -13.733 -7.679 -10.806 0.00 0.00 +0.000 A +ATOM 2361 HZ PHE 318 -13.569 -7.123 -11.616 0.00 0.00 +0.000 HD +ATOM 2362 CE2 PHE 318 -14.986 -7.671 -10.188 0.00 0.00 +0.000 A +ATOM 2363 HE2 PHE 318 -15.731 -7.098 -10.559 0.00 0.00 +0.000 HD +ATOM 2364 CD2 PHE 318 -15.206 -8.450 -9.061 0.00 0.00 +0.000 A +ATOM 2365 HD2 PHE 318 -16.107 -8.441 -8.622 0.00 0.00 +0.000 HD +ATOM 2366 C PHE 318 -14.374 -8.229 -5.662 0.00 0.00 +0.000 C +ATOM 2367 O PHE 318 -13.821 -7.177 -5.980 0.00 0.00 +0.000 OA +ATOM 2368 N PHE 319 -15.495 -8.275 -4.950 0.00 0.00 +0.000 N +ATOM 2369 H PHE 319 -15.820 -9.231 -4.708 0.00 0.00 +0.000 HD +ATOM 2370 CA PHE 319 -16.196 -7.061 -4.551 0.00 0.00 +0.000 C +ATOM 2371 HA PHE 319 -15.856 -6.310 -5.159 0.00 0.00 +0.000 HD +ATOM 2372 CB PHE 319 -17.685 -7.247 -4.792 0.00 0.00 +0.000 C +ATOM 2373 HB2 PHE 319 -17.942 -8.144 -4.459 0.00 0.00 +0.000 HD +ATOM 2374 HB3 PHE 319 -18.168 -6.534 -4.303 0.00 0.00 +0.000 HD +ATOM 2375 CG PHE 319 -18.090 -7.163 -6.243 0.00 0.00 +0.000 A +ATOM 2376 CD1 PHE 319 -18.040 -5.950 -6.913 0.00 0.00 +0.000 A +ATOM 2377 HD1 PHE 319 -17.728 -5.131 -6.441 0.00 0.00 +0.000 HD +ATOM 2378 CE1 PHE 319 -18.422 -5.856 -8.254 0.00 0.00 +0.000 A +ATOM 2379 HE1 PHE 319 -18.436 -4.956 -8.701 0.00 0.00 +0.000 HD +ATOM 2380 CZ PHE 319 -18.780 -7.001 -8.956 0.00 0.00 +0.000 A +ATOM 2381 HZ PHE 319 -19.001 -6.942 -9.925 0.00 0.00 +0.000 HD +ATOM 2382 CE2 PHE 319 -18.824 -8.218 -8.294 0.00 0.00 +0.000 A +ATOM 2383 HE2 PHE 319 -19.135 -9.053 -8.780 0.00 0.00 +0.000 HD +ATOM 2384 CD2 PHE 319 -18.445 -8.302 -6.964 0.00 0.00 +0.000 A +ATOM 2385 HD2 PHE 319 -18.424 -9.195 -6.510 0.00 0.00 +0.000 HD +ATOM 2386 C PHE 319 -15.959 -6.591 -3.113 0.00 0.00 +0.000 C +ATOM 2387 O PHE 319 -16.508 -5.563 -2.702 0.00 0.00 +0.000 OA +ATOM 2388 N HIE 320 -15.142 -7.327 -2.360 0.00 0.00 +0.000 N +ATOM 2389 H HIE 320 -14.746 -8.163 -2.844 0.00 0.00 +0.000 HD +ATOM 2390 CA HIE 320 -14.827 -6.989 -0.970 0.00 0.00 +0.000 C +ATOM 2391 HA HIE 320 -15.658 -7.155 -0.409 0.00 0.00 +0.000 HD +ATOM 2392 CB HIE 320 -13.721 -7.908 -0.459 0.00 0.00 +0.000 C +ATOM 2393 HB2 HIE 320 -14.045 -8.860 -0.483 0.00 0.00 +0.000 HD +ATOM 2394 HB3 HIE 320 -12.921 -7.827 -1.063 0.00 0.00 +0.000 HD +ATOM 2395 CG HIE 320 -13.281 -7.599 0.943 0.00 0.00 +0.000 A +ATOM 2396 ND1 HIE 320 -12.082 -7.001 1.233 0.00 0.00 +0.000 NA +ATOM 2397 CE1 HIE 320 -11.992 -6.810 2.544 0.00 0.00 +0.000 A +ATOM 2398 HE1 HIE 320 -11.224 -6.395 3.018 0.00 0.00 +0.000 HD +ATOM 2399 NE2 HIE 320 -13.094 -7.268 3.099 0.00 0.00 +0.000 N +ATOM 2400 HE2 HIE 320 -13.305 -7.253 4.087 0.00 0.00 +0.000 HD +ATOM 2401 CD2 HIE 320 -13.922 -7.773 2.122 0.00 0.00 +0.000 A +ATOM 2402 HD2 HIE 320 -14.814 -8.185 2.260 0.00 0.00 +0.000 HD +ATOM 2403 C HIE 320 -14.408 -5.537 -0.782 0.00 0.00 +0.000 C +ATOM 2404 O HIE 320 -13.615 -5.004 -1.559 0.00 0.00 +0.000 OA +ATOM 2405 N VAL 321 -14.952 -4.910 0.258 0.00 0.00 +0.000 N +ATOM 2406 H VAL 321 -15.604 -5.489 0.824 0.00 0.00 +0.000 HD +ATOM 2407 CA VAL 321 -14.645 -3.513 0.566 0.00 0.00 +0.000 C +ATOM 2408 HA VAL 321 -14.327 -3.069 -0.278 0.00 0.00 +0.000 HD +ATOM 2409 CB VAL 321 -15.896 -2.762 1.098 0.00 0.00 +0.000 C +ATOM 2410 HB VAL 321 -15.663 -1.800 1.156 0.00 0.00 +0.000 HD +ATOM 2411 CG1 VAL 321 -17.041 -2.889 0.101 0.00 0.00 +0.000 C +ATOM 2412 HG11 VAL 321 -16.676 -2.876 -0.829 0.00 0.00 +0.000 HD +ATOM 2413 HG12 VAL 321 -17.525 -3.750 0.257 0.00 0.00 +0.000 HD +ATOM 2414 HG13 VAL 321 -17.674 -2.125 0.221 0.00 0.00 +0.000 HD +ATOM 2415 CG2 VAL 321 -16.310 -3.320 2.445 0.00 0.00 +0.000 C +ATOM 2416 HG21 VAL 321 -16.918 -4.103 2.309 0.00 0.00 +0.000 HD +ATOM 2417 HG22 VAL 321 -15.496 -3.613 2.949 0.00 0.00 +0.000 HD +ATOM 2418 HG23 VAL 321 -16.789 -2.612 2.966 0.00 0.00 +0.000 HD +ATOM 2419 C VAL 321 -13.520 -3.423 1.597 0.00 0.00 +0.000 C +ATOM 2420 O VAL 321 -12.468 -2.832 1.254 0.00 0.00 +0.000 OA +ATOM 2421 OXT VAL 321 -13.431 -3.824 2.731 0.00 0.00 +0.000 OA +TER diff --git a/receptor/pdbqt_files/6o6f_wt_H.pdbqt b/receptor/pdbqt_files/6o6f_wt_H.pdbqt new file mode 100644 index 0000000..ba84091 --- /dev/null +++ b/receptor/pdbqt_files/6o6f_wt_H.pdbqt @@ -0,0 +1,2423 @@ +REMARK Name = ../receptor/6o6f_wt_H.pdb +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ATOM 1 N SER 171 -23.840 -34.508 -6.167 0.00 0.00 +0.000 NA +ATOM 2 H1 SER 171 -24.073 -34.914 -5.272 0.00 0.00 +0.000 HD +ATOM 3 H2 SER 171 -23.979 -34.837 -5.236 0.00 0.00 +0.000 HD +ATOM 4 H3 SER 171 -23.978 -35.254 -6.813 0.00 0.00 +0.000 HD +ATOM 5 CA SER 171 -24.823 -33.425 -6.454 0.00 0.00 +0.000 C +ATOM 6 HA SER 171 -25.412 -33.750 -7.212 0.00 0.00 +0.000 HD +ATOM 7 CB SER 171 -25.708 -33.194 -5.243 0.00 0.00 +0.000 C +ATOM 8 HB2 SER 171 -26.374 -32.476 -5.458 0.00 0.00 +0.000 HD +ATOM 9 HB3 SER 171 -26.200 -34.043 -5.033 0.00 0.00 +0.000 HD +ATOM 10 OG SER 171 -24.971 -32.802 -4.100 0.00 0.00 +0.000 OA +ATOM 11 HG SER 171 -24.797 -31.818 -4.136 0.00 0.00 +0.000 HD +ATOM 12 C SER 171 -24.177 -32.110 -6.883 0.00 0.00 +0.000 C +ATOM 13 O SER 171 -22.964 -31.912 -6.751 0.00 0.00 +0.000 OA +ATOM 14 N ASP 172 -25.017 -31.207 -7.377 0.00 0.00 +0.000 N +ATOM 15 H ASP 172 -26.019 -31.507 -7.379 0.00 0.00 +0.000 HD +ATOM 16 CA ASP 172 -24.576 -29.909 -7.873 0.00 0.00 +0.000 C +ATOM 17 HA ASP 172 -23.602 -30.008 -8.149 0.00 0.00 +0.000 HD +ATOM 18 CB ASP 172 -25.432 -29.532 -9.076 0.00 0.00 +0.000 C +ATOM 19 HB2 ASP 172 -25.664 -30.370 -9.561 0.00 0.00 +0.000 HD +ATOM 20 HB3 ASP 172 -26.258 -29.091 -8.739 0.00 0.00 +0.000 HD +ATOM 21 CG ASP 172 -24.727 -28.599 -10.018 0.00 0.00 +0.000 C +ATOM 22 OD1 ASP 172 -23.703 -27.997 -9.623 0.00 0.00 +0.000 OA +ATOM 23 OD2 ASP 172 -25.214 -28.470 -11.157 0.00 0.00 +0.000 OA +ATOM 24 C ASP 172 -24.625 -28.796 -6.824 0.00 0.00 +0.000 C +ATOM 25 O ASP 172 -25.612 -28.057 -6.729 0.00 0.00 +0.000 OA +ATOM 26 N GLU 173 -23.548 -28.683 -6.049 0.00 0.00 +0.000 N +ATOM 27 H GLU 173 -22.790 -29.365 -6.257 0.00 0.00 +0.000 HD +ATOM 28 CA GLU 173 -23.453 -27.676 -4.995 0.00 0.00 +0.000 C +ATOM 29 HA GLU 173 -24.232 -27.772 -4.359 0.00 0.00 +0.000 HD +ATOM 30 CB GLU 173 -22.200 -27.947 -4.155 0.00 0.00 +0.000 C +ATOM 31 HB2 GLU 173 -22.347 -28.794 -3.669 0.00 0.00 +0.000 HD +ATOM 32 HB3 GLU 173 -21.435 -28.012 -4.775 0.00 0.00 +0.000 HD +ATOM 33 CG GLU 173 -21.879 -26.877 -3.134 0.00 0.00 +0.000 C +ATOM 34 HG2 GLU 173 -21.026 -27.114 -2.693 0.00 0.00 +0.000 HD +ATOM 35 HG3 GLU 173 -21.810 -26.008 -3.602 0.00 0.00 +0.000 HD +ATOM 36 CD GLU 173 -22.924 -26.721 -2.045 0.00 0.00 +0.000 C +ATOM 37 OE1 GLU 173 -23.943 -27.446 -2.041 0.00 0.00 +0.000 OA +ATOM 38 OE2 GLU 173 -22.734 -25.830 -1.194 0.00 0.00 +0.000 OA +ATOM 39 C GLU 173 -23.443 -26.240 -5.559 0.00 0.00 +0.000 C +ATOM 40 O GLU 173 -24.129 -25.350 -5.049 0.00 0.00 +0.000 OA +ATOM 41 N LEU 174 -22.675 -26.019 -6.620 0.00 0.00 +0.000 N +ATOM 42 H LEU 174 -22.143 -26.835 -6.959 0.00 0.00 +0.000 HD +ATOM 43 CA LEU 174 -22.619 -24.699 -7.230 0.00 0.00 +0.000 C +ATOM 44 HA LEU 174 -22.328 -24.032 -6.531 0.00 0.00 +0.000 HD +ATOM 45 CB LEU 174 -21.586 -24.661 -8.357 0.00 0.00 +0.000 C +ATOM 46 HB2 LEU 174 -20.686 -24.796 -7.952 0.00 0.00 +0.000 HD +ATOM 47 HB3 LEU 174 -21.794 -25.401 -8.988 0.00 0.00 +0.000 HD +ATOM 48 CG LEU 174 -21.530 -23.367 -9.171 0.00 0.00 +0.000 C +ATOM 49 HG LEU 174 -22.441 -23.160 -9.522 0.00 0.00 +0.000 HD +ATOM 50 CD1 LEU 174 -21.054 -22.201 -8.293 0.00 0.00 +0.000 C +ATOM 51 HD11 LEU 174 -20.143 -22.406 -7.942 0.00 0.00 +0.000 HD +ATOM 52 HD12 LEU 174 -21.025 -21.368 -8.842 0.00 0.00 +0.000 HD +ATOM 53 HD13 LEU 174 -21.690 -22.082 -7.533 0.00 0.00 +0.000 HD +ATOM 54 CD2 LEU 174 -20.605 -23.568 -10.350 0.00 0.00 +0.000 C +ATOM 55 HD21 LEU 174 -20.947 -24.313 -10.927 0.00 0.00 +0.000 HD +ATOM 56 HD22 LEU 174 -20.559 -22.727 -10.893 0.00 0.00 +0.000 HD +ATOM 57 HD23 LEU 174 -19.686 -23.800 -10.025 0.00 0.00 +0.000 HD +ATOM 58 C LEU 174 -23.982 -24.270 -7.762 0.00 0.00 +0.000 C +ATOM 59 O LEU 174 -24.374 -23.103 -7.633 0.00 0.00 +0.000 OA +ATOM 60 N TYR 175 -24.715 -25.192 -8.372 0.00 0.00 +0.000 N +ATOM 61 H TYR 175 -24.296 -26.118 -8.460 0.00 0.00 +0.000 HD +ATOM 62 CA TYR 175 -26.039 -24.830 -8.864 0.00 0.00 +0.000 C +ATOM 63 HA TYR 175 -25.951 -24.004 -9.436 0.00 0.00 +0.000 HD +ATOM 64 CB TYR 175 -26.649 -25.942 -9.716 0.00 0.00 +0.000 C +ATOM 65 HB2 TYR 175 -26.023 -26.152 -10.448 0.00 0.00 +0.000 HD +ATOM 66 HB3 TYR 175 -26.811 -26.724 -9.137 0.00 0.00 +0.000 HD +ATOM 67 CG TYR 175 -27.958 -25.506 -10.312 0.00 0.00 +0.000 A +ATOM 68 CD1 TYR 175 -27.995 -24.770 -11.495 0.00 0.00 +0.000 A +ATOM 69 HD1 TYR 175 -27.147 -24.606 -12.002 0.00 0.00 +0.000 HD +ATOM 70 CE1 TYR 175 -29.191 -24.255 -11.988 0.00 0.00 +0.000 A +ATOM 71 HE1 TYR 175 -29.198 -23.731 -12.840 0.00 0.00 +0.000 HD +ATOM 72 CZ TYR 175 -30.369 -24.474 -11.292 0.00 0.00 +0.000 A +ATOM 73 OH TYR 175 -31.551 -23.926 -11.754 0.00 0.00 +0.000 OA +ATOM 74 HH TYR 175 -31.551 -23.947 -12.751 0.00 0.00 +0.000 HD +ATOM 75 CE2 TYR 175 -30.358 -25.213 -10.119 0.00 0.00 +0.000 A +ATOM 76 HE2 TYR 175 -31.208 -25.379 -9.621 0.00 0.00 +0.000 HD +ATOM 77 CD2 TYR 175 -29.155 -25.724 -9.637 0.00 0.00 +0.000 A +ATOM 78 HD2 TYR 175 -29.154 -26.257 -8.793 0.00 0.00 +0.000 HD +ATOM 79 C TYR 175 -26.995 -24.507 -7.714 0.00 0.00 +0.000 C +ATOM 80 O TYR 175 -27.704 -23.510 -7.775 0.00 0.00 +0.000 OA +ATOM 81 N ARG 176 -27.007 -25.346 -6.679 0.00 0.00 +0.000 N +ATOM 82 H ARG 176 -26.357 -26.148 -6.760 0.00 0.00 +0.000 HD +ATOM 83 CA ARG 176 -27.880 -25.122 -5.538 0.00 0.00 +0.000 C +ATOM 84 HA ARG 176 -28.838 -25.126 -5.855 0.00 0.00 +0.000 HD +ATOM 85 CB ARG 176 -27.703 -26.232 -4.499 0.00 0.00 +0.000 C +ATOM 86 HB2 ARG 176 -27.919 -27.104 -4.934 0.00 0.00 +0.000 HD +ATOM 87 HB3 ARG 176 -26.751 -26.231 -4.201 0.00 0.00 +0.000 HD +ATOM 88 CG ARG 176 -28.582 -26.093 -3.263 0.00 0.00 +0.000 C +ATOM 89 HG2 ARG 176 -28.651 -25.127 -3.013 0.00 0.00 +0.000 HD +ATOM 90 HG3 ARG 176 -29.494 -26.450 -3.465 0.00 0.00 +0.000 HD +ATOM 91 CD ARG 176 -28.029 -26.853 -2.073 0.00 0.00 +0.000 C +ATOM 92 HD2 ARG 176 -28.698 -26.811 -1.338 0.00 0.00 +0.000 HD +ATOM 93 HD3 ARG 176 -27.879 -27.797 -2.350 0.00 0.00 +0.000 HD +ATOM 94 NE ARG 176 -26.768 -26.279 -1.611 0.00 0.00 +0.000 N +ATOM 95 HE ARG 176 -25.931 -26.828 -1.727 0.00 0.00 +0.000 HD +ATOM 96 CZ ARG 176 -26.649 -25.079 -1.047 0.00 0.00 +0.000 C +ATOM 97 NH1 ARG 176 -25.462 -24.636 -0.662 0.00 0.00 +0.000 N +ATOM 98 HH11 ARG 176 -24.638 -25.179 -0.804 0.00 0.00 +0.000 HD +ATOM 99 HH12 ARG 176 -25.387 -23.734 -0.219 0.00 0.00 +0.000 HD +ATOM 100 NH2 ARG 176 -27.717 -24.321 -0.856 0.00 0.00 +0.000 N +ATOM 101 HH21 ARG 176 -28.617 -24.651 -1.158 0.00 0.00 +0.000 HD +ATOM 102 HH22 ARG 176 -27.634 -23.430 -0.418 0.00 0.00 +0.000 HD +ATOM 103 C ARG 176 -27.593 -23.783 -4.878 0.00 0.00 +0.000 C +ATOM 104 O ARG 176 -28.505 -23.016 -4.554 0.00 0.00 +0.000 OA +ATOM 105 N GLN 177 -26.313 -23.517 -4.660 0.00 0.00 +0.000 N +ATOM 106 H GLN 177 -25.654 -24.258 -4.972 0.00 0.00 +0.000 HD +ATOM 107 CA GLN 177 -25.894 -22.281 -4.034 0.00 0.00 +0.000 C +ATOM 108 HA GLN 177 -26.375 -22.196 -3.149 0.00 0.00 +0.000 HD +ATOM 109 CB GLN 177 -24.390 -22.315 -3.808 0.00 0.00 +0.000 C +ATOM 110 HB2 GLN 177 -24.174 -23.066 -3.180 0.00 0.00 +0.000 HD +ATOM 111 HB3 GLN 177 -23.935 -22.483 -4.686 0.00 0.00 +0.000 HD +ATOM 112 CG GLN 177 -23.831 -21.036 -3.224 0.00 0.00 +0.000 C +ATOM 113 HG2 GLN 177 -23.923 -20.309 -3.898 0.00 0.00 +0.000 HD +ATOM 114 HG3 GLN 177 -24.344 -20.808 -2.401 0.00 0.00 +0.000 HD +ATOM 115 CD GLN 177 -22.379 -21.189 -2.867 0.00 0.00 +0.000 C +ATOM 116 OE1 GLN 177 -21.604 -21.751 -3.639 0.00 0.00 +0.000 OA +ATOM 117 NE2 GLN 177 -21.996 -20.691 -1.694 0.00 0.00 +0.000 N +ATOM 118 HE21 GLN 177 -21.032 -20.769 -1.378 0.00 0.00 +0.000 HD +ATOM 119 HE22 GLN 177 -22.690 -20.224 -1.110 0.00 0.00 +0.000 HD +ATOM 120 C GLN 177 -26.268 -21.070 -4.879 0.00 0.00 +0.000 C +ATOM 121 O GLN 177 -26.763 -20.074 -4.355 0.00 0.00 +0.000 OA +ATOM 122 N SER 178 -26.034 -21.158 -6.184 0.00 0.00 +0.000 N +ATOM 123 H SER 178 -25.612 -22.049 -6.496 0.00 0.00 +0.000 HD +ATOM 124 CA SER 178 -26.362 -20.057 -7.081 0.00 0.00 +0.000 C +ATOM 125 HA SER 178 -25.897 -19.228 -6.744 0.00 0.00 +0.000 HD +ATOM 126 CB SER 178 -25.888 -20.374 -8.504 0.00 0.00 +0.000 C +ATOM 127 HB2 SER 178 -26.337 -21.208 -8.813 0.00 0.00 +0.000 HD +ATOM 128 HB3 SER 178 -26.132 -19.613 -9.099 0.00 0.00 +0.000 HD +ATOM 129 OG SER 178 -24.482 -20.562 -8.549 0.00 0.00 +0.000 OA +ATOM 130 HG SER 178 -24.258 -21.476 -8.214 0.00 0.00 +0.000 HD +ATOM 131 C SER 178 -27.863 -19.774 -7.098 0.00 0.00 +0.000 C +ATOM 132 O SER 178 -28.285 -18.616 -7.152 0.00 0.00 +0.000 OA +ATOM 133 N LEU 179 -28.669 -20.829 -7.054 0.00 0.00 +0.000 N +ATOM 134 H LEU 179 -28.201 -21.744 -7.001 0.00 0.00 +0.000 HD +ATOM 135 CA LEU 179 -30.117 -20.652 -7.082 0.00 0.00 +0.000 C +ATOM 136 HA LEU 179 -30.355 -20.079 -7.882 0.00 0.00 +0.000 HD +ATOM 137 CB LEU 179 -30.823 -21.998 -7.275 0.00 0.00 +0.000 C +ATOM 138 HB2 LEU 179 -30.510 -22.388 -8.129 0.00 0.00 +0.000 HD +ATOM 139 HB3 LEU 179 -30.592 -22.578 -6.509 0.00 0.00 +0.000 HD +ATOM 140 CG LEU 179 -32.355 -21.915 -7.344 0.00 0.00 +0.000 C +ATOM 141 HG LEU 179 -32.701 -21.589 -6.466 0.00 0.00 +0.000 HD +ATOM 142 CD1 LEU 179 -32.793 -20.955 -8.449 0.00 0.00 +0.000 C +ATOM 143 HD11 LEU 179 -32.446 -21.281 -9.328 0.00 0.00 +0.000 HD +ATOM 144 HD12 LEU 179 -33.791 -20.915 -8.477 0.00 0.00 +0.000 HD +ATOM 145 HD13 LEU 179 -32.427 -20.044 -8.261 0.00 0.00 +0.000 HD +ATOM 146 CD2 LEU 179 -32.923 -23.296 -7.579 0.00 0.00 +0.000 C +ATOM 147 HD21 LEU 179 -32.657 -23.905 -6.828 0.00 0.00 +0.000 HD +ATOM 148 HD22 LEU 179 -33.923 -23.249 -7.625 0.00 0.00 +0.000 HD +ATOM 149 HD23 LEU 179 -32.572 -23.666 -8.442 0.00 0.00 +0.000 HD +ATOM 150 C LEU 179 -30.643 -19.964 -5.827 0.00 0.00 +0.000 C +ATOM 151 O LEU 179 -31.515 -19.100 -5.916 0.00 0.00 +0.000 OA +ATOM 152 N GLU 180 -30.114 -20.332 -4.664 0.00 0.00 +0.000 N +ATOM 153 H GLU 180 -29.384 -21.055 -4.720 0.00 0.00 +0.000 HD +ATOM 154 CA GLU 180 -30.573 -19.723 -3.431 0.00 0.00 +0.000 C +ATOM 155 HA GLU 180 -31.571 -19.818 -3.350 0.00 0.00 +0.000 HD +ATOM 156 CB GLU 180 -29.980 -20.469 -2.231 0.00 0.00 +0.000 C +ATOM 157 HB2 GLU 180 -30.326 -21.392 -2.254 0.00 0.00 +0.000 HD +ATOM 158 HB3 GLU 180 -28.999 -20.442 -2.318 0.00 0.00 +0.000 HD +ATOM 159 CG GLU 180 -30.342 -19.873 -0.882 0.00 0.00 +0.000 C +ATOM 160 HG2 GLU 180 -29.648 -19.218 -0.637 0.00 0.00 +0.000 HD +ATOM 161 HG3 GLU 180 -31.231 -19.455 -0.955 0.00 0.00 +0.000 HD +ATOM 162 CD GLU 180 -30.412 -20.902 0.231 0.00 0.00 +0.000 C +ATOM 163 OE1 GLU 180 -29.479 -21.732 0.342 0.00 0.00 +0.000 OA +ATOM 164 OE2 GLU 180 -31.405 -20.868 1.003 0.00 0.00 +0.000 OA +ATOM 165 C GLU 180 -30.206 -18.237 -3.394 0.00 0.00 +0.000 C +ATOM 166 O GLU 180 -31.022 -17.410 -3.014 0.00 0.00 +0.000 OA +ATOM 167 N ILE 181 -28.991 -17.898 -3.817 0.00 0.00 +0.000 N +ATOM 168 H ILE 181 -28.400 -18.686 -4.133 0.00 0.00 +0.000 HD +ATOM 169 CA ILE 181 -28.557 -16.506 -3.821 0.00 0.00 +0.000 C +ATOM 170 HA ILE 181 -28.724 -16.153 -2.890 0.00 0.00 +0.000 HD +ATOM 171 CB ILE 181 -27.079 -16.406 -4.239 0.00 0.00 +0.000 C +ATOM 172 HB ILE 181 -26.977 -16.860 -5.115 0.00 0.00 +0.000 HD +ATOM 173 CG2 ILE 181 -26.670 -14.946 -4.374 0.00 0.00 +0.000 C +ATOM 174 HG21 ILE 181 -25.720 -14.892 -4.676 0.00 0.00 +0.000 HD +ATOM 175 HG22 ILE 181 -27.257 -14.496 -5.045 0.00 0.00 +0.000 HD +ATOM 176 HG23 ILE 181 -26.764 -14.490 -3.491 0.00 0.00 +0.000 HD +ATOM 177 CG1 ILE 181 -26.205 -17.135 -3.221 0.00 0.00 +0.000 C +ATOM 178 HG12 ILE 181 -26.169 -16.593 -2.387 0.00 0.00 +0.000 HD +ATOM 179 HG13 ILE 181 -26.625 -18.016 -3.019 0.00 0.00 +0.000 HD +ATOM 180 CD1 ILE 181 -24.790 -17.375 -3.713 0.00 0.00 +0.000 C +ATOM 181 HD11 ILE 181 -24.357 -16.498 -3.912 0.00 0.00 +0.000 HD +ATOM 182 HD12 ILE 181 -24.272 -17.853 -3.006 0.00 0.00 +0.000 HD +ATOM 183 HD13 ILE 181 -24.819 -17.931 -4.542 0.00 0.00 +0.000 HD +ATOM 184 C ILE 181 -29.390 -15.639 -4.768 0.00 0.00 +0.000 C +ATOM 185 O ILE 181 -29.881 -14.570 -4.388 0.00 0.00 +0.000 OA +ATOM 186 N ILE 182 -29.538 -16.098 -6.006 0.00 0.00 +0.000 N +ATOM 187 H ILE 182 -29.087 -17.009 -6.196 0.00 0.00 +0.000 HD +ATOM 188 CA ILE 182 -30.293 -15.344 -7.008 0.00 0.00 +0.000 C +ATOM 189 HA ILE 182 -29.944 -14.397 -6.971 0.00 0.00 +0.000 HD +ATOM 190 CB ILE 182 -30.077 -15.948 -8.418 0.00 0.00 +0.000 C +ATOM 191 HB ILE 182 -30.270 -16.917 -8.367 0.00 0.00 +0.000 HD +ATOM 192 CG2 ILE 182 -31.002 -15.272 -9.432 0.00 0.00 +0.000 C +ATOM 193 HG21 ILE 182 -30.867 -15.687 -10.329 0.00 0.00 +0.000 HD +ATOM 194 HG22 ILE 182 -31.950 -15.393 -9.146 0.00 0.00 +0.000 HD +ATOM 195 HG23 ILE 182 -30.787 -14.299 -9.477 0.00 0.00 +0.000 HD +ATOM 196 CG1 ILE 182 -28.607 -15.776 -8.836 0.00 0.00 +0.000 C +ATOM 197 HG12 ILE 182 -28.430 -14.805 -8.974 0.00 0.00 +0.000 HD +ATOM 198 HG13 ILE 182 -28.030 -16.107 -8.092 0.00 0.00 +0.000 HD +ATOM 199 CD1 ILE 182 -28.233 -16.529 -10.110 0.00 0.00 +0.000 C +ATOM 200 HD11 ILE 182 -28.798 -16.197 -10.861 0.00 0.00 +0.000 HD +ATOM 201 HD12 ILE 182 -27.270 -16.367 -10.312 0.00 0.00 +0.000 HD +ATOM 202 HD13 ILE 182 -28.392 -17.503 -9.970 0.00 0.00 +0.000 HD +ATOM 203 C ILE 182 -31.792 -15.266 -6.690 0.00 0.00 +0.000 C +ATOM 204 O ILE 182 -32.411 -14.222 -6.884 0.00 0.00 +0.000 OA +ATOM 205 N SER 183 -32.364 -16.364 -6.197 0.00 0.00 +0.000 N +ATOM 206 H SER 183 -31.726 -17.177 -6.091 0.00 0.00 +0.000 HD +ATOM 207 CA SER 183 -33.785 -16.407 -5.836 0.00 0.00 +0.000 C +ATOM 208 HA SER 183 -34.316 -16.106 -6.633 0.00 0.00 +0.000 HD +ATOM 209 CB SER 183 -34.195 -17.822 -5.410 0.00 0.00 +0.000 C +ATOM 210 HB2 SER 183 -33.678 -18.068 -4.594 0.00 0.00 +0.000 HD +ATOM 211 HB3 SER 183 -35.171 -17.819 -5.206 0.00 0.00 +0.000 HD +ATOM 212 OG SER 183 -33.934 -18.750 -6.427 0.00 0.00 +0.000 OA +ATOM 213 HG SER 183 -32.968 -19.016 -6.406 0.00 0.00 +0.000 HD +ATOM 214 C SER 183 -34.077 -15.447 -4.686 0.00 0.00 +0.000 C +ATOM 215 O SER 183 -35.054 -14.693 -4.717 0.00 0.00 +0.000 OA +ATOM 216 N ARG 184 -33.228 -15.485 -3.665 0.00 0.00 +0.000 N +ATOM 217 H ARG 184 -32.460 -16.164 -3.751 0.00 0.00 +0.000 HD +ATOM 218 CA ARG 184 -33.417 -14.602 -2.522 0.00 0.00 +0.000 C +ATOM 219 HA ARG 184 -34.340 -14.751 -2.143 0.00 0.00 +0.000 HD +ATOM 220 CB ARG 184 -32.406 -14.909 -1.415 0.00 0.00 +0.000 C +ATOM 221 HB2 ARG 184 -31.495 -14.916 -1.821 0.00 0.00 +0.000 HD +ATOM 222 HB3 ARG 184 -32.467 -14.186 -0.731 0.00 0.00 +0.000 HD +ATOM 223 CG ARG 184 -32.626 -16.236 -0.722 0.00 0.00 +0.000 C +ATOM 224 HG2 ARG 184 -33.580 -16.493 -0.787 0.00 0.00 +0.000 HD +ATOM 225 HG3 ARG 184 -32.043 -16.926 -1.128 0.00 0.00 +0.000 HD +ATOM 226 CD ARG 184 -32.264 -16.113 0.746 0.00 0.00 +0.000 C +ATOM 227 HD2 ARG 184 -31.310 -15.829 0.808 0.00 0.00 +0.000 HD +ATOM 228 HD3 ARG 184 -32.853 -15.418 1.153 0.00 0.00 +0.000 HD +ATOM 229 NE ARG 184 -32.439 -17.372 1.459 0.00 0.00 +0.000 N +ATOM 230 HE ARG 184 -32.645 -18.196 0.918 0.00 0.00 +0.000 HD +ATOM 231 CZ ARG 184 -32.344 -17.503 2.777 0.00 0.00 +0.000 C +ATOM 232 NH1 ARG 184 -32.079 -16.447 3.533 0.00 0.00 +0.000 N +ATOM 233 HH11 ARG 184 -31.967 -15.541 3.135 0.00 0.00 +0.000 HD +ATOM 234 HH12 ARG 184 -31.990 -16.561 4.531 0.00 0.00 +0.000 HD +ATOM 235 NH2 ARG 184 -32.508 -18.695 3.339 0.00 0.00 +0.000 N +ATOM 236 HH21 ARG 184 -32.723 -19.488 2.764 0.00 0.00 +0.000 HD +ATOM 237 HH22 ARG 184 -32.420 -18.802 4.326 0.00 0.00 +0.000 HD +ATOM 238 C ARG 184 -33.290 -13.134 -2.923 0.00 0.00 +0.000 C +ATOM 239 O ARG 184 -34.059 -12.283 -2.466 0.00 0.00 +0.000 OA +ATOM 240 N TYR 185 -32.320 -12.830 -3.777 0.00 0.00 +0.000 N +ATOM 241 H TYR 185 -31.741 -13.617 -4.093 0.00 0.00 +0.000 HD +ATOM 242 CA TYR 185 -32.137 -11.452 -4.202 0.00 0.00 +0.000 C +ATOM 243 HA TYR 185 -32.029 -10.877 -3.383 0.00 0.00 +0.000 HD +ATOM 244 CB TYR 185 -30.880 -11.310 -5.074 0.00 0.00 +0.000 C +ATOM 245 HB2 TYR 185 -30.112 -11.686 -4.573 0.00 0.00 +0.000 HD +ATOM 246 HB3 TYR 185 -31.031 -11.809 -5.917 0.00 0.00 +0.000 HD +ATOM 247 CG TYR 185 -30.570 -9.871 -5.419 0.00 0.00 +0.000 A +ATOM 248 CD1 TYR 185 -30.431 -8.910 -4.413 0.00 0.00 +0.000 A +ATOM 249 HD1 TYR 185 -30.515 -9.183 -3.455 0.00 0.00 +0.000 HD +ATOM 250 CE1 TYR 185 -30.178 -7.574 -4.723 0.00 0.00 +0.000 A +ATOM 251 HE1 TYR 185 -30.077 -6.899 -3.995 0.00 0.00 +0.000 HD +ATOM 252 CZ TYR 185 -30.066 -7.189 -6.058 0.00 0.00 +0.000 A +ATOM 253 OH TYR 185 -29.845 -5.870 -6.376 0.00 0.00 +0.000 OA +ATOM 254 HH TYR 185 -29.842 -5.326 -5.538 0.00 0.00 +0.000 HD +ATOM 255 CE2 TYR 185 -30.197 -8.120 -7.069 0.00 0.00 +0.000 A +ATOM 256 HE2 TYR 185 -30.117 -7.847 -8.025 0.00 0.00 +0.000 HD +ATOM 257 CD2 TYR 185 -30.445 -9.460 -6.746 0.00 0.00 +0.000 A +ATOM 258 HD2 TYR 185 -30.532 -10.128 -7.480 0.00 0.00 +0.000 HD +ATOM 259 C TYR 185 -33.360 -10.955 -4.969 0.00 0.00 +0.000 C +ATOM 260 O TYR 185 -33.872 -9.872 -4.690 0.00 0.00 +0.000 OA +ATOM 261 N LEU 186 -33.840 -11.739 -5.933 0.00 0.00 +0.000 N +ATOM 262 H LEU 186 -33.347 -12.629 -6.071 0.00 0.00 +0.000 HD +ATOM 263 CA LEU 186 -35.002 -11.314 -6.721 0.00 0.00 +0.000 C +ATOM 264 HA LEU 186 -34.796 -10.410 -7.129 0.00 0.00 +0.000 HD +ATOM 265 CB LEU 186 -35.257 -12.282 -7.881 0.00 0.00 +0.000 C +ATOM 266 HB2 LEU 186 -34.873 -13.166 -7.630 0.00 0.00 +0.000 HD +ATOM 267 HB3 LEU 186 -36.241 -12.357 -8.005 0.00 0.00 +0.000 HD +ATOM 268 CG LEU 186 -34.654 -11.889 -9.231 0.00 0.00 +0.000 C +ATOM 269 HG LEU 186 -35.038 -11.015 -9.515 0.00 0.00 +0.000 HD +ATOM 270 CD1 LEU 186 -33.146 -11.763 -9.099 0.00 0.00 +0.000 C +ATOM 271 HD11 LEU 186 -32.760 -12.639 -8.806 0.00 0.00 +0.000 HD +ATOM 272 HD12 LEU 186 -32.752 -11.506 -9.982 0.00 0.00 +0.000 HD +ATOM 273 HD13 LEU 186 -32.926 -11.061 -8.421 0.00 0.00 +0.000 HD +ATOM 274 CD2 LEU 186 -35.024 -12.920 -10.294 0.00 0.00 +0.000 C +ATOM 275 HD21 LEU 186 -36.019 -12.966 -10.380 0.00 0.00 +0.000 HD +ATOM 276 HD22 LEU 186 -34.624 -12.652 -11.170 0.00 0.00 +0.000 HD +ATOM 277 HD23 LEU 186 -34.670 -13.816 -10.025 0.00 0.00 +0.000 HD +ATOM 278 C LEU 186 -36.268 -11.184 -5.879 0.00 0.00 +0.000 C +ATOM 279 O LEU 186 -37.076 -10.276 -6.093 0.00 0.00 +0.000 OA +ATOM 280 N ARG 187 -36.440 -12.076 -4.913 0.00 0.00 +0.000 N +ATOM 281 H ARG 187 -35.706 -12.783 -4.821 0.00 0.00 +0.000 HD +ATOM 282 CA ARG 187 -37.615 -11.988 -4.085 0.00 0.00 +0.000 C +ATOM 283 HA ARG 187 -38.439 -11.913 -4.678 0.00 0.00 +0.000 HD +ATOM 284 CB ARG 187 -37.800 -13.281 -3.308 0.00 0.00 +0.000 C +ATOM 285 HB2 ARG 187 -37.759 -14.036 -3.941 0.00 0.00 +0.000 HD +ATOM 286 HB3 ARG 187 -37.094 -13.340 -2.623 0.00 0.00 +0.000 HD +ATOM 287 CG ARG 187 -39.143 -13.318 -2.610 0.00 0.00 +0.000 C +ATOM 288 HG2 ARG 187 -39.139 -12.689 -1.827 0.00 0.00 +0.000 HD +ATOM 289 HG3 ARG 187 -39.867 -13.037 -3.247 0.00 0.00 +0.000 HD +ATOM 290 CD ARG 187 -39.527 -14.716 -2.071 0.00 0.00 +0.000 C +ATOM 291 HD2 ARG 187 -39.428 -15.360 -2.826 0.00 0.00 +0.000 HD +ATOM 292 HD3 ARG 187 -38.879 -14.939 -1.346 0.00 0.00 +0.000 HD +ATOM 293 NE ARG 187 -40.880 -14.758 -1.558 0.00 0.00 +0.000 N +ATOM 294 HE ARG 187 -41.022 -15.060 -0.606 0.00 0.00 +0.000 HD +ATOM 295 CZ ARG 187 -41.962 -14.422 -2.263 0.00 0.00 +0.000 C +ATOM 296 NH1 ARG 187 -41.866 -14.026 -3.524 0.00 0.00 +0.000 N +ATOM 297 HH11 ARG 187 -40.975 -13.992 -3.976 0.00 0.00 +0.000 HD +ATOM 298 HH12 ARG 187 -42.689 -13.760 -4.030 0.00 0.00 +0.000 HD +ATOM 299 NH2 ARG 187 -43.169 -14.421 -1.700 0.00 0.00 +0.000 N +ATOM 300 HH21 ARG 187 -43.253 -14.698 -0.737 0.00 0.00 +0.000 HD +ATOM 301 HH22 ARG 187 -43.969 -14.154 -2.221 0.00 0.00 +0.000 HD +ATOM 302 C ARG 187 -37.607 -10.776 -3.138 0.00 0.00 +0.000 C +ATOM 303 O ARG 187 -38.623 -10.082 -2.999 0.00 0.00 +0.000 OA +ATOM 304 N GLU 188 -36.486 -10.498 -2.479 0.00 0.00 +0.000 N +ATOM 305 H GLU 188 -35.700 -11.122 -2.635 0.00 0.00 +0.000 HD +ATOM 306 CA GLU 188 -36.463 -9.332 -1.590 0.00 0.00 +0.000 C +ATOM 307 HA GLU 188 -37.257 -9.366 -0.968 0.00 0.00 +0.000 HD +ATOM 308 CB GLU 188 -35.257 -9.375 -0.649 0.00 0.00 +0.000 C +ATOM 309 HB2 GLU 188 -35.354 -8.607 -0.018 0.00 0.00 +0.000 HD +ATOM 310 HB3 GLU 188 -35.314 -10.234 -0.143 0.00 0.00 +0.000 HD +ATOM 311 CG GLU 188 -33.914 -9.293 -1.280 0.00 0.00 +0.000 C +ATOM 312 HG2 GLU 188 -33.715 -10.144 -1.726 0.00 0.00 +0.000 HD +ATOM 313 HG3 GLU 188 -33.892 -8.530 -1.896 0.00 0.00 +0.000 HD +ATOM 314 CD GLU 188 -32.836 -9.065 -0.246 0.00 0.00 +0.000 C +ATOM 315 OE1 GLU 188 -32.857 -9.773 0.778 0.00 0.00 +0.000 OA +ATOM 316 OE2 GLU 188 -31.959 -8.199 -0.446 0.00 0.00 +0.000 OA +ATOM 317 C GLU 188 -36.491 -8.010 -2.371 0.00 0.00 +0.000 C +ATOM 318 O GLU 188 -36.955 -6.991 -1.860 0.00 0.00 +0.000 OA +ATOM 319 N GLN 189 -35.996 -8.024 -3.606 0.00 0.00 +0.000 N +ATOM 320 H GLN 189 -35.603 -8.921 -3.916 0.00 0.00 +0.000 HD +ATOM 321 CA GLN 189 -36.035 -6.818 -4.421 0.00 0.00 +0.000 C +ATOM 322 HA GLN 189 -35.710 -6.055 -3.868 0.00 0.00 +0.000 HD +ATOM 323 CB GLN 189 -35.194 -7.003 -5.691 0.00 0.00 +0.000 C +ATOM 324 HB2 GLN 189 -35.385 -7.912 -6.070 0.00 0.00 +0.000 HD +ATOM 325 HB3 GLN 189 -35.471 -6.308 -6.361 0.00 0.00 +0.000 HD +ATOM 326 CG GLN 189 -33.694 -6.884 -5.479 0.00 0.00 +0.000 C +ATOM 327 HG2 GLN 189 -33.455 -7.324 -4.617 0.00 0.00 +0.000 HD +ATOM 328 HG3 GLN 189 -33.226 -7.337 -6.234 0.00 0.00 +0.000 HD +ATOM 329 CD GLN 189 -33.241 -5.437 -5.425 0.00 0.00 +0.000 C +ATOM 330 OE1 GLN 189 -33.468 -4.676 -6.366 0.00 0.00 +0.000 OA +ATOM 331 NE2 GLN 189 -32.601 -5.047 -4.324 0.00 0.00 +0.000 N +ATOM 332 HE21 GLN 189 -32.259 -4.100 -4.226 0.00 0.00 +0.000 HD +ATOM 333 HE22 GLN 189 -32.462 -5.726 -3.575 0.00 0.00 +0.000 HD +ATOM 334 C GLN 189 -37.491 -6.535 -4.794 0.00 0.00 +0.000 C +ATOM 335 O GLN 189 -37.945 -5.398 -4.771 0.00 0.00 +0.000 OA +ATOM 336 N ALA 190 -38.227 -7.591 -5.125 0.00 0.00 +0.000 N +ATOM 337 H ALA 190 -37.734 -8.501 -5.082 0.00 0.00 +0.000 HD +ATOM 338 CA ALA 190 -39.628 -7.450 -5.517 0.00 0.00 +0.000 C +ATOM 339 HA ALA 190 -39.696 -6.704 -6.210 0.00 0.00 +0.000 HD +ATOM 340 CB ALA 190 -40.105 -8.721 -6.222 0.00 0.00 +0.000 C +ATOM 341 HB1 ALA 190 -39.426 -9.442 -6.098 0.00 0.00 +0.000 HD +ATOM 342 HB2 ALA 190 -40.976 -9.010 -5.829 0.00 0.00 +0.000 HD +ATOM 343 HB3 ALA 190 -40.222 -8.534 -7.196 0.00 0.00 +0.000 HD +ATOM 344 C ALA 190 -40.575 -7.118 -4.363 0.00 0.00 +0.000 C +ATOM 345 O ALA 190 -41.540 -6.361 -4.534 0.00 0.00 +0.000 OA +ATOM 346 N THR 191 -40.291 -7.670 -3.188 0.00 0.00 +0.000 N +ATOM 347 H THR 191 -39.428 -8.249 -3.176 0.00 0.00 +0.000 HD +ATOM 348 CA THR 191 -41.137 -7.467 -2.017 0.00 0.00 +0.000 C +ATOM 349 HA THR 191 -42.084 -7.255 -2.340 0.00 0.00 +0.000 HD +ATOM 350 CB THR 191 -41.212 -8.756 -1.190 0.00 0.00 +0.000 C +ATOM 351 HB THR 191 -41.899 -8.633 -0.445 0.00 0.00 +0.000 HD +ATOM 352 CG2 THR 191 -41.579 -9.934 -2.094 0.00 0.00 +0.000 C +ATOM 353 HG21 THR 191 -40.796 -10.553 -2.174 0.00 0.00 +0.000 HD +ATOM 354 HG22 THR 191 -42.355 -10.430 -1.701 0.00 0.00 +0.000 HD +ATOM 355 HG23 THR 191 -41.828 -9.595 -3.003 0.00 0.00 +0.000 HD +ATOM 356 OG1 THR 191 -39.938 -9.010 -0.582 0.00 0.00 +0.000 OA +ATOM 357 HG1 THR 191 -39.291 -9.367 -1.264 0.00 0.00 +0.000 HD +ATOM 358 C THR 191 -40.690 -6.337 -1.095 0.00 0.00 +0.000 C +ATOM 359 O THR 191 -41.528 -5.627 -0.535 0.00 0.00 +0.000 OA +ATOM 360 N GLY 192 -39.380 -6.175 -0.932 0.00 0.00 +0.000 N +ATOM 361 H GLY 192 -38.786 -6.840 -1.450 0.00 0.00 +0.000 HD +ATOM 362 CA GLY 192 -38.866 -5.120 -0.073 0.00 0.00 +0.000 C +ATOM 363 HA2 GLY 192 -38.083 -4.662 -0.540 0.00 0.00 +0.000 HD +ATOM 364 HA3 GLY 192 -39.585 -4.405 0.045 0.00 0.00 +0.000 HD +ATOM 365 C GLY 192 -38.419 -5.605 1.289 0.00 0.00 +0.000 C +ATOM 366 O GLY 192 -38.015 -4.815 2.149 0.00 0.00 +0.000 OA +ATOM 367 N ALA 193 -38.481 -6.913 1.503 0.00 0.00 +0.000 N +ATOM 368 H ALA 193 -38.812 -7.479 0.708 0.00 0.00 +0.000 HD +ATOM 369 CA ALA 193 -38.095 -7.481 2.800 0.00 0.00 +0.000 C +ATOM 370 HA ALA 193 -37.816 -6.717 3.416 0.00 0.00 +0.000 HD +ATOM 371 CB ALA 193 -39.311 -8.131 3.428 0.00 0.00 +0.000 C +ATOM 372 HB1 ALA 193 -39.671 -8.836 2.816 0.00 0.00 +0.000 HD +ATOM 373 HB2 ALA 193 -39.057 -8.551 4.300 0.00 0.00 +0.000 HD +ATOM 374 HB3 ALA 193 -40.018 -7.441 3.588 0.00 0.00 +0.000 HD +ATOM 375 C ALA 193 -36.941 -8.491 2.737 0.00 0.00 +0.000 C +ATOM 376 O ALA 193 -36.797 -9.218 1.764 0.00 0.00 +0.000 OA +ATOM 377 N LYS 194 -36.137 -8.521 3.792 0.00 0.00 +0.000 N +ATOM 378 H LYS 194 -36.399 -7.834 4.546 0.00 0.00 +0.000 HD +ATOM 379 CA LYS 194 -35.000 -9.414 3.905 0.00 0.00 +0.000 C +ATOM 380 HA LYS 194 -34.637 -9.608 2.994 0.00 0.00 +0.000 HD +ATOM 381 CB LYS 194 -33.962 -8.782 4.828 0.00 0.00 +0.000 C +ATOM 382 HB2 LYS 194 -34.314 -7.891 5.142 0.00 0.00 +0.000 HD +ATOM 383 HB3 LYS 194 -33.850 -9.376 5.637 0.00 0.00 +0.000 HD +ATOM 384 CG LYS 194 -32.552 -8.537 4.238 0.00 0.00 +0.000 C +ATOM 385 HG2 LYS 194 -32.228 -9.382 3.836 0.00 0.00 +0.000 HD +ATOM 386 HG3 LYS 194 -32.614 -7.819 3.560 0.00 0.00 +0.000 HD +ATOM 387 CD LYS 194 -31.598 -8.106 5.345 0.00 0.00 +0.000 C +ATOM 388 HD2 LYS 194 -30.683 -8.034 4.977 0.00 0.00 +0.000 HD +ATOM 389 HD3 LYS 194 -31.904 -7.246 5.723 0.00 0.00 +0.000 HD +ATOM 390 CE LYS 194 -31.578 -9.150 6.480 0.00 0.00 +0.000 C +ATOM 391 HE2 LYS 194 -31.475 -8.660 7.367 0.00 0.00 +0.000 HD +ATOM 392 HE3 LYS 194 -32.485 -9.612 6.509 0.00 0.00 +0.000 HD +ATOM 393 NZ LYS 194 -30.502 -10.219 6.399 0.00 0.00 +0.000 N +ATOM 394 HZ1 LYS 194 -29.673 -9.866 6.821 0.00 0.00 +0.000 HD +ATOM 395 HZ2 LYS 194 -30.821 -11.027 6.884 0.00 0.00 +0.000 HD +ATOM 396 HZ3 LYS 194 -30.339 -10.432 5.441 0.00 0.00 +0.000 HD +ATOM 397 C LYS 194 -35.461 -10.736 4.534 0.00 0.00 +0.000 C +ATOM 398 O LYS 194 -36.205 -10.719 5.517 0.00 0.00 +0.000 OA +ATOM 399 N ASP 195 -35.042 -11.872 3.975 0.00 0.00 +0.000 N +ATOM 400 H ASP 195 -34.456 -11.759 3.133 0.00 0.00 +0.000 HD +ATOM 401 CA ASP 195 -35.407 -13.175 4.543 0.00 0.00 +0.000 C +ATOM 402 HA ASP 195 -36.292 -13.075 4.961 0.00 0.00 +0.000 HD +ATOM 403 CB ASP 195 -35.264 -14.296 3.512 0.00 0.00 +0.000 C +ATOM 404 HB2 ASP 195 -35.753 -14.024 2.693 0.00 0.00 +0.000 HD +ATOM 405 HB3 ASP 195 -34.299 -14.418 3.323 0.00 0.00 +0.000 HD +ATOM 406 CG ASP 195 -35.836 -15.608 4.010 0.00 0.00 +0.000 C +ATOM 407 OD1 ASP 195 -35.806 -15.841 5.242 0.00 0.00 +0.000 OA +ATOM 408 OD2 ASP 195 -36.306 -16.414 3.179 0.00 0.00 +0.000 OA +ATOM 409 C ASP 195 -34.400 -13.409 5.671 0.00 0.00 +0.000 C +ATOM 410 O ASP 195 -33.192 -13.293 5.460 0.00 0.00 +0.000 OA +ATOM 411 N THR 196 -34.881 -13.764 6.859 0.00 0.00 +0.000 N +ATOM 412 H THR 196 -35.908 -13.876 6.902 0.00 0.00 +0.000 HD +ATOM 413 CA THR 196 -33.995 -13.974 8.004 0.00 0.00 +0.000 C +ATOM 414 HA THR 196 -33.160 -13.396 7.871 0.00 0.00 +0.000 HD +ATOM 415 CB THR 196 -34.663 -13.462 9.298 0.00 0.00 +0.000 C +ATOM 416 HB THR 196 -34.741 -12.447 9.246 0.00 0.00 +0.000 HD +ATOM 417 CG2 THR 196 -36.039 -14.081 9.476 0.00 0.00 +0.000 C +ATOM 418 HG21 THR 196 -36.744 -13.372 9.400 0.00 0.00 +0.000 HD +ATOM 419 HG22 THR 196 -36.195 -14.775 8.769 0.00 0.00 +0.000 HD +ATOM 420 HG23 THR 196 -36.105 -14.513 10.379 0.00 0.00 +0.000 HD +ATOM 421 OG1 THR 196 -33.838 -13.793 10.419 0.00 0.00 +0.000 OA +ATOM 422 HG1 THR 196 -33.244 -14.575 10.199 0.00 0.00 +0.000 HD +ATOM 423 C THR 196 -33.533 -15.420 8.225 0.00 0.00 +0.000 C +ATOM 424 O THR 196 -32.717 -15.686 9.106 0.00 0.00 +0.000 OA +ATOM 425 N LYS 197 -34.047 -16.354 7.436 0.00 0.00 +0.000 N +ATOM 426 H LYS 197 -34.728 -16.019 6.736 0.00 0.00 +0.000 HD +ATOM 427 CA LYS 197 -33.653 -17.761 7.574 0.00 0.00 +0.000 C +ATOM 428 HA LYS 197 -33.695 -18.013 8.550 0.00 0.00 +0.000 HD +ATOM 429 CB LYS 197 -34.582 -18.672 6.768 0.00 0.00 +0.000 C +ATOM 430 HB2 LYS 197 -34.700 -18.260 5.855 0.00 0.00 +0.000 HD +ATOM 431 HB3 LYS 197 -34.116 -19.560 6.652 0.00 0.00 +0.000 HD +ATOM 432 CG LYS 197 -35.945 -18.920 7.360 0.00 0.00 +0.000 C +ATOM 433 HG2 LYS 197 -35.859 -19.468 8.180 0.00 0.00 +0.000 HD +ATOM 434 HG3 LYS 197 -36.390 -18.057 7.552 0.00 0.00 +0.000 HD +ATOM 435 CD LYS 197 -36.792 -19.691 6.345 0.00 0.00 +0.000 C +ATOM 436 HD2 LYS 197 -36.349 -20.560 6.155 0.00 0.00 +0.000 HD +ATOM 437 HD3 LYS 197 -37.697 -19.837 6.728 0.00 0.00 +0.000 HD +ATOM 438 CE LYS 197 -36.937 -18.921 5.034 0.00 0.00 +0.000 C +ATOM 439 HE2 LYS 197 -37.346 -18.024 5.233 0.00 0.00 +0.000 HD +ATOM 440 HE3 LYS 197 -36.021 -18.775 4.645 0.00 0.00 +0.000 HD +ATOM 441 NZ LYS 197 -37.781 -19.638 4.047 0.00 0.00 +0.000 N +ATOM 442 HZ1 LYS 197 -37.836 -19.103 3.203 0.00 0.00 +0.000 HD +ATOM 443 HZ2 LYS 197 -37.377 -20.532 3.849 0.00 0.00 +0.000 HD +ATOM 444 HZ3 LYS 197 -38.700 -19.763 4.422 0.00 0.00 +0.000 HD +ATOM 445 C LYS 197 -32.235 -17.999 7.066 0.00 0.00 +0.000 C +ATOM 446 O LYS 197 -31.797 -17.352 6.116 0.00 0.00 +0.000 OA +ATOM 447 N PRO 198 -31.498 -18.937 7.693 0.00 0.00 +0.000 N +ATOM 448 CD PRO 198 -31.793 -19.679 8.933 0.00 0.00 +0.000 C +ATOM 449 HD2 PRO 198 -32.731 -20.015 8.924 0.00 0.00 +0.000 HD +ATOM 450 HD3 PRO 198 -31.646 -19.099 9.731 0.00 0.00 +0.000 HD +ATOM 451 CG PRO 198 -30.801 -20.803 8.874 0.00 0.00 +0.000 C +ATOM 452 HG2 PRO 198 -31.115 -21.527 8.265 0.00 0.00 +0.000 HD +ATOM 453 HG3 PRO 198 -30.624 -21.173 9.782 0.00 0.00 +0.000 HD +ATOM 454 CB PRO 198 -29.581 -20.144 8.326 0.00 0.00 +0.000 C +ATOM 455 HB2 PRO 198 -28.955 -20.816 7.932 0.00 0.00 +0.000 HD +ATOM 456 HB3 PRO 198 -29.107 -19.620 9.032 0.00 0.00 +0.000 HD +ATOM 457 CA PRO 198 -30.132 -19.217 7.241 0.00 0.00 +0.000 C +ATOM 458 HA PRO 198 -29.578 -18.369 7.242 0.00 0.00 +0.000 HD +ATOM 459 C PRO 198 -30.105 -19.878 5.874 0.00 0.00 +0.000 C +ATOM 460 O PRO 198 -31.050 -20.558 5.479 0.00 0.00 +0.000 OA +ATOM 461 N MET 199 -29.018 -19.659 5.146 0.00 0.00 +0.000 N +ATOM 462 H MET 199 -28.313 -19.040 5.584 0.00 0.00 +0.000 HD +ATOM 463 CA MET 199 -28.864 -20.261 3.834 0.00 0.00 +0.000 C +ATOM 464 HA MET 199 -29.708 -20.131 3.324 0.00 0.00 +0.000 HD +ATOM 465 CB MET 199 -27.650 -19.656 3.126 0.00 0.00 +0.000 C +ATOM 466 HB2 MET 199 -26.845 -19.720 3.736 0.00 0.00 +0.000 HD +ATOM 467 HB3 MET 199 -27.449 -20.196 2.295 0.00 0.00 +0.000 HD +ATOM 468 CG MET 199 -27.807 -18.184 2.705 0.00 0.00 +0.000 C +ATOM 469 HG2 MET 199 -28.163 -17.663 3.515 0.00 0.00 +0.000 HD +ATOM 470 HG3 MET 199 -26.869 -17.806 2.530 0.00 0.00 +0.000 HD +ATOM 471 SD MET 199 -28.869 -17.976 1.279 0.00 0.00 +0.000 S +ATOM 472 CE MET 199 -29.039 -16.192 1.184 0.00 0.00 +0.000 C +ATOM 473 HE1 MET 199 -28.557 -15.769 1.952 0.00 0.00 +0.000 HD +ATOM 474 HE2 MET 199 -28.647 -15.864 0.324 0.00 0.00 +0.000 HD +ATOM 475 HE3 MET 199 -30.008 -15.946 1.223 0.00 0.00 +0.000 HD +ATOM 476 C MET 199 -28.659 -21.757 4.034 0.00 0.00 +0.000 C +ATOM 477 O MET 199 -28.502 -22.222 5.167 0.00 0.00 +0.000 OA +ATOM 478 N GLY 200 -28.675 -22.519 2.944 0.00 0.00 +0.000 N +ATOM 479 H GLY 200 -28.837 -22.025 2.059 0.00 0.00 +0.000 HD +ATOM 480 CA GLY 200 -28.471 -23.950 3.064 0.00 0.00 +0.000 C +ATOM 481 HA2 GLY 200 -29.090 -24.324 3.751 0.00 0.00 +0.000 HD +ATOM 482 HA3 GLY 200 -28.639 -24.391 2.185 0.00 0.00 +0.000 HD +ATOM 483 C GLY 200 -27.036 -24.195 3.488 0.00 0.00 +0.000 C +ATOM 484 O GLY 200 -26.294 -23.225 3.695 0.00 0.00 +0.000 OA +ATOM 485 N SER 202 -22.146 -24.130 3.748 0.00 0.00 +0.000 NA +ATOM 486 H SER 202 -22.234 -23.719 4.664 0.00 0.00 +0.000 HD +ATOM 487 CA SER 202 -22.622 -23.510 2.517 0.00 0.00 +0.000 C +ATOM 488 HA SER 202 -21.830 -23.349 1.919 0.00 0.00 +0.000 HD +ATOM 489 CB SER 202 -23.636 -24.435 1.814 0.00 0.00 +0.000 C +ATOM 490 HB2 SER 202 -24.414 -24.578 2.423 0.00 0.00 +0.000 HD +ATOM 491 HB3 SER 202 -23.943 -23.992 0.974 0.00 0.00 +0.000 HD +ATOM 492 OG SER 202 -23.074 -25.710 1.481 0.00 0.00 +0.000 OA +ATOM 493 HG SER 202 -22.978 -25.775 0.491 0.00 0.00 +0.000 HD +ATOM 494 C SER 202 -23.272 -22.153 2.804 0.00 0.00 +0.000 C +ATOM 495 O SER 202 -23.310 -21.276 1.936 0.00 0.00 +0.000 OA +ATOM 496 N GLY 203 -23.777 -21.984 4.021 0.00 0.00 +0.000 N +ATOM 497 H GLY 203 -23.655 -22.788 4.661 0.00 0.00 +0.000 HD +ATOM 498 CA GLY 203 -24.441 -20.751 4.383 0.00 0.00 +0.000 C +ATOM 499 HA2 GLY 203 -25.256 -20.613 3.746 0.00 0.00 +0.000 HD +ATOM 500 HA3 GLY 203 -24.892 -20.877 5.315 0.00 0.00 +0.000 HD +ATOM 501 C GLY 203 -23.633 -19.469 4.412 0.00 0.00 +0.000 C +ATOM 502 O GLY 203 -24.079 -18.443 3.888 0.00 0.00 +0.000 OA +ATOM 503 N ALA 204 -22.455 -19.505 5.029 0.00 0.00 +0.000 N +ATOM 504 H ALA 204 -22.188 -20.427 5.414 0.00 0.00 +0.000 HD +ATOM 505 CA ALA 204 -21.620 -18.309 5.138 0.00 0.00 +0.000 C +ATOM 506 HA ALA 204 -22.069 -17.664 5.793 0.00 0.00 +0.000 HD +ATOM 507 CB ALA 204 -20.295 -18.660 5.774 0.00 0.00 +0.000 C +ATOM 508 HB1 ALA 204 -19.693 -19.083 5.094 0.00 0.00 +0.000 HD +ATOM 509 HB2 ALA 204 -19.858 -17.831 6.128 0.00 0.00 +0.000 HD +ATOM 510 HB3 ALA 204 -20.440 -19.302 6.529 0.00 0.00 +0.000 HD +ATOM 511 C ALA 204 -21.387 -17.579 3.827 0.00 0.00 +0.000 C +ATOM 512 O ALA 204 -21.739 -16.404 3.713 0.00 0.00 +0.000 OA +ATOM 513 N THR 205 -20.775 -18.251 2.859 0.00 0.00 +0.000 N +ATOM 514 H THR 205 -20.498 -19.217 3.100 0.00 0.00 +0.000 HD +ATOM 515 CA THR 205 -20.532 -17.633 1.568 0.00 0.00 +0.000 C +ATOM 516 HA THR 205 -19.930 -16.829 1.705 0.00 0.00 +0.000 HD +ATOM 517 CB THR 205 -19.838 -18.600 0.603 0.00 0.00 +0.000 C +ATOM 518 HB THR 205 -20.388 -19.459 0.541 0.00 0.00 +0.000 HD +ATOM 519 CG2 THR 205 -19.688 -17.969 -0.767 0.00 0.00 +0.000 C +ATOM 520 HG21 THR 205 -18.922 -18.393 -1.258 0.00 0.00 +0.000 HD +ATOM 521 HG22 THR 205 -20.529 -18.100 -1.299 0.00 0.00 +0.000 HD +ATOM 522 HG23 THR 205 -19.511 -16.986 -0.674 0.00 0.00 +0.000 HD +ATOM 523 OG1 THR 205 -18.539 -18.940 1.106 0.00 0.00 +0.000 OA +ATOM 524 HG1 THR 205 -17.858 -18.903 0.367 0.00 0.00 +0.000 HD +ATOM 525 C THR 205 -21.813 -17.161 0.908 0.00 0.00 +0.000 C +ATOM 526 O THR 205 -21.870 -16.049 0.377 0.00 0.00 +0.000 OA +ATOM 527 N SER 206 -22.849 -17.987 0.930 0.00 0.00 +0.000 N +ATOM 528 H SER 206 -22.712 -18.880 1.388 0.00 0.00 +0.000 HD +ATOM 529 CA SER 206 -24.082 -17.545 0.301 0.00 0.00 +0.000 C +ATOM 530 HA SER 206 -23.894 -17.344 -0.664 0.00 0.00 +0.000 HD +ATOM 531 CB SER 206 -25.163 -18.627 0.400 0.00 0.00 +0.000 C +ATOM 532 HB2 SER 206 -25.271 -18.884 1.360 0.00 0.00 +0.000 HD +ATOM 533 HB3 SER 206 -26.023 -18.250 0.057 0.00 0.00 +0.000 HD +ATOM 534 OG SER 206 -24.833 -19.780 -0.352 0.00 0.00 +0.000 OA +ATOM 535 HG SER 206 -24.317 -20.416 0.221 0.00 0.00 +0.000 HD +ATOM 536 C SER 206 -24.580 -16.241 0.955 0.00 0.00 +0.000 C +ATOM 537 O SER 206 -25.060 -15.346 0.260 0.00 0.00 +0.000 OA +ATOM 538 N ARG 207 -24.463 -16.128 2.280 0.00 0.00 +0.000 N +ATOM 539 H ARG 207 -24.026 -16.932 2.753 0.00 0.00 +0.000 HD +ATOM 540 CA ARG 207 -24.935 -14.931 2.966 0.00 0.00 +0.000 C +ATOM 541 HA ARG 207 -25.912 -14.791 2.736 0.00 0.00 +0.000 HD +ATOM 542 CB ARG 207 -24.870 -15.099 4.487 0.00 0.00 +0.000 C +ATOM 543 HB2 ARG 207 -25.449 -15.865 4.741 0.00 0.00 +0.000 HD +ATOM 544 HB3 ARG 207 -23.926 -15.277 4.741 0.00 0.00 +0.000 HD +ATOM 545 CG ARG 207 -25.343 -13.873 5.257 0.00 0.00 +0.000 C +ATOM 546 HG2 ARG 207 -24.726 -13.107 5.076 0.00 0.00 +0.000 HD +ATOM 547 HG3 ARG 207 -26.268 -13.633 4.965 0.00 0.00 +0.000 HD +ATOM 548 CD ARG 207 -25.374 -14.106 6.768 0.00 0.00 +0.000 C +ATOM 549 HD2 ARG 207 -25.475 -13.222 7.213 0.00 0.00 +0.000 HD +ATOM 550 HD3 ARG 207 -26.156 -14.687 6.972 0.00 0.00 +0.000 HD +ATOM 551 NE ARG 207 -24.150 -14.753 7.248 0.00 0.00 +0.000 N +ATOM 552 HE ARG 207 -23.369 -14.165 7.482 0.00 0.00 +0.000 HD +ATOM 553 CZ ARG 207 -24.008 -16.068 7.394 0.00 0.00 +0.000 C +ATOM 554 NH1 ARG 207 -25.010 -16.887 7.093 0.00 0.00 +0.000 N +ATOM 555 HH11 ARG 207 -25.871 -16.536 6.737 0.00 0.00 +0.000 HD +ATOM 556 HH12 ARG 207 -24.897 -17.879 7.226 0.00 0.00 +0.000 HD +ATOM 557 NH2 ARG 207 -22.882 -16.570 7.876 0.00 0.00 +0.000 N +ATOM 558 HH21 ARG 207 -22.127 -15.951 8.113 0.00 0.00 +0.000 HD +ATOM 559 HH22 ARG 207 -22.779 -17.553 8.003 0.00 0.00 +0.000 HD +ATOM 560 C ARG 207 -24.159 -13.691 2.565 0.00 0.00 +0.000 C +ATOM 561 O ARG 207 -24.739 -12.622 2.380 0.00 0.00 +0.000 OA +ATOM 562 N LYS 208 -22.847 -13.824 2.452 0.00 0.00 +0.000 N +ATOM 563 H LYS 208 -22.477 -14.764 2.651 0.00 0.00 +0.000 HD +ATOM 564 CA LYS 208 -22.031 -12.689 2.070 0.00 0.00 +0.000 C +ATOM 565 HA LYS 208 -22.285 -11.895 2.630 0.00 0.00 +0.000 HD +ATOM 566 CB LYS 208 -20.548 -12.995 2.327 0.00 0.00 +0.000 C +ATOM 567 HB2 LYS 208 -20.249 -13.677 1.671 0.00 0.00 +0.000 HD +ATOM 568 HB3 LYS 208 -20.030 -12.155 2.219 0.00 0.00 +0.000 HD +ATOM 569 CG LYS 208 -20.272 -13.545 3.743 0.00 0.00 +0.000 C +ATOM 570 HG2 LYS 208 -20.522 -12.847 4.412 0.00 0.00 +0.000 HD +ATOM 571 HG3 LYS 208 -20.829 -14.361 3.884 0.00 0.00 +0.000 HD +ATOM 572 CD LYS 208 -18.793 -13.913 3.941 0.00 0.00 +0.000 C +ATOM 573 HD2 LYS 208 -18.726 -14.565 4.691 0.00 0.00 +0.000 HD +ATOM 574 HD3 LYS 208 -18.451 -14.319 3.099 0.00 0.00 +0.000 HD +ATOM 575 CE LYS 208 -17.930 -12.693 4.278 0.00 0.00 +0.000 C +ATOM 576 HE2 LYS 208 -16.968 -12.964 4.247 0.00 0.00 +0.000 HD +ATOM 577 HE3 LYS 208 -18.098 -11.984 3.594 0.00 0.00 +0.000 HD +ATOM 578 NZ LYS 208 -18.254 -12.166 5.628 0.00 0.00 +0.000 N +ATOM 579 HZ1 LYS 208 -18.502 -12.924 6.231 0.00 0.00 +0.000 HD +ATOM 580 HZ2 LYS 208 -17.457 -11.691 6.000 0.00 0.00 +0.000 HD +ATOM 581 HZ3 LYS 208 -19.022 -11.528 5.561 0.00 0.00 +0.000 HD +ATOM 582 C LYS 208 -22.269 -12.344 0.603 0.00 0.00 +0.000 C +ATOM 583 O LYS 208 -22.216 -11.180 0.220 0.00 0.00 +0.000 OA +ATOM 584 N ALA 209 -22.535 -13.358 -0.219 0.00 0.00 +0.000 N +ATOM 585 H ALA 209 -22.551 -14.292 0.224 0.00 0.00 +0.000 HD +ATOM 586 CA ALA 209 -22.784 -13.136 -1.649 0.00 0.00 +0.000 C +ATOM 587 HA ALA 209 -22.020 -12.620 -2.033 0.00 0.00 +0.000 HD +ATOM 588 CB ALA 209 -22.907 -14.491 -2.387 0.00 0.00 +0.000 C +ATOM 589 HB1 ALA 209 -23.859 -14.782 -2.368 0.00 0.00 +0.000 HD +ATOM 590 HB2 ALA 209 -22.604 -14.373 -3.328 0.00 0.00 +0.000 HD +ATOM 591 HB3 ALA 209 -22.335 -15.162 -1.925 0.00 0.00 +0.000 HD +ATOM 592 C ALA 209 -24.065 -12.313 -1.817 0.00 0.00 +0.000 C +ATOM 593 O ALA 209 -24.118 -11.411 -2.654 0.00 0.00 +0.000 OA +ATOM 594 N LEU 210 -25.086 -12.614 -1.014 0.00 0.00 +0.000 N +ATOM 595 H LEU 210 -24.914 -13.393 -0.359 0.00 0.00 +0.000 HD +ATOM 596 CA LEU 210 -26.340 -11.872 -1.086 0.00 0.00 +0.000 C +ATOM 597 HA LEU 210 -26.663 -11.880 -2.037 0.00 0.00 +0.000 HD +ATOM 598 CB LEU 210 -27.393 -12.512 -0.177 0.00 0.00 +0.000 C +ATOM 599 HB2 LEU 210 -27.535 -13.450 -0.489 0.00 0.00 +0.000 HD +ATOM 600 HB3 LEU 210 -27.031 -12.517 0.753 0.00 0.00 +0.000 HD +ATOM 601 CG LEU 210 -28.766 -11.836 -0.129 0.00 0.00 +0.000 C +ATOM 602 HG LEU 210 -28.666 -10.918 0.234 0.00 0.00 +0.000 HD +ATOM 603 CD1 LEU 210 -29.339 -11.757 -1.551 0.00 0.00 +0.000 C +ATOM 604 HD11 LEU 210 -29.430 -12.680 -1.919 0.00 0.00 +0.000 HD +ATOM 605 HD12 LEU 210 -30.234 -11.316 -1.520 0.00 0.00 +0.000 HD +ATOM 606 HD13 LEU 210 -28.720 -11.224 -2.125 0.00 0.00 +0.000 HD +ATOM 607 CD2 LEU 210 -29.717 -12.614 0.785 0.00 0.00 +0.000 C +ATOM 608 HD21 LEU 210 -29.336 -12.644 1.708 0.00 0.00 +0.000 HD +ATOM 609 HD22 LEU 210 -30.605 -12.157 0.802 0.00 0.00 +0.000 HD +ATOM 610 HD23 LEU 210 -29.824 -13.544 0.435 0.00 0.00 +0.000 HD +ATOM 611 C LEU 210 -26.126 -10.426 -0.661 0.00 0.00 +0.000 C +ATOM 612 O LEU 210 -26.672 -9.500 -1.267 0.00 0.00 +0.000 OA +ATOM 613 N GLU 211 -25.336 -10.239 0.392 0.00 0.00 +0.000 N +ATOM 614 H GLU 211 -24.941 -11.106 0.802 0.00 0.00 +0.000 HD +ATOM 615 CA GLU 211 -25.060 -8.902 0.914 0.00 0.00 +0.000 C +ATOM 616 HA GLU 211 -25.921 -8.451 1.161 0.00 0.00 +0.000 HD +ATOM 617 CB GLU 211 -24.248 -9.010 2.216 0.00 0.00 +0.000 C +ATOM 618 HB2 GLU 211 -23.607 -9.734 2.109 0.00 0.00 +0.000 HD +ATOM 619 HB3 GLU 211 -23.845 -8.143 2.390 0.00 0.00 +0.000 HD +ATOM 620 CG GLU 211 -25.141 -9.355 3.414 0.00 0.00 +0.000 C +ATOM 621 HG2 GLU 211 -25.576 -8.524 3.721 0.00 0.00 +0.000 HD +ATOM 622 HG3 GLU 211 -25.805 -10.024 3.121 0.00 0.00 +0.000 HD +ATOM 623 CD GLU 211 -24.396 -9.950 4.615 0.00 0.00 +0.000 C +ATOM 624 OE1 GLU 211 -23.160 -10.134 4.545 0.00 0.00 +0.000 OA +ATOM 625 OE2 GLU 211 -25.066 -10.236 5.638 0.00 0.00 +0.000 OA +ATOM 626 C GLU 211 -24.331 -8.066 -0.137 0.00 0.00 +0.000 C +ATOM 627 O GLU 211 -24.606 -6.878 -0.308 0.00 0.00 +0.000 OA +ATOM 628 N THR 212 -23.403 -8.695 -0.850 0.00 0.00 +0.000 N +ATOM 629 H THR 212 -23.261 -9.693 -0.597 0.00 0.00 +0.000 HD +ATOM 630 CA THR 212 -22.652 -8.019 -1.903 0.00 0.00 +0.000 C +ATOM 631 HA THR 212 -22.234 -7.197 -1.521 0.00 0.00 +0.000 HD +ATOM 632 CB THR 212 -21.593 -8.951 -2.489 0.00 0.00 +0.000 C +ATOM 633 HB THR 212 -22.050 -9.782 -2.864 0.00 0.00 +0.000 HD +ATOM 634 CG2 THR 212 -20.804 -8.250 -3.592 0.00 0.00 +0.000 C +ATOM 635 HG21 THR 212 -20.406 -8.932 -4.208 0.00 0.00 +0.000 HD +ATOM 636 HG22 THR 212 -21.413 -7.649 -4.113 0.00 0.00 +0.000 HD +ATOM 637 HG23 THR 212 -20.069 -7.704 -3.186 0.00 0.00 +0.000 HD +ATOM 638 OG1 THR 212 -20.707 -9.364 -1.445 0.00 0.00 +0.000 OA +ATOM 639 HG1 THR 212 -21.163 -10.025 -0.839 0.00 0.00 +0.000 HD +ATOM 640 C THR 212 -23.621 -7.598 -3.006 0.00 0.00 +0.000 C +ATOM 641 O THR 212 -23.522 -6.497 -3.545 0.00 0.00 +0.000 OA +ATOM 642 N LEU 213 -24.557 -8.483 -3.353 0.00 0.00 +0.000 N +ATOM 643 H LEU 213 -24.524 -9.381 -2.857 0.00 0.00 +0.000 HD +ATOM 644 CA LEU 213 -25.546 -8.147 -4.381 0.00 0.00 +0.000 C +ATOM 645 HA LEU 213 -25.055 -7.882 -5.224 0.00 0.00 +0.000 HD +ATOM 646 CB LEU 213 -26.428 -9.358 -4.726 0.00 0.00 +0.000 C +ATOM 647 HB2 LEU 213 -26.596 -9.861 -3.876 0.00 0.00 +0.000 HD +ATOM 648 HB3 LEU 213 -27.295 -9.008 -5.081 0.00 0.00 +0.000 HD +ATOM 649 CG LEU 213 -25.884 -10.357 -5.747 0.00 0.00 +0.000 C +ATOM 650 HG LEU 213 -24.983 -10.658 -5.458 0.00 0.00 +0.000 HD +ATOM 651 CD1 LEU 213 -26.821 -11.552 -5.819 0.00 0.00 +0.000 C +ATOM 652 HD11 LEU 213 -27.732 -11.247 -6.099 0.00 0.00 +0.000 HD +ATOM 653 HD12 LEU 213 -26.472 -12.212 -6.486 0.00 0.00 +0.000 HD +ATOM 654 HD13 LEU 213 -26.878 -11.987 -4.920 0.00 0.00 +0.000 HD +ATOM 655 CD2 LEU 213 -25.750 -9.692 -7.117 0.00 0.00 +0.000 C +ATOM 656 HD21 LEU 213 -25.122 -8.917 -7.049 0.00 0.00 +0.000 HD +ATOM 657 HD22 LEU 213 -25.394 -10.356 -7.774 0.00 0.00 +0.000 HD +ATOM 658 HD23 LEU 213 -26.647 -9.371 -7.418 0.00 0.00 +0.000 HD +ATOM 659 C LEU 213 -26.448 -6.975 -3.966 0.00 0.00 +0.000 C +ATOM 660 O LEU 213 -26.835 -6.171 -4.802 0.00 0.00 +0.000 OA +ATOM 661 N ARG 214 -26.796 -6.887 -2.684 0.00 0.00 +0.000 N +ATOM 662 H ARG 214 -26.430 -7.627 -2.072 0.00 0.00 +0.000 HD +ATOM 663 CA ARG 214 -27.649 -5.788 -2.220 0.00 0.00 +0.000 C +ATOM 664 HA ARG 214 -28.475 -5.762 -2.789 0.00 0.00 +0.000 HD +ATOM 665 CB ARG 214 -28.025 -5.958 -0.756 0.00 0.00 +0.000 C +ATOM 666 HB2 ARG 214 -27.182 -6.127 -0.238 0.00 0.00 +0.000 HD +ATOM 667 HB3 ARG 214 -28.433 -5.097 -0.439 0.00 0.00 +0.000 HD +ATOM 668 CG ARG 214 -28.986 -7.069 -0.472 0.00 0.00 +0.000 C +ATOM 669 HG2 ARG 214 -29.854 -6.889 -0.908 0.00 0.00 +0.000 HD +ATOM 670 HG3 ARG 214 -28.606 -7.932 -0.769 0.00 0.00 +0.000 HD +ATOM 671 CD ARG 214 -29.212 -7.141 1.020 0.00 0.00 +0.000 C +ATOM 672 HD2 ARG 214 -28.324 -7.169 1.469 0.00 0.00 +0.000 HD +ATOM 673 HD3 ARG 214 -29.714 -6.327 1.299 0.00 0.00 +0.000 HD +ATOM 674 NE ARG 214 -29.974 -8.325 1.382 0.00 0.00 +0.000 N +ATOM 675 HE ARG 214 -30.629 -8.690 0.709 0.00 0.00 +0.000 HD +ATOM 676 CZ ARG 214 -29.859 -8.952 2.541 0.00 0.00 +0.000 C +ATOM 677 NH1 ARG 214 -29.010 -8.502 3.450 0.00 0.00 +0.000 N +ATOM 678 HH11 ARG 214 -28.462 -7.685 3.296 0.00 0.00 +0.000 HD +ATOM 679 HH12 ARG 214 -28.912 -8.997 4.327 0.00 0.00 +0.000 HD +ATOM 680 NH2 ARG 214 -30.589 -10.032 2.782 0.00 0.00 +0.000 N +ATOM 681 HH21 ARG 214 -31.240 -10.358 2.092 0.00 0.00 +0.000 HD +ATOM 682 HH22 ARG 214 -30.494 -10.521 3.648 0.00 0.00 +0.000 HD +ATOM 683 C ARG 214 -26.916 -4.468 -2.353 0.00 0.00 +0.000 C +ATOM 684 O ARG 214 -27.527 -3.411 -2.529 0.00 0.00 +0.000 OA +ATOM 685 N ARG 215 -25.598 -4.531 -2.240 0.00 0.00 +0.000 N +ATOM 686 H ARG 215 -25.218 -5.484 -2.074 0.00 0.00 +0.000 HD +ATOM 687 CA ARG 215 -24.772 -3.343 -2.344 0.00 0.00 +0.000 C +ATOM 688 HA ARG 215 -25.251 -2.571 -1.903 0.00 0.00 +0.000 HD +ATOM 689 CB ARG 215 -23.456 -3.579 -1.595 0.00 0.00 +0.000 C +ATOM 690 HB2 ARG 215 -23.668 -3.684 -0.620 0.00 0.00 +0.000 HD +ATOM 691 HB3 ARG 215 -23.054 -4.433 -1.934 0.00 0.00 +0.000 HD +ATOM 692 CG ARG 215 -22.404 -2.483 -1.729 0.00 0.00 +0.000 C +ATOM 693 HG2 ARG 215 -21.960 -2.554 -2.610 0.00 0.00 +0.000 HD +ATOM 694 HG3 ARG 215 -22.830 -1.598 -1.612 0.00 0.00 +0.000 HD +ATOM 695 CD ARG 215 -21.336 -2.642 -0.644 0.00 0.00 +0.000 C +ATOM 696 HD2 ARG 215 -20.586 -2.020 -0.858 0.00 0.00 +0.000 HD +ATOM 697 HD3 ARG 215 -21.748 -2.390 0.229 0.00 0.00 +0.000 HD +ATOM 698 NE ARG 215 -20.817 -4.012 -0.557 0.00 0.00 +0.000 N +ATOM 699 HE ARG 215 -21.280 -4.645 0.082 0.00 0.00 +0.000 HD +ATOM 700 CZ ARG 215 -19.786 -4.485 -1.253 0.00 0.00 +0.000 C +ATOM 701 NH1 ARG 215 -19.136 -3.710 -2.101 0.00 0.00 +0.000 N +ATOM 702 HH11 ARG 215 -19.389 -2.752 -2.223 0.00 0.00 +0.000 HD +ATOM 703 HH12 ARG 215 -18.369 -4.086 -2.636 0.00 0.00 +0.000 HD +ATOM 704 NH2 ARG 215 -19.408 -5.743 -1.095 0.00 0.00 +0.000 N +ATOM 705 HH21 ARG 215 -19.886 -6.331 -0.437 0.00 0.00 +0.000 HD +ATOM 706 HH22 ARG 215 -18.646 -6.112 -1.627 0.00 0.00 +0.000 HD +ATOM 707 C ARG 215 -24.504 -2.978 -3.798 0.00 0.00 +0.000 C +ATOM 708 O ARG 215 -24.844 -1.875 -4.230 0.00 0.00 +0.000 OA +ATOM 709 N VAL 216 -23.937 -3.911 -4.560 0.00 0.00 +0.000 N +ATOM 710 H VAL 216 -23.767 -4.818 -4.080 0.00 0.00 +0.000 HD +ATOM 711 CA VAL 216 -23.588 -3.665 -5.956 0.00 0.00 +0.000 C +ATOM 712 HA VAL 216 -23.173 -2.734 -6.016 0.00 0.00 +0.000 HD +ATOM 713 CB VAL 216 -22.501 -4.669 -6.424 0.00 0.00 +0.000 C +ATOM 714 HB VAL 216 -22.904 -5.579 -6.390 0.00 0.00 +0.000 HD +ATOM 715 CG1 VAL 216 -22.107 -4.403 -7.864 0.00 0.00 +0.000 C +ATOM 716 HG11 VAL 216 -21.477 -5.115 -8.178 0.00 0.00 +0.000 HD +ATOM 717 HG12 VAL 216 -22.924 -4.406 -8.443 0.00 0.00 +0.000 HD +ATOM 718 HG13 VAL 216 -21.658 -3.511 -7.931 0.00 0.00 +0.000 HD +ATOM 719 CG2 VAL 216 -21.285 -4.550 -5.521 0.00 0.00 +0.000 C +ATOM 720 HG21 VAL 216 -21.276 -5.314 -4.875 0.00 0.00 +0.000 HD +ATOM 721 HG22 VAL 216 -20.455 -4.572 -6.079 0.00 0.00 +0.000 HD +ATOM 722 HG23 VAL 216 -21.329 -3.686 -5.018 0.00 0.00 +0.000 HD +ATOM 723 C VAL 216 -24.770 -3.707 -6.922 0.00 0.00 +0.000 C +ATOM 724 O VAL 216 -24.858 -2.883 -7.834 0.00 0.00 +0.000 OA +ATOM 725 N GLY 217 -25.667 -4.672 -6.741 0.00 0.00 +0.000 N +ATOM 726 H GLY 217 -25.482 -5.307 -5.955 0.00 0.00 +0.000 HD +ATOM 727 CA GLY 217 -26.813 -4.773 -7.627 0.00 0.00 +0.000 C +ATOM 728 HA2 GLY 217 -26.491 -4.980 -8.572 0.00 0.00 +0.000 HD +ATOM 729 HA3 GLY 217 -27.391 -5.563 -7.341 0.00 0.00 +0.000 HD +ATOM 730 C GLY 217 -27.671 -3.518 -7.660 0.00 0.00 +0.000 C +ATOM 731 O GLY 217 -28.157 -3.111 -8.712 0.00 0.00 +0.000 OA +ATOM 732 N ASP 218 -27.863 -2.905 -6.500 0.00 0.00 +0.000 N +ATOM 733 H ASP 218 -27.396 -3.356 -5.686 0.00 0.00 +0.000 HD +ATOM 734 CA ASP 218 -28.667 -1.695 -6.391 0.00 0.00 +0.000 C +ATOM 735 HA ASP 218 -29.551 -1.881 -6.844 0.00 0.00 +0.000 HD +ATOM 736 CB ASP 218 -28.881 -1.366 -4.912 0.00 0.00 +0.000 C +ATOM 737 HB2 ASP 218 -27.995 -1.323 -4.472 0.00 0.00 +0.000 HD +ATOM 738 HB3 ASP 218 -29.351 -0.498 -4.852 0.00 0.00 +0.000 HD +ATOM 739 CG ASP 218 -29.725 -2.426 -4.199 0.00 0.00 +0.000 C +ATOM 740 OD1 ASP 218 -29.671 -3.617 -4.593 0.00 0.00 +0.000 OA +ATOM 741 OD2 ASP 218 -30.443 -2.080 -3.231 0.00 0.00 +0.000 OA +ATOM 742 C ASP 218 -28.031 -0.518 -7.125 0.00 0.00 +0.000 C +ATOM 743 O ASP 218 -28.728 0.302 -7.718 0.00 0.00 +0.000 OA +ATOM 744 N GLY 219 -26.705 -0.442 -7.097 0.00 0.00 +0.000 N +ATOM 745 H GLY 219 -26.229 -1.187 -6.572 0.00 0.00 +0.000 HD +ATOM 746 CA GLY 219 -26.027 0.643 -7.780 0.00 0.00 +0.000 C +ATOM 747 HA2 GLY 219 -26.419 1.527 -7.483 0.00 0.00 +0.000 HD +ATOM 748 HA3 GLY 219 -25.048 0.643 -7.527 0.00 0.00 +0.000 HD +ATOM 749 C GLY 219 -26.152 0.524 -9.291 0.00 0.00 +0.000 C +ATOM 750 O GLY 219 -26.279 1.531 -9.995 0.00 0.00 +0.000 OA +ATOM 751 N VAL 220 -26.126 -0.709 -9.786 0.00 0.00 +0.000 N +ATOM 752 H VAL 220 -26.028 -1.462 -9.075 0.00 0.00 +0.000 HD +ATOM 753 CA VAL 220 -26.228 -0.966 -11.217 0.00 0.00 +0.000 C +ATOM 754 HA VAL 220 -25.505 -0.431 -11.685 0.00 0.00 +0.000 HD +ATOM 755 CB VAL 220 -26.008 -2.470 -11.526 0.00 0.00 +0.000 C +ATOM 756 HB VAL 220 -26.700 -2.979 -11.027 0.00 0.00 +0.000 HD +ATOM 757 CG1 VAL 220 -26.224 -2.738 -13.001 0.00 0.00 +0.000 C +ATOM 758 HG11 VAL 220 -25.631 -3.488 -13.298 0.00 0.00 +0.000 HD +ATOM 759 HG12 VAL 220 -27.180 -2.990 -13.162 0.00 0.00 +0.000 HD +ATOM 760 HG13 VAL 220 -26.006 -1.916 -13.529 0.00 0.00 +0.000 HD +ATOM 761 CG2 VAL 220 -24.601 -2.884 -11.109 0.00 0.00 +0.000 C +ATOM 762 HG21 VAL 220 -24.131 -2.097 -10.711 0.00 0.00 +0.000 HD +ATOM 763 HG22 VAL 220 -24.661 -3.618 -10.434 0.00 0.00 +0.000 HD +ATOM 764 HG23 VAL 220 -24.101 -3.205 -11.913 0.00 0.00 +0.000 HD +ATOM 765 C VAL 220 -27.572 -0.539 -11.796 0.00 0.00 +0.000 C +ATOM 766 O VAL 220 -27.629 0.062 -12.865 0.00 0.00 +0.000 OA +ATOM 767 N GLN 221 -28.653 -0.860 -11.092 0.00 0.00 +0.000 N +ATOM 768 H GLN 221 -28.465 -1.365 -10.207 0.00 0.00 +0.000 HD +ATOM 769 CA GLN 221 -29.991 -0.514 -11.556 0.00 0.00 +0.000 C +ATOM 770 HA GLN 221 -30.109 -0.894 -12.482 0.00 0.00 +0.000 HD +ATOM 771 CB GLN 221 -31.044 -1.094 -10.606 0.00 0.00 +0.000 C +ATOM 772 HB2 GLN 221 -30.895 -0.710 -9.689 0.00 0.00 +0.000 HD +ATOM 773 HB3 GLN 221 -31.955 -0.815 -10.928 0.00 0.00 +0.000 HD +ATOM 774 CG GLN 221 -31.032 -2.613 -10.488 0.00 0.00 +0.000 C +ATOM 775 HG2 GLN 221 -31.214 -3.006 -11.385 0.00 0.00 +0.000 HD +ATOM 776 HG3 GLN 221 -30.136 -2.903 -10.163 0.00 0.00 +0.000 HD +ATOM 777 CD GLN 221 -32.088 -3.121 -9.514 0.00 0.00 +0.000 C +ATOM 778 OE1 GLN 221 -31.765 -3.778 -8.530 0.00 0.00 +0.000 OA +ATOM 779 NE2 GLN 221 -33.352 -2.822 -9.790 0.00 0.00 +0.000 N +ATOM 780 HE21 GLN 221 -34.106 -3.139 -9.194 0.00 0.00 +0.000 HD +ATOM 781 HE22 GLN 221 -33.552 -2.262 -10.620 0.00 0.00 +0.000 HD +ATOM 782 C GLN 221 -30.175 1.002 -11.652 0.00 0.00 +0.000 C +ATOM 783 O GLN 221 -30.936 1.487 -12.489 0.00 0.00 +0.000 OA +ATOM 784 N ARG 222 -29.482 1.740 -10.785 0.00 0.00 +0.000 N +ATOM 785 H ARG 222 -28.895 1.194 -10.123 0.00 0.00 +0.000 HD +ATOM 786 CA ARG 222 -29.554 3.198 -10.780 0.00 0.00 +0.000 C +ATOM 787 HA ARG 222 -30.497 3.478 -10.985 0.00 0.00 +0.000 HD +ATOM 788 CB ARG 222 -29.146 3.743 -9.411 0.00 0.00 +0.000 C +ATOM 789 HB2 ARG 222 -28.240 3.386 -9.190 0.00 0.00 +0.000 HD +ATOM 790 HB3 ARG 222 -29.110 4.739 -9.469 0.00 0.00 +0.000 HD +ATOM 791 CG ARG 222 -30.087 3.373 -8.273 0.00 0.00 +0.000 C +ATOM 792 HG2 ARG 222 -30.510 2.489 -8.463 0.00 0.00 +0.000 HD +ATOM 793 HG3 ARG 222 -29.574 3.324 -7.418 0.00 0.00 +0.000 HD +ATOM 794 CD ARG 222 -31.205 4.401 -8.091 0.00 0.00 +0.000 C +ATOM 795 HD2 ARG 222 -31.701 4.164 -7.261 0.00 0.00 +0.000 HD +ATOM 796 HD3 ARG 222 -30.779 5.296 -7.994 0.00 0.00 +0.000 HD +ATOM 797 NE ARG 222 -32.111 4.409 -9.220 0.00 0.00 +0.000 N +ATOM 798 HE ARG 222 -32.021 3.673 -9.908 0.00 0.00 +0.000 HD +ATOM 799 CZ ARG 222 -33.062 5.320 -9.423 0.00 0.00 +0.000 C +ATOM 800 NH1 ARG 222 -33.254 6.320 -8.557 0.00 0.00 +0.000 N +ATOM 801 HH11 ARG 222 -32.669 6.405 -7.754 0.00 0.00 +0.000 HD +ATOM 802 HH12 ARG 222 -33.986 6.982 -8.719 0.00 0.00 +0.000 HD +ATOM 803 NH2 ARG 222 -33.795 5.265 -10.528 0.00 0.00 +0.000 N +ATOM 804 HH21 ARG 222 -33.618 4.554 -11.211 0.00 0.00 +0.000 HD +ATOM 805 HH22 ARG 222 -34.523 5.933 -10.681 0.00 0.00 +0.000 HD +ATOM 806 C ARG 222 -28.630 3.781 -11.846 0.00 0.00 +0.000 C +ATOM 807 O ARG 222 -29.035 4.643 -12.633 0.00 0.00 +0.000 OA +ATOM 808 N ASN 223 -27.386 3.304 -11.867 0.00 0.00 +0.000 N +ATOM 809 H ASN 223 -27.178 2.587 -11.153 0.00 0.00 +0.000 HD +ATOM 810 CA ASN 223 -26.412 3.784 -12.845 0.00 0.00 +0.000 C +ATOM 811 HA ASN 223 -26.346 4.788 -12.729 0.00 0.00 +0.000 HD +ATOM 812 CB ASN 223 -25.052 3.121 -12.625 0.00 0.00 +0.000 C +ATOM 813 HB2 ASN 223 -25.205 2.158 -12.418 0.00 0.00 +0.000 HD +ATOM 814 HB3 ASN 223 -24.523 3.209 -13.466 0.00 0.00 +0.000 HD +ATOM 815 CG ASN 223 -24.284 3.747 -11.496 0.00 0.00 +0.000 C +ATOM 816 OD1 ASN 223 -24.321 4.960 -11.310 0.00 0.00 +0.000 OA +ATOM 817 ND2 ASN 223 -23.569 2.929 -10.741 0.00 0.00 +0.000 N +ATOM 818 HD21 ASN 223 -23.040 3.287 -9.970 0.00 0.00 +0.000 HD +ATOM 819 HD22 ASN 223 -23.554 1.946 -10.939 0.00 0.00 +0.000 HD +ATOM 820 C ASN 223 -26.845 3.528 -14.280 0.00 0.00 +0.000 C +ATOM 821 O ASN 223 -26.482 4.267 -15.189 0.00 0.00 +0.000 OA +ATOM 822 N HIE 224 -27.626 2.479 -14.479 0.00 0.00 +0.000 N +ATOM 823 H HIE 224 -27.882 1.952 -13.625 0.00 0.00 +0.000 HD +ATOM 824 CA HIE 224 -28.068 2.127 -15.810 0.00 0.00 +0.000 C +ATOM 825 HA HIE 224 -27.697 2.802 -16.464 0.00 0.00 +0.000 HD +ATOM 826 CB HIE 224 -27.465 0.762 -16.162 0.00 0.00 +0.000 C +ATOM 827 HB2 HIE 224 -27.749 0.092 -15.474 0.00 0.00 +0.000 HD +ATOM 828 HB3 HIE 224 -27.804 0.478 -17.060 0.00 0.00 +0.000 HD +ATOM 829 CG HIE 224 -25.966 0.787 -16.208 0.00 0.00 +0.000 A +ATOM 830 ND1 HIE 224 -25.278 1.419 -17.219 0.00 0.00 +0.000 NA +ATOM 831 CE1 HIE 224 -23.982 1.395 -16.948 0.00 0.00 +0.000 A +ATOM 832 HE1 HIE 224 -23.263 1.785 -17.515 0.00 0.00 +0.000 HD +ATOM 833 NE2 HIE 224 -23.808 0.766 -15.803 0.00 0.00 +0.000 N +ATOM 834 HE2 HIE 224 -22.922 0.599 -15.348 0.00 0.00 +0.000 HD +ATOM 835 CD2 HIE 224 -25.033 0.367 -15.317 0.00 0.00 +0.000 A +ATOM 836 HD2 HIE 224 -25.199 -0.133 -14.475 0.00 0.00 +0.000 HD +ATOM 837 C HIE 224 -29.589 2.151 -15.920 0.00 0.00 +0.000 C +ATOM 838 O HIE 224 -30.184 1.417 -16.696 0.00 0.00 +0.000 OA +ATOM 839 N GLU 225 -30.198 3.056 -15.157 0.00 0.00 +0.000 N +ATOM 840 H GLU 225 -29.545 3.640 -14.582 0.00 0.00 +0.000 HD +ATOM 841 CA GLU 225 -31.647 3.223 -15.122 0.00 0.00 +0.000 C +ATOM 842 HA GLU 225 -32.064 2.437 -14.627 0.00 0.00 +0.000 HD +ATOM 843 CB GLU 225 -32.009 4.470 -14.313 0.00 0.00 +0.000 C +ATOM 844 HB2 GLU 225 -31.779 4.294 -13.373 0.00 0.00 +0.000 HD +ATOM 845 HB3 GLU 225 -31.502 5.226 -14.684 0.00 0.00 +0.000 HD +ATOM 846 CG GLU 225 -33.485 4.834 -14.366 0.00 0.00 +0.000 C +ATOM 847 HG2 GLU 225 -33.750 4.902 -15.307 0.00 0.00 +0.000 HD +ATOM 848 HG3 GLU 225 -33.989 4.148 -13.879 0.00 0.00 +0.000 HD +ATOM 849 CD GLU 225 -33.767 6.167 -13.709 0.00 0.00 +0.000 C +ATOM 850 OE1 GLU 225 -34.384 6.172 -12.627 0.00 0.00 +0.000 OA +ATOM 851 OE2 GLU 225 -33.367 7.211 -14.275 0.00 0.00 +0.000 OA +ATOM 852 C GLU 225 -32.279 3.340 -16.501 0.00 0.00 +0.000 C +ATOM 853 O GLU 225 -33.199 2.598 -16.844 0.00 0.00 +0.000 OA +ATOM 854 N THR 226 -31.799 4.295 -17.283 0.00 0.00 +0.000 N +ATOM 855 H THR 226 -31.027 4.852 -16.875 0.00 0.00 +0.000 HD +ATOM 856 CA THR 226 -32.340 4.519 -18.614 0.00 0.00 +0.000 C +ATOM 857 HA THR 226 -33.312 4.798 -18.524 0.00 0.00 +0.000 HD +ATOM 858 CB THR 226 -31.601 5.678 -19.321 0.00 0.00 +0.000 C +ATOM 859 HB THR 226 -30.630 5.406 -19.466 0.00 0.00 +0.000 HD +ATOM 860 CG2 THR 226 -32.278 6.016 -20.645 0.00 0.00 +0.000 C +ATOM 861 HG21 THR 226 -33.265 5.859 -20.570 0.00 0.00 +0.000 HD +ATOM 862 HG22 THR 226 -32.114 6.978 -20.873 0.00 0.00 +0.000 HD +ATOM 863 HG23 THR 226 -31.906 5.437 -21.373 0.00 0.00 +0.000 HD +ATOM 864 OG1 THR 226 -31.622 6.837 -18.478 0.00 0.00 +0.000 OA +ATOM 865 HG1 THR 226 -32.024 6.612 -17.584 0.00 0.00 +0.000 HD +ATOM 866 C THR 226 -32.285 3.274 -19.493 0.00 0.00 +0.000 C +ATOM 867 O THR 226 -33.275 2.921 -20.132 0.00 0.00 +0.000 OA +ATOM 868 N ALA 227 -31.140 2.604 -19.535 0.00 0.00 +0.000 N +ATOM 869 H ALA 227 -30.377 2.985 -18.965 0.00 0.00 +0.000 HD +ATOM 870 CA ALA 227 -31.030 1.404 -20.360 0.00 0.00 +0.000 C +ATOM 871 HA ALA 227 -31.313 1.626 -21.299 0.00 0.00 +0.000 HD +ATOM 872 CB ALA 227 -29.587 0.923 -20.403 0.00 0.00 +0.000 C +ATOM 873 HB1 ALA 227 -29.545 0.033 -20.856 0.00 0.00 +0.000 HD +ATOM 874 HB2 ALA 227 -29.030 1.580 -20.910 0.00 0.00 +0.000 HD +ATOM 875 HB3 ALA 227 -29.235 0.839 -19.471 0.00 0.00 +0.000 HD +ATOM 876 C ALA 227 -31.946 0.291 -19.831 0.00 0.00 +0.000 C +ATOM 877 O ALA 227 -32.558 -0.445 -20.607 0.00 0.00 +0.000 OA +ATOM 878 N PHE 228 -32.040 0.180 -18.508 0.00 0.00 +0.000 N +ATOM 879 H PHE 228 -31.483 0.867 -17.970 0.00 0.00 +0.000 HD +ATOM 880 CA PHE 228 -32.875 -0.845 -17.894 0.00 0.00 +0.000 C +ATOM 881 HA PHE 228 -32.609 -1.726 -18.303 0.00 0.00 +0.000 HD +ATOM 882 CB PHE 228 -32.657 -0.863 -16.376 0.00 0.00 +0.000 C +ATOM 883 HB2 PHE 228 -32.453 0.057 -16.087 0.00 0.00 +0.000 HD +ATOM 884 HB3 PHE 228 -33.480 -1.206 -15.955 0.00 0.00 +0.000 HD +ATOM 885 CG PHE 228 -31.509 -1.751 -15.940 0.00 0.00 +0.000 A +ATOM 886 CD1 PHE 228 -30.329 -1.796 -16.678 0.00 0.00 +0.000 A +ATOM 887 HD1 PHE 228 -30.236 -1.239 -17.499 0.00 0.00 +0.000 HD +ATOM 888 CE1 PHE 228 -29.267 -2.610 -16.286 0.00 0.00 +0.000 A +ATOM 889 HE1 PHE 228 -28.428 -2.631 -16.841 0.00 0.00 +0.000 HD +ATOM 890 CZ PHE 228 -29.369 -3.390 -15.134 0.00 0.00 +0.000 A +ATOM 891 HZ PHE 228 -28.607 -3.965 -14.854 0.00 0.00 +0.000 HD +ATOM 892 CE2 PHE 228 -30.542 -3.356 -14.382 0.00 0.00 +0.000 A +ATOM 893 HE2 PHE 228 -30.638 -3.918 -13.551 0.00 0.00 +0.000 HD +ATOM 894 CD2 PHE 228 -31.606 -2.531 -14.785 0.00 0.00 +0.000 A +ATOM 895 HD2 PHE 228 -32.438 -2.504 -14.237 0.00 0.00 +0.000 HD +ATOM 896 C PHE 228 -34.346 -0.630 -18.234 0.00 0.00 +0.000 C +ATOM 897 O PHE 228 -35.036 -1.576 -18.613 0.00 0.00 +0.000 OA +ATOM 898 N GLN 229 -34.822 0.609 -18.104 0.00 0.00 +0.000 N +ATOM 899 H GLN 229 -34.143 1.306 -17.757 0.00 0.00 +0.000 HD +ATOM 900 CA GLN 229 -36.212 0.925 -18.437 0.00 0.00 +0.000 C +ATOM 901 HA GLN 229 -36.802 0.315 -17.914 0.00 0.00 +0.000 HD +ATOM 902 CB GLN 229 -36.517 2.409 -18.220 0.00 0.00 +0.000 C +ATOM 903 HB2 GLN 229 -35.962 2.948 -18.880 0.00 0.00 +0.000 HD +ATOM 904 HB3 GLN 229 -37.494 2.572 -18.458 0.00 0.00 +0.000 HD +ATOM 905 CG GLN 229 -36.275 2.978 -16.835 0.00 0.00 +0.000 C +ATOM 906 HG2 GLN 229 -36.906 2.557 -16.194 0.00 0.00 +0.000 HD +ATOM 907 HG3 GLN 229 -35.335 2.800 -16.569 0.00 0.00 +0.000 HD +ATOM 908 CD GLN 229 -36.503 4.493 -16.807 0.00 0.00 +0.000 C +ATOM 909 OE1 GLN 229 -37.320 4.990 -16.022 0.00 0.00 +0.000 OA +ATOM 910 NE2 GLN 229 -35.779 5.232 -17.659 0.00 0.00 +0.000 N +ATOM 911 HE21 GLN 229 -35.892 6.229 -17.699 0.00 0.00 +0.000 HD +ATOM 912 HE22 GLN 229 -35.111 4.755 -18.263 0.00 0.00 +0.000 HD +ATOM 913 C GLN 229 -36.435 0.633 -19.922 0.00 0.00 +0.000 C +ATOM 914 O GLN 229 -37.483 0.135 -20.321 0.00 0.00 +0.000 OA +ATOM 915 N GLY 230 -35.441 0.976 -20.732 0.00 0.00 +0.000 N +ATOM 916 H GLY 230 -34.618 1.394 -20.266 0.00 0.00 +0.000 HD +ATOM 917 CA GLY 230 -35.540 0.763 -22.165 0.00 0.00 +0.000 C +ATOM 918 HA2 GLY 230 -36.349 1.273 -22.524 0.00 0.00 +0.000 HD +ATOM 919 HA3 GLY 230 -34.723 1.173 -22.621 0.00 0.00 +0.000 HD +ATOM 920 C GLY 230 -35.654 -0.692 -22.564 0.00 0.00 +0.000 C +ATOM 921 O GLY 230 -36.481 -1.049 -23.410 0.00 0.00 +0.000 OA +ATOM 922 N MET 231 -34.824 -1.535 -21.957 0.00 0.00 +0.000 N +ATOM 923 H MET 231 -34.183 -1.102 -21.270 0.00 0.00 +0.000 HD +ATOM 924 CA MET 231 -34.844 -2.958 -22.262 0.00 0.00 +0.000 C +ATOM 925 HA MET 231 -34.808 -3.069 -23.257 0.00 0.00 +0.000 HD +ATOM 926 CB MET 231 -33.647 -3.666 -21.615 0.00 0.00 +0.000 C +ATOM 927 HB2 MET 231 -32.797 -3.241 -21.947 0.00 0.00 +0.000 HD +ATOM 928 HB3 MET 231 -33.695 -3.543 -20.617 0.00 0.00 +0.000 HD +ATOM 929 CG MET 231 -33.583 -5.163 -21.911 0.00 0.00 +0.000 C +ATOM 930 HG2 MET 231 -32.788 -5.561 -21.399 0.00 0.00 +0.000 HD +ATOM 931 HG3 MET 231 -34.416 -5.610 -21.511 0.00 0.00 +0.000 HD +ATOM 932 SD MET 231 -33.450 -5.539 -23.685 0.00 0.00 +0.000 S +ATOM 933 CE MET 231 -32.706 -7.161 -23.630 0.00 0.00 +0.000 C +ATOM 934 HE1 MET 231 -32.654 -7.541 -24.556 0.00 0.00 +0.000 HD +ATOM 935 HE2 MET 231 -31.782 -7.097 -23.248 0.00 0.00 +0.000 HD +ATOM 936 HE3 MET 231 -33.259 -7.768 -23.055 0.00 0.00 +0.000 HD +ATOM 937 C MET 231 -36.150 -3.574 -21.767 0.00 0.00 +0.000 C +ATOM 938 O MET 231 -36.762 -4.372 -22.472 0.00 0.00 +0.000 OA +ATOM 939 N LEU 232 -36.589 -3.202 -20.565 0.00 0.00 +0.000 N +ATOM 940 H LEU 232 -36.000 -2.524 -20.067 0.00 0.00 +0.000 HD +ATOM 941 CA LEU 232 -37.835 -3.753 -20.035 0.00 0.00 +0.000 C +ATOM 942 HA LEU 232 -37.737 -4.753 -19.955 0.00 0.00 +0.000 HD +ATOM 943 CB LEU 232 -38.108 -3.214 -18.619 0.00 0.00 +0.000 C +ATOM 944 HB2 LEU 232 -37.344 -3.478 -18.041 0.00 0.00 +0.000 HD +ATOM 945 HB3 LEU 232 -38.178 -2.226 -18.678 0.00 0.00 +0.000 HD +ATOM 946 CG LEU 232 -39.392 -3.726 -17.941 0.00 0.00 +0.000 C +ATOM 947 HG LEU 232 -40.171 -3.491 -18.518 0.00 0.00 +0.000 HD +ATOM 948 CD1 LEU 232 -39.318 -5.224 -17.761 0.00 0.00 +0.000 C +ATOM 949 HD11 LEU 232 -38.530 -5.459 -17.188 0.00 0.00 +0.000 HD +ATOM 950 HD12 LEU 232 -40.155 -5.555 -17.320 0.00 0.00 +0.000 HD +ATOM 951 HD13 LEU 232 -39.220 -5.669 -18.653 0.00 0.00 +0.000 HD +ATOM 952 CD2 LEU 232 -39.595 -3.050 -16.608 0.00 0.00 +0.000 C +ATOM 953 HD21 LEU 232 -39.673 -2.058 -16.737 0.00 0.00 +0.000 HD +ATOM 954 HD22 LEU 232 -40.434 -3.391 -16.176 0.00 0.00 +0.000 HD +ATOM 955 HD23 LEU 232 -38.816 -3.241 -16.006 0.00 0.00 +0.000 HD +ATOM 956 C LEU 232 -39.024 -3.463 -20.965 0.00 0.00 +0.000 C +ATOM 957 O LEU 232 -39.825 -4.358 -21.258 0.00 0.00 +0.000 OA +ATOM 958 N ARG 233 -39.128 -2.222 -21.441 0.00 0.00 +0.000 N +ATOM 959 H ARG 233 -38.392 -1.567 -21.116 0.00 0.00 +0.000 HD +ATOM 960 CA ARG 233 -40.209 -1.829 -22.355 0.00 0.00 +0.000 C +ATOM 961 HA ARG 233 -41.088 -1.993 -21.902 0.00 0.00 +0.000 HD +ATOM 962 CB ARG 233 -40.090 -0.339 -22.721 0.00 0.00 +0.000 C +ATOM 963 HB2 ARG 233 -40.217 0.195 -21.889 0.00 0.00 +0.000 HD +ATOM 964 HB3 ARG 233 -39.178 -0.183 -23.090 0.00 0.00 +0.000 HD +ATOM 965 CG ARG 233 -41.106 0.149 -23.754 0.00 0.00 +0.000 C +ATOM 966 HG2 ARG 233 -40.816 -0.134 -24.658 0.00 0.00 +0.000 HD +ATOM 967 HG3 ARG 233 -41.999 -0.219 -23.534 0.00 0.00 +0.000 HD +ATOM 968 CD ARG 233 -41.191 1.664 -23.727 0.00 0.00 +0.000 C +ATOM 969 HD2 ARG 233 -40.826 1.981 -22.864 0.00 0.00 +0.000 HD +ATOM 970 HD3 ARG 233 -40.667 2.018 -24.489 0.00 0.00 +0.000 HD +ATOM 971 NE ARG 233 -42.583 2.097 -23.853 0.00 0.00 +0.000 N +ATOM 972 HE ARG 233 -43.096 2.270 -22.997 0.00 0.00 +0.000 HD +ATOM 973 CZ ARG 233 -43.223 2.280 -25.000 0.00 0.00 +0.000 C +ATOM 974 NH1 ARG 233 -42.604 2.085 -26.154 0.00 0.00 +0.000 N +ATOM 975 HH11 ARG 233 -41.655 1.779 -26.184 0.00 0.00 +0.000 HD +ATOM 976 HH12 ARG 233 -43.096 2.246 -27.018 0.00 0.00 +0.000 HD +ATOM 977 NH2 ARG 233 -44.495 2.646 -24.990 0.00 0.00 +0.000 N +ATOM 978 HH21 ARG 233 -44.976 2.765 -24.118 0.00 0.00 +0.000 HD +ATOM 979 HH22 ARG 233 -44.981 2.804 -25.850 0.00 0.00 +0.000 HD +ATOM 980 C ARG 233 -40.147 -2.669 -23.628 0.00 0.00 +0.000 C +ATOM 981 O ARG 233 -41.156 -3.186 -24.111 0.00 0.00 +0.000 OA +ATOM 982 N LYS 234 -38.945 -2.788 -24.172 0.00 0.00 +0.000 N +ATOM 983 H LYS 234 -38.187 -2.283 -23.661 0.00 0.00 +0.000 HD +ATOM 984 CA LYS 234 -38.717 -3.558 -25.377 0.00 0.00 +0.000 C +ATOM 985 HA LYS 234 -39.224 -3.132 -26.142 0.00 0.00 +0.000 HD +ATOM 986 CB LYS 234 -37.226 -3.516 -25.701 0.00 0.00 +0.000 C +ATOM 987 HB2 LYS 234 -36.952 -2.545 -25.764 0.00 0.00 +0.000 HD +ATOM 988 HB3 LYS 234 -36.730 -3.924 -24.920 0.00 0.00 +0.000 HD +ATOM 989 CG LYS 234 -36.794 -4.215 -26.958 0.00 0.00 +0.000 C +ATOM 990 HG2 LYS 234 -36.765 -5.192 -26.806 0.00 0.00 +0.000 HD +ATOM 991 HG3 LYS 234 -37.406 -3.984 -27.699 0.00 0.00 +0.000 HD +ATOM 992 CD LYS 234 -35.391 -3.735 -27.315 0.00 0.00 +0.000 C +ATOM 993 HD2 LYS 234 -35.458 -3.070 -28.053 0.00 0.00 +0.000 HD +ATOM 994 HD3 LYS 234 -34.980 -3.316 -26.511 0.00 0.00 +0.000 HD +ATOM 995 CE LYS 234 -34.497 -4.881 -27.774 0.00 0.00 +0.000 C +ATOM 996 HE2 LYS 234 -34.432 -5.562 -27.035 0.00 0.00 +0.000 HD +ATOM 997 HE3 LYS 234 -34.916 -5.324 -28.576 0.00 0.00 +0.000 HD +ATOM 998 NZ LYS 234 -33.104 -4.438 -28.144 0.00 0.00 +0.000 N +ATOM 999 HZ1 LYS 234 -32.517 -4.519 -27.343 0.00 0.00 +0.000 HD +ATOM 1000 HZ2 LYS 234 -32.765 -5.022 -28.877 0.00 0.00 +0.000 HD +ATOM 1001 HZ3 LYS 234 -33.138 -3.490 -28.449 0.00 0.00 +0.000 HD +ATOM 1002 C LYS 234 -39.192 -4.997 -25.225 0.00 0.00 +0.000 C +ATOM 1003 O LYS 234 -39.803 -5.550 -26.143 0.00 0.00 +0.000 OA +ATOM 1004 N LEU 235 -38.898 -5.594 -24.072 0.00 0.00 +0.000 N +ATOM 1005 H LEU 235 -38.370 -4.992 -23.399 0.00 0.00 +0.000 HD +ATOM 1006 CA LEU 235 -39.280 -6.971 -23.774 0.00 0.00 +0.000 C +ATOM 1007 HA LEU 235 -38.951 -7.565 -24.526 0.00 0.00 +0.000 HD +ATOM 1008 CB LEU 235 -38.581 -7.431 -22.494 0.00 0.00 +0.000 C +ATOM 1009 HB2 LEU 235 -38.735 -6.749 -21.799 0.00 0.00 +0.000 HD +ATOM 1010 HB3 LEU 235 -38.953 -8.307 -22.239 0.00 0.00 +0.000 HD +ATOM 1011 CG LEU 235 -37.066 -7.599 -22.646 0.00 0.00 +0.000 C +ATOM 1012 HG LEU 235 -36.686 -6.758 -23.029 0.00 0.00 +0.000 HD +ATOM 1013 CD1 LEU 235 -36.429 -7.880 -21.301 0.00 0.00 +0.000 C +ATOM 1014 HD11 LEU 235 -36.811 -8.721 -20.915 0.00 0.00 +0.000 HD +ATOM 1015 HD12 LEU 235 -35.439 -7.988 -21.412 0.00 0.00 +0.000 HD +ATOM 1016 HD13 LEU 235 -36.610 -7.119 -20.676 0.00 0.00 +0.000 HD +ATOM 1017 CD2 LEU 235 -36.785 -8.737 -23.619 0.00 0.00 +0.000 C +ATOM 1018 HD21 LEU 235 -37.190 -8.524 -24.508 0.00 0.00 +0.000 HD +ATOM 1019 HD22 LEU 235 -35.796 -8.851 -23.722 0.00 0.00 +0.000 HD +ATOM 1020 HD23 LEU 235 -37.183 -9.584 -23.266 0.00 0.00 +0.000 HD +ATOM 1021 C LEU 235 -40.790 -7.151 -23.649 0.00 0.00 +0.000 C +ATOM 1022 O LEU 235 -41.312 -8.244 -23.864 0.00 0.00 +0.000 OA +ATOM 1023 N ASP 236 -41.479 -6.078 -23.281 0.00 0.00 +0.000 N +ATOM 1024 H ASP 236 -40.897 -5.237 -23.078 0.00 0.00 +0.000 HD +ATOM 1025 CA ASP 236 -42.930 -6.089 -23.174 0.00 0.00 +0.000 C +ATOM 1026 HA ASP 236 -43.198 -5.284 -22.612 0.00 0.00 +0.000 HD +ATOM 1027 CB ASP 236 -43.512 -5.955 -24.582 0.00 0.00 +0.000 C +ATOM 1028 HB2 ASP 236 -43.130 -5.134 -24.994 0.00 0.00 +0.000 HD +ATOM 1029 HB3 ASP 236 -43.244 -6.759 -25.102 0.00 0.00 +0.000 HD +ATOM 1030 CG ASP 236 -45.020 -5.848 -24.587 0.00 0.00 +0.000 C +ATOM 1031 OD1 ASP 236 -45.614 -5.551 -23.527 0.00 0.00 +0.000 OA +ATOM 1032 OD2 ASP 236 -45.595 -6.052 -25.673 0.00 0.00 +0.000 OA +ATOM 1033 C ASP 236 -43.492 -7.326 -22.464 0.00 0.00 +0.000 C +ATOM 1034 O ASP 236 -44.227 -8.124 -23.049 0.00 0.00 +0.000 OA +ATOM 1035 N ILE 237 -43.153 -7.458 -21.184 0.00 0.00 +0.000 N +ATOM 1036 H ILE 237 -42.562 -6.680 -20.813 0.00 0.00 +0.000 HD +ATOM 1037 CA ILE 237 -43.573 -8.593 -20.373 0.00 0.00 +0.000 C +ATOM 1038 HA ILE 237 -43.630 -9.385 -21.002 0.00 0.00 +0.000 HD +ATOM 1039 CB ILE 237 -42.572 -8.834 -19.239 0.00 0.00 +0.000 C +ATOM 1040 HB ILE 237 -42.634 -8.076 -18.604 0.00 0.00 +0.000 HD +ATOM 1041 CG2 ILE 237 -42.882 -10.158 -18.555 0.00 0.00 +0.000 C +ATOM 1042 HG21 ILE 237 -42.233 -10.309 -17.812 0.00 0.00 +0.000 HD +ATOM 1043 HG22 ILE 237 -43.810 -10.134 -18.186 0.00 0.00 +0.000 HD +ATOM 1044 HG23 ILE 237 -42.808 -10.901 -19.218 0.00 0.00 +0.000 HD +ATOM 1045 CG1 ILE 237 -41.151 -8.856 -19.811 0.00 0.00 +0.000 C +ATOM 1046 HG12 ILE 237 -41.034 -9.703 -20.330 0.00 0.00 +0.000 HD +ATOM 1047 HG13 ILE 237 -41.058 -8.085 -20.443 0.00 0.00 +0.000 HD +ATOM 1048 CD1 ILE 237 -40.061 -8.763 -18.768 0.00 0.00 +0.000 C +ATOM 1049 HD11 ILE 237 -40.136 -9.536 -18.139 0.00 0.00 +0.000 HD +ATOM 1050 HD12 ILE 237 -39.169 -8.784 -19.217 0.00 0.00 +0.000 HD +ATOM 1051 HD13 ILE 237 -40.160 -7.908 -18.260 0.00 0.00 +0.000 HD +ATOM 1052 C ILE 237 -44.960 -8.419 -19.768 0.00 0.00 +0.000 C +ATOM 1053 O ILE 237 -45.183 -7.546 -18.917 0.00 0.00 +0.000 OA +ATOM 1054 N LYS 238 -45.884 -9.273 -20.199 0.00 0.00 +0.000 N +ATOM 1055 H LYS 238 -45.540 -9.973 -20.889 0.00 0.00 +0.000 HD +ATOM 1056 CA LYS 238 -47.262 -9.218 -19.732 0.00 0.00 +0.000 C +ATOM 1057 HA LYS 238 -47.355 -8.439 -19.081 0.00 0.00 +0.000 HD +ATOM 1058 CB LYS 238 -48.179 -8.957 -20.924 0.00 0.00 +0.000 C +ATOM 1059 HB2 LYS 238 -48.145 -9.754 -21.526 0.00 0.00 +0.000 HD +ATOM 1060 HB3 LYS 238 -49.111 -8.837 -20.582 0.00 0.00 +0.000 HD +ATOM 1061 CG LYS 238 -47.810 -7.728 -21.741 0.00 0.00 +0.000 C +ATOM 1062 HG2 LYS 238 -48.003 -6.906 -21.206 0.00 0.00 +0.000 HD +ATOM 1063 HG3 LYS 238 -46.837 -7.760 -21.966 0.00 0.00 +0.000 HD +ATOM 1064 CD LYS 238 -48.610 -7.654 -23.052 0.00 0.00 +0.000 C +ATOM 1065 HD2 LYS 238 -49.480 -8.117 -22.922 0.00 0.00 +0.000 HD +ATOM 1066 HD3 LYS 238 -48.756 -6.699 -23.285 0.00 0.00 +0.000 HD +ATOM 1067 CE LYS 238 -47.874 -8.330 -24.227 0.00 0.00 +0.000 C +ATOM 1068 HE2 LYS 238 -48.518 -8.438 -24.988 0.00 0.00 +0.000 HD +ATOM 1069 HE3 LYS 238 -47.121 -7.735 -24.517 0.00 0.00 +0.000 HD +ATOM 1070 NZ LYS 238 -47.318 -9.681 -23.860 0.00 0.00 +0.000 N +ATOM 1071 HZ1 LYS 238 -47.680 -10.361 -24.492 0.00 0.00 +0.000 HD +ATOM 1072 HZ2 LYS 238 -46.324 -9.649 -23.925 0.00 0.00 +0.000 HD +ATOM 1073 HZ3 LYS 238 -47.593 -9.900 -22.927 0.00 0.00 +0.000 HD +ATOM 1074 C LYS 238 -47.726 -10.489 -19.030 0.00 0.00 +0.000 C +ATOM 1075 O LYS 238 -48.572 -10.441 -18.132 0.00 0.00 +0.000 OA +ATOM 1076 N ASN 239 -47.178 -11.625 -19.441 0.00 0.00 +0.000 N +ATOM 1077 H ASN 239 -46.461 -11.534 -20.173 0.00 0.00 +0.000 HD +ATOM 1078 CA ASN 239 -47.600 -12.889 -18.861 0.00 0.00 +0.000 C +ATOM 1079 HA ASN 239 -47.917 -12.691 -17.910 0.00 0.00 +0.000 HD +ATOM 1080 CB ASN 239 -48.744 -13.446 -19.706 0.00 0.00 +0.000 C +ATOM 1081 HB2 ASN 239 -48.927 -14.379 -19.418 0.00 0.00 +0.000 HD +ATOM 1082 HB3 ASN 239 -49.546 -12.875 -19.570 0.00 0.00 +0.000 HD +ATOM 1083 CG ASN 239 -48.407 -13.458 -21.193 0.00 0.00 +0.000 C +ATOM 1084 OD1 ASN 239 -47.492 -14.166 -21.637 0.00 0.00 +0.000 OA +ATOM 1085 ND2 ASN 239 -49.138 -12.669 -21.970 0.00 0.00 +0.000 N +ATOM 1086 HD21 ASN 239 -48.969 -12.636 -22.955 0.00 0.00 +0.000 HD +ATOM 1087 HD22 ASN 239 -49.861 -12.103 -21.569 0.00 0.00 +0.000 HD +ATOM 1088 C ASN 239 -46.506 -13.939 -18.750 0.00 0.00 +0.000 C +ATOM 1089 O ASN 239 -45.313 -13.666 -18.947 0.00 0.00 +0.000 OA +ATOM 1090 N GLU 240 -46.952 -15.156 -18.459 0.00 0.00 +0.000 N +ATOM 1091 H GLU 240 -48.000 -15.208 -18.353 0.00 0.00 +0.000 HD +ATOM 1092 CA GLU 240 -46.091 -16.315 -18.299 0.00 0.00 +0.000 C +ATOM 1093 HA GLU 240 -45.426 -16.146 -17.552 0.00 0.00 +0.000 HD +ATOM 1094 CB GLU 240 -46.957 -17.490 -17.848 0.00 0.00 +0.000 C +ATOM 1095 HB2 GLU 240 -47.330 -17.258 -16.955 0.00 0.00 +0.000 HD +ATOM 1096 HB3 GLU 240 -47.690 -17.591 -18.512 0.00 0.00 +0.000 HD +ATOM 1097 CG GLU 240 -46.262 -18.822 -17.724 0.00 0.00 +0.000 C +ATOM 1098 HG2 GLU 240 -46.068 -19.159 -18.621 0.00 0.00 +0.000 HD +ATOM 1099 HG3 GLU 240 -45.463 -18.710 -17.173 0.00 0.00 +0.000 HD +ATOM 1100 CD GLU 240 -47.151 -19.838 -17.037 0.00 0.00 +0.000 C +ATOM 1101 OE1 GLU 240 -48.271 -20.067 -17.540 0.00 0.00 +0.000 OA +ATOM 1102 OE2 GLU 240 -46.731 -20.397 -15.997 0.00 0.00 +0.000 OA +ATOM 1103 C GLU 240 -45.330 -16.660 -19.577 0.00 0.00 +0.000 C +ATOM 1104 O GLU 240 -44.142 -16.980 -19.526 0.00 0.00 +0.000 OA +ATOM 1105 N ASP 241 -46.003 -16.593 -20.721 0.00 0.00 +0.000 N +ATOM 1106 H ASP 241 -46.986 -16.316 -20.645 0.00 0.00 +0.000 HD +ATOM 1107 CA ASP 241 -45.327 -16.906 -21.970 0.00 0.00 +0.000 C +ATOM 1108 HA ASP 241 -44.904 -17.812 -21.866 0.00 0.00 +0.000 HD +ATOM 1109 CB ASP 241 -46.316 -16.953 -23.145 0.00 0.00 +0.000 C +ATOM 1110 HB2 ASP 241 -46.894 -16.152 -23.094 0.00 0.00 +0.000 HD +ATOM 1111 HB3 ASP 241 -45.796 -16.967 -23.985 0.00 0.00 +0.000 HD +ATOM 1112 CG ASP 241 -47.208 -18.199 -23.103 0.00 0.00 +0.000 C +ATOM 1113 OD1 ASP 241 -46.773 -19.234 -22.538 0.00 0.00 +0.000 OA +ATOM 1114 OD2 ASP 241 -48.335 -18.158 -23.643 0.00 0.00 +0.000 OA +ATOM 1115 C ASP 241 -44.188 -15.913 -22.229 0.00 0.00 +0.000 C +ATOM 1116 O ASP 241 -43.108 -16.313 -22.680 0.00 0.00 +0.000 OA +ATOM 1117 N ASP 242 -44.404 -14.628 -21.944 0.00 0.00 +0.000 N +ATOM 1118 H ASP 242 -45.338 -14.393 -21.607 0.00 0.00 +0.000 HD +ATOM 1119 CA ASP 242 -43.319 -13.655 -22.126 0.00 0.00 +0.000 C +ATOM 1120 HA ASP 242 -42.953 -13.790 -23.048 0.00 0.00 +0.000 HD +ATOM 1121 CB ASP 242 -43.792 -12.217 -21.884 0.00 0.00 +0.000 C +ATOM 1122 HB2 ASP 242 -44.008 -12.126 -20.917 0.00 0.00 +0.000 HD +ATOM 1123 HB3 ASP 242 -43.047 -11.606 -22.130 0.00 0.00 +0.000 HD +ATOM 1124 CG ASP 242 -45.015 -11.852 -22.695 0.00 0.00 +0.000 C +ATOM 1125 OD1 ASP 242 -45.044 -12.127 -23.907 0.00 0.00 +0.000 OA +ATOM 1126 OD2 ASP 242 -45.950 -11.279 -22.106 0.00 0.00 +0.000 OA +ATOM 1127 C ASP 242 -42.181 -13.949 -21.144 0.00 0.00 +0.000 C +ATOM 1128 O ASP 242 -41.015 -13.758 -21.470 0.00 0.00 +0.000 OA +ATOM 1129 N VAL 243 -42.505 -14.396 -19.934 0.00 0.00 +0.000 N +ATOM 1130 H VAL 243 -43.506 -14.513 -19.754 0.00 0.00 +0.000 HD +ATOM 1131 CA VAL 243 -41.453 -14.684 -18.965 0.00 0.00 +0.000 C +ATOM 1132 HA VAL 243 -40.864 -13.877 -18.892 0.00 0.00 +0.000 HD +ATOM 1133 CB VAL 243 -42.030 -15.023 -17.558 0.00 0.00 +0.000 C +ATOM 1134 HB VAL 243 -42.661 -15.780 -17.672 0.00 0.00 +0.000 HD +ATOM 1135 CG1 VAL 243 -40.915 -15.500 -16.632 0.00 0.00 +0.000 C +ATOM 1136 HG11 VAL 243 -40.495 -16.322 -17.014 0.00 0.00 +0.000 HD +ATOM 1137 HG12 VAL 243 -40.225 -14.782 -16.546 0.00 0.00 +0.000 HD +ATOM 1138 HG13 VAL 243 -41.297 -15.707 -15.732 0.00 0.00 +0.000 HD +ATOM 1139 CG2 VAL 243 -42.699 -13.795 -16.959 0.00 0.00 +0.000 C +ATOM 1140 HG21 VAL 243 -43.686 -13.851 -17.107 0.00 0.00 +0.000 HD +ATOM 1141 HG22 VAL 243 -42.507 -13.760 -15.978 0.00 0.00 +0.000 HD +ATOM 1142 HG23 VAL 243 -42.339 -12.974 -17.402 0.00 0.00 +0.000 HD +ATOM 1143 C VAL 243 -40.604 -15.844 -19.465 0.00 0.00 +0.000 C +ATOM 1144 O VAL 243 -39.394 -15.845 -19.300 0.00 0.00 +0.000 OA +ATOM 1145 N LYS 244 -41.241 -16.828 -20.091 0.00 0.00 +0.000 N +ATOM 1146 H LYS 244 -42.262 -16.706 -20.180 0.00 0.00 +0.000 HD +ATOM 1147 CA LYS 244 -40.512 -17.979 -20.600 0.00 0.00 +0.000 C +ATOM 1148 HA LYS 244 -39.925 -18.344 -19.871 0.00 0.00 +0.000 HD +ATOM 1149 CB LYS 244 -41.491 -19.072 -21.035 0.00 0.00 +0.000 C +ATOM 1150 HB2 LYS 244 -42.115 -18.680 -21.705 0.00 0.00 +0.000 HD +ATOM 1151 HB3 LYS 244 -40.966 -19.811 -21.449 0.00 0.00 +0.000 HD +ATOM 1152 CG LYS 244 -42.307 -19.641 -19.892 0.00 0.00 +0.000 C +ATOM 1153 HG2 LYS 244 -41.711 -19.784 -19.101 0.00 0.00 +0.000 HD +ATOM 1154 HG3 LYS 244 -43.032 -18.997 -19.652 0.00 0.00 +0.000 HD +ATOM 1155 CD LYS 244 -42.940 -20.971 -20.274 0.00 0.00 +0.000 C +ATOM 1156 HD2 LYS 244 -43.713 -20.800 -20.869 0.00 0.00 +0.000 HD +ATOM 1157 HD3 LYS 244 -42.261 -21.534 -20.723 0.00 0.00 +0.000 HD +ATOM 1158 CE LYS 244 -43.432 -21.698 -19.032 0.00 0.00 +0.000 C +ATOM 1159 HE2 LYS 244 -42.715 -21.672 -18.334 0.00 0.00 +0.000 HD +ATOM 1160 HE3 LYS 244 -44.248 -21.234 -18.684 0.00 0.00 +0.000 HD +ATOM 1161 NZ LYS 244 -43.770 -23.120 -19.332 0.00 0.00 +0.000 N +ATOM 1162 HZ1 LYS 244 -44.005 -23.589 -18.482 0.00 0.00 +0.000 HD +ATOM 1163 HZ2 LYS 244 -44.548 -23.149 -19.958 0.00 0.00 +0.000 HD +ATOM 1164 HZ3 LYS 244 -42.981 -23.564 -19.755 0.00 0.00 +0.000 HD +ATOM 1165 C LYS 244 -39.634 -17.566 -21.772 0.00 0.00 +0.000 C +ATOM 1166 O LYS 244 -38.559 -18.126 -21.990 0.00 0.00 +0.000 OA +ATOM 1167 N SER 245 -40.084 -16.571 -22.522 0.00 0.00 +0.000 N +ATOM 1168 H SER 245 -40.986 -16.165 -22.226 0.00 0.00 +0.000 HD +ATOM 1169 CA SER 245 -39.327 -16.110 -23.679 0.00 0.00 +0.000 C +ATOM 1170 HA SER 245 -39.098 -16.917 -24.247 0.00 0.00 +0.000 HD +ATOM 1171 CB SER 245 -40.176 -15.146 -24.509 0.00 0.00 +0.000 C +ATOM 1172 HB2 SER 245 -39.747 -15.025 -25.399 0.00 0.00 +0.000 HD +ATOM 1173 HB3 SER 245 -41.087 -15.533 -24.617 0.00 0.00 +0.000 HD +ATOM 1174 OG SER 245 -40.283 -13.886 -23.872 0.00 0.00 +0.000 OA +ATOM 1175 HG SER 245 -40.573 -14.015 -22.924 0.00 0.00 +0.000 HD +ATOM 1176 C SER 245 -38.014 -15.430 -23.290 0.00 0.00 +0.000 C +ATOM 1177 O SER 245 -37.148 -15.217 -24.137 0.00 0.00 +0.000 OA +ATOM 1178 N LEU 246 -37.859 -15.104 -22.010 0.00 0.00 +0.000 N +ATOM 1179 H LEU 246 -38.642 -15.366 -21.390 0.00 0.00 +0.000 HD +ATOM 1180 CA LEU 246 -36.651 -14.423 -21.551 0.00 0.00 +0.000 C +ATOM 1181 HA LEU 246 -36.510 -13.595 -22.137 0.00 0.00 +0.000 HD +ATOM 1182 CB LEU 246 -36.860 -13.871 -20.137 0.00 0.00 +0.000 C +ATOM 1183 HB2 LEU 246 -37.135 -14.618 -19.557 0.00 0.00 +0.000 HD +ATOM 1184 HB3 LEU 246 -36.015 -13.464 -19.841 0.00 0.00 +0.000 HD +ATOM 1185 CG LEU 246 -37.946 -12.798 -20.057 0.00 0.00 +0.000 C +ATOM 1186 HG LEU 246 -38.782 -13.150 -20.467 0.00 0.00 +0.000 HD +ATOM 1187 CD1 LEU 246 -38.209 -12.441 -18.599 0.00 0.00 +0.000 C +ATOM 1188 HD11 LEU 246 -37.368 -12.093 -18.184 0.00 0.00 +0.000 HD +ATOM 1189 HD12 LEU 246 -38.920 -11.739 -18.551 0.00 0.00 +0.000 HD +ATOM 1190 HD13 LEU 246 -38.512 -13.256 -18.106 0.00 0.00 +0.000 HD +ATOM 1191 CD2 LEU 246 -37.526 -11.581 -20.857 0.00 0.00 +0.000 C +ATOM 1192 HD21 LEU 246 -37.387 -11.838 -21.815 0.00 0.00 +0.000 HD +ATOM 1193 HD22 LEU 246 -38.239 -10.879 -20.803 0.00 0.00 +0.000 HD +ATOM 1194 HD23 LEU 246 -36.671 -11.212 -20.487 0.00 0.00 +0.000 HD +ATOM 1195 C LEU 246 -35.376 -15.259 -21.598 0.00 0.00 +0.000 C +ATOM 1196 O LEU 246 -34.285 -14.711 -21.756 0.00 0.00 +0.000 OA +ATOM 1197 N SER 247 -35.501 -16.575 -21.463 0.00 0.00 +0.000 N +ATOM 1198 H SER 247 -36.463 -16.918 -21.330 0.00 0.00 +0.000 HD +ATOM 1199 CA SER 247 -34.326 -17.438 -21.507 0.00 0.00 +0.000 C +ATOM 1200 HA SER 247 -33.723 -17.189 -20.738 0.00 0.00 +0.000 HD +ATOM 1201 CB SER 247 -34.731 -18.912 -21.372 0.00 0.00 +0.000 C +ATOM 1202 HB2 SER 247 -35.345 -19.144 -22.121 0.00 0.00 +0.000 HD +ATOM 1203 HB3 SER 247 -33.909 -19.473 -21.418 0.00 0.00 +0.000 HD +ATOM 1204 OG SER 247 -35.389 -19.155 -20.141 0.00 0.00 +0.000 OA +ATOM 1205 HG SER 247 -35.365 -18.328 -19.581 0.00 0.00 +0.000 HD +ATOM 1206 C SER 247 -33.530 -17.243 -22.802 0.00 0.00 +0.000 C +ATOM 1207 O SER 247 -32.311 -17.108 -22.768 0.00 0.00 +0.000 OA +ATOM 1208 N ARG 248 -34.227 -17.231 -23.938 0.00 0.00 +0.000 N +ATOM 1209 H ARG 248 -35.254 -17.356 -23.817 0.00 0.00 +0.000 HD +ATOM 1210 CA ARG 248 -33.593 -17.055 -25.249 0.00 0.00 +0.000 C +ATOM 1211 HA ARG 248 -32.956 -17.818 -25.404 0.00 0.00 +0.000 HD +ATOM 1212 CB ARG 248 -34.660 -17.078 -26.367 0.00 0.00 +0.000 C +ATOM 1213 HB2 ARG 248 -35.156 -17.940 -26.306 0.00 0.00 +0.000 HD +ATOM 1214 HB3 ARG 248 -35.284 -16.315 -26.218 0.00 0.00 +0.000 HD +ATOM 1215 CG ARG 248 -34.111 -16.956 -27.809 0.00 0.00 +0.000 C +ATOM 1216 HG2 ARG 248 -33.851 -16.014 -27.980 0.00 0.00 +0.000 HD +ATOM 1217 HG3 ARG 248 -33.332 -17.561 -27.913 0.00 0.00 +0.000 HD +ATOM 1218 CD ARG 248 -35.170 -17.358 -28.856 0.00 0.00 +0.000 C +ATOM 1219 HD2 ARG 248 -35.648 -18.160 -28.508 0.00 0.00 +0.000 HD +ATOM 1220 HD3 ARG 248 -35.805 -16.595 -28.949 0.00 0.00 +0.000 HD +ATOM 1221 NE ARG 248 -34.584 -17.668 -30.165 0.00 0.00 +0.000 N +ATOM 1222 HE ARG 248 -34.342 -18.638 -30.345 0.00 0.00 +0.000 HD +ATOM 1223 CZ ARG 248 -34.344 -16.789 -31.132 0.00 0.00 +0.000 C +ATOM 1224 NH1 ARG 248 -34.645 -15.504 -30.966 0.00 0.00 +0.000 N +ATOM 1225 HH11 ARG 248 -35.035 -15.178 -30.109 0.00 0.00 +0.000 HD +ATOM 1226 HH12 ARG 248 -34.475 -14.854 -31.714 0.00 0.00 +0.000 HD +ATOM 1227 NH2 ARG 248 -33.783 -17.199 -32.267 0.00 0.00 +0.000 N +ATOM 1228 HH21 ARG 248 -33.528 -18.161 -32.377 0.00 0.00 +0.000 HD +ATOM 1229 HH22 ARG 248 -33.616 -16.549 -33.006 0.00 0.00 +0.000 HD +ATOM 1230 C ARG 248 -32.810 -15.746 -25.304 0.00 0.00 +0.000 C +ATOM 1231 O ARG 248 -31.688 -15.699 -25.813 0.00 0.00 +0.000 OA +ATOM 1232 N VAL 249 -33.405 -14.683 -24.773 0.00 0.00 +0.000 N +ATOM 1233 H VAL 249 -34.342 -14.858 -24.373 0.00 0.00 +0.000 HD +ATOM 1234 CA VAL 249 -32.753 -13.381 -24.773 0.00 0.00 +0.000 C +ATOM 1235 HA VAL 249 -32.458 -13.175 -25.719 0.00 0.00 +0.000 HD +ATOM 1236 CB VAL 249 -33.716 -12.262 -24.314 0.00 0.00 +0.000 C +ATOM 1237 HB VAL 249 -33.921 -12.417 -23.357 0.00 0.00 +0.000 HD +ATOM 1238 CG1 VAL 249 -33.018 -10.911 -24.410 0.00 0.00 +0.000 C +ATOM 1239 HG11 VAL 249 -32.036 -11.033 -24.272 0.00 0.00 +0.000 HD +ATOM 1240 HG12 VAL 249 -33.181 -10.515 -25.313 0.00 0.00 +0.000 HD +ATOM 1241 HG13 VAL 249 -33.380 -10.298 -23.708 0.00 0.00 +0.000 HD +ATOM 1242 CG2 VAL 249 -34.972 -12.268 -25.166 0.00 0.00 +0.000 C +ATOM 1243 HG21 VAL 249 -34.718 -12.223 -26.133 0.00 0.00 +0.000 HD +ATOM 1244 HG22 VAL 249 -35.486 -13.109 -24.994 0.00 0.00 +0.000 HD +ATOM 1245 HG23 VAL 249 -35.537 -11.476 -24.931 0.00 0.00 +0.000 HD +ATOM 1246 C VAL 249 -31.510 -13.350 -23.882 0.00 0.00 +0.000 C +ATOM 1247 O VAL 249 -30.495 -12.756 -24.245 0.00 0.00 +0.000 OA +ATOM 1248 N MET 250 -31.575 -13.993 -22.717 0.00 0.00 +0.000 N +ATOM 1249 H MET 250 -32.471 -14.450 -22.509 0.00 0.00 +0.000 HD +ATOM 1250 CA MET 250 -30.413 -14.021 -21.817 0.00 0.00 +0.000 C +ATOM 1251 HA MET 250 -30.108 -13.073 -21.675 0.00 0.00 +0.000 HD +ATOM 1252 CB MET 250 -30.767 -14.652 -20.462 0.00 0.00 +0.000 C +ATOM 1253 HB2 MET 250 -31.159 -15.570 -20.623 0.00 0.00 +0.000 HD +ATOM 1254 HB3 MET 250 -29.917 -14.770 -19.927 0.00 0.00 +0.000 HD +ATOM 1255 CG MET 250 -31.756 -13.851 -19.619 0.00 0.00 +0.000 C +ATOM 1256 HG2 MET 250 -31.425 -12.878 -19.564 0.00 0.00 +0.000 HD +ATOM 1257 HG3 MET 250 -32.651 -13.799 -20.124 0.00 0.00 +0.000 HD +ATOM 1258 SD MET 250 -32.022 -14.522 -17.935 0.00 0.00 +0.000 S +ATOM 1259 CE MET 250 -33.303 -15.728 -18.230 0.00 0.00 +0.000 C +ATOM 1260 HE1 MET 250 -33.057 -16.597 -17.796 0.00 0.00 +0.000 HD +ATOM 1261 HE2 MET 250 -34.170 -15.403 -17.847 0.00 0.00 +0.000 HD +ATOM 1262 HE3 MET 250 -33.413 -15.872 -19.216 0.00 0.00 +0.000 HD +ATOM 1263 C MET 250 -29.254 -14.805 -22.431 0.00 0.00 +0.000 C +ATOM 1264 O MET 250 -28.099 -14.462 -22.220 0.00 0.00 +0.000 OA +ATOM 1265 N ILE 251 -29.562 -15.866 -23.169 0.00 0.00 +0.000 N +ATOM 1266 H ILE 251 -30.571 -16.073 -23.244 0.00 0.00 +0.000 HD +ATOM 1267 CA ILE 251 -28.520 -16.659 -23.813 0.00 0.00 +0.000 C +ATOM 1268 HA ILE 251 -27.814 -16.802 -23.131 0.00 0.00 +0.000 HD +ATOM 1269 CB ILE 251 -29.122 -17.962 -24.439 0.00 0.00 +0.000 C +ATOM 1270 HB ILE 251 -29.942 -17.701 -24.933 0.00 0.00 +0.000 HD +ATOM 1271 CG2 ILE 251 -28.130 -18.591 -25.407 0.00 0.00 +0.000 C +ATOM 1272 HG21 ILE 251 -28.544 -19.393 -25.834 0.00 0.00 +0.000 HD +ATOM 1273 HG22 ILE 251 -27.886 -17.928 -26.113 0.00 0.00 +0.000 HD +ATOM 1274 HG23 ILE 251 -27.308 -18.865 -24.911 0.00 0.00 +0.000 HD +ATOM 1275 CG1 ILE 251 -29.514 -18.960 -23.343 0.00 0.00 +0.000 C +ATOM 1276 HG12 ILE 251 -30.052 -18.475 -22.652 0.00 0.00 +0.000 HD +ATOM 1277 HG13 ILE 251 -30.096 -19.664 -23.755 0.00 0.00 +0.000 HD +ATOM 1278 CD1 ILE 251 -28.341 -19.644 -22.658 0.00 0.00 +0.000 C +ATOM 1279 HD11 ILE 251 -27.763 -18.952 -22.230 0.00 0.00 +0.000 HD +ATOM 1280 HD12 ILE 251 -28.688 -20.272 -21.964 0.00 0.00 +0.000 HD +ATOM 1281 HD13 ILE 251 -27.814 -20.150 -23.338 0.00 0.00 +0.000 HD +ATOM 1282 C ILE 251 -27.899 -15.796 -24.909 0.00 0.00 +0.000 C +ATOM 1283 O ILE 251 -26.686 -15.713 -25.061 0.00 0.00 +0.000 OA +ATOM 1284 N HIE 252 -28.766 -15.125 -25.655 0.00 0.00 +0.000 N +ATOM 1285 H HIE 252 -29.766 -15.260 -25.388 0.00 0.00 +0.000 HD +ATOM 1286 CA HIE 252 -28.349 -14.265 -26.763 0.00 0.00 +0.000 C +ATOM 1287 HA HIE 252 -27.828 -14.831 -27.425 0.00 0.00 +0.000 HD +ATOM 1288 CB HIE 252 -29.595 -13.708 -27.470 0.00 0.00 +0.000 C +ATOM 1289 HB2 HIE 252 -30.203 -14.475 -27.706 0.00 0.00 +0.000 HD +ATOM 1290 HB3 HIE 252 -30.083 -13.101 -26.832 0.00 0.00 +0.000 HD +ATOM 1291 CG HIE 252 -29.293 -12.942 -28.716 0.00 0.00 +0.000 A +ATOM 1292 ND1 HIE 252 -28.674 -11.718 -28.707 0.00 0.00 +0.000 NA +ATOM 1293 CE1 HIE 252 -28.569 -11.272 -29.952 0.00 0.00 +0.000 A +ATOM 1294 HE1 HIE 252 -28.162 -10.408 -30.226 0.00 0.00 +0.000 HD +ATOM 1295 NE2 HIE 252 -29.099 -12.171 -30.756 0.00 0.00 +0.000 N +ATOM 1296 HE2 HIE 252 -29.160 -12.100 -31.762 0.00 0.00 +0.000 HD +ATOM 1297 CD2 HIE 252 -29.559 -13.231 -30.011 0.00 0.00 +0.000 A +ATOM 1298 HD2 HIE 252 -30.002 -14.049 -30.359 0.00 0.00 +0.000 HD +ATOM 1299 C HIE 252 -27.455 -13.107 -26.323 0.00 0.00 +0.000 C +ATOM 1300 O HIE 252 -26.403 -12.851 -26.914 0.00 0.00 +0.000 OA +ATOM 1301 N VAL 253 -27.868 -12.431 -25.260 0.00 0.00 +0.000 N +ATOM 1302 H VAL 253 -28.738 -12.802 -24.820 0.00 0.00 +0.000 HD +ATOM 1303 CA VAL 253 -27.155 -11.263 -24.755 0.00 0.00 +0.000 C +ATOM 1304 HA VAL 253 -26.718 -10.791 -25.553 0.00 0.00 +0.000 HD +ATOM 1305 CB VAL 253 -28.172 -10.255 -24.143 0.00 0.00 +0.000 C +ATOM 1306 HB VAL 253 -28.626 -10.716 -23.390 0.00 0.00 +0.000 HD +ATOM 1307 CG1 VAL 253 -27.444 -9.054 -23.567 0.00 0.00 +0.000 C +ATOM 1308 HG11 VAL 253 -26.951 -8.579 -24.296 0.00 0.00 +0.000 HD +ATOM 1309 HG12 VAL 253 -28.105 -8.428 -23.152 0.00 0.00 +0.000 HD +ATOM 1310 HG13 VAL 253 -26.793 -9.358 -22.870 0.00 0.00 +0.000 HD +ATOM 1311 CG2 VAL 253 -29.170 -9.822 -25.214 0.00 0.00 +0.000 C +ATOM 1312 HG21 VAL 253 -29.979 -10.407 -25.164 0.00 0.00 +0.000 HD +ATOM 1313 HG22 VAL 253 -29.430 -8.871 -25.054 0.00 0.00 +0.000 HD +ATOM 1314 HG23 VAL 253 -28.744 -9.910 -26.113 0.00 0.00 +0.000 HD +ATOM 1315 C VAL 253 -26.048 -11.549 -23.730 0.00 0.00 +0.000 C +ATOM 1316 O VAL 253 -24.956 -10.985 -23.811 0.00 0.00 +0.000 OA +ATOM 1317 N PHE 254 -26.328 -12.408 -22.759 0.00 0.00 +0.000 N +ATOM 1318 H PHE 254 -27.266 -12.822 -22.785 0.00 0.00 +0.000 HD +ATOM 1319 CA PHE 254 -25.325 -12.707 -21.744 0.00 0.00 +0.000 C +ATOM 1320 HA PHE 254 -24.774 -11.854 -21.612 0.00 0.00 +0.000 HD +ATOM 1321 CB PHE 254 -25.989 -13.057 -20.407 0.00 0.00 +0.000 C +ATOM 1322 HB2 PHE 254 -26.372 -12.229 -20.033 0.00 0.00 +0.000 HD +ATOM 1323 HB3 PHE 254 -26.683 -13.735 -20.582 0.00 0.00 +0.000 HD +ATOM 1324 CG PHE 254 -25.029 -13.626 -19.389 0.00 0.00 +0.000 A +ATOM 1325 CD1 PHE 254 -24.147 -12.797 -18.690 0.00 0.00 +0.000 A +ATOM 1326 HD1 PHE 254 -24.181 -11.814 -18.825 0.00 0.00 +0.000 HD +ATOM 1327 CE1 PHE 254 -23.221 -13.337 -17.803 0.00 0.00 +0.000 A +ATOM 1328 HE1 PHE 254 -22.601 -12.726 -17.299 0.00 0.00 +0.000 HD +ATOM 1329 CZ PHE 254 -23.155 -14.716 -17.618 0.00 0.00 +0.000 A +ATOM 1330 HZ PHE 254 -22.481 -15.100 -16.991 0.00 0.00 +0.000 HD +ATOM 1331 CE2 PHE 254 -24.029 -15.548 -18.308 0.00 0.00 +0.000 A +ATOM 1332 HE2 PHE 254 -23.994 -16.551 -18.171 0.00 0.00 +0.000 HD +ATOM 1333 CD2 PHE 254 -24.952 -15.006 -19.189 0.00 0.00 +0.000 A +ATOM 1334 HD2 PHE 254 -25.574 -15.609 -19.690 0.00 0.00 +0.000 HD +ATOM 1335 C PHE 254 -24.328 -13.814 -22.100 0.00 0.00 +0.000 C +ATOM 1336 O PHE 254 -23.119 -13.620 -22.006 0.00 0.00 +0.000 OA +ATOM 1337 N SER 255 -24.824 -14.984 -22.489 0.00 0.00 +0.000 N +ATOM 1338 H SER 255 -25.846 -15.043 -22.539 0.00 0.00 +0.000 HD +ATOM 1339 CA SER 255 -23.919 -16.088 -22.814 0.00 0.00 +0.000 C +ATOM 1340 HA SER 255 -23.308 -16.236 -22.009 0.00 0.00 +0.000 HD +ATOM 1341 CB SER 255 -24.706 -17.379 -23.015 0.00 0.00 +0.000 C +ATOM 1342 HB2 SER 255 -25.312 -17.270 -23.792 0.00 0.00 +0.000 HD +ATOM 1343 HB3 SER 255 -24.070 -18.125 -23.165 0.00 0.00 +0.000 HD +ATOM 1344 OG SER 255 -25.481 -17.658 -21.860 0.00 0.00 +0.000 OA +ATOM 1345 HG SER 255 -26.173 -16.947 -21.744 0.00 0.00 +0.000 HD +ATOM 1346 C SER 255 -23.028 -15.853 -24.033 0.00 0.00 +0.000 C +ATOM 1347 O SER 255 -21.872 -16.284 -24.046 0.00 0.00 +0.000 OA +ATOM 1348 N ASP 256 -23.562 -15.187 -25.054 0.00 0.00 +0.000 N +ATOM 1349 H ASP 256 -24.538 -14.876 -24.914 0.00 0.00 +0.000 HD +ATOM 1350 CA ASP 256 -22.796 -14.929 -26.274 0.00 0.00 +0.000 C +ATOM 1351 HA ASP 256 -22.166 -15.700 -26.396 0.00 0.00 +0.000 HD +ATOM 1352 CB ASP 256 -23.747 -14.753 -27.466 0.00 0.00 +0.000 C +ATOM 1353 HB2 ASP 256 -24.491 -15.403 -27.360 0.00 0.00 +0.000 HD +ATOM 1354 HB3 ASP 256 -24.092 -13.822 -27.446 0.00 0.00 +0.000 HD +ATOM 1355 CG ASP 256 -23.067 -14.997 -28.796 0.00 0.00 +0.000 C +ATOM 1356 OD1 ASP 256 -21.899 -15.441 -28.789 0.00 0.00 +0.000 OA +ATOM 1357 OD2 ASP 256 -23.705 -14.759 -29.840 0.00 0.00 +0.000 OA +ATOM 1358 C ASP 256 -21.950 -13.679 -26.100 0.00 0.00 +0.000 C +ATOM 1359 O ASP 256 -22.237 -12.639 -26.691 0.00 0.00 +0.000 OA +ATOM 1360 N GLY 257 -20.903 -13.787 -25.291 0.00 0.00 +0.000 N +ATOM 1361 H GLY 257 -20.767 -14.718 -24.867 0.00 0.00 +0.000 HD +ATOM 1362 CA GLY 257 -20.035 -12.647 -25.048 0.00 0.00 +0.000 C +ATOM 1363 HA2 GLY 257 -19.568 -12.390 -25.896 0.00 0.00 +0.000 HD +ATOM 1364 HA3 GLY 257 -20.579 -11.870 -24.726 0.00 0.00 +0.000 HD +ATOM 1365 C GLY 257 -18.999 -13.009 -23.992 0.00 0.00 +0.000 C +ATOM 1366 O GLY 257 -19.096 -14.059 -23.348 0.00 0.00 +0.000 OA +ATOM 1367 N VAL 258 -18.008 -12.147 -23.794 0.00 0.00 +0.000 N +ATOM 1368 H VAL 258 -18.029 -11.305 -24.384 0.00 0.00 +0.000 HD +ATOM 1369 CA VAL 258 -16.993 -12.427 -22.800 0.00 0.00 +0.000 C +ATOM 1370 HA VAL 258 -16.642 -13.351 -22.958 0.00 0.00 +0.000 HD +ATOM 1371 CB VAL 258 -15.803 -11.420 -22.883 0.00 0.00 +0.000 C +ATOM 1372 HB VAL 258 -16.082 -10.596 -22.417 0.00 0.00 +0.000 HD +ATOM 1373 CG1 VAL 258 -14.611 -11.992 -22.117 0.00 0.00 +0.000 C +ATOM 1374 HG11 VAL 258 -14.588 -12.984 -22.234 0.00 0.00 +0.000 HD +ATOM 1375 HG12 VAL 258 -13.767 -11.593 -22.472 0.00 0.00 +0.000 HD +ATOM 1376 HG13 VAL 258 -14.704 -11.771 -21.147 0.00 0.00 +0.000 HD +ATOM 1377 CG2 VAL 258 -15.418 -11.159 -24.334 0.00 0.00 +0.000 C +ATOM 1378 HG21 VAL 258 -14.941 -11.959 -24.697 0.00 0.00 +0.000 HD +ATOM 1379 HG22 VAL 258 -16.245 -10.989 -24.869 0.00 0.00 +0.000 HD +ATOM 1380 HG23 VAL 258 -14.819 -10.360 -24.377 0.00 0.00 +0.000 HD +ATOM 1381 C VAL 258 -17.632 -12.393 -21.429 0.00 0.00 +0.000 C +ATOM 1382 O VAL 258 -18.617 -11.691 -21.193 0.00 0.00 +0.000 OA +ATOM 1383 N THR 259 -17.055 -13.166 -20.524 0.00 0.00 +0.000 N +ATOM 1384 H THR 259 -16.219 -13.685 -20.861 0.00 0.00 +0.000 HD +ATOM 1385 CA THR 259 -17.570 -13.262 -19.175 0.00 0.00 +0.000 C +ATOM 1386 HA THR 259 -18.481 -12.817 -19.143 0.00 0.00 +0.000 HD +ATOM 1387 CB THR 259 -17.698 -14.742 -18.757 0.00 0.00 +0.000 C +ATOM 1388 HB THR 259 -16.764 -15.138 -18.663 0.00 0.00 +0.000 HD +ATOM 1389 CG2 THR 259 -18.450 -14.851 -17.455 0.00 0.00 +0.000 C +ATOM 1390 HG21 THR 259 -19.421 -14.635 -17.596 0.00 0.00 +0.000 HD +ATOM 1391 HG22 THR 259 -18.377 -15.784 -17.089 0.00 0.00 +0.000 HD +ATOM 1392 HG23 THR 259 -18.072 -14.209 -16.781 0.00 0.00 +0.000 HD +ATOM 1393 OG1 THR 259 -18.391 -15.469 -19.785 0.00 0.00 +0.000 OA +ATOM 1394 HG1 THR 259 -18.425 -14.928 -20.631 0.00 0.00 +0.000 HD +ATOM 1395 C THR 259 -16.670 -12.569 -18.162 0.00 0.00 +0.000 C +ATOM 1396 O THR 259 -15.458 -12.745 -18.180 0.00 0.00 +0.000 OA +ATOM 1397 N ASN 260 -17.278 -11.789 -17.279 0.00 0.00 +0.000 N +ATOM 1398 H ASN 260 -18.307 -11.683 -17.432 0.00 0.00 +0.000 HD +ATOM 1399 CA ASN 260 -16.568 -11.135 -16.186 0.00 0.00 +0.000 C +ATOM 1400 HA ASN 260 -15.902 -11.776 -15.842 0.00 0.00 +0.000 HD +ATOM 1401 CB ASN 260 -15.905 -9.805 -16.602 0.00 0.00 +0.000 C +ATOM 1402 HB2 ASN 260 -15.574 -9.352 -15.775 0.00 0.00 +0.000 HD +ATOM 1403 HB3 ASN 260 -15.133 -10.018 -17.200 0.00 0.00 +0.000 HD +ATOM 1404 CG ASN 260 -16.841 -8.858 -17.334 0.00 0.00 +0.000 C +ATOM 1405 OD1 ASN 260 -17.905 -8.490 -16.837 0.00 0.00 +0.000 OA +ATOM 1406 ND2 ASN 260 -16.428 -8.445 -18.529 0.00 0.00 +0.000 N +ATOM 1407 HD21 ASN 260 -16.996 -7.815 -19.063 0.00 0.00 +0.000 HD +ATOM 1408 HD22 ASN 260 -15.555 -8.760 -18.898 0.00 0.00 +0.000 HD +ATOM 1409 C ASN 260 -17.607 -10.938 -15.098 0.00 0.00 +0.000 C +ATOM 1410 O ASN 260 -18.800 -11.075 -15.362 0.00 0.00 +0.000 OA +ATOM 1411 N TRP 261 -17.170 -10.647 -13.877 0.00 0.00 +0.000 N +ATOM 1412 H TRP 261 -16.152 -10.550 -13.781 0.00 0.00 +0.000 HD +ATOM 1413 CA TRP 261 -18.117 -10.488 -12.788 0.00 0.00 +0.000 C +ATOM 1414 HA TRP 261 -18.642 -11.351 -12.705 0.00 0.00 +0.000 HD +ATOM 1415 CB TRP 261 -17.375 -10.282 -11.458 0.00 0.00 +0.000 C +ATOM 1416 HB2 TRP 261 -16.612 -9.673 -11.604 0.00 0.00 +0.000 HD +ATOM 1417 HB3 TRP 261 -18.005 -9.923 -10.788 0.00 0.00 +0.000 HD +ATOM 1418 CG TRP 261 -16.810 -11.573 -10.890 0.00 0.00 +0.000 A +ATOM 1419 CD1 TRP 261 -15.501 -11.850 -10.618 0.00 0.00 +0.000 A +ATOM 1420 HD1 TRP 261 -14.739 -11.221 -10.750 0.00 0.00 +0.000 HD +ATOM 1421 NE1 TRP 261 -15.379 -13.137 -10.129 0.00 0.00 +0.000 N +ATOM 1422 HE1 TRP 261 -14.522 -13.574 -9.861 0.00 0.00 +0.000 HD +ATOM 1423 CE2 TRP 261 -16.620 -13.712 -10.073 0.00 0.00 +0.000 A +ATOM 1424 CZ2 TRP 261 -17.006 -14.995 -9.651 0.00 0.00 +0.000 A +ATOM 1425 HZ2 TRP 261 -16.315 -15.646 -9.327 0.00 0.00 +0.000 HD +ATOM 1426 CH2 TRP 261 -18.340 -15.306 -9.703 0.00 0.00 +0.000 A +ATOM 1427 HH2 TRP 261 -18.655 -16.207 -9.405 0.00 0.00 +0.000 HD +ATOM 1428 CZ3 TRP 261 -19.289 -14.382 -10.169 0.00 0.00 +0.000 A +ATOM 1429 HZ3 TRP 261 -20.249 -14.631 -10.204 0.00 0.00 +0.000 HD +ATOM 1430 CE3 TRP 261 -18.906 -13.105 -10.590 0.00 0.00 +0.000 A +ATOM 1431 HE3 TRP 261 -19.592 -12.461 -10.911 0.00 0.00 +0.000 HD +ATOM 1432 CD2 TRP 261 -17.549 -12.761 -10.547 0.00 0.00 +0.000 A +ATOM 1433 C TRP 261 -19.123 -9.367 -13.037 0.00 0.00 +0.000 C +ATOM 1434 O TRP 261 -20.273 -9.459 -12.611 0.00 0.00 +0.000 OA +ATOM 1435 N GLY 262 -18.696 -8.325 -13.748 0.00 0.00 +0.000 N +ATOM 1436 H GLY 262 -17.715 -8.379 -14.061 0.00 0.00 +0.000 HD +ATOM 1437 CA GLY 262 -19.586 -7.214 -14.037 0.00 0.00 +0.000 C +ATOM 1438 HA2 GLY 262 -19.918 -6.812 -13.169 0.00 0.00 +0.000 HD +ATOM 1439 HA3 GLY 262 -19.075 -6.492 -14.529 0.00 0.00 +0.000 HD +ATOM 1440 C GLY 262 -20.780 -7.641 -14.877 0.00 0.00 +0.000 C +ATOM 1441 O GLY 262 -21.913 -7.225 -14.620 0.00 0.00 +0.000 OA +ATOM 1442 N ARG 263 -20.539 -8.488 -15.875 0.00 0.00 +0.000 N +ATOM 1443 H ARG 263 -19.560 -8.777 -15.986 0.00 0.00 +0.000 HD +ATOM 1444 CA ARG 263 -21.633 -8.947 -16.729 0.00 0.00 +0.000 C +ATOM 1445 HA ARG 263 -22.156 -8.144 -17.044 0.00 0.00 +0.000 HD +ATOM 1446 CB ARG 263 -21.092 -9.657 -17.976 0.00 0.00 +0.000 C +ATOM 1447 HB2 ARG 263 -20.407 -10.313 -17.688 0.00 0.00 +0.000 HD +ATOM 1448 HB3 ARG 263 -21.848 -10.112 -18.428 0.00 0.00 +0.000 HD +ATOM 1449 CG ARG 263 -20.444 -8.706 -18.979 0.00 0.00 +0.000 C +ATOM 1450 HG2 ARG 263 -21.127 -8.065 -19.323 0.00 0.00 +0.000 HD +ATOM 1451 HG3 ARG 263 -19.704 -8.205 -18.535 0.00 0.00 +0.000 HD +ATOM 1452 CD ARG 263 -19.846 -9.447 -20.189 0.00 0.00 +0.000 C +ATOM 1453 HD2 ARG 263 -19.412 -8.769 -20.774 0.00 0.00 +0.000 HD +ATOM 1454 HD3 ARG 263 -19.170 -10.090 -19.844 0.00 0.00 +0.000 HD +ATOM 1455 NE ARG 263 -20.865 -10.172 -20.953 0.00 0.00 +0.000 N +ATOM 1456 HE ARG 263 -20.922 -11.166 -20.833 0.00 0.00 +0.000 HD +ATOM 1457 CZ ARG 263 -21.712 -9.588 -21.790 0.00 0.00 +0.000 C +ATOM 1458 NH1 ARG 263 -21.642 -8.290 -21.971 0.00 0.00 +0.000 N +ATOM 1459 HH11 ARG 263 -20.961 -7.721 -21.518 0.00 0.00 +0.000 HD +ATOM 1460 HH12 ARG 263 -22.304 -7.837 -22.598 0.00 0.00 +0.000 HD +ATOM 1461 NH2 ARG 263 -22.642 -10.290 -22.413 0.00 0.00 +0.000 N +ATOM 1462 HH21 ARG 263 -22.690 -11.284 -22.261 0.00 0.00 +0.000 HD +ATOM 1463 HH22 ARG 263 -23.288 -9.848 -23.027 0.00 0.00 +0.000 HD +ATOM 1464 C ARG 263 -22.575 -9.876 -15.974 0.00 0.00 +0.000 C +ATOM 1465 O ARG 263 -23.756 -9.949 -16.291 0.00 0.00 +0.000 OA +ATOM 1466 N ILE 264 -22.050 -10.595 -14.985 0.00 0.00 +0.000 N +ATOM 1467 H ILE 264 -21.039 -10.459 -14.830 0.00 0.00 +0.000 HD +ATOM 1468 CA ILE 264 -22.880 -11.500 -14.199 0.00 0.00 +0.000 C +ATOM 1469 HA ILE 264 -23.483 -11.964 -14.843 0.00 0.00 +0.000 HD +ATOM 1470 CB ILE 264 -21.985 -12.465 -13.384 0.00 0.00 +0.000 C +ATOM 1471 HB ILE 264 -21.293 -11.928 -12.933 0.00 0.00 +0.000 HD +ATOM 1472 CG2 ILE 264 -22.805 -13.230 -12.339 0.00 0.00 +0.000 C +ATOM 1473 HG21 ILE 264 -22.199 -13.828 -11.821 0.00 0.00 +0.000 HD +ATOM 1474 HG22 ILE 264 -23.242 -12.579 -11.724 0.00 0.00 +0.000 HD +ATOM 1475 HG23 ILE 264 -23.500 -13.774 -12.802 0.00 0.00 +0.000 HD +ATOM 1476 CG1 ILE 264 -21.291 -13.423 -14.357 0.00 0.00 +0.000 C +ATOM 1477 HG12 ILE 264 -21.995 -13.994 -14.788 0.00 0.00 +0.000 HD +ATOM 1478 HG13 ILE 264 -20.858 -12.872 -15.076 0.00 0.00 +0.000 HD +ATOM 1479 CD1 ILE 264 -20.253 -14.307 -13.729 0.00 0.00 +0.000 C +ATOM 1480 HD11 ILE 264 -20.676 -14.873 -13.020 0.00 0.00 +0.000 HD +ATOM 1481 HD12 ILE 264 -19.848 -14.900 -14.427 0.00 0.00 +0.000 HD +ATOM 1482 HD13 ILE 264 -19.535 -13.744 -13.317 0.00 0.00 +0.000 HD +ATOM 1483 C ILE 264 -23.782 -10.670 -13.282 0.00 0.00 +0.000 C +ATOM 1484 O ILE 264 -24.956 -10.986 -13.084 0.00 0.00 +0.000 OA +ATOM 1485 N VAL 265 -23.231 -9.590 -12.741 0.00 0.00 +0.000 N +ATOM 1486 H VAL 265 -22.236 -9.436 -12.982 0.00 0.00 +0.000 HD +ATOM 1487 CA VAL 265 -23.999 -8.703 -11.874 0.00 0.00 +0.000 C +ATOM 1488 HA VAL 265 -24.442 -9.254 -11.169 0.00 0.00 +0.000 HD +ATOM 1489 CB VAL 265 -23.098 -7.632 -11.234 0.00 0.00 +0.000 C +ATOM 1490 HB VAL 265 -22.575 -7.203 -11.962 0.00 0.00 +0.000 HD +ATOM 1491 CG1 VAL 265 -23.949 -6.547 -10.596 0.00 0.00 +0.000 C +ATOM 1492 HG11 VAL 265 -23.364 -5.926 -10.073 0.00 0.00 +0.000 HD +ATOM 1493 HG12 VAL 265 -24.425 -6.032 -11.309 0.00 0.00 +0.000 HD +ATOM 1494 HG13 VAL 265 -24.621 -6.965 -9.984 0.00 0.00 +0.000 HD +ATOM 1495 CG2 VAL 265 -22.187 -8.274 -10.192 0.00 0.00 +0.000 C +ATOM 1496 HG21 VAL 265 -22.288 -9.267 -10.235 0.00 0.00 +0.000 HD +ATOM 1497 HG22 VAL 265 -21.239 -8.022 -10.385 0.00 0.00 +0.000 HD +ATOM 1498 HG23 VAL 265 -22.446 -7.947 -9.284 0.00 0.00 +0.000 HD +ATOM 1499 C VAL 265 -25.106 -8.024 -12.699 0.00 0.00 +0.000 C +ATOM 1500 O VAL 265 -26.230 -7.866 -12.228 0.00 0.00 +0.000 OA +ATOM 1501 N THR 266 -24.797 -7.645 -13.937 0.00 0.00 +0.000 N +ATOM 1502 H THR 266 -23.827 -7.828 -14.227 0.00 0.00 +0.000 HD +ATOM 1503 CA THR 266 -25.802 -7.015 -14.791 0.00 0.00 +0.000 C +ATOM 1504 HA THR 266 -26.195 -6.237 -14.302 0.00 0.00 +0.000 HD +ATOM 1505 CB THR 266 -25.192 -6.544 -16.125 0.00 0.00 +0.000 C +ATOM 1506 HB THR 266 -24.752 -7.338 -16.584 0.00 0.00 +0.000 HD +ATOM 1507 CG2 THR 266 -26.275 -5.935 -17.034 0.00 0.00 +0.000 C +ATOM 1508 HG21 THR 266 -27.172 -6.277 -16.755 0.00 0.00 +0.000 HD +ATOM 1509 HG22 THR 266 -26.255 -4.939 -16.951 0.00 0.00 +0.000 HD +ATOM 1510 HG23 THR 266 -26.097 -6.196 -17.982 0.00 0.00 +0.000 HD +ATOM 1511 OG1 THR 266 -24.177 -5.563 -15.857 0.00 0.00 +0.000 OA +ATOM 1512 HG1 THR 266 -23.376 -5.998 -15.434 0.00 0.00 +0.000 HD +ATOM 1513 C THR 266 -26.919 -8.016 -15.079 0.00 0.00 +0.000 C +ATOM 1514 O THR 266 -28.102 -7.673 -15.065 0.00 0.00 +0.000 OA +ATOM 1515 N LEU 267 -26.537 -9.259 -15.345 0.00 0.00 +0.000 N +ATOM 1516 H LEU 267 -25.512 -9.412 -15.348 0.00 0.00 +0.000 HD +ATOM 1517 CA LEU 267 -27.511 -10.311 -15.610 0.00 0.00 +0.000 C +ATOM 1518 HA LEU 267 -28.040 -10.063 -16.429 0.00 0.00 +0.000 HD +ATOM 1519 CB LEU 267 -26.791 -11.643 -15.839 0.00 0.00 +0.000 C +ATOM 1520 HB2 LEU 267 -26.350 -11.603 -16.734 0.00 0.00 +0.000 HD +ATOM 1521 HB3 LEU 267 -26.101 -11.745 -15.126 0.00 0.00 +0.000 HD +ATOM 1522 CG LEU 267 -27.658 -12.908 -15.817 0.00 0.00 +0.000 C +ATOM 1523 HG LEU 267 -28.287 -12.856 -15.047 0.00 0.00 +0.000 HD +ATOM 1524 CD1 LEU 267 -28.450 -13.011 -17.114 0.00 0.00 +0.000 C +ATOM 1525 HD11 LEU 267 -27.818 -13.056 -17.888 0.00 0.00 +0.000 HD +ATOM 1526 HD12 LEU 267 -29.014 -13.837 -17.096 0.00 0.00 +0.000 HD +ATOM 1527 HD13 LEU 267 -29.038 -12.208 -17.210 0.00 0.00 +0.000 HD +ATOM 1528 CD2 LEU 267 -26.769 -14.138 -15.637 0.00 0.00 +0.000 C +ATOM 1529 HD21 LEU 267 -26.269 -14.062 -14.775 0.00 0.00 +0.000 HD +ATOM 1530 HD22 LEU 267 -27.339 -14.959 -15.623 0.00 0.00 +0.000 HD +ATOM 1531 HD23 LEU 267 -26.121 -14.192 -16.396 0.00 0.00 +0.000 HD +ATOM 1532 C LEU 267 -28.486 -10.466 -14.440 0.00 0.00 +0.000 C +ATOM 1533 O LEU 267 -29.704 -10.525 -14.630 0.00 0.00 +0.000 OA +ATOM 1534 N ILE 268 -27.937 -10.531 -13.232 0.00 0.00 +0.000 N +ATOM 1535 H ILE 268 -26.899 -10.447 -13.221 0.00 0.00 +0.000 HD +ATOM 1536 CA ILE 268 -28.737 -10.707 -12.023 0.00 0.00 +0.000 C +ATOM 1537 HA ILE 268 -29.429 -11.406 -12.241 0.00 0.00 +0.000 HD +ATOM 1538 CB ILE 268 -27.836 -11.130 -10.830 0.00 0.00 +0.000 C +ATOM 1539 HB ILE 268 -27.096 -10.477 -10.765 0.00 0.00 +0.000 HD +ATOM 1540 CG2 ILE 268 -28.635 -11.125 -9.524 0.00 0.00 +0.000 C +ATOM 1541 HG21 ILE 268 -28.031 -11.365 -8.768 0.00 0.00 +0.000 HD +ATOM 1542 HG22 ILE 268 -29.015 -10.215 -9.374 0.00 0.00 +0.000 HD +ATOM 1543 HG23 ILE 268 -29.374 -11.791 -9.588 0.00 0.00 +0.000 HD +ATOM 1544 CG1 ILE 268 -27.232 -12.514 -11.101 0.00 0.00 +0.000 C +ATOM 1545 HG12 ILE 268 -27.963 -13.193 -11.050 0.00 0.00 +0.000 HD +ATOM 1546 HG13 ILE 268 -26.860 -12.516 -12.029 0.00 0.00 +0.000 HD +ATOM 1547 CD1 ILE 268 -26.127 -12.908 -10.135 0.00 0.00 +0.000 C +ATOM 1548 HD11 ILE 268 -26.492 -12.921 -9.206 0.00 0.00 +0.000 HD +ATOM 1549 HD12 ILE 268 -25.788 -13.815 -10.377 0.00 0.00 +0.000 HD +ATOM 1550 HD13 ILE 268 -25.385 -12.243 -10.197 0.00 0.00 +0.000 HD +ATOM 1551 C ILE 268 -29.503 -9.437 -11.658 0.00 0.00 +0.000 C +ATOM 1552 O ILE 268 -30.666 -9.494 -11.258 0.00 0.00 +0.000 OA +ATOM 1553 N SER 269 -28.850 -8.293 -11.829 0.00 0.00 +0.000 N +ATOM 1554 H SER 269 -27.887 -8.395 -12.209 0.00 0.00 +0.000 HD +ATOM 1555 CA SER 269 -29.452 -7.007 -11.504 0.00 0.00 +0.000 C +ATOM 1556 HA SER 269 -29.763 -7.043 -10.539 0.00 0.00 +0.000 HD +ATOM 1557 CB SER 269 -28.413 -5.898 -11.641 0.00 0.00 +0.000 C +ATOM 1558 HB2 SER 269 -28.046 -5.913 -12.562 0.00 0.00 +0.000 HD +ATOM 1559 HB3 SER 269 -28.846 -5.026 -11.449 0.00 0.00 +0.000 HD +ATOM 1560 OG SER 269 -27.359 -6.104 -10.719 0.00 0.00 +0.000 OA +ATOM 1561 HG SER 269 -26.715 -6.772 -11.091 0.00 0.00 +0.000 HD +ATOM 1562 C SER 269 -30.657 -6.687 -12.371 0.00 0.00 +0.000 C +ATOM 1563 O SER 269 -31.663 -6.161 -11.887 0.00 0.00 +0.000 OA +ATOM 1564 N PHE 270 -30.554 -6.970 -13.660 0.00 0.00 +0.000 N +ATOM 1565 H PHE 270 -29.662 -7.363 -13.966 0.00 0.00 +0.000 HD +ATOM 1566 CA PHE 270 -31.685 -6.709 -14.524 0.00 0.00 +0.000 C +ATOM 1567 HA PHE 270 -32.057 -5.822 -14.269 0.00 0.00 +0.000 HD +ATOM 1568 CB PHE 270 -31.292 -6.802 -16.000 0.00 0.00 +0.000 C +ATOM 1569 HB2 PHE 270 -30.548 -6.174 -16.155 0.00 0.00 +0.000 HD +ATOM 1570 HB3 PHE 270 -31.029 -7.734 -16.185 0.00 0.00 +0.000 HD +ATOM 1571 CG PHE 270 -32.412 -6.439 -16.935 0.00 0.00 +0.000 A +ATOM 1572 CD1 PHE 270 -32.845 -5.119 -17.043 0.00 0.00 +0.000 A +ATOM 1573 HD1 PHE 270 -32.389 -4.402 -16.529 0.00 0.00 +0.000 HD +ATOM 1574 CE1 PHE 270 -33.919 -4.787 -17.873 0.00 0.00 +0.000 A +ATOM 1575 HE1 PHE 270 -34.218 -3.831 -17.935 0.00 0.00 +0.000 HD +ATOM 1576 CZ PHE 270 -34.560 -5.781 -18.600 0.00 0.00 +0.000 A +ATOM 1577 HZ PHE 270 -35.328 -5.548 -19.194 0.00 0.00 +0.000 HD +ATOM 1578 CE2 PHE 270 -34.130 -7.102 -18.499 0.00 0.00 +0.000 A +ATOM 1579 HE2 PHE 270 -34.593 -7.831 -19.025 0.00 0.00 +0.000 HD +ATOM 1580 CD2 PHE 270 -33.062 -7.419 -17.670 0.00 0.00 +0.000 A +ATOM 1581 HD2 PHE 270 -32.756 -8.372 -17.603 0.00 0.00 +0.000 HD +ATOM 1582 C PHE 270 -32.759 -7.742 -14.201 0.00 0.00 +0.000 C +ATOM 1583 O PHE 270 -33.948 -7.482 -14.363 0.00 0.00 +0.000 OA +ATOM 1584 N GLY 271 -32.330 -8.919 -13.752 0.00 0.00 +0.000 N +ATOM 1585 H GLY 271 -31.308 -9.025 -13.696 0.00 0.00 +0.000 HD +ATOM 1586 CA GLY 271 -33.283 -9.951 -13.379 0.00 0.00 +0.000 C +ATOM 1587 HA2 GLY 271 -33.873 -10.163 -14.156 0.00 0.00 +0.000 HD +ATOM 1588 HA3 GLY 271 -32.796 -10.774 -13.093 0.00 0.00 +0.000 HD +ATOM 1589 C GLY 271 -34.130 -9.437 -12.226 0.00 0.00 +0.000 C +ATOM 1590 O GLY 271 -35.335 -9.677 -12.173 0.00 0.00 +0.000 OA +ATOM 1591 N ALA 272 -33.489 -8.730 -11.298 0.00 0.00 +0.000 N +ATOM 1592 H ALA 272 -32.467 -8.624 -11.461 0.00 0.00 +0.000 HD +ATOM 1593 CA ALA 272 -34.182 -8.156 -10.149 0.00 0.00 +0.000 C +ATOM 1594 HA ALA 272 -34.733 -8.872 -9.712 0.00 0.00 +0.000 HD +ATOM 1595 CB ALA 272 -33.182 -7.617 -9.146 0.00 0.00 +0.000 C +ATOM 1596 HB1 ALA 272 -32.392 -8.229 -9.095 0.00 0.00 +0.000 HD +ATOM 1597 HB2 ALA 272 -32.876 -6.707 -9.430 0.00 0.00 +0.000 HD +ATOM 1598 HB3 ALA 272 -33.610 -7.555 -8.243 0.00 0.00 +0.000 HD +ATOM 1599 C ALA 272 -35.109 -7.037 -10.606 0.00 0.00 +0.000 C +ATOM 1600 O ALA 272 -36.184 -6.845 -10.039 0.00 0.00 +0.000 OA +ATOM 1601 N PHE 273 -34.682 -6.304 -11.634 0.00 0.00 +0.000 N +ATOM 1602 H PHE 273 -33.748 -6.581 -12.004 0.00 0.00 +0.000 HD +ATOM 1603 CA PHE 273 -35.467 -5.203 -12.191 0.00 0.00 +0.000 C +ATOM 1604 HA PHE 273 -35.743 -4.625 -11.428 0.00 0.00 +0.000 HD +ATOM 1605 CB PHE 273 -34.648 -4.478 -13.270 0.00 0.00 +0.000 C +ATOM 1606 HB2 PHE 273 -33.740 -4.323 -12.905 0.00 0.00 +0.000 HD +ATOM 1607 HB3 PHE 273 -34.614 -5.066 -14.067 0.00 0.00 +0.000 HD +ATOM 1608 CG PHE 273 -35.212 -3.149 -13.695 0.00 0.00 +0.000 A +ATOM 1609 CD1 PHE 273 -35.122 -2.036 -12.863 0.00 0.00 +0.000 A +ATOM 1610 HD1 PHE 273 -34.711 -2.117 -11.963 0.00 0.00 +0.000 HD +ATOM 1611 CE1 PHE 273 -35.607 -0.788 -13.281 0.00 0.00 +0.000 A +ATOM 1612 HE1 PHE 273 -35.534 0.000 -12.666 0.00 0.00 +0.000 HD +ATOM 1613 CZ PHE 273 -36.184 -0.659 -14.540 0.00 0.00 +0.000 A +ATOM 1614 HZ PHE 273 -36.527 0.227 -14.843 0.00 0.00 +0.000 HD +ATOM 1615 CE2 PHE 273 -36.279 -1.772 -15.373 0.00 0.00 +0.000 A +ATOM 1616 HE2 PHE 273 -36.701 -1.687 -16.289 0.00 0.00 +0.000 HD +ATOM 1617 CD2 PHE 273 -35.796 -3.002 -14.947 0.00 0.00 +0.000 A +ATOM 1618 HD2 PHE 273 -35.869 -3.797 -15.553 0.00 0.00 +0.000 HD +ATOM 1619 C PHE 273 -36.748 -5.778 -12.794 0.00 0.00 +0.000 C +ATOM 1620 O PHE 273 -37.816 -5.187 -12.683 0.00 0.00 +0.000 OA +ATOM 1621 N VAL 274 -36.633 -6.931 -13.447 0.00 0.00 +0.000 N +ATOM 1622 H VAL 274 -35.676 -7.316 -13.494 0.00 0.00 +0.000 HD +ATOM 1623 CA VAL 274 -37.798 -7.571 -14.039 0.00 0.00 +0.000 C +ATOM 1624 HA VAL 274 -38.326 -6.879 -14.527 0.00 0.00 +0.000 HD +ATOM 1625 CB VAL 274 -37.387 -8.720 -14.996 0.00 0.00 +0.000 C +ATOM 1626 HB VAL 274 -36.832 -9.358 -14.475 0.00 0.00 +0.000 HD +ATOM 1627 CG1 VAL 274 -38.619 -9.480 -15.471 0.00 0.00 +0.000 C +ATOM 1628 HG11 VAL 274 -38.340 -10.211 -16.093 0.00 0.00 +0.000 HD +ATOM 1629 HG12 VAL 274 -39.091 -9.875 -14.683 0.00 0.00 +0.000 HD +ATOM 1630 HG13 VAL 274 -39.234 -8.853 -15.948 0.00 0.00 +0.000 HD +ATOM 1631 CG2 VAL 274 -36.637 -8.154 -16.194 0.00 0.00 +0.000 C +ATOM 1632 HG21 VAL 274 -36.840 -7.179 -16.279 0.00 0.00 +0.000 HD +ATOM 1633 HG22 VAL 274 -35.655 -8.283 -16.059 0.00 0.00 +0.000 HD +ATOM 1634 HG23 VAL 274 -36.929 -8.632 -17.022 0.00 0.00 +0.000 HD +ATOM 1635 C VAL 274 -38.679 -8.128 -12.918 0.00 0.00 +0.000 C +ATOM 1636 O VAL 274 -39.900 -8.053 -12.989 0.00 0.00 +0.000 OA +ATOM 1637 N ALA 275 -38.051 -8.685 -11.885 0.00 0.00 +0.000 N +ATOM 1638 H ALA 275 -37.017 -8.693 -11.956 0.00 0.00 +0.000 HD +ATOM 1639 CA ALA 275 -38.788 -9.234 -10.754 0.00 0.00 +0.000 C +ATOM 1640 HA ALA 275 -39.379 -9.977 -11.078 0.00 0.00 +0.000 HD +ATOM 1641 CB ALA 275 -37.819 -9.798 -9.703 0.00 0.00 +0.000 C +ATOM 1642 HB1 ALA 275 -38.106 -9.494 -8.798 0.00 0.00 +0.000 HD +ATOM 1643 HB2 ALA 275 -37.834 -10.794 -9.746 0.00 0.00 +0.000 HD +ATOM 1644 HB3 ALA 275 -36.899 -9.465 -9.895 0.00 0.00 +0.000 HD +ATOM 1645 C ALA 275 -39.671 -8.149 -10.132 0.00 0.00 +0.000 C +ATOM 1646 O ALA 275 -40.813 -8.413 -9.743 0.00 0.00 +0.000 OA +ATOM 1647 N LYS 276 -39.140 -6.933 -10.027 0.00 0.00 +0.000 N +ATOM 1648 H LYS 276 -38.168 -6.846 -10.365 0.00 0.00 +0.000 HD +ATOM 1649 CA LYS 276 -39.909 -5.821 -9.467 0.00 0.00 +0.000 C +ATOM 1650 HA LYS 276 -40.239 -6.082 -8.559 0.00 0.00 +0.000 HD +ATOM 1651 CB LYS 276 -39.056 -4.558 -9.365 0.00 0.00 +0.000 C +ATOM 1652 HB2 LYS 276 -38.563 -4.446 -10.230 0.00 0.00 +0.000 HD +ATOM 1653 HB3 LYS 276 -39.672 -3.778 -9.236 0.00 0.00 +0.000 HD +ATOM 1654 CG LYS 276 -38.051 -4.567 -8.238 0.00 0.00 +0.000 C +ATOM 1655 HG2 LYS 276 -38.533 -4.481 -7.367 0.00 0.00 +0.000 HD +ATOM 1656 HG3 LYS 276 -37.542 -5.425 -8.258 0.00 0.00 +0.000 HD +ATOM 1657 CD LYS 276 -37.085 -3.417 -8.382 0.00 0.00 +0.000 C +ATOM 1658 HD2 LYS 276 -36.546 -3.546 -9.210 0.00 0.00 +0.000 HD +ATOM 1659 HD3 LYS 276 -37.597 -2.565 -8.435 0.00 0.00 +0.000 HD +ATOM 1660 CE LYS 276 -36.143 -3.341 -7.200 0.00 0.00 +0.000 C +ATOM 1661 HE2 LYS 276 -36.662 -3.100 -6.384 0.00 0.00 +0.000 HD +ATOM 1662 HE3 LYS 276 -35.705 -4.228 -7.074 0.00 0.00 +0.000 HD +ATOM 1663 NZ LYS 276 -35.107 -2.311 -7.446 0.00 0.00 +0.000 N +ATOM 1664 HZ1 LYS 276 -35.246 -1.905 -8.350 0.00 0.00 +0.000 HD +ATOM 1665 HZ2 LYS 276 -35.172 -1.597 -6.748 0.00 0.00 +0.000 HD +ATOM 1666 HZ3 LYS 276 -34.200 -2.732 -7.407 0.00 0.00 +0.000 HD +ATOM 1667 C LYS 276 -41.100 -5.536 -10.363 0.00 0.00 +0.000 C +ATOM 1668 O LYS 276 -42.215 -5.319 -9.885 0.00 0.00 +0.000 OA +ATOM 1669 N HIE 277 -40.853 -5.525 -11.670 0.00 0.00 +0.000 N +ATOM 1670 H HIE 277 -39.863 -5.706 -11.927 0.00 0.00 +0.000 HD +ATOM 1671 CA HIE 277 -41.905 -5.277 -12.645 0.00 0.00 +0.000 C +ATOM 1672 HA HIE 277 -42.322 -4.384 -12.449 0.00 0.00 +0.000 HD +ATOM 1673 CB HIE 277 -41.314 -5.289 -14.054 0.00 0.00 +0.000 C +ATOM 1674 HB2 HIE 277 -40.784 -4.446 -14.194 0.00 0.00 +0.000 HD +ATOM 1675 HB3 HIE 277 -40.693 -6.075 -14.141 0.00 0.00 +0.000 HD +ATOM 1676 CG HIE 277 -42.344 -5.382 -15.135 0.00 0.00 +0.000 A +ATOM 1677 ND1 HIE 277 -43.132 -4.316 -15.507 0.00 0.00 +0.000 NA +ATOM 1678 CE1 HIE 277 -43.967 -4.701 -16.457 0.00 0.00 +0.000 A +ATOM 1679 HE1 HIE 277 -44.647 -4.126 -16.903 0.00 0.00 +0.000 HD +ATOM 1680 NE2 HIE 277 -43.748 -5.977 -16.712 0.00 0.00 +0.000 N +ATOM 1681 HE2 HIE 277 -44.239 -6.529 -17.389 0.00 0.00 +0.000 HD +ATOM 1682 CD2 HIE 277 -42.735 -6.427 -15.899 0.00 0.00 +0.000 A +ATOM 1683 HD2 HIE 277 -42.362 -7.350 -15.878 0.00 0.00 +0.000 HD +ATOM 1684 C HIE 277 -43.002 -6.344 -12.545 0.00 0.00 +0.000 C +ATOM 1685 O HIE 277 -44.191 -6.039 -12.682 0.00 0.00 +0.000 OA +ATOM 1686 N LEU 278 -42.592 -7.592 -12.312 0.00 0.00 +0.000 N +ATOM 1687 H LEU 278 -41.560 -7.698 -12.221 0.00 0.00 +0.000 HD +ATOM 1688 CA LEU 278 -43.526 -8.711 -12.196 0.00 0.00 +0.000 C +ATOM 1689 HA LEU 278 -44.096 -8.740 -13.030 0.00 0.00 +0.000 HD +ATOM 1690 CB LEU 278 -42.762 -10.033 -12.087 0.00 0.00 +0.000 C +ATOM 1691 HB2 LEU 278 -42.036 -9.911 -11.434 0.00 0.00 +0.000 HD +ATOM 1692 HB3 LEU 278 -43.398 -10.730 -11.812 0.00 0.00 +0.000 HD +ATOM 1693 CG LEU 278 -42.133 -10.470 -13.405 0.00 0.00 +0.000 C +ATOM 1694 HG LEU 278 -41.482 -9.772 -13.703 0.00 0.00 +0.000 HD +ATOM 1695 CD1 LEU 278 -41.411 -11.794 -13.236 0.00 0.00 +0.000 C +ATOM 1696 HD11 LEU 278 -42.060 -12.496 -12.939 0.00 0.00 +0.000 HD +ATOM 1697 HD12 LEU 278 -41.003 -12.069 -14.108 0.00 0.00 +0.000 HD +ATOM 1698 HD13 LEU 278 -40.689 -11.698 -12.549 0.00 0.00 +0.000 HD +ATOM 1699 CD2 LEU 278 -43.222 -10.602 -14.452 0.00 0.00 +0.000 C +ATOM 1700 HD21 LEU 278 -43.681 -9.720 -14.575 0.00 0.00 +0.000 HD +ATOM 1701 HD22 LEU 278 -42.819 -10.889 -15.323 0.00 0.00 +0.000 HD +ATOM 1702 HD23 LEU 278 -43.893 -11.285 -14.157 0.00 0.00 +0.000 HD +ATOM 1703 C LEU 278 -44.450 -8.569 -10.989 0.00 0.00 +0.000 C +ATOM 1704 O LEU 278 -45.623 -8.954 -11.051 0.00 0.00 +0.000 OA +ATOM 1705 N LYS 279 -43.920 -8.030 -9.896 0.00 0.00 +0.000 N +ATOM 1706 H LYS 279 -42.923 -7.764 -9.975 0.00 0.00 +0.000 HD +ATOM 1707 CA LYS 279 -44.715 -7.840 -8.686 0.00 0.00 +0.000 C +ATOM 1708 HA LYS 279 -45.225 -8.680 -8.498 0.00 0.00 +0.000 HD +ATOM 1709 CB LYS 279 -43.805 -7.482 -7.512 0.00 0.00 +0.000 C +ATOM 1710 HB2 LYS 279 -43.176 -8.246 -7.362 0.00 0.00 +0.000 HD +ATOM 1711 HB3 LYS 279 -43.279 -6.667 -7.764 0.00 0.00 +0.000 HD +ATOM 1712 CG LYS 279 -44.532 -7.200 -6.214 0.00 0.00 +0.000 C +ATOM 1713 HG2 LYS 279 -43.874 -6.876 -5.534 0.00 0.00 +0.000 HD +ATOM 1714 HG3 LYS 279 -45.224 -6.497 -6.372 0.00 0.00 +0.000 HD +ATOM 1715 CD LYS 279 -45.207 -8.448 -5.691 0.00 0.00 +0.000 C +ATOM 1716 HD2 LYS 279 -45.969 -8.688 -6.296 0.00 0.00 +0.000 HD +ATOM 1717 HD3 LYS 279 -44.546 -9.201 -5.681 0.00 0.00 +0.000 HD +ATOM 1718 CE LYS 279 -45.763 -8.288 -4.271 0.00 0.00 +0.000 C +ATOM 1719 HE2 LYS 279 -46.090 -9.184 -3.949 0.00 0.00 +0.000 HD +ATOM 1720 HE3 LYS 279 -45.018 -7.987 -3.664 0.00 0.00 +0.000 HD +ATOM 1721 NZ LYS 279 -46.892 -7.298 -4.182 0.00 0.00 +0.000 N +ATOM 1722 HZ1 LYS 279 -47.093 -6.953 -5.096 0.00 0.00 +0.000 HD +ATOM 1723 HZ2 LYS 279 -47.694 -7.755 -3.806 0.00 0.00 +0.000 HD +ATOM 1724 HZ3 LYS 279 -46.618 -6.547 -3.586 0.00 0.00 +0.000 HD +ATOM 1725 C LYS 279 -45.696 -6.706 -8.913 0.00 0.00 +0.000 C +ATOM 1726 O LYS 279 -46.876 -6.795 -8.559 0.00 0.00 +0.000 OA +ATOM 1727 N THR 280 -45.177 -5.634 -9.503 0.00 0.00 +0.000 N +ATOM 1728 H THR 280 -44.158 -5.730 -9.741 0.00 0.00 +0.000 HD +ATOM 1729 CA THR 280 -45.943 -4.432 -9.797 0.00 0.00 +0.000 C +ATOM 1730 HA THR 280 -46.245 -4.020 -8.924 0.00 0.00 +0.000 HD +ATOM 1731 CB THR 280 -45.039 -3.414 -10.528 0.00 0.00 +0.000 C +ATOM 1732 HB THR 280 -44.638 -3.862 -11.348 0.00 0.00 +0.000 HD +ATOM 1733 CG2 THR 280 -45.819 -2.186 -10.931 0.00 0.00 +0.000 C +ATOM 1734 HG21 THR 280 -46.797 -2.404 -10.999 0.00 0.00 +0.000 HD +ATOM 1735 HG22 THR 280 -45.696 -1.459 -10.249 0.00 0.00 +0.000 HD +ATOM 1736 HG23 THR 280 -45.500 -1.850 -11.822 0.00 0.00 +0.000 HD +ATOM 1737 OG1 THR 280 -43.962 -3.031 -9.655 0.00 0.00 +0.000 OA +ATOM 1738 HG1 THR 280 -43.250 -3.740 -9.651 0.00 0.00 +0.000 HD +ATOM 1739 C THR 280 -47.187 -4.732 -10.634 0.00 0.00 +0.000 C +ATOM 1740 O THR 280 -48.260 -4.173 -10.379 0.00 0.00 +0.000 OA +ATOM 1741 N ILE 281 -47.040 -5.618 -11.619 0.00 0.00 +0.000 N +ATOM 1742 H ILE 281 -46.090 -6.016 -11.711 0.00 0.00 +0.000 HD +ATOM 1743 CA ILE 281 -48.158 -5.979 -12.487 0.00 0.00 +0.000 C +ATOM 1744 HA ILE 281 -48.818 -5.212 -12.429 0.00 0.00 +0.000 HD +ATOM 1745 CB ILE 281 -47.723 -6.197 -13.963 0.00 0.00 +0.000 C +ATOM 1746 HB ILE 281 -48.546 -6.348 -14.500 0.00 0.00 +0.000 HD +ATOM 1747 CG2 ILE 281 -46.986 -4.959 -14.477 0.00 0.00 +0.000 C +ATOM 1748 HG21 ILE 281 -46.747 -5.092 -15.436 0.00 0.00 +0.000 HD +ATOM 1749 HG22 ILE 281 -47.578 -4.162 -14.387 0.00 0.00 +0.000 HD +ATOM 1750 HG23 ILE 281 -46.156 -4.823 -13.941 0.00 0.00 +0.000 HD +ATOM 1751 CG1 ILE 281 -46.832 -7.434 -14.092 0.00 0.00 +0.000 C +ATOM 1752 HG12 ILE 281 -45.954 -7.234 -13.667 0.00 0.00 +0.000 HD +ATOM 1753 HG13 ILE 281 -47.268 -8.183 -13.599 0.00 0.00 +0.000 HD +ATOM 1754 CD1 ILE 281 -46.609 -7.851 -15.520 0.00 0.00 +0.000 C +ATOM 1755 HD11 ILE 281 -46.168 -7.106 -16.022 0.00 0.00 +0.000 HD +ATOM 1756 HD12 ILE 281 -46.022 -8.661 -15.545 0.00 0.00 +0.000 HD +ATOM 1757 HD13 ILE 281 -47.488 -8.065 -15.948 0.00 0.00 +0.000 HD +ATOM 1758 C ILE 281 -48.899 -7.226 -12.028 0.00 0.00 +0.000 C +ATOM 1759 O ILE 281 -49.607 -7.858 -12.817 0.00 0.00 +0.000 OA +ATOM 1760 N ASN 282 -48.731 -7.578 -10.754 0.00 0.00 +0.000 N +ATOM 1761 H ASN 282 -48.101 -6.948 -10.211 0.00 0.00 +0.000 HD +ATOM 1762 CA ASN 282 -49.380 -8.755 -10.167 0.00 0.00 +0.000 C +ATOM 1763 HA ASN 282 -49.008 -8.849 -9.211 0.00 0.00 +0.000 HD +ATOM 1764 CB ASN 282 -50.877 -8.523 -9.987 0.00 0.00 +0.000 C +ATOM 1765 HB2 ASN 282 -51.158 -7.797 -10.605 0.00 0.00 +0.000 HD +ATOM 1766 HB3 ASN 282 -51.352 -9.369 -10.204 0.00 0.00 +0.000 HD +ATOM 1767 CG ASN 282 -51.208 -8.122 -8.579 0.00 0.00 +0.000 C +ATOM 1768 OD1 ASN 282 -51.177 -6.936 -8.252 0.00 0.00 +0.000 OA +ATOM 1769 ND2 ASN 282 -51.493 -9.099 -7.724 0.00 0.00 +0.000 N +ATOM 1770 HD21 ASN 282 -51.725 -8.889 -6.778 0.00 0.00 +0.000 HD +ATOM 1771 HD22 ASN 282 -51.472 -10.051 -8.039 0.00 0.00 +0.000 HD +ATOM 1772 C ASN 282 -49.157 -10.096 -10.859 0.00 0.00 +0.000 C +ATOM 1773 O ASN 282 -50.109 -10.831 -11.162 0.00 0.00 +0.000 OA +ATOM 1774 N GLN 283 -47.888 -10.398 -11.128 0.00 0.00 +0.000 N +ATOM 1775 H GLN 283 -47.203 -9.656 -10.878 0.00 0.00 +0.000 HD +ATOM 1776 CA GLN 283 -47.501 -11.677 -11.728 0.00 0.00 +0.000 C +ATOM 1777 HA GLN 283 -48.270 -12.287 -11.668 0.00 0.00 +0.000 HD +ATOM 1778 CB GLN 283 -46.992 -11.472 -13.156 0.00 0.00 +0.000 C +ATOM 1779 HB2 GLN 283 -46.424 -10.653 -13.183 0.00 0.00 +0.000 HD +ATOM 1780 HB3 GLN 283 -46.453 -12.268 -13.425 0.00 0.00 +0.000 HD +ATOM 1781 CG GLN 283 -48.118 -11.299 -14.177 0.00 0.00 +0.000 C +ATOM 1782 HG2 GLN 283 -48.852 -10.767 -13.754 0.00 0.00 +0.000 HD +ATOM 1783 HG3 GLN 283 -47.758 -10.800 -14.966 0.00 0.00 +0.000 HD +ATOM 1784 CD GLN 283 -48.696 -12.621 -14.661 0.00 0.00 +0.000 C +ATOM 1785 OE1 GLN 283 -48.563 -13.663 -14.011 0.00 0.00 +0.000 OA +ATOM 1786 NE2 GLN 283 -49.364 -12.576 -15.803 0.00 0.00 +0.000 N +ATOM 1787 HE21 GLN 283 -49.771 -13.424 -16.202 0.00 0.00 +0.000 HD +ATOM 1788 HE22 GLN 283 -49.470 -11.685 -16.282 0.00 0.00 +0.000 HD +ATOM 1789 C GLN 283 -46.402 -12.207 -10.825 0.00 0.00 +0.000 C +ATOM 1790 O GLN 283 -45.402 -12.743 -11.289 0.00 0.00 +0.000 OA +ATOM 1791 N GLU 284 -46.614 -12.047 -9.522 0.00 0.00 +0.000 N +ATOM 1792 H GLU 284 -47.524 -11.591 -9.286 0.00 0.00 +0.000 HD +ATOM 1793 CA GLU 284 -45.653 -12.474 -8.508 0.00 0.00 +0.000 C +ATOM 1794 HA GLU 284 -44.825 -11.868 -8.554 0.00 0.00 +0.000 HD +ATOM 1795 CB GLU 284 -46.227 -12.220 -7.116 0.00 0.00 +0.000 C +ATOM 1796 HB2 GLU 284 -46.836 -11.454 -7.181 0.00 0.00 +0.000 HD +ATOM 1797 HB3 GLU 284 -46.681 -13.040 -6.827 0.00 0.00 +0.000 HD +ATOM 1798 CG GLU 284 -45.167 -11.889 -6.099 0.00 0.00 +0.000 C +ATOM 1799 HG2 GLU 284 -44.517 -12.628 -6.074 0.00 0.00 +0.000 HD +ATOM 1800 HG3 GLU 284 -44.746 -11.036 -6.351 0.00 0.00 +0.000 HD +ATOM 1801 CD GLU 284 -45.729 -11.727 -4.711 0.00 0.00 +0.000 C +ATOM 1802 OE1 GLU 284 -46.883 -11.254 -4.595 0.00 0.00 +0.000 OA +ATOM 1803 OE2 GLU 284 -45.005 -12.055 -3.750 0.00 0.00 +0.000 OA +ATOM 1804 C GLU 284 -45.204 -13.933 -8.594 0.00 0.00 +0.000 C +ATOM 1805 O GLU 284 -44.051 -14.254 -8.288 0.00 0.00 +0.000 OA +ATOM 1806 N SER 285 -46.099 -14.826 -9.001 0.00 0.00 +0.000 N +ATOM 1807 H SER 285 -47.022 -14.453 -9.249 0.00 0.00 +0.000 HD +ATOM 1808 CA SER 285 -45.736 -16.237 -9.071 0.00 0.00 +0.000 C +ATOM 1809 HA SER 285 -45.328 -16.499 -8.178 0.00 0.00 +0.000 HD +ATOM 1810 CB SER 285 -46.978 -17.107 -9.289 0.00 0.00 +0.000 C +ATOM 1811 HB2 SER 285 -46.721 -18.065 -9.180 0.00 0.00 +0.000 HD +ATOM 1812 HB3 SER 285 -47.664 -16.861 -8.607 0.00 0.00 +0.000 HD +ATOM 1813 OG SER 285 -47.529 -16.922 -10.583 0.00 0.00 +0.000 OA +ATOM 1814 HG SER 285 -48.009 -16.047 -10.618 0.00 0.00 +0.000 HD +ATOM 1815 C SER 285 -44.711 -16.547 -10.158 0.00 0.00 +0.000 C +ATOM 1816 O SER 285 -44.196 -17.662 -10.224 0.00 0.00 +0.000 OA +ATOM 1817 N CYS 286 -44.415 -15.567 -11.006 0.00 0.00 +0.000 N +ATOM 1818 H CYS 286 -44.905 -14.674 -10.836 0.00 0.00 +0.000 HD +ATOM 1819 CA CYS 286 -43.460 -15.778 -12.088 0.00 0.00 +0.000 C +ATOM 1820 HA CYS 286 -43.531 -16.747 -12.387 0.00 0.00 +0.000 HD +ATOM 1821 CB CYS 286 -43.816 -14.888 -13.282 0.00 0.00 +0.000 C +ATOM 1822 HB2 CYS 286 -43.878 -13.941 -12.951 0.00 0.00 +0.000 HD +ATOM 1823 HB3 CYS 286 -43.062 -14.947 -13.944 0.00 0.00 +0.000 HD +ATOM 1824 SG CYS 286 -45.353 -15.297 -14.132 0.00 0.00 +0.000 S +ATOM 1825 HG CYS 286 -45.691 -14.491 -14.619 0.00 0.00 +0.000 HD +ATOM 1826 C CYS 286 -42.018 -15.518 -11.677 0.00 0.00 +0.000 C +ATOM 1827 O CYS 286 -41.087 -15.868 -12.400 0.00 0.00 +0.000 OA +ATOM 1828 N ILE 287 -41.841 -14.909 -10.510 0.00 0.00 +0.000 N +ATOM 1829 H ILE 287 -42.715 -14.693 -9.994 0.00 0.00 +0.000 HD +ATOM 1830 CA ILE 287 -40.513 -14.583 -10.019 0.00 0.00 +0.000 C +ATOM 1831 HA ILE 287 -40.056 -14.056 -10.766 0.00 0.00 +0.000 HD +ATOM 1832 CB ILE 287 -40.600 -13.656 -8.774 0.00 0.00 +0.000 C +ATOM 1833 HB ILE 287 -41.148 -14.114 -8.094 0.00 0.00 +0.000 HD +ATOM 1834 CG2 ILE 287 -39.195 -13.338 -8.249 0.00 0.00 +0.000 C +ATOM 1835 HG21 ILE 287 -39.270 -12.748 -7.449 0.00 0.00 +0.000 HD +ATOM 1836 HG22 ILE 287 -38.738 -14.188 -7.999 0.00 0.00 +0.000 HD +ATOM 1837 HG23 ILE 287 -38.676 -12.874 -8.962 0.00 0.00 +0.000 HD +ATOM 1838 CG1 ILE 287 -41.317 -12.348 -9.164 0.00 0.00 +0.000 C +ATOM 1839 HG12 ILE 287 -40.728 -11.846 -9.800 0.00 0.00 +0.000 HD +ATOM 1840 HG13 ILE 287 -42.162 -12.590 -9.647 0.00 0.00 +0.000 HD +ATOM 1841 CD1 ILE 287 -41.672 -11.434 -7.997 0.00 0.00 +0.000 C +ATOM 1842 HD11 ILE 287 -40.835 -11.174 -7.521 0.00 0.00 +0.000 HD +ATOM 1843 HD12 ILE 287 -42.129 -10.620 -8.348 0.00 0.00 +0.000 HD +ATOM 1844 HD13 ILE 287 -42.279 -11.922 -7.374 0.00 0.00 +0.000 HD +ATOM 1845 C ILE 287 -39.618 -15.775 -9.723 0.00 0.00 +0.000 C +ATOM 1846 O ILE 287 -38.500 -15.831 -10.211 0.00 0.00 +0.000 OA +ATOM 1847 N GLU 288 -40.099 -16.733 -8.941 0.00 0.00 +0.000 N +ATOM 1848 H GLU 288 -41.052 -16.591 -8.590 0.00 0.00 +0.000 HD +ATOM 1849 CA GLU 288 -39.275 -17.902 -8.630 0.00 0.00 +0.000 C +ATOM 1850 HA GLU 288 -38.451 -17.615 -8.134 0.00 0.00 +0.000 HD +ATOM 1851 CB GLU 288 -40.025 -18.823 -7.677 0.00 0.00 +0.000 C +ATOM 1852 HB2 GLU 288 -40.347 -18.280 -6.921 0.00 0.00 +0.000 HD +ATOM 1853 HB3 GLU 288 -40.765 -19.239 -8.175 0.00 0.00 +0.000 HD +ATOM 1854 CG GLU 288 -39.173 -19.947 -7.101 0.00 0.00 +0.000 C +ATOM 1855 HG2 GLU 288 -39.013 -20.608 -7.809 0.00 0.00 +0.000 HD +ATOM 1856 HG3 GLU 288 -38.341 -19.560 -6.753 0.00 0.00 +0.000 HD +ATOM 1857 CD GLU 288 -39.856 -20.673 -5.944 0.00 0.00 +0.000 C +ATOM 1858 OE1 GLU 288 -39.451 -20.469 -4.775 0.00 0.00 +0.000 OA +ATOM 1859 OE2 GLU 288 -40.804 -21.433 -6.218 0.00 0.00 +0.000 OA +ATOM 1860 C GLU 288 -38.859 -18.634 -9.919 0.00 0.00 +0.000 C +ATOM 1861 O GLU 288 -37.709 -19.041 -10.060 0.00 0.00 +0.000 OA +ATOM 1862 N PRO 289 -39.785 -18.801 -10.879 0.00 0.00 +0.000 N +ATOM 1863 CD PRO 289 -41.247 -18.648 -10.751 0.00 0.00 +0.000 C +ATOM 1864 HD2 PRO 289 -41.522 -17.719 -10.984 0.00 0.00 +0.000 HD +ATOM 1865 HD3 PRO 289 -41.541 -18.866 -9.823 0.00 0.00 +0.000 HD +ATOM 1866 CG PRO 289 -41.764 -19.645 -11.745 0.00 0.00 +0.000 C +ATOM 1867 HG2 PRO 289 -42.678 -19.407 -12.055 0.00 0.00 +0.000 HD +ATOM 1868 HG3 PRO 289 -41.753 -20.566 -11.372 0.00 0.00 +0.000 HD +ATOM 1869 CB PRO 289 -40.780 -19.528 -12.878 0.00 0.00 +0.000 C +ATOM 1870 HB2 PRO 289 -40.935 -18.694 -13.394 0.00 0.00 +0.000 HD +ATOM 1871 HB3 PRO 289 -40.829 -20.321 -13.472 0.00 0.00 +0.000 HD +ATOM 1872 CA PRO 289 -39.443 -19.476 -12.140 0.00 0.00 +0.000 C +ATOM 1873 HA PRO 289 -39.121 -20.408 -11.970 0.00 0.00 +0.000 HD +ATOM 1874 C PRO 289 -38.387 -18.666 -12.901 0.00 0.00 +0.000 C +ATOM 1875 O PRO 289 -37.498 -19.231 -13.534 0.00 0.00 +0.000 OA +ATOM 1876 N LEU 290 -38.485 -17.340 -12.828 0.00 0.00 +0.000 N +ATOM 1877 H LEU 290 -39.281 -16.987 -12.273 0.00 0.00 +0.000 HD +ATOM 1878 CA LEU 290 -37.515 -16.476 -13.500 0.00 0.00 +0.000 C +ATOM 1879 HA LEU 290 -37.463 -16.744 -14.466 0.00 0.00 +0.000 HD +ATOM 1880 CB LEU 290 -37.923 -15.009 -13.387 0.00 0.00 +0.000 C +ATOM 1881 HB2 LEU 290 -38.773 -14.889 -13.868 0.00 0.00 +0.000 HD +ATOM 1882 HB3 LEU 290 -37.998 -14.783 -12.434 0.00 0.00 +0.000 HD +ATOM 1883 CG LEU 290 -36.903 -14.052 -14.009 0.00 0.00 +0.000 C +ATOM 1884 HG LEU 290 -36.003 -14.241 -13.620 0.00 0.00 +0.000 HD +ATOM 1885 CD1 LEU 290 -36.856 -14.244 -15.514 0.00 0.00 +0.000 C +ATOM 1886 HD11 LEU 290 -37.759 -14.059 -15.905 0.00 0.00 +0.000 HD +ATOM 1887 HD12 LEU 290 -36.187 -13.615 -15.913 0.00 0.00 +0.000 HD +ATOM 1888 HD13 LEU 290 -36.591 -15.186 -15.725 0.00 0.00 +0.000 HD +ATOM 1889 CD2 LEU 290 -37.269 -12.634 -13.665 0.00 0.00 +0.000 C +ATOM 1890 HD21 LEU 290 -37.271 -12.512 -12.669 0.00 0.00 +0.000 HD +ATOM 1891 HD22 LEU 290 -36.604 -12.000 -14.070 0.00 0.00 +0.000 HD +ATOM 1892 HD23 LEU 290 -38.182 -12.419 -14.021 0.00 0.00 +0.000 HD +ATOM 1893 C LEU 290 -36.131 -16.644 -12.878 0.00 0.00 +0.000 C +ATOM 1894 O LEU 290 -35.124 -16.698 -13.586 0.00 0.00 +0.000 OA +ATOM 1895 N ALA 291 -36.087 -16.709 -11.550 0.00 0.00 +0.000 N +ATOM 1896 H ALA 291 -37.001 -16.638 -11.075 0.00 0.00 +0.000 HD +ATOM 1897 CA ALA 291 -34.817 -16.870 -10.849 0.00 0.00 +0.000 C +ATOM 1898 HA ALA 291 -34.208 -16.116 -11.104 0.00 0.00 +0.000 HD +ATOM 1899 CB ALA 291 -35.032 -16.836 -9.329 0.00 0.00 +0.000 C +ATOM 1900 HB1 ALA 291 -35.841 -16.289 -9.125 0.00 0.00 +0.000 HD +ATOM 1901 HB2 ALA 291 -35.161 -17.767 -8.996 0.00 0.00 +0.000 HD +ATOM 1902 HB3 ALA 291 -34.231 -16.430 -8.894 0.00 0.00 +0.000 HD +ATOM 1903 C ALA 291 -34.166 -18.185 -11.261 0.00 0.00 +0.000 C +ATOM 1904 O ALA 291 -32.949 -18.275 -11.381 0.00 0.00 +0.000 OA +ATOM 1905 N GLU 292 -34.989 -19.204 -11.477 0.00 0.00 +0.000 N +ATOM 1906 H GLU 292 -35.994 -18.993 -11.330 0.00 0.00 +0.000 HD +ATOM 1907 CA GLU 292 -34.487 -20.500 -11.887 0.00 0.00 +0.000 C +ATOM 1908 HA GLU 292 -33.766 -20.804 -11.261 0.00 0.00 +0.000 HD +ATOM 1909 CB GLU 292 -35.612 -21.538 -11.847 0.00 0.00 +0.000 C +ATOM 1910 HB2 GLU 292 -36.072 -21.445 -10.981 0.00 0.00 +0.000 HD +ATOM 1911 HB3 GLU 292 -36.212 -21.357 -12.606 0.00 0.00 +0.000 HD +ATOM 1912 CG GLU 292 -35.134 -22.972 -11.966 0.00 0.00 +0.000 C +ATOM 1913 HG2 GLU 292 -34.917 -23.149 -12.905 0.00 0.00 +0.000 HD +ATOM 1914 HG3 GLU 292 -34.367 -23.095 -11.369 0.00 0.00 +0.000 HD +ATOM 1915 CD GLU 292 -36.204 -23.960 -11.547 0.00 0.00 +0.000 C +ATOM 1916 OE1 GLU 292 -36.975 -23.633 -10.618 0.00 0.00 +0.000 OA +ATOM 1917 OE2 GLU 292 -36.262 -25.059 -12.129 0.00 0.00 +0.000 OA +ATOM 1918 C GLU 292 -33.919 -20.405 -13.302 0.00 0.00 +0.000 C +ATOM 1919 O GLU 292 -32.898 -21.015 -13.600 0.00 0.00 +0.000 OA +ATOM 1920 N SER 293 -34.587 -19.641 -14.168 0.00 0.00 +0.000 N +ATOM 1921 H SER 293 -35.438 -19.189 -13.786 0.00 0.00 +0.000 HD +ATOM 1922 CA SER 293 -34.133 -19.468 -15.552 0.00 0.00 +0.000 C +ATOM 1923 HA SER 293 -34.007 -20.383 -15.953 0.00 0.00 +0.000 HD +ATOM 1924 CB SER 293 -35.161 -18.677 -16.365 0.00 0.00 +0.000 C +ATOM 1925 HB2 SER 293 -35.388 -17.844 -15.872 0.00 0.00 +0.000 HD +ATOM 1926 HB3 SER 293 -34.768 -18.458 -17.252 0.00 0.00 +0.000 HD +ATOM 1927 OG SER 293 -36.342 -19.437 -16.558 0.00 0.00 +0.000 OA +ATOM 1928 HG SER 293 -36.848 -19.490 -15.698 0.00 0.00 +0.000 HD +ATOM 1929 C SER 293 -32.793 -18.743 -15.604 0.00 0.00 +0.000 C +ATOM 1930 O SER 293 -31.915 -19.092 -16.394 0.00 0.00 +0.000 OA +ATOM 1931 N ILE 294 -32.644 -17.729 -14.760 0.00 0.00 +0.000 N +ATOM 1932 H ILE 294 -33.460 -17.532 -14.158 0.00 0.00 +0.000 HD +ATOM 1933 CA ILE 294 -31.398 -16.965 -14.712 0.00 0.00 +0.000 C +ATOM 1934 HA ILE 294 -31.183 -16.718 -15.657 0.00 0.00 +0.000 HD +ATOM 1935 CB ILE 294 -31.517 -15.748 -13.765 0.00 0.00 +0.000 C +ATOM 1936 HB ILE 294 -31.826 -16.078 -12.882 0.00 0.00 +0.000 HD +ATOM 1937 CG2 ILE 294 -30.166 -15.058 -13.630 0.00 0.00 +0.000 C +ATOM 1938 HG21 ILE 294 -30.246 -14.291 -12.996 0.00 0.00 +0.000 HD +ATOM 1939 HG22 ILE 294 -29.493 -15.709 -13.283 0.00 0.00 +0.000 HD +ATOM 1940 HG23 ILE 294 -29.873 -14.722 -14.523 0.00 0.00 +0.000 HD +ATOM 1941 CG1 ILE 294 -32.565 -14.763 -14.298 0.00 0.00 +0.000 C +ATOM 1942 HG12 ILE 294 -32.268 -14.440 -15.194 0.00 0.00 +0.000 HD +ATOM 1943 HG13 ILE 294 -33.429 -15.253 -14.404 0.00 0.00 +0.000 HD +ATOM 1944 CD1 ILE 294 -32.797 -13.561 -13.395 0.00 0.00 +0.000 C +ATOM 1945 HD11 ILE 294 -31.941 -13.059 -13.292 0.00 0.00 +0.000 HD +ATOM 1946 HD12 ILE 294 -33.488 -12.971 -13.807 0.00 0.00 +0.000 HD +ATOM 1947 HD13 ILE 294 -33.112 -13.878 -12.503 0.00 0.00 +0.000 HD +ATOM 1948 C ILE 294 -30.263 -17.863 -14.226 0.00 0.00 +0.000 C +ATOM 1949 O ILE 294 -29.157 -17.838 -14.768 0.00 0.00 +0.000 OA +ATOM 1950 N THR 295 -30.545 -18.657 -13.198 0.00 0.00 +0.000 N +ATOM 1951 H THR 295 -31.511 -18.575 -12.833 0.00 0.00 +0.000 HD +ATOM 1952 CA THR 295 -29.547 -19.564 -12.648 0.00 0.00 +0.000 C +ATOM 1953 HA THR 295 -28.737 -19.030 -12.387 0.00 0.00 +0.000 HD +ATOM 1954 CB THR 295 -30.079 -20.312 -11.406 0.00 0.00 +0.000 C +ATOM 1955 HB THR 295 -30.869 -20.891 -11.687 0.00 0.00 +0.000 HD +ATOM 1956 CG2 THR 295 -28.976 -21.162 -10.787 0.00 0.00 +0.000 C +ATOM 1957 HG21 THR 295 -28.350 -20.578 -10.266 0.00 0.00 +0.000 HD +ATOM 1958 HG22 THR 295 -29.378 -21.844 -10.172 0.00 0.00 +0.000 HD +ATOM 1959 HG23 THR 295 -28.464 -21.631 -11.509 0.00 0.00 +0.000 HD +ATOM 1960 OG1 THR 295 -30.539 -19.361 -10.441 0.00 0.00 +0.000 OA +ATOM 1961 HG1 THR 295 -31.401 -18.941 -10.746 0.00 0.00 +0.000 HD +ATOM 1962 C THR 295 -29.129 -20.588 -13.697 0.00 0.00 +0.000 C +ATOM 1963 O THR 295 -27.951 -20.909 -13.808 0.00 0.00 +0.000 OA +ATOM 1964 N ASP 296 -30.092 -21.093 -14.469 0.00 0.00 +0.000 N +ATOM 1965 H ASP 296 -31.041 -20.749 -14.276 0.00 0.00 +0.000 HD +ATOM 1966 CA ASP 296 -29.769 -22.070 -15.510 0.00 0.00 +0.000 C +ATOM 1967 HA ASP 296 -29.272 -22.822 -15.064 0.00 0.00 +0.000 HD +ATOM 1968 CB ASP 296 -31.028 -22.577 -16.218 0.00 0.00 +0.000 C +ATOM 1969 HB2 ASP 296 -31.595 -21.788 -16.432 0.00 0.00 +0.000 HD +ATOM 1970 HB3 ASP 296 -30.744 -23.035 -17.054 0.00 0.00 +0.000 HD +ATOM 1971 CG ASP 296 -31.823 -23.540 -15.375 0.00 0.00 +0.000 C +ATOM 1972 OD1 ASP 296 -31.238 -24.168 -14.466 0.00 0.00 +0.000 OA +ATOM 1973 OD2 ASP 296 -33.035 -23.683 -15.635 0.00 0.00 +0.000 OA +ATOM 1974 C ASP 296 -28.836 -21.464 -16.544 0.00 0.00 +0.000 C +ATOM 1975 O ASP 296 -27.879 -22.103 -16.968 0.00 0.00 +0.000 OA +ATOM 1976 N VAL 297 -29.112 -20.227 -16.948 0.00 0.00 +0.000 N +ATOM 1977 H VAL 297 -29.944 -19.797 -16.515 0.00 0.00 +0.000 HD +ATOM 1978 CA VAL 297 -28.271 -19.561 -17.936 0.00 0.00 +0.000 C +ATOM 1979 HA VAL 297 -28.191 -20.165 -18.739 0.00 0.00 +0.000 HD +ATOM 1980 CB VAL 297 -28.898 -18.220 -18.388 0.00 0.00 +0.000 C +ATOM 1981 HB VAL 297 -29.063 -17.675 -17.576 0.00 0.00 +0.000 HD +ATOM 1982 CG1 VAL 297 -27.904 -17.436 -19.256 0.00 0.00 +0.000 C +ATOM 1983 HG11 VAL 297 -28.385 -16.690 -19.711 0.00 0.00 +0.000 HD +ATOM 1984 HG12 VAL 297 -27.181 -17.068 -18.675 0.00 0.00 +0.000 HD +ATOM 1985 HG13 VAL 297 -27.510 -18.049 -19.937 0.00 0.00 +0.000 HD +ATOM 1986 CG2 VAL 297 -30.184 -18.490 -19.161 0.00 0.00 +0.000 C +ATOM 1987 HG21 VAL 297 -30.804 -19.028 -18.590 0.00 0.00 +0.000 HD +ATOM 1988 HG22 VAL 297 -30.614 -17.620 -19.399 0.00 0.00 +0.000 HD +ATOM 1989 HG23 VAL 297 -29.966 -18.998 -19.994 0.00 0.00 +0.000 HD +ATOM 1990 C VAL 297 -26.868 -19.315 -17.393 0.00 0.00 +0.000 C +ATOM 1991 O VAL 297 -25.877 -19.574 -18.071 0.00 0.00 +0.000 OA +ATOM 1992 N LEU 298 -26.787 -18.828 -16.159 0.00 0.00 +0.000 N +ATOM 1993 H LEU 298 -27.691 -18.665 -15.687 0.00 0.00 +0.000 HD +ATOM 1994 CA LEU 298 -25.487 -18.551 -15.537 0.00 0.00 +0.000 C +ATOM 1995 HA LEU 298 -24.962 -17.940 -16.154 0.00 0.00 +0.000 HD +ATOM 1996 CB LEU 298 -25.674 -17.814 -14.206 0.00 0.00 +0.000 C +ATOM 1997 HB2 LEU 298 -26.062 -16.920 -14.406 0.00 0.00 +0.000 HD +ATOM 1998 HB3 LEU 298 -26.299 -18.348 -13.649 0.00 0.00 +0.000 HD +ATOM 1999 CG LEU 298 -24.404 -17.591 -13.390 0.00 0.00 +0.000 C +ATOM 2000 HG LEU 298 -23.978 -18.472 -13.199 0.00 0.00 +0.000 HD +ATOM 2001 CD1 LEU 298 -23.426 -16.719 -14.175 0.00 0.00 +0.000 C +ATOM 2002 HD11 LEU 298 -23.852 -15.836 -14.370 0.00 0.00 +0.000 HD +ATOM 2003 HD12 LEU 298 -22.598 -16.579 -13.633 0.00 0.00 +0.000 HD +ATOM 2004 HD13 LEU 298 -23.191 -17.174 -15.033 0.00 0.00 +0.000 HD +ATOM 2005 CD2 LEU 298 -24.747 -16.911 -12.069 0.00 0.00 +0.000 C +ATOM 2006 HD21 LEU 298 -25.375 -17.490 -11.549 0.00 0.00 +0.000 HD +ATOM 2007 HD22 LEU 298 -23.910 -16.769 -11.540 0.00 0.00 +0.000 HD +ATOM 2008 HD23 LEU 298 -25.181 -16.028 -12.251 0.00 0.00 +0.000 HD +ATOM 2009 C LEU 298 -24.646 -19.810 -15.285 0.00 0.00 +0.000 C +ATOM 2010 O LEU 298 -23.514 -19.923 -15.764 0.00 0.00 +0.000 OA +ATOM 2011 N VAL 299 -25.210 -20.758 -14.545 0.00 0.00 +0.000 N +ATOM 2012 H VAL 299 -26.179 -20.563 -14.244 0.00 0.00 +0.000 HD +ATOM 2013 CA VAL 299 -24.480 -21.965 -14.208 0.00 0.00 +0.000 C +ATOM 2014 HA VAL 299 -23.540 -21.688 -13.894 0.00 0.00 +0.000 HD +ATOM 2015 CB VAL 299 -25.121 -22.663 -12.966 0.00 0.00 +0.000 C +ATOM 2016 HB VAL 299 -26.039 -22.940 -13.228 0.00 0.00 +0.000 HD +ATOM 2017 CG1 VAL 299 -24.354 -23.921 -12.597 0.00 0.00 +0.000 C +ATOM 2018 HG11 VAL 299 -24.502 -24.133 -11.630 0.00 0.00 +0.000 HD +ATOM 2019 HG12 VAL 299 -24.675 -24.686 -13.157 0.00 0.00 +0.000 HD +ATOM 2020 HG13 VAL 299 -23.377 -23.778 -12.759 0.00 0.00 +0.000 HD +ATOM 2021 CG2 VAL 299 -25.133 -21.702 -11.781 0.00 0.00 +0.000 C +ATOM 2022 HG21 VAL 299 -25.080 -20.763 -12.119 0.00 0.00 +0.000 HD +ATOM 2023 HG22 VAL 299 -25.979 -21.828 -11.265 0.00 0.00 +0.000 HD +ATOM 2024 HG23 VAL 299 -24.348 -21.895 -11.194 0.00 0.00 +0.000 HD +ATOM 2025 C VAL 299 -24.305 -22.980 -15.332 0.00 0.00 +0.000 C +ATOM 2026 O VAL 299 -23.236 -23.584 -15.445 0.00 0.00 +0.000 OA +ATOM 2027 N ARG 300 -25.322 -23.160 -16.172 0.00 0.00 +0.000 N +ATOM 2028 H ARG 300 -26.144 -22.561 -16.006 0.00 0.00 +0.000 HD +ATOM 2029 CA ARG 300 -25.236 -24.151 -17.242 0.00 0.00 +0.000 C +ATOM 2030 HA ARG 300 -24.816 -25.000 -16.861 0.00 0.00 +0.000 HD +ATOM 2031 CB ARG 300 -26.636 -24.560 -17.707 0.00 0.00 +0.000 C +ATOM 2032 HB2 ARG 300 -27.022 -23.808 -18.242 0.00 0.00 +0.000 HD +ATOM 2033 HB3 ARG 300 -26.551 -25.370 -18.287 0.00 0.00 +0.000 HD +ATOM 2034 CG ARG 300 -27.633 -24.894 -16.588 0.00 0.00 +0.000 C +ATOM 2035 HG2 ARG 300 -27.621 -24.150 -15.906 0.00 0.00 +0.000 HD +ATOM 2036 HG3 ARG 300 -28.562 -24.940 -16.981 0.00 0.00 +0.000 HD +ATOM 2037 CD ARG 300 -27.369 -26.208 -15.855 0.00 0.00 +0.000 C +ATOM 2038 HD2 ARG 300 -27.318 -26.931 -16.523 0.00 0.00 +0.000 HD +ATOM 2039 HD3 ARG 300 -26.528 -26.116 -15.348 0.00 0.00 +0.000 HD +ATOM 2040 NE ARG 300 -28.473 -26.492 -14.916 0.00 0.00 +0.000 N +ATOM 2041 HE ARG 300 -29.244 -25.837 -14.901 0.00 0.00 +0.000 HD +ATOM 2042 CZ ARG 300 -28.533 -27.537 -14.093 0.00 0.00 +0.000 C +ATOM 2043 NH1 ARG 300 -27.546 -28.413 -14.078 0.00 0.00 +0.000 N +ATOM 2044 HH11 ARG 300 -26.740 -28.308 -14.653 0.00 0.00 +0.000 HD +ATOM 2045 HH12 ARG 300 -27.604 -29.218 -13.465 0.00 0.00 +0.000 HD +ATOM 2046 NH2 ARG 300 -29.593 -27.723 -13.305 0.00 0.00 +0.000 N +ATOM 2047 HH21 ARG 300 -30.337 -27.049 -13.330 0.00 0.00 +0.000 HD +ATOM 2048 HH22 ARG 300 -29.643 -28.511 -12.706 0.00 0.00 +0.000 HD +ATOM 2049 C ARG 300 -24.416 -23.705 -18.443 0.00 0.00 +0.000 C +ATOM 2050 O ARG 300 -23.952 -24.554 -19.191 0.00 0.00 +0.000 OA +ATOM 2051 N THR 301 -24.238 -22.398 -18.647 0.00 0.00 +0.000 N +ATOM 2052 H THR 301 -24.694 -21.774 -17.981 0.00 0.00 +0.000 HD +ATOM 2053 CA THR 301 -23.423 -21.951 -19.781 0.00 0.00 +0.000 C +ATOM 2054 HA THR 301 -23.268 -22.748 -20.395 0.00 0.00 +0.000 HD +ATOM 2055 CB THR 301 -24.154 -20.889 -20.679 0.00 0.00 +0.000 C +ATOM 2056 HB THR 301 -23.608 -20.770 -21.533 0.00 0.00 +0.000 HD +ATOM 2057 CG2 THR 301 -25.556 -21.360 -21.005 0.00 0.00 +0.000 C +ATOM 2058 HG21 THR 301 -25.521 -22.100 -21.682 0.00 0.00 +0.000 HD +ATOM 2059 HG22 THR 301 -26.006 -21.699 -20.175 0.00 0.00 +0.000 HD +ATOM 2060 HG23 THR 301 -26.095 -20.601 -21.380 0.00 0.00 +0.000 HD +ATOM 2061 OG1 THR 301 -24.228 -19.629 -20.004 0.00 0.00 +0.000 OA +ATOM 2062 HG1 THR 301 -24.915 -19.664 -19.270 0.00 0.00 +0.000 HD +ATOM 2063 C THR 301 -22.053 -21.387 -19.382 0.00 0.00 +0.000 C +ATOM 2064 O THR 301 -21.204 -21.174 -20.242 0.00 0.00 +0.000 OA +ATOM 2065 N LYS 302 -21.823 -21.154 -18.093 0.00 0.00 +0.000 N +ATOM 2066 H LYS 302 -22.586 -21.387 -17.452 0.00 0.00 +0.000 HD +ATOM 2067 CA LYS 302 -20.535 -20.595 -17.674 0.00 0.00 +0.000 C +ATOM 2068 HA LYS 302 -19.895 -20.627 -18.471 0.00 0.00 +0.000 HD +ATOM 2069 CB LYS 302 -20.686 -19.101 -17.320 0.00 0.00 +0.000 C +ATOM 2070 HB2 LYS 302 -21.279 -19.036 -16.517 0.00 0.00 +0.000 HD +ATOM 2071 HB3 LYS 302 -19.778 -18.749 -17.091 0.00 0.00 +0.000 HD +ATOM 2072 CG LYS 302 -21.274 -18.240 -18.425 0.00 0.00 +0.000 C +ATOM 2073 HG2 LYS 302 -22.184 -18.595 -18.668 0.00 0.00 +0.000 HD +ATOM 2074 HG3 LYS 302 -21.379 -17.298 -18.087 0.00 0.00 +0.000 HD +ATOM 2075 CD LYS 302 -20.412 -18.213 -19.681 0.00 0.00 +0.000 C +ATOM 2076 HD2 LYS 302 -19.526 -17.824 -19.459 0.00 0.00 +0.000 HD +ATOM 2077 HD3 LYS 302 -20.313 -19.137 -20.028 0.00 0.00 +0.000 HD +ATOM 2078 CE LYS 302 -21.052 -17.352 -20.782 0.00 0.00 +0.000 C +ATOM 2079 HE2 LYS 302 -21.978 -17.698 -20.960 0.00 0.00 +0.000 HD +ATOM 2080 HE3 LYS 302 -21.119 -16.406 -20.450 0.00 0.00 +0.000 HD +ATOM 2081 NZ LYS 302 -20.267 -17.370 -22.056 0.00 0.00 +0.000 N +ATOM 2082 HZ1 LYS 302 -19.328 -17.089 -21.866 0.00 0.00 +0.000 HD +ATOM 2083 HZ2 LYS 302 -20.274 -18.295 -22.432 0.00 0.00 +0.000 HD +ATOM 2084 HZ3 LYS 302 -20.684 -16.738 -22.707 0.00 0.00 +0.000 HD +ATOM 2085 C LYS 302 -19.875 -21.312 -16.498 0.00 0.00 +0.000 C +ATOM 2086 O LYS 302 -19.105 -20.698 -15.763 0.00 0.00 +0.000 OA +ATOM 2087 N ARG 303 -20.147 -22.604 -16.328 0.00 0.00 +0.000 N +ATOM 2088 H ARG 303 -20.771 -23.023 -17.027 0.00 0.00 +0.000 HD +ATOM 2089 CA ARG 303 -19.568 -23.337 -15.200 0.00 0.00 +0.000 C +ATOM 2090 HA ARG 303 -19.917 -22.926 -14.337 0.00 0.00 +0.000 HD +ATOM 2091 CB ARG 303 -20.039 -24.794 -15.180 0.00 0.00 +0.000 C +ATOM 2092 HB2 ARG 303 -21.023 -24.809 -15.259 0.00 0.00 +0.000 HD +ATOM 2093 HB3 ARG 303 -19.609 -25.276 -15.927 0.00 0.00 +0.000 HD +ATOM 2094 CG ARG 303 -19.662 -25.522 -13.875 0.00 0.00 +0.000 C +ATOM 2095 HG2 ARG 303 -18.674 -25.478 -13.754 0.00 0.00 +0.000 HD +ATOM 2096 HG3 ARG 303 -20.121 -25.075 -13.112 0.00 0.00 +0.000 HD +ATOM 2097 CD ARG 303 -20.081 -26.981 -13.901 0.00 0.00 +0.000 C +ATOM 2098 HD2 ARG 303 -19.638 -27.418 -14.690 0.00 0.00 +0.000 HD +ATOM 2099 HD3 ARG 303 -19.741 -27.417 -13.060 0.00 0.00 +0.000 HD +ATOM 2100 NE ARG 303 -21.528 -27.189 -13.993 0.00 0.00 +0.000 N +ATOM 2101 HE ARG 303 -21.924 -27.307 -14.916 0.00 0.00 +0.000 HD +ATOM 2102 CZ ARG 303 -22.358 -27.234 -12.956 0.00 0.00 +0.000 C +ATOM 2103 NH1 ARG 303 -21.903 -27.077 -11.718 0.00 0.00 +0.000 N +ATOM 2104 HH11 ARG 303 -20.936 -26.903 -11.548 0.00 0.00 +0.000 HD +ATOM 2105 HH12 ARG 303 -22.540 -27.133 -10.943 0.00 0.00 +0.000 HD +ATOM 2106 NH2 ARG 303 -23.646 -27.480 -13.158 0.00 0.00 +0.000 N +ATOM 2107 HH21 ARG 303 -23.990 -27.611 -14.090 0.00 0.00 +0.000 HD +ATOM 2108 HH22 ARG 303 -24.275 -27.534 -12.383 0.00 0.00 +0.000 HD +ATOM 2109 C ARG 303 -18.046 -23.309 -15.169 0.00 0.00 +0.000 C +ATOM 2110 O ARG 303 -17.450 -23.016 -14.134 0.00 0.00 +0.000 OA +ATOM 2111 N ASP 304 -17.408 -23.618 -16.294 0.00 0.00 +0.000 N +ATOM 2112 H ASP 304 -18.010 -23.844 -17.098 0.00 0.00 +0.000 HD +ATOM 2113 CA ASP 304 -15.945 -23.624 -16.343 0.00 0.00 +0.000 C +ATOM 2114 HA ASP 304 -15.632 -24.350 -15.719 0.00 0.00 +0.000 HD +ATOM 2115 CB ASP 304 -15.438 -23.869 -17.767 0.00 0.00 +0.000 C +ATOM 2116 HB2 ASP 304 -15.813 -23.158 -18.351 0.00 0.00 +0.000 HD +ATOM 2117 HB3 ASP 304 -14.446 -23.818 -17.752 0.00 0.00 +0.000 HD +ATOM 2118 CG ASP 304 -15.852 -25.219 -18.310 0.00 0.00 +0.000 C +ATOM 2119 OD1 ASP 304 -15.508 -26.250 -17.690 0.00 0.00 +0.000 OA +ATOM 2120 OD2 ASP 304 -16.522 -25.239 -19.364 0.00 0.00 +0.000 OA +ATOM 2121 C ASP 304 -15.375 -22.313 -15.830 0.00 0.00 +0.000 C +ATOM 2122 O ASP 304 -14.464 -22.313 -15.010 0.00 0.00 +0.000 OA +ATOM 2123 N TRP 305 -15.908 -21.198 -16.320 0.00 0.00 +0.000 N +ATOM 2124 H TRP 305 -16.665 -21.343 -17.015 0.00 0.00 +0.000 HD +ATOM 2125 CA TRP 305 -15.447 -19.875 -15.898 0.00 0.00 +0.000 C +ATOM 2126 HA TRP 305 -14.455 -19.833 -16.050 0.00 0.00 +0.000 HD +ATOM 2127 CB TRP 305 -16.178 -18.769 -16.674 0.00 0.00 +0.000 C +ATOM 2128 HB2 TRP 305 -16.129 -18.965 -17.644 0.00 0.00 +0.000 HD +ATOM 2129 HB3 TRP 305 -17.119 -18.723 -16.367 0.00 0.00 +0.000 HD +ATOM 2130 CG TRP 305 -15.583 -17.381 -16.476 0.00 0.00 +0.000 A +ATOM 2131 CD1 TRP 305 -14.605 -16.794 -17.230 0.00 0.00 +0.000 A +ATOM 2132 HD1 TRP 305 -14.170 -17.210 -18.028 0.00 0.00 +0.000 HD +ATOM 2133 NE1 TRP 305 -14.305 -15.549 -16.734 0.00 0.00 +0.000 N +ATOM 2134 HE1 TRP 305 -13.624 -14.921 -17.112 0.00 0.00 +0.000 HD +ATOM 2135 CE2 TRP 305 -15.087 -15.304 -15.639 0.00 0.00 +0.000 A +ATOM 2136 CZ2 TRP 305 -15.143 -14.180 -14.801 0.00 0.00 +0.000 A +ATOM 2137 HZ2 TRP 305 -14.543 -13.394 -14.973 0.00 0.00 +0.000 HD +ATOM 2138 CH2 TRP 305 -16.036 -14.206 -13.758 0.00 0.00 +0.000 A +ATOM 2139 HH2 TRP 305 -16.103 -13.426 -13.138 0.00 0.00 +0.000 HD +ATOM 2140 CZ3 TRP 305 -16.871 -15.317 -13.538 0.00 0.00 +0.000 A +ATOM 2141 HZ3 TRP 305 -17.511 -15.313 -12.780 0.00 0.00 +0.000 HD +ATOM 2142 CE3 TRP 305 -16.817 -16.438 -14.373 0.00 0.00 +0.000 A +ATOM 2143 HE3 TRP 305 -17.412 -17.214 -14.203 0.00 0.00 +0.000 HD +ATOM 2144 CD2 TRP 305 -15.912 -16.433 -15.442 0.00 0.00 +0.000 A +ATOM 2145 C TRP 305 -15.692 -19.669 -14.402 0.00 0.00 +0.000 C +ATOM 2146 O TRP 305 -14.809 -19.222 -13.675 0.00 0.00 +0.000 OA +ATOM 2147 N LEU 306 -16.897 -19.995 -13.943 0.00 0.00 +0.000 N +ATOM 2148 H LEU 306 -17.551 -20.370 -14.647 0.00 0.00 +0.000 HD +ATOM 2149 CA LEU 306 -17.230 -19.819 -12.533 0.00 0.00 +0.000 C +ATOM 2150 HA LEU 306 -17.155 -18.836 -12.307 0.00 0.00 +0.000 HD +ATOM 2151 CB LEU 306 -18.679 -20.241 -12.273 0.00 0.00 +0.000 C +ATOM 2152 HB2 LEU 306 -18.811 -21.132 -12.666 0.00 0.00 +0.000 HD +ATOM 2153 HB3 LEU 306 -18.829 -20.232 -11.303 0.00 0.00 +0.000 HD +ATOM 2154 CG LEU 306 -19.695 -19.297 -12.911 0.00 0.00 +0.000 C +ATOM 2155 HG LEU 306 -19.384 -19.058 -13.830 0.00 0.00 +0.000 HD +ATOM 2156 CD1 LEU 306 -21.053 -19.967 -12.993 0.00 0.00 +0.000 C +ATOM 2157 HD11 LEU 306 -21.366 -20.209 -12.073 0.00 0.00 +0.000 HD +ATOM 2158 HD12 LEU 306 -21.713 -19.341 -13.412 0.00 0.00 +0.000 HD +ATOM 2159 HD13 LEU 306 -20.986 -20.797 -13.548 0.00 0.00 +0.000 HD +ATOM 2160 CD2 LEU 306 -19.769 -18.011 -12.098 0.00 0.00 +0.000 C +ATOM 2161 HD21 LEU 306 -18.869 -17.573 -12.083 0.00 0.00 +0.000 HD +ATOM 2162 HD22 LEU 306 -20.434 -17.391 -12.514 0.00 0.00 +0.000 HD +ATOM 2163 HD23 LEU 306 -20.052 -18.223 -11.162 0.00 0.00 +0.000 HD +ATOM 2164 C LEU 306 -16.291 -20.594 -11.618 0.00 0.00 +0.000 C +ATOM 2165 O LEU 306 -15.801 -20.061 -10.624 0.00 0.00 +0.000 OA +ATOM 2166 N VAL 307 -16.037 -21.850 -11.955 0.00 0.00 +0.000 N +ATOM 2167 H VAL 307 -16.500 -22.182 -12.814 0.00 0.00 +0.000 HD +ATOM 2168 CA VAL 307 -15.155 -22.673 -11.136 0.00 0.00 +0.000 C +ATOM 2169 HA VAL 307 -15.501 -22.661 -10.192 0.00 0.00 +0.000 HD +ATOM 2170 CB VAL 307 -15.143 -24.141 -11.644 0.00 0.00 +0.000 C +ATOM 2171 HB VAL 307 -14.859 -24.122 -12.597 0.00 0.00 +0.000 HD +ATOM 2172 CG1 VAL 307 -14.119 -24.965 -10.883 0.00 0.00 +0.000 C +ATOM 2173 HG11 VAL 307 -14.459 -25.899 -10.766 0.00 0.00 +0.000 HD +ATOM 2174 HG12 VAL 307 -13.259 -24.987 -11.394 0.00 0.00 +0.000 HD +ATOM 2175 HG13 VAL 307 -13.960 -24.556 -9.984 0.00 0.00 +0.000 HD +ATOM 2176 CG2 VAL 307 -16.537 -24.742 -11.481 0.00 0.00 +0.000 C +ATOM 2177 HG21 VAL 307 -16.594 -25.201 -10.595 0.00 0.00 +0.000 HD +ATOM 2178 HG22 VAL 307 -17.216 -24.011 -11.528 0.00 0.00 +0.000 HD +ATOM 2179 HG23 VAL 307 -16.697 -25.401 -12.215 0.00 0.00 +0.000 HD +ATOM 2180 C VAL 307 -13.741 -22.099 -11.125 0.00 0.00 +0.000 C +ATOM 2181 O VAL 307 -13.110 -21.996 -10.069 0.00 0.00 +0.000 OA +ATOM 2182 N LYS 308 -13.249 -21.704 -12.293 0.00 0.00 +0.000 N +ATOM 2183 H LYS 308 -13.872 -21.830 -13.103 0.00 0.00 +0.000 HD +ATOM 2184 CA LYS 308 -11.906 -21.133 -12.378 0.00 0.00 +0.000 C +ATOM 2185 HA LYS 308 -11.246 -21.792 -12.001 0.00 0.00 +0.000 HD +ATOM 2186 CB LYS 308 -11.521 -20.884 -13.844 0.00 0.00 +0.000 C +ATOM 2187 HB2 LYS 308 -11.676 -21.725 -14.353 0.00 0.00 +0.000 HD +ATOM 2188 HB3 LYS 308 -12.102 -20.157 -14.198 0.00 0.00 +0.000 HD +ATOM 2189 CG LYS 308 -10.063 -20.470 -14.035 0.00 0.00 +0.000 C +ATOM 2190 HG2 LYS 308 -9.967 -19.500 -13.791 0.00 0.00 +0.000 HD +ATOM 2191 HG3 LYS 308 -9.487 -21.017 -13.421 0.00 0.00 +0.000 HD +ATOM 2192 CD LYS 308 -9.578 -20.665 -15.467 0.00 0.00 +0.000 C +ATOM 2193 HD2 LYS 308 -9.666 -21.617 -15.710 0.00 0.00 +0.000 HD +ATOM 2194 HD3 LYS 308 -10.102 -20.084 -16.067 0.00 0.00 +0.000 HD +ATOM 2195 CE LYS 308 -8.105 -20.270 -15.570 0.00 0.00 +0.000 C +ATOM 2196 HE2 LYS 308 -7.729 -20.632 -16.413 0.00 0.00 +0.000 HD +ATOM 2197 HE3 LYS 308 -8.031 -19.281 -15.549 0.00 0.00 +0.000 HD +ATOM 2198 NZ LYS 308 -7.345 -20.845 -14.406 0.00 0.00 +0.000 N +ATOM 2199 HZ1 LYS 308 -6.403 -21.012 -14.685 0.00 0.00 +0.000 HD +ATOM 2200 HZ2 LYS 308 -7.367 -20.193 -13.652 0.00 0.00 +0.000 HD +ATOM 2201 HZ3 LYS 308 -7.775 -21.701 -14.130 0.00 0.00 +0.000 HD +ATOM 2202 C LYS 308 -11.812 -19.834 -11.569 0.00 0.00 +0.000 C +ATOM 2203 O LYS 308 -10.761 -19.522 -11.011 0.00 0.00 +0.000 OA +ATOM 2204 N GLN 309 -12.916 -19.093 -11.480 0.00 0.00 +0.000 N +ATOM 2205 H GLN 309 -13.738 -19.468 -11.979 0.00 0.00 +0.000 HD +ATOM 2206 CA GLN 309 -12.922 -17.846 -10.722 0.00 0.00 +0.000 C +ATOM 2207 HA GLN 309 -11.984 -17.463 -10.743 0.00 0.00 +0.000 HD +ATOM 2208 CB GLN 309 -13.872 -16.832 -11.364 0.00 0.00 +0.000 C +ATOM 2209 HB2 GLN 309 -14.777 -17.254 -11.456 0.00 0.00 +0.000 HD +ATOM 2210 HB3 GLN 309 -13.944 -16.033 -10.761 0.00 0.00 +0.000 HD +ATOM 2211 CG GLN 309 -13.433 -16.350 -12.736 0.00 0.00 +0.000 C +ATOM 2212 HG2 GLN 309 -13.461 -17.122 -13.371 0.00 0.00 +0.000 HD +ATOM 2213 HG3 GLN 309 -14.067 -15.641 -13.045 0.00 0.00 +0.000 HD +ATOM 2214 CD GLN 309 -12.032 -15.779 -12.731 0.00 0.00 +0.000 C +ATOM 2215 OE1 GLN 309 -11.704 -14.917 -11.908 0.00 0.00 +0.000 OA +ATOM 2216 NE2 GLN 309 -11.196 -16.252 -13.647 0.00 0.00 +0.000 N +ATOM 2217 HE21 GLN 309 -10.241 -15.906 -13.714 0.00 0.00 +0.000 HD +ATOM 2218 HE22 GLN 309 -11.525 -16.973 -14.288 0.00 0.00 +0.000 HD +ATOM 2219 C GLN 309 -13.304 -18.048 -9.253 0.00 0.00 +0.000 C +ATOM 2220 O GLN 309 -13.660 -17.099 -8.564 0.00 0.00 +0.000 OA +ATOM 2221 N ARG 310 -13.260 -19.298 -8.798 0.00 0.00 +0.000 N +ATOM 2222 H ARG 310 -12.992 -20.009 -9.518 0.00 0.00 +0.000 HD +ATOM 2223 CA ARG 310 -13.561 -19.655 -7.407 0.00 0.00 +0.000 C +ATOM 2224 HA ARG 310 -13.294 -20.640 -7.265 0.00 0.00 +0.000 HD +ATOM 2225 CB ARG 310 -12.605 -18.913 -6.455 0.00 0.00 +0.000 C +ATOM 2226 HB2 ARG 310 -12.560 -17.965 -6.736 0.00 0.00 +0.000 HD +ATOM 2227 HB3 ARG 310 -12.956 -18.996 -5.534 0.00 0.00 +0.000 HD +ATOM 2228 CG ARG 310 -11.176 -19.478 -6.468 0.00 0.00 +0.000 C +ATOM 2229 HG2 ARG 310 -11.160 -20.344 -5.969 0.00 0.00 +0.000 HD +ATOM 2230 HG3 ARG 310 -10.892 -19.632 -7.414 0.00 0.00 +0.000 HD +ATOM 2231 CD ARG 310 -10.153 -18.538 -5.816 0.00 0.00 +0.000 C +ATOM 2232 HD2 ARG 310 -9.293 -19.041 -5.725 0.00 0.00 +0.000 HD +ATOM 2233 HD3 ARG 310 -10.021 -17.760 -6.432 0.00 0.00 +0.000 HD +ATOM 2234 NE ARG 310 -10.570 -18.050 -4.501 0.00 0.00 +0.000 N +ATOM 2235 HE ARG 310 -10.736 -17.054 -4.406 0.00 0.00 +0.000 HD +ATOM 2236 CZ ARG 310 -10.749 -18.806 -3.424 0.00 0.00 +0.000 C +ATOM 2237 NH1 ARG 310 -10.551 -20.116 -3.478 0.00 0.00 +0.000 N +ATOM 2238 HH11 ARG 310 -10.245 -20.553 -4.321 0.00 0.00 +0.000 HD +ATOM 2239 HH12 ARG 310 -10.709 -20.678 -2.659 0.00 0.00 +0.000 HD +ATOM 2240 NH2 ARG 310 -11.135 -18.238 -2.288 0.00 0.00 +0.000 N +ATOM 2241 HH21 ARG 310 -11.270 -17.247 -2.242 0.00 0.00 +0.000 HD +ATOM 2242 HH22 ARG 310 -11.291 -18.800 -1.475 0.00 0.00 +0.000 HD +ATOM 2243 C ARG 310 -15.009 -19.484 -6.950 0.00 0.00 +0.000 C +ATOM 2244 O ARG 310 -15.268 -19.281 -5.769 0.00 0.00 +0.000 OA +ATOM 2245 N GLY 311 -15.940 -19.577 -7.895 0.00 0.00 +0.000 N +ATOM 2246 H GLY 311 -15.578 -19.721 -8.854 0.00 0.00 +0.000 HD +ATOM 2247 CA GLY 311 -17.353 -19.479 -7.568 0.00 0.00 +0.000 C +ATOM 2248 HA2 GLY 311 -17.898 -19.492 -8.441 0.00 0.00 +0.000 HD +ATOM 2249 HA3 GLY 311 -17.638 -20.331 -7.066 0.00 0.00 +0.000 HD +ATOM 2250 C GLY 311 -17.759 -18.269 -6.753 0.00 0.00 +0.000 C +ATOM 2251 O GLY 311 -17.192 -17.194 -6.911 0.00 0.00 +0.000 OA +ATOM 2252 N TRP 312 -18.734 -18.445 -5.866 0.00 0.00 +0.000 N +ATOM 2253 H TRP 312 -19.110 -19.405 -5.810 0.00 0.00 +0.000 HD +ATOM 2254 CA TRP 312 -19.204 -17.337 -5.056 0.00 0.00 +0.000 C +ATOM 2255 HA TRP 312 -19.419 -16.563 -5.681 0.00 0.00 +0.000 HD +ATOM 2256 CB TRP 312 -20.528 -17.714 -4.385 0.00 0.00 +0.000 C +ATOM 2257 HB2 TRP 312 -20.415 -18.561 -3.904 0.00 0.00 +0.000 HD +ATOM 2258 HB3 TRP 312 -20.812 -16.981 -3.798 0.00 0.00 +0.000 HD +ATOM 2259 CG TRP 312 -21.611 -17.918 -5.408 0.00 0.00 +0.000 A +ATOM 2260 CD1 TRP 312 -22.114 -19.110 -5.855 0.00 0.00 +0.000 A +ATOM 2261 HD1 TRP 312 -21.844 -20.009 -5.517 0.00 0.00 +0.000 HD +ATOM 2262 NE1 TRP 312 -23.050 -18.891 -6.843 0.00 0.00 +0.000 N +ATOM 2263 HE1 TRP 312 -23.559 -19.598 -7.327 0.00 0.00 +0.000 HD +ATOM 2264 CE2 TRP 312 -23.165 -17.541 -7.050 0.00 0.00 +0.000 A +ATOM 2265 CZ2 TRP 312 -23.979 -16.829 -7.943 0.00 0.00 +0.000 A +ATOM 2266 HZ2 TRP 312 -24.602 -17.321 -8.557 0.00 0.00 +0.000 HD +ATOM 2267 CH2 TRP 312 -23.884 -15.462 -7.937 0.00 0.00 +0.000 A +ATOM 2268 HH2 TRP 312 -24.446 -14.917 -8.558 0.00 0.00 +0.000 HD +ATOM 2269 CZ3 TRP 312 -23.001 -14.790 -7.064 0.00 0.00 +0.000 A +ATOM 2270 HZ3 TRP 312 -22.953 -13.799 -7.082 0.00 0.00 +0.000 HD +ATOM 2271 CE3 TRP 312 -22.194 -15.496 -6.178 0.00 0.00 +0.000 A +ATOM 2272 HE3 TRP 312 -21.575 -15.010 -5.568 0.00 0.00 +0.000 HD +ATOM 2273 CD2 TRP 312 -22.273 -16.895 -6.162 0.00 0.00 +0.000 A +ATOM 2274 C TRP 312 -18.173 -16.830 -4.049 0.00 0.00 +0.000 C +ATOM 2275 O TRP 312 -18.248 -15.684 -3.600 0.00 0.00 +0.000 OA +ATOM 2276 N ASP 313 -17.200 -17.662 -3.693 0.00 0.00 +0.000 N +ATOM 2277 H ASP 313 -17.237 -18.598 -4.090 0.00 0.00 +0.000 HD +ATOM 2278 CA ASP 313 -16.167 -17.185 -2.776 0.00 0.00 +0.000 C +ATOM 2279 HA ASP 313 -16.623 -16.709 -2.041 0.00 0.00 +0.000 HD +ATOM 2280 CB ASP 313 -15.235 -18.307 -2.338 0.00 0.00 +0.000 C +ATOM 2281 HB2 ASP 313 -14.914 -18.779 -3.151 0.00 0.00 +0.000 HD +ATOM 2282 HB3 ASP 313 -14.473 -17.903 -1.846 0.00 0.00 +0.000 HD +ATOM 2283 CG ASP 313 -15.921 -19.311 -1.433 0.00 0.00 +0.000 C +ATOM 2284 OD1 ASP 313 -16.655 -18.880 -0.517 0.00 0.00 +0.000 OA +ATOM 2285 OD2 ASP 313 -15.721 -20.525 -1.634 0.00 0.00 +0.000 OA +ATOM 2286 C ASP 313 -15.376 -16.151 -3.561 0.00 0.00 +0.000 C +ATOM 2287 O ASP 313 -14.967 -15.123 -3.014 0.00 0.00 +0.000 OA +ATOM 2288 N GLY 314 -15.181 -16.427 -4.850 0.00 0.00 +0.000 N +ATOM 2289 H GLY 314 -15.578 -17.322 -5.173 0.00 0.00 +0.000 HD +ATOM 2290 CA GLY 314 -14.453 -15.501 -5.703 0.00 0.00 +0.000 C +ATOM 2291 HA2 GLY 314 -13.563 -15.285 -5.285 0.00 0.00 +0.000 HD +ATOM 2292 HA3 GLY 314 -14.285 -15.929 -6.599 0.00 0.00 +0.000 HD +ATOM 2293 C GLY 314 -15.239 -14.212 -5.902 0.00 0.00 +0.000 C +ATOM 2294 O GLY 314 -14.670 -13.125 -5.933 0.00 0.00 +0.000 OA +ATOM 2295 N PHE 315 -16.550 -14.349 -6.055 0.00 0.00 +0.000 N +ATOM 2296 H PHE 315 -16.884 -15.342 -6.033 0.00 0.00 +0.000 HD +ATOM 2297 CA PHE 315 -17.450 -13.216 -6.238 0.00 0.00 +0.000 C +ATOM 2298 HA PHE 315 -17.134 -12.716 -7.046 0.00 0.00 +0.000 HD +ATOM 2299 CB PHE 315 -18.892 -13.727 -6.340 0.00 0.00 +0.000 C +ATOM 2300 HB2 PHE 315 -18.956 -14.288 -7.155 0.00 0.00 +0.000 HD +ATOM 2301 HB3 PHE 315 -19.080 -14.264 -5.527 0.00 0.00 +0.000 HD +ATOM 2302 CG PHE 315 -19.936 -12.648 -6.435 0.00 0.00 +0.000 A +ATOM 2303 CD1 PHE 315 -20.142 -11.951 -7.624 0.00 0.00 +0.000 A +ATOM 2304 HD1 PHE 315 -19.563 -12.131 -8.412 0.00 0.00 +0.000 HD +ATOM 2305 CE1 PHE 315 -21.157 -10.998 -7.728 0.00 0.00 +0.000 A +ATOM 2306 HE1 PHE 315 -21.297 -10.515 -8.595 0.00 0.00 +0.000 HD +ATOM 2307 CZ PHE 315 -21.963 -10.728 -6.626 0.00 0.00 +0.000 A +ATOM 2308 HZ PHE 315 -22.686 -10.044 -6.694 0.00 0.00 +0.000 HD +ATOM 2309 CE2 PHE 315 -21.756 -11.415 -5.433 0.00 0.00 +0.000 A +ATOM 2310 HE2 PHE 315 -22.341 -11.225 -4.628 0.00 0.00 +0.000 HD +ATOM 2311 CD2 PHE 315 -20.746 -12.361 -5.342 0.00 0.00 +0.000 A +ATOM 2312 HD2 PHE 315 -20.598 -12.845 -4.478 0.00 0.00 +0.000 HD +ATOM 2313 C PHE 315 -17.323 -12.260 -5.052 0.00 0.00 +0.000 C +ATOM 2314 O PHE 315 -17.168 -11.053 -5.223 0.00 0.00 +0.000 OA +ATOM 2315 N VAL 316 -17.398 -12.819 -3.850 0.00 0.00 +0.000 N +ATOM 2316 H VAL 316 -17.527 -13.853 -3.859 0.00 0.00 +0.000 HD +ATOM 2317 CA VAL 316 -17.305 -12.036 -2.627 0.00 0.00 +0.000 C +ATOM 2318 HA VAL 316 -18.019 -11.319 -2.655 0.00 0.00 +0.000 HD +ATOM 2319 CB VAL 316 -17.572 -12.943 -1.391 0.00 0.00 +0.000 C +ATOM 2320 HB VAL 316 -16.970 -13.732 -1.470 0.00 0.00 +0.000 HD +ATOM 2321 CG1 VAL 316 -17.214 -12.225 -0.108 0.00 0.00 +0.000 C +ATOM 2322 HG11 VAL 316 -16.431 -12.675 0.324 0.00 0.00 +0.000 HD +ATOM 2323 HG12 VAL 316 -16.978 -11.273 -0.308 0.00 0.00 +0.000 HD +ATOM 2324 HG13 VAL 316 -17.993 -12.246 0.520 0.00 0.00 +0.000 HD +ATOM 2325 CG2 VAL 316 -19.034 -13.352 -1.366 0.00 0.00 +0.000 C +ATOM 2326 HG21 VAL 316 -19.224 -13.853 -0.521 0.00 0.00 +0.000 HD +ATOM 2327 HG22 VAL 316 -19.608 -12.534 -1.407 0.00 0.00 +0.000 HD +ATOM 2328 HG23 VAL 316 -19.228 -13.938 -2.153 0.00 0.00 +0.000 HD +ATOM 2329 C VAL 316 -15.951 -11.338 -2.486 0.00 0.00 +0.000 C +ATOM 2330 O VAL 316 -15.879 -10.180 -2.059 0.00 0.00 +0.000 OA +ATOM 2331 N GLU 317 -14.883 -12.042 -2.854 0.00 0.00 +0.000 N +ATOM 2332 H GLU 317 -15.092 -13.000 -3.199 0.00 0.00 +0.000 HD +ATOM 2333 CA GLU 317 -13.536 -11.493 -2.772 0.00 0.00 +0.000 C +ATOM 2334 HA GLU 317 -13.370 -11.138 -1.844 0.00 0.00 +0.000 HD +ATOM 2335 CB GLU 317 -12.481 -12.571 -3.051 0.00 0.00 +0.000 C +ATOM 2336 HB2 GLU 317 -12.613 -12.880 -3.983 0.00 0.00 +0.000 HD +ATOM 2337 HB3 GLU 317 -11.592 -12.152 -2.938 0.00 0.00 +0.000 HD +ATOM 2338 CG GLU 317 -12.538 -13.785 -2.149 0.00 0.00 +0.000 C +ATOM 2339 HG2 GLU 317 -12.380 -13.497 -1.226 0.00 0.00 +0.000 HD +ATOM 2340 HG3 GLU 317 -13.405 -14.225 -2.268 0.00 0.00 +0.000 HD +ATOM 2341 CD GLU 317 -11.460 -14.806 -2.497 0.00 0.00 +0.000 C +ATOM 2342 OE1 GLU 317 -11.286 -15.099 -3.704 0.00 0.00 +0.000 OA +ATOM 2343 OE2 GLU 317 -10.791 -15.314 -1.570 0.00 0.00 +0.000 OA +ATOM 2344 C GLU 317 -13.347 -10.373 -3.785 0.00 0.00 +0.000 C +ATOM 2345 O GLU 317 -12.708 -9.370 -3.488 0.00 0.00 +0.000 OA +ATOM 2346 N PHE 318 -13.903 -10.554 -4.982 0.00 0.00 +0.000 N +ATOM 2347 H PHE 318 -14.429 -11.445 -5.085 0.00 0.00 +0.000 HD +ATOM 2348 CA PHE 318 -13.772 -9.570 -6.046 0.00 0.00 +0.000 C +ATOM 2349 HA PHE 318 -12.782 -9.417 -6.185 0.00 0.00 +0.000 HD +ATOM 2350 CB PHE 318 -14.452 -10.090 -7.317 0.00 0.00 +0.000 C +ATOM 2351 HB2 PHE 318 -14.103 -10.997 -7.496 0.00 0.00 +0.000 HD +ATOM 2352 HB3 PHE 318 -15.427 -10.104 -7.153 0.00 0.00 +0.000 HD +ATOM 2353 CG PHE 318 -14.196 -9.244 -8.532 0.00 0.00 +0.000 A +ATOM 2354 CD1 PHE 318 -12.948 -9.247 -9.151 0.00 0.00 +0.000 A +ATOM 2355 HD1 PHE 318 -12.214 -9.809 -8.785 0.00 0.00 +0.000 HD +ATOM 2356 CE1 PHE 318 -12.711 -8.470 -10.285 0.00 0.00 +0.000 A +ATOM 2357 HE1 PHE 318 -11.806 -8.485 -10.717 0.00 0.00 +0.000 HD +ATOM 2358 CZ PHE 318 -13.733 -7.679 -10.806 0.00 0.00 +0.000 A +ATOM 2359 HZ PHE 318 -13.569 -7.123 -11.616 0.00 0.00 +0.000 HD +ATOM 2360 CE2 PHE 318 -14.986 -7.671 -10.188 0.00 0.00 +0.000 A +ATOM 2361 HE2 PHE 318 -15.731 -7.098 -10.559 0.00 0.00 +0.000 HD +ATOM 2362 CD2 PHE 318 -15.206 -8.450 -9.061 0.00 0.00 +0.000 A +ATOM 2363 HD2 PHE 318 -16.107 -8.441 -8.622 0.00 0.00 +0.000 HD +ATOM 2364 C PHE 318 -14.374 -8.229 -5.662 0.00 0.00 +0.000 C +ATOM 2365 O PHE 318 -13.821 -7.177 -5.980 0.00 0.00 +0.000 OA +ATOM 2366 N PHE 319 -15.495 -8.275 -4.950 0.00 0.00 +0.000 N +ATOM 2367 H PHE 319 -15.820 -9.231 -4.708 0.00 0.00 +0.000 HD +ATOM 2368 CA PHE 319 -16.196 -7.061 -4.551 0.00 0.00 +0.000 C +ATOM 2369 HA PHE 319 -15.856 -6.310 -5.159 0.00 0.00 +0.000 HD +ATOM 2370 CB PHE 319 -17.685 -7.247 -4.792 0.00 0.00 +0.000 C +ATOM 2371 HB2 PHE 319 -17.942 -8.144 -4.459 0.00 0.00 +0.000 HD +ATOM 2372 HB3 PHE 319 -18.168 -6.534 -4.303 0.00 0.00 +0.000 HD +ATOM 2373 CG PHE 319 -18.090 -7.163 -6.243 0.00 0.00 +0.000 A +ATOM 2374 CD1 PHE 319 -18.040 -5.950 -6.913 0.00 0.00 +0.000 A +ATOM 2375 HD1 PHE 319 -17.728 -5.131 -6.441 0.00 0.00 +0.000 HD +ATOM 2376 CE1 PHE 319 -18.422 -5.856 -8.254 0.00 0.00 +0.000 A +ATOM 2377 HE1 PHE 319 -18.436 -4.956 -8.701 0.00 0.00 +0.000 HD +ATOM 2378 CZ PHE 319 -18.780 -7.001 -8.956 0.00 0.00 +0.000 A +ATOM 2379 HZ PHE 319 -19.001 -6.942 -9.925 0.00 0.00 +0.000 HD +ATOM 2380 CE2 PHE 319 -18.824 -8.218 -8.294 0.00 0.00 +0.000 A +ATOM 2381 HE2 PHE 319 -19.135 -9.053 -8.780 0.00 0.00 +0.000 HD +ATOM 2382 CD2 PHE 319 -18.445 -8.302 -6.964 0.00 0.00 +0.000 A +ATOM 2383 HD2 PHE 319 -18.424 -9.195 -6.510 0.00 0.00 +0.000 HD +ATOM 2384 C PHE 319 -15.959 -6.591 -3.113 0.00 0.00 +0.000 C +ATOM 2385 O PHE 319 -16.508 -5.563 -2.702 0.00 0.00 +0.000 OA +ATOM 2386 N HIE 320 -15.142 -7.327 -2.360 0.00 0.00 +0.000 N +ATOM 2387 H HIE 320 -14.746 -8.163 -2.844 0.00 0.00 +0.000 HD +ATOM 2388 CA HIE 320 -14.827 -6.989 -0.970 0.00 0.00 +0.000 C +ATOM 2389 HA HIE 320 -15.658 -7.155 -0.409 0.00 0.00 +0.000 HD +ATOM 2390 CB HIE 320 -13.721 -7.908 -0.459 0.00 0.00 +0.000 C +ATOM 2391 HB2 HIE 320 -14.045 -8.860 -0.483 0.00 0.00 +0.000 HD +ATOM 2392 HB3 HIE 320 -12.921 -7.827 -1.063 0.00 0.00 +0.000 HD +ATOM 2393 CG HIE 320 -13.281 -7.599 0.943 0.00 0.00 +0.000 A +ATOM 2394 ND1 HIE 320 -12.082 -7.001 1.233 0.00 0.00 +0.000 NA +ATOM 2395 CE1 HIE 320 -11.992 -6.810 2.544 0.00 0.00 +0.000 A +ATOM 2396 HE1 HIE 320 -11.224 -6.395 3.018 0.00 0.00 +0.000 HD +ATOM 2397 NE2 HIE 320 -13.094 -7.268 3.099 0.00 0.00 +0.000 N +ATOM 2398 HE2 HIE 320 -13.305 -7.253 4.087 0.00 0.00 +0.000 HD +ATOM 2399 CD2 HIE 320 -13.922 -7.773 2.122 0.00 0.00 +0.000 A +ATOM 2400 HD2 HIE 320 -14.814 -8.185 2.260 0.00 0.00 +0.000 HD +ATOM 2401 C HIE 320 -14.408 -5.537 -0.782 0.00 0.00 +0.000 C +ATOM 2402 O HIE 320 -13.615 -5.004 -1.559 0.00 0.00 +0.000 OA +ATOM 2403 N VAL 321 -14.952 -4.910 0.258 0.00 0.00 +0.000 N +ATOM 2404 H VAL 321 -15.604 -5.489 0.824 0.00 0.00 +0.000 HD +ATOM 2405 CA VAL 321 -14.645 -3.513 0.566 0.00 0.00 +0.000 C +ATOM 2406 HA VAL 321 -14.327 -3.069 -0.278 0.00 0.00 +0.000 HD +ATOM 2407 CB VAL 321 -15.896 -2.762 1.098 0.00 0.00 +0.000 C +ATOM 2408 HB VAL 321 -15.663 -1.800 1.156 0.00 0.00 +0.000 HD +ATOM 2409 CG1 VAL 321 -17.041 -2.889 0.101 0.00 0.00 +0.000 C +ATOM 2410 HG11 VAL 321 -16.676 -2.876 -0.829 0.00 0.00 +0.000 HD +ATOM 2411 HG12 VAL 321 -17.525 -3.750 0.257 0.00 0.00 +0.000 HD +ATOM 2412 HG13 VAL 321 -17.674 -2.125 0.221 0.00 0.00 +0.000 HD +ATOM 2413 CG2 VAL 321 -16.310 -3.320 2.445 0.00 0.00 +0.000 C +ATOM 2414 HG21 VAL 321 -16.918 -4.103 2.309 0.00 0.00 +0.000 HD +ATOM 2415 HG22 VAL 321 -15.496 -3.613 2.949 0.00 0.00 +0.000 HD +ATOM 2416 HG23 VAL 321 -16.789 -2.612 2.966 0.00 0.00 +0.000 HD +ATOM 2417 C VAL 321 -13.520 -3.423 1.597 0.00 0.00 +0.000 C +ATOM 2418 O VAL 321 -12.468 -2.832 1.254 0.00 0.00 +0.000 OA +ATOM 2419 OXT VAL 321 -13.431 -3.824 2.731 0.00 0.00 +0.000 OA +TER diff --git a/receptor/pdbqt_files/AFv6_MCL1_171-321_wt_H.pdbqt b/receptor/pdbqt_files/AFv6_MCL1_171-321_wt_H.pdbqt new file mode 100644 index 0000000..3baae26 --- /dev/null +++ b/receptor/pdbqt_files/AFv6_MCL1_171-321_wt_H.pdbqt @@ -0,0 +1,2451 @@ +REMARK Name = ../receptor/AFv6_MCL1_171-321_wt_H.pdb +REMARK x y z vdW Elec q Type +REMARK _______ _______ _______ _____ _____ ______ ____ +ATOM 1 N GLU 171 -21.539 -30.540 -8.894 0.00 0.00 +0.000 N +ATOM 2 H1 GLU 171 -22.092 -30.516 -8.049 0.00 0.00 +0.000 HD +ATOM 3 H2 GLU 171 -20.728 -29.951 -8.769 0.00 0.00 +0.000 HD +ATOM 4 H3 GLU 171 -21.424 -31.502 -9.179 0.00 0.00 +0.000 HD +ATOM 5 CA GLU 171 -22.307 -29.917 -9.952 0.00 0.00 +0.000 C +ATOM 6 HA GLU 171 -21.764 -29.057 -10.347 0.00 0.00 +0.000 HD +ATOM 7 CB GLU 171 -22.546 -30.912 -11.093 0.00 0.00 +0.000 C +ATOM 8 HB2 GLU 171 -22.717 -31.898 -10.660 0.00 0.00 +0.000 HD +ATOM 9 HB3 GLU 171 -23.433 -30.598 -11.644 0.00 0.00 +0.000 HD +ATOM 10 CG GLU 171 -21.347 -30.975 -12.050 0.00 0.00 +0.000 C +ATOM 11 HG2 GLU 171 -21.098 -29.917 -12.125 0.00 0.00 +0.000 HD +ATOM 12 HG3 GLU 171 -20.481 -31.526 -11.682 0.00 0.00 +0.000 HD +ATOM 13 CD GLU 171 -21.738 -31.506 -13.431 0.00 0.00 +0.000 C +ATOM 14 OE1 GLU 171 -20.925 -32.237 -14.031 0.00 0.00 +0.000 OA +ATOM 15 OE2 GLU 171 -22.779 -31.019 -13.947 0.00 0.00 +0.000 OA +ATOM 16 C GLU 171 -23.637 -29.350 -9.453 0.00 0.00 +0.000 C +ATOM 17 O GLU 171 -23.992 -28.209 -9.793 0.00 0.00 +0.000 OA +ATOM 18 N ASP 172 -24.327 -30.123 -8.625 0.00 0.00 +0.000 N +ATOM 19 H ASP 172 -23.970 -31.052 -8.450 0.00 0.00 +0.000 HD +ATOM 20 CA ASP 172 -25.595 -29.748 -8.023 0.00 0.00 +0.000 C +ATOM 21 HA ASP 172 -26.244 -29.271 -8.758 0.00 0.00 +0.000 HD +ATOM 22 CB ASP 172 -26.288 -31.016 -7.505 0.00 0.00 +0.000 C +ATOM 23 HB2 ASP 172 -25.453 -31.555 -7.059 0.00 0.00 +0.000 HD +ATOM 24 HB3 ASP 172 -27.040 -30.816 -6.742 0.00 0.00 +0.000 HD +ATOM 25 CG ASP 172 -26.908 -31.866 -8.624 0.00 0.00 +0.000 C +ATOM 26 OD1 ASP 172 -27.081 -31.331 -9.747 0.00 0.00 +0.000 OA +ATOM 27 OD2 ASP 172 -27.332 -32.994 -8.297 0.00 0.00 +0.000 OA +ATOM 28 C ASP 172 -25.423 -28.704 -6.915 0.00 0.00 +0.000 C +ATOM 29 O ASP 172 -26.259 -27.806 -6.781 0.00 0.00 +0.000 OA +ATOM 30 N GLU 173 -24.321 -28.732 -6.158 0.00 0.00 +0.000 N +ATOM 31 H GLU 173 -23.668 -29.494 -6.264 0.00 0.00 +0.000 HD +ATOM 32 CA GLU 173 -24.092 -27.764 -5.081 0.00 0.00 +0.000 C +ATOM 33 HA GLU 173 -24.993 -27.661 -4.477 0.00 0.00 +0.000 HD +ATOM 34 CB GLU 173 -22.944 -28.236 -4.175 0.00 0.00 +0.000 C +ATOM 35 HB2 GLU 173 -23.206 -29.236 -3.828 0.00 0.00 +0.000 HD +ATOM 36 HB3 GLU 173 -22.052 -28.291 -4.800 0.00 0.00 +0.000 HD +ATOM 37 CG GLU 173 -22.665 -27.327 -2.961 0.00 0.00 +0.000 C +ATOM 38 HG2 GLU 173 -21.789 -27.743 -2.463 0.00 0.00 +0.000 HD +ATOM 39 HG3 GLU 173 -22.416 -26.350 -3.377 0.00 0.00 +0.000 HD +ATOM 40 CD GLU 173 -23.813 -27.174 -1.941 0.00 0.00 +0.000 C +ATOM 41 OE1 GLU 173 -23.716 -26.295 -1.050 0.00 0.00 +0.000 OA +ATOM 42 OE2 GLU 173 -24.847 -27.881 -1.961 0.00 0.00 +0.000 OA +ATOM 43 C GLU 173 -23.869 -26.342 -5.618 0.00 0.00 +0.000 C +ATOM 44 O GLU 173 -24.464 -25.398 -5.088 0.00 0.00 +0.000 OA +ATOM 45 N LEU 174 -23.090 -26.164 -6.698 0.00 0.00 +0.000 N +ATOM 46 H LEU 174 -22.566 -26.943 -7.070 0.00 0.00 +0.000 HD +ATOM 47 CA LEU 174 -22.914 -24.843 -7.323 0.00 0.00 +0.000 C +ATOM 48 HA LEU 174 -22.586 -24.121 -6.574 0.00 0.00 +0.000 HD +ATOM 49 CB LEU 174 -21.853 -24.912 -8.440 0.00 0.00 +0.000 C +ATOM 50 HB2 LEU 174 -20.935 -25.266 -7.969 0.00 0.00 +0.000 HD +ATOM 51 HB3 LEU 174 -22.188 -25.640 -9.179 0.00 0.00 +0.000 HD +ATOM 52 CG LEU 174 -21.585 -23.557 -9.136 0.00 0.00 +0.000 C +ATOM 53 HG LEU 174 -22.536 -23.174 -9.504 0.00 0.00 +0.000 HD +ATOM 54 CD1 LEU 174 -20.950 -22.527 -8.195 0.00 0.00 +0.000 C +ATOM 55 HD11 LEU 174 -19.998 -22.909 -7.827 0.00 0.00 +0.000 HD +ATOM 56 HD12 LEU 174 -20.782 -21.595 -8.734 0.00 0.00 +0.000 HD +ATOM 57 HD13 LEU 174 -21.617 -22.344 -7.352 0.00 0.00 +0.000 HD +ATOM 58 CD2 LEU 174 -20.655 -23.748 -10.333 0.00 0.00 +0.000 C +ATOM 59 HD21 LEU 174 -21.116 -24.428 -11.048 0.00 0.00 +0.000 HD +ATOM 60 HD22 LEU 174 -20.476 -22.785 -10.812 0.00 0.00 +0.000 HD +ATOM 61 HD23 LEU 174 -19.707 -24.166 -9.994 0.00 0.00 +0.000 HD +ATOM 62 C LEU 174 -24.243 -24.308 -7.870 0.00 0.00 +0.000 C +ATOM 63 O LEU 174 -24.538 -23.117 -7.724 0.00 0.00 +0.000 OA +ATOM 64 N TYR 175 -25.052 -25.176 -8.485 0.00 0.00 +0.000 N +ATOM 65 H TYR 175 -24.720 -26.115 -8.653 0.00 0.00 +0.000 HD +ATOM 66 CA TYR 175 -26.368 -24.805 -8.996 0.00 0.00 +0.000 C +ATOM 67 HA TYR 175 -26.284 -23.936 -9.648 0.00 0.00 +0.000 HD +ATOM 68 CB TYR 175 -26.963 -25.964 -9.801 0.00 0.00 +0.000 C +ATOM 69 HB2 TYR 175 -26.256 -26.295 -10.561 0.00 0.00 +0.000 HD +ATOM 70 HB3 TYR 175 -27.142 -26.774 -9.094 0.00 0.00 +0.000 HD +ATOM 71 CG TYR 175 -28.268 -25.576 -10.460 0.00 0.00 +0.000 A +ATOM 72 CD1 TYR 175 -29.486 -25.721 -9.767 0.00 0.00 +0.000 A +ATOM 73 HD1 TYR 175 -29.495 -26.151 -8.766 0.00 0.00 +0.000 HD +ATOM 74 CE1 TYR 175 -30.690 -25.310 -10.369 0.00 0.00 +0.000 A +ATOM 75 HE1 TYR 175 -31.629 -25.390 -9.820 0.00 0.00 +0.000 HD +ATOM 76 CZ TYR 175 -30.678 -24.769 -11.668 0.00 0.00 +0.000 A +ATOM 77 OH TYR 175 -31.846 -24.418 -12.258 0.00 0.00 +0.000 OA +ATOM 78 HH TYR 175 -32.611 -24.581 -11.701 0.00 0.00 +0.000 HD +ATOM 79 CE2 TYR 175 -29.454 -24.625 -12.355 0.00 0.00 +0.000 A +ATOM 80 HE2 TYR 175 -29.445 -24.200 -13.359 0.00 0.00 +0.000 HD +ATOM 81 CD2 TYR 175 -28.251 -25.025 -11.752 0.00 0.00 +0.000 A +ATOM 82 HD2 TYR 175 -27.308 -24.908 -12.286 0.00 0.00 +0.000 HD +ATOM 83 C TYR 175 -27.301 -24.382 -7.860 0.00 0.00 +0.000 C +ATOM 84 O TYR 175 -27.832 -23.271 -7.869 0.00 0.00 +0.000 OA +ATOM 85 N ARG 176 -27.428 -25.226 -6.831 0.00 0.00 +0.000 N +ATOM 86 H ARG 176 -26.933 -26.104 -6.902 0.00 0.00 +0.000 HD +ATOM 87 CA ARG 176 -28.265 -24.993 -5.652 0.00 0.00 +0.000 C +ATOM 88 HA ARG 176 -29.313 -24.866 -5.927 0.00 0.00 +0.000 HD +ATOM 89 CB ARG 176 -28.142 -26.233 -4.753 0.00 0.00 +0.000 C +ATOM 90 HB2 ARG 176 -28.266 -27.113 -5.383 0.00 0.00 +0.000 HD +ATOM 91 HB3 ARG 176 -27.140 -26.233 -4.324 0.00 0.00 +0.000 HD +ATOM 92 CG ARG 176 -29.179 -26.262 -3.625 0.00 0.00 +0.000 C +ATOM 93 HG2 ARG 176 -29.237 -25.268 -3.182 0.00 0.00 +0.000 HD +ATOM 94 HG3 ARG 176 -30.147 -26.526 -4.051 0.00 0.00 +0.000 HD +ATOM 95 CD ARG 176 -28.799 -27.286 -2.539 0.00 0.00 +0.000 C +ATOM 96 HD2 ARG 176 -29.628 -27.364 -1.836 0.00 0.00 +0.000 HD +ATOM 97 HD3 ARG 176 -28.638 -28.252 -3.019 0.00 0.00 +0.000 HD +ATOM 98 NE ARG 176 -27.575 -26.918 -1.792 0.00 0.00 +0.000 N +ATOM 99 HE ARG 176 -26.818 -27.580 -1.883 0.00 0.00 +0.000 HD +ATOM 100 CZ ARG 176 -27.396 -25.859 -1.027 0.00 0.00 +0.000 C +ATOM 101 NH1 ARG 176 -28.341 -24.989 -0.779 0.00 0.00 +0.000 N +ATOM 102 HH11 ARG 176 -29.258 -25.116 -1.181 0.00 0.00 +0.000 HD +ATOM 103 HH12 ARG 176 -28.149 -24.194 -0.186 0.00 0.00 +0.000 HD +ATOM 104 NH2 ARG 176 -26.241 -25.617 -0.498 0.00 0.00 +0.000 N +ATOM 105 HH21 ARG 176 -25.468 -26.244 -0.671 0.00 0.00 +0.000 HD +ATOM 106 HH22 ARG 176 -26.118 -24.801 0.085 0.00 0.00 +0.000 HD +ATOM 107 C ARG 176 -27.860 -23.719 -4.912 0.00 0.00 +0.000 C +ATOM 108 O ARG 176 -28.725 -22.945 -4.505 0.00 0.00 +0.000 OA +ATOM 109 N GLN 177 -26.558 -23.480 -4.753 0.00 0.00 +0.000 N +ATOM 110 H GLN 177 -25.902 -24.196 -5.030 0.00 0.00 +0.000 HD +ATOM 111 CA GLN 177 -26.033 -22.260 -4.140 0.00 0.00 +0.000 C +ATOM 112 HA GLN 177 -26.491 -22.098 -3.164 0.00 0.00 +0.000 HD +ATOM 113 CB GLN 177 -24.513 -22.396 -3.953 0.00 0.00 +0.000 C +ATOM 114 HB2 GLN 177 -24.299 -23.331 -3.433 0.00 0.00 +0.000 HD +ATOM 115 HB3 GLN 177 -24.032 -22.406 -4.931 0.00 0.00 +0.000 HD +ATOM 116 CG GLN 177 -23.975 -21.220 -3.131 0.00 0.00 +0.000 C +ATOM 117 HG2 GLN 177 -24.310 -20.281 -3.573 0.00 0.00 +0.000 HD +ATOM 118 HG3 GLN 177 -24.413 -21.330 -2.139 0.00 0.00 +0.000 HD +ATOM 119 CD GLN 177 -22.461 -21.178 -2.993 0.00 0.00 +0.000 C +ATOM 120 OE1 GLN 177 -21.697 -21.805 -3.702 0.00 0.00 +0.000 OA +ATOM 121 NE2 GLN 177 -21.967 -20.373 -2.081 0.00 0.00 +0.000 N +ATOM 122 HE21 GLN 177 -20.967 -20.312 -1.953 0.00 0.00 +0.000 HD +ATOM 123 HE22 GLN 177 -22.590 -19.819 -1.511 0.00 0.00 +0.000 HD +ATOM 124 C GLN 177 -26.371 -21.019 -4.978 0.00 0.00 +0.000 C +ATOM 125 O GLN 177 -26.834 -20.015 -4.435 0.00 0.00 +0.000 OA +ATOM 126 N SER 178 -26.163 -21.087 -6.295 0.00 0.00 +0.000 N +ATOM 127 H SER 178 -25.752 -21.928 -6.675 0.00 0.00 +0.000 HD +ATOM 128 CA SER 178 -26.452 -19.977 -7.213 0.00 0.00 +0.000 C +ATOM 129 HA SER 178 -25.930 -19.079 -6.882 0.00 0.00 +0.000 HD +ATOM 130 CB SER 178 -25.986 -20.318 -8.630 0.00 0.00 +0.000 C +ATOM 131 HB2 SER 178 -26.538 -21.187 -8.988 0.00 0.00 +0.000 HD +ATOM 132 HB3 SER 178 -26.182 -19.468 -9.284 0.00 0.00 +0.000 HD +ATOM 133 OG SER 178 -24.601 -20.605 -8.634 0.00 0.00 +0.000 OA +ATOM 134 HG SER 178 -24.321 -20.817 -9.527 0.00 0.00 +0.000 HD +ATOM 135 C SER 178 -27.939 -19.632 -7.225 0.00 0.00 +0.000 C +ATOM 136 O SER 178 -28.290 -18.458 -7.098 0.00 0.00 +0.000 OA +ATOM 137 N LEU 179 -28.800 -20.652 -7.278 0.00 0.00 +0.000 N +ATOM 138 H LEU 179 -28.429 -21.584 -7.403 0.00 0.00 +0.000 HD +ATOM 139 CA LEU 179 -30.248 -20.487 -7.227 0.00 0.00 +0.000 C +ATOM 140 HA LEU 179 -30.579 -19.816 -8.020 0.00 0.00 +0.000 HD +ATOM 141 CB LEU 179 -30.932 -21.854 -7.421 0.00 0.00 +0.000 C +ATOM 142 HB2 LEU 179 -30.526 -22.298 -8.330 0.00 0.00 +0.000 HD +ATOM 143 HB3 LEU 179 -30.669 -22.475 -6.565 0.00 0.00 +0.000 HD +ATOM 144 CG LEU 179 -32.466 -21.761 -7.537 0.00 0.00 +0.000 C +ATOM 145 HG LEU 179 -32.852 -21.314 -6.621 0.00 0.00 +0.000 HD +ATOM 146 CD1 LEU 179 -32.896 -20.918 -8.735 0.00 0.00 +0.000 C +ATOM 147 HD11 LEU 179 -32.512 -21.365 -9.652 0.00 0.00 +0.000 HD +ATOM 148 HD12 LEU 179 -33.985 -20.879 -8.780 0.00 0.00 +0.000 HD +ATOM 149 HD13 LEU 179 -32.500 -19.908 -8.630 0.00 0.00 +0.000 HD +ATOM 150 CD2 LEU 179 -33.047 -23.163 -7.705 0.00 0.00 +0.000 C +ATOM 151 HD21 LEU 179 -32.783 -23.772 -6.841 0.00 0.00 +0.000 HD +ATOM 152 HD22 LEU 179 -34.131 -23.100 -7.787 0.00 0.00 +0.000 HD +ATOM 153 HD23 LEU 179 -32.641 -23.619 -8.607 0.00 0.00 +0.000 HD +ATOM 154 C LEU 179 -30.682 -19.844 -5.911 0.00 0.00 +0.000 C +ATOM 155 O LEU 179 -31.489 -18.917 -5.915 0.00 0.00 +0.000 OA +ATOM 156 N GLU 180 -30.121 -20.285 -4.781 0.00 0.00 +0.000 N +ATOM 157 H GLU 180 -29.515 -21.091 -4.825 0.00 0.00 +0.000 HD +ATOM 158 CA GLU 180 -30.434 -19.722 -3.466 0.00 0.00 +0.000 C +ATOM 159 HA GLU 180 -31.509 -19.748 -3.291 0.00 0.00 +0.000 HD +ATOM 160 CB GLU 180 -29.735 -20.551 -2.368 0.00 0.00 +0.000 C +ATOM 161 HB2 GLU 180 -30.141 -21.563 -2.390 0.00 0.00 +0.000 HD +ATOM 162 HB3 GLU 180 -28.668 -20.584 -2.589 0.00 0.00 +0.000 HD +ATOM 163 CG GLU 180 -29.949 -19.946 -0.975 0.00 0.00 +0.000 C +ATOM 164 HG2 GLU 180 -29.255 -19.106 -0.949 0.00 0.00 +0.000 HD +ATOM 165 HG3 GLU 180 -30.970 -19.575 -0.881 0.00 0.00 +0.000 HD +ATOM 166 CD GLU 180 -29.642 -20.899 0.188 0.00 0.00 +0.000 C +ATOM 167 OE1 GLU 180 -30.475 -20.901 1.127 0.00 0.00 +0.000 OA +ATOM 168 OE2 GLU 180 -28.581 -21.569 0.227 0.00 0.00 +0.000 OA +ATOM 169 C GLU 180 -30.079 -18.227 -3.378 0.00 0.00 +0.000 C +ATOM 170 O GLU 180 -30.871 -17.436 -2.862 0.00 0.00 +0.000 OA +ATOM 171 N ILE 181 -28.918 -17.825 -3.898 0.00 0.00 +0.000 N +ATOM 172 H ILE 181 -28.288 -18.528 -4.258 0.00 0.00 +0.000 HD +ATOM 173 CA ILE 181 -28.466 -16.426 -3.883 0.00 0.00 +0.000 C +ATOM 174 HA ILE 181 -28.618 -15.978 -2.901 0.00 0.00 +0.000 HD +ATOM 175 CB ILE 181 -26.965 -16.362 -4.252 0.00 0.00 +0.000 C +ATOM 176 HB ILE 181 -26.809 -16.933 -5.168 0.00 0.00 +0.000 HD +ATOM 177 CG2 ILE 181 -26.500 -14.911 -4.468 0.00 0.00 +0.000 C +ATOM 178 HG21 ILE 181 -26.655 -14.340 -3.552 0.00 0.00 +0.000 HD +ATOM 179 HG22 ILE 181 -25.441 -14.903 -4.725 0.00 0.00 +0.000 HD +ATOM 180 HG23 ILE 181 -27.075 -14.462 -5.278 0.00 0.00 +0.000 HD +ATOM 181 CG1 ILE 181 -26.107 -17.017 -3.145 0.00 0.00 +0.000 C +ATOM 182 HG12 ILE 181 -26.047 -16.318 -2.310 0.00 0.00 +0.000 HD +ATOM 183 HG13 ILE 181 -26.615 -17.925 -2.821 0.00 0.00 +0.000 HD +ATOM 184 CD1 ILE 181 -24.693 -17.365 -3.620 0.00 0.00 +0.000 C +ATOM 185 HD11 ILE 181 -24.184 -16.456 -3.943 0.00 0.00 +0.000 HD +ATOM 186 HD12 ILE 181 -24.136 -17.822 -2.802 0.00 0.00 +0.000 HD +ATOM 187 HD13 ILE 181 -24.751 -18.064 -4.454 0.00 0.00 +0.000 HD +ATOM 188 C ILE 181 -29.335 -15.562 -4.807 0.00 0.00 +0.000 C +ATOM 189 O ILE 181 -29.830 -14.512 -4.384 0.00 0.00 +0.000 OA +ATOM 190 N ILE 182 -29.540 -15.997 -6.055 0.00 0.00 +0.000 N +ATOM 191 H ILE 182 -29.107 -16.869 -6.323 0.00 0.00 +0.000 HD +ATOM 192 CA ILE 182 -30.261 -15.231 -7.082 0.00 0.00 +0.000 C +ATOM 193 HA ILE 182 -29.915 -14.197 -7.095 0.00 0.00 +0.000 HD +ATOM 194 CB ILE 182 -30.041 -15.865 -8.478 0.00 0.00 +0.000 C +ATOM 195 HB ILE 182 -30.272 -16.929 -8.413 0.00 0.00 +0.000 HD +ATOM 196 CG2 ILE 182 -30.939 -15.208 -9.546 0.00 0.00 +0.000 C +ATOM 197 HG21 ILE 182 -30.708 -14.144 -9.610 0.00 0.00 +0.000 HD +ATOM 198 HG22 ILE 182 -30.759 -15.677 -10.512 0.00 0.00 +0.000 HD +ATOM 199 HG23 ILE 182 -31.986 -15.336 -9.270 0.00 0.00 +0.000 HD +ATOM 200 CG1 ILE 182 -28.555 -15.719 -8.891 0.00 0.00 +0.000 C +ATOM 201 HG12 ILE 182 -28.396 -14.672 -9.148 0.00 0.00 +0.000 HD +ATOM 202 HG13 ILE 182 -27.954 -15.975 -8.020 0.00 0.00 +0.000 HD +ATOM 203 CD1 ILE 182 -28.142 -16.603 -10.073 0.00 0.00 +0.000 C +ATOM 204 HD11 ILE 182 -28.743 -16.348 -10.947 0.00 0.00 +0.000 HD +ATOM 205 HD12 ILE 182 -27.088 -16.440 -10.299 0.00 0.00 +0.000 HD +ATOM 206 HD13 ILE 182 -28.301 -17.651 -9.817 0.00 0.00 +0.000 HD +ATOM 207 C ILE 182 -31.744 -15.100 -6.719 0.00 0.00 +0.000 C +ATOM 208 O ILE 182 -32.277 -13.989 -6.739 0.00 0.00 +0.000 OA +ATOM 209 N SER 183 -32.399 -16.194 -6.318 0.00 0.00 +0.000 N +ATOM 210 H SER 183 -31.900 -17.072 -6.287 0.00 0.00 +0.000 HD +ATOM 211 CA SER 183 -33.830 -16.192 -5.976 0.00 0.00 +0.000 C +ATOM 212 HA SER 183 -34.397 -15.770 -6.805 0.00 0.00 +0.000 HD +ATOM 213 CB SER 183 -34.348 -17.608 -5.699 0.00 0.00 +0.000 C +ATOM 214 HB2 SER 183 -33.900 -17.989 -4.781 0.00 0.00 +0.000 HD +ATOM 215 HB3 SER 183 -35.433 -17.586 -5.590 0.00 0.00 +0.000 HD +ATOM 216 OG SER 183 -34.002 -18.446 -6.771 0.00 0.00 +0.000 OA +ATOM 217 HG SER 183 -34.325 -19.333 -6.600 0.00 0.00 +0.000 HD +ATOM 218 C SER 183 -34.118 -15.305 -4.772 0.00 0.00 +0.000 C +ATOM 219 O SER 183 -35.060 -14.509 -4.798 0.00 0.00 +0.000 OA +ATOM 220 N ARG 184 -33.268 -15.359 -3.735 0.00 0.00 +0.000 N +ATOM 221 H ARG 184 -32.562 -16.080 -3.703 0.00 0.00 +0.000 HD +ATOM 222 CA ARG 184 -33.385 -14.446 -2.590 0.00 0.00 +0.000 C +ATOM 223 HA ARG 184 -34.394 -14.504 -2.182 0.00 0.00 +0.000 HD +ATOM 224 CB ARG 184 -32.389 -14.808 -1.487 0.00 0.00 +0.000 C +ATOM 225 HB2 ARG 184 -31.415 -14.969 -1.948 0.00 0.00 +0.000 HD +ATOM 226 HB3 ARG 184 -32.328 -13.969 -0.795 0.00 0.00 +0.000 HD +ATOM 227 CG ARG 184 -32.809 -16.072 -0.723 0.00 0.00 +0.000 C +ATOM 228 HG2 ARG 184 -33.742 -15.898 -0.187 0.00 0.00 +0.000 HD +ATOM 229 HG3 ARG 184 -32.936 -16.906 -1.413 0.00 0.00 +0.000 HD +ATOM 230 CD ARG 184 -31.702 -16.404 0.278 0.00 0.00 +0.000 C +ATOM 231 HD2 ARG 184 -30.753 -16.460 -0.255 0.00 0.00 +0.000 HD +ATOM 232 HD3 ARG 184 -31.652 -15.609 1.023 0.00 0.00 +0.000 HD +ATOM 233 NE ARG 184 -31.933 -17.684 0.967 0.00 0.00 +0.000 N +ATOM 234 HE ARG 184 -32.006 -18.473 0.343 0.00 0.00 +0.000 HD +ATOM 235 CZ ARG 184 -32.080 -17.889 2.259 0.00 0.00 +0.000 C +ATOM 236 NH1 ARG 184 -32.196 -16.911 3.112 0.00 0.00 +0.000 N +ATOM 237 HH11 ARG 184 -32.175 -15.955 2.787 0.00 0.00 +0.000 HD +ATOM 238 HH12 ARG 184 -32.307 -17.114 4.096 0.00 0.00 +0.000 HD +ATOM 239 NH2 ARG 184 -32.074 -19.112 2.698 0.00 0.00 +0.000 N +ATOM 240 HH21 ARG 184 -31.957 -19.878 2.050 0.00 0.00 +0.000 HD +ATOM 241 HH22 ARG 184 -32.186 -19.291 3.686 0.00 0.00 +0.000 HD +ATOM 242 C ARG 184 -33.206 -12.997 -3.024 0.00 0.00 +0.000 C +ATOM 243 O ARG 184 -34.047 -12.180 -2.675 0.00 0.00 +0.000 OA +ATOM 244 N TYR 185 -32.179 -12.670 -3.810 0.00 0.00 +0.000 N +ATOM 245 H TYR 185 -31.489 -13.366 -4.054 0.00 0.00 +0.000 HD +ATOM 246 CA TYR 185 -31.968 -11.292 -4.266 0.00 0.00 +0.000 C +ATOM 247 HA TYR 185 -31.880 -10.627 -3.407 0.00 0.00 +0.000 HD +ATOM 248 CB TYR 185 -30.679 -11.198 -5.094 0.00 0.00 +0.000 C +ATOM 249 HB2 TYR 185 -29.843 -11.579 -4.507 0.00 0.00 +0.000 HD +ATOM 250 HB3 TYR 185 -30.836 -11.841 -5.960 0.00 0.00 +0.000 HD +ATOM 251 CG TYR 185 -30.368 -9.787 -5.562 0.00 0.00 +0.000 A +ATOM 252 CD1 TYR 185 -30.349 -9.492 -6.938 0.00 0.00 +0.000 A +ATOM 253 HD1 TYR 185 -30.531 -10.284 -7.663 0.00 0.00 +0.000 HD +ATOM 254 CE1 TYR 185 -30.096 -8.176 -7.379 0.00 0.00 +0.000 A +ATOM 255 HE1 TYR 185 -30.021 -7.967 -8.446 0.00 0.00 +0.000 HD +ATOM 256 CZ TYR 185 -29.898 -7.140 -6.441 0.00 0.00 +0.000 A +ATOM 257 OH TYR 185 -29.721 -5.856 -6.860 0.00 0.00 +0.000 OA +ATOM 258 HH TYR 185 -29.750 -5.765 -7.816 0.00 0.00 +0.000 HD +ATOM 259 CE2 TYR 185 -29.926 -7.436 -5.063 0.00 0.00 +0.000 A +ATOM 260 HE2 TYR 185 -29.778 -6.638 -4.336 0.00 0.00 +0.000 HD +ATOM 261 CD2 TYR 185 -30.145 -8.759 -4.624 0.00 0.00 +0.000 A +ATOM 262 HD2 TYR 185 -30.143 -8.986 -3.558 0.00 0.00 +0.000 HD +ATOM 263 C TYR 185 -33.166 -10.746 -5.058 0.00 0.00 +0.000 C +ATOM 264 O TYR 185 -33.653 -9.657 -4.760 0.00 0.00 +0.000 OA +ATOM 265 N LEU 186 -33.691 -11.513 -6.020 0.00 0.00 +0.000 N +ATOM 266 H LEU 186 -33.230 -12.384 -6.240 0.00 0.00 +0.000 HD +ATOM 267 CA LEU 186 -34.859 -11.122 -6.820 0.00 0.00 +0.000 C +ATOM 268 HA LEU 186 -34.689 -10.154 -7.292 0.00 0.00 +0.000 HD +ATOM 269 CB LEU 186 -35.096 -12.173 -7.923 0.00 0.00 +0.000 C +ATOM 270 HB2 LEU 186 -34.649 -13.095 -7.553 0.00 0.00 +0.000 HD +ATOM 271 HB3 LEU 186 -36.170 -12.312 -8.043 0.00 0.00 +0.000 HD +ATOM 272 CG LEU 186 -34.471 -11.809 -9.280 0.00 0.00 +0.000 C +ATOM 273 HG LEU 186 -34.948 -10.890 -9.619 0.00 0.00 +0.000 HD +ATOM 274 CD1 LEU 186 -32.955 -11.609 -9.229 0.00 0.00 +0.000 C +ATOM 275 HD11 LEU 186 -32.477 -12.528 -8.890 0.00 0.00 +0.000 HD +ATOM 276 HD12 LEU 186 -32.589 -11.355 -10.223 0.00 0.00 +0.000 HD +ATOM 277 HD13 LEU 186 -32.718 -10.800 -8.538 0.00 0.00 +0.000 HD +ATOM 278 CD2 LEU 186 -34.781 -12.902 -10.299 0.00 0.00 +0.000 C +ATOM 279 HD21 LEU 186 -35.861 -12.998 -10.413 0.00 0.00 +0.000 HD +ATOM 280 HD22 LEU 186 -34.336 -12.640 -11.259 0.00 0.00 +0.000 HD +ATOM 281 HD23 LEU 186 -34.367 -13.849 -9.953 0.00 0.00 +0.000 HD +ATOM 282 C LEU 186 -36.115 -10.940 -5.959 0.00 0.00 +0.000 C +ATOM 283 O LEU 186 -36.826 -9.945 -6.110 0.00 0.00 +0.000 OA +ATOM 284 N ARG 187 -36.372 -11.863 -5.023 0.00 0.00 +0.000 N +ATOM 285 H ARG 187 -35.782 -12.682 -4.989 0.00 0.00 +0.000 HD +ATOM 286 CA ARG 187 -37.516 -11.789 -4.103 0.00 0.00 +0.000 C +ATOM 287 HA ARG 187 -38.444 -11.626 -4.652 0.00 0.00 +0.000 HD +ATOM 288 CB ARG 187 -37.621 -13.120 -3.347 0.00 0.00 +0.000 C +ATOM 289 HB2 ARG 187 -37.540 -13.926 -4.078 0.00 0.00 +0.000 HD +ATOM 290 HB3 ARG 187 -36.784 -13.175 -2.652 0.00 0.00 +0.000 HD +ATOM 291 CG ARG 187 -38.941 -13.264 -2.571 0.00 0.00 +0.000 C +ATOM 292 HG2 ARG 187 -39.048 -12.406 -1.906 0.00 0.00 +0.000 HD +ATOM 293 HG3 ARG 187 -39.764 -13.273 -3.286 0.00 0.00 +0.000 HD +ATOM 294 CD ARG 187 -38.965 -14.559 -1.745 0.00 0.00 +0.000 C +ATOM 295 HD2 ARG 187 -38.164 -14.519 -1.007 0.00 0.00 +0.000 HD +ATOM 296 HD3 ARG 187 -39.925 -14.632 -1.236 0.00 0.00 +0.000 HD +ATOM 297 NE ARG 187 -38.778 -15.765 -2.581 0.00 0.00 +0.000 N +ATOM 298 HE ARG 187 -39.228 -15.719 -3.483 0.00 0.00 +0.000 HD +ATOM 299 CZ ARG 187 -38.110 -16.862 -2.263 0.00 0.00 +0.000 C +ATOM 300 NH1 ARG 187 -37.549 -17.040 -1.095 0.00 0.00 +0.000 N +ATOM 301 HH11 ARG 187 -37.617 -16.320 -0.390 0.00 0.00 +0.000 HD +ATOM 302 HH12 ARG 187 -37.049 -17.898 -0.903 0.00 0.00 +0.000 HD +ATOM 303 NH2 ARG 187 -37.977 -17.825 -3.132 0.00 0.00 +0.000 N +ATOM 304 HH21 ARG 187 -38.386 -17.731 -4.052 0.00 0.00 +0.000 HD +ATOM 305 HH22 ARG 187 -37.466 -18.659 -2.883 0.00 0.00 +0.000 HD +ATOM 306 C ARG 187 -37.412 -10.599 -3.150 0.00 0.00 +0.000 C +ATOM 307 O ARG 187 -38.406 -9.906 -2.941 0.00 0.00 +0.000 OA +ATOM 308 N GLU 188 -36.224 -10.325 -2.611 0.00 0.00 +0.000 N +ATOM 309 H GLU 188 -35.465 -10.973 -2.768 0.00 0.00 +0.000 HD +ATOM 310 CA GLU 188 -35.973 -9.149 -1.767 0.00 0.00 +0.000 C +ATOM 311 HA GLU 188 -36.668 -9.149 -0.927 0.00 0.00 +0.000 HD +ATOM 312 CB GLU 188 -34.537 -9.160 -1.216 0.00 0.00 +0.000 C +ATOM 313 HB2 GLU 188 -33.863 -9.354 -2.051 0.00 0.00 +0.000 HD +ATOM 314 HB3 GLU 188 -34.331 -8.171 -0.805 0.00 0.00 +0.000 HD +ATOM 315 CG GLU 188 -34.322 -10.221 -0.127 0.00 0.00 +0.000 C +ATOM 316 HG2 GLU 188 -35.136 -10.058 0.579 0.00 0.00 +0.000 HD +ATOM 317 HG3 GLU 188 -34.406 -11.220 -0.556 0.00 0.00 +0.000 HD +ATOM 318 CD GLU 188 -32.980 -10.091 0.600 0.00 0.00 +0.000 C +ATOM 319 OE1 GLU 188 -32.762 -10.821 1.593 0.00 0.00 +0.000 OA +ATOM 320 OE2 GLU 188 -32.129 -9.232 0.267 0.00 0.00 +0.000 OA +ATOM 321 C GLU 188 -36.205 -7.848 -2.540 0.00 0.00 +0.000 C +ATOM 322 O GLU 188 -36.816 -6.920 -2.015 0.00 0.00 +0.000 OA +ATOM 323 N GLN 189 -35.777 -7.789 -3.804 0.00 0.00 +0.000 N +ATOM 324 H GLN 189 -35.241 -8.564 -4.166 0.00 0.00 +0.000 HD +ATOM 325 CA GLN 189 -35.979 -6.622 -4.666 0.00 0.00 +0.000 C +ATOM 326 HA GLN 189 -35.673 -5.712 -4.150 0.00 0.00 +0.000 HD +ATOM 327 CB GLN 189 -35.128 -6.777 -5.935 0.00 0.00 +0.000 C +ATOM 328 HB2 GLN 189 -35.272 -7.777 -6.343 0.00 0.00 +0.000 HD +ATOM 329 HB3 GLN 189 -35.444 -6.036 -6.670 0.00 0.00 +0.000 HD +ATOM 330 CG GLN 189 -33.644 -6.568 -5.605 0.00 0.00 +0.000 C +ATOM 331 HG2 GLN 189 -33.434 -7.123 -4.691 0.00 0.00 +0.000 HD +ATOM 332 HG3 GLN 189 -33.029 -6.958 -6.415 0.00 0.00 +0.000 HD +ATOM 333 CD GLN 189 -33.282 -5.106 -5.380 0.00 0.00 +0.000 C +ATOM 334 OE1 GLN 189 -33.627 -4.215 -6.160 0.00 0.00 +0.000 OA +ATOM 335 NE2 GLN 189 -32.551 -4.842 -4.324 0.00 0.00 +0.000 N +ATOM 336 HE21 GLN 189 -32.280 -3.889 -4.125 0.00 0.00 +0.000 HD +ATOM 337 HE22 GLN 189 -32.262 -5.593 -3.713 0.00 0.00 +0.000 HD +ATOM 338 C GLN 189 -37.452 -6.404 -5.014 0.00 0.00 +0.000 C +ATOM 339 O GLN 189 -37.911 -5.266 -5.005 0.00 0.00 +0.000 OA +ATOM 340 N ALA 190 -38.197 -7.475 -5.291 0.00 0.00 +0.000 N +ATOM 341 H ALA 190 -37.748 -8.379 -5.318 0.00 0.00 +0.000 HD +ATOM 342 CA ALA 190 -39.615 -7.397 -5.620 0.00 0.00 +0.000 C +ATOM 343 HA ALA 190 -39.775 -6.617 -6.364 0.00 0.00 +0.000 HD +ATOM 344 CB ALA 190 -40.018 -8.741 -6.225 0.00 0.00 +0.000 C +ATOM 345 HB1 ALA 190 -39.873 -9.531 -5.487 0.00 0.00 +0.000 HD +ATOM 346 HB2 ALA 190 -41.067 -8.708 -6.518 0.00 0.00 +0.000 HD +ATOM 347 HB3 ALA 190 -39.403 -8.945 -7.101 0.00 0.00 +0.000 HD +ATOM 348 C ALA 190 -40.490 -7.045 -4.408 0.00 0.00 +0.000 C +ATOM 349 O ALA 190 -41.403 -6.233 -4.517 0.00 0.00 +0.000 OA +ATOM 350 N THR 191 -40.226 -7.651 -3.249 0.00 0.00 +0.000 N +ATOM 351 H THR 191 -39.443 -8.287 -3.203 0.00 0.00 +0.000 HD +ATOM 352 CA THR 191 -41.072 -7.495 -2.051 0.00 0.00 +0.000 C +ATOM 353 HA THR 191 -42.087 -7.214 -2.332 0.00 0.00 +0.000 HD +ATOM 354 CB THR 191 -41.131 -8.793 -1.235 0.00 0.00 +0.000 C +ATOM 355 HB THR 191 -41.773 -8.613 -0.372 0.00 0.00 +0.000 HD +ATOM 356 CG2 THR 191 -41.674 -9.979 -2.035 0.00 0.00 +0.000 C +ATOM 357 HG21 THR 191 -41.033 -10.160 -2.897 0.00 0.00 +0.000 HD +ATOM 358 HG22 THR 191 -41.692 -10.867 -1.403 0.00 0.00 +0.000 HD +ATOM 359 HG23 THR 191 -42.685 -9.756 -2.375 0.00 0.00 +0.000 HD +ATOM 360 OG1 THR 191 -39.850 -9.128 -0.758 0.00 0.00 +0.000 OA +ATOM 361 HG1 THR 191 -39.901 -9.941 -0.249 0.00 0.00 +0.000 HD +ATOM 362 C THR 191 -40.637 -6.353 -1.134 0.00 0.00 +0.000 C +ATOM 363 O THR 191 -41.428 -5.903 -0.308 0.00 0.00 +0.000 OA +ATOM 364 N GLY 192 -39.384 -5.899 -1.237 0.00 0.00 +0.000 N +ATOM 365 H GLY 192 -38.834 -6.218 -2.022 0.00 0.00 +0.000 HD +ATOM 366 CA GLY 192 -38.765 -4.973 -0.286 0.00 0.00 +0.000 C +ATOM 367 HA2 GLY 192 -37.836 -4.616 -0.729 0.00 0.00 +0.000 HD +ATOM 368 HA3 GLY 192 -39.449 -4.134 -0.150 0.00 0.00 +0.000 HD +ATOM 369 C GLY 192 -38.459 -5.594 1.085 0.00 0.00 +0.000 C +ATOM 370 O GLY 192 -37.940 -4.905 1.964 0.00 0.00 +0.000 OA +ATOM 371 N ALA 193 -38.760 -6.882 1.287 0.00 0.00 +0.000 N +ATOM 372 H ALA 193 -39.199 -7.372 0.521 0.00 0.00 +0.000 HD +ATOM 373 CA ALA 193 -38.572 -7.592 2.545 0.00 0.00 +0.000 C +ATOM 374 HA ALA 193 -38.324 -6.881 3.334 0.00 0.00 +0.000 HD +ATOM 375 CB ALA 193 -39.878 -8.301 2.918 0.00 0.00 +0.000 C +ATOM 376 HB1 ALA 193 -40.135 -9.022 2.142 0.00 0.00 +0.000 HD +ATOM 377 HB2 ALA 193 -39.753 -8.820 3.868 0.00 0.00 +0.000 HD +ATOM 378 HB3 ALA 193 -40.678 -7.566 3.008 0.00 0.00 +0.000 HD +ATOM 379 C ALA 193 -37.392 -8.566 2.448 0.00 0.00 +0.000 C +ATOM 380 O ALA 193 -37.286 -9.334 1.495 0.00 0.00 +0.000 OA +ATOM 381 N LYS 194 -36.511 -8.549 3.455 0.00 0.00 +0.000 N +ATOM 382 H LYS 194 -36.582 -7.817 4.146 0.00 0.00 +0.000 HD +ATOM 383 CA LYS 194 -35.380 -9.484 3.543 0.00 0.00 +0.000 C +ATOM 384 HA LYS 194 -34.938 -9.609 2.555 0.00 0.00 +0.000 HD +ATOM 385 CB LYS 194 -34.300 -8.970 4.500 0.00 0.00 +0.000 C +ATOM 386 HB2 LYS 194 -34.772 -8.707 5.447 0.00 0.00 +0.000 HD +ATOM 387 HB3 LYS 194 -33.574 -9.766 4.665 0.00 0.00 +0.000 HD +ATOM 388 CG LYS 194 -33.587 -7.739 3.923 0.00 0.00 +0.000 C +ATOM 389 HG2 LYS 194 -33.162 -7.996 2.953 0.00 0.00 +0.000 HD +ATOM 390 HG3 LYS 194 -34.312 -6.934 3.800 0.00 0.00 +0.000 HD +ATOM 391 CD LYS 194 -32.470 -7.279 4.864 0.00 0.00 +0.000 C +ATOM 392 HD2 LYS 194 -32.895 -7.025 5.835 0.00 0.00 +0.000 HD +ATOM 393 HD3 LYS 194 -31.744 -8.083 4.985 0.00 0.00 +0.000 HD +ATOM 394 CE LYS 194 -31.776 -6.050 4.272 0.00 0.00 +0.000 C +ATOM 395 HE2 LYS 194 -31.328 -6.331 3.319 0.00 0.00 +0.000 HD +ATOM 396 HE3 LYS 194 -32.526 -5.276 4.107 0.00 0.00 +0.000 HD +ATOM 397 NZ LYS 194 -30.723 -5.531 5.180 0.00 0.00 +0.000 N +ATOM 398 HZ1 LYS 194 -30.028 -6.248 5.333 0.00 0.00 +0.000 HD +ATOM 399 HZ2 LYS 194 -30.286 -4.723 4.760 0.00 0.00 +0.000 HD +ATOM 400 HZ3 LYS 194 -31.137 -5.270 6.063 0.00 0.00 +0.000 HD +ATOM 401 C LYS 194 -35.854 -10.881 3.933 0.00 0.00 +0.000 C +ATOM 402 O LYS 194 -36.648 -11.018 4.864 0.00 0.00 +0.000 OA +ATOM 403 N ASP 195 -35.321 -11.907 3.274 0.00 0.00 +0.000 N +ATOM 404 H ASP 195 -34.756 -11.725 2.457 0.00 0.00 +0.000 HD +ATOM 405 CA ASP 195 -35.616 -13.301 3.620 0.00 0.00 +0.000 C +ATOM 406 HA ASP 195 -36.660 -13.396 3.918 0.00 0.00 +0.000 HD +ATOM 407 CB ASP 195 -35.363 -14.220 2.411 0.00 0.00 +0.000 C +ATOM 408 HB2 ASP 195 -35.839 -13.742 1.554 0.00 0.00 +0.000 HD +ATOM 409 HB3 ASP 195 -34.289 -14.285 2.239 0.00 0.00 +0.000 HD +ATOM 410 CG ASP 195 -35.939 -15.632 2.595 0.00 0.00 +0.000 C +ATOM 411 OD1 ASP 195 -35.979 -16.105 3.754 0.00 0.00 +0.000 OA +ATOM 412 OD2 ASP 195 -36.315 -16.245 1.568 0.00 0.00 +0.000 OA +ATOM 413 C ASP 195 -34.810 -13.709 4.865 0.00 0.00 +0.000 C +ATOM 414 O ASP 195 -33.576 -13.728 4.852 0.00 0.00 +0.000 OA +ATOM 415 N THR 196 -35.508 -14.019 5.960 0.00 0.00 +0.000 N +ATOM 416 H THR 196 -36.512 -13.925 5.909 0.00 0.00 +0.000 HD +ATOM 417 CA THR 196 -34.906 -14.397 7.248 0.00 0.00 +0.000 C +ATOM 418 HA THR 196 -33.924 -13.933 7.335 0.00 0.00 +0.000 HD +ATOM 419 CB THR 196 -35.776 -13.926 8.423 0.00 0.00 +0.000 C +ATOM 420 HB THR 196 -35.318 -14.278 9.347 0.00 0.00 +0.000 HD +ATOM 421 CG2 THR 196 -35.911 -12.404 8.469 0.00 0.00 +0.000 C +ATOM 422 HG21 THR 196 -36.370 -12.051 7.545 0.00 0.00 +0.000 HD +ATOM 423 HG22 THR 196 -36.535 -12.119 9.317 0.00 0.00 +0.000 HD +ATOM 424 HG23 THR 196 -34.923 -11.955 8.578 0.00 0.00 +0.000 HD +ATOM 425 OG1 THR 196 -37.075 -14.460 8.308 0.00 0.00 +0.000 OA +ATOM 426 HG1 THR 196 -37.611 -14.160 9.046 0.00 0.00 +0.000 HD +ATOM 427 C THR 196 -34.631 -15.896 7.376 0.00 0.00 +0.000 C +ATOM 428 O THR 196 -34.060 -16.327 8.381 0.00 0.00 +0.000 OA +ATOM 429 N LYS 197 -35.000 -16.711 6.378 0.00 0.00 +0.000 N +ATOM 430 H LYS 197 -35.496 -16.313 5.593 0.00 0.00 +0.000 HD +ATOM 431 CA LYS 197 -34.788 -18.161 6.403 0.00 0.00 +0.000 C +ATOM 432 HA LYS 197 -35.199 -18.593 7.315 0.00 0.00 +0.000 HD +ATOM 433 CB LYS 197 -35.503 -18.790 5.194 0.00 0.00 +0.000 C +ATOM 434 HB2 LYS 197 -36.505 -18.365 5.148 0.00 0.00 +0.000 HD +ATOM 435 HB3 LYS 197 -34.948 -18.508 4.301 0.00 0.00 +0.000 HD +ATOM 436 CG LYS 197 -35.601 -20.319 5.273 0.00 0.00 +0.000 C +ATOM 437 HG2 LYS 197 -34.594 -20.734 5.284 0.00 0.00 +0.000 HD +ATOM 438 HG3 LYS 197 -36.115 -20.590 6.196 0.00 0.00 +0.000 HD +ATOM 439 CD LYS 197 -36.371 -20.882 4.076 0.00 0.00 +0.000 C +ATOM 440 HD2 LYS 197 -37.375 -20.457 4.062 0.00 0.00 +0.000 HD +ATOM 441 HD3 LYS 197 -35.851 -20.614 3.156 0.00 0.00 +0.000 HD +ATOM 442 CE LYS 197 -36.465 -22.408 4.183 0.00 0.00 +0.000 C +ATOM 443 HE2 LYS 197 -35.454 -22.816 4.200 0.00 0.00 +0.000 HD +ATOM 444 HE3 LYS 197 -36.973 -22.657 5.115 0.00 0.00 +0.000 HD +ATOM 445 NZ LYS 197 -37.214 -22.990 3.040 0.00 0.00 +0.000 N +ATOM 446 HZ1 LYS 197 -36.743 -22.759 2.177 0.00 0.00 +0.000 HD +ATOM 447 HZ2 LYS 197 -37.256 -23.993 3.142 0.00 0.00 +0.000 HD +ATOM 448 HZ3 LYS 197 -38.150 -22.612 3.024 0.00 0.00 +0.000 HD +ATOM 449 C LYS 197 -33.285 -18.477 6.421 0.00 0.00 +0.000 C +ATOM 450 O LYS 197 -32.531 -17.853 5.669 0.00 0.00 +0.000 OA +ATOM 451 N PRO 198 -32.817 -19.462 7.210 0.00 0.00 +0.000 N +ATOM 452 CD PRO 198 -33.570 -20.317 8.116 0.00 0.00 +0.000 C +ATOM 453 HD2 PRO 198 -34.546 -20.516 7.673 0.00 0.00 +0.000 HD +ATOM 454 HD3 PRO 198 -33.700 -19.790 9.061 0.00 0.00 +0.000 HD +ATOM 455 CG PRO 198 -32.726 -21.579 8.265 0.00 0.00 +0.000 C +ATOM 456 HG2 PRO 198 -32.942 -22.293 7.470 0.00 0.00 +0.000 HD +ATOM 457 HG3 PRO 198 -32.895 -22.052 9.233 0.00 0.00 +0.000 HD +ATOM 458 CB PRO 198 -31.299 -21.044 8.161 0.00 0.00 +0.000 C +ATOM 459 HB2 PRO 198 -30.637 -21.811 7.760 0.00 0.00 +0.000 HD +ATOM 460 HB3 PRO 198 -30.899 -20.679 9.108 0.00 0.00 +0.000 HD +ATOM 461 CA PRO 198 -31.419 -19.886 7.164 0.00 0.00 +0.000 C +ATOM 462 HA PRO 198 -30.790 -19.060 7.495 0.00 0.00 +0.000 HD +ATOM 463 C PRO 198 -31.018 -20.294 5.740 0.00 0.00 +0.000 C +ATOM 464 O PRO 198 -31.831 -20.849 4.998 0.00 0.00 +0.000 OA +ATOM 465 N MET 199 -29.788 -19.964 5.344 0.00 0.00 +0.000 N +ATOM 466 H MET 199 -29.262 -19.300 5.894 0.00 0.00 +0.000 HD +ATOM 467 CA MET 199 -29.210 -20.430 4.078 0.00 0.00 +0.000 C +ATOM 468 HA MET 199 -29.996 -20.504 3.326 0.00 0.00 +0.000 HD +ATOM 469 CB MET 199 -28.134 -19.464 3.568 0.00 0.00 +0.000 C +ATOM 470 HB2 MET 199 -27.485 -19.209 4.406 0.00 0.00 +0.000 HD +ATOM 471 HB3 MET 199 -27.553 -19.978 2.802 0.00 0.00 +0.000 HD +ATOM 472 CG MET 199 -28.735 -18.186 2.982 0.00 0.00 +0.000 C +ATOM 473 HG2 MET 199 -29.341 -18.457 2.118 0.00 0.00 +0.000 HD +ATOM 474 HG3 MET 199 -29.369 -17.725 3.739 0.00 0.00 +0.000 HD +ATOM 475 SD MET 199 -27.469 -17.008 2.472 0.00 0.00 +0.000 S +ATOM 476 CE MET 199 -28.459 -15.691 1.739 0.00 0.00 +0.000 C +ATOM 477 HE1 MET 199 -29.141 -15.289 2.488 0.00 0.00 +0.000 HD +ATOM 478 HE2 MET 199 -27.803 -14.898 1.382 0.00 0.00 +0.000 HD +ATOM 479 HE3 MET 199 -29.034 -16.090 0.903 0.00 0.00 +0.000 HD +ATOM 480 C MET 199 -28.683 -21.861 4.208 0.00 0.00 +0.000 C +ATOM 481 O MET 199 -28.428 -22.315 5.325 0.00 0.00 +0.000 OA +ATOM 482 N GLY 200 -28.536 -22.563 3.080 0.00 0.00 +0.000 N +ATOM 483 H GLY 200 -28.747 -22.101 2.207 0.00 0.00 +0.000 HD +ATOM 484 CA GLY 200 -28.089 -23.959 3.035 0.00 0.00 +0.000 C +ATOM 485 HA2 GLY 200 -28.738 -24.527 3.701 0.00 0.00 +0.000 HD +ATOM 486 HA3 GLY 200 -28.224 -24.308 2.012 0.00 0.00 +0.000 HD +ATOM 487 C GLY 200 -26.626 -24.182 3.452 0.00 0.00 +0.000 C +ATOM 488 O GLY 200 -26.008 -23.357 4.126 0.00 0.00 +0.000 OA +ATOM 489 N ARG 201 -26.045 -25.313 3.021 0.00 0.00 +0.000 N +ATOM 490 H ARG 201 -26.616 -25.919 2.448 0.00 0.00 +0.000 HD +ATOM 491 CA ARG 201 -24.692 -25.779 3.405 0.00 0.00 +0.000 C +ATOM 492 HA ARG 201 -24.649 -26.018 4.468 0.00 0.00 +0.000 HD +ATOM 493 CB ARG 201 -24.378 -27.058 2.599 0.00 0.00 +0.000 C +ATOM 494 HB2 ARG 201 -25.178 -27.769 2.802 0.00 0.00 +0.000 HD +ATOM 495 HB3 ARG 201 -24.396 -26.783 1.544 0.00 0.00 +0.000 HD +ATOM 496 CG ARG 201 -23.021 -27.701 2.938 0.00 0.00 +0.000 C +ATOM 497 HG2 ARG 201 -22.239 -26.964 2.759 0.00 0.00 +0.000 HD +ATOM 498 HG3 ARG 201 -23.026 -27.975 3.993 0.00 0.00 +0.000 HD +ATOM 499 CD ARG 201 -22.752 -28.954 2.084 0.00 0.00 +0.000 C +ATOM 500 HD2 ARG 201 -23.397 -28.913 1.206 0.00 0.00 +0.000 HD +ATOM 501 HD3 ARG 201 -21.709 -28.935 1.770 0.00 0.00 +0.000 HD +ATOM 502 NE ARG 201 -23.009 -30.223 2.802 0.00 0.00 +0.000 N +ATOM 503 HE ARG 201 -23.163 -30.146 3.797 0.00 0.00 +0.000 HD +ATOM 504 CZ ARG 201 -23.055 -31.428 2.246 0.00 0.00 +0.000 C +ATOM 505 NH1 ARG 201 -23.019 -31.605 0.954 0.00 0.00 +0.000 N +ATOM 506 HH11 ARG 201 -22.953 -30.807 0.339 0.00 0.00 +0.000 HD +ATOM 507 HH12 ARG 201 -23.057 -32.540 0.574 0.00 0.00 +0.000 HD +ATOM 508 NH2 ARG 201 -23.134 -32.500 2.985 0.00 0.00 +0.000 N +ATOM 509 HH21 ARG 201 -23.161 -32.414 3.991 0.00 0.00 +0.000 HD +ATOM 510 HH22 ARG 201 -23.169 -33.409 2.547 0.00 0.00 +0.000 HD +ATOM 511 C ARG 201 -23.608 -24.701 3.241 0.00 0.00 +0.000 C +ATOM 512 O ARG 201 -22.802 -24.508 4.144 0.00 0.00 +0.000 OA +ATOM 513 N SER 202 -23.651 -23.933 2.151 0.00 0.00 +0.000 N +ATOM 514 H SER 202 -24.269 -24.236 1.411 0.00 0.00 +0.000 HD +ATOM 515 CA SER 202 -22.743 -22.802 1.884 0.00 0.00 +0.000 C +ATOM 516 HA SER 202 -21.834 -22.900 2.477 0.00 0.00 +0.000 HD +ATOM 517 CB SER 202 -22.362 -22.791 0.400 0.00 0.00 +0.000 C +ATOM 518 HB2 SER 202 -22.201 -23.809 0.049 0.00 0.00 +0.000 HD +ATOM 519 HB3 SER 202 -23.154 -22.325 -0.186 0.00 0.00 +0.000 HD +ATOM 520 OG SER 202 -21.172 -22.050 0.252 0.00 0.00 +0.000 OA +ATOM 521 HG SER 202 -20.919 -22.033 -0.674 0.00 0.00 +0.000 HD +ATOM 522 C SER 202 -23.270 -21.448 2.404 0.00 0.00 +0.000 C +ATOM 523 O SER 202 -23.106 -20.390 1.788 0.00 0.00 +0.000 OA +ATOM 524 N GLY 203 -23.966 -21.445 3.546 0.00 0.00 +0.000 N +ATOM 525 H GLY 203 -23.977 -22.290 4.100 0.00 0.00 +0.000 HD +ATOM 526 CA GLY 203 -24.714 -20.284 4.034 0.00 0.00 +0.000 C +ATOM 527 HA2 GLY 203 -25.381 -19.976 3.229 0.00 0.00 +0.000 HD +ATOM 528 HA3 GLY 203 -25.304 -20.624 4.885 0.00 0.00 +0.000 HD +ATOM 529 C GLY 203 -23.864 -19.083 4.464 0.00 0.00 +0.000 C +ATOM 530 O GLY 203 -24.362 -17.960 4.501 0.00 0.00 +0.000 OA +ATOM 531 N ALA 204 -22.580 -19.262 4.786 0.00 0.00 +0.000 N +ATOM 532 H ALA 204 -22.227 -20.199 4.911 0.00 0.00 +0.000 HD +ATOM 533 CA ALA 204 -21.684 -18.137 5.076 0.00 0.00 +0.000 C +ATOM 534 HA ALA 204 -22.219 -17.432 5.712 0.00 0.00 +0.000 HD +ATOM 535 CB ALA 204 -20.456 -18.648 5.835 0.00 0.00 +0.000 C +ATOM 536 HB1 ALA 204 -19.905 -19.349 5.207 0.00 0.00 +0.000 HD +ATOM 537 HB2 ALA 204 -19.812 -17.808 6.092 0.00 0.00 +0.000 HD +ATOM 538 HB3 ALA 204 -20.776 -19.153 6.746 0.00 0.00 +0.000 HD +ATOM 539 C ALA 204 -21.311 -17.369 3.796 0.00 0.00 +0.000 C +ATOM 540 O ALA 204 -21.524 -16.157 3.728 0.00 0.00 +0.000 OA +ATOM 541 N THR 205 -20.824 -18.074 2.773 0.00 0.00 +0.000 N +ATOM 542 H THR 205 -20.636 -19.055 2.930 0.00 0.00 +0.000 HD +ATOM 543 CA THR 205 -20.488 -17.502 1.461 0.00 0.00 +0.000 C +ATOM 544 HA THR 205 -19.805 -16.659 1.564 0.00 0.00 +0.000 HD +ATOM 545 CB THR 205 -19.821 -18.569 0.580 0.00 0.00 +0.000 C +ATOM 546 HB THR 205 -20.507 -19.414 0.507 0.00 0.00 +0.000 HD +ATOM 547 CG2 THR 205 -19.485 -18.065 -0.821 0.00 0.00 +0.000 C +ATOM 548 HG21 THR 205 -18.799 -17.221 -0.750 0.00 0.00 +0.000 HD +ATOM 549 HG22 THR 205 -19.017 -18.865 -1.394 0.00 0.00 +0.000 HD +ATOM 550 HG23 THR 205 -20.399 -17.747 -1.323 0.00 0.00 +0.000 HD +ATOM 551 OG1 THR 205 -18.647 -18.969 1.244 0.00 0.00 +0.000 OA +ATOM 552 HG1 THR 205 -18.197 -19.639 0.723 0.00 0.00 +0.000 HD +ATOM 553 C THR 205 -21.724 -16.933 0.775 0.00 0.00 +0.000 C +ATOM 554 O THR 205 -21.692 -15.803 0.296 0.00 0.00 +0.000 OA +ATOM 555 N SER 206 -22.848 -17.650 0.819 0.00 0.00 +0.000 N +ATOM 556 H SER 206 -22.819 -18.570 1.236 0.00 0.00 +0.000 HD +ATOM 557 CA SER 206 -24.106 -17.204 0.204 0.00 0.00 +0.000 C +ATOM 558 HA SER 206 -23.934 -16.944 -0.841 0.00 0.00 +0.000 HD +ATOM 559 CB SER 206 -25.155 -18.317 0.266 0.00 0.00 +0.000 C +ATOM 560 HB2 SER 206 -25.439 -18.493 1.303 0.00 0.00 +0.000 HD +ATOM 561 HB3 SER 206 -26.035 -18.021 -0.305 0.00 0.00 +0.000 HD +ATOM 562 OG SER 206 -24.615 -19.502 -0.282 0.00 0.00 +0.000 OA +ATOM 563 HG SER 206 -25.271 -20.200 -0.244 0.00 0.00 +0.000 HD +ATOM 564 C SER 206 -24.643 -15.914 0.834 0.00 0.00 +0.000 C +ATOM 565 O SER 206 -25.127 -15.038 0.118 0.00 0.00 +0.000 OA +ATOM 566 N ARG 207 -24.482 -15.729 2.156 0.00 0.00 +0.000 N +ATOM 567 H ARG 207 -24.158 -16.500 2.722 0.00 0.00 +0.000 HD +ATOM 568 CA ARG 207 -24.838 -14.467 2.831 0.00 0.00 +0.000 C +ATOM 569 HA ARG 207 -25.858 -14.191 2.564 0.00 0.00 +0.000 HD +ATOM 570 CB ARG 207 -24.750 -14.599 4.360 0.00 0.00 +0.000 C +ATOM 571 HB2 ARG 207 -23.881 -15.213 4.597 0.00 0.00 +0.000 HD +ATOM 572 HB3 ARG 207 -24.615 -13.602 4.779 0.00 0.00 +0.000 HD +ATOM 573 CG ARG 207 -26.008 -15.240 4.959 0.00 0.00 +0.000 C +ATOM 574 HG2 ARG 207 -26.872 -14.656 4.642 0.00 0.00 +0.000 HD +ATOM 575 HG3 ARG 207 -26.092 -16.254 4.568 0.00 0.00 +0.000 HD +ATOM 576 CD ARG 207 -25.959 -15.287 6.485 0.00 0.00 +0.000 C +ATOM 577 HD2 ARG 207 -25.706 -14.299 6.868 0.00 0.00 +0.000 HD +ATOM 578 HD3 ARG 207 -26.936 -15.586 6.868 0.00 0.00 +0.000 HD +ATOM 579 NE ARG 207 -24.951 -16.251 6.961 0.00 0.00 +0.000 N +ATOM 580 HE ARG 207 -24.545 -16.850 6.256 0.00 0.00 +0.000 HD +ATOM 581 CZ ARG 207 -24.542 -16.380 8.211 0.00 0.00 +0.000 C +ATOM 582 NH1 ARG 207 -25.021 -15.636 9.170 0.00 0.00 +0.000 N +ATOM 583 HH11 ARG 207 -25.724 -14.941 8.964 0.00 0.00 +0.000 HD +ATOM 584 HH12 ARG 207 -24.687 -15.760 10.115 0.00 0.00 +0.000 HD +ATOM 585 NH2 ARG 207 -23.645 -17.270 8.527 0.00 0.00 +0.000 N +ATOM 586 HH21 ARG 207 -23.257 -17.868 7.812 0.00 0.00 +0.000 HD +ATOM 587 HH22 ARG 207 -23.341 -17.358 9.487 0.00 0.00 +0.000 HD +ATOM 588 C ARG 207 -23.972 -13.308 2.352 0.00 0.00 +0.000 C +ATOM 589 O ARG 207 -24.517 -12.270 1.986 0.00 0.00 +0.000 OA +ATOM 590 N LYS 208 -22.650 -13.497 2.298 0.00 0.00 +0.000 N +ATOM 591 H LYS 208 -22.275 -14.374 2.630 0.00 0.00 +0.000 HD +ATOM 592 CA LYS 208 -21.708 -12.471 1.816 0.00 0.00 +0.000 C +ATOM 593 HA LYS 208 -21.844 -11.547 2.376 0.00 0.00 +0.000 HD +ATOM 594 CB LYS 208 -20.266 -12.952 2.008 0.00 0.00 +0.000 C +ATOM 595 HB2 LYS 208 -20.187 -13.935 1.542 0.00 0.00 +0.000 HD +ATOM 596 HB3 LYS 208 -19.617 -12.249 1.486 0.00 0.00 +0.000 HD +ATOM 597 CG LYS 208 -19.838 -13.048 3.478 0.00 0.00 +0.000 C +ATOM 598 HG2 LYS 208 -19.918 -12.069 3.950 0.00 0.00 +0.000 HD +ATOM 599 HG3 LYS 208 -20.476 -13.759 4.003 0.00 0.00 +0.000 HD +ATOM 600 CD LYS 208 -18.383 -13.527 3.538 0.00 0.00 +0.000 C +ATOM 601 HD2 LYS 208 -18.321 -14.509 3.068 0.00 0.00 +0.000 HD +ATOM 602 HD3 LYS 208 -17.762 -12.821 2.988 0.00 0.00 +0.000 HD +ATOM 603 CE LYS 208 -17.888 -13.622 4.983 0.00 0.00 +0.000 C +ATOM 604 HE2 LYS 208 -17.987 -12.646 5.456 0.00 0.00 +0.000 HD +ATOM 605 HE3 LYS 208 -18.499 -14.348 5.520 0.00 0.00 +0.000 HD +ATOM 606 NZ LYS 208 -16.466 -14.048 5.020 0.00 0.00 +0.000 N +ATOM 607 HZ1 LYS 208 -15.900 -13.375 4.523 0.00 0.00 +0.000 HD +ATOM 608 HZ2 LYS 208 -16.156 -14.105 5.979 0.00 0.00 +0.000 HD +ATOM 609 HZ3 LYS 208 -16.374 -14.953 4.582 0.00 0.00 +0.000 HD +ATOM 610 C LYS 208 -21.936 -12.123 0.342 0.00 0.00 +0.000 C +ATOM 611 O LYS 208 -21.875 -10.952 -0.033 0.00 0.00 +0.000 OA +ATOM 612 N ALA 209 -22.229 -13.119 -0.492 0.00 0.00 +0.000 N +ATOM 613 H ALA 209 -22.165 -14.065 -0.144 0.00 0.00 +0.000 HD +ATOM 614 CA ALA 209 -22.561 -12.920 -1.900 0.00 0.00 +0.000 C +ATOM 615 HA ALA 209 -21.779 -12.334 -2.383 0.00 0.00 +0.000 HD +ATOM 616 CB ALA 209 -22.641 -14.287 -2.583 0.00 0.00 +0.000 C +ATOM 617 HB1 ALA 209 -23.426 -14.881 -2.117 0.00 0.00 +0.000 HD +ATOM 618 HB2 ALA 209 -22.868 -14.153 -3.641 0.00 0.00 +0.000 HD +ATOM 619 HB3 ALA 209 -21.686 -14.802 -2.480 0.00 0.00 +0.000 HD +ATOM 620 C ALA 209 -23.864 -12.126 -2.053 0.00 0.00 +0.000 C +ATOM 621 O ALA 209 -23.909 -11.167 -2.821 0.00 0.00 +0.000 OA +ATOM 622 N LEU 210 -24.891 -12.445 -1.261 0.00 0.00 +0.000 N +ATOM 623 H LEU 210 -24.829 -13.282 -0.699 0.00 0.00 +0.000 HD +ATOM 624 CA LEU 210 -26.147 -11.699 -1.256 0.00 0.00 +0.000 C +ATOM 625 HA LEU 210 -26.533 -11.583 -2.269 0.00 0.00 +0.000 HD +ATOM 626 CB LEU 210 -27.176 -12.484 -0.425 0.00 0.00 +0.000 C +ATOM 627 HB2 LEU 210 -27.191 -13.504 -0.808 0.00 0.00 +0.000 HD +ATOM 628 HB3 LEU 210 -26.820 -12.489 0.605 0.00 0.00 +0.000 HD +ATOM 629 CG LEU 210 -28.596 -11.897 -0.472 0.00 0.00 +0.000 C +ATOM 630 HG LEU 210 -28.552 -10.876 -0.092 0.00 0.00 +0.000 HD +ATOM 631 CD1 LEU 210 -29.176 -11.890 -1.881 0.00 0.00 +0.000 C +ATOM 632 HD11 LEU 210 -29.221 -12.910 -2.262 0.00 0.00 +0.000 HD +ATOM 633 HD12 LEU 210 -30.181 -11.467 -1.860 0.00 0.00 +0.000 HD +ATOM 634 HD13 LEU 210 -28.542 -11.288 -2.532 0.00 0.00 +0.000 HD +ATOM 635 CD2 LEU 210 -29.531 -12.724 0.409 0.00 0.00 +0.000 C +ATOM 636 HD21 LEU 210 -29.171 -12.709 1.437 0.00 0.00 +0.000 HD +ATOM 637 HD22 LEU 210 -30.535 -12.303 0.370 0.00 0.00 +0.000 HD +ATOM 638 HD23 LEU 210 -29.555 -13.752 0.048 0.00 0.00 +0.000 HD +ATOM 639 C LEU 210 -25.962 -10.251 -0.765 0.00 0.00 +0.000 C +ATOM 640 O LEU 210 -26.504 -9.326 -1.358 0.00 0.00 +0.000 OA +ATOM 641 N GLU 211 -25.161 -10.017 0.279 0.00 0.00 +0.000 N +ATOM 642 H GLU 211 -24.822 -10.807 0.808 0.00 0.00 +0.000 HD +ATOM 643 CA GLU 211 -24.784 -8.664 0.725 0.00 0.00 +0.000 C +ATOM 644 HA GLU 211 -25.676 -8.085 0.967 0.00 0.00 +0.000 HD +ATOM 645 CB GLU 211 -23.905 -8.759 1.980 0.00 0.00 +0.000 C +ATOM 646 HB2 GLU 211 -23.140 -9.515 1.804 0.00 0.00 +0.000 HD +ATOM 647 HB3 GLU 211 -23.430 -7.791 2.139 0.00 0.00 +0.000 HD +ATOM 648 CG GLU 211 -24.723 -9.139 3.222 0.00 0.00 +0.000 C +ATOM 649 HG2 GLU 211 -25.369 -8.301 3.482 0.00 0.00 +0.000 HD +ATOM 650 HG3 GLU 211 -25.335 -9.995 2.937 0.00 0.00 +0.000 HD +ATOM 651 CD GLU 211 -23.856 -9.510 4.436 0.00 0.00 +0.000 C +ATOM 652 OE1 GLU 211 -24.475 -9.921 5.444 0.00 0.00 +0.000 OA +ATOM 653 OE2 GLU 211 -22.612 -9.414 4.351 0.00 0.00 +0.000 OA +ATOM 654 C GLU 211 -24.044 -7.877 -0.364 0.00 0.00 +0.000 C +ATOM 655 O GLU 211 -24.339 -6.703 -0.601 0.00 0.00 +0.000 OA +ATOM 656 N THR 212 -23.135 -8.540 -1.075 0.00 0.00 +0.000 N +ATOM 657 H THR 212 -22.891 -9.475 -0.777 0.00 0.00 +0.000 HD +ATOM 658 CA THR 212 -22.409 -7.962 -2.210 0.00 0.00 +0.000 C +ATOM 659 HA THR 212 -21.954 -7.018 -1.909 0.00 0.00 +0.000 HD +ATOM 660 CB THR 212 -21.301 -8.918 -2.659 0.00 0.00 +0.000 C +ATOM 661 HB THR 212 -21.770 -9.861 -2.938 0.00 0.00 +0.000 HD +ATOM 662 CG2 THR 212 -20.495 -8.385 -3.836 0.00 0.00 +0.000 C +ATOM 663 HG21 THR 212 -20.025 -7.442 -3.558 0.00 0.00 +0.000 HD +ATOM 664 HG22 THR 212 -19.726 -9.108 -4.107 0.00 0.00 +0.000 HD +ATOM 665 HG23 THR 212 -21.157 -8.223 -4.686 0.00 0.00 +0.000 HD +ATOM 666 OG1 THR 212 -20.403 -9.117 -1.590 0.00 0.00 +0.000 OA +ATOM 667 HG1 THR 212 -19.705 -9.716 -1.865 0.00 0.00 +0.000 HD +ATOM 668 C THR 212 -23.358 -7.619 -3.361 0.00 0.00 +0.000 C +ATOM 669 O THR 212 -23.272 -6.516 -3.899 0.00 0.00 +0.000 OA +ATOM 670 N LEU 213 -24.314 -8.496 -3.694 0.00 0.00 +0.000 N +ATOM 671 H LEU 213 -24.299 -9.402 -3.250 0.00 0.00 +0.000 HD +ATOM 672 CA LEU 213 -25.348 -8.232 -4.702 0.00 0.00 +0.000 C +ATOM 673 HA LEU 213 -24.878 -7.964 -5.648 0.00 0.00 +0.000 HD +ATOM 674 CB LEU 213 -26.227 -9.476 -4.923 0.00 0.00 +0.000 C +ATOM 675 HB2 LEU 213 -26.389 -9.940 -3.950 0.00 0.00 +0.000 HD +ATOM 676 HB3 LEU 213 -27.177 -9.107 -5.312 0.00 0.00 +0.000 HD +ATOM 677 CG LEU 213 -25.647 -10.514 -5.894 0.00 0.00 +0.000 C +ATOM 678 HG LEU 213 -24.646 -10.804 -5.571 0.00 0.00 +0.000 HD +ATOM 679 CD1 LEU 213 -26.553 -11.741 -5.900 0.00 0.00 +0.000 C +ATOM 680 HD11 LEU 213 -27.553 -11.453 -6.223 0.00 0.00 +0.000 HD +ATOM 681 HD12 LEU 213 -26.151 -12.486 -6.586 0.00 0.00 +0.000 HD +ATOM 682 HD13 LEU 213 -26.603 -12.162 -4.895 0.00 0.00 +0.000 HD +ATOM 683 CD2 LEU 213 -25.571 -9.984 -7.326 0.00 0.00 +0.000 C +ATOM 684 HD21 LEU 213 -24.934 -9.101 -7.353 0.00 0.00 +0.000 HD +ATOM 685 HD22 LEU 213 -25.154 -10.753 -7.976 0.00 0.00 +0.000 HD +ATOM 686 HD23 LEU 213 -26.571 -9.721 -7.670 0.00 0.00 +0.000 HD +ATOM 687 C LEU 213 -26.241 -7.053 -4.324 0.00 0.00 +0.000 C +ATOM 688 O LEU 213 -26.521 -6.228 -5.184 0.00 0.00 +0.000 OA +ATOM 689 N ARG 214 -26.637 -6.912 -3.055 0.00 0.00 +0.000 N +ATOM 690 H ARG 214 -26.480 -7.655 -2.390 0.00 0.00 +0.000 HD +ATOM 691 CA ARG 214 -27.373 -5.718 -2.606 0.00 0.00 +0.000 C +ATOM 692 HA ARG 214 -28.286 -5.610 -3.191 0.00 0.00 +0.000 HD +ATOM 693 CB ARG 214 -27.750 -5.831 -1.125 0.00 0.00 +0.000 C +ATOM 694 HB2 ARG 214 -26.837 -6.054 -0.573 0.00 0.00 +0.000 HD +ATOM 695 HB3 ARG 214 -28.137 -4.861 -0.812 0.00 0.00 +0.000 HD +ATOM 696 CG ARG 214 -28.799 -6.916 -0.841 0.00 0.00 +0.000 C +ATOM 697 HG2 ARG 214 -29.745 -6.656 -1.313 0.00 0.00 +0.000 HD +ATOM 698 HG3 ARG 214 -28.455 -7.878 -1.222 0.00 0.00 +0.000 HD +ATOM 699 CD ARG 214 -28.994 -7.010 0.676 0.00 0.00 +0.000 C +ATOM 700 HD2 ARG 214 -28.015 -7.028 1.155 0.00 0.00 +0.000 HD +ATOM 701 HD3 ARG 214 -29.548 -6.133 1.012 0.00 0.00 +0.000 HD +ATOM 702 NE ARG 214 -29.737 -8.217 1.074 0.00 0.00 +0.000 N +ATOM 703 HE ARG 214 -30.624 -8.315 0.601 0.00 0.00 +0.000 HD +ATOM 704 CZ ARG 214 -29.373 -9.153 1.929 0.00 0.00 +0.000 C +ATOM 705 NH1 ARG 214 -28.198 -9.167 2.497 0.00 0.00 +0.000 N +ATOM 706 HH11 ARG 214 -27.530 -8.441 2.285 0.00 0.00 +0.000 HD +ATOM 707 HH12 ARG 214 -27.963 -9.904 3.146 0.00 0.00 +0.000 HD +ATOM 708 NH2 ARG 214 -30.204 -10.093 2.253 0.00 0.00 +0.000 N +ATOM 709 HH21 ARG 214 -31.130 -10.106 1.849 0.00 0.00 +0.000 HD +ATOM 710 HH22 ARG 214 -29.922 -10.809 2.908 0.00 0.00 +0.000 HD +ATOM 711 C ARG 214 -26.562 -4.451 -2.858 0.00 0.00 +0.000 C +ATOM 712 O ARG 214 -27.062 -3.505 -3.446 0.00 0.00 +0.000 OA +ATOM 713 N ARG 215 -25.282 -4.424 -2.477 0.00 0.00 +0.000 N +ATOM 714 H ARG 215 -24.894 -5.211 -1.976 0.00 0.00 +0.000 HD +ATOM 715 CA ARG 215 -24.442 -3.230 -2.659 0.00 0.00 +0.000 C +ATOM 716 HA ARG 215 -24.949 -2.343 -2.279 0.00 0.00 +0.000 HD +ATOM 717 CB ARG 215 -23.135 -3.418 -1.882 0.00 0.00 +0.000 C +ATOM 718 HB2 ARG 215 -23.385 -3.563 -0.831 0.00 0.00 +0.000 HD +ATOM 719 HB3 ARG 215 -22.640 -4.310 -2.264 0.00 0.00 +0.000 HD +ATOM 720 CG ARG 215 -22.191 -2.209 -2.022 0.00 0.00 +0.000 C +ATOM 721 HG2 ARG 215 -21.880 -2.133 -3.065 0.00 0.00 +0.000 HD +ATOM 722 HG3 ARG 215 -22.739 -1.310 -1.742 0.00 0.00 +0.000 HD +ATOM 723 CD ARG 215 -20.952 -2.352 -1.130 0.00 0.00 +0.000 C +ATOM 724 HD2 ARG 215 -20.282 -1.510 -1.310 0.00 0.00 +0.000 HD +ATOM 725 HD3 ARG 215 -21.263 -2.350 -0.085 0.00 0.00 +0.000 HD +ATOM 726 NE ARG 215 -20.223 -3.603 -1.403 0.00 0.00 +0.000 N +ATOM 727 HE ARG 215 -20.488 -4.370 -0.801 0.00 0.00 +0.000 HD +ATOM 728 CZ ARG 215 -19.305 -3.816 -2.327 0.00 0.00 +0.000 C +ATOM 729 NH1 ARG 215 -18.873 -2.890 -3.135 0.00 0.00 +0.000 N +ATOM 730 HH11 ARG 215 -19.245 -1.954 -3.070 0.00 0.00 +0.000 HD +ATOM 731 HH12 ARG 215 -18.168 -3.113 -3.823 0.00 0.00 +0.000 HD +ATOM 732 NH2 ARG 215 -18.787 -5.000 -2.442 0.00 0.00 +0.000 N +ATOM 733 HH21 ARG 215 -19.089 -5.742 -1.826 0.00 0.00 +0.000 HD +ATOM 734 HH22 ARG 215 -18.083 -5.174 -3.145 0.00 0.00 +0.000 HD +ATOM 735 C ARG 215 -24.201 -2.901 -4.136 0.00 0.00 +0.000 C +ATOM 736 O ARG 215 -24.439 -1.775 -4.566 0.00 0.00 +0.000 OA +ATOM 737 N VAL 216 -23.697 -3.870 -4.896 0.00 0.00 +0.000 N +ATOM 738 H VAL 216 -23.558 -4.780 -4.479 0.00 0.00 +0.000 HD +ATOM 739 CA VAL 216 -23.269 -3.669 -6.287 0.00 0.00 +0.000 C +ATOM 740 HA VAL 216 -22.794 -2.693 -6.387 0.00 0.00 +0.000 HD +ATOM 741 CB VAL 216 -22.263 -4.753 -6.719 0.00 0.00 +0.000 C +ATOM 742 HB VAL 216 -22.747 -5.726 -6.634 0.00 0.00 +0.000 HD +ATOM 743 CG1 VAL 216 -21.788 -4.543 -8.163 0.00 0.00 +0.000 C +ATOM 744 HG11 VAL 216 -21.303 -3.571 -8.248 0.00 0.00 +0.000 HD +ATOM 745 HG12 VAL 216 -21.080 -5.328 -8.431 0.00 0.00 +0.000 HD +ATOM 746 HG13 VAL 216 -22.644 -4.582 -8.837 0.00 0.00 +0.000 HD +ATOM 747 CG2 VAL 216 -21.022 -4.747 -5.814 0.00 0.00 +0.000 C +ATOM 748 HG21 VAL 216 -21.321 -4.939 -4.784 0.00 0.00 +0.000 HD +ATOM 749 HG22 VAL 216 -20.329 -5.521 -6.142 0.00 0.00 +0.000 HD +ATOM 750 HG23 VAL 216 -20.533 -3.775 -5.874 0.00 0.00 +0.000 HD +ATOM 751 C VAL 216 -24.473 -3.649 -7.216 0.00 0.00 +0.000 C +ATOM 752 O VAL 216 -24.611 -2.740 -8.033 0.00 0.00 +0.000 OA +ATOM 753 N GLY 217 -25.373 -4.616 -7.067 0.00 0.00 +0.000 N +ATOM 754 H GLY 217 -25.251 -5.268 -6.306 0.00 0.00 +0.000 HD +ATOM 755 CA GLY 217 -26.522 -4.785 -7.941 0.00 0.00 +0.000 C +ATOM 756 HA2 GLY 217 -26.160 -4.848 -8.966 0.00 0.00 +0.000 HD +ATOM 757 HA3 GLY 217 -27.017 -5.718 -7.672 0.00 0.00 +0.000 HD +ATOM 758 C GLY 217 -27.529 -3.642 -7.840 0.00 0.00 +0.000 C +ATOM 759 O GLY 217 -28.032 -3.197 -8.872 0.00 0.00 +0.000 OA +ATOM 760 N ASP 218 -27.759 -3.092 -6.643 0.00 0.00 +0.000 N +ATOM 761 H ASP 218 -27.353 -3.518 -5.823 0.00 0.00 +0.000 HD +ATOM 762 CA ASP 218 -28.621 -1.914 -6.464 0.00 0.00 +0.000 C +ATOM 763 HA ASP 218 -29.531 -2.043 -7.048 0.00 0.00 +0.000 HD +ATOM 764 CB ASP 218 -29.008 -1.712 -4.988 0.00 0.00 +0.000 C +ATOM 765 HB2 ASP 218 -28.052 -1.583 -4.479 0.00 0.00 +0.000 HD +ATOM 766 HB3 ASP 218 -29.597 -0.800 -4.891 0.00 0.00 +0.000 HD +ATOM 767 CG ASP 218 -29.772 -2.885 -4.352 0.00 0.00 +0.000 C +ATOM 768 OD1 ASP 218 -29.982 -3.920 -5.030 0.00 0.00 +0.000 OA +ATOM 769 OD2 ASP 218 -30.213 -2.733 -3.194 0.00 0.00 +0.000 OA +ATOM 770 C ASP 218 -27.939 -0.640 -6.983 0.00 0.00 +0.000 C +ATOM 771 O ASP 218 -28.604 0.298 -7.427 0.00 0.00 +0.000 OA +ATOM 772 N GLY 219 -26.602 -0.589 -6.950 0.00 0.00 +0.000 N +ATOM 773 H GLY 219 -26.110 -1.303 -6.432 0.00 0.00 +0.000 HD +ATOM 774 CA GLY 219 -25.815 0.446 -7.623 0.00 0.00 +0.000 C +ATOM 775 HA2 GLY 219 -26.137 1.422 -7.261 0.00 0.00 +0.000 HD +ATOM 776 HA3 GLY 219 -24.762 0.299 -7.384 0.00 0.00 +0.000 HD +ATOM 777 C GLY 219 -25.992 0.397 -9.143 0.00 0.00 +0.000 C +ATOM 778 O GLY 219 -26.306 1.414 -9.754 0.00 0.00 +0.000 OA +ATOM 779 N VAL 220 -25.874 -0.791 -9.744 0.00 0.00 +0.000 N +ATOM 780 H VAL 220 -25.568 -1.571 -9.180 0.00 0.00 +0.000 HD +ATOM 781 CA VAL 220 -26.084 -1.012 -11.186 0.00 0.00 +0.000 C +ATOM 782 HA VAL 220 -25.419 -0.366 -11.760 0.00 0.00 +0.000 HD +ATOM 783 CB VAL 220 -25.789 -2.480 -11.562 0.00 0.00 +0.000 C +ATOM 784 HB VAL 220 -26.335 -3.113 -10.862 0.00 0.00 +0.000 HD +ATOM 785 CG1 VAL 220 -26.195 -2.836 -12.998 0.00 0.00 +0.000 C +ATOM 786 HG11 VAL 220 -25.648 -2.204 -13.698 0.00 0.00 +0.000 HD +ATOM 787 HG12 VAL 220 -25.960 -3.882 -13.195 0.00 0.00 +0.000 HD +ATOM 788 HG13 VAL 220 -27.266 -2.676 -13.124 0.00 0.00 +0.000 HD +ATOM 789 CG2 VAL 220 -24.291 -2.783 -11.435 0.00 0.00 +0.000 C +ATOM 790 HG21 VAL 220 -23.971 -2.611 -10.407 0.00 0.00 +0.000 HD +ATOM 791 HG22 VAL 220 -24.106 -3.822 -11.704 0.00 0.00 +0.000 HD +ATOM 792 HG23 VAL 220 -23.730 -2.130 -12.103 0.00 0.00 +0.000 HD +ATOM 793 C VAL 220 -27.498 -0.613 -11.606 0.00 0.00 +0.000 C +ATOM 794 O VAL 220 -27.654 0.126 -12.576 0.00 0.00 +0.000 OA +ATOM 795 N GLN 221 -28.525 -1.035 -10.862 0.00 0.00 +0.000 N +ATOM 796 H GLN 221 -28.350 -1.649 -10.079 0.00 0.00 +0.000 HD +ATOM 797 CA GLN 221 -29.914 -0.690 -11.179 0.00 0.00 +0.000 C +ATOM 798 HA GLN 221 -30.153 -1.006 -12.195 0.00 0.00 +0.000 HD +ATOM 799 CB GLN 221 -30.867 -1.397 -10.209 0.00 0.00 +0.000 C +ATOM 800 HB2 GLN 221 -30.496 -1.233 -9.197 0.00 0.00 +0.000 HD +ATOM 801 HB3 GLN 221 -31.850 -0.937 -10.314 0.00 0.00 +0.000 HD +ATOM 802 CG GLN 221 -30.977 -2.905 -10.475 0.00 0.00 +0.000 C +ATOM 803 HG2 GLN 221 -31.339 -2.988 -11.500 0.00 0.00 +0.000 HD +ATOM 804 HG3 GLN 221 -30.045 -3.460 -10.373 0.00 0.00 +0.000 HD +ATOM 805 CD GLN 221 -32.009 -3.516 -9.546 0.00 0.00 +0.000 C +ATOM 806 OE1 GLN 221 -33.198 -3.320 -9.733 0.00 0.00 +0.000 OA +ATOM 807 NE2 GLN 221 -31.630 -4.162 -8.465 0.00 0.00 +0.000 N +ATOM 808 HE21 GLN 221 -32.324 -4.566 -7.852 0.00 0.00 +0.000 HD +ATOM 809 HE22 GLN 221 -30.646 -4.251 -8.252 0.00 0.00 +0.000 HD +ATOM 810 C GLN 221 -30.164 0.823 -11.152 0.00 0.00 +0.000 C +ATOM 811 O GLN 221 -30.831 1.332 -12.046 0.00 0.00 +0.000 OA +ATOM 812 N ARG 222 -29.602 1.550 -10.174 0.00 0.00 +0.000 N +ATOM 813 H ARG 222 -29.122 1.069 -9.427 0.00 0.00 +0.000 HD +ATOM 814 CA ARG 222 -29.714 3.019 -10.102 0.00 0.00 +0.000 C +ATOM 815 HA ARG 222 -30.754 3.320 -10.224 0.00 0.00 +0.000 HD +ATOM 816 CB ARG 222 -29.215 3.519 -8.738 0.00 0.00 +0.000 C +ATOM 817 HB2 ARG 222 -28.272 3.020 -8.514 0.00 0.00 +0.000 HD +ATOM 818 HB3 ARG 222 -29.050 4.594 -8.807 0.00 0.00 +0.000 HD +ATOM 819 CG ARG 222 -30.226 3.229 -7.621 0.00 0.00 +0.000 C +ATOM 820 HG2 ARG 222 -31.166 3.724 -7.863 0.00 0.00 +0.000 HD +ATOM 821 HG3 ARG 222 -30.387 2.152 -7.567 0.00 0.00 +0.000 HD +ATOM 822 CD ARG 222 -29.717 3.736 -6.267 0.00 0.00 +0.000 C +ATOM 823 HD2 ARG 222 -29.397 4.773 -6.370 0.00 0.00 +0.000 HD +ATOM 824 HD3 ARG 222 -30.523 3.676 -5.536 0.00 0.00 +0.000 HD +ATOM 825 NE ARG 222 -28.575 2.936 -5.780 0.00 0.00 +0.000 N +ATOM 826 HE ARG 222 -28.584 1.970 -6.072 0.00 0.00 +0.000 HD +ATOM 827 CZ ARG 222 -27.579 3.356 -5.019 0.00 0.00 +0.000 C +ATOM 828 NH1 ARG 222 -27.451 4.607 -4.667 0.00 0.00 +0.000 N +ATOM 829 HH11 ARG 222 -28.128 5.288 -4.979 0.00 0.00 +0.000 HD +ATOM 830 HH12 ARG 222 -26.675 4.887 -4.085 0.00 0.00 +0.000 HD +ATOM 831 NH2 ARG 222 -26.680 2.514 -4.594 0.00 0.00 +0.000 N +ATOM 832 HH21 ARG 222 -26.746 1.538 -4.848 0.00 0.00 +0.000 HD +ATOM 833 HH22 ARG 222 -25.921 2.840 -4.013 0.00 0.00 +0.000 HD +ATOM 834 C ARG 222 -28.956 3.715 -11.231 0.00 0.00 +0.000 C +ATOM 835 O ARG 222 -29.484 4.630 -11.850 0.00 0.00 +0.000 OA +ATOM 836 N ASN 223 -27.737 3.270 -11.524 0.00 0.00 +0.000 N +ATOM 837 H ASN 223 -27.359 2.496 -10.996 0.00 0.00 +0.000 HD +ATOM 838 CA ASN 223 -26.890 3.897 -12.542 0.00 0.00 +0.000 C +ATOM 839 HA ASN 223 -26.866 4.979 -12.412 0.00 0.00 +0.000 HD +ATOM 840 CB ASN 223 -25.461 3.354 -12.390 0.00 0.00 +0.000 C +ATOM 841 HB2 ASN 223 -25.527 2.266 -12.373 0.00 0.00 +0.000 HD +ATOM 842 HB3 ASN 223 -24.864 3.668 -13.246 0.00 0.00 +0.000 HD +ATOM 843 CG ASN 223 -24.771 3.819 -11.121 0.00 0.00 +0.000 C +ATOM 844 OD1 ASN 223 -25.153 4.766 -10.456 0.00 0.00 +0.000 OA +ATOM 845 ND2 ASN 223 -23.694 3.167 -10.751 0.00 0.00 +0.000 N +ATOM 846 HD21 ASN 223 -23.204 3.444 -9.913 0.00 0.00 +0.000 HD +ATOM 847 HD22 ASN 223 -23.361 2.392 -11.306 0.00 0.00 +0.000 HD +ATOM 848 C ASN 223 -27.404 3.673 -13.972 0.00 0.00 +0.000 C +ATOM 849 O ASN 223 -27.159 4.496 -14.851 0.00 0.00 +0.000 OA +ATOM 850 N HIE 224 -28.110 2.566 -14.210 0.00 0.00 +0.000 N +ATOM 851 H HIE 224 -28.212 1.911 -13.448 0.00 0.00 +0.000 HD +ATOM 852 CA HIE 224 -28.603 2.174 -15.530 0.00 0.00 +0.000 C +ATOM 853 HA HIE 224 -28.363 2.941 -16.267 0.00 0.00 +0.000 HD +ATOM 854 CB HIE 224 -27.933 0.859 -15.957 0.00 0.00 +0.000 C +ATOM 855 HB2 HIE 224 -28.143 0.106 -15.197 0.00 0.00 +0.000 HD +ATOM 856 HB3 HIE 224 -28.275 0.499 -16.927 0.00 0.00 +0.000 HD +ATOM 857 CG HIE 224 -26.432 0.977 -16.045 0.00 0.00 +0.000 A +ATOM 858 ND1 HIE 224 -25.722 1.606 -17.042 0.00 0.00 +0.000 NA +ATOM 859 CE1 HIE 224 -24.416 1.531 -16.734 0.00 0.00 +0.000 A +ATOM 860 HE1 HIE 224 -23.693 1.971 -17.421 0.00 0.00 +0.000 HD +ATOM 861 NE2 HIE 224 -24.245 0.888 -15.568 0.00 0.00 +0.000 N +ATOM 862 HE2 HIE 224 -23.385 0.686 -15.079 0.00 0.00 +0.000 HD +ATOM 863 CD2 HIE 224 -25.522 0.531 -15.127 0.00 0.00 +0.000 A +ATOM 864 HD2 HIE 224 -25.642 -0.011 -14.189 0.00 0.00 +0.000 HD +ATOM 865 C HIE 224 -30.133 2.135 -15.615 0.00 0.00 +0.000 C +ATOM 866 O HIE 224 -30.676 1.497 -16.517 0.00 0.00 +0.000 OA +ATOM 867 N GLU 225 -30.838 2.840 -14.722 0.00 0.00 +0.000 N +ATOM 868 H GLU 225 -30.329 3.385 -14.042 0.00 0.00 +0.000 HD +ATOM 869 CA GLU 225 -32.301 2.797 -14.625 0.00 0.00 +0.000 C +ATOM 870 HA GLU 225 -32.631 1.792 -14.364 0.00 0.00 +0.000 HD +ATOM 871 CB GLU 225 -32.775 3.769 -13.533 0.00 0.00 +0.000 C +ATOM 872 HB2 GLU 225 -32.296 3.510 -12.588 0.00 0.00 +0.000 HD +ATOM 873 HB3 GLU 225 -32.498 4.786 -13.813 0.00 0.00 +0.000 HD +ATOM 874 CG GLU 225 -34.299 3.679 -13.375 0.00 0.00 +0.000 C +ATOM 875 HG2 GLU 225 -34.727 4.026 -14.315 0.00 0.00 +0.000 HD +ATOM 876 HG3 GLU 225 -34.546 2.628 -13.230 0.00 0.00 +0.000 HD +ATOM 877 CD GLU 225 -34.873 4.501 -12.219 0.00 0.00 +0.000 C +ATOM 878 OE1 GLU 225 -36.101 4.350 -12.023 0.00 0.00 +0.000 OA +ATOM 879 OE2 GLU 225 -34.118 5.254 -11.566 0.00 0.00 +0.000 OA +ATOM 880 C GLU 225 -32.985 3.099 -15.967 0.00 0.00 +0.000 C +ATOM 881 O GLU 225 -33.809 2.313 -16.431 0.00 0.00 +0.000 OA +ATOM 882 N THR 226 -32.600 4.183 -16.647 0.00 0.00 +0.000 N +ATOM 883 H THR 226 -31.893 4.781 -16.241 0.00 0.00 +0.000 HD +ATOM 884 CA THR 226 -33.178 4.569 -17.947 0.00 0.00 +0.000 C +ATOM 885 HA THR 226 -34.250 4.731 -17.833 0.00 0.00 +0.000 HD +ATOM 886 CB THR 226 -32.535 5.871 -18.450 0.00 0.00 +0.000 C +ATOM 887 HB THR 226 -31.491 5.657 -18.677 0.00 0.00 +0.000 HD +ATOM 888 CG2 THR 226 -33.220 6.439 -19.693 0.00 0.00 +0.000 C +ATOM 889 HG21 THR 226 -34.264 6.654 -19.467 0.00 0.00 +0.000 HD +ATOM 890 HG22 THR 226 -32.718 7.357 -19.997 0.00 0.00 +0.000 HD +ATOM 891 HG23 THR 226 -33.166 5.710 -20.503 0.00 0.00 +0.000 HD +ATOM 892 OG1 THR 226 -32.619 6.853 -17.446 0.00 0.00 +0.000 OA +ATOM 893 HG1 THR 226 -32.217 7.666 -17.760 0.00 0.00 +0.000 HD +ATOM 894 C THR 226 -32.994 3.484 -19.011 0.00 0.00 +0.000 C +ATOM 895 O THR 226 -33.915 3.189 -19.776 0.00 0.00 +0.000 OA +ATOM 896 N ALA 227 -31.816 2.856 -19.053 0.00 0.00 +0.000 N +ATOM 897 H ALA 227 -31.068 3.177 -18.455 0.00 0.00 +0.000 HD +ATOM 898 CA ALA 227 -31.537 1.772 -19.990 0.00 0.00 +0.000 C +ATOM 899 HA ALA 227 -31.826 2.074 -20.997 0.00 0.00 +0.000 HD +ATOM 900 CB ALA 227 -30.031 1.481 -19.981 0.00 0.00 +0.000 C +ATOM 901 HB1 ALA 227 -29.728 1.168 -18.982 0.00 0.00 +0.000 HD +ATOM 902 HB2 ALA 227 -29.809 0.686 -20.693 0.00 0.00 +0.000 HD +ATOM 903 HB3 ALA 227 -29.485 2.382 -20.261 0.00 0.00 +0.000 HD +ATOM 904 C ALA 227 -32.369 0.527 -19.650 0.00 0.00 +0.000 C +ATOM 905 O ALA 227 -32.960 -0.085 -20.540 0.00 0.00 +0.000 OA +ATOM 906 N PHE 228 -32.468 0.185 -18.363 0.00 0.00 +0.000 N +ATOM 907 H PHE 228 -31.923 0.716 -17.698 0.00 0.00 +0.000 HD +ATOM 908 CA PHE 228 -33.241 -0.955 -17.873 0.00 0.00 +0.000 C +ATOM 909 HA PHE 228 -32.960 -1.861 -18.409 0.00 0.00 +0.000 HD +ATOM 910 CB PHE 228 -32.958 -1.162 -16.377 0.00 0.00 +0.000 C +ATOM 911 HB2 PHE 228 -32.903 -0.179 -15.910 0.00 0.00 +0.000 HD +ATOM 912 HB3 PHE 228 -33.768 -1.733 -15.925 0.00 0.00 +0.000 HD +ATOM 913 CG PHE 228 -31.666 -1.885 -16.026 0.00 0.00 +0.000 A +ATOM 914 CD1 PHE 228 -30.559 -1.933 -16.900 0.00 0.00 +0.000 A +ATOM 915 HD1 PHE 228 -30.594 -1.382 -17.839 0.00 0.00 +0.000 HD +ATOM 916 CE1 PHE 228 -29.418 -2.683 -16.568 0.00 0.00 +0.000 A +ATOM 917 HE1 PHE 228 -28.576 -2.728 -17.258 0.00 0.00 +0.000 HD +ATOM 918 CZ PHE 228 -29.362 -3.373 -15.347 0.00 0.00 +0.000 A +ATOM 919 HZ PHE 228 -28.486 -3.969 -15.092 0.00 0.00 +0.000 HD +ATOM 920 CE2 PHE 228 -30.440 -3.294 -14.453 0.00 0.00 +0.000 A +ATOM 921 HE2 PHE 228 -30.388 -3.809 -13.494 0.00 0.00 +0.000 HD +ATOM 922 CD2 PHE 228 -31.586 -2.553 -14.791 0.00 0.00 +0.000 A +ATOM 923 HD2 PHE 228 -32.421 -2.492 -14.093 0.00 0.00 +0.000 HD +ATOM 924 C PHE 228 -34.735 -0.778 -18.147 0.00 0.00 +0.000 C +ATOM 925 O PHE 228 -35.365 -1.699 -18.662 0.00 0.00 +0.000 OA +ATOM 926 N GLN 229 -35.287 0.416 -17.919 0.00 0.00 +0.000 N +ATOM 927 H GLN 229 -34.732 1.119 -17.451 0.00 0.00 +0.000 HD +ATOM 928 CA GLN 229 -36.664 0.749 -18.285 0.00 0.00 +0.000 C +ATOM 929 HA GLN 229 -37.357 0.077 -17.778 0.00 0.00 +0.000 HD +ATOM 930 CB GLN 229 -36.989 2.192 -17.872 0.00 0.00 +0.000 C +ATOM 931 HB2 GLN 229 -36.172 2.821 -18.226 0.00 0.00 +0.000 HD +ATOM 932 HB3 GLN 229 -37.911 2.473 -18.382 0.00 0.00 +0.000 HD +ATOM 933 CG GLN 229 -37.164 2.385 -16.357 0.00 0.00 +0.000 C +ATOM 934 HG2 GLN 229 -37.914 1.698 -15.965 0.00 0.00 +0.000 HD +ATOM 935 HG3 GLN 229 -36.198 2.167 -15.902 0.00 0.00 +0.000 HD +ATOM 936 CD GLN 229 -37.566 3.810 -15.989 0.00 0.00 +0.000 C +ATOM 937 OE1 GLN 229 -37.952 4.605 -16.836 0.00 0.00 +0.000 OA +ATOM 938 NE2 GLN 229 -37.548 4.182 -14.727 0.00 0.00 +0.000 N +ATOM 939 HE21 GLN 229 -37.814 5.124 -14.478 0.00 0.00 +0.000 HD +ATOM 940 HE22 GLN 229 -37.268 3.524 -14.013 0.00 0.00 +0.000 HD +ATOM 941 C GLN 229 -36.903 0.593 -19.793 0.00 0.00 +0.000 C +ATOM 942 O GLN 229 -37.908 0.012 -20.203 0.00 0.00 +0.000 OA +ATOM 943 N GLY 230 -35.980 1.080 -20.629 0.00 0.00 +0.000 N +ATOM 944 H GLY 230 -35.188 1.577 -20.246 0.00 0.00 +0.000 HD +ATOM 945 CA GLY 230 -36.063 0.924 -22.082 0.00 0.00 +0.000 C +ATOM 946 HA2 GLY 230 -36.981 1.402 -22.425 0.00 0.00 +0.000 HD +ATOM 947 HA3 GLY 230 -35.204 1.425 -22.530 0.00 0.00 +0.000 HD +ATOM 948 C GLY 230 -36.070 -0.543 -22.523 0.00 0.00 +0.000 C +ATOM 949 O GLY 230 -36.877 -0.925 -23.370 0.00 0.00 +0.000 OA +ATOM 950 N MET 231 -35.212 -1.375 -21.927 0.00 0.00 +0.000 N +ATOM 951 H MET 231 -34.527 -0.984 -21.297 0.00 0.00 +0.000 HD +ATOM 952 CA MET 231 -35.165 -2.818 -22.197 0.00 0.00 +0.000 C +ATOM 953 HA MET 231 -35.120 -2.994 -23.272 0.00 0.00 +0.000 HD +ATOM 954 CB MET 231 -33.923 -3.443 -21.546 0.00 0.00 +0.000 C +ATOM 955 HB2 MET 231 -33.887 -3.138 -20.500 0.00 0.00 +0.000 HD +ATOM 956 HB3 MET 231 -34.007 -4.528 -21.604 0.00 0.00 +0.000 HD +ATOM 957 CG MET 231 -32.642 -2.990 -22.254 0.00 0.00 +0.000 C +ATOM 958 HG2 MET 231 -32.770 -3.222 -23.311 0.00 0.00 +0.000 HD +ATOM 959 HG3 MET 231 -32.577 -1.910 -22.125 0.00 0.00 +0.000 HD +ATOM 960 SD MET 231 -31.111 -3.754 -21.657 0.00 0.00 +0.000 S +ATOM 961 CE MET 231 -31.034 -3.150 -19.957 0.00 0.00 +0.000 C +ATOM 962 HE1 MET 231 -31.919 -3.480 -19.413 0.00 0.00 +0.000 HD +ATOM 963 HE2 MET 231 -30.141 -3.543 -19.472 0.00 0.00 +0.000 HD +ATOM 964 HE3 MET 231 -30.996 -2.060 -19.960 0.00 0.00 +0.000 HD +ATOM 965 C MET 231 -36.432 -3.531 -21.721 0.00 0.00 +0.000 C +ATOM 966 O MET 231 -37.022 -4.284 -22.488 0.00 0.00 +0.000 OA +ATOM 967 N LEU 232 -36.899 -3.242 -20.504 0.00 0.00 +0.000 N +ATOM 968 H LEU 232 -36.350 -2.631 -19.917 0.00 0.00 +0.000 HD +ATOM 969 CA LEU 232 -38.124 -3.818 -19.949 0.00 0.00 +0.000 C +ATOM 970 HA LEU 232 -38.053 -4.905 -19.890 0.00 0.00 +0.000 HD +ATOM 971 CB LEU 232 -38.315 -3.261 -18.528 0.00 0.00 +0.000 C +ATOM 972 HB2 LEU 232 -37.422 -3.530 -17.964 0.00 0.00 +0.000 HD +ATOM 973 HB3 LEU 232 -38.386 -2.176 -18.601 0.00 0.00 +0.000 HD +ATOM 974 CG LEU 232 -39.560 -3.809 -17.809 0.00 0.00 +0.000 C +ATOM 975 HG LEU 232 -40.423 -3.662 -18.458 0.00 0.00 +0.000 HD +ATOM 976 CD1 LEU 232 -39.417 -5.294 -17.481 0.00 0.00 +0.000 C +ATOM 977 HD11 LEU 232 -38.554 -5.442 -16.832 0.00 0.00 +0.000 HD +ATOM 978 HD12 LEU 232 -40.316 -5.643 -16.974 0.00 0.00 +0.000 HD +ATOM 979 HD13 LEU 232 -39.278 -5.860 -18.402 0.00 0.00 +0.000 HD +ATOM 980 CD2 LEU 232 -39.775 -3.032 -16.515 0.00 0.00 +0.000 C +ATOM 981 HD21 LEU 232 -39.921 -1.976 -16.744 0.00 0.00 +0.000 HD +ATOM 982 HD22 LEU 232 -40.656 -3.416 -16.001 0.00 0.00 +0.000 HD +ATOM 983 HD23 LEU 232 -38.902 -3.146 -15.873 0.00 0.00 +0.000 HD +ATOM 984 C LEU 232 -39.342 -3.531 -20.842 0.00 0.00 +0.000 C +ATOM 985 O LEU 232 -40.116 -4.438 -21.134 0.00 0.00 +0.000 OA +ATOM 986 N ARG 233 -39.476 -2.293 -21.343 0.00 0.00 +0.000 N +ATOM 987 H ARG 233 -38.835 -1.574 -21.040 0.00 0.00 +0.000 HD +ATOM 988 CA ARG 233 -40.552 -1.922 -22.280 0.00 0.00 +0.000 C +ATOM 989 HA ARG 233 -41.519 -2.180 -21.849 0.00 0.00 +0.000 HD +ATOM 990 CB ARG 233 -40.529 -0.417 -22.564 0.00 0.00 +0.000 C +ATOM 991 HB2 ARG 233 -39.502 -0.136 -22.797 0.00 0.00 +0.000 HD +ATOM 992 HB3 ARG 233 -41.162 -0.231 -23.432 0.00 0.00 +0.000 HD +ATOM 993 CG ARG 233 -41.028 0.416 -21.380 0.00 0.00 +0.000 C +ATOM 994 HG2 ARG 233 -42.055 0.139 -21.140 0.00 0.00 +0.000 HD +ATOM 995 HG3 ARG 233 -40.393 0.244 -20.512 0.00 0.00 +0.000 HD +ATOM 996 CD ARG 233 -40.977 1.899 -21.763 0.00 0.00 +0.000 C +ATOM 997 HD2 ARG 233 -39.994 2.127 -22.175 0.00 0.00 +0.000 HD +ATOM 998 HD3 ARG 233 -41.741 2.101 -22.513 0.00 0.00 +0.000 HD +ATOM 999 NE ARG 233 -41.215 2.770 -20.601 0.00 0.00 +0.000 N +ATOM 1000 HE ARG 233 -41.509 2.300 -19.757 0.00 0.00 +0.000 HD +ATOM 1001 CZ ARG 233 -41.085 4.084 -20.578 0.00 0.00 +0.000 C +ATOM 1002 NH1 ARG 233 -40.835 4.773 -21.659 0.00 0.00 +0.000 N +ATOM 1003 HH11 ARG 233 -40.736 4.298 -22.545 0.00 0.00 +0.000 HD +ATOM 1004 HH12 ARG 233 -40.742 5.777 -21.605 0.00 0.00 +0.000 HD +ATOM 1005 NH2 ARG 233 -41.194 4.738 -19.456 0.00 0.00 +0.000 N +ATOM 1006 HH21 ARG 233 -41.380 4.236 -18.599 0.00 0.00 +0.000 HD +ATOM 1007 HH22 ARG 233 -41.093 5.743 -19.449 0.00 0.00 +0.000 HD +ATOM 1008 C ARG 233 -40.470 -2.675 -23.604 0.00 0.00 +0.000 C +ATOM 1009 O ARG 233 -41.504 -3.035 -24.149 0.00 0.00 +0.000 OA +ATOM 1010 N LYS 234 -39.262 -2.899 -24.132 0.00 0.00 +0.000 N +ATOM 1011 H LYS 234 -38.451 -2.504 -23.677 0.00 0.00 +0.000 HD +ATOM 1012 CA LYS 234 -39.063 -3.651 -25.384 0.00 0.00 +0.000 C +ATOM 1013 HA LYS 234 -39.734 -3.271 -26.154 0.00 0.00 +0.000 HD +ATOM 1014 CB LYS 234 -37.620 -3.502 -25.875 0.00 0.00 +0.000 C +ATOM 1015 HB2 LYS 234 -36.958 -3.639 -25.019 0.00 0.00 +0.000 HD +ATOM 1016 HB3 LYS 234 -37.432 -4.287 -26.608 0.00 0.00 +0.000 HD +ATOM 1017 CG LYS 234 -37.353 -2.135 -26.511 0.00 0.00 +0.000 C +ATOM 1018 HG2 LYS 234 -38.006 -1.999 -27.374 0.00 0.00 +0.000 HD +ATOM 1019 HG3 LYS 234 -37.546 -1.347 -25.782 0.00 0.00 +0.000 HD +ATOM 1020 CD LYS 234 -35.890 -2.066 -26.962 0.00 0.00 +0.000 C +ATOM 1021 HD2 LYS 234 -35.245 -2.187 -26.092 0.00 0.00 +0.000 HD +ATOM 1022 HD3 LYS 234 -35.700 -2.873 -27.669 0.00 0.00 +0.000 HD +ATOM 1023 CE LYS 234 -35.594 -0.722 -27.632 0.00 0.00 +0.000 C +ATOM 1024 HE2 LYS 234 -36.271 -0.597 -28.478 0.00 0.00 +0.000 HD +ATOM 1025 HE3 LYS 234 -35.768 0.075 -26.909 0.00 0.00 +0.000 HD +ATOM 1026 NZ LYS 234 -34.189 -0.659 -28.109 0.00 0.00 +0.000 N +ATOM 1027 HZ1 LYS 234 -34.028 -1.397 -28.779 0.00 0.00 +0.000 HD +ATOM 1028 HZ2 LYS 234 -34.021 0.236 -28.545 0.00 0.00 +0.000 HD +ATOM 1029 HZ3 LYS 234 -33.562 -0.774 -27.325 0.00 0.00 +0.000 HD +ATOM 1030 C LYS 234 -39.398 -5.134 -25.240 0.00 0.00 +0.000 C +ATOM 1031 O LYS 234 -39.814 -5.739 -26.220 0.00 0.00 +0.000 OA +ATOM 1032 N LEU 235 -39.190 -5.701 -24.053 0.00 0.00 +0.000 N +ATOM 1033 H LEU 235 -38.744 -5.154 -23.332 0.00 0.00 +0.000 HD +ATOM 1034 CA LEU 235 -39.505 -7.100 -23.768 0.00 0.00 +0.000 C +ATOM 1035 HA LEU 235 -39.251 -7.733 -24.618 0.00 0.00 +0.000 HD +ATOM 1036 CB LEU 235 -38.681 -7.555 -22.555 0.00 0.00 +0.000 C +ATOM 1037 HB2 LEU 235 -38.876 -6.834 -21.761 0.00 0.00 +0.000 HD +ATOM 1038 HB3 LEU 235 -39.049 -8.536 -22.251 0.00 0.00 +0.000 HD +ATOM 1039 CG LEU 235 -37.167 -7.634 -22.815 0.00 0.00 +0.000 C +ATOM 1040 HG LEU 235 -36.830 -6.740 -23.340 0.00 0.00 +0.000 HD +ATOM 1041 CD1 LEU 235 -36.458 -7.729 -21.470 0.00 0.00 +0.000 C +ATOM 1042 HD11 LEU 235 -36.794 -8.622 -20.944 0.00 0.00 +0.000 HD +ATOM 1043 HD12 LEU 235 -35.381 -7.786 -21.629 0.00 0.00 +0.000 HD +ATOM 1044 HD13 LEU 235 -36.690 -6.847 -20.872 0.00 0.00 +0.000 HD +ATOM 1045 CD2 LEU 235 -36.782 -8.836 -23.676 0.00 0.00 +0.000 C +ATOM 1046 HD21 LEU 235 -37.285 -8.768 -24.641 0.00 0.00 +0.000 HD +ATOM 1047 HD22 LEU 235 -35.703 -8.843 -23.829 0.00 0.00 +0.000 HD +ATOM 1048 HD23 LEU 235 -37.083 -9.754 -23.173 0.00 0.00 +0.000 HD +ATOM 1049 C LEU 235 -41.004 -7.340 -23.534 0.00 0.00 +0.000 C +ATOM 1050 O LEU 235 -41.434 -8.475 -23.667 0.00 0.00 +0.000 OA +ATOM 1051 N ASP 236 -41.773 -6.296 -23.197 0.00 0.00 +0.000 N +ATOM 1052 H ASP 236 -41.279 -5.463 -22.912 0.00 0.00 +0.000 HD +ATOM 1053 CA ASP 236 -43.237 -6.337 -23.015 0.00 0.00 +0.000 C +ATOM 1054 HA ASP 236 -43.560 -5.492 -22.409 0.00 0.00 +0.000 HD +ATOM 1055 CB ASP 236 -43.948 -6.263 -24.381 0.00 0.00 +0.000 C +ATOM 1056 HB2 ASP 236 -43.478 -5.519 -25.023 0.00 0.00 +0.000 HD +ATOM 1057 HB3 ASP 236 -43.805 -7.255 -24.810 0.00 0.00 +0.000 HD +ATOM 1058 CG ASP 236 -45.451 -5.967 -24.267 0.00 0.00 +0.000 C +ATOM 1059 OD1 ASP 236 -45.874 -5.225 -23.349 0.00 0.00 +0.000 OA +ATOM 1060 OD2 ASP 236 -46.236 -6.406 -25.143 0.00 0.00 +0.000 OA +ATOM 1061 C ASP 236 -43.724 -7.487 -22.108 0.00 0.00 +0.000 C +ATOM 1062 O ASP 236 -44.690 -8.183 -22.407 0.00 0.00 +0.000 OA +ATOM 1063 N ILE 237 -43.035 -7.691 -20.979 0.00 0.00 +0.000 N +ATOM 1064 H ILE 237 -42.252 -7.083 -20.787 0.00 0.00 +0.000 HD +ATOM 1065 CA ILE 237 -43.295 -8.805 -20.054 0.00 0.00 +0.000 C +ATOM 1066 HA ILE 237 -43.458 -9.735 -20.599 0.00 0.00 +0.000 HD +ATOM 1067 CB ILE 237 -42.128 -8.989 -19.057 0.00 0.00 +0.000 C +ATOM 1068 HB ILE 237 -42.022 -8.078 -18.468 0.00 0.00 +0.000 HD +ATOM 1069 CG2 ILE 237 -42.391 -10.182 -18.114 0.00 0.00 +0.000 C +ATOM 1070 HG21 ILE 237 -42.497 -11.095 -18.701 0.00 0.00 +0.000 HD +ATOM 1071 HG22 ILE 237 -41.556 -10.291 -17.422 0.00 0.00 +0.000 HD +ATOM 1072 HG23 ILE 237 -43.308 -10.006 -17.551 0.00 0.00 +0.000 HD +ATOM 1073 CG1 ILE 237 -40.789 -9.181 -19.808 0.00 0.00 +0.000 C +ATOM 1074 HG12 ILE 237 -40.865 -10.116 -20.364 0.00 0.00 +0.000 HD +ATOM 1075 HG13 ILE 237 -40.694 -8.350 -20.508 0.00 0.00 +0.000 HD +ATOM 1076 CD1 ILE 237 -39.559 -9.225 -18.898 0.00 0.00 +0.000 C +ATOM 1077 HD11 ILE 237 -39.654 -10.056 -18.199 0.00 0.00 +0.000 HD +ATOM 1078 HD12 ILE 237 -38.663 -9.361 -19.504 0.00 0.00 +0.000 HD +ATOM 1079 HD13 ILE 237 -39.483 -8.290 -18.344 0.00 0.00 +0.000 HD +ATOM 1080 C ILE 237 -44.631 -8.592 -19.330 0.00 0.00 +0.000 C +ATOM 1081 O ILE 237 -44.774 -7.654 -18.536 0.00 0.00 +0.000 OA +ATOM 1082 N LYS 238 -45.589 -9.489 -19.576 0.00 0.00 +0.000 N +ATOM 1083 H LYS 238 -45.343 -10.234 -20.212 0.00 0.00 +0.000 HD +ATOM 1084 CA LYS 238 -46.952 -9.464 -19.022 0.00 0.00 +0.000 C +ATOM 1085 HA LYS 238 -47.078 -8.632 -18.330 0.00 0.00 +0.000 HD +ATOM 1086 CB LYS 238 -47.936 -9.286 -20.187 0.00 0.00 +0.000 C +ATOM 1087 HB2 LYS 238 -47.690 -10.017 -20.956 0.00 0.00 +0.000 HD +ATOM 1088 HB3 LYS 238 -48.943 -9.477 -19.815 0.00 0.00 +0.000 HD +ATOM 1089 CG LYS 238 -47.872 -7.877 -20.784 0.00 0.00 +0.000 C +ATOM 1090 HG2 LYS 238 -48.379 -7.183 -20.113 0.00 0.00 +0.000 HD +ATOM 1091 HG3 LYS 238 -46.828 -7.582 -20.889 0.00 0.00 +0.000 HD +ATOM 1092 CD LYS 238 -48.549 -7.848 -22.152 0.00 0.00 +0.000 C +ATOM 1093 HD2 LYS 238 -47.977 -8.437 -22.869 0.00 0.00 +0.000 HD +ATOM 1094 HD3 LYS 238 -49.561 -8.245 -22.081 0.00 0.00 +0.000 HD +ATOM 1095 CE LYS 238 -48.605 -6.397 -22.618 0.00 0.00 +0.000 C +ATOM 1096 HE2 LYS 238 -49.486 -5.927 -22.179 0.00 0.00 +0.000 HD +ATOM 1097 HE3 LYS 238 -47.708 -5.887 -22.267 0.00 0.00 +0.000 HD +ATOM 1098 NZ LYS 238 -48.680 -6.302 -24.086 0.00 0.00 +0.000 N +ATOM 1099 HZ1 LYS 238 -49.512 -6.773 -24.411 0.00 0.00 +0.000 HD +ATOM 1100 HZ2 LYS 238 -48.716 -5.330 -24.359 0.00 0.00 +0.000 HD +ATOM 1101 HZ3 LYS 238 -47.865 -6.737 -24.494 0.00 0.00 +0.000 HD +ATOM 1102 C LYS 238 -47.313 -10.731 -18.252 0.00 0.00 +0.000 C +ATOM 1103 O LYS 238 -48.158 -10.670 -17.363 0.00 0.00 +0.000 OA +ATOM 1104 N ASN 239 -46.726 -11.870 -18.605 0.00 0.00 +0.000 N +ATOM 1105 H ASN 239 -46.056 -11.833 -19.361 0.00 0.00 +0.000 HD +ATOM 1106 CA ASN 239 -47.063 -13.177 -18.040 0.00 0.00 +0.000 C +ATOM 1107 HA ASN 239 -47.381 -13.091 -17.001 0.00 0.00 +0.000 HD +ATOM 1108 CB ASN 239 -48.235 -13.750 -18.867 0.00 0.00 +0.000 C +ATOM 1109 HB2 ASN 239 -48.464 -14.727 -18.443 0.00 0.00 +0.000 HD +ATOM 1110 HB3 ASN 239 -49.122 -13.117 -18.821 0.00 0.00 +0.000 HD +ATOM 1111 CG ASN 239 -47.846 -13.932 -20.322 0.00 0.00 +0.000 C +ATOM 1112 OD1 ASN 239 -46.968 -14.709 -20.634 0.00 0.00 +0.000 OA +ATOM 1113 ND2 ASN 239 -48.417 -13.191 -21.237 0.00 0.00 +0.000 N +ATOM 1114 HD21 ASN 239 -48.163 -13.306 -22.208 0.00 0.00 +0.000 HD +ATOM 1115 HD22 ASN 239 -49.110 -12.506 -20.967 0.00 0.00 +0.000 HD +ATOM 1116 C ASN 239 -45.839 -14.119 -17.988 0.00 0.00 +0.000 C +ATOM 1117 O ASN 239 -44.724 -13.747 -18.357 0.00 0.00 +0.000 OA +ATOM 1118 N GLU 240 -46.048 -15.347 -17.509 0.00 0.00 +0.000 N +ATOM 1119 H GLU 240 -46.982 -15.569 -17.197 0.00 0.00 +0.000 HD +ATOM 1120 CA GLU 240 -45.005 -16.374 -17.372 0.00 0.00 +0.000 C +ATOM 1121 HA GLU 240 -44.182 -16.016 -16.754 0.00 0.00 +0.000 HD +ATOM 1122 CB GLU 240 -45.635 -17.600 -16.691 0.00 0.00 +0.000 C +ATOM 1123 HB2 GLU 240 -46.254 -17.241 -15.869 0.00 0.00 +0.000 HD +ATOM 1124 HB3 GLU 240 -46.264 -18.102 -17.428 0.00 0.00 +0.000 HD +ATOM 1125 CG GLU 240 -44.591 -18.590 -16.152 0.00 0.00 +0.000 C +ATOM 1126 HG2 GLU 240 -43.867 -18.718 -16.957 0.00 0.00 +0.000 HD +ATOM 1127 HG3 GLU 240 -44.086 -18.202 -15.268 0.00 0.00 +0.000 HD +ATOM 1128 CD GLU 240 -45.231 -19.943 -15.822 0.00 0.00 +0.000 C +ATOM 1129 OE1 GLU 240 -44.695 -20.964 -16.328 0.00 0.00 +0.000 OA +ATOM 1130 OE2 GLU 240 -46.277 -19.953 -15.139 0.00 0.00 +0.000 OA +ATOM 1131 C GLU 240 -44.376 -16.794 -18.715 0.00 0.00 +0.000 C +ATOM 1132 O GLU 240 -43.177 -17.075 -18.780 0.00 0.00 +0.000 OA +ATOM 1133 N ASP 241 -45.147 -16.813 -19.807 0.00 0.00 +0.000 N +ATOM 1134 H ASP 241 -46.136 -16.630 -19.714 0.00 0.00 +0.000 HD +ATOM 1135 CA ASP 241 -44.630 -17.188 -21.130 0.00 0.00 +0.000 C +ATOM 1136 HA ASP 241 -44.063 -18.115 -21.048 0.00 0.00 +0.000 HD +ATOM 1137 CB ASP 241 -45.774 -17.400 -22.137 0.00 0.00 +0.000 C +ATOM 1138 HB2 ASP 241 -46.341 -16.469 -22.103 0.00 0.00 +0.000 HD +ATOM 1139 HB3 ASP 241 -45.377 -17.547 -23.141 0.00 0.00 +0.000 HD +ATOM 1140 CG ASP 241 -46.694 -18.571 -21.774 0.00 0.00 +0.000 C +ATOM 1141 OD1 ASP 241 -46.169 -19.585 -21.243 0.00 0.00 +0.000 OA +ATOM 1142 OD2 ASP 241 -47.901 -18.478 -22.097 0.00 0.00 +0.000 OA +ATOM 1143 C ASP 241 -43.621 -16.153 -21.645 0.00 0.00 +0.000 C +ATOM 1144 O ASP 241 -42.603 -16.510 -22.249 0.00 0.00 +0.000 OA +ATOM 1145 N ASP 242 -43.832 -14.877 -21.315 0.00 0.00 +0.000 N +ATOM 1146 H ASP 242 -44.707 -14.626 -20.878 0.00 0.00 +0.000 HD +ATOM 1147 CA ASP 242 -42.877 -13.811 -21.620 0.00 0.00 +0.000 C +ATOM 1148 HA ASP 242 -42.592 -13.868 -22.670 0.00 0.00 +0.000 HD +ATOM 1149 CB ASP 242 -43.488 -12.432 -21.351 0.00 0.00 +0.000 C +ATOM 1150 HB2 ASP 242 -43.614 -12.336 -20.273 0.00 0.00 +0.000 HD +ATOM 1151 HB3 ASP 242 -42.765 -11.694 -21.699 0.00 0.00 +0.000 HD +ATOM 1152 CG ASP 242 -44.832 -12.196 -22.045 0.00 0.00 +0.000 C +ATOM 1153 OD1 ASP 242 -44.991 -12.596 -23.218 0.00 0.00 +0.000 OA +ATOM 1154 OD2 ASP 242 -45.705 -11.606 -21.365 0.00 0.00 +0.000 OA +ATOM 1155 C ASP 242 -41.577 -13.980 -20.815 0.00 0.00 +0.000 C +ATOM 1156 O ASP 242 -40.487 -13.743 -21.341 0.00 0.00 +0.000 OA +ATOM 1157 N VAL 243 -41.650 -14.474 -19.572 0.00 0.00 +0.000 N +ATOM 1158 H VAL 243 -42.561 -14.551 -19.141 0.00 0.00 +0.000 HD +ATOM 1159 CA VAL 243 -40.462 -14.798 -18.759 0.00 0.00 +0.000 C +ATOM 1160 HA VAL 243 -39.774 -13.953 -18.775 0.00 0.00 +0.000 HD +ATOM 1161 CB VAL 243 -40.840 -15.098 -17.292 0.00 0.00 +0.000 C +ATOM 1162 HB VAL 243 -41.597 -15.882 -17.294 0.00 0.00 +0.000 HD +ATOM 1163 CG1 VAL 243 -39.638 -15.552 -16.456 0.00 0.00 +0.000 C +ATOM 1164 HG11 VAL 243 -38.880 -14.768 -16.454 0.00 0.00 +0.000 HD +ATOM 1165 HG12 VAL 243 -39.959 -15.750 -15.433 0.00 0.00 +0.000 HD +ATOM 1166 HG13 VAL 243 -39.218 -16.461 -16.886 0.00 0.00 +0.000 HD +ATOM 1167 CG2 VAL 243 -41.415 -13.834 -16.641 0.00 0.00 +0.000 C +ATOM 1168 HG21 VAL 243 -42.304 -13.515 -17.186 0.00 0.00 +0.000 HD +ATOM 1169 HG22 VAL 243 -41.682 -14.047 -15.606 0.00 0.00 +0.000 HD +ATOM 1170 HG23 VAL 243 -40.669 -13.039 -16.667 0.00 0.00 +0.000 HD +ATOM 1171 C VAL 243 -39.656 -15.943 -19.382 0.00 0.00 +0.000 C +ATOM 1172 O VAL 243 -38.430 -15.861 -19.446 0.00 0.00 +0.000 OA +ATOM 1173 N LYS 244 -40.310 -16.964 -19.948 0.00 0.00 +0.000 N +ATOM 1174 H LYS 244 -41.308 -17.045 -19.813 0.00 0.00 +0.000 HD +ATOM 1175 CA LYS 244 -39.619 -18.019 -20.719 0.00 0.00 +0.000 C +ATOM 1176 HA LYS 244 -38.819 -18.454 -20.120 0.00 0.00 +0.000 HD +ATOM 1177 CB LYS 244 -40.608 -19.132 -21.096 0.00 0.00 +0.000 C +ATOM 1178 HB2 LYS 244 -41.460 -18.673 -21.598 0.00 0.00 +0.000 HD +ATOM 1179 HB3 LYS 244 -40.106 -19.812 -21.783 0.00 0.00 +0.000 HD +ATOM 1180 CG LYS 244 -41.098 -19.913 -19.871 0.00 0.00 +0.000 C +ATOM 1181 HG2 LYS 244 -40.262 -20.485 -19.471 0.00 0.00 +0.000 HD +ATOM 1182 HG3 LYS 244 -41.440 -19.198 -19.122 0.00 0.00 +0.000 HD +ATOM 1183 CD LYS 244 -42.246 -20.866 -20.230 0.00 0.00 +0.000 C +ATOM 1184 HD2 LYS 244 -43.055 -20.321 -20.717 0.00 0.00 +0.000 HD +ATOM 1185 HD3 LYS 244 -41.890 -21.656 -20.891 0.00 0.00 +0.000 HD +ATOM 1186 CE LYS 244 -42.761 -21.484 -18.925 0.00 0.00 +0.000 C +ATOM 1187 HE2 LYS 244 -42.203 -22.405 -18.754 0.00 0.00 +0.000 HD +ATOM 1188 HE3 LYS 244 -42.552 -20.779 -18.121 0.00 0.00 +0.000 HD +ATOM 1189 NZ LYS 244 -44.210 -21.784 -18.954 0.00 0.00 +0.000 N +ATOM 1190 HZ1 LYS 244 -44.404 -22.438 -19.699 0.00 0.00 +0.000 HD +ATOM 1191 HZ2 LYS 244 -44.489 -22.188 -18.071 0.00 0.00 +0.000 HD +ATOM 1192 HZ3 LYS 244 -44.727 -20.931 -19.113 0.00 0.00 +0.000 HD +ATOM 1193 C LYS 244 -38.950 -17.467 -21.979 0.00 0.00 +0.000 C +ATOM 1194 O LYS 244 -37.899 -17.950 -22.403 0.00 0.00 +0.000 OA +ATOM 1195 N SER 245 -39.543 -16.449 -22.604 0.00 0.00 +0.000 N +ATOM 1196 H SER 245 -40.485 -16.194 -22.344 0.00 0.00 +0.000 HD +ATOM 1197 CA SER 245 -38.930 -15.770 -23.750 0.00 0.00 +0.000 C +ATOM 1198 HA SER 245 -38.538 -16.508 -24.450 0.00 0.00 +0.000 HD +ATOM 1199 CB SER 245 -39.966 -14.906 -24.478 0.00 0.00 +0.000 C +ATOM 1200 HB2 SER 245 -39.672 -14.842 -25.526 0.00 0.00 +0.000 HD +ATOM 1201 HB3 SER 245 -40.931 -15.406 -24.402 0.00 0.00 +0.000 HD +ATOM 1202 OG SER 245 -40.066 -13.610 -23.940 0.00 0.00 +0.000 OA +ATOM 1203 HG SER 245 -40.724 -13.111 -24.428 0.00 0.00 +0.000 HD +ATOM 1204 C SER 245 -37.679 -14.978 -23.343 0.00 0.00 +0.000 C +ATOM 1205 O SER 245 -36.672 -15.009 -24.058 0.00 0.00 +0.000 OA +ATOM 1206 N LEU 246 -37.692 -14.367 -22.151 0.00 0.00 +0.000 N +ATOM 1207 H LEU 246 -38.570 -14.348 -21.652 0.00 0.00 +0.000 HD +ATOM 1208 CA LEU 246 -36.553 -13.652 -21.579 0.00 0.00 +0.000 C +ATOM 1209 HA LEU 246 -36.209 -12.874 -22.260 0.00 0.00 +0.000 HD +ATOM 1210 CB LEU 246 -36.988 -12.992 -20.257 0.00 0.00 +0.000 C +ATOM 1211 HB2 LEU 246 -37.802 -12.309 -20.503 0.00 0.00 +0.000 HD +ATOM 1212 HB3 LEU 246 -37.365 -13.787 -19.613 0.00 0.00 +0.000 HD +ATOM 1213 CG LEU 246 -35.879 -12.223 -19.523 0.00 0.00 +0.000 C +ATOM 1214 HG LEU 246 -35.090 -12.927 -19.259 0.00 0.00 +0.000 HD +ATOM 1215 CD1 LEU 246 -35.297 -11.110 -20.389 0.00 0.00 +0.000 C +ATOM 1216 HD11 LEU 246 -36.085 -10.405 -20.654 0.00 0.00 +0.000 HD +ATOM 1217 HD12 LEU 246 -34.516 -10.589 -19.836 0.00 0.00 +0.000 HD +ATOM 1218 HD13 LEU 246 -34.874 -11.539 -21.297 0.00 0.00 +0.000 HD +ATOM 1219 CD2 LEU 246 -36.440 -11.599 -18.250 0.00 0.00 +0.000 C +ATOM 1220 HD21 LEU 246 -36.825 -12.383 -17.600 0.00 0.00 +0.000 HD +ATOM 1221 HD22 LEU 246 -35.650 -11.054 -17.732 0.00 0.00 +0.000 HD +ATOM 1222 HD23 LEU 246 -37.246 -10.911 -18.506 0.00 0.00 +0.000 HD +ATOM 1223 C LEU 246 -35.340 -14.574 -21.400 0.00 0.00 +0.000 C +ATOM 1224 O LEU 246 -34.221 -14.152 -21.689 0.00 0.00 +0.000 OA +ATOM 1225 N SER 247 -35.545 -15.844 -21.037 0.00 0.00 +0.000 N +ATOM 1226 H SER 247 -36.483 -16.115 -20.779 0.00 0.00 +0.000 HD +ATOM 1227 CA SER 247 -34.483 -16.864 -20.978 0.00 0.00 +0.000 C +ATOM 1228 HA SER 247 -33.807 -16.647 -20.152 0.00 0.00 +0.000 HD +ATOM 1229 CB SER 247 -35.088 -18.253 -20.762 0.00 0.00 +0.000 C +ATOM 1230 HB2 SER 247 -35.567 -18.574 -21.687 0.00 0.00 +0.000 HD +ATOM 1231 HB3 SER 247 -34.289 -18.948 -20.507 0.00 0.00 +0.000 HD +ATOM 1232 OG SER 247 -36.040 -18.230 -19.725 0.00 0.00 +0.000 OA +ATOM 1233 HG SER 247 -36.406 -19.109 -19.607 0.00 0.00 +0.000 HD +ATOM 1234 C SER 247 -33.642 -16.912 -22.252 0.00 0.00 +0.000 C +ATOM 1235 O SER 247 -32.414 -16.952 -22.193 0.00 0.00 +0.000 OA +ATOM 1236 N ARG 248 -34.292 -16.840 -23.420 0.00 0.00 +0.000 N +ATOM 1237 H ARG 248 -35.302 -16.824 -23.411 0.00 0.00 +0.000 HD +ATOM 1238 CA ARG 248 -33.607 -16.857 -24.721 0.00 0.00 +0.000 C +ATOM 1239 HA ARG 248 -32.907 -17.693 -24.756 0.00 0.00 +0.000 HD +ATOM 1240 CB ARG 248 -34.616 -17.015 -25.864 0.00 0.00 +0.000 C +ATOM 1241 HB2 ARG 248 -35.304 -16.169 -25.828 0.00 0.00 +0.000 HD +ATOM 1242 HB3 ARG 248 -34.067 -16.994 -26.805 0.00 0.00 +0.000 HD +ATOM 1243 CG ARG 248 -35.409 -18.324 -25.764 0.00 0.00 +0.000 C +ATOM 1244 HG2 ARG 248 -34.719 -19.167 -25.798 0.00 0.00 +0.000 HD +ATOM 1245 HG3 ARG 248 -35.958 -18.341 -24.823 0.00 0.00 +0.000 HD +ATOM 1246 CD ARG 248 -36.393 -18.423 -26.931 0.00 0.00 +0.000 C +ATOM 1247 HD2 ARG 248 -37.099 -17.594 -26.882 0.00 0.00 +0.000 HD +ATOM 1248 HD3 ARG 248 -35.846 -18.380 -27.872 0.00 0.00 +0.000 HD +ATOM 1249 NE ARG 248 -37.145 -19.689 -26.879 0.00 0.00 +0.000 N +ATOM 1250 HE ARG 248 -36.790 -20.374 -26.228 0.00 0.00 +0.000 HD +ATOM 1251 CZ ARG 248 -38.207 -19.996 -27.600 0.00 0.00 +0.000 C +ATOM 1252 NH1 ARG 248 -38.701 -19.170 -28.482 0.00 0.00 +0.000 N +ATOM 1253 HH11 ARG 248 -38.266 -18.269 -28.624 0.00 0.00 +0.000 HD +ATOM 1254 HH12 ARG 248 -39.514 -19.436 -29.017 0.00 0.00 +0.000 HD +ATOM 1255 NH2 ARG 248 -38.801 -21.144 -27.436 0.00 0.00 +0.000 N +ATOM 1256 HH21 ARG 248 -38.447 -21.801 -26.755 0.00 0.00 +0.000 HD +ATOM 1257 HH22 ARG 248 -39.613 -21.373 -27.991 0.00 0.00 +0.000 HD +ATOM 1258 C ARG 248 -32.761 -15.604 -24.923 0.00 0.00 +0.000 C +ATOM 1259 O ARG 248 -31.647 -15.699 -25.424 0.00 0.00 +0.000 OA +ATOM 1260 N VAL 249 -33.257 -14.446 -24.490 0.00 0.00 +0.000 N +ATOM 1261 H VAL 249 -34.212 -14.429 -24.160 0.00 0.00 +0.000 HD +ATOM 1262 CA VAL 249 -32.516 -13.177 -24.546 0.00 0.00 +0.000 C +ATOM 1263 HA VAL 249 -32.107 -13.026 -25.546 0.00 0.00 +0.000 HD +ATOM 1264 CB VAL 249 -33.432 -11.985 -24.203 0.00 0.00 +0.000 C +ATOM 1265 HB VAL 249 -33.805 -12.122 -23.188 0.00 0.00 +0.000 HD +ATOM 1266 CG1 VAL 249 -32.689 -10.645 -24.297 0.00 0.00 +0.000 C +ATOM 1267 HG11 VAL 249 -32.316 -10.507 -25.313 0.00 0.00 +0.000 HD +ATOM 1268 HG12 VAL 249 -33.371 -9.833 -24.047 0.00 0.00 +0.000 HD +ATOM 1269 HG13 VAL 249 -31.852 -10.644 -23.600 0.00 0.00 +0.000 HD +ATOM 1270 CG2 VAL 249 -34.639 -11.923 -25.149 0.00 0.00 +0.000 C +ATOM 1271 HG21 VAL 249 -35.218 -12.843 -25.061 0.00 0.00 +0.000 HD +ATOM 1272 HG22 VAL 249 -35.267 -11.073 -24.882 0.00 0.00 +0.000 HD +ATOM 1273 HG23 VAL 249 -34.291 -11.811 -26.175 0.00 0.00 +0.000 HD +ATOM 1274 C VAL 249 -31.293 -13.216 -23.626 0.00 0.00 +0.000 C +ATOM 1275 O VAL 249 -30.223 -12.750 -24.012 0.00 0.00 +0.000 OA +ATOM 1276 N MET 250 -31.410 -13.823 -22.441 0.00 0.00 +0.000 N +ATOM 1277 H MET 250 -32.318 -14.169 -22.167 0.00 0.00 +0.000 HD +ATOM 1278 CA MET 250 -30.306 -13.926 -21.479 0.00 0.00 +0.000 C +ATOM 1279 HA MET 250 -29.859 -12.945 -21.320 0.00 0.00 +0.000 HD +ATOM 1280 CB MET 250 -30.822 -14.452 -20.133 0.00 0.00 +0.000 C +ATOM 1281 HB2 MET 250 -31.357 -15.386 -20.303 0.00 0.00 +0.000 HD +ATOM 1282 HB3 MET 250 -29.971 -14.635 -19.478 0.00 0.00 +0.000 HD +ATOM 1283 CG MET 250 -31.764 -13.438 -19.475 0.00 0.00 +0.000 C +ATOM 1284 HG2 MET 250 -31.260 -12.472 -19.506 0.00 0.00 +0.000 HD +ATOM 1285 HG3 MET 250 -32.664 -13.397 -20.089 0.00 0.00 +0.000 HD +ATOM 1286 SD MET 250 -32.227 -13.811 -17.767 0.00 0.00 +0.000 S +ATOM 1287 CE MET 250 -33.280 -15.268 -17.964 0.00 0.00 +0.000 C +ATOM 1288 HE1 MET 250 -32.710 -16.068 -18.434 0.00 0.00 +0.000 HD +ATOM 1289 HE2 MET 250 -33.631 -15.597 -16.986 0.00 0.00 +0.000 HD +ATOM 1290 HE3 MET 250 -34.136 -15.016 -18.590 0.00 0.00 +0.000 HD +ATOM 1291 C MET 250 -29.142 -14.784 -21.988 0.00 0.00 +0.000 C +ATOM 1292 O MET 250 -27.989 -14.446 -21.728 0.00 0.00 +0.000 OA +ATOM 1293 N ILE 251 -29.403 -15.834 -22.775 0.00 0.00 +0.000 N +ATOM 1294 H ILE 251 -30.364 -16.122 -22.891 0.00 0.00 +0.000 HD +ATOM 1295 CA ILE 251 -28.345 -16.646 -23.412 0.00 0.00 +0.000 C +ATOM 1296 HA ILE 251 -27.653 -17.035 -22.665 0.00 0.00 +0.000 HD +ATOM 1297 CB ILE 251 -28.974 -17.824 -24.195 0.00 0.00 +0.000 C +ATOM 1298 HB ILE 251 -29.753 -17.426 -24.844 0.00 0.00 +0.000 HD +ATOM 1299 CG2 ILE 251 -27.927 -18.569 -25.047 0.00 0.00 +0.000 C +ATOM 1300 HG21 ILE 251 -27.148 -18.968 -24.398 0.00 0.00 +0.000 HD +ATOM 1301 HG22 ILE 251 -28.409 -19.388 -25.581 0.00 0.00 +0.000 HD +ATOM 1302 HG23 ILE 251 -27.484 -17.879 -25.765 0.00 0.00 +0.000 HD +ATOM 1303 CG1 ILE 251 -29.645 -18.811 -23.212 0.00 0.00 +0.000 C +ATOM 1304 HG12 ILE 251 -28.845 -19.317 -22.672 0.00 0.00 +0.000 HD +ATOM 1305 HG13 ILE 251 -30.234 -18.216 -22.514 0.00 0.00 +0.000 HD +ATOM 1306 CD1 ILE 251 -30.547 -19.852 -23.884 0.00 0.00 +0.000 C +ATOM 1307 HD11 ILE 251 -29.959 -20.448 -24.582 0.00 0.00 +0.000 HD +ATOM 1308 HD12 ILE 251 -30.978 -20.504 -23.125 0.00 0.00 +0.000 HD +ATOM 1309 HD13 ILE 251 -31.347 -19.347 -24.424 0.00 0.00 +0.000 HD +ATOM 1310 C ILE 251 -27.451 -15.780 -24.314 0.00 0.00 +0.000 C +ATOM 1311 O ILE 251 -26.231 -15.954 -24.346 0.00 0.00 +0.000 OA +ATOM 1312 N HIE 252 -28.031 -14.791 -25.002 0.00 0.00 +0.000 N +ATOM 1313 H HIE 252 -29.037 -14.704 -24.985 0.00 0.00 +0.000 HD +ATOM 1314 CA HIE 252 -27.274 -13.908 -25.889 0.00 0.00 +0.000 C +ATOM 1315 HA HIE 252 -26.597 -14.496 -26.509 0.00 0.00 +0.000 HD +ATOM 1316 CB HIE 252 -28.227 -13.132 -26.805 0.00 0.00 +0.000 C +ATOM 1317 HB2 HIE 252 -29.047 -12.694 -26.235 0.00 0.00 +0.000 HD +ATOM 1318 HB3 HIE 252 -27.690 -12.343 -27.332 0.00 0.00 +0.000 HD +ATOM 1319 CG HIE 252 -28.853 -14.006 -27.858 0.00 0.00 +0.000 A +ATOM 1320 ND1 HIE 252 -28.202 -14.536 -28.948 0.00 0.00 +0.000 NA +ATOM 1321 CE1 HIE 252 -29.091 -15.251 -29.655 0.00 0.00 +0.000 A +ATOM 1322 HE1 HIE 252 -28.751 -15.757 -30.558 0.00 0.00 +0.000 HD +ATOM 1323 NE2 HIE 252 -30.301 -15.202 -29.077 0.00 0.00 +0.000 N +ATOM 1324 HE2 HIE 252 -31.163 -15.632 -29.380 0.00 0.00 +0.000 HD +ATOM 1325 CD2 HIE 252 -30.157 -14.417 -27.928 0.00 0.00 +0.000 A +ATOM 1326 HD2 HIE 252 -31.015 -14.238 -27.279 0.00 0.00 +0.000 HD +ATOM 1327 C HIE 252 -26.309 -12.969 -25.153 0.00 0.00 +0.000 C +ATOM 1328 O HIE 252 -25.345 -12.516 -25.770 0.00 0.00 +0.000 OA +ATOM 1329 N VAL 253 -26.491 -12.729 -23.848 0.00 0.00 +0.000 N +ATOM 1330 H VAL 253 -27.300 -13.140 -23.404 0.00 0.00 +0.000 HD +ATOM 1331 CA VAL 253 -25.607 -11.868 -23.035 0.00 0.00 +0.000 C +ATOM 1332 HA VAL 253 -25.595 -10.857 -23.442 0.00 0.00 +0.000 HD +ATOM 1333 CB VAL 253 -26.106 -11.806 -21.576 0.00 0.00 +0.000 C +ATOM 1334 HB VAL 253 -26.177 -12.831 -21.213 0.00 0.00 +0.000 HD +ATOM 1335 CG1 VAL 253 -25.192 -10.996 -20.643 0.00 0.00 +0.000 C +ATOM 1336 HG11 VAL 253 -25.121 -9.971 -21.004 0.00 0.00 +0.000 HD +ATOM 1337 HG12 VAL 253 -25.607 -10.998 -19.636 0.00 0.00 +0.000 HD +ATOM 1338 HG13 VAL 253 -24.199 -11.445 -20.627 0.00 0.00 +0.000 HD +ATOM 1339 CG2 VAL 253 -27.493 -11.160 -21.509 0.00 0.00 +0.000 C +ATOM 1340 HG21 VAL 253 -28.196 -11.748 -22.099 0.00 0.00 +0.000 HD +ATOM 1341 HG22 VAL 253 -27.829 -11.125 -20.473 0.00 0.00 +0.000 HD +ATOM 1342 HG23 VAL 253 -27.442 -10.147 -21.909 0.00 0.00 +0.000 HD +ATOM 1343 C VAL 253 -24.156 -12.355 -23.051 0.00 0.00 +0.000 C +ATOM 1344 O VAL 253 -23.235 -11.544 -22.984 0.00 0.00 +0.000 OA +ATOM 1345 N PHE 254 -23.943 -13.667 -23.163 0.00 0.00 +0.000 N +ATOM 1346 H PHE 254 -24.749 -14.275 -23.183 0.00 0.00 +0.000 HD +ATOM 1347 CA PHE 254 -22.612 -14.280 -23.149 0.00 0.00 +0.000 C +ATOM 1348 HA PHE 254 -21.847 -13.520 -22.989 0.00 0.00 +0.000 HD +ATOM 1349 CB PHE 254 -22.536 -15.297 -22.013 0.00 0.00 +0.000 C +ATOM 1350 HB2 PHE 254 -23.257 -16.086 -22.229 0.00 0.00 +0.000 HD +ATOM 1351 HB3 PHE 254 -21.537 -15.727 -21.950 0.00 0.00 +0.000 HD +ATOM 1352 CG PHE 254 -22.870 -14.772 -20.633 0.00 0.00 +0.000 A +ATOM 1353 CD1 PHE 254 -21.951 -13.942 -19.962 0.00 0.00 +0.000 A +ATOM 1354 HD1 PHE 254 -21.018 -13.660 -20.448 0.00 0.00 +0.000 HD +ATOM 1355 CE1 PHE 254 -22.237 -13.479 -18.665 0.00 0.00 +0.000 A +ATOM 1356 HE1 PHE 254 -21.527 -12.835 -18.146 0.00 0.00 +0.000 HD +ATOM 1357 CZ PHE 254 -23.440 -13.848 -18.038 0.00 0.00 +0.000 A +ATOM 1358 HZ PHE 254 -23.666 -13.487 -17.034 0.00 0.00 +0.000 HD +ATOM 1359 CE2 PHE 254 -24.354 -14.684 -18.705 0.00 0.00 +0.000 A +ATOM 1360 HE2 PHE 254 -25.281 -14.977 -18.214 0.00 0.00 +0.000 HD +ATOM 1361 CD2 PHE 254 -24.073 -15.140 -20.004 0.00 0.00 +0.000 A +ATOM 1362 HD2 PHE 254 -24.787 -15.779 -20.523 0.00 0.00 +0.000 HD +ATOM 1363 C PHE 254 -22.207 -14.906 -24.491 0.00 0.00 +0.000 C +ATOM 1364 O PHE 254 -21.304 -15.749 -24.528 0.00 0.00 +0.000 OA +ATOM 1365 N SER 255 -22.892 -14.530 -25.575 0.00 0.00 +0.000 N +ATOM 1366 H SER 255 -23.639 -13.861 -25.452 0.00 0.00 +0.000 HD +ATOM 1367 CA SER 255 -22.694 -15.117 -26.909 0.00 0.00 +0.000 C +ATOM 1368 HA SER 255 -22.559 -16.195 -26.820 0.00 0.00 +0.000 HD +ATOM 1369 CB SER 255 -23.907 -14.849 -27.805 0.00 0.00 +0.000 C +ATOM 1370 HB2 SER 255 -23.720 -15.322 -28.768 0.00 0.00 +0.000 HD +ATOM 1371 HB3 SER 255 -24.776 -15.312 -27.336 0.00 0.00 +0.000 HD +ATOM 1372 OG SER 255 -24.156 -13.466 -27.998 0.00 0.00 +0.000 OA +ATOM 1373 HG SER 255 -24.923 -13.355 -28.564 0.00 0.00 +0.000 HD +ATOM 1374 C SER 255 -21.407 -14.673 -27.608 0.00 0.00 +0.000 C +ATOM 1375 O SER 255 -20.943 -15.359 -28.512 0.00 0.00 +0.000 OA +ATOM 1376 N ASP 256 -20.783 -13.585 -27.156 0.00 0.00 +0.000 N +ATOM 1377 H ASP 256 -21.279 -13.017 -26.485 0.00 0.00 +0.000 HD +ATOM 1378 CA ASP 256 -19.480 -13.113 -27.644 0.00 0.00 +0.000 C +ATOM 1379 HA ASP 256 -19.366 -13.330 -28.706 0.00 0.00 +0.000 HD +ATOM 1380 CB ASP 256 -19.396 -11.592 -27.442 0.00 0.00 +0.000 C +ATOM 1381 HB2 ASP 256 -18.478 -11.279 -27.940 0.00 0.00 +0.000 HD +ATOM 1382 HB3 ASP 256 -20.250 -11.113 -27.921 0.00 0.00 +0.000 HD +ATOM 1383 CG ASP 256 -19.342 -11.182 -25.972 0.00 0.00 +0.000 C +ATOM 1384 OD1 ASP 256 -19.484 -12.039 -25.068 0.00 0.00 +0.000 OA +ATOM 1385 OD2 ASP 256 -19.200 -9.973 -25.689 0.00 0.00 +0.000 OA +ATOM 1386 C ASP 256 -18.282 -13.839 -26.996 0.00 0.00 +0.000 C +ATOM 1387 O ASP 256 -17.133 -13.459 -27.207 0.00 0.00 +0.000 OA +ATOM 1388 N GLY 257 -18.540 -14.855 -26.166 0.00 0.00 +0.000 N +ATOM 1389 H GLY 257 -19.511 -15.097 -26.028 0.00 0.00 +0.000 HD +ATOM 1390 CA GLY 257 -17.524 -15.629 -25.452 0.00 0.00 +0.000 C +ATOM 1391 HA2 GLY 257 -17.972 -16.586 -25.186 0.00 0.00 +0.000 HD +ATOM 1392 HA3 GLY 257 -16.697 -15.795 -26.143 0.00 0.00 +0.000 HD +ATOM 1393 C GLY 257 -16.986 -14.960 -24.183 0.00 0.00 +0.000 C +ATOM 1394 O GLY 257 -16.421 -15.639 -23.324 0.00 0.00 +0.000 OA +ATOM 1395 N VAL 258 -17.219 -13.661 -23.980 0.00 0.00 +0.000 N +ATOM 1396 H VAL 258 -17.736 -13.144 -24.677 0.00 0.00 +0.000 HD +ATOM 1397 CA VAL 258 -16.640 -12.921 -22.854 0.00 0.00 +0.000 C +ATOM 1398 HA VAL 258 -15.684 -13.361 -22.572 0.00 0.00 +0.000 HD +ATOM 1399 CB VAL 258 -16.415 -11.439 -23.204 0.00 0.00 +0.000 C +ATOM 1400 HB VAL 258 -17.370 -11.006 -23.504 0.00 0.00 +0.000 HD +ATOM 1401 CG1 VAL 258 -15.850 -10.658 -22.007 0.00 0.00 +0.000 C +ATOM 1402 HG11 VAL 258 -14.896 -11.092 -21.707 0.00 0.00 +0.000 HD +ATOM 1403 HG12 VAL 258 -15.704 -9.616 -22.289 0.00 0.00 +0.000 HD +ATOM 1404 HG13 VAL 258 -16.551 -10.713 -21.173 0.00 0.00 +0.000 HD +ATOM 1405 CG2 VAL 258 -15.441 -11.290 -24.378 0.00 0.00 +0.000 C +ATOM 1406 HG21 VAL 258 -15.846 -11.797 -25.253 0.00 0.00 +0.000 HD +ATOM 1407 HG22 VAL 258 -15.301 -10.233 -24.602 0.00 0.00 +0.000 HD +ATOM 1408 HG23 VAL 258 -14.481 -11.734 -24.113 0.00 0.00 +0.000 HD +ATOM 1409 C VAL 258 -17.482 -13.102 -21.592 0.00 0.00 +0.000 C +ATOM 1410 O VAL 258 -18.664 -12.754 -21.530 0.00 0.00 +0.000 OA +ATOM 1411 N THR 259 -16.840 -13.604 -20.535 0.00 0.00 +0.000 N +ATOM 1412 H THR 259 -15.881 -13.892 -20.665 0.00 0.00 +0.000 HD +ATOM 1413 CA THR 259 -17.465 -13.832 -19.222 0.00 0.00 +0.000 C +ATOM 1414 HA THR 259 -18.455 -13.377 -19.207 0.00 0.00 +0.000 HD +ATOM 1415 CB THR 259 -17.610 -15.334 -18.936 0.00 0.00 +0.000 C +ATOM 1416 HB THR 259 -16.622 -15.742 -18.728 0.00 0.00 +0.000 HD +ATOM 1417 CG2 THR 259 -18.530 -15.595 -17.742 0.00 0.00 +0.000 C +ATOM 1418 HG21 THR 259 -19.520 -15.188 -17.948 0.00 0.00 +0.000 HD +ATOM 1419 HG22 THR 259 -18.608 -16.669 -17.571 0.00 0.00 +0.000 HD +ATOM 1420 HG23 THR 259 -18.119 -15.116 -16.854 0.00 0.00 +0.000 HD +ATOM 1421 OG1 THR 259 -18.163 -15.961 -20.080 0.00 0.00 +0.000 OA +ATOM 1422 HG1 THR 259 -18.259 -16.901 -19.913 0.00 0.00 +0.000 HD +ATOM 1423 C THR 259 -16.656 -13.136 -18.131 0.00 0.00 +0.000 C +ATOM 1424 O THR 259 -15.450 -13.339 -18.020 0.00 0.00 +0.000 OA +ATOM 1425 N ASN 260 -17.317 -12.285 -17.342 0.00 0.00 +0.000 N +ATOM 1426 H ASN 260 -18.258 -12.044 -17.617 0.00 0.00 +0.000 HD +ATOM 1427 CA ASN 260 -16.736 -11.604 -16.185 0.00 0.00 +0.000 C +ATOM 1428 HA ASN 260 -16.048 -12.274 -15.669 0.00 0.00 +0.000 HD +ATOM 1429 CB ASN 260 -15.962 -10.348 -16.630 0.00 0.00 +0.000 C +ATOM 1430 HB2 ASN 260 -15.459 -9.936 -15.754 0.00 0.00 +0.000 HD +ATOM 1431 HB3 ASN 260 -15.218 -10.647 -17.368 0.00 0.00 +0.000 HD +ATOM 1432 CG ASN 260 -16.840 -9.270 -17.235 0.00 0.00 +0.000 C +ATOM 1433 OD1 ASN 260 -17.654 -8.654 -16.567 0.00 0.00 +0.000 OA +ATOM 1434 ND2 ASN 260 -16.714 -9.008 -18.514 0.00 0.00 +0.000 N +ATOM 1435 HD21 ASN 260 -17.288 -8.294 -18.939 0.00 0.00 +0.000 HD +ATOM 1436 HD22 ASN 260 -16.042 -9.520 -19.068 0.00 0.00 +0.000 HD +ATOM 1437 C ASN 260 -17.817 -11.285 -15.140 0.00 0.00 +0.000 C +ATOM 1438 O ASN 260 -19.011 -11.256 -15.457 0.00 0.00 +0.000 OA +ATOM 1439 N TRP 261 -17.396 -10.999 -13.904 0.00 0.00 +0.000 N +ATOM 1440 H TRP 261 -16.408 -11.056 -13.703 0.00 0.00 +0.000 HD +ATOM 1441 CA TRP 261 -18.313 -10.702 -12.801 0.00 0.00 +0.000 C +ATOM 1442 HA TRP 261 -19.030 -11.514 -12.678 0.00 0.00 +0.000 HD +ATOM 1443 CB TRP 261 -17.520 -10.548 -11.499 0.00 0.00 +0.000 C +ATOM 1444 HB2 TRP 261 -16.682 -9.863 -11.631 0.00 0.00 +0.000 HD +ATOM 1445 HB3 TRP 261 -18.192 -10.154 -10.738 0.00 0.00 +0.000 HD +ATOM 1446 CG TRP 261 -16.952 -11.820 -10.951 0.00 0.00 +0.000 A +ATOM 1447 CD1 TRP 261 -15.660 -12.031 -10.614 0.00 0.00 +0.000 A +ATOM 1448 HD1 TRP 261 -14.960 -11.211 -10.774 0.00 0.00 +0.000 HD +ATOM 1449 NE1 TRP 261 -15.512 -13.311 -10.115 0.00 0.00 +0.000 N +ATOM 1450 HE1 TRP 261 -14.626 -13.678 -9.800 0.00 0.00 +0.000 HD +ATOM 1451 CE2 TRP 261 -16.709 -13.990 -10.103 0.00 0.00 +0.000 A +ATOM 1452 CZ2 TRP 261 -17.074 -15.278 -9.691 0.00 0.00 +0.000 A +ATOM 1453 HZ2 TRP 261 -16.279 -15.912 -9.295 0.00 0.00 +0.000 HD +ATOM 1454 CH2 TRP 261 -18.414 -15.679 -9.805 0.00 0.00 +0.000 A +ATOM 1455 HH2 TRP 261 -18.729 -16.676 -9.498 0.00 0.00 +0.000 HD +ATOM 1456 CZ3 TRP 261 -19.373 -14.792 -10.323 0.00 0.00 +0.000 A +ATOM 1457 HZ3 TRP 261 -20.421 -15.075 -10.417 0.00 0.00 +0.000 HD +ATOM 1458 CE3 TRP 261 -18.997 -13.500 -10.735 0.00 0.00 +0.000 A +ATOM 1459 HE3 TRP 261 -19.799 -12.870 -11.123 0.00 0.00 +0.000 HD +ATOM 1460 CD2 TRP 261 -17.656 -13.063 -10.635 0.00 0.00 +0.000 A +ATOM 1461 C TRP 261 -19.197 -9.474 -13.046 0.00 0.00 +0.000 C +ATOM 1462 O TRP 261 -20.350 -9.477 -12.623 0.00 0.00 +0.000 OA +ATOM 1463 N GLY 262 -18.709 -8.469 -13.781 0.00 0.00 +0.000 N +ATOM 1464 H GLY 262 -17.746 -8.537 -14.079 0.00 0.00 +0.000 HD +ATOM 1465 CA GLY 262 -19.478 -7.285 -14.179 0.00 0.00 +0.000 C +ATOM 1466 HA2 GLY 262 -19.810 -6.776 -13.274 0.00 0.00 +0.000 HD +ATOM 1467 HA3 GLY 262 -18.820 -6.626 -14.746 0.00 0.00 +0.000 HD +ATOM 1468 C GLY 262 -20.702 -7.626 -15.038 0.00 0.00 +0.000 C +ATOM 1469 O GLY 262 -21.806 -7.142 -14.790 0.00 0.00 +0.000 OA +ATOM 1470 N ARG 263 -20.545 -8.526 -16.015 0.00 0.00 +0.000 N +ATOM 1471 H ARG 263 -19.613 -8.851 -16.231 0.00 0.00 +0.000 HD +ATOM 1472 CA ARG 263 -21.665 -9.011 -16.843 0.00 0.00 +0.000 C +ATOM 1473 HA ARG 263 -22.251 -8.167 -17.206 0.00 0.00 +0.000 HD +ATOM 1474 CB ARG 263 -21.135 -9.793 -18.047 0.00 0.00 +0.000 C +ATOM 1475 HB2 ARG 263 -20.419 -10.534 -17.694 0.00 0.00 +0.000 HD +ATOM 1476 HB3 ARG 263 -21.971 -10.298 -18.530 0.00 0.00 +0.000 HD +ATOM 1477 CG ARG 263 -20.452 -8.862 -19.050 0.00 0.00 +0.000 C +ATOM 1478 HG2 ARG 263 -21.147 -8.086 -19.371 0.00 0.00 +0.000 HD +ATOM 1479 HG3 ARG 263 -19.577 -8.400 -18.593 0.00 0.00 +0.000 HD +ATOM 1480 CD ARG 263 -20.019 -9.686 -20.257 0.00 0.00 +0.000 C +ATOM 1481 HD2 ARG 263 -19.250 -10.394 -19.949 0.00 0.00 +0.000 HD +ATOM 1482 HD3 ARG 263 -20.880 -10.232 -20.644 0.00 0.00 +0.000 HD +ATOM 1483 NE ARG 263 -19.477 -8.838 -21.330 0.00 0.00 +0.000 N +ATOM 1484 HE ARG 263 -19.145 -7.915 -21.088 0.00 0.00 +0.000 HD +ATOM 1485 CZ ARG 263 -19.414 -9.217 -22.590 0.00 0.00 +0.000 C +ATOM 1486 NH1 ARG 263 -19.787 -10.400 -22.953 0.00 0.00 +0.000 N +ATOM 1487 HH11 ARG 263 -20.134 -11.050 -22.264 0.00 0.00 +0.000 HD +ATOM 1488 HH12 ARG 263 -19.729 -10.668 -23.925 0.00 0.00 +0.000 HD +ATOM 1489 NH2 ARG 263 -18.967 -8.430 -23.517 0.00 0.00 +0.000 N +ATOM 1490 HH21 ARG 263 -18.657 -7.499 -23.279 0.00 0.00 +0.000 HD +ATOM 1491 HH22 ARG 263 -18.932 -8.751 -24.475 0.00 0.00 +0.000 HD +ATOM 1492 C ARG 263 -22.643 -9.866 -16.046 0.00 0.00 +0.000 C +ATOM 1493 O ARG 263 -23.851 -9.688 -16.182 0.00 0.00 +0.000 OA +ATOM 1494 N ILE 264 -22.128 -10.740 -15.182 0.00 0.00 +0.000 N +ATOM 1495 H ILE 264 -21.127 -10.874 -15.177 0.00 0.00 +0.000 HD +ATOM 1496 CA ILE 264 -22.950 -11.594 -14.314 0.00 0.00 +0.000 C +ATOM 1497 HA ILE 264 -23.704 -12.128 -14.892 0.00 0.00 +0.000 HD +ATOM 1498 CB ILE 264 -22.061 -12.614 -13.564 0.00 0.00 +0.000 C +ATOM 1499 HB ILE 264 -21.245 -12.079 -13.079 0.00 0.00 +0.000 HD +ATOM 1500 CG2 ILE 264 -22.878 -13.375 -12.503 0.00 0.00 +0.000 C +ATOM 1501 HG21 ILE 264 -23.694 -13.910 -12.986 0.00 0.00 +0.000 HD +ATOM 1502 HG22 ILE 264 -22.232 -14.086 -11.988 0.00 0.00 +0.000 HD +ATOM 1503 HG23 ILE 264 -23.285 -12.667 -11.781 0.00 0.00 +0.000 HD +ATOM 1504 CG1 ILE 264 -21.432 -13.598 -14.577 0.00 0.00 +0.000 C +ATOM 1505 HG12 ILE 264 -22.237 -14.229 -14.954 0.00 0.00 +0.000 HD +ATOM 1506 HG13 ILE 264 -21.026 -13.001 -15.395 0.00 0.00 +0.000 HD +ATOM 1507 CD1 ILE 264 -20.326 -14.479 -13.989 0.00 0.00 +0.000 C +ATOM 1508 HD11 ILE 264 -20.732 -15.076 -13.172 0.00 0.00 +0.000 HD +ATOM 1509 HD12 ILE 264 -19.937 -15.140 -14.764 0.00 0.00 +0.000 HD +ATOM 1510 HD13 ILE 264 -19.521 -13.849 -13.613 0.00 0.00 +0.000 HD +ATOM 1511 C ILE 264 -23.796 -10.741 -13.360 0.00 0.00 +0.000 C +ATOM 1512 O ILE 264 -25.010 -10.926 -13.300 0.00 0.00 +0.000 OA +ATOM 1513 N VAL 265 -23.196 -9.762 -12.668 0.00 0.00 +0.000 N +ATOM 1514 H VAL 265 -22.189 -9.687 -12.677 0.00 0.00 +0.000 HD +ATOM 1515 CA VAL 265 -23.954 -8.885 -11.762 0.00 0.00 +0.000 C +ATOM 1516 HA VAL 265 -24.603 -9.480 -11.120 0.00 0.00 +0.000 HD +ATOM 1517 CB VAL 265 -23.043 -8.014 -10.871 0.00 0.00 +0.000 C +ATOM 1518 HB VAL 265 -22.326 -8.691 -10.406 0.00 0.00 +0.000 HD +ATOM 1519 CG1 VAL 265 -22.291 -6.896 -11.595 0.00 0.00 +0.000 C +ATOM 1520 HG11 VAL 265 -23.007 -6.218 -12.059 0.00 0.00 +0.000 HD +ATOM 1521 HG12 VAL 265 -21.681 -6.345 -10.880 0.00 0.00 +0.000 HD +ATOM 1522 HG13 VAL 265 -21.649 -7.328 -12.363 0.00 0.00 +0.000 HD +ATOM 1523 CG2 VAL 265 -23.850 -7.360 -9.748 0.00 0.00 +0.000 C +ATOM 1524 HG21 VAL 265 -24.309 -8.134 -9.132 0.00 0.00 +0.000 HD +ATOM 1525 HG22 VAL 265 -23.189 -6.751 -9.131 0.00 0.00 +0.000 HD +ATOM 1526 HG23 VAL 265 -24.628 -6.730 -10.177 0.00 0.00 +0.000 HD +ATOM 1527 C VAL 265 -24.982 -8.052 -12.519 0.00 0.00 +0.000 C +ATOM 1528 O VAL 265 -26.100 -7.904 -12.047 0.00 0.00 +0.000 OA +ATOM 1529 N THR 266 -24.660 -7.585 -13.728 0.00 0.00 +0.000 N +ATOM 1530 H THR 266 -23.722 -7.731 -14.073 0.00 0.00 +0.000 HD +ATOM 1531 CA THR 266 -25.600 -6.825 -14.566 0.00 0.00 +0.000 C +ATOM 1532 HA THR 266 -25.977 -5.972 -14.003 0.00 0.00 +0.000 HD +ATOM 1533 CB THR 266 -24.906 -6.311 -15.825 0.00 0.00 +0.000 C +ATOM 1534 HB THR 266 -24.540 -7.174 -16.381 0.00 0.00 +0.000 HD +ATOM 1535 CG2 THR 266 -25.839 -5.485 -16.718 0.00 0.00 +0.000 C +ATOM 1536 HG21 THR 266 -26.204 -4.622 -16.162 0.00 0.00 +0.000 HD +ATOM 1537 HG22 THR 266 -25.293 -5.145 -17.598 0.00 0.00 +0.000 HD +ATOM 1538 HG23 THR 266 -26.682 -6.101 -17.030 0.00 0.00 +0.000 HD +ATOM 1539 OG1 THR 266 -23.840 -5.495 -15.407 0.00 0.00 +0.000 OA +ATOM 1540 HG1 THR 266 -23.379 -5.153 -16.176 0.00 0.00 +0.000 HD +ATOM 1541 C THR 266 -26.811 -7.654 -14.967 0.00 0.00 +0.000 C +ATOM 1542 O THR 266 -27.936 -7.160 -14.888 0.00 0.00 +0.000 OA +ATOM 1543 N LEU 267 -26.597 -8.910 -15.364 0.00 0.00 +0.000 N +ATOM 1544 H LEU 267 -25.645 -9.223 -15.490 0.00 0.00 +0.000 HD +ATOM 1545 CA LEU 267 -27.677 -9.834 -15.692 0.00 0.00 +0.000 C +ATOM 1546 HA LEU 267 -28.303 -9.432 -16.489 0.00 0.00 +0.000 HD +ATOM 1547 CB LEU 267 -27.055 -11.156 -16.174 0.00 0.00 +0.000 C +ATOM 1548 HB2 LEU 267 -26.480 -10.933 -17.073 0.00 0.00 +0.000 HD +ATOM 1549 HB3 LEU 267 -26.382 -11.504 -15.390 0.00 0.00 +0.000 HD +ATOM 1550 CG LEU 267 -28.089 -12.250 -16.485 0.00 0.00 +0.000 C +ATOM 1551 HG LEU 267 -28.643 -12.474 -15.573 0.00 0.00 +0.000 HD +ATOM 1552 CD1 LEU 267 -29.060 -11.801 -17.572 0.00 0.00 +0.000 C +ATOM 1553 HD11 LEU 267 -28.507 -11.577 -18.484 0.00 0.00 +0.000 HD +ATOM 1554 HD12 LEU 267 -29.779 -12.596 -17.770 0.00 0.00 +0.000 HD +ATOM 1555 HD13 LEU 267 -29.589 -10.908 -17.241 0.00 0.00 +0.000 HD +ATOM 1556 CD2 LEU 267 -27.376 -13.512 -16.963 0.00 0.00 +0.000 C +ATOM 1557 HD21 LEU 267 -26.700 -13.866 -16.184 0.00 0.00 +0.000 HD +ATOM 1558 HD22 LEU 267 -28.112 -14.285 -17.183 0.00 0.00 +0.000 HD +ATOM 1559 HD23 LEU 267 -26.805 -13.288 -17.865 0.00 0.00 +0.000 HD +ATOM 1560 C LEU 267 -28.606 -10.042 -14.488 0.00 0.00 +0.000 C +ATOM 1561 O LEU 267 -29.820 -9.899 -14.613 0.00 0.00 +0.000 OA +ATOM 1562 N ILE 268 -28.034 -10.307 -13.311 0.00 0.00 +0.000 N +ATOM 1563 H ILE 268 -27.035 -10.450 -13.288 0.00 0.00 +0.000 HD +ATOM 1564 CA ILE 268 -28.795 -10.505 -12.069 0.00 0.00 +0.000 C +ATOM 1565 HA ILE 268 -29.605 -11.218 -12.218 0.00 0.00 +0.000 HD +ATOM 1566 CB ILE 268 -27.854 -11.018 -10.955 0.00 0.00 +0.000 C +ATOM 1567 HB ILE 268 -27.004 -10.342 -10.871 0.00 0.00 +0.000 HD +ATOM 1568 CG2 ILE 268 -28.595 -11.082 -9.608 0.00 0.00 +0.000 C +ATOM 1569 HG21 ILE 268 -29.445 -11.759 -9.692 0.00 0.00 +0.000 HD +ATOM 1570 HG22 ILE 268 -27.916 -11.446 -8.837 0.00 0.00 +0.000 HD +ATOM 1571 HG23 ILE 268 -28.949 -10.086 -9.340 0.00 0.00 +0.000 HD +ATOM 1572 CG1 ILE 268 -27.293 -12.416 -11.312 0.00 0.00 +0.000 C +ATOM 1573 HG12 ILE 268 -28.107 -13.132 -11.205 0.00 0.00 +0.000 HD +ATOM 1574 HG13 ILE 268 -26.972 -12.383 -12.353 0.00 0.00 +0.000 HD +ATOM 1575 CD1 ILE 268 -26.116 -12.844 -10.428 0.00 0.00 +0.000 C +ATOM 1576 HD11 ILE 268 -26.436 -12.877 -9.386 0.00 0.00 +0.000 HD +ATOM 1577 HD12 ILE 268 -25.773 -13.833 -10.733 0.00 0.00 +0.000 HD +ATOM 1578 HD13 ILE 268 -25.301 -12.128 -10.534 0.00 0.00 +0.000 HD +ATOM 1579 C ILE 268 -29.536 -9.216 -11.669 0.00 0.00 +0.000 C +ATOM 1580 O ILE 268 -30.711 -9.267 -11.311 0.00 0.00 +0.000 OA +ATOM 1581 N SER 269 -28.895 -8.051 -11.787 0.00 0.00 +0.000 N +ATOM 1582 H SER 269 -27.924 -8.087 -12.064 0.00 0.00 +0.000 HD +ATOM 1583 CA SER 269 -29.502 -6.735 -11.550 0.00 0.00 +0.000 C +ATOM 1584 HA SER 269 -29.864 -6.671 -10.523 0.00 0.00 +0.000 HD +ATOM 1585 CB SER 269 -28.468 -5.633 -11.773 0.00 0.00 +0.000 C +ATOM 1586 HB2 SER 269 -27.917 -5.842 -12.690 0.00 0.00 +0.000 HD +ATOM 1587 HB3 SER 269 -28.981 -4.676 -11.868 0.00 0.00 +0.000 HD +ATOM 1588 OG SER 269 -27.576 -5.581 -10.693 0.00 0.00 +0.000 OA +ATOM 1589 HG SER 269 -26.931 -4.885 -10.844 0.00 0.00 +0.000 HD +ATOM 1590 C SER 269 -30.673 -6.450 -12.481 0.00 0.00 +0.000 C +ATOM 1591 O SER 269 -31.685 -5.906 -12.040 0.00 0.00 +0.000 OA +ATOM 1592 N PHE 270 -30.560 -6.802 -13.762 0.00 0.00 +0.000 N +ATOM 1593 H PHE 270 -29.664 -7.100 -14.120 0.00 0.00 +0.000 HD +ATOM 1594 CA PHE 270 -31.671 -6.673 -14.698 0.00 0.00 +0.000 C +ATOM 1595 HA PHE 270 -32.122 -5.684 -14.608 0.00 0.00 +0.000 HD +ATOM 1596 CB PHE 270 -31.171 -6.853 -16.134 0.00 0.00 +0.000 C +ATOM 1597 HB2 PHE 270 -30.350 -6.186 -16.397 0.00 0.00 +0.000 HD +ATOM 1598 HB3 PHE 270 -30.853 -7.888 -16.260 0.00 0.00 +0.000 HD +ATOM 1599 CG PHE 270 -32.267 -6.611 -17.150 0.00 0.00 +0.000 A +ATOM 1600 CD1 PHE 270 -32.782 -7.672 -17.917 0.00 0.00 +0.000 A +ATOM 1601 HD1 PHE 270 -32.362 -8.673 -17.819 0.00 0.00 +0.000 HD +ATOM 1602 CE1 PHE 270 -33.839 -7.438 -18.814 0.00 0.00 +0.000 A +ATOM 1603 HE1 PHE 270 -34.233 -8.255 -19.419 0.00 0.00 +0.000 HD +ATOM 1604 CZ PHE 270 -34.390 -6.149 -18.930 0.00 0.00 +0.000 A +ATOM 1605 HZ PHE 270 -35.212 -5.973 -19.624 0.00 0.00 +0.000 HD +ATOM 1606 CE2 PHE 270 -33.886 -5.092 -18.158 0.00 0.00 +0.000 A +ATOM 1607 HE2 PHE 270 -34.319 -4.096 -18.241 0.00 0.00 +0.000 HD +ATOM 1608 CD2 PHE 270 -32.819 -5.322 -17.275 0.00 0.00 +0.000 A +ATOM 1609 HD2 PHE 270 -32.414 -4.500 -16.683 0.00 0.00 +0.000 HD +ATOM 1610 C PHE 270 -32.799 -7.651 -14.351 0.00 0.00 +0.000 C +ATOM 1611 O PHE 270 -33.962 -7.259 -14.342 0.00 0.00 +0.000 OA +ATOM 1612 N GLY 271 -32.468 -8.882 -13.950 0.00 0.00 +0.000 N +ATOM 1613 H GLY 271 -31.503 -9.167 -14.034 0.00 0.00 +0.000 HD +ATOM 1614 CA GLY 271 -33.428 -9.840 -13.395 0.00 0.00 +0.000 C +ATOM 1615 HA2 GLY 271 -34.141 -10.099 -14.178 0.00 0.00 +0.000 HD +ATOM 1616 HA3 GLY 271 -32.883 -10.733 -13.092 0.00 0.00 +0.000 HD +ATOM 1617 C GLY 271 -34.195 -9.288 -12.187 0.00 0.00 +0.000 C +ATOM 1618 O GLY 271 -35.417 -9.379 -12.139 0.00 0.00 +0.000 OA +ATOM 1619 N ALA 272 -33.512 -8.628 -11.250 0.00 0.00 +0.000 N +ATOM 1620 H ALA 272 -32.503 -8.641 -11.297 0.00 0.00 +0.000 HD +ATOM 1621 CA ALA 272 -34.146 -7.937 -10.123 0.00 0.00 +0.000 C +ATOM 1622 HA ALA 272 -34.770 -8.647 -9.582 0.00 0.00 +0.000 HD +ATOM 1623 CB ALA 272 -33.046 -7.440 -9.188 0.00 0.00 +0.000 C +ATOM 1624 HB1 ALA 272 -32.419 -6.720 -9.713 0.00 0.00 +0.000 HD +ATOM 1625 HB2 ALA 272 -33.497 -6.961 -8.318 0.00 0.00 +0.000 HD +ATOM 1626 HB3 ALA 272 -32.437 -8.283 -8.862 0.00 0.00 +0.000 HD +ATOM 1627 C ALA 272 -35.050 -6.770 -10.559 0.00 0.00 +0.000 C +ATOM 1628 O ALA 272 -36.110 -6.545 -9.969 0.00 0.00 +0.000 OA +ATOM 1629 N PHE 273 -34.661 -6.040 -11.607 0.00 0.00 +0.000 N +ATOM 1630 H PHE 273 -33.729 -6.179 -11.969 0.00 0.00 +0.000 HD +ATOM 1631 CA PHE 273 -35.483 -4.985 -12.197 0.00 0.00 +0.000 C +ATOM 1632 HA PHE 273 -35.817 -4.285 -11.432 0.00 0.00 +0.000 HD +ATOM 1633 CB PHE 273 -34.641 -4.222 -13.226 0.00 0.00 +0.000 C +ATOM 1634 HB2 PHE 273 -33.643 -4.007 -12.843 0.00 0.00 +0.000 HD +ATOM 1635 HB3 PHE 273 -34.560 -4.813 -14.139 0.00 0.00 +0.000 HD +ATOM 1636 CG PHE 273 -35.247 -2.897 -13.621 0.00 0.00 +0.000 A +ATOM 1637 CD1 PHE 273 -36.157 -2.820 -14.692 0.00 0.00 +0.000 A +ATOM 1638 HD1 PHE 273 -36.402 -3.712 -15.270 0.00 0.00 +0.000 HD +ATOM 1639 CE1 PHE 273 -36.751 -1.588 -15.016 0.00 0.00 +0.000 A +ATOM 1640 HE1 PHE 273 -37.451 -1.518 -15.848 0.00 0.00 +0.000 HD +ATOM 1641 CZ PHE 273 -36.440 -0.444 -14.261 0.00 0.00 +0.000 A +ATOM 1642 HZ PHE 273 -36.928 0.503 -14.496 0.00 0.00 +0.000 HD +ATOM 1643 CE2 PHE 273 -35.509 -0.513 -13.214 0.00 0.00 +0.000 A +ATOM 1644 HE2 PHE 273 -35.249 0.385 -12.652 0.00 0.00 +0.000 HD +ATOM 1645 CD2 PHE 273 -34.913 -1.741 -12.891 0.00 0.00 +0.000 A +ATOM 1646 HD2 PHE 273 -34.192 -1.800 -12.076 0.00 0.00 +0.000 HD +ATOM 1647 C PHE 273 -36.777 -5.551 -12.807 0.00 0.00 +0.000 C +ATOM 1648 O PHE 273 -37.860 -5.010 -12.581 0.00 0.00 +0.000 OA +ATOM 1649 N VAL 274 -36.685 -6.686 -13.510 0.00 0.00 +0.000 N +ATOM 1650 H VAL 274 -35.759 -7.013 -13.744 0.00 0.00 +0.000 HD +ATOM 1651 CA VAL 274 -37.841 -7.433 -14.030 0.00 0.00 +0.000 C +ATOM 1652 HA VAL 274 -38.499 -6.757 -14.576 0.00 0.00 +0.000 HD +ATOM 1653 CB VAL 274 -37.389 -8.558 -14.984 0.00 0.00 +0.000 C +ATOM 1654 HB VAL 274 -36.673 -9.188 -14.456 0.00 0.00 +0.000 HD +ATOM 1655 CG1 VAL 274 -38.570 -9.414 -15.459 0.00 0.00 +0.000 C +ATOM 1656 HG11 VAL 274 -39.286 -8.785 -15.988 0.00 0.00 +0.000 HD +ATOM 1657 HG12 VAL 274 -38.207 -10.195 -16.129 0.00 0.00 +0.000 HD +ATOM 1658 HG13 VAL 274 -39.056 -9.873 -14.598 0.00 0.00 +0.000 HD +ATOM 1659 CG2 VAL 274 -36.702 -8.001 -16.241 0.00 0.00 +0.000 C +ATOM 1660 HG21 VAL 274 -35.822 -7.426 -15.950 0.00 0.00 +0.000 HD +ATOM 1661 HG22 VAL 274 -36.399 -8.826 -16.885 0.00 0.00 +0.000 HD +ATOM 1662 HG23 VAL 274 -37.395 -7.356 -16.779 0.00 0.00 +0.000 HD +ATOM 1663 C VAL 274 -38.697 -7.991 -12.887 0.00 0.00 +0.000 C +ATOM 1664 O VAL 274 -39.917 -7.877 -12.941 0.00 0.00 +0.000 OA +ATOM 1665 N ALA 275 -38.099 -8.525 -11.817 0.00 0.00 +0.000 N +ATOM 1666 H ALA 275 -37.096 -8.642 -11.837 0.00 0.00 +0.000 HD +ATOM 1667 CA ALA 275 -38.836 -9.038 -10.659 0.00 0.00 +0.000 C +ATOM 1668 HA ALA 275 -39.532 -9.800 -11.009 0.00 0.00 +0.000 HD +ATOM 1669 CB ALA 275 -37.841 -9.691 -9.692 0.00 0.00 +0.000 C +ATOM 1670 HB1 ALA 275 -37.142 -8.938 -9.326 0.00 0.00 +0.000 HD +ATOM 1671 HB2 ALA 275 -38.382 -10.124 -8.851 0.00 0.00 +0.000 HD +ATOM 1672 HB3 ALA 275 -37.290 -10.476 -10.211 0.00 0.00 +0.000 HD +ATOM 1673 C ALA 275 -39.682 -7.949 -9.970 0.00 0.00 +0.000 C +ATOM 1674 O ALA 275 -40.830 -8.198 -9.598 0.00 0.00 +0.000 OA +ATOM 1675 N LYS 276 -39.162 -6.716 -9.870 0.00 0.00 +0.000 N +ATOM 1676 H LYS 276 -38.176 -6.593 -10.056 0.00 0.00 +0.000 HD +ATOM 1677 CA LYS 276 -39.938 -5.551 -9.412 0.00 0.00 +0.000 C +ATOM 1678 HA LYS 276 -40.380 -5.760 -8.437 0.00 0.00 +0.000 HD +ATOM 1679 CB LYS 276 -39.029 -4.317 -9.286 0.00 0.00 +0.000 C +ATOM 1680 HB2 LYS 276 -38.329 -4.292 -10.121 0.00 0.00 +0.000 HD +ATOM 1681 HB3 LYS 276 -39.637 -3.412 -9.294 0.00 0.00 +0.000 HD +ATOM 1682 CG LYS 276 -38.252 -4.396 -7.971 0.00 0.00 +0.000 C +ATOM 1683 HG2 LYS 276 -38.990 -4.486 -7.173 0.00 0.00 +0.000 HD +ATOM 1684 HG3 LYS 276 -37.651 -5.304 -8.014 0.00 0.00 +0.000 HD +ATOM 1685 CD LYS 276 -37.343 -3.196 -7.694 0.00 0.00 +0.000 C +ATOM 1686 HD2 LYS 276 -37.911 -2.283 -7.874 0.00 0.00 +0.000 HD +ATOM 1687 HD3 LYS 276 -37.034 -3.231 -6.649 0.00 0.00 +0.000 HD +ATOM 1688 CE LYS 276 -36.108 -3.211 -8.591 0.00 0.00 +0.000 C +ATOM 1689 HE2 LYS 276 -35.762 -4.239 -8.696 0.00 0.00 +0.000 HD +ATOM 1690 HE3 LYS 276 -36.380 -2.818 -9.570 0.00 0.00 +0.000 HD +ATOM 1691 NZ LYS 276 -35.028 -2.385 -8.012 0.00 0.00 +0.000 N +ATOM 1692 HZ1 LYS 276 -34.775 -2.750 -7.105 0.00 0.00 +0.000 HD +ATOM 1693 HZ2 LYS 276 -34.222 -2.409 -8.622 0.00 0.00 +0.000 HD +ATOM 1694 HZ3 LYS 276 -35.348 -1.432 -7.915 0.00 0.00 +0.000 HD +ATOM 1695 C LYS 276 -41.130 -5.262 -10.318 0.00 0.00 +0.000 C +ATOM 1696 O LYS 276 -42.234 -5.069 -9.821 0.00 0.00 +0.000 OA +ATOM 1697 N HIE 277 -40.937 -5.292 -11.636 0.00 0.00 +0.000 N +ATOM 1698 H HIE 277 -39.996 -5.361 -11.995 0.00 0.00 +0.000 HD +ATOM 1699 CA HIE 277 -42.036 -5.131 -12.594 0.00 0.00 +0.000 C +ATOM 1700 HA HIE 277 -42.576 -4.203 -12.399 0.00 0.00 +0.000 HD +ATOM 1701 CB HIE 277 -41.469 -5.076 -14.011 0.00 0.00 +0.000 C +ATOM 1702 HB2 HIE 277 -40.818 -4.216 -14.166 0.00 0.00 +0.000 HD +ATOM 1703 HB3 HIE 277 -40.912 -5.993 -14.205 0.00 0.00 +0.000 HD +ATOM 1704 CG HIE 277 -42.545 -4.997 -15.062 0.00 0.00 +0.000 A +ATOM 1705 ND1 HIE 277 -43.337 -3.880 -15.324 0.00 0.00 +0.000 NA +ATOM 1706 CE1 HIE 277 -44.188 -4.260 -16.290 0.00 0.00 +0.000 A +ATOM 1707 HE1 HIE 277 -44.924 -3.539 -16.644 0.00 0.00 +0.000 HD +ATOM 1708 NE2 HIE 277 -43.954 -5.534 -16.654 0.00 0.00 +0.000 N +ATOM 1709 HE2 HIE 277 -44.438 -6.059 -17.369 0.00 0.00 +0.000 HD +ATOM 1710 CD2 HIE 277 -42.928 -6.017 -15.881 0.00 0.00 +0.000 A +ATOM 1711 HD2 HIE 277 -42.587 -7.045 -16.007 0.00 0.00 +0.000 HD +ATOM 1712 C HIE 277 -43.095 -6.231 -12.446 0.00 0.00 +0.000 C +ATOM 1713 O HIE 277 -44.277 -5.916 -12.327 0.00 0.00 +0.000 OA +ATOM 1714 N LEU 278 -42.683 -7.499 -12.339 0.00 0.00 +0.000 N +ATOM 1715 H LEU 278 -41.700 -7.687 -12.467 0.00 0.00 +0.000 HD +ATOM 1716 CA LEU 278 -43.586 -8.634 -12.121 0.00 0.00 +0.000 C +ATOM 1717 HA LEU 278 -44.293 -8.714 -12.947 0.00 0.00 +0.000 HD +ATOM 1718 CB LEU 278 -42.778 -9.940 -12.037 0.00 0.00 +0.000 C +ATOM 1719 HB2 LEU 278 -41.981 -9.762 -11.315 0.00 0.00 +0.000 HD +ATOM 1720 HB3 LEU 278 -43.450 -10.707 -11.653 0.00 0.00 +0.000 HD +ATOM 1721 CG LEU 278 -42.166 -10.415 -13.370 0.00 0.00 +0.000 C +ATOM 1722 HG LEU 278 -41.594 -9.603 -13.819 0.00 0.00 +0.000 HD +ATOM 1723 CD1 LEU 278 -41.242 -11.604 -13.108 0.00 0.00 +0.000 C +ATOM 1724 HD11 LEU 278 -41.813 -12.417 -12.659 0.00 0.00 +0.000 HD +ATOM 1725 HD12 LEU 278 -40.807 -11.942 -14.049 0.00 0.00 +0.000 HD +ATOM 1726 HD13 LEU 278 -40.444 -11.303 -12.428 0.00 0.00 +0.000 HD +ATOM 1727 CD2 LEU 278 -43.233 -10.843 -14.377 0.00 0.00 +0.000 C +ATOM 1728 HD21 LEU 278 -43.892 -10.001 -14.589 0.00 0.00 +0.000 HD +ATOM 1729 HD22 LEU 278 -42.753 -11.169 -15.299 0.00 0.00 +0.000 HD +ATOM 1730 HD23 LEU 278 -43.816 -11.664 -13.962 0.00 0.00 +0.000 HD +ATOM 1731 C LEU 278 -44.447 -8.448 -10.863 0.00 0.00 +0.000 C +ATOM 1732 O LEU 278 -45.651 -8.697 -10.907 0.00 0.00 +0.000 OA +ATOM 1733 N LYS 279 -43.873 -7.927 -9.768 0.00 0.00 +0.000 N +ATOM 1734 H LYS 279 -42.866 -7.851 -9.735 0.00 0.00 +0.000 HD +ATOM 1735 CA LYS 279 -44.641 -7.553 -8.570 0.00 0.00 +0.000 C +ATOM 1736 HA LYS 279 -45.219 -8.406 -8.213 0.00 0.00 +0.000 HD +ATOM 1737 CB LYS 279 -43.680 -7.107 -7.453 0.00 0.00 +0.000 C +ATOM 1738 HB2 LYS 279 -43.025 -7.953 -7.243 0.00 0.00 +0.000 HD +ATOM 1739 HB3 LYS 279 -43.091 -6.283 -7.853 0.00 0.00 +0.000 HD +ATOM 1740 CG LYS 279 -44.375 -6.660 -6.154 0.00 0.00 +0.000 C +ATOM 1741 HG2 LYS 279 -43.617 -6.227 -5.502 0.00 0.00 +0.000 HD +ATOM 1742 HG3 LYS 279 -45.109 -5.897 -6.413 0.00 0.00 +0.000 HD +ATOM 1743 CD LYS 279 -45.070 -7.812 -5.432 0.00 0.00 +0.000 C +ATOM 1744 HD2 LYS 279 -45.916 -8.141 -6.037 0.00 0.00 +0.000 HD +ATOM 1745 HD3 LYS 279 -44.362 -8.631 -5.321 0.00 0.00 +0.000 HD +ATOM 1746 CE LYS 279 -45.571 -7.378 -4.050 0.00 0.00 +0.000 C +ATOM 1747 HE2 LYS 279 -44.710 -7.089 -3.447 0.00 0.00 +0.000 HD +ATOM 1748 HE3 LYS 279 -46.230 -6.519 -4.176 0.00 0.00 +0.000 HD +ATOM 1749 NZ LYS 279 -46.305 -8.469 -3.369 0.00 0.00 +0.000 N +ATOM 1750 HZ1 LYS 279 -45.694 -9.264 -3.252 0.00 0.00 +0.000 HD +ATOM 1751 HZ2 LYS 279 -46.619 -8.149 -2.464 0.00 0.00 +0.000 HD +ATOM 1752 HZ3 LYS 279 -47.103 -8.736 -3.927 0.00 0.00 +0.000 HD +ATOM 1753 C LYS 279 -45.689 -6.480 -8.870 0.00 0.00 +0.000 C +ATOM 1754 O LYS 279 -46.829 -6.625 -8.440 0.00 0.00 +0.000 OA +ATOM 1755 N THR 280 -45.340 -5.429 -9.619 0.00 0.00 +0.000 N +ATOM 1756 H THR 280 -44.382 -5.337 -9.922 0.00 0.00 +0.000 HD +ATOM 1757 CA THR 280 -46.285 -4.337 -9.939 0.00 0.00 +0.000 C +ATOM 1758 HA THR 280 -46.801 -3.987 -9.045 0.00 0.00 +0.000 HD +ATOM 1759 CB THR 280 -45.617 -3.135 -10.623 0.00 0.00 +0.000 C +ATOM 1760 HB THR 280 -46.393 -2.398 -10.832 0.00 0.00 +0.000 HD +ATOM 1761 CG2 THR 280 -44.525 -2.496 -9.767 0.00 0.00 +0.000 C +ATOM 1762 HG21 THR 280 -43.749 -3.232 -9.558 0.00 0.00 +0.000 HD +ATOM 1763 HG22 THR 280 -44.090 -1.652 -10.303 0.00 0.00 +0.000 HD +ATOM 1764 HG23 THR 280 -44.955 -2.146 -8.829 0.00 0.00 +0.000 HD +ATOM 1765 OG1 THR 280 -45.065 -3.424 -11.886 0.00 0.00 +0.000 OA +ATOM 1766 HG1 THR 280 -44.667 -2.631 -12.250 0.00 0.00 +0.000 HD +ATOM 1767 C THR 280 -47.473 -4.781 -10.790 0.00 0.00 +0.000 C +ATOM 1768 O THR 280 -48.557 -4.222 -10.646 0.00 0.00 +0.000 OA +ATOM 1769 N ILE 281 -47.299 -5.809 -11.627 0.00 0.00 +0.000 N +ATOM 1770 H ILE 281 -46.348 -6.101 -11.801 0.00 0.00 +0.000 HD +ATOM 1771 CA ILE 281 -48.374 -6.411 -12.435 0.00 0.00 +0.000 C +ATOM 1772 HA ILE 281 -49.277 -5.801 -12.442 0.00 0.00 +0.000 HD +ATOM 1773 CB ILE 281 -47.914 -6.666 -13.888 0.00 0.00 +0.000 C +ATOM 1774 HB ILE 281 -48.744 -7.094 -14.451 0.00 0.00 +0.000 HD +ATOM 1775 CG2 ILE 281 -47.467 -5.351 -14.554 0.00 0.00 +0.000 C +ATOM 1776 HG21 ILE 281 -46.637 -4.922 -13.993 0.00 0.00 +0.000 HD +ATOM 1777 HG22 ILE 281 -47.147 -5.551 -15.577 0.00 0.00 +0.000 HD +ATOM 1778 HG23 ILE 281 -48.299 -4.647 -14.565 0.00 0.00 +0.000 HD +ATOM 1779 CG1 ILE 281 -46.809 -7.738 -13.954 0.00 0.00 +0.000 C +ATOM 1780 HG12 ILE 281 -45.917 -7.315 -13.492 0.00 0.00 +0.000 HD +ATOM 1781 HG13 ILE 281 -47.150 -8.594 -13.370 0.00 0.00 +0.000 HD +ATOM 1782 CD1 ILE 281 -46.479 -8.193 -15.377 0.00 0.00 +0.000 C +ATOM 1783 HD11 ILE 281 -46.138 -7.339 -15.963 0.00 0.00 +0.000 HD +ATOM 1784 HD12 ILE 281 -45.693 -8.948 -15.344 0.00 0.00 +0.000 HD +ATOM 1785 HD13 ILE 281 -47.370 -8.617 -15.840 0.00 0.00 +0.000 HD +ATOM 1786 C ILE 281 -49.001 -7.653 -11.776 0.00 0.00 +0.000 C +ATOM 1787 O ILE 281 -49.738 -8.390 -12.426 0.00 0.00 +0.000 OA +ATOM 1788 N ASN 282 -48.718 -7.889 -10.489 0.00 0.00 +0.000 N +ATOM 1789 H ASN 282 -47.952 -7.351 -10.109 0.00 0.00 +0.000 HD +ATOM 1790 CA ASN 282 -49.268 -8.982 -9.681 0.00 0.00 +0.000 C +ATOM 1791 HA ASN 282 -48.750 -9.057 -8.725 0.00 0.00 +0.000 HD +ATOM 1792 CB ASN 282 -50.757 -8.683 -9.413 0.00 0.00 +0.000 C +ATOM 1793 HB2 ASN 282 -50.899 -7.603 -9.458 0.00 0.00 +0.000 HD +ATOM 1794 HB3 ASN 282 -51.368 -9.163 -10.178 0.00 0.00 +0.000 HD +ATOM 1795 CG ASN 282 -51.209 -9.173 -8.056 0.00 0.00 +0.000 C +ATOM 1796 OD1 ASN 282 -51.139 -8.468 -7.066 0.00 0.00 +0.000 OA +ATOM 1797 ND2 ASN 282 -51.666 -10.396 -7.962 0.00 0.00 +0.000 N +ATOM 1798 HD21 ASN 282 -51.975 -10.750 -7.068 0.00 0.00 +0.000 HD +ATOM 1799 HD22 ASN 282 -51.708 -10.981 -8.785 0.00 0.00 +0.000 HD +ATOM 1800 C ASN 282 -48.954 -10.400 -10.220 0.00 0.00 +0.000 C +ATOM 1801 O ASN 282 -49.737 -11.331 -10.036 0.00 0.00 +0.000 OA +ATOM 1802 N GLN 283 -47.791 -10.561 -10.863 0.00 0.00 +0.000 N +ATOM 1803 H GLN 283 -47.285 -9.702 -11.024 0.00 0.00 +0.000 HD +ATOM 1804 CA GLN 283 -47.246 -11.809 -11.425 0.00 0.00 +0.000 C +ATOM 1805 HA GLN 283 -47.999 -12.597 -11.386 0.00 0.00 +0.000 HD +ATOM 1806 CB GLN 283 -46.838 -11.589 -12.894 0.00 0.00 +0.000 C +ATOM 1807 HB2 GLN 283 -46.200 -10.706 -12.928 0.00 0.00 +0.000 HD +ATOM 1808 HB3 GLN 283 -46.266 -12.462 -13.210 0.00 0.00 +0.000 HD +ATOM 1809 CG GLN 283 -48.033 -11.394 -13.836 0.00 0.00 +0.000 C +ATOM 1810 HG2 GLN 283 -48.675 -10.628 -13.400 0.00 0.00 +0.000 HD +ATOM 1811 HG3 GLN 283 -47.665 -11.052 -14.803 0.00 0.00 +0.000 HD +ATOM 1812 CD GLN 283 -48.859 -12.660 -14.048 0.00 0.00 +0.000 C +ATOM 1813 OE1 GLN 283 -48.490 -13.766 -13.690 0.00 0.00 +0.000 OA +ATOM 1814 NE2 GLN 283 -50.016 -12.551 -14.658 0.00 0.00 +0.000 N +ATOM 1815 HE21 GLN 283 -50.583 -13.373 -14.811 0.00 0.00 +0.000 HD +ATOM 1816 HE22 GLN 283 -50.335 -11.646 -14.972 0.00 0.00 +0.000 HD +ATOM 1817 C GLN 283 -46.080 -12.350 -10.578 0.00 0.00 +0.000 C +ATOM 1818 O GLN 283 -45.052 -12.790 -11.090 0.00 0.00 +0.000 OA +ATOM 1819 N GLU 284 -46.209 -12.298 -9.252 0.00 0.00 +0.000 N +ATOM 1820 H GLU 284 -47.077 -11.956 -8.865 0.00 0.00 +0.000 HD +ATOM 1821 CA GLU 284 -45.138 -12.696 -8.322 0.00 0.00 +0.000 C +ATOM 1822 HA GLU 284 -44.235 -12.118 -8.517 0.00 0.00 +0.000 HD +ATOM 1823 CB GLU 284 -45.583 -12.435 -6.885 0.00 0.00 +0.000 C +ATOM 1824 HB2 GLU 284 -46.545 -12.920 -6.718 0.00 0.00 +0.000 HD +ATOM 1825 HB3 GLU 284 -44.843 -12.854 -6.203 0.00 0.00 +0.000 HD +ATOM 1826 CG GLU 284 -45.718 -10.943 -6.631 0.00 0.00 +0.000 C +ATOM 1827 HG2 GLU 284 -44.666 -10.660 -6.669 0.00 0.00 +0.000 HD +ATOM 1828 HG3 GLU 284 -46.282 -10.344 -7.346 0.00 0.00 +0.000 HD +ATOM 1829 CD GLU 284 -46.258 -10.702 -5.230 0.00 0.00 +0.000 C +ATOM 1830 OE1 GLU 284 -47.334 -10.077 -5.122 0.00 0.00 +0.000 OA +ATOM 1831 OE2 GLU 284 -45.534 -10.924 -4.232 0.00 0.00 +0.000 OA +ATOM 1832 C GLU 284 -44.742 -14.169 -8.434 0.00 0.00 +0.000 C +ATOM 1833 O GLU 284 -43.588 -14.513 -8.188 0.00 0.00 +0.000 OA +ATOM 1834 N SER 285 -45.673 -15.031 -8.855 0.00 0.00 +0.000 N +ATOM 1835 H SER 285 -46.619 -14.693 -8.953 0.00 0.00 +0.000 HD +ATOM 1836 CA SER 285 -45.406 -16.444 -9.138 0.00 0.00 +0.000 C +ATOM 1837 HA SER 285 -45.018 -16.937 -8.246 0.00 0.00 +0.000 HD +ATOM 1838 CB SER 285 -46.701 -17.145 -9.560 0.00 0.00 +0.000 C +ATOM 1839 HB2 SER 285 -46.468 -18.159 -9.884 0.00 0.00 +0.000 HD +ATOM 1840 HB3 SER 285 -47.380 -17.184 -8.709 0.00 0.00 +0.000 HD +ATOM 1841 OG SER 285 -47.316 -16.441 -10.623 0.00 0.00 +0.000 OA +ATOM 1842 HG SER 285 -48.126 -16.889 -10.878 0.00 0.00 +0.000 HD +ATOM 1843 C SER 285 -44.347 -16.644 -10.224 0.00 0.00 +0.000 C +ATOM 1844 O SER 285 -43.709 -17.688 -10.252 0.00 0.00 +0.000 OA +ATOM 1845 N CYS 286 -44.114 -15.641 -11.080 0.00 0.00 +0.000 N +ATOM 1846 H CYS 286 -44.707 -14.826 -11.016 0.00 0.00 +0.000 HD +ATOM 1847 CA CYS 286 -43.109 -15.686 -12.141 0.00 0.00 +0.000 C +ATOM 1848 HA CYS 286 -43.015 -16.697 -12.538 0.00 0.00 +0.000 HD +ATOM 1849 CB CYS 286 -43.545 -14.754 -13.277 0.00 0.00 +0.000 C +ATOM 1850 HB2 CYS 286 -43.663 -13.728 -12.928 0.00 0.00 +0.000 HD +ATOM 1851 HB3 CYS 286 -42.834 -14.775 -14.104 0.00 0.00 +0.000 HD +ATOM 1852 SG CYS 286 -45.146 -15.235 -13.977 0.00 0.00 +0.000 S +ATOM 1853 HG CYS 286 -45.200 -14.261 -14.882 0.00 0.00 +0.000 HD +ATOM 1854 C CYS 286 -41.690 -15.327 -11.664 0.00 0.00 +0.000 C +ATOM 1855 O CYS 286 -40.738 -15.477 -12.428 0.00 0.00 +0.000 OA +ATOM 1856 N ILE 287 -41.518 -14.860 -10.419 0.00 0.00 +0.000 N +ATOM 1857 H ILE 287 -42.333 -14.703 -9.844 0.00 0.00 +0.000 HD +ATOM 1858 CA ILE 287 -40.203 -14.459 -9.890 0.00 0.00 +0.000 C +ATOM 1859 HA ILE 287 -39.655 -13.877 -10.632 0.00 0.00 +0.000 HD +ATOM 1860 CB ILE 287 -40.360 -13.626 -8.595 0.00 0.00 +0.000 C +ATOM 1861 HB ILE 287 -40.962 -14.191 -7.884 0.00 0.00 +0.000 HD +ATOM 1862 CG2 ILE 287 -38.983 -13.316 -7.969 0.00 0.00 +0.000 C +ATOM 1863 HG21 ILE 287 -38.380 -12.748 -8.678 0.00 0.00 +0.000 HD +ATOM 1864 HG22 ILE 287 -39.120 -12.730 -7.060 0.00 0.00 +0.000 HD +ATOM 1865 HG23 ILE 287 -38.476 -14.249 -7.725 0.00 0.00 +0.000 HD +ATOM 1866 CG1 ILE 287 -41.114 -12.307 -8.895 0.00 0.00 +0.000 C +ATOM 1867 HG12 ILE 287 -40.446 -11.678 -9.483 0.00 0.00 +0.000 HD +ATOM 1868 HG13 ILE 287 -41.990 -12.563 -9.492 0.00 0.00 +0.000 HD +ATOM 1869 CD1 ILE 287 -41.555 -11.549 -7.638 0.00 0.00 +0.000 C +ATOM 1870 HD11 ILE 287 -40.680 -11.293 -7.041 0.00 0.00 +0.000 HD +ATOM 1871 HD12 ILE 287 -42.077 -10.637 -7.928 0.00 0.00 +0.000 HD +ATOM 1872 HD13 ILE 287 -42.224 -12.178 -7.050 0.00 0.00 +0.000 HD +ATOM 1873 C ILE 287 -39.292 -15.676 -9.680 0.00 0.00 +0.000 C +ATOM 1874 O ILE 287 -38.106 -15.599 -9.997 0.00 0.00 +0.000 OA +ATOM 1875 N GLU 288 -39.827 -16.797 -9.186 0.00 0.00 +0.000 N +ATOM 1876 H GLU 288 -40.768 -16.773 -8.819 0.00 0.00 +0.000 HD +ATOM 1877 CA GLU 288 -39.035 -18.023 -8.998 0.00 0.00 +0.000 C +ATOM 1878 HA GLU 288 -38.071 -17.766 -8.560 0.00 0.00 +0.000 HD +ATOM 1879 CB GLU 288 -39.752 -19.017 -8.064 0.00 0.00 +0.000 C +ATOM 1880 HB2 GLU 288 -40.256 -18.444 -7.287 0.00 0.00 +0.000 HD +ATOM 1881 HB3 GLU 288 -40.492 -19.558 -8.654 0.00 0.00 +0.000 HD +ATOM 1882 CG GLU 288 -38.784 -20.019 -7.414 0.00 0.00 +0.000 C +ATOM 1883 HG2 GLU 288 -39.456 -20.767 -6.995 0.00 0.00 +0.000 HD +ATOM 1884 HG3 GLU 288 -38.131 -20.488 -8.150 0.00 0.00 +0.000 HD +ATOM 1885 CD GLU 288 -37.931 -19.406 -6.287 0.00 0.00 +0.000 C +ATOM 1886 OE1 GLU 288 -36.970 -20.055 -5.824 0.00 0.00 +0.000 OA +ATOM 1887 OE2 GLU 288 -38.279 -18.310 -5.772 0.00 0.00 +0.000 OA +ATOM 1888 C GLU 288 -38.616 -18.639 -10.348 0.00 0.00 +0.000 C +ATOM 1889 O GLU 288 -37.414 -18.815 -10.546 0.00 0.00 +0.000 OA +ATOM 1890 N PRO 289 -39.518 -18.821 -11.341 0.00 0.00 +0.000 N +ATOM 1891 CD PRO 289 -40.975 -18.786 -11.249 0.00 0.00 +0.000 C +ATOM 1892 HD2 PRO 289 -41.283 -17.741 -11.223 0.00 0.00 +0.000 HD +ATOM 1893 HD3 PRO 289 -41.264 -19.273 -10.318 0.00 0.00 +0.000 HD +ATOM 1894 CG PRO 289 -41.498 -19.521 -12.476 0.00 0.00 +0.000 C +ATOM 1895 HG2 PRO 289 -42.464 -19.125 -12.791 0.00 0.00 +0.000 HD +ATOM 1896 HG3 PRO 289 -41.588 -20.590 -12.286 0.00 0.00 +0.000 HD +ATOM 1897 CB PRO 289 -40.419 -19.241 -13.513 0.00 0.00 +0.000 C +ATOM 1898 HB2 PRO 289 -40.555 -18.275 -13.999 0.00 0.00 +0.000 HD +ATOM 1899 HB3 PRO 289 -40.375 -20.025 -14.270 0.00 0.00 +0.000 HD +ATOM 1900 CA PRO 289 -39.124 -19.233 -12.694 0.00 0.00 +0.000 C +ATOM 1901 HA PRO 289 -38.714 -20.241 -12.617 0.00 0.00 +0.000 HD +ATOM 1902 C PRO 289 -38.088 -18.311 -13.353 0.00 0.00 +0.000 C +ATOM 1903 O PRO 289 -37.203 -18.771 -14.075 0.00 0.00 +0.000 OA +ATOM 1904 N LEU 290 -38.164 -16.997 -13.106 0.00 0.00 +0.000 N +ATOM 1905 H LEU 290 -38.972 -16.630 -12.623 0.00 0.00 +0.000 HD +ATOM 1906 CA LEU 290 -37.154 -16.051 -13.582 0.00 0.00 +0.000 C +ATOM 1907 HA LEU 290 -37.003 -16.164 -14.656 0.00 0.00 +0.000 HD +ATOM 1908 CB LEU 290 -37.636 -14.616 -13.300 0.00 0.00 +0.000 C +ATOM 1909 HB2 LEU 290 -38.545 -14.468 -13.883 0.00 0.00 +0.000 HD +ATOM 1910 HB3 LEU 290 -37.873 -14.558 -12.238 0.00 0.00 +0.000 HD +ATOM 1911 CG LEU 290 -36.615 -13.523 -13.659 0.00 0.00 +0.000 C +ATOM 1912 HG LEU 290 -35.707 -13.708 -13.084 0.00 0.00 +0.000 HD +ATOM 1913 CD1 LEU 290 -36.280 -13.509 -15.148 0.00 0.00 +0.000 C +ATOM 1914 HD11 LEU 290 -37.188 -13.324 -15.723 0.00 0.00 +0.000 HD +ATOM 1915 HD12 LEU 290 -35.555 -12.720 -15.351 0.00 0.00 +0.000 HD +ATOM 1916 HD13 LEU 290 -35.859 -14.472 -15.436 0.00 0.00 +0.000 HD +ATOM 1917 CD2 LEU 290 -37.185 -12.159 -13.280 0.00 0.00 +0.000 C +ATOM 1918 HD21 LEU 290 -37.386 -12.133 -12.209 0.00 0.00 +0.000 HD +ATOM 1919 HD22 LEU 290 -36.465 -11.380 -13.532 0.00 0.00 +0.000 HD +ATOM 1920 HD23 LEU 290 -38.111 -11.987 -13.827 0.00 0.00 +0.000 HD +ATOM 1921 C LEU 290 -35.783 -16.327 -12.945 0.00 0.00 +0.000 C +ATOM 1922 O LEU 290 -34.770 -16.332 -13.645 0.00 0.00 +0.000 OA +ATOM 1923 N ALA 291 -35.741 -16.560 -11.632 0.00 0.00 +0.000 N +ATOM 1924 H ALA 291 -36.596 -16.471 -11.102 0.00 0.00 +0.000 HD +ATOM 1925 CA ALA 291 -34.508 -16.853 -10.913 0.00 0.00 +0.000 C +ATOM 1926 HA ALA 291 -33.771 -16.085 -11.149 0.00 0.00 +0.000 HD +ATOM 1927 CB ALA 291 -34.799 -16.807 -9.414 0.00 0.00 +0.000 C +ATOM 1928 HB1 ALA 291 -35.528 -17.576 -9.161 0.00 0.00 +0.000 HD +ATOM 1929 HB2 ALA 291 -33.878 -16.983 -8.858 0.00 0.00 +0.000 HD +ATOM 1930 HB3 ALA 291 -35.200 -15.828 -9.151 0.00 0.00 +0.000 HD +ATOM 1931 C ALA 291 -33.895 -18.200 -11.331 0.00 0.00 +0.000 C +ATOM 1932 O ALA 291 -32.684 -18.272 -11.564 0.00 0.00 +0.000 OA +ATOM 1933 N GLU 292 -34.724 -19.231 -11.506 0.00 0.00 +0.000 N +ATOM 1934 H GLU 292 -35.679 -19.113 -11.197 0.00 0.00 +0.000 HD +ATOM 1935 CA GLU 292 -34.332 -20.523 -12.077 0.00 0.00 +0.000 C +ATOM 1936 HA GLU 292 -33.568 -20.986 -11.454 0.00 0.00 +0.000 HD +ATOM 1937 CB GLU 292 -35.541 -21.463 -12.152 0.00 0.00 +0.000 C +ATOM 1938 HB2 GLU 292 -36.365 -20.915 -12.608 0.00 0.00 +0.000 HD +ATOM 1939 HB3 GLU 292 -35.271 -22.307 -12.787 0.00 0.00 +0.000 HD +ATOM 1940 CG GLU 292 -35.973 -21.980 -10.771 0.00 0.00 +0.000 C +ATOM 1941 HG2 GLU 292 -35.151 -22.568 -10.361 0.00 0.00 +0.000 HD +ATOM 1942 HG3 GLU 292 -36.152 -21.114 -10.134 0.00 0.00 +0.000 HD +ATOM 1943 CD GLU 292 -37.243 -22.846 -10.828 0.00 0.00 +0.000 C +ATOM 1944 OE1 GLU 292 -37.772 -23.159 -9.739 0.00 0.00 +0.000 OA +ATOM 1945 OE2 GLU 292 -37.685 -23.192 -11.949 0.00 0.00 +0.000 OA +ATOM 1946 C GLU 292 -33.735 -20.339 -13.469 0.00 0.00 +0.000 C +ATOM 1947 O GLU 292 -32.633 -20.810 -13.737 0.00 0.00 +0.000 OA +ATOM 1948 N SER 293 -34.385 -19.555 -14.334 0.00 0.00 +0.000 N +ATOM 1949 H SER 293 -35.276 -19.154 -14.076 0.00 0.00 +0.000 HD +ATOM 1950 CA SER 293 -33.877 -19.304 -15.678 0.00 0.00 +0.000 C +ATOM 1951 HA SER 293 -33.686 -20.251 -16.183 0.00 0.00 +0.000 HD +ATOM 1952 CB SER 293 -34.893 -18.514 -16.491 0.00 0.00 +0.000 C +ATOM 1953 HB2 SER 293 -35.817 -19.080 -16.612 0.00 0.00 +0.000 HD +ATOM 1954 HB3 SER 293 -35.113 -17.558 -16.016 0.00 0.00 +0.000 HD +ATOM 1955 OG SER 293 -34.309 -18.287 -17.760 0.00 0.00 +0.000 OA +ATOM 1956 HG SER 293 -34.919 -17.789 -18.308 0.00 0.00 +0.000 HD +ATOM 1957 C SER 293 -32.537 -18.563 -15.695 0.00 0.00 +0.000 C +ATOM 1958 O SER 293 -31.686 -18.895 -16.522 0.00 0.00 +0.000 OA +ATOM 1959 N ILE 294 -32.343 -17.547 -14.849 0.00 0.00 +0.000 N +ATOM 1960 H ILE 294 -33.112 -17.222 -14.280 0.00 0.00 +0.000 HD +ATOM 1961 CA ILE 294 -31.056 -16.836 -14.754 0.00 0.00 +0.000 C +ATOM 1962 HA ILE 294 -30.763 -16.494 -15.747 0.00 0.00 +0.000 HD +ATOM 1963 CB ILE 294 -31.160 -15.621 -13.802 0.00 0.00 +0.000 C +ATOM 1964 HB ILE 294 -31.596 -15.957 -12.861 0.00 0.00 +0.000 HD +ATOM 1965 CG2 ILE 294 -29.776 -14.993 -13.532 0.00 0.00 +0.000 C +ATOM 1966 HG21 ILE 294 -29.339 -14.657 -14.472 0.00 0.00 +0.000 HD +ATOM 1967 HG22 ILE 294 -29.888 -14.143 -12.859 0.00 0.00 +0.000 HD +ATOM 1968 HG23 ILE 294 -29.123 -15.736 -13.074 0.00 0.00 +0.000 HD +ATOM 1969 CG1 ILE 294 -32.071 -14.530 -14.397 0.00 0.00 +0.000 C +ATOM 1970 HG12 ILE 294 -31.503 -14.026 -15.179 0.00 0.00 +0.000 HD +ATOM 1971 HG13 ILE 294 -32.931 -15.034 -14.840 0.00 0.00 +0.000 HD +ATOM 1972 CD1 ILE 294 -32.555 -13.501 -13.375 0.00 0.00 +0.000 C +ATOM 1973 HD11 ILE 294 -31.695 -12.997 -12.932 0.00 0.00 +0.000 HD +ATOM 1974 HD12 ILE 294 -33.190 -12.766 -13.870 0.00 0.00 +0.000 HD +ATOM 1975 HD13 ILE 294 -33.123 -14.003 -12.593 0.00 0.00 +0.000 HD +ATOM 1976 C ILE 294 -29.971 -17.809 -14.284 0.00 0.00 +0.000 C +ATOM 1977 O ILE 294 -28.866 -17.821 -14.832 0.00 0.00 +0.000 OA +ATOM 1978 N THR 295 -30.297 -18.638 -13.292 0.00 0.00 +0.000 N +ATOM 1979 H THR 295 -31.215 -18.546 -12.880 0.00 0.00 +0.000 HD +ATOM 1980 CA THR 295 -29.375 -19.623 -12.722 0.00 0.00 +0.000 C +ATOM 1981 HA THR 295 -28.457 -19.103 -12.448 0.00 0.00 +0.000 HD +ATOM 1982 CB THR 295 -29.962 -20.276 -11.467 0.00 0.00 +0.000 C +ATOM 1983 HB THR 295 -30.816 -20.892 -11.746 0.00 0.00 +0.000 HD +ATOM 1984 CG2 THR 295 -28.906 -21.147 -10.793 0.00 0.00 +0.000 C +ATOM 1985 HG21 THR 295 -28.051 -20.531 -10.513 0.00 0.00 +0.000 HD +ATOM 1986 HG22 THR 295 -29.329 -21.608 -9.901 0.00 0.00 +0.000 HD +ATOM 1987 HG23 THR 295 -28.581 -21.925 -11.484 0.00 0.00 +0.000 HD +ATOM 1988 OG1 THR 295 -30.341 -19.273 -10.550 0.00 0.00 +0.000 OA +ATOM 1989 HG1 THR 295 -30.708 -19.682 -9.762 0.00 0.00 +0.000 HD +ATOM 1990 C THR 295 -29.003 -20.694 -13.743 0.00 0.00 +0.000 C +ATOM 1991 O THR 295 -27.823 -20.995 -13.896 0.00 0.00 +0.000 OA +ATOM 1992 N ASP 296 -29.977 -21.209 -14.494 0.00 0.00 +0.000 N +ATOM 1993 H ASP 296 -30.923 -20.940 -14.266 0.00 0.00 +0.000 HD +ATOM 1994 CA ASP 296 -29.770 -22.154 -15.591 0.00 0.00 +0.000 C +ATOM 1995 HA ASP 296 -29.341 -23.080 -15.209 0.00 0.00 +0.000 HD +ATOM 1996 CB ASP 296 -31.117 -22.479 -16.271 0.00 0.00 +0.000 C +ATOM 1997 HB2 ASP 296 -31.661 -21.589 -15.955 0.00 0.00 +0.000 HD +ATOM 1998 HB3 ASP 296 -31.091 -22.521 -17.359 0.00 0.00 +0.000 HD +ATOM 1999 CG ASP 296 -31.821 -23.724 -15.730 0.00 0.00 +0.000 C +ATOM 2000 OD1 ASP 296 -31.307 -24.339 -14.777 0.00 0.00 +0.000 OA +ATOM 2001 OD2 ASP 296 -32.765 -24.198 -16.396 0.00 0.00 +0.000 OA +ATOM 2002 C ASP 296 -28.794 -21.599 -16.625 0.00 0.00 +0.000 C +ATOM 2003 O ASP 296 -27.808 -22.257 -16.951 0.00 0.00 +0.000 OA +ATOM 2004 N VAL 297 -29.028 -20.375 -17.111 0.00 0.00 +0.000 N +ATOM 2005 H VAL 297 -29.874 -19.891 -16.846 0.00 0.00 +0.000 HD +ATOM 2006 CA VAL 297 -28.141 -19.742 -18.096 0.00 0.00 +0.000 C +ATOM 2007 HA VAL 297 -28.040 -20.403 -18.957 0.00 0.00 +0.000 HD +ATOM 2008 CB VAL 297 -28.710 -18.392 -18.576 0.00 0.00 +0.000 C +ATOM 2009 HB VAL 297 -28.953 -17.798 -17.695 0.00 0.00 +0.000 HD +ATOM 2010 CG1 VAL 297 -27.721 -17.615 -19.459 0.00 0.00 +0.000 C +ATOM 2011 HG11 VAL 297 -27.478 -18.208 -20.341 0.00 0.00 +0.000 HD +ATOM 2012 HG12 VAL 297 -28.172 -16.672 -19.769 0.00 0.00 +0.000 HD +ATOM 2013 HG13 VAL 297 -26.810 -17.413 -18.895 0.00 0.00 +0.000 HD +ATOM 2014 CG2 VAL 297 -29.977 -18.619 -19.411 0.00 0.00 +0.000 C +ATOM 2015 HG21 VAL 297 -30.727 -19.127 -18.804 0.00 0.00 +0.000 HD +ATOM 2016 HG22 VAL 297 -30.370 -17.658 -19.745 0.00 0.00 +0.000 HD +ATOM 2017 HG23 VAL 297 -29.736 -19.233 -20.279 0.00 0.00 +0.000 HD +ATOM 2018 C VAL 297 -26.737 -19.583 -17.522 0.00 0.00 +0.000 C +ATOM 2019 O VAL 297 -25.765 -19.941 -18.182 0.00 0.00 +0.000 OA +ATOM 2020 N LEU 298 -26.610 -19.082 -16.294 0.00 0.00 +0.000 N +ATOM 2021 H LEU 298 -27.442 -18.811 -15.790 0.00 0.00 +0.000 HD +ATOM 2022 CA LEU 298 -25.314 -18.816 -15.683 0.00 0.00 +0.000 C +ATOM 2023 HA LEU 298 -24.673 -18.246 -16.356 0.00 0.00 +0.000 HD +ATOM 2024 CB LEU 298 -25.553 -17.985 -14.410 0.00 0.00 +0.000 C +ATOM 2025 HB2 LEU 298 -26.057 -17.074 -14.732 0.00 0.00 +0.000 HD +ATOM 2026 HB3 LEU 298 -26.214 -18.555 -13.757 0.00 0.00 +0.000 HD +ATOM 2027 CG LEU 298 -24.272 -17.618 -13.647 0.00 0.00 +0.000 C +ATOM 2028 HG LEU 298 -23.799 -18.541 -13.313 0.00 0.00 +0.000 HD +ATOM 2029 CD1 LEU 298 -23.292 -16.829 -14.518 0.00 0.00 +0.000 C +ATOM 2030 HD11 LEU 298 -23.765 -15.905 -14.852 0.00 0.00 +0.000 HD +ATOM 2031 HD12 LEU 298 -22.401 -16.591 -13.937 0.00 0.00 +0.000 HD +ATOM 2032 HD13 LEU 298 -23.011 -17.428 -15.384 0.00 0.00 +0.000 HD +ATOM 2033 CD2 LEU 298 -24.620 -16.784 -12.416 0.00 0.00 +0.000 C +ATOM 2034 HD21 LEU 298 -25.275 -17.358 -11.760 0.00 0.00 +0.000 HD +ATOM 2035 HD22 LEU 298 -23.705 -16.528 -11.880 0.00 0.00 +0.000 HD +ATOM 2036 HD23 LEU 298 -25.126 -15.870 -12.727 0.00 0.00 +0.000 HD +ATOM 2037 C LEU 298 -24.529 -20.105 -15.409 0.00 0.00 +0.000 C +ATOM 2038 O LEU 298 -23.395 -20.252 -15.863 0.00 0.00 +0.000 OA +ATOM 2039 N VAL 299 -25.126 -21.045 -14.680 0.00 0.00 +0.000 N +ATOM 2040 H VAL 299 -26.079 -20.890 -14.382 0.00 0.00 +0.000 HD +ATOM 2041 CA VAL 299 -24.433 -22.239 -14.195 0.00 0.00 +0.000 C +ATOM 2042 HA VAL 299 -23.425 -21.962 -13.884 0.00 0.00 +0.000 HD +ATOM 2043 CB VAL 299 -25.160 -22.873 -12.996 0.00 0.00 +0.000 C +ATOM 2044 HB VAL 299 -26.164 -23.154 -13.312 0.00 0.00 +0.000 HD +ATOM 2045 CG1 VAL 299 -24.419 -24.115 -12.479 0.00 0.00 +0.000 C +ATOM 2046 HG11 VAL 299 -23.414 -23.834 -12.163 0.00 0.00 +0.000 HD +ATOM 2047 HG12 VAL 299 -24.962 -24.535 -11.633 0.00 0.00 +0.000 HD +ATOM 2048 HG13 VAL 299 -24.355 -24.857 -13.275 0.00 0.00 +0.000 HD +ATOM 2049 CG2 VAL 299 -25.256 -21.873 -11.834 0.00 0.00 +0.000 C +ATOM 2050 HG21 VAL 299 -25.809 -20.992 -12.158 0.00 0.00 +0.000 HD +ATOM 2051 HG22 VAL 299 -25.772 -22.340 -10.995 0.00 0.00 +0.000 HD +ATOM 2052 HG23 VAL 299 -24.253 -21.579 -11.524 0.00 0.00 +0.000 HD +ATOM 2053 C VAL 299 -24.228 -23.239 -15.323 0.00 0.00 +0.000 C +ATOM 2054 O VAL 299 -23.119 -23.736 -15.466 0.00 0.00 +0.000 OA +ATOM 2055 N ARG 300 -25.228 -23.497 -16.179 0.00 0.00 +0.000 N +ATOM 2056 H ARG 300 -26.130 -23.060 -16.062 0.00 0.00 +0.000 HD +ATOM 2057 CA ARG 300 -25.074 -24.509 -17.239 0.00 0.00 +0.000 C +ATOM 2058 HA ARG 300 -24.568 -25.382 -16.826 0.00 0.00 +0.000 HD +ATOM 2059 CB ARG 300 -26.425 -24.952 -17.815 0.00 0.00 +0.000 C +ATOM 2060 HB2 ARG 300 -26.917 -24.068 -18.220 0.00 0.00 +0.000 HD +ATOM 2061 HB3 ARG 300 -26.225 -25.656 -18.622 0.00 0.00 +0.000 HD +ATOM 2062 CG ARG 300 -27.337 -25.613 -16.773 0.00 0.00 +0.000 C +ATOM 2063 HG2 ARG 300 -26.822 -26.461 -16.320 0.00 0.00 +0.000 HD +ATOM 2064 HG3 ARG 300 -27.594 -24.889 -15.999 0.00 0.00 +0.000 HD +ATOM 2065 CD ARG 300 -28.615 -26.101 -17.460 0.00 0.00 +0.000 C +ATOM 2066 HD2 ARG 300 -29.214 -25.239 -17.754 0.00 0.00 +0.000 HD +ATOM 2067 HD3 ARG 300 -28.348 -26.676 -18.346 0.00 0.00 +0.000 HD +ATOM 2068 NE ARG 300 -29.422 -26.954 -16.569 0.00 0.00 +0.000 N +ATOM 2069 HE ARG 300 -28.894 -27.526 -15.926 0.00 0.00 +0.000 HD +ATOM 2070 CZ ARG 300 -30.739 -27.051 -16.562 0.00 0.00 +0.000 C +ATOM 2071 NH1 ARG 300 -31.480 -26.455 -17.450 0.00 0.00 +0.000 N +ATOM 2072 HH11 ARG 300 -31.048 -25.898 -18.172 0.00 0.00 +0.000 HD +ATOM 2073 HH12 ARG 300 -32.485 -26.553 -17.412 0.00 0.00 +0.000 HD +ATOM 2074 NH2 ARG 300 -31.355 -27.729 -15.640 0.00 0.00 +0.000 N +ATOM 2075 HH21 ARG 300 -30.822 -28.189 -14.916 0.00 0.00 +0.000 HD +ATOM 2076 HH22 ARG 300 -32.363 -27.791 -15.651 0.00 0.00 +0.000 HD +ATOM 2077 C ARG 300 -24.149 -24.063 -18.365 0.00 0.00 +0.000 C +ATOM 2078 O ARG 300 -23.494 -24.908 -18.960 0.00 0.00 +0.000 OA +ATOM 2079 N THR 301 -24.076 -22.764 -18.672 0.00 0.00 +0.000 N +ATOM 2080 H THR 301 -24.687 -22.101 -18.217 0.00 0.00 +0.000 HD +ATOM 2081 CA THR 301 -23.220 -22.284 -19.776 0.00 0.00 +0.000 C +ATOM 2082 HA THR 301 -22.918 -23.106 -20.426 0.00 0.00 +0.000 HD +ATOM 2083 CB THR 301 -23.879 -21.196 -20.635 0.00 0.00 +0.000 C +ATOM 2084 HB THR 301 -23.246 -21.042 -21.509 0.00 0.00 +0.000 HD +ATOM 2085 CG2 THR 301 -25.295 -21.549 -21.089 0.00 0.00 +0.000 C +ATOM 2086 HG21 THR 301 -25.929 -21.702 -20.215 0.00 0.00 +0.000 HD +ATOM 2087 HG22 THR 301 -25.698 -20.735 -21.692 0.00 0.00 +0.000 HD +ATOM 2088 HG23 THR 301 -25.270 -22.462 -21.683 0.00 0.00 +0.000 HD +ATOM 2089 OG1 THR 301 -23.917 -19.948 -19.989 0.00 0.00 +0.000 OA +ATOM 2090 HG1 THR 301 -24.336 -19.304 -20.563 0.00 0.00 +0.000 HD +ATOM 2091 C THR 301 -21.837 -21.825 -19.327 0.00 0.00 +0.000 C +ATOM 2092 O THR 301 -20.921 -21.813 -20.146 0.00 0.00 +0.000 OA +ATOM 2093 N LYS 302 -21.664 -21.438 -18.053 0.00 0.00 +0.000 N +ATOM 2094 H LYS 302 -22.479 -21.436 -17.458 0.00 0.00 +0.000 HD +ATOM 2095 CA LYS 302 -20.408 -20.880 -17.518 0.00 0.00 +0.000 C +ATOM 2096 HA LYS 302 -19.607 -21.029 -18.242 0.00 0.00 +0.000 HD +ATOM 2097 CB LYS 302 -20.546 -19.364 -17.239 0.00 0.00 +0.000 C +ATOM 2098 HB2 LYS 302 -21.219 -19.267 -16.386 0.00 0.00 +0.000 HD +ATOM 2099 HB3 LYS 302 -19.554 -19.009 -16.960 0.00 0.00 +0.000 HD +ATOM 2100 CG LYS 302 -21.079 -18.527 -18.408 0.00 0.00 +0.000 C +ATOM 2101 HG2 LYS 302 -22.068 -18.903 -18.671 0.00 0.00 +0.000 HD +ATOM 2102 HG3 LYS 302 -21.160 -17.493 -18.076 0.00 0.00 +0.000 HD +ATOM 2103 CD LYS 302 -20.162 -18.599 -19.637 0.00 0.00 +0.000 C +ATOM 2104 HD2 LYS 302 -19.208 -18.126 -19.404 0.00 0.00 +0.000 HD +ATOM 2105 HD3 LYS 302 -19.995 -19.643 -19.903 0.00 0.00 +0.000 HD +ATOM 2106 CE LYS 302 -20.814 -17.875 -20.809 0.00 0.00 +0.000 C +ATOM 2107 HE2 LYS 302 -21.736 -18.396 -21.067 0.00 0.00 +0.000 HD +ATOM 2108 HE3 LYS 302 -21.046 -16.856 -20.500 0.00 0.00 +0.000 HD +ATOM 2109 NZ LYS 302 -19.917 -17.841 -21.992 0.00 0.00 +0.000 N +ATOM 2110 HZ1 LYS 302 -19.701 -18.785 -22.279 0.00 0.00 +0.000 HD +ATOM 2111 HZ2 LYS 302 -20.378 -17.356 -22.749 0.00 0.00 +0.000 HD +ATOM 2112 HZ3 LYS 302 -19.063 -17.358 -21.754 0.00 0.00 +0.000 HD +ATOM 2113 C LYS 302 -19.871 -21.637 -16.304 0.00 0.00 +0.000 C +ATOM 2114 O LYS 302 -19.064 -21.064 -15.570 0.00 0.00 +0.000 OA +ATOM 2115 N ARG 303 -20.268 -22.901 -16.097 0.00 0.00 +0.000 N +ATOM 2116 H ARG 303 -20.958 -23.277 -16.731 0.00 0.00 +0.000 HD +ATOM 2117 CA ARG 303 -19.812 -23.746 -14.974 0.00 0.00 +0.000 C +ATOM 2118 HA ARG 303 -20.233 -23.371 -14.042 0.00 0.00 +0.000 HD +ATOM 2119 CB ARG 303 -20.262 -25.213 -15.165 0.00 0.00 +0.000 C +ATOM 2120 HB2 ARG 303 -21.325 -25.225 -15.409 0.00 0.00 +0.000 HD +ATOM 2121 HB3 ARG 303 -19.696 -25.650 -15.987 0.00 0.00 +0.000 HD +ATOM 2122 CG ARG 303 -20.021 -26.029 -13.886 0.00 0.00 +0.000 C +ATOM 2123 HG2 ARG 303 -18.971 -25.912 -13.616 0.00 0.00 +0.000 HD +ATOM 2124 HG3 ARG 303 -20.646 -25.602 -13.102 0.00 0.00 +0.000 HD +ATOM 2125 CD ARG 303 -20.346 -27.524 -14.045 0.00 0.00 +0.000 C +ATOM 2126 HD2 ARG 303 -19.900 -27.854 -14.982 0.00 0.00 +0.000 HD +ATOM 2127 HD3 ARG 303 -19.875 -28.048 -13.213 0.00 0.00 +0.000 HD +ATOM 2128 NE ARG 303 -21.789 -27.859 -14.061 0.00 0.00 +0.000 N +ATOM 2129 HE ARG 303 -22.167 -28.032 -14.981 0.00 0.00 +0.000 HD +ATOM 2130 CZ ARG 303 -22.606 -27.905 -13.027 0.00 0.00 +0.000 C +ATOM 2131 NH1 ARG 303 -22.299 -27.383 -11.880 0.00 0.00 +0.000 N +ATOM 2132 HH11 ARG 303 -21.408 -26.922 -11.761 0.00 0.00 +0.000 HD +ATOM 2133 HH12 ARG 303 -22.953 -27.439 -11.112 0.00 0.00 +0.000 HD +ATOM 2134 NH2 ARG 303 -23.741 -28.527 -13.104 0.00 0.00 +0.000 N +ATOM 2135 HH21 ARG 303 -24.006 -28.983 -13.966 0.00 0.00 +0.000 HD +ATOM 2136 HH22 ARG 303 -24.355 -28.553 -12.303 0.00 0.00 +0.000 HD +ATOM 2137 C ARG 303 -18.297 -23.691 -14.798 0.00 0.00 +0.000 C +ATOM 2138 O ARG 303 -17.828 -23.278 -13.743 0.00 0.00 +0.000 OA +ATOM 2139 N ASP 304 -17.547 -24.024 -15.846 0.00 0.00 +0.000 N +ATOM 2140 H ASP 304 -18.007 -24.244 -16.718 0.00 0.00 +0.000 HD +ATOM 2141 CA ASP 304 -16.081 -24.105 -15.793 0.00 0.00 +0.000 C +ATOM 2142 HA ASP 304 -15.770 -24.837 -15.048 0.00 0.00 +0.000 HD +ATOM 2143 CB ASP 304 -15.538 -24.536 -17.163 0.00 0.00 +0.000 C +ATOM 2144 HB2 ASP 304 -15.776 -23.785 -17.916 0.00 0.00 +0.000 HD +ATOM 2145 HB3 ASP 304 -14.457 -24.586 -17.030 0.00 0.00 +0.000 HD +ATOM 2146 CG ASP 304 -16.058 -25.898 -17.618 0.00 0.00 +0.000 C +ATOM 2147 OD1 ASP 304 -16.504 -26.667 -16.740 0.00 0.00 +0.000 OA +ATOM 2148 OD2 ASP 304 -16.057 -26.108 -18.847 0.00 0.00 +0.000 OA +ATOM 2149 C ASP 304 -15.448 -22.767 -15.413 0.00 0.00 +0.000 C +ATOM 2150 O ASP 304 -14.514 -22.705 -14.612 0.00 0.00 +0.000 OA +ATOM 2151 N TRP 305 -15.995 -21.670 -15.943 0.00 0.00 +0.000 N +ATOM 2152 H TRP 305 -16.698 -21.771 -16.662 0.00 0.00 +0.000 HD +ATOM 2153 CA TRP 305 -15.545 -20.327 -15.600 0.00 0.00 +0.000 C +ATOM 2154 HA TRP 305 -14.460 -20.264 -15.686 0.00 0.00 +0.000 HD +ATOM 2155 CB TRP 305 -16.172 -19.304 -16.552 0.00 0.00 +0.000 C +ATOM 2156 HB2 TRP 305 -15.937 -19.590 -17.578 0.00 0.00 +0.000 HD +ATOM 2157 HB3 TRP 305 -17.254 -19.256 -16.429 0.00 0.00 +0.000 HD +ATOM 2158 CG TRP 305 -15.658 -17.911 -16.367 0.00 0.00 +0.000 A +ATOM 2159 CD1 TRP 305 -14.643 -17.350 -17.063 0.00 0.00 +0.000 A +ATOM 2160 HD1 TRP 305 -14.170 -17.954 -17.838 0.00 0.00 +0.000 HD +ATOM 2161 NE1 TRP 305 -14.425 -16.066 -16.606 0.00 0.00 +0.000 N +ATOM 2162 HE1 TRP 305 -13.723 -15.454 -16.999 0.00 0.00 +0.000 HD +ATOM 2163 CE2 TRP 305 -15.274 -15.747 -15.570 0.00 0.00 +0.000 A +ATOM 2164 CZ2 TRP 305 -15.414 -14.604 -14.773 0.00 0.00 +0.000 A +ATOM 2165 HZ2 TRP 305 -14.729 -13.779 -14.969 0.00 0.00 +0.000 HD +ATOM 2166 CH2 TRP 305 -16.409 -14.581 -13.782 0.00 0.00 +0.000 A +ATOM 2167 HH2 TRP 305 -16.550 -13.709 -13.143 0.00 0.00 +0.000 HD +ATOM 2168 CZ3 TRP 305 -17.243 -15.699 -13.603 0.00 0.00 +0.000 A +ATOM 2169 HZ3 TRP 305 -18.020 -15.711 -12.837 0.00 0.00 +0.000 HD +ATOM 2170 CE3 TRP 305 -17.097 -16.840 -14.414 0.00 0.00 +0.000 A +ATOM 2171 HE3 TRP 305 -17.789 -17.659 -14.216 0.00 0.00 +0.000 HD +ATOM 2172 CD2 TRP 305 -16.097 -16.901 -15.409 0.00 0.00 +0.000 A +ATOM 2173 C TRP 305 -15.840 -20.005 -14.132 0.00 0.00 +0.000 C +ATOM 2174 O TRP 305 -14.952 -19.524 -13.433 0.00 0.00 +0.000 OA +ATOM 2175 N LEU 306 -17.045 -20.306 -13.637 0.00 0.00 +0.000 N +ATOM 2176 H LEU 306 -17.745 -20.671 -14.268 0.00 0.00 +0.000 HD +ATOM 2177 CA LEU 306 -17.417 -20.086 -12.237 0.00 0.00 +0.000 C +ATOM 2178 HA LEU 306 -17.290 -19.035 -11.978 0.00 0.00 +0.000 HD +ATOM 2179 CB LEU 306 -18.890 -20.472 -12.012 0.00 0.00 +0.000 C +ATOM 2180 HB2 LEU 306 -19.014 -21.476 -12.420 0.00 0.00 +0.000 HD +ATOM 2181 HB3 LEU 306 -19.062 -20.493 -10.936 0.00 0.00 +0.000 HD +ATOM 2182 CG LEU 306 -19.900 -19.524 -12.673 0.00 0.00 +0.000 C +ATOM 2183 HG LEU 306 -19.580 -19.301 -13.691 0.00 0.00 +0.000 HD +ATOM 2184 CD1 LEU 306 -21.273 -20.189 -12.706 0.00 0.00 +0.000 C +ATOM 2185 HD11 LEU 306 -21.594 -20.412 -11.689 0.00 0.00 +0.000 HD +ATOM 2186 HD12 LEU 306 -21.992 -19.518 -13.174 0.00 0.00 +0.000 HD +ATOM 2187 HD13 LEU 306 -21.214 -21.115 -13.278 0.00 0.00 +0.000 HD +ATOM 2188 CD2 LEU 306 -20.014 -18.197 -11.917 0.00 0.00 +0.000 C +ATOM 2189 HD21 LEU 306 -19.043 -17.704 -11.900 0.00 0.00 +0.000 HD +ATOM 2190 HD22 LEU 306 -20.738 -17.554 -12.417 0.00 0.00 +0.000 HD +ATOM 2191 HD23 LEU 306 -20.342 -18.387 -10.896 0.00 0.00 +0.000 HD +ATOM 2192 C LEU 306 -16.514 -20.885 -11.296 0.00 0.00 +0.000 C +ATOM 2193 O LEU 306 -15.996 -20.319 -10.339 0.00 0.00 +0.000 OA +ATOM 2194 N VAL 307 -16.267 -22.162 -11.590 0.00 0.00 +0.000 N +ATOM 2195 H VAL 307 -16.777 -22.580 -12.356 0.00 0.00 +0.000 HD +ATOM 2196 CA VAL 307 -15.371 -23.020 -10.800 0.00 0.00 +0.000 C +ATOM 2197 HA VAL 307 -15.673 -22.996 -9.753 0.00 0.00 +0.000 HD +ATOM 2198 CB VAL 307 -15.435 -24.478 -11.298 0.00 0.00 +0.000 C +ATOM 2199 HB VAL 307 -15.231 -24.482 -12.369 0.00 0.00 +0.000 HD +ATOM 2200 CG1 VAL 307 -14.418 -25.373 -10.582 0.00 0.00 +0.000 C +ATOM 2201 HG11 VAL 307 -14.620 -25.370 -9.511 0.00 0.00 +0.000 HD +ATOM 2202 HG12 VAL 307 -14.497 -26.392 -10.963 0.00 0.00 +0.000 HD +ATOM 2203 HG13 VAL 307 -13.411 -24.996 -10.761 0.00 0.00 +0.000 HD +ATOM 2204 CG2 VAL 307 -16.827 -25.077 -11.051 0.00 0.00 +0.000 C +ATOM 2205 HG21 VAL 307 -17.575 -24.490 -11.583 0.00 0.00 +0.000 HD +ATOM 2206 HG22 VAL 307 -16.850 -26.105 -11.410 0.00 0.00 +0.000 HD +ATOM 2207 HG23 VAL 307 -17.045 -25.060 -9.983 0.00 0.00 +0.000 HD +ATOM 2208 C VAL 307 -13.941 -22.469 -10.817 0.00 0.00 +0.000 C +ATOM 2209 O VAL 307 -13.342 -22.289 -9.755 0.00 0.00 +0.000 OA +ATOM 2210 N LYS 308 -13.419 -22.088 -11.993 0.00 0.00 +0.000 N +ATOM 2211 H LYS 308 -13.942 -22.306 -12.829 0.00 0.00 +0.000 HD +ATOM 2212 CA LYS 308 -12.094 -21.453 -12.143 0.00 0.00 +0.000 C +ATOM 2213 HA LYS 308 -11.309 -22.097 -11.747 0.00 0.00 +0.000 HD +ATOM 2214 CB LYS 308 -11.830 -21.219 -13.641 0.00 0.00 +0.000 C +ATOM 2215 HB2 LYS 308 -11.944 -22.183 -14.137 0.00 0.00 +0.000 HD +ATOM 2216 HB3 LYS 308 -12.600 -20.535 -13.997 0.00 0.00 +0.000 HD +ATOM 2217 CG LYS 308 -10.440 -20.639 -13.963 0.00 0.00 +0.000 C +ATOM 2218 HG2 LYS 308 -10.355 -19.645 -13.525 0.00 0.00 +0.000 HD +ATOM 2219 HG3 LYS 308 -9.672 -21.288 -13.542 0.00 0.00 +0.000 HD +ATOM 2220 CD LYS 308 -10.252 -20.545 -15.488 0.00 0.00 +0.000 C +ATOM 2221 HD2 LYS 308 -10.379 -21.545 -15.901 0.00 0.00 +0.000 HD +ATOM 2222 HD3 LYS 308 -11.030 -19.889 -15.879 0.00 0.00 +0.000 HD +ATOM 2223 CE LYS 308 -8.873 -19.998 -15.886 0.00 0.00 +0.000 C +ATOM 2224 HE2 LYS 308 -8.784 -18.978 -15.511 0.00 0.00 +0.000 HD +ATOM 2225 HE3 LYS 308 -8.107 -20.622 -15.426 0.00 0.00 +0.000 HD +ATOM 2226 NZ LYS 308 -8.693 -20.000 -17.369 0.00 0.00 +0.000 N +ATOM 2227 HZ1 LYS 308 -9.403 -19.422 -17.795 0.00 0.00 +0.000 HD +ATOM 2228 HZ2 LYS 308 -7.779 -19.636 -17.597 0.00 0.00 +0.000 HD +ATOM 2229 HZ3 LYS 308 -8.776 -20.946 -17.716 0.00 0.00 +0.000 HD +ATOM 2230 C LYS 308 -11.971 -20.156 -11.337 0.00 0.00 +0.000 C +ATOM 2231 O LYS 308 -10.900 -19.858 -10.817 0.00 0.00 +0.000 OA +ATOM 2232 N GLN 309 -13.061 -19.402 -11.204 0.00 0.00 +0.000 N +ATOM 2233 H GLN 309 -13.863 -19.659 -11.762 0.00 0.00 +0.000 HD +ATOM 2234 CA GLN 309 -13.134 -18.175 -10.409 0.00 0.00 +0.000 C +ATOM 2235 HA GLN 309 -12.145 -17.721 -10.334 0.00 0.00 +0.000 HD +ATOM 2236 CB GLN 309 -14.087 -17.168 -11.074 0.00 0.00 +0.000 C +ATOM 2237 HB2 GLN 309 -15.067 -17.641 -11.142 0.00 0.00 +0.000 HD +ATOM 2238 HB3 GLN 309 -14.150 -16.297 -10.422 0.00 0.00 +0.000 HD +ATOM 2239 CG GLN 309 -13.636 -16.728 -12.470 0.00 0.00 +0.000 C +ATOM 2240 HG2 GLN 309 -13.561 -17.635 -13.070 0.00 0.00 +0.000 HD +ATOM 2241 HG3 GLN 309 -14.397 -16.073 -12.897 0.00 0.00 +0.000 HD +ATOM 2242 CD GLN 309 -12.297 -16.008 -12.510 0.00 0.00 +0.000 C +ATOM 2243 OE1 GLN 309 -11.906 -15.277 -11.616 0.00 0.00 +0.000 OA +ATOM 2244 NE2 GLN 309 -11.546 -16.166 -13.578 0.00 0.00 +0.000 N +ATOM 2245 HE21 GLN 309 -10.652 -15.701 -13.635 0.00 0.00 +0.000 HD +ATOM 2246 HE22 GLN 309 -11.868 -16.751 -14.336 0.00 0.00 +0.000 HD +ATOM 2247 C GLN 309 -13.508 -18.418 -8.940 0.00 0.00 +0.000 C +ATOM 2248 O GLN 309 -13.855 -17.465 -8.255 0.00 0.00 +0.000 OA +ATOM 2249 N ARG 310 -13.432 -19.655 -8.424 0.00 0.00 +0.000 N +ATOM 2250 H ARG 310 -13.231 -20.403 -9.071 0.00 0.00 +0.000 HD +ATOM 2251 CA ARG 310 -13.779 -20.007 -7.029 0.00 0.00 +0.000 C +ATOM 2252 HA ARG 310 -13.762 -21.090 -6.913 0.00 0.00 +0.000 HD +ATOM 2253 CB ARG 310 -12.777 -19.389 -6.031 0.00 0.00 +0.000 C +ATOM 2254 HB2 ARG 310 -12.898 -18.306 -6.079 0.00 0.00 +0.000 HD +ATOM 2255 HB3 ARG 310 -13.051 -19.741 -5.037 0.00 0.00 +0.000 HD +ATOM 2256 CG ARG 310 -11.311 -19.753 -6.317 0.00 0.00 +0.000 C +ATOM 2257 HG2 ARG 310 -11.177 -20.820 -6.140 0.00 0.00 +0.000 HD +ATOM 2258 HG3 ARG 310 -11.094 -19.528 -7.362 0.00 0.00 +0.000 HD +ATOM 2259 CD ARG 310 -10.354 -18.963 -5.416 0.00 0.00 +0.000 C +ATOM 2260 HD2 ARG 310 -9.329 -19.225 -5.679 0.00 0.00 +0.000 HD +ATOM 2261 HD3 ARG 310 -10.512 -17.898 -5.588 0.00 0.00 +0.000 HD +ATOM 2262 NE ARG 310 -10.563 -19.247 -3.981 0.00 0.00 +0.000 N +ATOM 2263 HE ARG 310 -10.878 -20.181 -3.760 0.00 0.00 +0.000 HD +ATOM 2264 CZ ARG 310 -10.366 -18.396 -2.988 0.00 0.00 +0.000 C +ATOM 2265 NH1 ARG 310 -9.853 -17.215 -3.194 0.00 0.00 +0.000 N +ATOM 2266 HH11 ARG 310 -9.596 -16.936 -4.130 0.00 0.00 +0.000 HD +ATOM 2267 HH12 ARG 310 -9.714 -16.585 -2.417 0.00 0.00 +0.000 HD +ATOM 2268 NH2 ARG 310 -10.692 -18.721 -1.770 0.00 0.00 +0.000 N +ATOM 2269 HH21 ARG 310 -11.097 -19.627 -1.583 0.00 0.00 +0.000 HD +ATOM 2270 HH22 ARG 310 -10.539 -18.064 -1.018 0.00 0.00 +0.000 HD +ATOM 2271 C ARG 310 -15.239 -19.692 -6.664 0.00 0.00 +0.000 C +ATOM 2272 O ARG 310 -15.542 -19.315 -5.534 0.00 0.00 +0.000 OA +ATOM 2273 N GLY 311 -16.144 -19.830 -7.630 0.00 0.00 +0.000 N +ATOM 2274 H GLY 311 -15.790 -20.070 -8.545 0.00 0.00 +0.000 HD +ATOM 2275 CA GLY 311 -17.585 -19.664 -7.467 0.00 0.00 +0.000 C +ATOM 2276 HA2 GLY 311 -18.044 -19.712 -8.454 0.00 0.00 +0.000 HD +ATOM 2277 HA3 GLY 311 -17.954 -20.485 -6.853 0.00 0.00 +0.000 HD +ATOM 2278 C GLY 311 -17.966 -18.339 -6.805 0.00 0.00 +0.000 C +ATOM 2279 O GLY 311 -17.419 -17.276 -7.102 0.00 0.00 +0.000 OA +ATOM 2280 N TRP 312 -18.914 -18.408 -5.874 0.00 0.00 +0.000 N +ATOM 2281 H TRP 312 -19.387 -19.289 -5.724 0.00 0.00 +0.000 HD +ATOM 2282 CA TRP 312 -19.394 -17.232 -5.151 0.00 0.00 +0.000 C +ATOM 2283 HA TRP 312 -19.529 -16.394 -5.835 0.00 0.00 +0.000 HD +ATOM 2284 CB TRP 312 -20.741 -17.557 -4.505 0.00 0.00 +0.000 C +ATOM 2285 HB2 TRP 312 -20.640 -18.492 -3.955 0.00 0.00 +0.000 HD +ATOM 2286 HB3 TRP 312 -21.079 -16.772 -3.829 0.00 0.00 +0.000 HD +ATOM 2287 CG TRP 312 -21.837 -17.763 -5.503 0.00 0.00 +0.000 A +ATOM 2288 CD1 TRP 312 -22.326 -18.956 -5.913 0.00 0.00 +0.000 A +ATOM 2289 HD1 TRP 312 -21.910 -19.857 -5.462 0.00 0.00 +0.000 HD +ATOM 2290 NE1 TRP 312 -23.300 -18.745 -6.867 0.00 0.00 +0.000 N +ATOM 2291 HE1 TRP 312 -23.775 -19.504 -7.335 0.00 0.00 +0.000 HD +ATOM 2292 CE2 TRP 312 -23.510 -17.405 -7.102 0.00 0.00 +0.000 A +ATOM 2293 CZ2 TRP 312 -24.386 -16.705 -7.941 0.00 0.00 +0.000 A +ATOM 2294 HZ2 TRP 312 -25.085 -17.298 -8.532 0.00 0.00 +0.000 HD +ATOM 2295 CH2 TRP 312 -24.320 -15.302 -7.977 0.00 0.00 +0.000 A +ATOM 2296 HH2 TRP 312 -24.991 -14.725 -8.612 0.00 0.00 +0.000 HD +ATOM 2297 CZ3 TRP 312 -23.376 -14.622 -7.187 0.00 0.00 +0.000 A +ATOM 2298 HZ3 TRP 312 -23.293 -13.535 -7.204 0.00 0.00 +0.000 HD +ATOM 2299 CE3 TRP 312 -22.505 -15.339 -6.342 0.00 0.00 +0.000 A +ATOM 2300 HE3 TRP 312 -21.803 -14.740 -5.763 0.00 0.00 +0.000 HD +ATOM 2301 CD2 TRP 312 -22.559 -16.748 -6.268 0.00 0.00 +0.000 A +ATOM 2302 C TRP 312 -18.385 -16.669 -4.140 0.00 0.00 +0.000 C +ATOM 2303 O TRP 312 -18.498 -15.496 -3.786 0.00 0.00 +0.000 OA +ATOM 2304 N ASP 313 -17.377 -17.437 -3.711 0.00 0.00 +0.000 N +ATOM 2305 H ASP 313 -17.379 -18.427 -3.914 0.00 0.00 +0.000 HD +ATOM 2306 CA ASP 313 -16.285 -16.897 -2.889 0.00 0.00 +0.000 C +ATOM 2307 HA ASP 313 -16.708 -16.331 -2.058 0.00 0.00 +0.000 HD +ATOM 2308 CB ASP 313 -15.396 -18.013 -2.321 0.00 0.00 +0.000 C +ATOM 2309 HB2 ASP 313 -15.100 -18.664 -3.144 0.00 0.00 +0.000 HD +ATOM 2310 HB3 ASP 313 -14.510 -17.549 -1.889 0.00 0.00 +0.000 HD +ATOM 2311 CG ASP 313 -16.111 -18.837 -1.253 0.00 0.00 +0.000 C +ATOM 2312 OD1 ASP 313 -16.513 -18.245 -0.222 0.00 0.00 +0.000 OA +ATOM 2313 OD2 ASP 313 -16.265 -20.056 -1.458 0.00 0.00 +0.000 OA +ATOM 2314 C ASP 313 -15.436 -15.909 -3.694 0.00 0.00 +0.000 C +ATOM 2315 O ASP 313 -15.146 -14.813 -3.214 0.00 0.00 +0.000 OA +ATOM 2316 N GLY 314 -15.099 -16.247 -4.942 0.00 0.00 +0.000 N +ATOM 2317 H GLY 314 -15.345 -17.159 -5.301 0.00 0.00 +0.000 HD +ATOM 2318 CA GLY 314 -14.377 -15.328 -5.820 0.00 0.00 +0.000 C +ATOM 2319 HA2 GLY 314 -13.498 -14.971 -5.283 0.00 0.00 +0.000 HD +ATOM 2320 HA3 GLY 314 -14.061 -15.886 -6.703 0.00 0.00 +0.000 HD +ATOM 2321 C GLY 314 -15.210 -14.128 -6.263 0.00 0.00 +0.000 C +ATOM 2322 O GLY 314 -14.659 -13.040 -6.404 0.00 0.00 +0.000 OA +ATOM 2323 N PHE 315 -16.533 -14.274 -6.403 0.00 0.00 +0.000 N +ATOM 2324 H PHE 315 -16.931 -15.203 -6.402 0.00 0.00 +0.000 HD +ATOM 2325 CA PHE 315 -17.435 -13.130 -6.593 0.00 0.00 +0.000 C +ATOM 2326 HA PHE 315 -17.161 -12.582 -7.495 0.00 0.00 +0.000 HD +ATOM 2327 CB PHE 315 -18.880 -13.622 -6.739 0.00 0.00 +0.000 C +ATOM 2328 HB2 PHE 315 -18.988 -14.156 -7.683 0.00 0.00 +0.000 HD +ATOM 2329 HB3 PHE 315 -19.133 -14.288 -5.914 0.00 0.00 +0.000 HD +ATOM 2330 CG PHE 315 -19.921 -12.520 -6.743 0.00 0.00 +0.000 A +ATOM 2331 CD1 PHE 315 -20.656 -12.236 -5.577 0.00 0.00 +0.000 A +ATOM 2332 HD1 PHE 315 -20.466 -12.799 -4.663 0.00 0.00 +0.000 HD +ATOM 2333 CE1 PHE 315 -21.634 -11.226 -5.590 0.00 0.00 +0.000 A +ATOM 2334 HE1 PHE 315 -22.202 -11.013 -4.685 0.00 0.00 +0.000 HD +ATOM 2335 CZ PHE 315 -21.880 -10.495 -6.762 0.00 0.00 +0.000 A +ATOM 2336 HZ PHE 315 -22.627 -9.702 -6.768 0.00 0.00 +0.000 HD +ATOM 2337 CE2 PHE 315 -21.159 -10.787 -7.930 0.00 0.00 +0.000 A +ATOM 2338 HE2 PHE 315 -21.371 -10.244 -8.852 0.00 0.00 +0.000 HD +ATOM 2339 CD2 PHE 315 -20.166 -11.780 -7.912 0.00 0.00 +0.000 A +ATOM 2340 HD2 PHE 315 -19.579 -11.981 -8.809 0.00 0.00 +0.000 HD +ATOM 2341 C PHE 315 -17.349 -12.143 -5.423 0.00 0.00 +0.000 C +ATOM 2342 O PHE 315 -17.194 -10.938 -5.632 0.00 0.00 +0.000 OA +ATOM 2343 N VAL 316 -17.432 -12.651 -4.189 0.00 0.00 +0.000 N +ATOM 2344 H VAL 316 -17.647 -13.631 -4.075 0.00 0.00 +0.000 HD +ATOM 2345 CA VAL 316 -17.309 -11.821 -2.986 0.00 0.00 +0.000 C +ATOM 2346 HA VAL 316 -18.039 -11.014 -3.045 0.00 0.00 +0.000 HD +ATOM 2347 CB VAL 316 -17.582 -12.638 -1.710 0.00 0.00 +0.000 C +ATOM 2348 HB VAL 316 -16.970 -13.539 -1.754 0.00 0.00 +0.000 HD +ATOM 2349 CG1 VAL 316 -17.260 -11.863 -0.424 0.00 0.00 +0.000 C +ATOM 2350 HG11 VAL 316 -17.873 -10.963 -0.379 0.00 0.00 +0.000 HD +ATOM 2351 HG12 VAL 316 -17.473 -12.490 0.442 0.00 0.00 +0.000 HD +ATOM 2352 HG13 VAL 316 -16.206 -11.585 -0.422 0.00 0.00 +0.000 HD +ATOM 2353 CG2 VAL 316 -19.065 -13.014 -1.634 0.00 0.00 +0.000 C +ATOM 2354 HG21 VAL 316 -19.334 -13.611 -2.506 0.00 0.00 +0.000 HD +ATOM 2355 HG22 VAL 316 -19.248 -13.592 -0.729 0.00 0.00 +0.000 HD +ATOM 2356 HG23 VAL 316 -19.669 -12.107 -1.615 0.00 0.00 +0.000 HD +ATOM 2357 C VAL 316 -15.934 -11.166 -2.945 0.00 0.00 +0.000 C +ATOM 2358 O VAL 316 -15.866 -9.958 -2.765 0.00 0.00 +0.000 OA +ATOM 2359 N GLU 317 -14.854 -11.921 -3.154 0.00 0.00 +0.000 N +ATOM 2360 H GLU 317 -14.988 -12.916 -3.266 0.00 0.00 +0.000 HD +ATOM 2361 CA GLU 317 -13.481 -11.402 -3.135 0.00 0.00 +0.000 C +ATOM 2362 HA GLU 317 -13.267 -10.915 -2.183 0.00 0.00 +0.000 HD +ATOM 2363 CB GLU 317 -12.503 -12.576 -3.316 0.00 0.00 +0.000 C +ATOM 2364 HB2 GLU 317 -12.775 -13.350 -2.598 0.00 0.00 +0.000 HD +ATOM 2365 HB3 GLU 317 -12.630 -12.961 -4.328 0.00 0.00 +0.000 HD +ATOM 2366 CG GLU 317 -11.035 -12.171 -3.102 0.00 0.00 +0.000 C +ATOM 2367 HG2 GLU 317 -10.760 -11.426 -3.847 0.00 0.00 +0.000 HD +ATOM 2368 HG3 GLU 317 -11.005 -11.721 -2.110 0.00 0.00 +0.000 HD +ATOM 2369 CD GLU 317 -10.042 -13.350 -3.162 0.00 0.00 +0.000 C +ATOM 2370 OE1 GLU 317 -8.826 -13.070 -3.265 0.00 0.00 +0.000 OA +ATOM 2371 OE2 GLU 317 -10.457 -14.533 -3.063 0.00 0.00 +0.000 OA +ATOM 2372 C GLU 317 -13.258 -10.303 -4.185 0.00 0.00 +0.000 C +ATOM 2373 O GLU 317 -12.703 -9.252 -3.862 0.00 0.00 +0.000 OA +ATOM 2374 N PHE 318 -13.761 -10.504 -5.408 0.00 0.00 +0.000 N +ATOM 2375 H PHE 318 -14.193 -11.398 -5.595 0.00 0.00 +0.000 HD +ATOM 2376 CA PHE 318 -13.662 -9.540 -6.505 0.00 0.00 +0.000 C +ATOM 2377 HA PHE 318 -12.618 -9.333 -6.740 0.00 0.00 +0.000 HD +ATOM 2378 CB PHE 318 -14.338 -10.134 -7.752 0.00 0.00 +0.000 C +ATOM 2379 HB2 PHE 318 -13.865 -11.073 -8.039 0.00 0.00 +0.000 HD +ATOM 2380 HB3 PHE 318 -15.392 -10.308 -7.536 0.00 0.00 +0.000 HD +ATOM 2381 CG PHE 318 -14.288 -9.233 -8.969 0.00 0.00 +0.000 A +ATOM 2382 CD1 PHE 318 -15.369 -8.385 -9.269 0.00 0.00 +0.000 A +ATOM 2383 HD1 PHE 318 -16.258 -8.397 -8.636 0.00 0.00 +0.000 HD +ATOM 2384 CE1 PHE 318 -15.310 -7.525 -10.379 0.00 0.00 +0.000 A +ATOM 2385 HE1 PHE 318 -16.147 -6.864 -10.603 0.00 0.00 +0.000 HD +ATOM 2386 CZ PHE 318 -14.170 -7.517 -11.199 0.00 0.00 +0.000 A +ATOM 2387 HZ PHE 318 -14.122 -6.850 -12.059 0.00 0.00 +0.000 HD +ATOM 2388 CE2 PHE 318 -13.090 -8.369 -10.909 0.00 0.00 +0.000 A +ATOM 2389 HE2 PHE 318 -12.208 -8.368 -11.549 0.00 0.00 +0.000 HD +ATOM 2390 CD2 PHE 318 -13.148 -9.224 -9.793 0.00 0.00 +0.000 A +ATOM 2391 HD2 PHE 318 -12.309 -9.881 -9.566 0.00 0.00 +0.000 HD +ATOM 2392 C PHE 318 -14.273 -8.182 -6.136 0.00 0.00 +0.000 C +ATOM 2393 O PHE 318 -13.662 -7.145 -6.376 0.00 0.00 +0.000 OA +ATOM 2394 N PHE 319 -15.445 -8.183 -5.495 0.00 0.00 +0.000 N +ATOM 2395 H PHE 319 -15.915 -9.064 -5.343 0.00 0.00 +0.000 HD +ATOM 2396 CA PHE 319 -16.132 -6.953 -5.101 0.00 0.00 +0.000 C +ATOM 2397 HA PHE 319 -15.806 -6.116 -5.719 0.00 0.00 +0.000 HD +ATOM 2398 CB PHE 319 -17.637 -7.146 -5.295 0.00 0.00 +0.000 C +ATOM 2399 HB2 PHE 319 -17.951 -8.092 -4.853 0.00 0.00 +0.000 HD +ATOM 2400 HB3 PHE 319 -18.178 -6.327 -4.821 0.00 0.00 +0.000 HD +ATOM 2401 CG PHE 319 -18.080 -7.178 -6.743 0.00 0.00 +0.000 A +ATOM 2402 CD1 PHE 319 -17.949 -6.023 -7.539 0.00 0.00 +0.000 A +ATOM 2403 HD1 PHE 319 -17.523 -5.117 -7.109 0.00 0.00 +0.000 HD +ATOM 2404 CE1 PHE 319 -18.366 -6.035 -8.881 0.00 0.00 +0.000 A +ATOM 2405 HE1 PHE 319 -18.275 -5.134 -9.487 0.00 0.00 +0.000 HD +ATOM 2406 CZ PHE 319 -18.898 -7.208 -9.440 0.00 0.00 +0.000 A +ATOM 2407 HZ PHE 319 -19.221 -7.224 -10.481 0.00 0.00 +0.000 HD +ATOM 2408 CE2 PHE 319 -19.014 -8.363 -8.652 0.00 0.00 +0.000 A +ATOM 2409 HE2 PHE 319 -19.413 -9.276 -9.094 0.00 0.00 +0.000 HD +ATOM 2410 CD2 PHE 319 -18.619 -8.350 -7.303 0.00 0.00 +0.000 A +ATOM 2411 HD2 PHE 319 -18.731 -9.247 -6.693 0.00 0.00 +0.000 HD +ATOM 2412 C PHE 319 -15.807 -6.474 -3.681 0.00 0.00 +0.000 C +ATOM 2413 O PHE 319 -16.211 -5.365 -3.322 0.00 0.00 +0.000 OA +ATOM 2414 N HIE 320 -15.112 -7.264 -2.856 0.00 0.00 +0.000 N +ATOM 2415 H HIE 320 -14.868 -8.188 -3.181 0.00 0.00 +0.000 HD +ATOM 2416 CA HIE 320 -14.753 -6.893 -1.482 0.00 0.00 +0.000 C +ATOM 2417 HA HIE 320 -15.628 -6.513 -0.954 0.00 0.00 +0.000 HD +ATOM 2418 CB HIE 320 -14.223 -8.129 -0.731 0.00 0.00 +0.000 C +ATOM 2419 HB2 HIE 320 -14.957 -8.928 -0.837 0.00 0.00 +0.000 HD +ATOM 2420 HB3 HIE 320 -13.265 -8.461 -1.130 0.00 0.00 +0.000 HD +ATOM 2421 CG HIE 320 -14.025 -7.920 0.747 0.00 0.00 +0.000 A +ATOM 2422 ND1 HIE 320 -15.004 -7.576 1.651 0.00 0.00 +0.000 NA +ATOM 2423 CE1 HIE 320 -14.441 -7.505 2.867 0.00 0.00 +0.000 A +ATOM 2424 HE1 HIE 320 -15.064 -7.211 3.711 0.00 0.00 +0.000 HD +ATOM 2425 NE2 HIE 320 -13.141 -7.830 2.804 0.00 0.00 +0.000 N +ATOM 2426 HE2 HIE 320 -12.469 -7.895 3.556 0.00 0.00 +0.000 HD +ATOM 2427 CD2 HIE 320 -12.862 -8.074 1.454 0.00 0.00 +0.000 A +ATOM 2428 HD2 HIE 320 -11.850 -8.334 1.145 0.00 0.00 +0.000 HD +ATOM 2429 C HIE 320 -13.730 -5.749 -1.441 0.00 0.00 +0.000 C +ATOM 2430 O HIE 320 -13.750 -4.945 -0.519 0.00 0.00 +0.000 OA +ATOM 2431 N VAL 321 -12.868 -5.638 -2.458 0.00 0.00 +0.000 N +ATOM 2432 H VAL 321 -12.913 -6.349 -3.174 0.00 0.00 +0.000 HD +ATOM 2433 CA VAL 321 -11.750 -4.671 -2.498 0.00 0.00 +0.000 C +ATOM 2434 HA VAL 321 -11.478 -4.381 -1.483 0.00 0.00 +0.000 HD +ATOM 2435 CB VAL 321 -10.521 -5.332 -3.170 0.00 0.00 +0.000 C +ATOM 2436 HB VAL 321 -10.817 -5.582 -4.189 0.00 0.00 +0.000 HD +ATOM 2437 CG1 VAL 321 -9.258 -4.458 -3.203 0.00 0.00 +0.000 C +ATOM 2438 HG11 VAL 321 -8.961 -4.208 -2.184 0.00 0.00 +0.000 HD +ATOM 2439 HG12 VAL 321 -8.451 -5.004 -3.692 0.00 0.00 +0.000 HD +ATOM 2440 HG13 VAL 321 -9.464 -3.542 -3.756 0.00 0.00 +0.000 HD +ATOM 2441 CG2 VAL 321 -10.132 -6.611 -2.405 0.00 0.00 +0.000 C +ATOM 2442 HG21 VAL 321 -10.967 -7.311 -2.417 0.00 0.00 +0.000 HD +ATOM 2443 HG22 VAL 321 -9.267 -7.071 -2.883 0.00 0.00 +0.000 HD +ATOM 2444 HG23 VAL 321 -9.885 -6.358 -1.374 0.00 0.00 +0.000 HD +ATOM 2445 C VAL 321 -12.156 -3.309 -3.094 0.00 0.00 +0.000 C +ATOM 2446 O VAL 321 -11.349 -2.393 -3.207 0.00 0.00 +0.000 OA +ATOM 2447 OXT VAL 321 -13.286 -3.138 -3.547 0.00 0.00 +0.000 OA +TER diff --git a/receptor/xal_structure/6o6f_complex.pdb b/receptor/xal_structure/6o6f_complex.pdb new file mode 100644 index 0000000..d3f5a12 --- /dev/null +++ b/receptor/xal_structure/6o6f_complex.pdb @@ -0,0 +1 @@ +