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Per-target results from evaluating side-chain packing for DiffPack

Dataset: CASP14
Backbone type: AlphaFold2-Generated
Tool used for packing side-chains: DiffPack

RMSD (Å) ↓ χ-MAE (°) ↓ RR (%) ↑ Steric Clashes (#) ↓
Target ID All Core Surface χ1 χ2 χ3 χ4 χ1-4 100% 90% 80%
T1024 0.84 0.70 1.05 26.37 29.38 45.57 44.02 52.4 101.0 33.0 17.0
T1026 1.20 0.99 1.27 43.50 34.30 69.39 80.69 37.0 21.0 4.0 1.0
T1027 1.55 1.19 1.75 53.55 49.90 66.84 51.00 18.1 52.0 15.0 2.0
T1029 1.95 2.11 1.79 72.61 46.68 78.57 77.16 20.4 26.0 4.0 1.0
T1030 1.09 0.58 1.45 34.02 32.08 50.86 57.65 40.8 46.0 9.0 3.0
T1031 1.39 1.01 1.49 47.10 38.96 46.59 24.21 26.4 16.0 3.0 1.0
T1032 1.19 0.75 1.53 34.83 34.13 49.85 64.22 36.7 25.0 1.0 0.0
T1033 1.09 0.88 1.35 35.65 39.39 51.77 42.69 39.4 19.0 0.0 0.0
T1034 0.90 0.72 1.10 26.51 29.65 44.58 61.23 51.1 38.0 5.0 0.0
T1035 1.25 0.94 1.38 46.23 44.74 43.59 71.29 26.3 9.0 1.0 0.0
T1037 1.27 0.97 1.57 46.59 35.72 51.43 37.20 32.9 111.0 26.0 6.0
T1038 1.16 0.59 1.47 45.39 35.48 57.31 41.52 44.3 44.0 15.0 2.0
T1039 1.47 1.21 1.60 51.44 40.26 47.77 28.07 25.2 60.0 20.0 4.0
T1040 1.38 1.08 1.48 46.59 47.69 29.68 62.11 27.7 24.0 3.0 2.0
T1041 1.17 0.77 1.34 36.85 34.12 52.18 45.75 37.6 75.0 21.0 7.0
T1042 1.17 0.73 1.39 40.04 38.28 54.80 46.34 35.9 57.0 9.0 1.0
T1043 1.25 0.93 1.37 43.65 34.24 56.07 45.92 30.8 31.0 9.0 2.0
T1045s2 0.93 0.72 1.18 27.89 29.29 54.87 62.44 57.6 36.0 5.0 1.0
T1046s1 0.96 0.57 1.22 24.87 29.11 53.49 80.48 59.7 15.0 3.0 1.0
T1046s2 0.85 0.49 1.18 27.70 26.86 58.61 58.24 54.4 43.0 9.0 0.0
T1047s1 1.50 0.74 1.63 57.41 41.26 77.92 75.34 31.6 37.0 8.0 2.0
T1047s2 1.28 0.80 1.40 46.13 40.92 71.40 78.73 37.1 29.0 10.0 3.0
T1048 1.60 0.00 1.60 59.44 40.66 64.32 57.06 18.0 3.0 0.0 0.0
T1049 0.70 0.57 0.71 22.81 21.90 41.08 69.37 69.8 41.0 9.0 5.0
T1050 1.03 0.68 1.58 35.88 32.14 53.43 65.64 48.1 192.0 37.0 14.0
T1052 0.79 0.58 0.94 24.52 26.12 57.43 49.82 63.8 232.0 62.0 20.0
T1053 1.03 0.74 1.33 34.45 29.66 53.37 57.98 40.7 141.0 54.0 29.0
T1054 0.88 0.37 1.25 30.22 22.43 50.54 68.59 58.7 25.0 2.0 1.0
T1055 1.31 1.00 1.57 47.98 40.86 71.56 81.08 35.4 25.0 4.0 1.0
T1056 0.76 0.58 1.06 20.26 23.04 37.68 59.16 59.0 51.0 20.0 5.0
T1057 0.89 0.43 1.31 26.28 30.36 48.16 52.04 52.8 43.0 10.0 2.0
T1058 1.20 0.92 1.68 35.15 36.13 64.10 61.56 45.7 88.0 17.0 4.0
T1060s2 1.33 0.80 1.70 49.07 37.50 71.81 46.05 35.7 70.0 8.0 0.0
T1060s3 1.38 0.98 1.45 52.80 40.30 61.49 33.54 39.6 11.0 1.0 0.0
T1061 1.19 0.92 1.47 41.95 32.94 51.53 57.07 40.2 228.0 43.0 17.0
T1062 1.39 0.00 1.39 48.31 29.93 89.07 73.55 39.3 2.0 0.0 0.0
T1064 0.88 0.82 0.95 30.66 23.69 32.71 42.80 65.9 29.0 7.0 0.0
T1065s1 0.72 0.34 1.15 25.44 21.23 37.02 38.63 65.6 8.0 0.0 0.0
T1065s2 0.75 0.22 0.97 19.33 17.44 38.30 58.06 70.2 27.0 6.0 2.0
T1067 0.98 0.43 1.40 28.07 23.10 45.73 63.88 57.5 54.0 5.0 1.0
T1068 0.84 0.38 1.17 18.95 23.00 61.87 51.70 64.5 41.0 13.0 3.0
T1070 0.98 0.68 1.13 38.74 33.82 60.41 52.98 43.9 35.0 3.0 2.0
T1072s1 1.42 0.00 1.42 46.44 39.03 45.40 57.45 35.6 5.0 2.0 1.0
T1073 1.30 0.13 1.59 43.27 39.86 45.60 66.24 40.4 7.0 1.0 0.0
T1074 1.06 0.65 1.39 30.96 23.15 48.88 41.20 52.3 38.0 11.0 4.0
T1076 0.68 0.48 1.01 19.58 23.46 39.84 59.99 67.1 116.0 27.0 12.0
T1078 0.65 0.32 0.95 21.71 23.52 37.78 23.14 70.2 17.0 6.0 1.0
T1079 0.73 0.45 0.93 20.64 18.88 38.41 54.38 61.7 123.0 14.0 2.0
T1080 0.81 0.57 0.84 30.53 22.74 76.57 59.70 55.1 18.0 1.0 0.0
T1082 0.87 0.38 1.19 23.79 22.91 42.28 65.98 62.7 15.0 2.0 0.0
T1083 1.27 0.53 1.64 29.48 33.75 41.87 82.14 44.3 10.0 0.0 0.0
T1084 1.23 0.30 1.57 19.37 40.65 64.74 66.76 39.6 8.0 0.0 0.0
T1087 1.00 0.63 1.12 24.26 32.60 45.08 38.88 42.6 18.0 1.0 0.0
T1088 1.33 1.07 1.46 41.22 29.06 50.75 64.75 47.9 60.0 20.0 15.0
T1089 0.61 0.54 0.69 18.88 14.91 28.48 35.66 69.8 105.0 19.0 6.0
T1090 0.76 0.45 0.86 24.98 22.08 53.20 50.55 62.4 58.0 16.0 8.0
T1091 0.89 0.53 1.11 29.40 27.08 46.94 56.05 55.1 123.0 28.0 10.0
T1092 1.32 0.76 1.48 43.84 38.79 53.34 63.34 33.8 89.0 22.0 4.0
T1093 1.37 0.90 1.56 47.06 43.29 62.34 61.34 31.6 126.0 12.0 3.0
T1094 1.31 0.91 1.55 44.02 42.50 60.04 58.55 33.3 99.0 6.0 1.0
T1095 1.58 1.13 1.74 55.67 47.88 56.86 60.28 22.3 131.0 15.0 4.0
T1096 1.45 0.89 1.66 46.36 47.60 52.29 40.57 30.9 114.0 19.0 4.0
T1098 1.59 1.53 1.67 51.59 44.48 60.22 48.04 41.3 79.0 11.0 1.0
T1099 1.33 0.69 1.47 44.94 40.99 65.62 58.76 28.9 40.0 8.0 2.0
T1100 0.95 0.66 1.15 28.62 33.19 55.63 56.02 45.4 39.0 3.0 0.0
T1101 0.95 0.53 1.37 29.74 25.98 48.03 57.70 52.7 75.0 14.0 6.0