name Intraclash total energy Backbone Hbond Sidechain Hbond Van der Waals Electrostatics Solvation Polar Solvation Hydrophobic Van de Waals clashes entropy side chain entropy main chain sloop_entropy mloop_entropy cis_bond torsional clash backbone clash helix dipole water bridge disulfide electrostatic Kon partial covalent bonds YSC84_1OOT-17_1.PDB 2.05133 -8.11000 -0.42000 -2.12000 -8.05000 -0.17000 6.74000 -10.93000 1.51000 3.13000 2.81000 0.00000 0.00000 0.00000 0.27000 0.21000 0.00000 -0.58000 0.00000 -0.28000 0.00000 2.38000 66.00000 YSC84_1OOT-17_2.PDB 2.49680 -8.82000 -0.47000 -1.85000 -8.08000 -0.28000 6.73000 -10.86000 0.98000 3.12000 2.78000 0.00000 0.00000 0.00000 0.17000 0.19000 0.00000 -0.65000 0.00000 -0.40000 0.00000 2.38000 66.00000 YSC84_1OOT-17_3.PDB 3.48014 -8.21000 -0.32000 -4.59000 -7.96000 -0.28000 7.97000 -10.19000 1.00000 3.85000 2.91000 0.00000 0.00000 0.00000 0.27000 0.11000 0.00000 -0.46000 0.00000 -0.41000 0.00000 2.38000 66.00000 YSC84_1OOT-17_4.PDB 1.69753 -5.10000 -0.37000 -0.37000 -7.63000 -0.39000 6.17000 -10.73000 2.82000 3.15000 3.03000 0.00000 0.00000 0.00000 0.08000 0.20000 0.00000 -0.37000 0.00000 -0.49000 0.00000 2.38000 66.00000 YSC84_1OOT-17_5.PDB 2.99115 -8.98000 -0.88000 -4.29000 -8.35000 -0.30000 8.42000 -10.56000 0.92000 3.70000 3.16000 0.00000 0.00000 0.00000 0.19000 0.19000 0.00000 -0.56000 0.00000 -0.43000 0.00000 2.38000 66.00000 YSC84_1OOT-17_6.PDB 2.85677 -8.57000 -0.65000 -3.44000 -8.60000 -0.20000 8.07000 -11.33000 1.64000 3.73000 2.90000 0.00000 0.00000 0.00000 0.22000 0.31000 0.00000 -0.60000 0.00000 -0.31000 0.00000 2.38000 66.00000 YSC84_1OOT-17_7.PDB 3.88215 -9.31000 -1.38000 -3.69000 -9.14000 -1.00000 9.52000 -11.52000 1.01000 5.17000 3.59000 0.00000 0.00000 0.00000 0.22000 0.57000 0.00000 -1.12000 0.00000 -0.98000 0.00000 2.38000 66.00000 YSC84_1OOT-17_8.PDB 2.81564 -7.52000 -0.25000 -3.38000 -7.59000 -0.33000 6.99000 -9.94000 1.67000 3.23000 3.03000 0.00000 0.00000 0.00000 0.21000 0.12000 0.00000 -0.70000 0.00000 -0.46000 0.00000 2.38000 66.00000 YSC84_1OOT-17_9.PDB 4.48598 -9.45000 -2.17000 -5.55000 -10.44000 -1.16000 11.99000 -12.53000 1.89000 6.73000 3.72000 0.00000 0.00000 0.00000 0.26000 0.61000 0.00000 -1.20000 0.00000 -1.00000 0.00000 2.38000 66.00000 YSC84_1OOT-17_10.PDB 2.97730 -7.92000 -0.27000 -1.71000 -8.14000 -0.33000 7.40000 -10.78000 0.70000 3.24000 2.86000 0.00000 0.00000 0.00000 0.26000 0.39000 0.00000 -0.71000 0.00000 -0.44000 0.00000 2.38000 66.00000 YSC84_1OOT-17_11.PDB 2.55339 -8.65000 -0.39000 -1.95000 -8.21000 -0.11000 6.86000 -11.05000 0.92000 3.06000 2.83000 0.00000 0.00000 0.00000 0.19000 0.17000 0.00000 -0.63000 0.00000 -0.17000 0.00000 2.38000 66.00000 YSC84_1OOT-17_12.PDB 2.35134 -9.31000 -0.63000 -2.04000 -8.54000 -0.34000 7.01000 -11.41000 1.42000 3.43000 2.78000 0.00000 0.00000 0.00000 0.23000 0.18000 0.00000 -0.74000 0.00000 -0.47000 0.00000 2.38000 66.00000 YSC84_1OOT-17_13.PDB 2.73731 -8.75000 -0.25000 -1.70000 -8.02000 -0.19000 6.50000 -10.94000 0.75000 3.11000 2.77000 0.00000 0.00000 0.00000 0.20000 0.17000 0.00000 -0.73000 0.00000 -0.25000 0.00000 2.38000 66.00000 YSC84_1OOT-17_14.PDB 2.25312 -8.21000 -0.36000 -1.84000 -8.14000 -0.04000 6.59000 -10.95000 0.74000 3.15000 2.89000 0.00000 0.00000 0.00000 0.24000 0.28000 0.00000 -0.42000 0.00000 -0.08000 0.00000 2.38000 66.00000 YSC84_1OOT-17_15.PDB 2.52290 -9.09000 -0.49000 -1.98000 -8.56000 -0.12000 7.34000 -11.58000 0.96000 3.23000 2.82000 0.00000 0.00000 0.00000 0.20000 0.37000 0.00000 -0.74000 0.00000 -0.18000 0.00000 2.38000 66.00000 YSC84_1OOT-17_16.PDB 2.21393 -7.14000 -0.28000 -3.07000 -7.91000 -0.29000 7.34000 -10.15000 1.65000 3.38000 3.18000 0.00000 0.00000 0.00000 0.11000 0.12000 0.00000 -0.68000 0.00000 -0.42000 0.00000 2.38000 66.00000 YSC84_1OOT-17_17.PDB 2.99477 -9.08000 -0.58000 -4.80000 -8.07000 -0.13000 8.03000 -10.46000 0.81000 3.78000 2.91000 0.00000 0.00000 0.00000 0.23000 0.12000 0.00000 -0.62000 0.00000 -0.19000 0.00000 2.38000 66.00000 YSC84_1OOT-17_18.PDB 4.09285 -8.66000 -2.27000 -3.72000 -9.25000 -0.54000 10.00000 -11.62000 1.45000 4.84000 3.89000 0.00000 0.00000 0.00000 0.23000 0.32000 0.00000 -1.19000 0.00000 -0.48000 0.00000 2.38000 66.00000 YSC84_1OOT-17_19.PDB 2.89662 -8.49000 -0.45000 -3.53000 -8.25000 -0.29000 7.58000 -10.58000 1.56000 3.41000 2.92000 0.00000 0.00000 0.00000 0.26000 0.11000 0.00000 -0.71000 0.00000 -0.42000 0.00000 2.38000 66.00000 YSC84_1OOT-17_20.PDB 2.68420 -8.16000 -0.45000 -3.64000 -7.83000 -0.14000 7.34000 -10.24000 1.02000 3.15000 3.25000 0.00000 0.00000 0.00000 0.21000 0.12000 0.00000 -0.64000 0.00000 -0.21000 0.00000 2.38000 66.00000 YSC84_1OOT-17_21.PDB 4.01632 -9.46000 -2.12000 -4.37000 -9.72000 -1.30000 11.26000 -11.77000 1.51000 5.56000 3.85000 0.00000 0.00000 0.00000 0.27000 0.62000 0.00000 -1.53000 0.00000 -1.09000 0.00000 2.38000 66.00000 YSC84_1OOT-17_22.PDB 1.87616 -7.98000 -0.24000 -3.05000 -8.35000 -0.18000 6.94000 -11.16000 1.86000 4.01000 2.72000 0.00000 0.00000 0.00000 0.07000 0.18000 0.00000 -0.30000 0.00000 -0.29000 0.00000 2.38000 66.00000 YSC84_1OOT-17_23.PDB 2.83095 -7.08000 -0.23000 -2.89000 -8.38000 -0.13000 7.87000 -10.99000 1.44000 3.82000 2.94000 0.00000 0.00000 0.00000 0.23000 0.51000 0.00000 -0.56000 0.00000 -0.20000 0.00000 2.38000 66.00000 YSC84_1OOT-17_24.PDB 2.72989 -7.51000 -0.27000 -3.49000 -7.96000 -0.15000 7.60000 -10.34000 1.81000 3.17000 2.86000 0.00000 0.00000 0.00000 0.21000 0.12000 0.00000 -0.72000 0.00000 -0.22000 0.00000 2.38000 66.00000 YSC84_1OOT-17_25.PDB 4.50988 -9.68000 -2.17000 -5.62000 -10.29000 -1.09000 11.84000 -12.42000 1.77000 6.30000 3.86000 0.00000 0.00000 0.00000 0.34000 0.66000 0.00000 -1.23000 0.00000 -0.98000 0.00000 2.38000 66.00000 YSC84_1OOT-17_26.PDB 2.63023 -7.53000 -0.26000 -3.29000 -7.60000 -0.07000 7.03000 -9.96000 0.89000 3.09000 3.10000 0.00000 0.00000 0.00000 0.22000 0.22000 0.00000 -0.58000 0.00000 -0.11000 0.00000 2.38000 66.00000 YSC84_1OOT-17_27.PDB 2.54488 -8.03000 -0.40000 -1.89000 -8.03000 -0.12000 6.66000 -10.79000 1.46000 2.95000 2.76000 0.00000 0.00000 0.00000 0.25000 0.17000 0.00000 -0.69000 0.00000 -0.18000 0.00000 2.38000 66.00000 YSC84_1OOT-17_28.PDB 2.45248 -9.01000 -0.44000 -2.94000 -8.54000 -0.19000 7.37000 -11.53000 1.18000 3.92000 2.90000 0.00000 0.00000 0.00000 0.17000 0.30000 0.00000 -0.65000 0.00000 -0.26000 0.00000 2.38000 66.00000 YSC84_1OOT-17_29.PDB 3.98773 -6.61000 -1.37000 -1.28000 -8.90000 -0.35000 8.71000 -11.64000 1.82000 4.75000 3.07000 0.00000 0.00000 0.00000 0.29000 0.59000 0.00000 -1.33000 0.00000 -0.38000 0.00000 2.38000 66.00000 YSC84_1OOT-17_30.PDB 2.89702 -7.01000 -0.05000 -1.67000 -8.33000 -0.03000 7.37000 -11.16000 1.39000 2.96000 2.89000 0.00000 0.00000 0.00000 0.34000 0.44000 0.00000 -0.66000 0.00000 -0.06000 0.00000 2.38000 66.00000