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_2A08-1_1.PDB 2.99710 -9.61000 -1.35000 -3.06000 -10.94000 -1.31000 10.42000 -14.51000 2.05000 6.35000 3.30000 0.00000 0.00000 0.00000 0.78000 1.13000 0.00000 -0.46000 0.00000 -0.88000 0.00000 2.38000 67.00000 YSC84_2A08-1_2.PDB 4.41751 -10.39000 -1.32000 -4.83000 -11.00000 -1.57000 10.79000 -14.28000 1.81000 7.08000 3.51000 0.00000 0.00000 0.00000 0.81000 1.03000 0.00000 -0.51000 0.00000 -0.88000 0.00000 2.38000 67.00000 YSC84_2A08-1_3.PDB 4.56023 -9.43000 -1.30000 -3.58000 -11.17000 -1.74000 11.01000 -14.61000 2.00000 6.39000 4.15000 0.00000 0.00000 0.00000 0.88000 1.17000 0.00000 -0.32000 0.00000 -1.15000 0.00000 2.38000 67.00000 YSC84_2A08-1_4.PDB 3.02763 -10.01000 -1.00000 -2.60000 -10.94000 -0.57000 9.09000 -14.59000 0.70000 6.61000 3.43000 0.00000 0.00000 0.00000 0.82000 1.18000 0.00000 -0.36000 0.00000 -0.61000 0.00000 2.38000 67.00000 YSC84_2A08-1_5.PDB 2.97747 -8.25000 -1.02000 -2.39000 -11.20000 -1.39000 10.40000 -14.81000 2.16000 6.51000 3.93000 0.00000 0.00000 0.00000 0.78000 1.17000 0.00000 -0.31000 0.00000 -0.91000 0.00000 2.38000 67.00000 YSC84_2A08-1_6.PDB 3.17731 -8.90000 -1.01000 -2.38000 -10.92000 -1.24000 10.16000 -14.45000 1.84000 6.25000 3.31000 0.00000 0.00000 0.00000 0.76000 1.12000 0.00000 -0.50000 0.00000 -0.72000 0.00000 2.38000 67.00000 YSC84_2A08-1_7.PDB 3.37614 -11.44000 -1.33000 -5.42000 -11.54000 -0.40000 9.73000 -15.28000 1.58000 8.06000 3.38000 0.00000 0.00000 0.00000 0.89000 1.09000 0.00000 -0.70000 0.00000 -0.41000 0.00000 2.38000 67.00000 YSC84_2A08-1_8.PDB 3.81803 -10.40000 -1.07000 -3.61000 -11.11000 -0.58000 9.55000 -14.75000 0.76000 6.95000 3.75000 0.00000 0.00000 0.00000 0.94000 1.14000 0.00000 -0.57000 0.00000 -0.65000 0.00000 2.38000 67.00000 YSC84_2A08-1_9.PDB 3.66315 -8.55000 -1.25000 -2.73000 -10.46000 -1.40000 10.30000 -13.68000 1.88000 5.94000 3.54000 0.00000 0.00000 0.00000 0.71000 1.07000 0.00000 -0.44000 0.00000 -0.95000 0.00000 2.38000 67.00000 YSC84_2A08-1_10.PDB 4.00605 -8.87000 -1.29000 -2.01000 -10.81000 -1.26000 10.07000 -14.37000 1.67000 5.87000 3.71000 0.00000 0.00000 0.00000 0.85000 1.11000 0.00000 -0.53000 0.00000 -0.77000 0.00000 2.38000 67.00000 YSC84_2A08-1_11.PDB 3.53320 -7.97000 -1.00000 -1.87000 -11.07000 -1.39000 10.83000 -14.39000 1.69000 6.01000 3.95000 0.00000 0.00000 0.00000 0.85000 1.04000 0.00000 -0.66000 0.00000 -0.92000 0.00000 2.38000 67.00000 YSC84_2A08-1_12.PDB 3.27837 -8.35000 -1.02000 -2.02000 -11.00000 -1.26000 10.08000 -14.53000 1.95000 5.98000 3.96000 0.00000 0.00000 0.00000 0.85000 1.21000 0.00000 -0.67000 0.00000 -0.69000 0.00000 2.38000 67.00000 YSC84_2A08-1_13.PDB 4.42199 -9.13000 -1.00000 -3.62000 -11.37000 -1.61000 10.72000 -14.83000 3.70000 6.71000 3.07000 0.00000 0.00000 0.00000 0.84000 1.15000 0.00000 -0.46000 0.00000 -1.27000 0.00000 2.38000 67.00000 YSC84_2A08-1_14.PDB 3.05252 -8.07000 -1.03000 -2.40000 -11.05000 -1.37000 10.48000 -14.58000 2.30000 6.15000 4.02000 0.00000 0.00000 0.00000 0.89000 1.12000 0.00000 -0.59000 0.00000 -0.89000 0.00000 2.38000 67.00000 YSC84_2A08-1_15.PDB 2.99490 -9.68000 -1.03000 -2.63000 -10.98000 -0.48000 9.15000 -14.61000 1.22000 6.69000 3.15000 0.00000 0.00000 0.00000 0.83000 1.12000 0.00000 -0.48000 0.00000 -0.52000 0.00000 2.38000 67.00000 YSC84_2A08-1_16.PDB 3.27536 -10.36000 -1.00000 -2.60000 -11.73000 -0.46000 9.49000 -15.68000 0.64000 7.17000 3.77000 0.00000 0.00000 0.00000 0.88000 1.32000 0.00000 -0.35000 0.00000 -0.50000 0.00000 2.38000 67.00000 YSC84_2A08-1_17.PDB 3.74410 -6.69000 -1.76000 -4.31000 -10.16000 -1.41000 10.84000 -13.26000 2.56000 7.34000 4.15000 0.00000 0.00000 0.00000 0.89000 0.69000 0.00000 -0.58000 0.00000 -1.00000 0.00000 2.38000 67.00000 YSC84_2A08-1_18.PDB 3.77945 -8.22000 -0.94000 -2.15000 -10.17000 -1.44000 9.86000 -13.51000 1.59000 5.61000 3.66000 0.00000 0.00000 0.00000 0.72000 1.08000 0.00000 -0.43000 0.00000 -1.03000 0.00000 2.38000 67.00000 YSC84_2A08-1_19.PDB 3.58524 -8.37000 -0.92000 -0.86000 -10.18000 -1.32000 9.53000 -13.37000 1.69000 5.01000 3.11000 0.00000 0.00000 0.00000 0.64000 1.09000 0.00000 -0.81000 0.00000 -0.89000 0.00000 2.38000 67.00000 YSC84_2A08-1_20.PDB 4.26684 -7.67000 -0.98000 -1.64000 -10.73000 -1.34000 10.29000 -14.09000 1.96000 5.42000 3.98000 0.00000 0.00000 0.00000 0.90000 0.94000 0.00000 -0.48000 0.00000 -0.95000 0.00000 2.38000 67.00000 YSC84_2A08-1_21.PDB 3.98259 -9.00000 -0.93000 -2.85000 -10.79000 -1.69000 10.97000 -13.85000 2.04000 5.71000 3.27000 0.00000 0.00000 0.00000 0.73000 1.12000 0.00000 -0.54000 0.00000 -1.07000 0.00000 2.38000 67.00000 YSC84_2A08-1_22.PDB 3.08079 -11.58000 -1.20000 -4.60000 -11.32000 -0.53000 9.58000 -14.93000 0.85000 7.77000 3.19000 0.00000 0.00000 0.00000 0.76000 1.14000 0.00000 -0.56000 0.00000 -0.60000 0.00000 2.38000 67.00000 YSC84_2A08-1_23.PDB 2.97823 -8.14000 -0.96000 -3.50000 -10.66000 -1.36000 10.22000 -14.06000 3.28000 6.60000 2.99000 0.00000 0.00000 0.00000 0.82000 1.01000 0.00000 -0.55000 0.00000 -0.96000 0.00000 2.38000 67.00000 YSC84_2A08-1_24.PDB 3.34162 -11.14000 -1.00000 -2.77000 -11.97000 -0.36000 9.52000 -15.99000 1.11000 7.29000 3.36000 0.00000 0.00000 0.00000 1.07000 1.19000 0.00000 -0.98000 0.00000 -0.42000 0.00000 2.38000 67.00000 YSC84_2A08-1_25.PDB 3.40257 -9.33000 -1.35000 -3.69000 -11.24000 -1.68000 11.32000 -14.37000 3.33000 6.25000 3.13000 0.00000 0.00000 0.00000 0.88000 1.07000 0.00000 -0.61000 0.00000 -1.30000 0.00000 2.38000 67.00000 YSC84_2A08-1_26.PDB 3.83804 -6.24000 -1.25000 -2.65000 -10.09000 -1.28000 10.50000 -13.18000 2.58000 5.79000 3.78000 0.00000 0.00000 0.00000 0.82000 0.77000 0.00000 -0.47000 0.00000 -0.80000 0.00000 2.38000 67.00000 YSC84_2A08-1_27.PDB 3.17860 -10.42000 -0.99000 -2.58000 -12.06000 -0.48000 10.09000 -16.03000 0.84000 7.10000 3.89000 0.00000 0.00000 0.00000 0.98000 1.31000 0.00000 -0.63000 0.00000 -0.54000 0.00000 2.38000 67.00000 YSC84_2A08-1_28.PDB 3.21876 -8.89000 -1.23000 -1.99000 -10.06000 -1.14000 9.70000 -13.18000 1.49000 5.39000 2.96000 0.00000 0.00000 0.00000 0.56000 0.97000 0.00000 -0.54000 0.00000 -0.83000 0.00000 2.38000 67.00000 YSC84_2A08-1_29.PDB 3.96370 -10.04000 -1.27000 -4.05000 -11.03000 -1.32000 10.72000 -14.64000 1.86000 6.87000 3.38000 0.00000 0.00000 0.00000 0.84000 1.13000 0.00000 -0.56000 0.00000 -0.85000 0.00000 2.38000 67.00000 YSC84_2A08-1_30.PDB 3.72181 -6.19000 -1.82000 -4.86000 -10.57000 -1.44000 12.38000 -13.46000 2.65000 7.31000 4.63000 0.00000 0.00000 0.00000 0.93000 0.93000 0.00000 -0.96000 0.00000 -0.98000 0.00000 2.38000 67.00000