name total energy Backbone Hbon 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 PIN3_1CKB-15_1.PDB 6.34000 -40.47000 -14.29000 -66.79000 -1.29000 82.50000 -86.08000 8.19000 35.63000 89.35000 0.00000 0.00000 0.00000 2.96000 16.49000 0.00000 -2.78000 0.00000 -0.59000 0.00000 0.00000 64.00000 PIN3_1CKB-15_2.PDB 8.04000 -38.79000 -11.09000 -65.11000 -1.58000 79.95000 -84.14000 7.99000 33.51000 88.02000 0.00000 0.00000 0.00000 3.04000 16.41000 0.00000 -3.00000 0.00000 -0.76000 0.00000 0.00000 64.00000 PIN3_1CKB-15_3.PDB 7.83000 -39.58000 -13.40000 -66.43000 -1.45000 82.23000 -86.02000 8.33000 34.71000 89.15000 0.00000 0.00000 0.00000 3.20000 16.36000 0.00000 -2.25000 0.00000 -0.67000 0.00000 0.00000 64.00000 PIN3_1CKB-15_4.PDB 8.51000 -39.33000 -10.29000 -65.25000 -1.32000 79.99000 -84.27000 8.35000 33.19000 87.56000 0.00000 0.00000 0.00000 3.24000 16.21000 0.00000 -2.62000 0.00000 -0.73000 0.00000 0.00000 64.00000 PIN3_1CKB-15_5.PDB 8.15000 -38.90000 -10.64000 -66.32000 -1.49000 80.84000 -85.81000 8.05000 33.91000 88.21000 0.00000 0.00000 0.00000 3.31000 16.39000 0.00000 -2.32000 0.00000 -0.69000 0.00000 0.00000 64.00000 PIN3_1CKB-15_6.PDB 8.16000 -39.57000 -12.84000 -65.74000 -1.53000 81.70000 -84.70000 8.06000 34.20000 88.28000 0.00000 0.00000 0.00000 3.57000 16.45000 0.00000 -2.62000 0.00000 -0.65000 0.00000 0.00000 64.00000 PIN3_1CKB-15_7.PDB 9.25000 -39.10000 -11.32000 -64.86000 -1.34000 79.86000 -83.83000 8.35000 33.25000 88.59000 0.00000 0.00000 0.00000 3.06000 16.32000 0.00000 -2.87000 0.00000 -0.54000 0.00000 0.00000 64.00000 PIN3_1CKB-15_8.PDB 6.83000 -39.29000 -10.30000 -67.60000 -1.26000 81.40000 -87.56000 8.51000 34.44000 88.21000 0.00000 0.00000 0.00000 3.20000 16.40000 0.00000 -2.43000 0.00000 -0.48000 0.00000 0.00000 64.00000 PIN3_1CKB-15_9.PDB 7.09000 -39.10000 -10.81000 -67.58000 -1.51000 81.68000 -87.63000 8.15000 34.66000 88.30000 0.00000 0.00000 0.00000 4.03000 16.83000 0.00000 -2.52000 0.00000 -0.58000 0.00000 0.00000 64.00000 PIN3_1CKB-15_10.PDB 7.62000 -39.87000 -12.57000 -66.13000 -1.34000 81.59000 -85.36000 8.15000 34.21000 89.23000 0.00000 0.00000 0.00000 2.96000 16.18000 0.00000 -2.81000 0.00000 -0.45000 0.00000 0.00000 64.00000 PIN3_1CKB-15_11.PDB 7.97000 -39.25000 -10.92000 -65.21000 -1.62000 80.30000 -84.05000 8.16000 33.35000 87.64000 0.00000 0.00000 0.00000 3.22000 16.12000 0.00000 -2.96000 0.00000 -0.70000 0.00000 0.00000 64.00000 PIN3_1CKB-15_12.PDB 7.46000 -39.08000 -10.74000 -67.32000 -1.50000 81.92000 -86.89000 8.16000 34.56000 88.11000 0.00000 0.00000 0.00000 3.17000 16.38000 0.00000 -2.28000 0.00000 -0.64000 0.00000 0.00000 64.00000 PIN3_1CKB-15_13.PDB 7.08000 -39.15000 -10.23000 -67.46000 -1.31000 81.76000 -87.15000 7.94000 34.61000 88.02000 0.00000 0.00000 0.00000 2.95000 16.39000 0.00000 -2.37000 0.00000 -0.53000 0.00000 0.00000 64.00000 PIN3_1CKB-15_14.PDB 9.38000 -39.14000 -10.81000 -65.93000 -1.49000 80.93000 -84.98000 8.31000 33.70000 89.03000 0.00000 0.00000 0.00000 2.99000 16.11000 0.00000 -2.66000 0.00000 -0.59000 0.00000 0.00000 64.00000 PIN3_1CKB-15_15.PDB 8.69000 -39.25000 -10.84000 -65.76000 -1.31000 80.52000 -84.80000 8.12000 33.53000 88.60000 0.00000 0.00000 0.00000 3.06000 16.06000 0.00000 -2.65000 0.00000 -0.53000 0.00000 0.00000 64.00000 PIN3_1CKB-15_16.PDB 8.67000 -39.15000 -11.19000 -66.68000 -1.57000 82.39000 -86.09000 7.93000 34.11000 87.96000 0.00000 0.00000 0.00000 3.91000 16.44000 0.00000 -2.35000 0.00000 -0.59000 0.00000 0.00000 64.00000 PIN3_1CKB-15_17.PDB 8.35000 -38.83000 -10.61000 -65.32000 -1.28000 80.24000 -84.37000 8.12000 33.33000 87.04000 0.00000 0.00000 0.00000 2.84000 16.41000 0.00000 -2.28000 0.00000 -0.53000 0.00000 0.00000 64.00000 PIN3_1CKB-15_18.PDB 7.76000 -39.11000 -11.29000 -67.69000 -1.41000 82.81000 -86.97000 8.28000 34.69000 88.21000 0.00000 0.00000 0.00000 3.09000 16.50000 0.00000 -2.39000 0.00000 -0.48000 0.00000 0.00000 64.00000 PIN3_1CKB-15_19.PDB 7.32000 -39.47000 -10.42000 -67.44000 -1.17000 81.34000 -87.40000 8.32000 34.36000 87.92000 0.00000 0.00000 0.00000 4.14000 16.94000 0.00000 -2.45000 0.00000 -0.41000 0.00000 0.00000 64.00000 PIN3_1CKB-15_20.PDB 7.55000 -39.37000 -10.99000 -66.17000 -1.50000 81.19000 -85.26000 8.56000 33.64000 87.85000 0.00000 0.00000 0.00000 2.98000 16.36000 0.00000 -2.82000 0.00000 -0.58000 0.00000 0.00000 64.00000 PIN3_1CKB-15_21.PDB 8.43000 -39.51000 -11.10000 -66.10000 -1.08000 81.05000 -85.47000 8.15000 33.63000 88.49000 0.00000 0.00000 0.00000 2.91000 16.12000 0.00000 -2.22000 0.00000 -0.31000 0.00000 0.00000 64.00000 PIN3_1CKB-15_22.PDB 8.66000 -39.11000 -10.65000 -65.60000 -1.30000 80.65000 -85.01000 8.15000 33.22000 88.12000 0.00000 0.00000 0.00000 2.98000 16.33000 0.00000 -2.30000 0.00000 -0.49000 0.00000 0.00000 64.00000 PIN3_1CKB-15_23.PDB 9.13000 -39.31000 -10.29000 -66.09000 -1.02000 80.66000 -85.37000 8.57000 33.42000 87.70000 0.00000 0.00000 0.00000 3.67000 16.68000 0.00000 -2.52000 0.00000 -0.29000 0.00000 0.00000 64.00000 PIN3_1CKB-15_24.PDB 8.69000 -39.43000 -11.13000 -65.45000 -1.45000 80.23000 -84.50000 7.94000 33.80000 88.59000 0.00000 0.00000 0.00000 3.28000 16.08000 0.00000 -2.71000 0.00000 -0.47000 0.00000 0.00000 64.00000 PIN3_1CKB-15_25.PDB 9.94000 -38.68000 -11.08000 -66.17000 -1.37000 81.34000 -85.48000 8.01000 33.77000 88.75000 0.00000 0.00000 0.00000 3.81000 16.44000 0.00000 -2.35000 0.00000 -0.62000 0.00000 0.00000 64.00000 PIN3_1CKB-15_26.PDB 9.41000 -39.17000 -10.86000 -65.77000 -1.25000 80.22000 -85.13000 8.19000 33.66000 88.75000 0.00000 0.00000 0.00000 3.83000 16.46000 0.00000 -2.66000 0.00000 -0.39000 0.00000 0.00000 64.00000 PIN3_1CKB-15_27.PDB 9.97000 -38.84000 -10.43000 -66.40000 -1.20000 81.04000 -85.81000 8.14000 33.78000 88.77000 0.00000 0.00000 0.00000 3.78000 16.33000 0.00000 -2.29000 0.00000 -0.57000 0.00000 0.00000 64.00000 PIN3_1CKB-15_28.PDB 9.76000 -39.60000 -13.44000 -65.67000 -1.48000 81.76000 -84.68000 8.61000 34.47000 89.43000 0.00000 0.00000 0.00000 3.59000 16.21000 0.00000 -2.55000 0.00000 -0.68000 0.00000 0.00000 64.00000 PIN3_1CKB-15_29.PDB 8.30000 -40.50000 -12.96000 -67.71000 -1.42000 83.32000 -87.07000 8.04000 36.04000 90.26000 0.00000 0.00000 0.00000 3.48000 16.33000 0.00000 -2.47000 0.00000 -0.71000 0.00000 0.00000 64.00000 PIN3_1CKB-15_30.PDB 10.59000 -40.47000 -11.37000 -66.02000 -1.27000 82.09000 -84.73000 8.09000 34.76000 89.21000 0.00000 0.00000 0.00000 3.12000 16.19000 0.00000 -2.27000 0.00000 -0.56000 0.00000 0.00000 64.00000