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-14_1.PDB 6.51000 -36.91000 -7.52000 -66.62000 -0.50000 78.10000 -88.23000 7.91000 32.32000 87.26000 0.00000 0.00000 0.00000 3.05000 17.27000 0.00000 -1.97000 0.00000 -0.41000 0.00000 0.00000 64.00000 PIN3_1CKB-14_2.PDB 7.31000 -36.63000 -7.31000 -66.98000 -0.38000 78.40000 -88.75000 8.35000 32.24000 87.54000 0.00000 0.00000 0.00000 2.82000 17.61000 0.00000 -1.89000 0.00000 -0.09000 0.00000 0.00000 64.00000 PIN3_1CKB-14_3.PDB 5.35000 -36.95000 -7.91000 -67.23000 -0.57000 78.44000 -89.13000 8.30000 33.14000 86.57000 0.00000 0.00000 0.00000 3.02000 17.76000 0.00000 -1.92000 0.00000 -0.41000 0.00000 0.00000 64.00000 PIN3_1CKB-14_4.PDB 5.70000 -36.91000 -8.39000 -66.19000 -0.59000 77.97000 -87.62000 8.32000 32.43000 85.97000 0.00000 0.00000 0.00000 3.11000 17.35000 0.00000 -1.91000 0.00000 -0.50000 0.00000 0.00000 64.00000 PIN3_1CKB-14_5.PDB 5.94000 -36.91000 -9.30000 -67.41000 -0.44000 78.82000 -88.75000 8.66000 33.64000 87.13000 0.00000 0.00000 0.00000 3.16000 17.32000 0.00000 -2.27000 0.00000 -0.39000 0.00000 0.00000 64.00000 PIN3_1CKB-14_6.PDB 5.56000 -35.85000 -10.44000 -67.31000 -0.56000 78.99000 -88.49000 8.31000 34.40000 86.24000 0.00000 0.00000 0.00000 2.95000 17.50000 0.00000 -2.26000 0.00000 -0.42000 0.00000 0.00000 64.00000 PIN3_1CKB-14_7.PDB 5.89000 -36.74000 -9.22000 -66.07000 -0.45000 77.90000 -86.97000 8.19000 32.66000 85.75000 0.00000 0.00000 0.00000 3.16000 17.33000 0.00000 -2.08000 0.00000 -0.23000 0.00000 0.00000 64.00000 PIN3_1CKB-14_8.PDB 6.69000 -36.86000 -9.32000 -67.10000 -0.35000 78.86000 -88.12000 8.09000 33.24000 87.28000 0.00000 0.00000 0.00000 3.21000 17.38000 0.00000 -2.19000 0.00000 -0.06000 0.00000 0.00000 64.00000 PIN3_1CKB-14_9.PDB 6.65000 -36.01000 -8.66000 -66.43000 -0.51000 78.10000 -88.21000 8.27000 32.90000 86.84000 0.00000 0.00000 0.00000 3.06000 17.61000 0.00000 -2.00000 0.00000 -0.70000 0.00000 0.00000 64.00000 PIN3_1CKB-14_10.PDB 7.73000 -36.53000 -5.45000 -66.90000 -0.28000 77.24000 -89.09000 9.10000 31.06000 87.54000 0.00000 0.00000 0.00000 3.11000 17.64000 0.00000 -1.78000 0.00000 -0.31000 0.00000 0.00000 64.00000 PIN3_1CKB-14_11.PDB 5.62000 -36.25000 -11.18000 -67.02000 -0.49000 79.28000 -88.10000 7.93000 34.56000 86.78000 0.00000 0.00000 0.00000 3.10000 17.53000 0.00000 -2.28000 0.00000 -0.70000 0.00000 0.00000 64.00000 PIN3_1CKB-14_12.PDB 7.77000 -36.58000 -9.06000 -67.06000 -0.35000 78.97000 -88.18000 9.08000 33.08000 87.30000 0.00000 0.00000 0.00000 3.18000 17.71000 0.00000 -2.25000 0.00000 -0.34000 0.00000 0.00000 64.00000 PIN3_1CKB-14_13.PDB 6.81000 -36.57000 -7.97000 -66.97000 -0.60000 78.76000 -88.70000 8.16000 33.09000 87.39000 0.00000 0.00000 0.00000 2.84000 17.47000 0.00000 -2.02000 0.00000 -0.57000 0.00000 0.00000 64.00000 PIN3_1CKB-14_14.PDB 5.75000 -36.12000 -9.37000 -67.13000 -0.63000 78.89000 -88.93000 8.53000 33.88000 86.28000 0.00000 0.00000 0.00000 2.93000 17.53000 0.00000 -2.01000 0.00000 -0.57000 0.00000 0.00000 64.00000 PIN3_1CKB-14_15.PDB 6.24000 -36.90000 -7.52000 -67.39000 -0.29000 78.07000 -89.23000 8.68000 32.79000 86.88000 0.00000 0.00000 0.00000 3.20000 17.57000 0.00000 -1.88000 0.00000 -0.16000 0.00000 0.00000 64.00000 PIN3_1CKB-14_16.PDB 8.12000 -37.73000 -10.18000 -67.73000 -0.85000 81.13000 -88.26000 9.15000 34.48000 88.15000 0.00000 0.00000 0.00000 3.01000 18.02000 0.00000 -2.58000 0.00000 -0.46000 0.00000 0.00000 64.00000 PIN3_1CKB-14_17.PDB 7.81000 -36.63000 -7.23000 -66.64000 -0.35000 77.94000 -88.15000 8.59000 32.39000 87.20000 0.00000 0.00000 0.00000 2.99000 17.52000 0.00000 -2.12000 0.00000 -0.18000 0.00000 0.00000 64.00000 PIN3_1CKB-14_18.PDB 8.40000 -36.07000 -9.25000 -67.36000 -0.77000 79.20000 -88.75000 8.70000 34.08000 88.03000 0.00000 0.00000 0.00000 3.09000 17.53000 0.00000 -1.90000 0.00000 -0.59000 0.00000 0.00000 64.00000 PIN3_1CKB-14_19.PDB 8.36000 -36.80000 -7.66000 -65.82000 -0.66000 78.74000 -86.59000 8.07000 31.95000 86.75000 0.00000 0.00000 0.00000 3.01000 17.50000 0.00000 -2.04000 0.00000 -0.60000 0.00000 0.00000 64.00000 PIN3_1CKB-14_20.PDB 8.70000 -36.68000 -7.25000 -67.78000 -0.17000 78.90000 -89.83000 9.38000 32.75000 88.44000 0.00000 0.00000 0.00000 2.88000 17.54000 0.00000 -1.90000 0.00000 -0.05000 0.00000 0.00000 64.00000 PIN3_1CKB-14_21.PDB 5.74000 -36.89000 -8.62000 -65.80000 -0.27000 77.14000 -87.01000 8.03000 32.20000 86.03000 0.00000 0.00000 0.00000 3.06000 17.32000 0.00000 -2.00000 0.00000 -0.14000 0.00000 0.00000 64.00000 PIN3_1CKB-14_22.PDB 6.88000 -36.90000 -8.18000 -66.93000 -0.61000 78.33000 -88.55000 8.95000 32.81000 87.35000 0.00000 0.00000 0.00000 3.08000 17.37000 0.00000 -1.89000 0.00000 -0.58000 0.00000 0.00000 64.00000 PIN3_1CKB-14_23.PDB 6.38000 -36.74000 -7.41000 -65.30000 -0.48000 76.78000 -86.49000 8.13000 31.19000 85.86000 0.00000 0.00000 0.00000 3.02000 17.25000 0.00000 -1.90000 0.00000 -0.28000 0.00000 0.00000 64.00000 PIN3_1CKB-14_24.PDB 8.16000 -36.62000 -7.85000 -66.33000 -0.34000 78.23000 -87.69000 8.51000 32.12000 87.28000 0.00000 0.00000 0.00000 2.87000 17.39000 0.00000 -1.97000 0.00000 -0.05000 0.00000 0.00000 64.00000 PIN3_1CKB-14_25.PDB 5.61000 -35.96000 -8.41000 -66.58000 -0.41000 77.28000 -88.53000 8.28000 32.79000 86.35000 0.00000 0.00000 0.00000 2.89000 17.61000 0.00000 -1.88000 0.00000 -0.23000 0.00000 0.00000 64.00000 PIN3_1CKB-14_26.PDB 6.27000 -36.50000 -7.10000 -67.51000 -0.30000 77.80000 -89.85000 8.43000 32.35000 87.94000 0.00000 0.00000 0.00000 3.06000 17.55000 0.00000 -1.95000 0.00000 -0.13000 0.00000 0.00000 64.00000 PIN3_1CKB-14_27.PDB 7.32000 -36.84000 -9.91000 -66.92000 -0.90000 79.39000 -87.68000 8.18000 33.94000 87.18000 0.00000 0.00000 0.00000 3.95000 17.28000 0.00000 -2.35000 0.00000 -0.73000 0.00000 0.00000 64.00000 PIN3_1CKB-14_28.PDB 8.66000 -36.87000 -7.39000 -67.60000 -0.94000 79.50000 -88.83000 8.25000 33.67000 87.61000 0.00000 0.00000 0.00000 4.24000 17.48000 0.00000 -2.20000 0.00000 -0.80000 0.00000 0.00000 64.00000 PIN3_1CKB-14_29.PDB 5.03000 -37.78000 -10.13000 -68.41000 -1.10000 81.13000 -89.15000 9.20000 35.18000 86.37000 0.00000 0.00000 0.00000 3.06000 17.37000 0.00000 -2.64000 0.00000 -0.71000 0.00000 0.00000 64.00000 PIN3_1CKB-14_30.PDB 5.77000 -37.48000 -9.91000 -67.98000 -0.84000 80.66000 -88.71000 8.81000 34.63000 86.45000 0.00000 0.00000 0.00000 2.86000 17.56000 0.00000 -2.26000 0.00000 -0.46000 0.00000 0.00000 64.00000