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-28_1.PDB 10.65000 -36.43000 -7.57000 -68.35000 -0.62000 80.32000 -89.51000 11.74000 32.29000 87.18000 0.00000 0.00000 0.00000 3.73000 17.33000 0.00000 -2.10000 0.00000 -0.04000 0.00000 0.00000 65.00000 PIN3_1CKB-28_2.PDB 9.49000 -36.55000 -7.73000 -69.12000 -0.60000 80.37000 -90.86000 11.95000 32.93000 87.51000 0.00000 0.00000 0.00000 3.57000 17.62000 0.00000 -1.94000 0.00000 -0.05000 0.00000 0.00000 65.00000 PIN3_1CKB-28_3.PDB 10.14000 -36.45000 -9.65000 -69.37000 -0.66000 81.39000 -90.73000 11.86000 33.45000 89.19000 0.00000 0.00000 0.00000 3.12000 17.43000 0.00000 -1.93000 0.00000 -0.09000 0.00000 0.00000 65.00000 PIN3_1CKB-28_4.PDB 9.54000 -36.73000 -8.01000 -68.67000 -0.51000 80.03000 -90.11000 12.45000 32.89000 86.11000 0.00000 0.00000 0.00000 3.88000 16.33000 0.00000 -1.77000 0.00000 -0.01000 0.00000 0.00000 65.00000 PIN3_1CKB-28_5.PDB 9.80000 -36.50000 -7.68000 -70.33000 -0.47000 80.80000 -92.88000 11.98000 33.87000 88.79000 0.00000 0.00000 0.00000 4.03000 17.38000 0.00000 -1.77000 0.00000 -0.05000 0.00000 0.00000 65.00000 PIN3_1CKB-28_6.PDB 9.75000 -36.49000 -8.71000 -68.69000 -0.67000 80.19000 -89.95000 12.45000 32.66000 88.14000 0.00000 0.00000 0.00000 3.00000 16.23000 0.00000 -2.02000 0.00000 -0.17000 0.00000 0.00000 65.00000 PIN3_1CKB-28_7.PDB 10.78000 -36.47000 -7.68000 -68.16000 -0.60000 80.10000 -89.35000 11.83000 32.26000 87.10000 0.00000 0.00000 0.00000 3.68000 17.41000 0.00000 -1.84000 0.00000 -0.09000 0.00000 0.00000 65.00000 PIN3_1CKB-28_8.PDB 7.31000 -37.45000 -6.91000 -69.51000 -0.66000 80.36000 -91.57000 12.62000 32.76000 86.86000 0.00000 0.00000 0.00000 2.95000 16.49000 0.00000 -2.10000 0.00000 -0.05000 0.00000 0.00000 65.00000 PIN3_1CKB-28_9.PDB 11.29000 -36.53000 -7.73000 -69.21000 -0.55000 81.38000 -90.76000 11.03000 32.92000 88.76000 0.00000 0.00000 0.00000 3.94000 17.66000 0.00000 -1.94000 0.00000 -0.02000 0.00000 0.00000 65.00000 PIN3_1CKB-28_10.PDB 10.42000 -36.14000 -8.34000 -69.10000 -0.67000 81.10000 -90.39000 10.82000 32.77000 89.28000 0.00000 0.00000 0.00000 3.01000 17.42000 0.00000 -1.85000 0.00000 -0.07000 0.00000 0.00000 65.00000 PIN3_1CKB-28_11.PDB 8.73000 -36.60000 -7.78000 -69.52000 -0.67000 80.30000 -91.61000 11.86000 33.40000 87.53000 0.00000 0.00000 0.00000 3.76000 17.13000 0.00000 -1.81000 0.00000 -0.12000 0.00000 0.00000 65.00000 PIN3_1CKB-28_12.PDB 9.27000 -36.53000 -5.96000 -69.11000 -0.64000 79.15000 -91.35000 12.67000 32.10000 88.17000 0.00000 0.00000 0.00000 2.86000 16.39000 0.00000 -2.05000 0.00000 -0.05000 0.00000 0.00000 65.00000 PIN3_1CKB-28_13.PDB 10.87000 -36.99000 -8.21000 -68.30000 -0.50000 79.73000 -89.80000 12.94000 32.52000 87.52000 0.00000 0.00000 0.00000 3.87000 17.57000 0.00000 -1.84000 0.00000 -0.05000 0.00000 0.00000 65.00000 PIN3_1CKB-28_14.PDB 9.85000 -35.44000 -7.25000 -67.73000 -0.52000 79.39000 -88.75000 11.22000 30.83000 86.93000 0.00000 0.00000 0.00000 2.96000 17.28000 0.00000 -1.86000 0.00000 0.07000 0.00000 0.00000 65.00000 PIN3_1CKB-28_15.PDB 10.46000 -36.59000 -7.75000 -69.72000 -0.52000 80.95000 -91.91000 11.72000 33.42000 88.93000 0.00000 0.00000 0.00000 3.87000 17.55000 0.00000 -1.92000 0.00000 -0.03000 0.00000 0.00000 65.00000 PIN3_1CKB-28_16.PDB 11.58000 -36.53000 -7.73000 -68.60000 -0.58000 80.41000 -90.13000 12.57000 32.74000 87.68000 0.00000 0.00000 0.00000 3.82000 16.22000 0.00000 -2.07000 0.00000 -0.01000 0.00000 0.00000 65.00000 PIN3_1CKB-28_17.PDB 10.32000 -35.62000 -8.18000 -68.15000 -0.61000 80.15000 -89.04000 11.55000 31.40000 87.83000 0.00000 0.00000 0.00000 2.82000 17.40000 0.00000 -1.80000 0.00000 -0.04000 0.00000 0.00000 65.00000 PIN3_1CKB-28_18.PDB 9.79000 -36.48000 -5.95000 -69.64000 -0.68000 80.09000 -91.99000 11.67000 32.51000 89.36000 0.00000 0.00000 0.00000 2.88000 17.50000 0.00000 -1.86000 0.00000 -0.12000 0.00000 0.00000 65.00000 PIN3_1CKB-28_19.PDB 10.62000 -36.86000 -9.81000 -69.77000 -0.66000 81.28000 -91.44000 13.47000 33.69000 89.49000 0.00000 0.00000 0.00000 3.22000 17.76000 0.00000 -1.87000 0.00000 -0.10000 0.00000 0.00000 65.00000 PIN3_1CKB-28_20.PDB 9.37000 -35.39000 -8.85000 -68.46000 -0.48000 80.17000 -89.78000 10.99000 32.08000 88.16000 0.00000 0.00000 0.00000 2.77000 17.36000 0.00000 -1.88000 0.00000 0.03000 0.00000 0.00000 65.00000 PIN3_1CKB-28_21.PDB 8.35000 -36.76000 -7.37000 -69.69000 -0.63000 79.34000 -92.31000 13.16000 33.45000 87.94000 0.00000 0.00000 0.00000 3.19000 17.31000 0.00000 -1.90000 0.00000 -0.07000 0.00000 0.00000 65.00000 PIN3_1CKB-28_22.PDB 7.98000 -35.22000 -4.66000 -68.83000 -0.62000 78.48000 -91.24000 11.75000 31.03000 86.34000 0.00000 0.00000 0.00000 2.74000 17.11000 0.00000 -1.83000 0.00000 0.05000 0.00000 0.00000 65.00000 PIN3_1CKB-28_23.PDB 8.92000 -37.43000 -9.83000 -69.25000 -0.55000 81.32000 -90.55000 13.54000 33.54000 87.00000 0.00000 0.00000 0.00000 3.08000 16.53000 0.00000 -1.88000 0.00000 -0.07000 0.00000 0.00000 65.00000 PIN3_1CKB-28_24.PDB 8.56000 -35.76000 -8.56000 -67.78000 -0.50000 78.97000 -88.94000 12.63000 31.35000 85.84000 0.00000 0.00000 0.00000 3.03000 16.23000 0.00000 -1.81000 0.00000 0.09000 0.00000 0.00000 65.00000 PIN3_1CKB-28_25.PDB 10.56000 -36.52000 -9.45000 -69.11000 -0.71000 81.13000 -90.43000 12.01000 33.21000 89.34000 0.00000 0.00000 0.00000 3.16000 17.33000 0.00000 -1.99000 0.00000 -0.09000 0.00000 0.00000 65.00000 PIN3_1CKB-28_26.PDB 9.88000 -36.18000 -7.32000 -69.40000 -0.58000 80.24000 -91.59000 11.87000 33.06000 87.99000 0.00000 0.00000 0.00000 3.79000 16.46000 0.00000 -2.00000 0.00000 -0.01000 0.00000 0.00000 65.00000 PIN3_1CKB-28_27.PDB 11.13000 -35.72000 -7.98000 -69.16000 -0.63000 81.14000 -90.64000 11.78000 32.29000 89.18000 0.00000 0.00000 0.00000 2.80000 17.37000 0.00000 -1.86000 0.00000 -0.06000 0.00000 0.00000 65.00000 PIN3_1CKB-28_28.PDB 9.33000 -36.66000 -6.15000 -69.14000 -0.62000 79.68000 -91.29000 12.46000 31.85000 88.02000 0.00000 0.00000 0.00000 2.99000 17.47000 0.00000 -1.79000 0.00000 -0.02000 0.00000 0.00000 65.00000 PIN3_1CKB-28_29.PDB 10.53000 -36.54000 -5.97000 -70.27000 -0.65000 79.70000 -93.16000 13.74000 32.82000 89.28000 0.00000 0.00000 0.00000 3.41000 17.69000 0.00000 -1.68000 0.00000 -0.13000 0.00000 0.00000 65.00000 PIN3_1CKB-28_30.PDB 9.41000 -35.79000 -5.21000 -68.93000 -0.64000 79.07000 -91.34000 11.83000 31.22000 88.25000 0.00000 0.00000 0.00000 2.80000 17.45000 0.00000 -1.85000 0.00000 0.02000 0.00000 0.00000 65.00000