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_1CKA-19_1.PDB 11.29000 -37.46000 -10.22000 -62.69000 -0.88000 73.89000 -82.47000 13.81000 30.66000 86.95000 0.00000 0.00000 0.00000 2.09000 15.19000 0.00000 -2.08000 0.00000 -0.31000 0.00000 0.00000 64.00000 PIN3_1CKA-19_2.PDB 10.24000 -37.95000 -10.71000 -61.99000 -1.02000 73.24000 -81.48000 13.60000 30.82000 85.78000 0.00000 0.00000 0.00000 2.08000 15.17000 0.00000 -1.70000 0.00000 -0.42000 0.00000 0.00000 64.00000 PIN3_1CKA-19_3.PDB 10.15000 -37.84000 -12.29000 -63.72000 -0.97000 75.54000 -83.52000 13.89000 32.81000 86.74000 0.00000 0.00000 0.00000 2.10000 15.27000 0.00000 -2.17000 0.00000 -0.44000 0.00000 0.00000 64.00000 PIN3_1CKA-19_4.PDB 10.68000 -38.56000 -10.98000 -62.87000 -0.80000 74.51000 -82.20000 13.86000 31.42000 86.15000 0.00000 0.00000 0.00000 2.28000 15.25000 0.00000 -1.83000 0.00000 -0.31000 0.00000 0.00000 64.00000 PIN3_1CKA-19_5.PDB 11.01000 -37.81000 -10.64000 -62.56000 -1.04000 73.94000 -81.91000 13.81000 31.02000 86.71000 0.00000 0.00000 0.00000 2.05000 15.24000 0.00000 -2.03000 0.00000 -0.55000 0.00000 0.00000 64.00000 PIN3_1CKA-19_6.PDB 10.38000 -37.89000 -10.69000 -62.95000 -0.86000 74.01000 -82.66000 13.48000 31.32000 86.00000 0.00000 0.00000 0.00000 2.71000 15.25000 0.00000 -1.83000 0.00000 -0.27000 0.00000 0.00000 64.00000 PIN3_1CKA-19_7.PDB 9.68000 -37.87000 -12.33000 -62.87000 -0.95000 74.99000 -82.44000 13.15000 32.39000 86.34000 0.00000 0.00000 0.00000 1.95000 15.17000 0.00000 -2.27000 0.00000 -0.42000 0.00000 0.00000 64.00000 PIN3_1CKA-19_8.PDB 10.38000 -40.16000 -14.14000 -64.78000 -0.91000 78.30000 -83.91000 14.09000 34.76000 87.07000 0.00000 0.00000 0.00000 2.83000 15.34000 0.00000 -2.34000 0.00000 -0.44000 0.00000 0.00000 64.00000 PIN3_1CKA-19_9.PDB 12.45000 -37.46000 -8.49000 -63.41000 -0.57000 73.57000 -83.71000 13.89000 30.71000 87.59000 0.00000 0.00000 0.00000 2.25000 15.23000 0.00000 -1.88000 0.00000 -0.05000 0.00000 0.00000 64.00000 PIN3_1CKA-19_10.PDB 10.22000 -37.78000 -10.61000 -62.08000 -1.01000 73.38000 -81.54000 13.75000 30.59000 86.05000 0.00000 0.00000 0.00000 2.01000 15.15000 0.00000 -2.01000 0.00000 -0.54000 0.00000 0.00000 64.00000 PIN3_1CKA-19_11.PDB 11.17000 -38.12000 -12.57000 -63.63000 -1.15000 76.97000 -82.65000 13.41000 33.21000 86.51000 0.00000 0.00000 0.00000 1.99000 15.23000 0.00000 -2.24000 0.00000 -0.56000 0.00000 0.00000 64.00000 PIN3_1CKA-19_12.PDB 9.64000 -37.86000 -12.35000 -63.83000 -0.97000 75.30000 -83.84000 14.09000 32.72000 86.47000 0.00000 0.00000 0.00000 2.36000 15.28000 0.00000 -2.03000 0.00000 -0.42000 0.00000 0.00000 64.00000 PIN3_1CKA-19_13.PDB 11.35000 -38.43000 -10.83000 -63.17000 -1.36000 75.52000 -82.14000 13.91000 31.68000 86.04000 0.00000 0.00000 0.00000 2.57000 15.29000 0.00000 -1.79000 0.00000 -0.65000 0.00000 0.00000 64.00000 PIN3_1CKA-19_14.PDB 11.23000 -37.67000 -10.29000 -63.83000 -1.01000 74.65000 -84.08000 14.66000 31.67000 87.14000 0.00000 0.00000 0.00000 2.18000 15.29000 0.00000 -2.00000 0.00000 -0.20000 0.00000 0.00000 64.00000 PIN3_1CKA-19_15.PDB 11.88000 -37.68000 -6.99000 -62.08000 -0.66000 72.69000 -81.74000 13.57000 28.71000 86.02000 0.00000 0.00000 0.00000 2.06000 15.12000 0.00000 -1.96000 0.00000 -0.04000 0.00000 0.00000 64.00000 PIN3_1CKA-19_16.PDB 10.93000 -36.90000 -9.24000 -63.21000 -0.91000 74.12000 -83.26000 13.76000 30.52000 85.87000 0.00000 0.00000 0.00000 2.20000 15.21000 0.00000 -1.76000 0.00000 -0.27000 0.00000 0.00000 64.00000 PIN3_1CKA-19_17.PDB 9.98000 -39.23000 -12.03000 -64.06000 -1.54000 76.77000 -83.32000 13.97000 33.08000 86.37000 0.00000 0.00000 0.00000 2.64000 15.28000 0.00000 -1.92000 0.00000 -0.76000 0.00000 0.00000 64.00000 PIN3_1CKA-19_18.PDB 10.95000 -37.84000 -8.92000 -62.80000 -0.58000 72.74000 -83.04000 13.62000 30.49000 86.94000 0.00000 0.00000 0.00000 2.26000 15.19000 0.00000 -1.85000 0.00000 -0.07000 0.00000 0.00000 64.00000 PIN3_1CKA-19_19.PDB 11.78000 -38.46000 -9.10000 -63.19000 -0.48000 73.87000 -82.91000 13.64000 31.08000 87.15000 0.00000 0.00000 0.00000 2.28000 15.24000 0.00000 -2.05000 0.00000 -0.04000 0.00000 0.00000 64.00000 PIN3_1CKA-19_20.PDB 10.61000 -37.91000 -12.30000 -63.63000 -1.29000 76.38000 -83.04000 14.13000 32.96000 86.16000 0.00000 0.00000 0.00000 2.06000 15.23000 0.00000 -2.23000 0.00000 -0.67000 0.00000 0.00000 64.00000 PIN3_1CKA-19_21.PDB 11.10000 -38.44000 -12.40000 -64.16000 -1.23000 77.35000 -83.08000 13.98000 33.36000 86.46000 0.00000 0.00000 0.00000 2.33000 15.33000 0.00000 -2.28000 0.00000 -0.80000 0.00000 0.00000 64.00000 PIN3_1CKA-19_22.PDB 11.86000 -37.47000 -8.54000 -62.90000 -0.80000 73.42000 -82.63000 13.69000 30.29000 86.87000 0.00000 0.00000 0.00000 2.17000 15.28000 0.00000 -1.94000 0.00000 -0.29000 0.00000 0.00000 64.00000 PIN3_1CKA-19_23.PDB 9.99000 -39.40000 -10.45000 -63.78000 -1.22000 75.83000 -83.81000 14.04000 32.36000 86.49000 0.00000 0.00000 0.00000 2.22000 15.24000 0.00000 -2.04000 0.00000 -0.24000 0.00000 0.00000 64.00000 PIN3_1CKA-19_24.PDB 11.24000 -37.76000 -8.84000 -63.12000 -0.77000 73.42000 -83.15000 13.42000 31.01000 87.09000 0.00000 0.00000 0.00000 2.28000 15.19000 0.00000 -2.06000 0.00000 -0.27000 0.00000 0.00000 64.00000 PIN3_1CKA-19_25.PDB 9.05000 -38.64000 -16.26000 -63.25000 -1.07000 76.25000 -82.56000 13.96000 35.00000 86.31000 0.00000 0.00000 0.00000 2.01000 15.18000 0.00000 -2.28000 0.00000 -0.42000 0.00000 0.00000 64.00000 PIN3_1CKA-19_26.PDB 9.90000 -37.24000 -10.07000 -62.48000 -0.87000 73.34000 -82.41000 13.87000 30.23000 85.96000 0.00000 0.00000 0.00000 2.02000 15.11000 0.00000 -2.13000 0.00000 -0.31000 0.00000 0.00000 64.00000 PIN3_1CKA-19_27.PDB 10.80000 -37.83000 -8.89000 -63.16000 -0.69000 73.70000 -83.48000 13.86000 30.92000 86.47000 0.00000 0.00000 0.00000 2.03000 15.27000 0.00000 -2.05000 0.00000 -0.09000 0.00000 0.00000 64.00000 PIN3_1CKA-19_28.PDB 11.68000 -38.49000 -9.10000 -63.51000 -1.10000 75.26000 -83.18000 13.86000 31.41000 86.43000 0.00000 0.00000 0.00000 2.33000 15.30000 0.00000 -2.01000 0.00000 -0.22000 0.00000 0.00000 64.00000 PIN3_1CKA-19_29.PDB 10.07000 -36.95000 -11.44000 -63.98000 -0.97000 75.60000 -83.85000 13.96000 31.87000 86.01000 0.00000 0.00000 0.00000 2.29000 15.31000 0.00000 -2.04000 0.00000 -0.44000 0.00000 0.00000 64.00000 PIN3_1CKA-19_30.PDB 10.99000 -38.54000 -12.61000 -63.09000 -0.82000 75.13000 -82.13000 13.93000 32.65000 86.26000 0.00000 0.00000 0.00000 2.67000 15.24000 0.00000 -2.17000 0.00000 -0.29000 0.00000 0.00000 64.00000