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_1ZX6-8_1.PDB -5.20000 -43.78000 -11.13000 -64.70000 -1.59000 79.56000 -83.97000 2.17000 34.45000 84.97000 0.00000 0.00000 0.00000 2.10000 16.68000 0.00000 -3.02000 0.00000 -0.27000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_2.PDB -2.76000 -44.40000 -11.70000 -65.95000 -1.54000 81.78000 -84.64000 3.40000 35.27000 86.02000 0.00000 0.00000 0.00000 2.34000 16.86000 0.00000 -3.06000 0.00000 -0.28000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_3.PDB -4.62000 -43.93000 -11.27000 -64.06000 -1.80000 78.48000 -83.29000 2.21000 34.43000 85.17000 0.00000 0.00000 0.00000 2.96000 16.70000 0.00000 -3.04000 0.00000 -0.46000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_4.PDB -1.66000 -43.73000 -12.81000 -65.02000 -2.00000 81.62000 -83.47000 2.12000 35.88000 85.96000 0.00000 0.00000 0.00000 3.23000 16.47000 0.00000 -2.80000 0.00000 -0.63000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_5.PDB -2.40000 -44.48000 -13.15000 -64.25000 -1.38000 80.01000 -82.97000 2.54000 35.63000 86.44000 0.00000 0.00000 0.00000 2.59000 16.57000 0.00000 -3.04000 0.00000 -0.36000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_6.PDB -4.13000 -42.87000 -10.33000 -63.92000 -1.58000 77.46000 -83.27000 2.46000 33.73000 84.91000 0.00000 0.00000 0.00000 2.27000 16.56000 0.00000 -2.65000 0.00000 -0.35000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_7.PDB -4.54000 -43.06000 -10.41000 -64.88000 -1.55000 78.89000 -84.32000 2.32000 34.12000 85.45000 0.00000 0.00000 0.00000 2.26000 16.66000 0.00000 -2.98000 0.00000 -0.36000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_8.PDB -1.44000 -42.91000 -10.32000 -64.94000 -1.41000 79.73000 -84.00000 2.52000 34.67000 85.68000 0.00000 0.00000 0.00000 2.81000 16.44000 0.00000 -2.92000 0.00000 -0.36000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_9.PDB -1.33000 -42.94000 -11.12000 -65.71000 -1.86000 80.98000 -85.26000 3.75000 35.48000 86.26000 0.00000 0.00000 0.00000 2.56000 17.06000 0.00000 -3.06000 0.00000 -0.42000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_10.PDB -3.40000 -42.72000 -11.00000 -66.86000 -1.89000 81.29000 -87.03000 3.94000 36.19000 84.94000 0.00000 0.00000 0.00000 2.44000 17.21000 0.00000 -2.34000 0.00000 -0.35000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_11.PDB -4.67000 -43.53000 -11.08000 -64.23000 -1.48000 78.62000 -83.58000 2.26000 34.49000 84.27000 0.00000 0.00000 0.00000 2.51000 16.62000 0.00000 -2.65000 0.00000 -0.27000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_12.PDB -2.52000 -42.09000 -9.55000 -64.43000 -1.48000 78.03000 -83.77000 2.29000 33.63000 85.34000 0.00000 0.00000 0.00000 2.37000 16.53000 0.00000 -2.71000 0.00000 -0.15000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_13.PDB -2.49000 -44.61000 -12.01000 -64.33000 -1.30000 80.36000 -82.93000 2.14000 35.17000 86.04000 0.00000 0.00000 0.00000 2.38000 16.56000 0.00000 -3.05000 0.00000 -0.35000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_14.PDB -2.43000 -44.34000 -11.78000 -65.38000 -1.52000 81.57000 -83.89000 3.17000 34.81000 86.07000 0.00000 0.00000 0.00000 2.35000 16.88000 0.00000 -3.18000 0.00000 -0.30000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_15.PDB -4.48000 -42.85000 -10.29000 -64.77000 -1.46000 78.91000 -84.31000 2.23000 34.36000 84.43000 0.00000 0.00000 0.00000 2.16000 16.56000 0.00000 -2.61000 0.00000 -0.28000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_16.PDB -3.20000 -42.99000 -11.94000 -64.76000 -1.51000 79.69000 -83.83000 2.22000 35.04000 86.05000 0.00000 0.00000 0.00000 2.39000 16.58000 0.00000 -3.13000 0.00000 -0.44000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_17.PDB -3.37000 -43.68000 -11.19000 -66.64000 -1.54000 81.87000 -86.41000 3.63000 36.34000 85.02000 0.00000 0.00000 0.00000 2.43000 17.24000 0.00000 -3.06000 0.00000 -0.15000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_18.PDB -1.58000 -44.11000 -11.52000 -66.32000 -1.39000 81.82000 -85.87000 3.67000 36.30000 86.35000 0.00000 0.00000 0.00000 2.62000 17.05000 0.00000 -3.02000 0.00000 -0.11000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_19.PDB -4.79000 -43.05000 -10.38000 -64.15000 -1.80000 78.60000 -83.22000 2.22000 33.46000 85.07000 0.00000 0.00000 0.00000 2.06000 16.68000 0.00000 -3.09000 0.00000 -0.52000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_20.PDB -4.07000 -43.84000 -11.20000 -65.29000 -1.55000 80.02000 -84.64000 2.26000 34.91000 86.43000 0.00000 0.00000 0.00000 2.25000 16.64000 0.00000 -3.12000 0.00000 -0.30000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_21.PDB -4.12000 -43.61000 -11.96000 -65.83000 -1.80000 80.57000 -85.77000 3.56000 36.29000 85.35000 0.00000 0.00000 0.00000 2.40000 17.24000 0.00000 -2.95000 0.00000 -0.37000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_22.PDB -1.03000 -43.46000 -10.86000 -65.17000 -1.78000 81.02000 -83.42000 3.17000 34.71000 85.87000 0.00000 0.00000 0.00000 2.38000 16.77000 0.00000 -2.88000 0.00000 -0.60000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_23.PDB -0.56000 -42.34000 -10.60000 -65.53000 -1.88000 81.03000 -84.42000 2.44000 34.49000 86.40000 0.00000 0.00000 0.00000 3.15000 16.48000 0.00000 -2.70000 0.00000 -0.60000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_24.PDB -1.41000 -42.99000 -10.38000 -64.57000 -1.52000 79.96000 -83.25000 2.27000 34.14000 85.93000 0.00000 0.00000 0.00000 2.34000 16.60000 0.00000 -3.07000 0.00000 -0.28000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_25.PDB -2.23000 -44.35000 -14.11000 -66.47000 -1.66000 82.29000 -85.81000 3.66000 38.26000 86.53000 0.00000 0.00000 0.00000 2.98000 17.08000 0.00000 -3.09000 0.00000 -0.45000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_26.PDB -4.54000 -43.05000 -10.24000 -64.50000 -1.51000 78.80000 -83.91000 2.28000 33.48000 85.10000 0.00000 0.00000 0.00000 2.14000 16.69000 0.00000 -2.96000 0.00000 -0.19000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_27.PDB -4.81000 -45.38000 -10.57000 -64.51000 -1.43000 79.46000 -83.65000 2.30000 34.06000 85.99000 0.00000 0.00000 0.00000 2.23000 16.73000 0.00000 -3.06000 0.00000 -0.24000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_28.PDB -4.63000 -43.05000 -10.39000 -64.41000 -1.62000 78.44000 -83.79000 2.60000 33.54000 85.37000 0.00000 0.00000 0.00000 1.99000 16.71000 0.00000 -3.04000 0.00000 -0.28000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_29.PDB -2.44000 -42.95000 -12.17000 -64.22000 -1.62000 79.30000 -83.02000 2.23000 34.69000 86.43000 0.00000 0.00000 0.00000 2.33000 16.58000 0.00000 -3.04000 0.00000 -0.39000 0.00000 0.00000 64.00000 PIN3_1ZX6-8_30.PDB -3.51000 -42.84000 -11.16000 -66.72000 -1.80000 81.01000 -87.10000 3.75000 36.16000 85.40000 0.00000 0.00000 0.00000 3.30000 17.21000 0.00000 -3.07000 0.00000 -0.44000 0.00000 0.00000 64.00000