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-13_1.PDB 8.93000 -38.99000 -9.29000 -63.81000 -0.85000 75.08000 -83.08000 16.06000 31.78000 81.10000 0.00000 0.00000 0.00000 2.84000 14.88000 0.00000 -1.30000 0.00000 -0.60000 0.00000 0.00000 63.00000 PIN3_1CKA-13_2.PDB 7.59000 -36.86000 -10.26000 -64.02000 -0.94000 75.09000 -83.43000 15.11000 31.40000 80.92000 0.00000 0.00000 0.00000 2.52000 14.85000 0.00000 -1.41000 0.00000 -0.52000 0.00000 0.00000 63.00000 PIN3_1CKA-13_3.PDB 7.99000 -38.90000 -9.34000 -64.23000 -0.80000 75.04000 -83.97000 15.93000 31.87000 81.50000 0.00000 0.00000 0.00000 2.85000 14.86000 0.00000 -1.47000 0.00000 -0.47000 0.00000 0.00000 63.00000 PIN3_1CKA-13_4.PDB 7.85000 -38.74000 -9.05000 -64.01000 -0.94000 75.43000 -83.30000 15.69000 31.47000 80.55000 0.00000 0.00000 0.00000 2.81000 14.86000 0.00000 -1.56000 0.00000 -0.49000 0.00000 0.00000 63.00000 PIN3_1CKA-13_5.PDB 8.57000 -38.23000 -8.63000 -64.47000 -0.86000 75.62000 -84.06000 15.35000 31.08000 81.73000 0.00000 0.00000 0.00000 2.85000 14.90000 0.00000 -1.45000 0.00000 -0.36000 0.00000 0.00000 63.00000 PIN3_1CKA-13_6.PDB 8.12000 -39.08000 -9.49000 -64.13000 -0.82000 75.30000 -83.70000 15.94000 31.90000 81.17000 0.00000 0.00000 0.00000 2.89000 14.87000 0.00000 -1.39000 0.00000 -0.48000 0.00000 0.00000 63.00000 PIN3_1CKA-13_7.PDB 7.93000 -38.12000 -8.23000 -64.16000 -0.84000 74.69000 -84.03000 15.86000 30.80000 80.58000 0.00000 0.00000 0.00000 3.07000 14.84000 0.00000 -1.32000 0.00000 -0.37000 0.00000 0.00000 63.00000 PIN3_1CKA-13_8.PDB 7.74000 -40.18000 -12.97000 -63.59000 -0.61000 76.23000 -82.00000 15.67000 33.66000 81.11000 0.00000 0.00000 0.00000 2.74000 14.86000 0.00000 -1.69000 0.00000 -0.65000 0.00000 0.00000 63.00000 PIN3_1CKA-13_9.PDB 8.19000 -39.88000 -10.33000 -63.62000 -0.85000 75.89000 -82.35000 15.58000 32.13000 81.33000 0.00000 0.00000 0.00000 2.77000 14.79000 0.00000 -1.82000 0.00000 -0.65000 0.00000 0.00000 63.00000 PIN3_1CKA-13_10.PDB 8.51000 -38.16000 -8.55000 -64.33000 -0.83000 75.42000 -84.12000 15.52000 31.14000 81.30000 0.00000 0.00000 0.00000 2.82000 14.84000 0.00000 -1.33000 0.00000 -0.35000 0.00000 0.00000 63.00000 PIN3_1CKA-13_11.PDB 7.52000 -40.60000 -11.03000 -64.20000 -0.78000 76.38000 -83.29000 15.74000 33.37000 81.57000 0.00000 0.00000 0.00000 2.80000 14.86000 0.00000 -1.72000 0.00000 -0.71000 0.00000 0.00000 63.00000 PIN3_1CKA-13_12.PDB 9.21000 -37.93000 -11.09000 -63.93000 -0.76000 75.69000 -82.83000 15.58000 32.60000 81.16000 0.00000 0.00000 0.00000 2.63000 14.90000 0.00000 -1.38000 0.00000 -0.53000 0.00000 0.00000 63.00000 PIN3_1CKA-13_13.PDB 7.50000 -39.63000 -9.75000 -63.85000 -1.08000 75.04000 -83.02000 15.78000 32.14000 80.96000 0.00000 0.00000 0.00000 3.06000 14.88000 0.00000 -1.54000 0.00000 -0.60000 0.00000 0.00000 63.00000 PIN3_1CKA-13_14.PDB 9.00000 -38.73000 -10.29000 -63.15000 -0.83000 75.41000 -81.70000 15.54000 31.50000 80.79000 0.00000 0.00000 0.00000 2.72000 14.81000 0.00000 -1.66000 0.00000 -0.58000 0.00000 0.00000 63.00000 PIN3_1CKA-13_15.PDB 7.55000 -39.91000 -10.41000 -64.32000 -0.89000 76.10000 -83.41000 15.79000 32.37000 81.72000 0.00000 0.00000 0.00000 2.81000 14.73000 0.00000 -1.74000 0.00000 -0.56000 0.00000 0.00000 63.00000 PIN3_1CKA-13_16.PDB 7.63000 -38.22000 -8.63000 -63.87000 -0.86000 74.98000 -83.46000 15.52000 30.91000 80.33000 0.00000 0.00000 0.00000 2.68000 14.85000 0.00000 -1.38000 0.00000 -0.36000 0.00000 0.00000 63.00000 PIN3_1CKA-13_17.PDB 9.27000 -38.07000 -10.06000 -63.82000 -0.91000 75.47000 -83.01000 15.78000 32.06000 81.09000 0.00000 0.00000 0.00000 2.58000 14.83000 0.00000 -1.35000 0.00000 -0.47000 0.00000 0.00000 63.00000 PIN3_1CKA-13_18.PDB 8.74000 -39.07000 -9.16000 -64.03000 -0.87000 75.52000 -83.11000 15.80000 31.68000 81.22000 0.00000 0.00000 0.00000 2.81000 14.84000 0.00000 -1.33000 0.00000 -0.72000 0.00000 0.00000 63.00000 PIN3_1CKA-13_19.PDB 9.57000 -39.48000 -9.48000 -63.94000 -0.70000 75.35000 -83.07000 15.74000 32.06000 82.25000 0.00000 0.00000 0.00000 2.87000 14.87000 0.00000 -1.49000 0.00000 -0.53000 0.00000 0.00000 63.00000 PIN3_1CKA-13_20.PDB 7.80000 -39.00000 -11.00000 -64.19000 -0.80000 75.70000 -83.73000 15.56000 33.13000 81.32000 0.00000 0.00000 0.00000 2.73000 14.86000 0.00000 -1.45000 0.00000 -0.47000 0.00000 0.00000 63.00000 PIN3_1CKA-13_21.PDB 7.42000 -36.86000 -9.34000 -63.38000 -1.31000 74.05000 -82.70000 14.26000 30.68000 80.36000 0.00000 0.00000 0.00000 3.44000 14.85000 0.00000 -1.19000 0.00000 -0.58000 0.00000 0.00000 63.00000 PIN3_1CKA-13_22.PDB 7.50000 -38.90000 -9.25000 -63.94000 -1.03000 74.87000 -83.39000 15.62000 31.52000 80.94000 0.00000 0.00000 0.00000 2.95000 14.81000 0.00000 -1.38000 0.00000 -0.49000 0.00000 0.00000 63.00000 PIN3_1CKA-13_23.PDB 6.58000 -38.62000 -11.53000 -63.88000 -1.15000 76.15000 -82.99000 14.87000 32.59000 80.81000 0.00000 0.00000 0.00000 2.81000 14.88000 0.00000 -1.82000 0.00000 -0.67000 0.00000 0.00000 63.00000 PIN3_1CKA-13_24.PDB 11.88000 -36.89000 -8.21000 -64.12000 -1.03000 75.49000 -83.27000 17.88000 31.09000 80.87000 0.00000 0.00000 0.00000 2.58000 14.78000 0.00000 -1.88000 0.00000 -0.62000 0.00000 0.00000 63.00000 PIN3_1CKA-13_25.PDB 7.62000 -40.64000 -11.05000 -64.03000 -0.78000 76.30000 -83.02000 15.61000 33.15000 81.48000 0.00000 0.00000 0.00000 3.02000 14.80000 0.00000 -1.71000 0.00000 -0.70000 0.00000 0.00000 63.00000 PIN3_1CKA-13_26.PDB 8.38000 -38.11000 -10.38000 -64.48000 -0.87000 76.15000 -84.21000 15.87000 31.88000 81.62000 0.00000 0.00000 0.00000 2.69000 14.83000 0.00000 -1.40000 0.00000 -0.37000 0.00000 0.00000 63.00000 PIN3_1CKA-13_27.PDB 9.88000 -36.99000 -8.65000 -64.21000 -0.96000 75.22000 -83.62000 15.72000 30.67000 82.08000 0.00000 0.00000 0.00000 2.58000 14.89000 0.00000 -1.50000 0.00000 -0.48000 0.00000 0.00000 63.00000 PIN3_1CKA-13_28.PDB 8.08000 -38.83000 -9.30000 -64.59000 -0.80000 75.63000 -84.25000 15.85000 31.96000 81.44000 0.00000 0.00000 0.00000 2.90000 14.88000 0.00000 -1.29000 0.00000 -0.62000 0.00000 0.00000 63.00000 PIN3_1CKA-13_29.PDB 8.35000 -38.13000 -8.54000 -63.12000 -0.88000 74.54000 -82.30000 15.45000 30.55000 80.06000 0.00000 0.00000 0.00000 2.64000 14.80000 0.00000 -1.43000 0.00000 -0.48000 0.00000 0.00000 63.00000 PIN3_1CKA-13_30.PDB 8.04000 -39.09000 -9.58000 -65.15000 -0.76000 75.95000 -85.02000 15.56000 32.41000 82.73000 0.00000 0.00000 0.00000 2.81000 14.89000 0.00000 -1.35000 0.00000 -0.46000 0.00000 0.00000 63.00000