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-14_1.PDB 7.12000 -38.24000 -7.29000 -64.42000 -1.30000 75.78000 -84.87000 12.83000 30.83000 82.88000 0.00000 0.00000 0.00000 3.74000 17.73000 0.00000 -2.12000 0.00000 -0.69000 0.00000 0.00000 64.00000 PIN3_1CKA-14_2.PDB 6.90000 -37.84000 -8.24000 -65.43000 -1.68000 76.79000 -85.94000 13.25000 31.78000 83.47000 0.00000 0.00000 0.00000 3.72000 17.85000 0.00000 -2.04000 0.00000 -0.93000 0.00000 0.00000 64.00000 PIN3_1CKA-14_3.PDB 5.09000 -37.90000 -9.07000 -67.10000 -2.78000 78.59000 -87.67000 12.67000 33.07000 83.97000 0.00000 0.00000 0.00000 4.60000 18.09000 0.00000 -1.98000 0.00000 -1.32000 0.00000 0.00000 64.00000 PIN3_1CKA-14_4.PDB 7.62000 -37.83000 -8.22000 -65.63000 -1.52000 77.37000 -85.97000 13.42000 31.85000 83.62000 0.00000 0.00000 0.00000 3.82000 17.67000 0.00000 -2.16000 0.00000 -1.14000 0.00000 0.00000 64.00000 PIN3_1CKA-14_5.PDB 7.02000 -37.82000 -7.37000 -64.69000 -1.21000 75.60000 -85.29000 13.08000 30.52000 82.82000 0.00000 0.00000 0.00000 3.95000 17.78000 0.00000 -1.98000 0.00000 -0.59000 0.00000 0.00000 64.00000 PIN3_1CKA-14_6.PDB 5.63000 -37.87000 -6.66000 -66.74000 -2.84000 77.79000 -87.43000 12.81000 31.57000 83.28000 0.00000 0.00000 0.00000 4.71000 17.92000 0.00000 -1.75000 0.00000 -1.24000 0.00000 0.00000 64.00000 PIN3_1CKA-14_7.PDB 6.97000 -37.89000 -8.28000 -66.46000 -1.64000 77.89000 -86.95000 12.45000 32.64000 84.30000 0.00000 0.00000 0.00000 3.92000 17.90000 0.00000 -2.19000 0.00000 -0.83000 0.00000 0.00000 64.00000 PIN3_1CKA-14_8.PDB 8.09000 -38.34000 -7.79000 -66.03000 -1.35000 76.99000 -86.83000 13.84000 32.08000 84.29000 0.00000 0.00000 0.00000 4.16000 17.50000 0.00000 -2.07000 0.00000 -0.86000 0.00000 0.00000 64.00000 PIN3_1CKA-14_9.PDB 7.86000 -37.88000 -8.15000 -66.42000 -1.56000 77.95000 -86.90000 12.64000 32.41000 85.02000 0.00000 0.00000 0.00000 3.68000 18.09000 0.00000 -2.00000 0.00000 -0.94000 0.00000 0.00000 64.00000 PIN3_1CKA-14_10.PDB 6.35000 -37.88000 -9.07000 -67.17000 -2.90000 79.14000 -87.37000 13.39000 33.32000 83.93000 0.00000 0.00000 0.00000 4.57000 18.06000 0.00000 -2.27000 0.00000 -1.34000 0.00000 0.00000 64.00000 PIN3_1CKA-14_11.PDB 7.22000 -37.88000 -8.25000 -66.35000 -1.63000 77.89000 -86.89000 12.63000 32.58000 84.12000 0.00000 0.00000 0.00000 3.79000 17.87000 0.00000 -2.00000 0.00000 -0.81000 0.00000 0.00000 64.00000 PIN3_1CKA-14_12.PDB 5.11000 -37.78000 -8.24000 -64.82000 -1.85000 76.24000 -84.87000 12.12000 31.85000 82.69000 0.00000 0.00000 0.00000 3.08000 17.66000 0.00000 -2.18000 0.00000 -1.14000 0.00000 0.00000 64.00000 PIN3_1CKA-14_13.PDB 5.73000 -37.88000 -8.38000 -66.06000 -2.72000 78.44000 -85.49000 12.32000 32.06000 83.68000 0.00000 0.00000 0.00000 3.21000 18.03000 0.00000 -2.25000 0.00000 -1.22000 0.00000 0.00000 64.00000 PIN3_1CKA-14_14.PDB 8.67000 -37.87000 -8.18000 -66.46000 -1.70000 78.31000 -86.87000 13.27000 32.43000 84.71000 0.00000 0.00000 0.00000 4.12000 17.87000 0.00000 -2.03000 0.00000 -1.05000 0.00000 0.00000 64.00000 PIN3_1CKA-14_15.PDB 7.15000 -38.32000 -6.21000 -65.30000 -1.12000 76.43000 -86.32000 12.97000 30.43000 83.01000 0.00000 0.00000 0.00000 4.13000 17.67000 0.00000 -1.86000 0.00000 -0.68000 0.00000 0.00000 64.00000 PIN3_1CKA-14_16.PDB 6.16000 -38.19000 -6.05000 -65.47000 -1.44000 76.22000 -86.21000 12.08000 30.59000 84.25000 0.00000 0.00000 0.00000 3.07000 17.58000 0.00000 -1.98000 0.00000 -0.71000 0.00000 0.00000 64.00000 PIN3_1CKA-14_17.PDB 4.12000 -37.82000 -9.15000 -65.55000 -2.95000 77.91000 -85.00000 12.30000 32.28000 83.06000 0.00000 0.00000 0.00000 2.67000 17.81000 0.00000 -2.31000 0.00000 -1.32000 0.00000 0.00000 64.00000 PIN3_1CKA-14_18.PDB 7.38000 -37.92000 -9.10000 -66.66000 -2.65000 80.29000 -87.28000 12.93000 33.14000 84.01000 0.00000 0.00000 0.00000 3.83000 17.98000 0.00000 -1.98000 0.00000 -1.22000 0.00000 0.00000 64.00000 PIN3_1CKA-14_19.PDB 6.04000 -38.24000 -7.05000 -65.43000 -3.00000 77.36000 -85.07000 12.17000 30.94000 83.96000 0.00000 0.00000 0.00000 3.83000 17.84000 0.00000 -2.00000 0.00000 -1.43000 0.00000 0.00000 64.00000 PIN3_1CKA-14_20.PDB 8.69000 -37.87000 -8.17000 -66.47000 -1.74000 78.58000 -86.70000 13.10000 32.49000 84.80000 0.00000 0.00000 0.00000 3.95000 17.70000 0.00000 -1.98000 0.00000 -1.31000 0.00000 0.00000 64.00000 PIN3_1CKA-14_21.PDB 7.63000 -38.39000 -8.27000 -65.59000 -1.66000 77.59000 -85.73000 12.83000 32.06000 83.65000 0.00000 0.00000 0.00000 4.24000 17.78000 0.00000 -2.04000 0.00000 -1.07000 0.00000 0.00000 64.00000 PIN3_1CKA-14_22.PDB 7.74000 -38.20000 -6.03000 -65.57000 -1.11000 75.44000 -86.88000 14.74000 30.35000 82.85000 0.00000 0.00000 0.00000 4.56000 17.78000 0.00000 -1.78000 0.00000 -0.62000 0.00000 0.00000 64.00000 PIN3_1CKA-14_23.PDB 5.19000 -37.84000 -8.31000 -66.67000 -1.15000 76.56000 -88.37000 13.10000 32.59000 83.81000 0.00000 0.00000 0.00000 4.20000 17.98000 0.00000 -2.08000 0.00000 -0.65000 0.00000 0.00000 64.00000 PIN3_1CKA-14_24.PDB 6.97000 -38.35000 -6.23000 -65.18000 -1.57000 76.57000 -85.49000 12.44000 30.62000 83.89000 0.00000 0.00000 0.00000 3.04000 17.70000 0.00000 -1.97000 0.00000 -0.80000 0.00000 0.00000 64.00000 PIN3_1CKA-14_25.PDB 8.37000 -37.86000 -8.23000 -65.82000 -1.58000 77.41000 -86.22000 13.03000 32.30000 84.77000 0.00000 0.00000 0.00000 3.54000 17.73000 0.00000 -2.01000 0.00000 -0.96000 0.00000 0.00000 64.00000 PIN3_1CKA-14_26.PDB 7.15000 -37.90000 -7.94000 -66.35000 -1.71000 77.97000 -86.70000 12.56000 32.50000 83.88000 0.00000 0.00000 0.00000 4.00000 17.91000 0.00000 -2.17000 0.00000 -0.99000 0.00000 0.00000 64.00000 PIN3_1CKA-14_27.PDB 8.04000 -37.75000 -9.07000 -65.14000 -1.06000 76.45000 -86.38000 12.56000 32.85000 84.21000 0.00000 0.00000 0.00000 3.76000 17.99000 0.00000 -1.89000 0.00000 -0.50000 0.00000 0.00000 64.00000 PIN3_1CKA-14_28.PDB 5.49000 -38.56000 -9.04000 -65.51000 -1.72000 76.91000 -85.92000 12.06000 32.97000 84.63000 0.00000 0.00000 0.00000 3.04000 17.54000 0.00000 -2.28000 0.00000 -1.09000 0.00000 0.00000 64.00000 PIN3_1CKA-14_29.PDB 5.95000 -37.80000 -5.94000 -64.03000 -1.59000 75.06000 -84.06000 11.97000 29.67000 82.42000 0.00000 0.00000 0.00000 3.20000 17.69000 0.00000 -1.81000 0.00000 -1.14000 0.00000 0.00000 64.00000 PIN3_1CKA-14_30.PDB 5.53000 -38.70000 -6.50000 -65.61000 -2.17000 77.74000 -85.47000 11.96000 31.97000 82.58000 0.00000 0.00000 0.00000 3.03000 17.60000 0.00000 -1.90000 0.00000 -1.40000 0.00000 0.00000 64.00000