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-26_1.PDB 8.73000 -37.60000 -10.79000 -63.50000 -0.64000 74.42000 -83.19000 10.77000 32.48000 84.34000 0.00000 0.00000 0.00000 4.02000 14.51000 0.00000 -1.42000 0.00000 -0.17000 0.00000 0.00000 64.00000 PIN3_1CKB-26_2.PDB 10.25000 -37.19000 -12.09000 -63.59000 -0.48000 75.40000 -82.91000 10.63000 33.65000 84.88000 0.00000 0.00000 0.00000 3.66000 14.41000 0.00000 -1.49000 0.00000 -0.23000 0.00000 0.00000 64.00000 PIN3_1CKB-26_3.PDB 8.27000 -37.81000 -11.00000 -63.32000 -0.68000 74.50000 -82.83000 10.61000 32.60000 84.54000 0.00000 0.00000 0.00000 3.57000 14.49000 0.00000 -1.74000 0.00000 -0.17000 0.00000 0.00000 64.00000 PIN3_1CKB-26_4.PDB 10.87000 -36.47000 -11.42000 -63.31000 -0.63000 75.11000 -82.72000 10.84000 32.75000 84.98000 0.00000 0.00000 0.00000 3.37000 14.43000 0.00000 -1.42000 0.00000 -0.22000 0.00000 0.00000 64.00000 PIN3_1CKB-26_5.PDB 9.05000 -37.72000 -10.92000 -63.22000 -0.69000 74.49000 -82.68000 10.68000 32.41000 84.60000 0.00000 0.00000 0.00000 3.72000 14.44000 0.00000 -1.46000 0.00000 -0.16000 0.00000 0.00000 64.00000 PIN3_1CKB-26_6.PDB 10.71000 -36.43000 -12.92000 -62.64000 -0.73000 74.81000 -81.64000 10.06000 33.10000 84.76000 0.00000 0.00000 0.00000 4.13000 14.22000 0.00000 -1.53000 0.00000 -0.28000 0.00000 0.00000 64.00000 PIN3_1CKB-26_7.PDB 10.33000 -37.56000 -12.35000 -62.68000 -0.93000 75.32000 -81.91000 10.65000 32.88000 85.20000 0.00000 0.00000 0.00000 3.43000 14.37000 0.00000 -1.50000 0.00000 -0.22000 0.00000 0.00000 64.00000 PIN3_1CKB-26_8.PDB 8.51000 -37.72000 -10.90000 -63.07000 -0.85000 74.21000 -82.74000 11.47000 32.06000 84.49000 0.00000 0.00000 0.00000 3.16000 14.47000 0.00000 -1.50000 0.00000 -0.10000 0.00000 0.00000 64.00000 PIN3_1CKB-26_9.PDB 8.71000 -38.50000 -11.68000 -63.36000 -0.95000 74.82000 -82.92000 10.68000 33.04000 84.83000 0.00000 0.00000 0.00000 4.39000 14.44000 0.00000 -1.52000 0.00000 -0.11000 0.00000 0.00000 64.00000 PIN3_1CKB-26_10.PDB 9.61000 -37.77000 -12.72000 -63.28000 -0.87000 75.22000 -82.44000 10.64000 33.64000 85.26000 0.00000 0.00000 0.00000 3.67000 14.42000 0.00000 -1.51000 0.00000 -0.23000 0.00000 0.00000 64.00000 PIN3_1CKB-26_11.PDB 8.71000 -37.53000 -11.87000 -62.52000 -0.86000 74.26000 -81.92000 10.52000 32.14000 84.29000 0.00000 0.00000 0.00000 3.82000 14.39000 0.00000 -1.50000 0.00000 -0.12000 0.00000 0.00000 64.00000 PIN3_1CKB-26_12.PDB 10.16000 -37.62000 -12.35000 -63.05000 -0.97000 75.74000 -82.40000 10.56000 33.05000 85.24000 0.00000 0.00000 0.00000 3.80000 14.36000 0.00000 -1.63000 0.00000 -0.23000 0.00000 0.00000 64.00000 PIN3_1CKB-26_13.PDB 10.02000 -37.68000 -12.58000 -63.31000 -0.56000 75.55000 -82.60000 10.68000 33.50000 85.29000 0.00000 0.00000 0.00000 3.53000 14.38000 0.00000 -1.57000 0.00000 -0.24000 0.00000 0.00000 64.00000 PIN3_1CKB-26_14.PDB 9.45000 -37.81000 -10.98000 -63.34000 -0.65000 74.80000 -82.97000 11.06000 32.60000 84.51000 0.00000 0.00000 0.00000 3.95000 14.39000 0.00000 -1.60000 0.00000 -0.12000 0.00000 0.00000 64.00000 PIN3_1CKB-26_15.PDB 12.31000 -36.75000 -11.27000 -62.64000 -0.69000 74.77000 -81.92000 11.45000 32.23000 85.07000 0.00000 0.00000 0.00000 3.81000 14.17000 0.00000 -1.56000 0.00000 -0.18000 0.00000 0.00000 64.00000 PIN3_1CKB-26_16.PDB 12.59000 -36.80000 -10.03000 -63.44000 -0.65000 75.61000 -82.94000 12.22000 31.43000 85.23000 0.00000 0.00000 0.00000 3.54000 14.53000 0.00000 -1.41000 0.00000 -0.17000 0.00000 0.00000 64.00000 PIN3_1CKB-26_17.PDB 8.86000 -37.62000 -10.81000 -63.47000 -0.62000 74.75000 -83.11000 11.05000 32.51000 84.36000 0.00000 0.00000 0.00000 3.51000 14.40000 0.00000 -1.53000 0.00000 -0.15000 0.00000 0.00000 64.00000 PIN3_1CKB-26_18.PDB 9.18000 -37.69000 -12.07000 -63.21000 -0.66000 74.91000 -82.66000 10.88000 32.87000 84.56000 0.00000 0.00000 0.00000 3.93000 14.38000 0.00000 -1.57000 0.00000 -0.10000 0.00000 0.00000 64.00000 PIN3_1CKB-26_19.PDB 8.64000 -37.23000 -11.62000 -62.64000 -0.75000 74.28000 -82.20000 10.79000 32.00000 84.10000 0.00000 0.00000 0.00000 3.39000 14.27000 0.00000 -1.41000 0.00000 -0.05000 0.00000 0.00000 64.00000 PIN3_1CKB-26_20.PDB 9.64000 -37.81000 -11.01000 -62.94000 -0.79000 74.61000 -82.56000 11.14000 32.10000 84.40000 0.00000 0.00000 0.00000 4.14000 14.33000 0.00000 -1.58000 0.00000 -0.05000 0.00000 0.00000 64.00000 PIN3_1CKB-26_21.PDB 10.02000 -37.81000 -14.30000 -63.69000 -0.93000 77.09000 -82.70000 11.49000 34.55000 85.29000 0.00000 0.00000 0.00000 3.24000 14.30000 0.00000 -1.98000 0.00000 -0.24000 0.00000 0.00000 64.00000 PIN3_1CKB-26_22.PDB 10.21000 -37.18000 -12.09000 -63.15000 -1.14000 76.09000 -82.47000 10.40000 33.11000 84.81000 0.00000 0.00000 0.00000 3.33000 14.36000 0.00000 -1.38000 0.00000 -0.11000 0.00000 0.00000 64.00000 PIN3_1CKB-26_23.PDB 12.02000 -37.14000 -10.43000 -62.68000 -0.85000 75.44000 -81.91000 11.67000 31.72000 84.72000 0.00000 0.00000 0.00000 3.03000 14.45000 0.00000 -1.44000 0.00000 -0.10000 0.00000 0.00000 64.00000 PIN3_1CKB-26_24.PDB 10.07000 -37.38000 -13.03000 -62.96000 -0.84000 74.81000 -82.23000 9.71000 33.14000 86.27000 0.00000 0.00000 0.00000 4.54000 14.39000 0.00000 -1.46000 0.00000 -0.50000 0.00000 0.00000 64.00000 PIN3_1CKB-26_25.PDB 8.34000 -38.45000 -11.64000 -63.45000 -0.85000 75.32000 -83.04000 10.81000 32.97000 84.91000 0.00000 0.00000 0.00000 3.40000 14.45000 0.00000 -1.57000 0.00000 -0.07000 0.00000 0.00000 64.00000 PIN3_1CKB-26_26.PDB 11.56000 -37.21000 -12.07000 -63.47000 -0.69000 75.43000 -82.82000 10.91000 33.75000 85.90000 0.00000 0.00000 0.00000 3.68000 14.32000 0.00000 -1.38000 0.00000 -0.48000 0.00000 0.00000 64.00000 PIN3_1CKB-26_27.PDB 10.20000 -37.03000 -11.94000 -63.30000 -0.88000 75.10000 -82.79000 9.90000 32.97000 86.32000 0.00000 0.00000 0.00000 3.90000 14.42000 0.00000 -1.49000 0.00000 -0.57000 0.00000 0.00000 64.00000 PIN3_1CKB-26_28.PDB 9.16000 -37.44000 -11.34000 -63.32000 -0.92000 74.29000 -83.08000 9.99000 32.50000 85.36000 0.00000 0.00000 0.00000 5.14000 14.47000 0.00000 -1.52000 0.00000 -0.51000 0.00000 0.00000 64.00000 PIN3_1CKB-26_29.PDB 9.63000 -37.11000 -12.05000 -64.19000 -0.73000 76.33000 -83.58000 10.41000 33.62000 85.20000 0.00000 0.00000 0.00000 3.59000 14.64000 0.00000 -1.49000 0.00000 -0.37000 0.00000 0.00000 64.00000 PIN3_1CKB-26_30.PDB 8.74000 -37.33000 -10.50000 -63.74000 -0.83000 74.68000 -83.58000 10.30000 32.60000 85.28000 0.00000 0.00000 0.00000 3.87000 14.53000 0.00000 -1.61000 0.00000 -0.41000 0.00000 0.00000 64.00000