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-26_1.PDB 7.58000 -37.46000 -8.91000 -62.32000 -1.36000 73.04000 -81.88000 13.57000 30.30000 81.93000 0.00000 0.00000 0.00000 2.39000 15.19000 0.00000 -1.47000 0.00000 -0.27000 0.00000 0.00000 64.00000 PIN3_1CKA-26_2.PDB 6.32000 -38.69000 -10.17000 -62.75000 -1.36000 73.13000 -82.54000 13.57000 31.78000 82.11000 0.00000 0.00000 0.00000 3.35000 15.18000 0.00000 -1.75000 0.00000 -0.36000 0.00000 0.00000 64.00000 PIN3_1CKA-26_3.PDB 6.85000 -38.66000 -10.12000 -62.67000 -1.24000 73.98000 -82.24000 14.20000 31.41000 81.45000 0.00000 0.00000 0.00000 2.32000 15.38000 0.00000 -1.53000 0.00000 -0.05000 0.00000 0.00000 64.00000 PIN3_1CKA-26_4.PDB 6.12000 -38.81000 -10.25000 -62.64000 -1.24000 73.46000 -82.14000 13.75000 31.64000 81.50000 0.00000 0.00000 0.00000 2.59000 15.37000 0.00000 -1.63000 0.00000 -0.12000 0.00000 0.00000 64.00000 PIN3_1CKA-26_5.PDB 5.96000 -39.36000 -10.84000 -62.54000 -1.08000 73.29000 -81.93000 13.96000 32.15000 81.81000 0.00000 0.00000 0.00000 2.41000 15.39000 0.00000 -1.71000 0.00000 -0.20000 0.00000 0.00000 64.00000 PIN3_1CKA-26_6.PDB 7.55000 -38.83000 -10.29000 -62.60000 -1.16000 73.56000 -82.26000 13.80000 31.81000 82.27000 0.00000 0.00000 0.00000 3.15000 15.23000 0.00000 -1.55000 0.00000 -0.34000 0.00000 0.00000 64.00000 PIN3_1CKA-26_7.PDB 6.92000 -38.05000 -9.51000 -62.43000 -0.89000 72.95000 -81.96000 13.97000 30.72000 81.33000 0.00000 0.00000 0.00000 2.46000 15.29000 0.00000 -1.51000 0.00000 -0.14000 0.00000 0.00000 64.00000 PIN3_1CKA-26_8.PDB 6.94000 -39.43000 -10.91000 -62.62000 -1.36000 73.80000 -82.01000 13.53000 32.26000 82.86000 0.00000 0.00000 0.00000 2.80000 15.37000 0.00000 -1.65000 0.00000 -0.34000 0.00000 0.00000 64.00000 PIN3_1CKA-26_9.PDB 6.77000 -38.33000 -9.77000 -63.07000 -0.49000 73.44000 -82.53000 13.75000 31.51000 81.31000 0.00000 0.00000 0.00000 2.72000 15.42000 0.00000 -1.60000 0.00000 -0.19000 0.00000 0.00000 64.00000 PIN3_1CKA-26_10.PDB 6.03000 -38.70000 -10.18000 -63.17000 -0.51000 73.48000 -83.06000 13.72000 31.84000 81.30000 0.00000 0.00000 0.00000 3.23000 15.35000 0.00000 -1.78000 0.00000 -0.15000 0.00000 0.00000 64.00000 PIN3_1CKA-26_11.PDB 7.60000 -38.16000 -9.64000 -62.89000 -0.63000 73.44000 -82.34000 13.80000 31.27000 82.01000 0.00000 0.00000 0.00000 2.67000 15.38000 0.00000 -1.57000 0.00000 -0.37000 0.00000 0.00000 64.00000 PIN3_1CKA-26_12.PDB 7.76000 -39.90000 -11.40000 -63.56000 -0.83000 75.75000 -82.84000 13.95000 32.97000 82.40000 0.00000 0.00000 0.00000 3.35000 15.26000 0.00000 -1.68000 0.00000 -0.45000 0.00000 0.00000 64.00000 PIN3_1CKA-26_13.PDB 7.17000 -37.98000 -9.42000 -62.58000 -0.57000 73.40000 -82.11000 13.72000 30.92000 80.97000 0.00000 0.00000 0.00000 2.49000 15.41000 0.00000 -1.51000 0.00000 -0.16000 0.00000 0.00000 64.00000 PIN3_1CKA-26_14.PDB 6.34000 -39.01000 -12.11000 -63.38000 -0.56000 74.09000 -82.63000 13.90000 33.63000 81.55000 0.00000 0.00000 0.00000 2.58000 15.45000 0.00000 -1.54000 0.00000 -0.19000 0.00000 0.00000 64.00000 PIN3_1CKA-26_15.PDB 7.53000 -39.48000 -10.95000 -63.15000 -0.79000 74.60000 -82.48000 13.89000 32.73000 82.79000 0.00000 0.00000 0.00000 2.58000 15.40000 0.00000 -1.79000 0.00000 -0.42000 0.00000 0.00000 64.00000 PIN3_1CKA-26_16.PDB 7.33000 -38.60000 -10.08000 -62.92000 -0.74000 73.47000 -82.44000 14.18000 31.81000 82.05000 0.00000 0.00000 0.00000 2.67000 15.35000 0.00000 -1.62000 0.00000 -0.45000 0.00000 0.00000 64.00000 PIN3_1CKA-26_17.PDB 7.19000 -37.90000 -9.38000 -62.20000 -1.23000 72.67000 -81.77000 13.76000 30.60000 82.21000 0.00000 0.00000 0.00000 2.50000 15.28000 0.00000 -1.75000 0.00000 -0.32000 0.00000 0.00000 64.00000 PIN3_1CKA-26_18.PDB 7.20000 -38.62000 -10.10000 -62.37000 -1.20000 73.14000 -81.84000 13.99000 31.42000 82.40000 0.00000 0.00000 0.00000 2.39000 15.36000 0.00000 -1.68000 0.00000 -0.36000 0.00000 0.00000 64.00000 PIN3_1CKA-26_19.PDB 6.28000 -38.82000 -10.13000 -62.48000 -1.13000 73.21000 -81.99000 13.82000 31.46000 81.51000 0.00000 0.00000 0.00000 2.64000 15.37000 0.00000 -1.69000 0.00000 -0.12000 0.00000 0.00000 64.00000 PIN3_1CKA-26_20.PDB 7.37000 -37.39000 -8.85000 -61.77000 -1.29000 72.27000 -81.18000 13.84000 30.00000 80.92000 0.00000 0.00000 0.00000 2.34000 15.14000 0.00000 -1.49000 0.00000 -0.03000 0.00000 0.00000 64.00000 PIN3_1CKA-26_21.PDB 6.96000 -38.62000 -10.12000 -62.02000 -1.38000 72.90000 -81.43000 13.75000 31.46000 82.10000 0.00000 0.00000 0.00000 2.31000 14.98000 0.00000 -1.65000 0.00000 -0.34000 0.00000 0.00000 64.00000 PIN3_1CKA-26_22.PDB 8.01000 -38.29000 -9.73000 -62.83000 -0.73000 73.94000 -82.17000 13.77000 31.44000 81.94000 0.00000 0.00000 0.00000 2.57000 15.36000 0.00000 -1.59000 0.00000 -0.32000 0.00000 0.00000 64.00000 PIN3_1CKA-26_23.PDB 6.20000 -38.27000 -9.72000 -62.42000 -1.00000 72.80000 -82.13000 13.71000 30.96000 80.88000 0.00000 0.00000 0.00000 3.12000 15.25000 0.00000 -1.58000 0.00000 -0.14000 0.00000 0.00000 64.00000 PIN3_1CKA-26_24.PDB 7.80000 -38.71000 -10.19000 -62.60000 -0.77000 73.47000 -81.98000 13.41000 31.74000 82.49000 0.00000 0.00000 0.00000 3.01000 15.31000 0.00000 -1.58000 0.00000 -0.50000 0.00000 0.00000 64.00000 PIN3_1CKA-26_25.PDB 7.22000 -38.36000 -9.80000 -62.69000 -0.58000 73.23000 -82.10000 14.05000 31.25000 81.12000 0.00000 0.00000 0.00000 2.74000 15.42000 0.00000 -1.46000 0.00000 -0.19000 0.00000 0.00000 64.00000 PIN3_1CKA-26_26.PDB 7.12000 -38.26000 -9.72000 -62.93000 -0.58000 73.45000 -82.67000 13.94000 31.48000 80.91000 0.00000 0.00000 0.00000 3.18000 15.31000 0.00000 -1.52000 0.00000 -0.17000 0.00000 0.00000 64.00000 PIN3_1CKA-26_27.PDB 7.27000 -38.90000 -10.36000 -62.38000 -1.37000 73.03000 -81.98000 13.96000 31.85000 82.11000 0.00000 0.00000 0.00000 3.16000 15.16000 0.00000 -1.54000 0.00000 -0.31000 0.00000 0.00000 64.00000 PIN3_1CKA-26_28.PDB 6.20000 -38.92000 -10.38000 -62.25000 -1.12000 73.07000 -81.57000 13.72000 31.47000 81.48000 0.00000 0.00000 0.00000 2.36000 15.25000 0.00000 -1.55000 0.00000 -0.09000 0.00000 0.00000 64.00000 PIN3_1CKA-26_29.PDB 7.71000 -38.30000 -9.76000 -62.65000 -0.68000 73.35000 -81.99000 13.91000 31.36000 81.91000 0.00000 0.00000 0.00000 2.57000 15.28000 0.00000 -1.61000 0.00000 -0.40000 0.00000 0.00000 64.00000 PIN3_1CKA-26_30.PDB 6.93000 -38.21000 -9.67000 -62.78000 -0.43000 73.25000 -82.19000 13.51000 31.21000 81.18000 0.00000 0.00000 0.00000 2.81000 15.31000 0.00000 -1.59000 0.00000 -0.16000 0.00000 0.00000 64.00000