name Intraclash total energy Backbone Hbond 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_1YNZ-11_1.PDB 2.54543 -5.60000 -2.84000 -5.82000 -9.06000 -1.28000 11.56000 -10.89000 3.41000 7.36000 3.50000 0.00000 0.00000 0.00000 0.26000 0.83000 0.00000 -0.88000 0.00000 -0.94000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_2.PDB 2.26480 -5.60000 -2.31000 -4.67000 -9.05000 -1.20000 9.52000 -10.69000 3.15000 7.23000 3.86000 0.00000 0.00000 0.00000 0.27000 0.94000 0.00000 -0.85000 0.00000 -0.87000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_3.PDB 2.11966 -7.05000 -3.14000 -6.02000 -6.97000 -1.19000 9.92000 -7.97000 0.45000 6.24000 3.35000 0.00000 0.00000 0.00000 0.04000 0.40000 0.00000 -0.78000 0.00000 -0.98000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_4.PDB 2.80978 -6.75000 -3.11000 -5.80000 -6.82000 -1.20000 9.59000 -7.67000 0.99000 6.10000 3.15000 0.00000 0.00000 0.00000 0.02000 0.47000 0.00000 -1.01000 0.00000 -0.99000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_5.PDB 2.23643 -5.32000 -3.16000 -5.39000 -7.64000 -1.24000 9.47000 -9.25000 3.26000 6.97000 3.25000 0.00000 0.00000 0.00000 0.05000 0.60000 0.00000 -0.66000 0.00000 -0.98000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_6.PDB 1.99661 -5.67000 -2.34000 -3.14000 -7.80000 -1.08000 8.13000 -9.51000 3.04000 6.08000 2.79000 0.00000 0.00000 0.00000 0.02000 0.72000 0.00000 -0.96000 0.00000 -0.91000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_7.PDB 2.83617 -4.82000 -1.40000 -3.83000 -8.27000 -1.28000 8.74000 -10.40000 3.20000 6.17000 3.66000 0.00000 0.00000 0.00000 0.32000 0.64000 0.00000 -0.84000 0.00000 -0.90000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_8.PDB 3.31923 -4.77000 -2.24000 -5.00000 -7.60000 -1.28000 9.90000 -9.34000 2.63000 5.69000 3.40000 0.00000 0.00000 0.00000 0.45000 0.61000 0.00000 -0.42000 0.00000 -0.94000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_9.PDB 2.01573 -6.39000 -2.30000 -4.58000 -6.31000 -1.10000 7.56000 -7.46000 0.67000 5.75000 3.34000 0.00000 0.00000 0.00000 0.04000 0.33000 0.00000 -1.04000 0.00000 -0.95000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_10.PDB 2.40618 -5.25000 -3.04000 -5.06000 -8.89000 -2.11000 11.62000 -10.74000 3.97000 6.91000 3.85000 0.00000 0.00000 0.00000 0.25000 0.70000 0.00000 -0.82000 0.00000 -1.19000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_11.PDB 1.80223 -5.88000 -2.32000 -3.15000 -6.39000 -1.13000 7.50000 -7.30000 0.25000 5.66000 2.96000 0.00000 0.00000 0.00000 0.01000 0.49000 0.00000 -1.00000 0.00000 -0.96000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_12.PDB 2.48196 -3.76000 -1.27000 -3.00000 -7.91000 -1.18000 8.34000 -9.75000 3.38000 5.57000 3.31000 0.00000 0.00000 0.00000 0.15000 0.52000 0.00000 -0.52000 0.00000 -0.88000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_13.PDB 2.12358 -6.96000 -3.11000 -5.59000 -6.63000 -1.20000 8.70000 -7.69000 0.85000 6.10000 3.24000 0.00000 0.00000 0.00000 0.03000 0.37000 0.00000 -0.65000 0.00000 -1.01000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_14.PDB 2.07970 -3.44000 -2.34000 -3.02000 -8.85000 -1.06000 8.96000 -11.16000 4.74000 6.96000 3.76000 0.00000 0.00000 0.00000 0.19000 0.86000 0.00000 -0.92000 0.00000 -0.68000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_15.PDB 2.44246 -4.22000 -2.30000 -4.44000 -8.51000 -1.23000 9.90000 -9.91000 3.49000 6.86000 3.66000 0.00000 0.00000 0.00000 0.23000 0.96000 0.00000 -1.08000 0.00000 -0.88000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_16.PDB 2.13865 -7.36000 -3.12000 -5.39000 -7.02000 -1.09000 8.99000 -7.94000 0.94000 6.25000 3.13000 0.00000 0.00000 0.00000 0.02000 0.44000 0.00000 -1.22000 0.00000 -0.91000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_17.PDB 2.29067 -4.45000 -2.32000 -3.10000 -8.66000 -1.25000 8.88000 -10.65000 3.49000 7.00000 3.60000 0.00000 0.00000 0.00000 0.23000 0.93000 0.00000 -0.80000 0.00000 -0.87000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_18.PDB 2.02988 -5.48000 -2.34000 -3.12000 -6.52000 -0.89000 7.18000 -7.92000 0.98000 5.59000 2.96000 0.00000 0.00000 0.00000 0.02000 0.35000 0.00000 -0.70000 0.00000 -0.71000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_19.PDB 2.66090 -4.15000 -3.07000 -5.05000 -9.22000 -3.00000 12.09000 -10.42000 4.19000 8.77000 3.98000 0.00000 0.00000 0.00000 0.27000 0.90000 0.00000 -0.95000 0.00000 -1.72000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_20.PDB 2.03427 -6.08000 -3.10000 -5.88000 -6.57000 -1.20000 10.14000 -7.02000 0.16000 6.14000 3.08000 0.00000 0.00000 0.00000 0.01000 0.45000 0.00000 -0.86000 0.00000 -0.99000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_21.PDB 2.01536 -6.37000 -2.29000 -3.23000 -7.02000 -1.07000 7.65000 -8.28000 0.21000 6.13000 3.16000 0.00000 0.00000 0.00000 0.02000 0.41000 0.00000 -0.75000 0.00000 -0.90000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_22.PDB 2.31248 -5.52000 -2.33000 -5.22000 -9.16000 -2.92000 10.96000 -10.19000 3.26000 8.48000 3.70000 0.00000 0.00000 0.00000 0.22000 0.94000 0.00000 -0.62000 0.00000 -1.70000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_23.PDB 2.15245 -5.30000 -3.18000 -5.30000 -7.94000 -1.28000 9.92000 -9.52000 3.75000 6.93000 3.36000 0.00000 0.00000 0.00000 0.05000 0.67000 0.00000 -1.07000 0.00000 -1.02000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_24.PDB 1.91140 -6.37000 -2.30000 -4.96000 -7.10000 -2.52000 9.28000 -7.56000 0.71000 7.11000 3.24000 0.00000 0.00000 0.00000 0.04000 0.55000 0.00000 -0.79000 0.00000 -1.54000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_25.PDB 2.02612 -8.71000 -2.89000 -6.69000 -7.35000 -2.99000 10.45000 -7.54000 0.21000 7.58000 2.81000 0.00000 0.00000 0.00000 0.04000 0.44000 0.00000 -0.56000 0.00000 -1.80000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_26.PDB 1.95585 -4.63000 -3.15000 -4.59000 -7.92000 -1.27000 9.88000 -9.36000 3.17000 6.85000 3.38000 0.00000 0.00000 0.00000 0.02000 0.82000 0.00000 -0.63000 0.00000 -1.01000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_27.PDB 2.74431 -5.67000 -2.03000 -4.43000 -7.28000 -1.28000 8.56000 -9.22000 2.74000 5.84000 3.05000 0.00000 0.00000 0.00000 0.12000 0.43000 0.00000 -0.62000 0.00000 -1.10000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_28.PDB 2.45457 -6.14000 -1.43000 -4.07000 -8.53000 -1.22000 9.14000 -11.02000 3.46000 6.04000 3.02000 0.00000 0.00000 0.00000 0.35000 0.63000 0.00000 -0.99000 0.00000 -0.88000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_29.PDB 2.05360 -6.22000 -2.21000 -4.43000 -7.22000 -1.26000 8.08000 -9.11000 2.62000 5.91000 3.12000 0.00000 0.00000 0.00000 0.03000 0.45000 0.00000 -0.68000 0.00000 -1.06000 0.00000 2.38000 64.00000 PIN3_1YNZ-11_30.PDB 1.96751 -4.41000 -1.44000 -2.15000 -8.61000 -1.01000 7.93000 -11.15000 4.25000 6.11000 3.01000 0.00000 0.00000 0.00000 0.21000 0.73000 0.00000 -0.87000 0.00000 -0.70000 0.00000 2.38000 64.00000