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-4_1.PDB 2.47881 -6.69000 -2.26000 -2.16000 -7.74000 -1.18000 7.97000 -10.21000 1.59000 4.99000 3.38000 0.00000 0.00000 0.00000 0.15000 0.43000 0.00000 -0.34000 0.00000 -0.89000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_2.PDB 2.60196 -8.01000 -2.20000 -2.10000 -7.80000 -1.46000 7.98000 -10.40000 0.60000 5.42000 3.25000 0.00000 0.00000 0.00000 0.27000 0.44000 0.00000 -0.31000 0.00000 -1.25000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_3.PDB 2.54581 -7.64000 -2.93000 -3.60000 -8.01000 -1.54000 9.83000 -10.32000 1.53000 5.96000 2.63000 0.00000 0.00000 0.00000 0.19000 0.43000 0.00000 -0.12000 0.00000 -1.27000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_4.PDB 2.29920 -6.60000 -2.88000 -3.47000 -8.17000 -1.76000 9.89000 -10.65000 2.84000 6.14000 2.86000 0.00000 0.00000 0.00000 0.12000 0.45000 0.00000 -0.05000 0.00000 -1.50000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_5.PDB 2.39202 -7.70000 -2.17000 -2.70000 -7.68000 -1.51000 9.13000 -10.52000 0.81000 5.10000 3.13000 0.00000 0.00000 0.00000 0.19000 0.45000 0.00000 -0.53000 0.00000 -0.96000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_6.PDB 2.36167 -7.69000 -2.22000 -3.80000 -8.07000 -1.24000 9.12000 -11.24000 1.13000 6.52000 3.41000 0.00000 0.00000 0.00000 0.14000 0.44000 0.00000 -0.36000 0.00000 -1.08000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_7.PDB 2.52987 -7.44000 -2.21000 -2.45000 -7.97000 -1.50000 8.52000 -10.48000 0.99000 5.37000 3.61000 0.00000 0.00000 0.00000 0.26000 0.45000 0.00000 -0.48000 0.00000 -1.10000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_8.PDB 2.07272 -7.07000 -2.24000 -2.21000 -7.92000 -1.41000 8.01000 -10.61000 2.94000 5.49000 2.34000 0.00000 0.00000 0.00000 0.11000 0.42000 0.00000 -0.37000 0.00000 -1.19000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_9.PDB 2.10783 -6.30000 -2.19000 -2.17000 -7.52000 -1.66000 8.39000 -9.42000 1.29000 5.51000 2.96000 0.00000 0.00000 0.00000 0.19000 0.44000 0.00000 -0.23000 0.00000 -1.45000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_10.PDB 2.65385 -7.14000 -2.27000 -2.16000 -8.02000 -1.19000 8.45000 -10.53000 0.54000 5.23000 3.79000 0.00000 0.00000 0.00000 0.29000 0.33000 0.00000 -0.27000 0.00000 -1.00000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_11.PDB 2.53863 -7.72000 -3.08000 -4.48000 -7.88000 -1.83000 11.00000 -10.53000 0.46000 6.11000 3.68000 0.00000 0.00000 0.00000 0.21000 0.45000 0.00000 -0.13000 0.00000 -1.25000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_12.PDB 2.77532 -7.92000 -2.27000 -2.21000 -7.60000 -1.20000 7.91000 -9.96000 0.69000 5.19000 2.92000 0.00000 0.00000 0.00000 0.11000 0.42000 0.00000 -0.46000 0.00000 -1.04000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_13.PDB 2.49148 -7.01000 -2.19000 -2.07000 -7.90000 -1.06000 7.90000 -10.69000 2.04000 5.21000 2.81000 0.00000 0.00000 0.00000 0.22000 0.43000 0.00000 -0.36000 0.00000 -0.94000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_14.PDB 2.33806 -6.84000 -1.36000 -1.25000 -7.07000 -0.85000 6.70000 -9.77000 0.62000 4.15000 2.99000 0.00000 0.00000 0.00000 0.12000 0.36000 0.00000 -0.27000 0.00000 -0.84000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_15.PDB 2.40397 -10.53000 -3.93000 -3.85000 -8.65000 -2.02000 9.78000 -10.78000 1.01000 7.33000 2.97000 0.00000 0.00000 0.00000 0.19000 0.49000 0.00000 -0.87000 0.00000 -1.71000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_16.PDB 2.32119 -7.34000 -2.76000 -2.79000 -7.46000 -1.67000 8.76000 -9.41000 1.32000 4.90000 3.15000 0.00000 0.00000 0.00000 0.11000 0.30000 0.00000 -0.23000 0.00000 -1.25000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_17.PDB 2.32467 -6.56000 -2.21000 -2.10000 -8.25000 -1.45000 8.46000 -11.11000 2.58000 5.77000 3.33000 0.00000 0.00000 0.00000 0.10000 0.44000 0.00000 -0.37000 0.00000 -1.30000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_18.PDB 3.40549 -7.99000 -2.94000 -4.66000 -8.13000 -2.27000 11.21000 -10.82000 0.53000 6.84000 3.55000 0.00000 0.00000 0.00000 0.31000 0.44000 0.00000 0.01000 0.00000 -1.63000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_19.PDB 2.24495 -7.17000 -1.36000 -1.25000 -7.98000 -1.26000 7.97000 -10.71000 1.19000 4.94000 2.44000 0.00000 0.00000 0.00000 0.13000 0.44000 0.00000 -0.20000 0.00000 -1.09000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_20.PDB 2.03396 -7.84000 -2.13000 -2.22000 -7.97000 -1.48000 8.09000 -10.66000 1.34000 6.02000 3.09000 0.00000 0.00000 0.00000 0.06000 0.41000 0.00000 -0.62000 0.00000 -1.35000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_21.PDB 2.39013 -8.45000 -2.26000 -2.16000 -7.85000 -1.53000 7.92000 -10.55000 0.66000 5.59000 3.31000 0.00000 0.00000 0.00000 0.12000 0.41000 0.00000 -0.43000 0.00000 -1.27000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_22.PDB 2.36568 -7.25000 -2.96000 -3.63000 -8.08000 -1.61000 10.11000 -10.16000 0.78000 6.00000 3.32000 0.00000 0.00000 0.00000 0.23000 0.44000 0.00000 0.01000 0.00000 -1.27000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_23.PDB 2.18387 -6.58000 -3.15000 -3.05000 -7.77000 -2.06000 10.29000 -9.18000 1.30000 5.77000 3.01000 0.00000 0.00000 0.00000 0.19000 0.43000 0.00000 -0.28000 0.00000 -1.64000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_24.PDB 2.45485 -6.07000 -2.19000 -3.17000 -8.23000 -2.02000 10.16000 -10.54000 2.25000 6.28000 2.97000 0.00000 0.00000 0.00000 0.20000 0.49000 0.00000 -0.16000 0.00000 -1.62000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_25.PDB 2.44429 -7.02000 -3.12000 -3.04000 -8.07000 -1.60000 9.64000 -10.31000 1.50000 6.04000 3.41000 0.00000 0.00000 0.00000 0.20000 0.44000 0.00000 -0.41000 0.00000 -1.27000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_26.PDB 2.74417 -8.29000 -3.53000 -3.48000 -8.08000 -1.53000 9.79000 -10.52000 1.04000 6.18000 3.24000 0.00000 0.00000 0.00000 0.20000 0.43000 0.00000 -0.31000 0.00000 -1.29000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_27.PDB 2.78919 -7.10000 -2.23000 -2.84000 -7.37000 -1.32000 8.68000 -9.81000 0.58000 5.20000 3.25000 0.00000 0.00000 0.00000 0.17000 0.37000 0.00000 -0.10000 0.00000 -1.31000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_28.PDB 2.48471 -9.11000 -1.40000 -3.54000 -7.80000 -2.32000 8.38000 -9.85000 0.41000 5.74000 2.76000 0.00000 0.00000 0.00000 0.23000 0.50000 0.00000 -0.42000 0.00000 -1.29000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_29.PDB 2.52428 -8.90000 -3.09000 -3.74000 -8.25000 -1.67000 10.21000 -10.39000 0.73000 6.26000 2.60000 0.00000 0.00000 0.00000 0.19000 0.46000 0.00000 -0.32000 0.00000 -1.42000 0.00000 2.38000 67.00000 PIN3_1YNZ-4_30.PDB 2.34720 -7.32000 -2.91000 -3.59000 -8.22000 -1.90000 10.21000 -10.34000 1.80000 5.99000 3.18000 0.00000 0.00000 0.00000 0.14000 0.44000 0.00000 -0.12000 0.00000 -1.58000 0.00000 2.38000 67.00000