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 PEX13_1JQQ-19_1.PDB 4.31031 -10.22000 -1.42000 -3.31000 -10.52000 -2.69000 13.00000 -13.27000 0.84000 7.00000 3.78000 0.00000 0.00000 0.00000 0.14000 0.86000 0.00000 -1.24000 0.00000 -2.54000 0.00000 2.38000 71.00000 PEX13_1JQQ-19_2.PDB 3.86963 -8.38000 -1.56000 -3.69000 -10.97000 -2.36000 13.13000 -14.03000 3.12000 7.06000 3.93000 0.00000 0.00000 0.00000 0.33000 0.80000 0.00000 -0.90000 0.00000 -2.43000 0.00000 2.38000 71.00000 PEX13_1JQQ-19_3.PDB 3.80544 -8.70000 -0.81000 -3.95000 -10.68000 -2.23000 11.92000 -13.73000 3.33000 6.79000 3.51000 0.00000 0.00000 0.00000 0.31000 0.40000 0.00000 -0.87000 0.00000 -2.29000 0.00000 2.38000 71.00000 PEX13_1JQQ-19_4.PDB 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0.37000 0.00000 -1.13000 0.00000 -2.11000 0.00000 2.38000 71.00000 PEX13_1JQQ-19_9.PDB 3.85339 -11.15000 -1.65000 -4.64000 -10.66000 -3.04000 14.11000 -12.99000 0.58000 7.41000 3.17000 0.00000 0.00000 0.00000 0.10000 0.64000 0.00000 -0.79000 0.00000 -2.75000 0.00000 2.38000 71.00000 PEX13_1JQQ-19_10.PDB 4.03972 -10.12000 -1.61000 -5.40000 -11.59000 -2.59000 14.70000 -14.30000 3.00000 7.83000 3.06000 0.00000 0.00000 0.00000 0.27000 0.66000 0.00000 -0.97000 0.00000 -2.52000 0.00000 2.38000 71.00000 PEX13_1JQQ-19_11.PDB 5.29821 -8.33000 -0.81000 -3.07000 -9.96000 -2.16000 11.86000 -12.37000 0.73000 6.48000 3.48000 0.00000 0.00000 0.00000 0.57000 0.51000 0.00000 -0.89000 0.00000 -2.19000 0.00000 2.38000 71.00000 PEX13_1JQQ-19_12.PDB 4.20495 -11.17000 -1.59000 -5.30000 -10.99000 -1.93000 12.62000 -13.95000 1.01000 7.83000 3.92000 0.00000 0.00000 0.00000 0.17000 0.86000 0.00000 -0.80000 0.00000 -2.17000 0.00000 2.38000 71.00000 PEX13_1JQQ-19_13.PDB 4.08722 -10.57000 -2.52000 -3.28000 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0.51000 7.33000 3.10000 0.00000 0.00000 0.00000 0.14000 0.56000 0.00000 -1.00000 0.00000 -2.54000 0.00000 2.38000 71.00000 PEX13_1JQQ-19_23.PDB 3.19318 -11.54000 -1.14000 -4.48000 -9.94000 -2.05000 12.72000 -12.36000 0.49000 5.35000 2.92000 0.00000 0.00000 0.00000 0.09000 0.45000 0.00000 -1.10000 0.00000 -2.03000 0.00000 2.38000 71.00000 PEX13_1JQQ-19_24.PDB 3.93837 -10.18000 -1.47000 -3.30000 -11.46000 -2.38000 12.59000 -14.68000 3.16000 7.01000 3.20000 0.00000 0.00000 0.00000 0.31000 0.56000 0.00000 -0.87000 0.00000 -2.30000 0.00000 2.38000 71.00000 PEX13_1JQQ-19_25.PDB 3.20466 -11.24000 -1.66000 -3.92000 -10.32000 -1.88000 11.33000 -13.24000 0.70000 6.99000 3.86000 0.00000 0.00000 0.00000 0.08000 0.79000 0.00000 -1.07000 0.00000 -2.10000 0.00000 2.38000 71.00000 PEX13_1JQQ-19_26.PDB 2.84278 -13.19000 -2.53000 -5.21000 -11.63000 -2.72000 13.94000 -14.13000 1.06000 8.17000 3.31000 0.00000 0.00000 0.00000 0.15000 0.59000 0.00000 -0.86000 0.00000 -2.75000 0.00000 2.38000 71.00000 PEX13_1JQQ-19_27.PDB 4.02590 -10.14000 -1.76000 -5.48000 -10.94000 -1.89000 13.20000 -13.70000 2.99000 7.39000 2.78000 0.00000 0.00000 0.00000 0.27000 0.87000 0.00000 -0.98000 0.00000 -2.02000 0.00000 2.38000 71.00000 PEX13_1JQQ-19_28.PDB 4.19672 -6.43000 -1.78000 -2.26000 -11.37000 -2.19000 13.15000 -14.07000 4.16000 7.11000 4.14000 0.00000 0.00000 0.00000 0.48000 0.78000 0.00000 -1.43000 0.00000 -2.37000 0.00000 2.38000 71.00000 PEX13_1JQQ-19_29.PDB 4.02166 -7.70000 -0.80000 -3.50000 -10.55000 -1.96000 11.88000 -13.78000 3.43000 6.52000 3.59000 0.00000 0.00000 0.00000 0.29000 0.44000 0.00000 -0.81000 0.00000 -2.03000 0.00000 2.38000 71.00000 PEX13_1JQQ-19_30.PDB 3.87671 -9.76000 -1.40000 -4.67000 -11.65000 -3.04000 14.51000 -14.73000 3.18000 8.34000 3.28000 0.00000 0.00000 0.00000 0.26000 0.84000 0.00000 -1.09000 0.00000 -2.75000 0.00000 2.38000 71.00000