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-21_1.PDB 4.58386 -7.86000 -2.90000 -5.74000 -7.59000 -2.10000 10.63000 -7.71000 1.97000 6.40000 1.30000 0.00000 0.00000 0.00000 1.30000 0.93000 0.00000 -1.94000 0.00000 -1.48000 0.00000 2.38000 72.00000 PEX13_1JQQ-21_2.PDB 5.58200 -10.18000 -2.33000 -4.91000 -8.15000 -1.85000 10.86000 -8.30000 1.68000 5.13000 0.90000 0.00000 0.00000 0.00000 0.37000 1.04000 0.00000 -2.02000 0.00000 -1.56000 0.00000 2.38000 72.00000 PEX13_1JQQ-21_3.PDB 4.34547 -10.32000 -2.92000 -2.90000 -8.23000 -2.92000 11.01000 -8.93000 0.98000 6.22000 1.09000 0.00000 0.00000 0.00000 0.19000 0.94000 0.00000 -1.50000 0.00000 -2.41000 0.00000 2.38000 72.00000 PEX13_1JQQ-21_4.PDB 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1.19000 6.10000 1.02000 0.00000 0.00000 0.00000 0.16000 1.02000 0.00000 -0.48000 0.00000 -1.82000 0.00000 2.38000 72.00000 PEX13_1JQQ-21_14.PDB 4.20094 -9.62000 -2.31000 -5.33000 -7.29000 -2.03000 9.83000 -7.57000 0.96000 4.63000 0.97000 0.00000 0.00000 0.00000 1.20000 1.16000 0.00000 -1.33000 0.00000 -1.35000 0.00000 2.38000 72.00000 PEX13_1JQQ-21_15.PDB 6.25254 -7.49000 -2.93000 -5.83000 -7.71000 -1.69000 10.70000 -8.05000 2.25000 6.02000 1.39000 0.00000 0.00000 0.00000 1.47000 0.97000 0.00000 -1.84000 0.00000 -1.26000 0.00000 2.38000 72.00000 PEX13_1JQQ-21_16.PDB 4.12326 -8.19000 -3.55000 -3.66000 -7.92000 -1.76000 9.80000 -8.78000 2.16000 5.69000 1.26000 0.00000 0.00000 0.00000 0.94000 1.09000 0.00000 -0.93000 0.00000 -1.45000 0.00000 2.38000 72.00000 PEX13_1JQQ-21_17.PDB 6.29863 -10.04000 -2.27000 -5.46000 -7.74000 -1.56000 10.10000 -8.48000 1.20000 4.20000 1.55000 0.00000 0.00000 0.00000 1.07000 1.11000 0.00000 -1.11000 0.00000 -1.53000 0.00000 2.38000 72.00000 PEX13_1JQQ-21_18.PDB 5.36683 -11.29000 -2.98000 -4.15000 -7.28000 -1.05000 8.22000 -8.60000 0.82000 5.03000 0.75000 0.00000 0.00000 0.00000 0.39000 0.88000 0.00000 -1.47000 0.00000 -0.96000 0.00000 2.38000 72.00000 PEX13_1JQQ-21_19.PDB 6.19228 -10.75000 -3.02000 -3.26000 -7.81000 -2.32000 10.15000 -8.31000 1.33000 4.26000 0.86000 0.00000 0.00000 0.00000 0.33000 0.86000 0.00000 -1.38000 0.00000 -1.59000 0.00000 2.38000 72.00000 PEX13_1JQQ-21_20.PDB 4.29810 -8.74000 -2.78000 -2.90000 -7.89000 -2.54000 9.58000 -8.78000 1.55000 6.56000 1.17000 0.00000 0.00000 0.00000 0.43000 1.05000 0.00000 -0.85000 0.00000 -2.30000 0.00000 2.38000 72.00000 PEX13_1JQQ-21_21.PDB 6.64840 -10.06000 -1.29000 -1.44000 -7.79000 -1.09000 6.75000 -9.64000 1.53000 3.69000 0.79000 0.00000 0.00000 0.00000 0.17000 0.63000 0.00000 -0.72000 0.00000 -1.02000 0.00000 2.38000 72.00000 PEX13_1JQQ-21_22.PDB 5.19332 -10.29000 -3.08000 -3.25000 -8.44000 -1.64000 9.70000 -9.45000 1.37000 4.76000 1.85000 0.00000 0.00000 0.00000 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-1.38000 9.62000 -8.70000 1.69000 4.27000 1.39000 0.00000 0.00000 0.00000 1.18000 0.99000 0.00000 -1.06000 0.00000 -1.14000 0.00000 2.38000 72.00000 PEX13_1JQQ-21_28.PDB 6.42650 -9.83000 -1.34000 -2.69000 -7.92000 -2.61000 9.88000 -7.99000 1.35000 3.78000 0.87000 0.00000 0.00000 0.00000 0.43000 0.70000 0.00000 -1.90000 0.00000 -1.70000 0.00000 2.38000 72.00000 PEX13_1JQQ-21_29.PDB 3.49334 -10.33000 -2.19000 -4.83000 -7.03000 -1.60000 8.43000 -8.23000 0.72000 5.97000 1.04000 0.00000 0.00000 0.00000 0.09000 0.94000 0.00000 -1.22000 0.00000 -1.47000 0.00000 2.38000 72.00000 PEX13_1JQQ-21_30.PDB 5.23527 -10.45000 -1.24000 -2.57000 -7.94000 -0.95000 6.77000 -10.05000 1.96000 3.93000 0.97000 0.00000 0.00000 0.00000 0.22000 0.64000 0.00000 -0.59000 0.00000 -0.95000 0.00000 2.38000 72.00000