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_1N5Z-19_1.PDB 3.01386 -9.96000 -0.72000 -1.52000 -10.83000 -1.74000 10.57000 -14.55000 2.21000 5.96000 3.25000 0.00000 0.00000 0.00000 0.05000 0.44000 0.00000 -0.82000 0.00000 -1.81000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_2.PDB 4.01892 -8.91000 -1.17000 -2.14000 -10.75000 -0.92000 9.83000 -15.12000 2.91000 5.27000 4.86000 0.00000 0.00000 0.00000 0.36000 0.45000 0.00000 -0.95000 0.00000 -1.10000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_3.PDB 3.24351 -9.29000 -0.96000 -1.98000 -9.94000 -1.64000 9.57000 -13.73000 2.20000 5.60000 4.40000 0.00000 0.00000 0.00000 0.06000 0.28000 0.00000 -1.01000 0.00000 -1.86000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_4.PDB 3.37969 -8.70000 -0.83000 -1.83000 -9.92000 -1.22000 9.63000 -13.55000 2.19000 5.34000 3.01000 0.00000 0.00000 0.00000 0.62000 0.39000 0.00000 -0.71000 0.00000 -1.43000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_5.PDB 3.89030 -9.79000 -0.97000 -1.93000 -10.58000 -1.20000 10.14000 -14.59000 1.90000 5.46000 3.44000 0.00000 0.00000 0.00000 0.70000 0.40000 0.00000 -0.68000 0.00000 -1.46000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_6.PDB 3.62235 -9.27000 -0.93000 -1.94000 -10.37000 -1.47000 10.16000 -14.20000 1.68000 5.50000 4.28000 0.00000 0.00000 0.00000 0.50000 0.39000 0.00000 -0.82000 0.00000 -1.68000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_7.PDB 3.11456 -8.22000 -0.71000 -1.65000 -9.99000 -1.38000 9.90000 -13.42000 2.99000 5.08000 3.23000 0.00000 0.00000 0.00000 0.11000 0.49000 0.00000 -0.79000 0.00000 -1.60000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_8.PDB 3.63306 -9.50000 -0.99000 -1.97000 -10.64000 -1.16000 10.55000 -14.52000 1.91000 5.52000 3.15000 0.00000 0.00000 0.00000 0.70000 0.47000 0.00000 -0.71000 0.00000 -1.34000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_9.PDB 3.57456 -8.28000 -0.79000 -1.76000 -10.38000 -0.97000 9.73000 -14.37000 1.88000 5.66000 3.95000 0.00000 0.00000 0.00000 0.53000 0.47000 0.00000 -0.60000 0.00000 -1.16000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_10.PDB 3.81005 -9.41000 -0.96000 -2.21000 -10.62000 -1.07000 9.58000 -14.80000 1.81000 5.96000 4.35000 0.00000 0.00000 0.00000 0.61000 0.44000 0.00000 -0.81000 0.00000 -1.27000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_11.PDB 3.15494 -10.08000 -0.97000 -1.87000 -10.28000 -2.22000 10.62000 -13.69000 2.21000 5.73000 3.56000 0.00000 0.00000 0.00000 0.05000 0.36000 0.00000 -1.00000 0.00000 -2.23000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_12.PDB 4.23925 -10.10000 -0.93000 -2.56000 -10.46000 -1.58000 10.78000 -13.89000 0.97000 5.90000 3.53000 0.00000 0.00000 0.00000 0.58000 0.53000 0.00000 -0.81000 0.00000 -1.62000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_13.PDB 3.04266 -9.33000 -0.76000 -1.54000 -10.90000 -1.09000 10.24000 -15.07000 3.01000 5.43000 3.09000 0.00000 0.00000 0.00000 0.09000 0.52000 0.00000 -0.70000 0.00000 -1.13000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_14.PDB 3.08037 -10.62000 -1.71000 -2.66000 -10.35000 -1.73000 10.66000 -13.83000 2.32000 6.21000 4.05000 0.00000 0.00000 0.00000 0.09000 0.40000 0.00000 -1.83000 0.00000 -1.83000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_15.PDB 3.26138 -9.63000 -0.70000 -1.59000 -10.95000 -1.81000 10.88000 -14.68000 2.85000 5.95000 2.90000 0.00000 0.00000 0.00000 0.10000 0.55000 0.00000 -0.81000 0.00000 -1.76000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_16.PDB 3.61368 -5.39000 -0.95000 -2.00000 -10.72000 -1.59000 10.76000 -13.97000 5.18000 5.79000 4.46000 0.00000 0.00000 0.00000 0.40000 0.58000 0.00000 -0.98000 0.00000 -1.77000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_17.PDB 2.98283 -8.84000 -0.96000 -1.86000 -9.28000 -1.34000 8.94000 -13.10000 2.27000 4.95000 3.69000 0.00000 0.00000 0.00000 0.07000 0.19000 0.00000 -0.69000 0.00000 -1.55000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_18.PDB 3.07842 -9.85000 -0.75000 -1.78000 -10.74000 -0.77000 9.68000 -14.98000 2.40000 5.53000 3.34000 0.00000 0.00000 0.00000 0.09000 0.55000 0.00000 -0.98000 0.00000 -0.89000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_19.PDB 3.37986 -8.96000 -0.73000 -1.76000 -9.79000 -1.02000 9.48000 -13.54000 2.07000 5.26000 3.25000 0.00000 0.00000 0.00000 0.05000 0.36000 0.00000 -0.98000 0.00000 -1.26000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_20.PDB 3.26731 -10.43000 -0.79000 -1.74000 -11.07000 -1.97000 11.08000 -14.75000 2.33000 6.25000 2.97000 0.00000 0.00000 0.00000 0.12000 0.57000 0.00000 -0.87000 0.00000 -1.98000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_21.PDB 3.15717 -7.16000 -0.65000 -1.69000 -10.39000 -1.54000 10.17000 -13.70000 3.83000 5.35000 4.03000 0.00000 0.00000 0.00000 0.03000 0.43000 0.00000 -0.83000 0.00000 -1.75000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_22.PDB 3.28833 -9.94000 -0.99000 -1.99000 -9.98000 -1.36000 9.47000 -14.09000 1.97000 5.17000 3.61000 0.00000 0.00000 0.00000 0.61000 0.28000 0.00000 -0.79000 0.00000 -1.56000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_23.PDB 3.47003 -10.21000 -0.69000 -2.46000 -10.54000 -1.64000 10.84000 -14.08000 1.75000 6.04000 3.18000 0.00000 0.00000 0.00000 0.11000 0.50000 0.00000 -1.06000 0.00000 -1.66000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_24.PDB 3.81218 -9.07000 -0.83000 -1.81000 -10.34000 -1.07000 9.82000 -14.35000 2.15000 5.33000 3.32000 0.00000 0.00000 0.00000 0.62000 0.46000 0.00000 -0.66000 0.00000 -1.25000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_25.PDB 3.14878 -8.98000 -0.93000 -1.92000 -9.85000 -2.15000 10.13000 -13.14000 1.76000 5.79000 4.51000 0.00000 0.00000 0.00000 0.06000 0.33000 0.00000 -0.97000 0.00000 -2.26000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_26.PDB 3.45358 -5.03000 -0.71000 -1.72000 -10.27000 -0.97000 9.73000 -13.90000 4.75000 5.40000 4.38000 0.00000 0.00000 0.00000 0.33000 0.49000 0.00000 -0.84000 0.00000 -1.22000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_27.PDB 3.81126 -8.95000 -0.99000 -2.00000 -9.83000 -1.45000 9.54000 -13.69000 2.81000 4.90000 3.44000 0.00000 0.00000 0.00000 0.67000 0.36000 0.00000 -0.77000 0.00000 -1.60000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_28.PDB 2.93177 -9.05000 -0.68000 -1.65000 -10.60000 -1.47000 10.08000 -14.63000 2.41000 6.13000 3.97000 0.00000 0.00000 0.00000 0.06000 0.55000 0.00000 -0.96000 0.00000 -1.70000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_29.PDB 2.98614 -9.11000 -0.98000 -1.93000 -9.58000 -1.12000 9.23000 -13.60000 2.13000 5.06000 3.64000 0.00000 0.00000 0.00000 0.08000 0.18000 0.00000 -0.72000 0.00000 -1.31000 0.00000 2.38000 71.00000 PEX13_1N5Z-19_30.PDB 2.93322 -9.61000 -0.93000 -1.92000 -9.82000 -1.02000 9.05000 -14.00000 2.59000 4.91000 3.78000 0.00000 0.00000 0.00000 0.07000 0.22000 0.00000 -1.09000 0.00000 -1.22000 0.00000 2.38000 71.00000