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-17_1.PDB 3.29920 -13.47000 -1.11000 -2.41000 -11.15000 -1.61000 9.81000 -14.87000 1.24000 5.03000 3.36000 0.00000 0.00000 0.00000 0.34000 0.74000 0.00000 -0.84000 0.00000 -1.25000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_2.PDB 3.37157 -12.86000 -0.92000 -1.85000 -10.97000 -1.14000 9.02000 -14.99000 1.82000 5.09000 3.17000 0.00000 0.00000 0.00000 0.13000 0.69000 0.00000 -0.95000 0.00000 -1.26000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_3.PDB 3.44069 -11.19000 -0.97000 -3.12000 -9.70000 -0.60000 8.82000 -12.78000 1.20000 4.18000 2.96000 0.00000 0.00000 0.00000 0.13000 0.49000 0.00000 -0.65000 0.00000 -0.65000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_4.PDB 3.23803 -12.61000 -1.03000 -1.93000 -10.72000 -1.10000 8.96000 -14.67000 1.21000 4.95000 3.29000 0.00000 0.00000 0.00000 0.15000 0.61000 0.00000 -0.64000 0.00000 -1.07000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_5.PDB 3.36179 -13.65000 -0.92000 -1.96000 -10.84000 -1.22000 8.86000 -14.93000 1.28000 4.72000 3.47000 0.00000 0.00000 0.00000 0.17000 0.65000 0.00000 -1.00000 0.00000 -1.28000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_6.PDB 3.26670 -12.88000 -0.92000 -1.81000 -9.70000 -1.66000 8.68000 -13.04000 1.00000 4.52000 2.15000 0.00000 0.00000 0.00000 0.16000 0.49000 0.00000 -0.60000 0.00000 -1.67000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_7.PDB 2.80890 -12.30000 -0.94000 -1.92000 -10.38000 -0.66000 8.28000 -14.54000 1.34000 4.72000 3.08000 0.00000 0.00000 0.00000 0.15000 0.59000 0.00000 -0.64000 0.00000 -0.79000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_8.PDB 3.89334 -11.22000 -0.98000 -1.99000 -9.90000 -1.13000 8.74000 -13.14000 2.12000 3.76000 2.96000 0.00000 0.00000 0.00000 0.12000 0.56000 0.00000 -0.81000 0.00000 -0.98000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_9.PDB 3.28676 -12.73000 -1.04000 -2.02000 -10.70000 -1.14000 8.67000 -14.79000 1.90000 5.19000 3.13000 0.00000 0.00000 0.00000 0.13000 0.64000 0.00000 -0.73000 0.00000 -1.32000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_10.PDB 3.07032 -11.31000 -0.90000 -1.90000 -11.05000 -1.25000 9.47000 -14.85000 2.52000 4.68000 3.68000 0.00000 0.00000 0.00000 0.17000 0.73000 0.00000 -0.83000 0.00000 -1.04000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_11.PDB 3.14309 -12.26000 -1.06000 -2.06000 -9.84000 -1.26000 8.24000 -13.31000 1.83000 4.52000 2.59000 0.00000 0.00000 0.00000 0.18000 0.44000 0.00000 -0.64000 0.00000 -1.45000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_12.PDB 3.08993 -11.50000 -1.01000 -1.90000 -9.46000 -0.93000 8.21000 -12.85000 1.56000 3.97000 2.13000 0.00000 0.00000 0.00000 0.16000 0.47000 0.00000 -0.42000 0.00000 -0.96000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_13.PDB 3.48662 -11.55000 -0.93000 -1.93000 -11.24000 -0.76000 9.60000 -15.40000 2.04000 5.37000 3.09000 0.00000 0.00000 0.00000 0.06000 0.68000 0.00000 -0.58000 0.00000 -0.87000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_14.PDB 2.89644 -13.13000 -1.00000 -1.99000 -10.78000 -1.06000 8.79000 -14.93000 1.33000 5.03000 3.21000 0.00000 0.00000 0.00000 0.14000 0.66000 0.00000 -0.70000 0.00000 -1.17000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_15.PDB 3.99920 -13.04000 -1.07000 -1.93000 -10.63000 -1.35000 8.71000 -14.77000 1.74000 5.18000 3.08000 0.00000 0.00000 0.00000 0.14000 0.66000 0.00000 -0.66000 0.00000 -1.48000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_16.PDB 2.94697 -11.56000 -1.08000 -2.02000 -9.82000 -1.66000 8.79000 -13.17000 2.56000 4.80000 2.16000 0.00000 0.00000 0.00000 0.22000 0.62000 0.00000 -0.62000 0.00000 -1.71000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_17.PDB 3.11854 -13.02000 -1.02000 -2.05000 -10.48000 -1.06000 8.45000 -14.51000 1.21000 4.84000 3.54000 0.00000 0.00000 0.00000 0.11000 0.58000 0.00000 -0.76000 0.00000 -1.28000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_18.PDB 3.30908 -10.52000 -1.08000 -3.35000 -10.24000 -1.37000 9.81000 -13.09000 2.99000 4.25000 3.37000 0.00000 0.00000 0.00000 0.14000 0.56000 0.00000 -0.86000 0.00000 -1.09000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_19.PDB 3.25550 -12.42000 -1.00000 -1.83000 -9.61000 -1.43000 8.18000 -12.85000 1.59000 4.05000 2.04000 0.00000 0.00000 0.00000 0.24000 0.55000 0.00000 -0.55000 0.00000 -1.24000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_20.PDB 3.16309 -12.19000 -0.98000 -1.87000 -9.85000 -1.30000 8.30000 -13.36000 1.77000 4.34000 2.66000 0.00000 0.00000 0.00000 0.19000 0.43000 0.00000 -0.65000 0.00000 -1.45000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_21.PDB 3.36543 -13.15000 -1.04000 -4.10000 -10.54000 -1.58000 9.80000 -13.77000 1.19000 5.73000 2.86000 0.00000 0.00000 0.00000 0.22000 0.68000 0.00000 -0.43000 0.00000 -1.50000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_22.PDB 4.35913 -12.54000 -1.10000 -1.93000 -11.55000 -1.56000 10.12000 -15.43000 2.03000 5.34000 3.17000 0.00000 0.00000 0.00000 0.29000 0.92000 0.00000 -0.57000 0.00000 -1.34000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_23.PDB 4.41017 -10.82000 -0.97000 -1.91000 -10.61000 -0.58000 8.91000 -14.56000 1.95000 4.78000 3.42000 0.00000 0.00000 0.00000 0.19000 0.70000 0.00000 -0.71000 0.00000 -0.73000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_24.PDB 3.11259 -12.67000 -0.95000 -3.12000 -9.73000 -1.19000 8.52000 -13.12000 1.32000 4.76000 2.84000 0.00000 0.00000 0.00000 0.12000 0.53000 0.00000 -0.72000 0.00000 -1.39000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_25.PDB 3.94272 -11.71000 -1.03000 -2.00000 -10.34000 -0.46000 8.04000 -14.62000 1.95000 4.49000 3.45000 0.00000 0.00000 0.00000 0.18000 0.51000 0.00000 -0.67000 0.00000 -0.70000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_26.PDB 3.68852 -13.94000 -1.09000 -2.32000 -11.25000 -1.76000 9.75000 -15.02000 1.19000 5.18000 3.28000 0.00000 0.00000 0.00000 0.47000 0.76000 0.00000 -0.96000 0.00000 -1.40000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_27.PDB 4.15010 -12.08000 -0.88000 -1.83000 -10.94000 -0.50000 8.53000 -15.38000 1.68000 4.88000 3.24000 0.00000 0.00000 0.00000 0.16000 0.66000 0.00000 -0.55000 0.00000 -0.49000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_28.PDB 3.90529 -12.78000 -1.11000 -2.05000 -11.21000 -1.75000 9.87000 -15.06000 1.72000 5.34000 3.26000 0.00000 0.00000 0.00000 0.22000 0.84000 0.00000 -0.55000 0.00000 -1.45000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_29.PDB 3.92065 -13.00000 -1.03000 -2.34000 -11.62000 -2.11000 10.88000 -15.27000 1.66000 5.59000 3.52000 0.00000 0.00000 0.00000 0.21000 0.82000 0.00000 -0.77000 0.00000 -1.73000 0.00000 2.38000 71.00000 PEX13_1N5Z-17_30.PDB 2.85338 -12.43000 -1.10000 -2.02000 -10.94000 -1.58000 9.27000 -14.87000 2.16000 5.09000 3.54000 0.00000 0.00000 0.00000 0.13000 0.79000 0.00000 -0.59000 0.00000 -1.53000 0.00000 2.38000 71.00000