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-8_1.PDB 3.71807 -11.99000 -1.33000 -2.58000 -9.77000 -2.00000 7.92000 -13.01000 0.85000 4.92000 3.53000 0.00000 0.00000 0.00000 0.91000 0.55000 0.00000 -0.23000 0.00000 -1.19000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_2.PDB 4.36086 -12.06000 -1.43000 -2.28000 -10.42000 -2.82000 9.25000 -13.40000 1.49000 5.03000 3.95000 0.00000 0.00000 0.00000 0.84000 0.73000 0.00000 -0.93000 0.00000 -1.35000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_3.PDB 4.14232 -13.12000 -2.74000 -2.71000 -10.68000 -1.43000 9.54000 -13.79000 1.31000 5.18000 3.60000 0.00000 0.00000 0.00000 0.75000 0.66000 0.00000 -1.14000 0.00000 -1.00000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_4.PDB 3.12312 -10.50000 -1.37000 -2.14000 -8.22000 -1.25000 6.60000 -10.99000 0.55000 3.87000 3.04000 0.00000 0.00000 0.00000 0.36000 0.46000 0.00000 -0.17000 0.00000 -0.79000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_5.PDB 3.86700 -8.74000 -1.25000 -2.68000 -9.78000 -1.95000 9.45000 -12.16000 1.49000 4.97000 4.07000 0.00000 0.00000 0.00000 0.95000 0.38000 0.00000 -0.69000 0.00000 -1.15000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_6.PDB 3.88228 -11.92000 -1.37000 -2.60000 -9.77000 -2.02000 8.19000 -12.84000 0.45000 4.92000 3.88000 0.00000 0.00000 0.00000 0.79000 0.54000 0.00000 -0.34000 0.00000 -1.22000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_7.PDB 4.24299 -11.07000 -1.34000 -2.14000 -10.51000 -1.91000 9.28000 -13.57000 1.28000 4.90000 3.89000 0.00000 0.00000 0.00000 0.83000 0.76000 0.00000 -0.77000 0.00000 -1.01000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_8.PDB 3.26487 -7.96000 -1.29000 -4.16000 -8.39000 -1.91000 8.47000 -10.21000 2.51000 5.39000 3.00000 0.00000 0.00000 0.00000 0.39000 0.36000 0.00000 -0.60000 0.00000 -1.15000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_9.PDB 4.47279 -9.39000 -1.36000 -2.77000 -9.86000 -1.94000 9.55000 -12.25000 1.07000 5.42000 3.81000 0.00000 0.00000 0.00000 0.55000 0.46000 0.00000 -0.50000 0.00000 -1.10000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_10.PDB 3.88846 -11.99000 -2.57000 -2.62000 -10.07000 -0.65000 8.67000 -13.13000 0.59000 4.51000 3.79000 0.00000 0.00000 0.00000 0.51000 0.60000 0.00000 -0.61000 0.00000 -0.41000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_11.PDB 4.00452 -12.08000 -2.10000 -2.09000 -9.85000 -1.92000 8.53000 -12.62000 0.85000 4.81000 3.51000 0.00000 0.00000 0.00000 0.87000 0.59000 0.00000 -0.86000 0.00000 -1.22000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_12.PDB 4.00041 -12.05000 -2.64000 -2.63000 -10.57000 -1.17000 9.39000 -13.59000 1.53000 4.99000 3.67000 0.00000 0.00000 0.00000 0.48000 0.69000 0.00000 -0.80000 0.00000 -0.71000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_13.PDB 4.69169 -13.00000 -2.63000 -2.63000 -10.74000 -1.52000 9.93000 -13.73000 0.44000 5.16000 3.62000 0.00000 0.00000 0.00000 1.22000 0.58000 0.00000 -1.12000 0.00000 -0.99000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_14.PDB 3.85916 -12.10000 -2.63000 -2.64000 -10.03000 -0.96000 8.78000 -12.97000 0.81000 4.46000 3.58000 0.00000 0.00000 0.00000 0.67000 0.59000 0.00000 -0.37000 0.00000 -0.79000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_15.PDB 3.20093 -11.09000 -2.64000 -2.68000 -9.15000 -1.56000 8.58000 -11.64000 1.66000 4.77000 3.39000 0.00000 0.00000 0.00000 0.27000 0.61000 0.00000 -0.99000 0.00000 -1.10000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_16.PDB 3.76259 -13.48000 -2.55000 -2.51000 -10.77000 -1.27000 9.13000 -14.01000 1.33000 4.56000 2.99000 0.00000 0.00000 0.00000 0.89000 0.60000 0.00000 -0.35000 0.00000 -0.92000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_17.PDB 4.70771 -12.85000 -2.62000 -2.69000 -10.48000 -1.48000 9.64000 -13.46000 0.51000 5.07000 3.66000 0.00000 0.00000 0.00000 1.08000 0.57000 0.00000 -1.02000 0.00000 -1.08000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_18.PDB 3.81595 -12.07000 -2.69000 -2.68000 -10.70000 -1.49000 9.84000 -13.65000 1.59000 5.32000 4.08000 0.00000 0.00000 0.00000 0.46000 0.73000 0.00000 -1.15000 0.00000 -0.99000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_19.PDB 3.50990 -8.34000 -1.35000 -2.55000 -8.31000 -1.96000 8.37000 -10.16000 0.75000 4.78000 3.54000 0.00000 0.00000 0.00000 0.29000 0.37000 0.00000 -0.58000 0.00000 -1.16000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_20.PDB 4.12498 -10.86000 -2.60000 -4.21000 -10.68000 -1.51000 11.02000 -12.78000 2.62000 4.89000 3.69000 0.00000 0.00000 0.00000 1.01000 0.46000 0.00000 -1.28000 0.00000 -1.03000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_21.PDB 3.19595 -11.48000 -1.31000 -1.28000 -8.31000 -0.87000 6.28000 -11.42000 0.27000 3.24000 2.55000 0.00000 0.00000 0.00000 0.43000 0.47000 0.00000 -0.23000 0.00000 -0.83000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_22.PDB 4.30095 -9.89000 -2.66000 -4.26000 -10.54000 -1.39000 10.66000 -12.74000 3.57000 4.80000 3.72000 0.00000 0.00000 0.00000 0.87000 0.48000 0.00000 -0.81000 0.00000 -1.13000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_23.PDB 4.22431 -12.41000 -2.67000 -2.68000 -10.28000 -1.26000 9.28000 -13.06000 0.78000 4.88000 3.86000 0.00000 0.00000 0.00000 0.48000 0.59000 0.00000 -0.77000 0.00000 -0.97000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_24.PDB 4.35275 -13.34000 -2.62000 -2.64000 -10.96000 -1.56000 10.04000 -14.06000 1.99000 5.12000 2.84000 0.00000 0.00000 0.00000 0.74000 0.66000 0.00000 -1.01000 0.00000 -1.21000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_25.PDB 3.29733 -9.60000 -1.40000 -2.18000 -8.34000 -1.33000 7.27000 -11.02000 1.19000 4.24000 3.07000 0.00000 0.00000 0.00000 0.19000 0.51000 0.00000 -0.37000 0.00000 -0.91000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_26.PDB 4.47192 -10.76000 -2.63000 -4.22000 -10.36000 -1.52000 10.51000 -12.50000 2.68000 4.77000 3.64000 0.00000 0.00000 0.00000 0.91000 0.45000 0.00000 -0.95000 0.00000 -1.10000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_27.PDB 4.28171 -13.65000 -2.62000 -2.61000 -10.40000 -1.54000 9.14000 -13.37000 0.44000 4.85000 3.54000 0.00000 0.00000 0.00000 0.51000 0.58000 0.00000 -0.57000 0.00000 -1.02000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_28.PDB 4.05400 -12.98000 -2.70000 -2.69000 -10.70000 -1.49000 9.79000 -13.72000 1.56000 5.14000 3.11000 0.00000 0.00000 0.00000 0.42000 0.64000 0.00000 -0.64000 0.00000 -1.07000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_29.PDB 3.53194 -10.25000 -2.58000 -3.38000 -9.38000 -1.33000 8.69000 -12.03000 2.03000 5.16000 4.27000 0.00000 0.00000 0.00000 0.70000 0.53000 0.00000 -1.24000 0.00000 -1.18000 0.00000 2.38000 70.00000 PEX13_1N5Z-8_30.PDB 4.09790 -9.00000 -2.53000 -4.14000 -10.43000 -1.40000 10.88000 -12.53000 3.79000 4.86000 4.13000 0.00000 0.00000 0.00000 0.59000 0.43000 0.00000 -1.18000 0.00000 -1.04000 0.00000 2.38000 70.00000