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-18_1.PDB 9.25622 -8.91000 -0.36000 -0.40000 -9.39000 -0.13000 6.34000 -13.88000 2.21000 4.21000 3.31000 0.00000 0.00000 0.00000 0.24000 0.72000 0.00000 -0.72000 0.00000 -0.33000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_2.PDB 8.63240 -8.56000 -0.44000 -0.47000 -9.36000 -0.72000 6.59000 -13.74000 3.22000 4.32000 3.39000 0.00000 0.00000 0.00000 0.18000 0.65000 0.00000 -0.56000 0.00000 -0.97000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_3.PDB 9.17227 -8.84000 -0.44000 -0.50000 -9.19000 -0.18000 5.91000 -13.53000 2.55000 4.19000 3.13000 0.00000 0.00000 0.00000 0.14000 0.64000 0.00000 -0.53000 0.00000 -0.39000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_4.PDB 5.94840 -9.08000 -0.44000 -0.48000 -9.46000 -0.13000 6.30000 -13.96000 2.10000 4.26000 3.61000 0.00000 0.00000 0.00000 0.13000 0.74000 0.00000 -0.68000 0.00000 -0.31000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_5.PDB 9.66591 -7.97000 -1.21000 -1.26000 -9.35000 -0.35000 7.28000 -13.34000 2.52000 4.72000 4.13000 0.00000 0.00000 0.00000 0.24000 0.87000 0.00000 -0.80000 0.00000 -0.54000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_6.PDB 8.88406 -8.72000 -0.36000 -1.21000 -9.80000 -0.44000 6.92000 -14.34000 2.76000 5.21000 3.70000 0.00000 0.00000 0.00000 0.25000 0.75000 0.00000 -0.76000 0.00000 -0.64000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_7.PDB 8.96540 -9.09000 -0.39000 -0.39000 -8.86000 -0.79000 6.19000 -12.81000 2.14000 4.23000 3.03000 0.00000 0.00000 0.00000 0.10000 0.56000 0.00000 -0.49000 0.00000 -1.03000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_8.PDB 5.53039 -9.94000 -0.43000 -0.49000 -9.71000 -0.79000 6.91000 -14.16000 1.88000 4.72000 3.54000 0.00000 0.00000 0.00000 0.17000 0.68000 0.00000 -0.51000 0.00000 -1.06000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_9.PDB 9.46133 -6.56000 -0.41000 -0.49000 -9.75000 -0.27000 7.18000 -14.00000 3.49000 4.76000 3.63000 0.00000 0.00000 0.00000 0.25000 0.70000 0.00000 -0.53000 0.00000 -0.43000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_10.PDB 9.24348 -8.88000 -0.40000 -0.44000 -9.58000 -0.82000 7.08000 -13.77000 2.26000 4.61000 3.59000 0.00000 0.00000 0.00000 0.24000 0.69000 0.00000 -0.62000 0.00000 -1.04000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_11.PDB 8.72337 -9.75000 -1.25000 -1.34000 -9.51000 -1.16000 7.92000 -13.23000 2.22000 5.11000 3.49000 0.00000 0.00000 0.00000 0.10000 0.66000 0.00000 -0.76000 0.00000 -1.33000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_12.PDB 9.18408 -8.46000 -0.25000 -0.31000 -9.25000 -0.22000 6.02000 -13.77000 2.76000 4.39000 3.34000 0.00000 0.00000 0.00000 0.11000 0.73000 0.00000 -0.76000 0.00000 -0.51000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_13.PDB 6.27407 -7.48000 -0.36000 -0.38000 -9.46000 -0.18000 6.50000 -13.82000 2.75000 4.52000 3.74000 0.00000 0.00000 0.00000 0.27000 0.79000 0.00000 -0.64000 0.00000 -0.42000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_14.PDB 6.24274 -7.60000 -0.39000 -0.43000 -9.56000 -0.87000 7.46000 -13.75000 2.59000 4.98000 3.75000 0.00000 0.00000 0.00000 0.23000 0.63000 0.00000 -0.51000 0.00000 -1.10000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_15.PDB 8.99672 -9.87000 -0.41000 -0.46000 -9.08000 -0.90000 6.45000 -13.34000 2.05000 4.35000 3.10000 0.00000 0.00000 0.00000 0.10000 0.58000 0.00000 -0.62000 0.00000 -1.13000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_16.PDB 9.03383 -9.78000 -0.37000 -0.39000 -9.52000 -0.25000 6.26000 -14.01000 1.99000 4.38000 3.21000 0.00000 0.00000 0.00000 0.23000 0.52000 0.00000 -0.77000 0.00000 -0.55000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_17.PDB 8.96391 -9.38000 -0.36000 -0.39000 -9.27000 -0.79000 6.49000 -13.63000 2.12000 4.49000 3.35000 0.00000 0.00000 0.00000 0.21000 0.60000 0.00000 -0.56000 0.00000 -1.04000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_18.PDB 9.32024 -9.03000 -1.25000 -1.29000 -9.11000 -0.29000 6.83000 -13.03000 2.13000 4.52000 3.51000 0.00000 0.00000 0.00000 0.09000 0.69000 0.00000 -0.66000 0.00000 -0.47000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_19.PDB 9.09394 -8.99000 -0.27000 -0.38000 -10.02000 -0.30000 6.84000 -14.60000 2.97000 4.94000 3.05000 0.00000 0.00000 0.00000 0.12000 0.80000 0.00000 -0.78000 0.00000 -0.58000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_20.PDB 5.60881 -8.51000 -0.44000 -0.44000 -9.98000 -0.20000 6.95000 -14.56000 2.46000 4.73000 3.78000 0.00000 0.00000 0.00000 0.13000 0.81000 0.00000 -0.57000 0.00000 -0.38000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_21.PDB 8.83881 -8.21000 -1.23000 -2.15000 -9.77000 -0.64000 8.18000 -13.73000 2.27000 5.64000 4.38000 0.00000 0.00000 0.00000 0.13000 0.70000 0.00000 -0.52000 0.00000 -0.75000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_22.PDB 5.51881 -7.92000 -0.41000 -0.44000 -9.41000 -0.13000 6.44000 -13.64000 2.90000 4.29000 3.30000 0.00000 0.00000 0.00000 0.09000 0.64000 0.00000 -0.58000 0.00000 -0.33000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_23.PDB 8.53005 -9.42000 -0.36000 -0.39000 -9.11000 -0.65000 6.08000 -13.34000 1.98000 4.24000 3.53000 0.00000 0.00000 0.00000 0.12000 0.43000 0.00000 -0.60000 0.00000 -0.92000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_24.PDB 6.45963 -7.72000 -0.39000 -0.44000 -9.80000 -0.12000 6.83000 -14.17000 3.40000 4.66000 3.06000 0.00000 0.00000 0.00000 0.20000 0.85000 0.00000 -0.64000 0.00000 -0.30000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_25.PDB 10.33260 -8.34000 -0.35000 -0.42000 -9.20000 -0.14000 6.29000 -13.50000 2.39000 4.20000 3.13000 0.00000 0.00000 0.00000 0.24000 0.73000 0.00000 -0.61000 0.00000 -0.37000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_26.PDB 5.60823 -8.66000 -1.22000 -1.22000 -9.81000 -0.96000 7.71000 -13.82000 3.27000 5.12000 3.94000 0.00000 0.00000 0.00000 0.16000 0.86000 0.00000 -0.68000 0.00000 -1.14000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_27.PDB 6.00264 -6.76000 -0.41000 -0.48000 -9.52000 -0.21000 6.89000 -13.88000 3.32000 4.53000 3.82000 0.00000 0.00000 0.00000 0.27000 0.73000 0.00000 -0.67000 0.00000 -0.43000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_28.PDB 8.59562 -8.87000 -0.38000 -0.42000 -9.35000 -0.84000 6.81000 -13.32000 2.25000 4.50000 3.40000 0.00000 0.00000 0.00000 0.11000 0.56000 0.00000 -0.60000 0.00000 -1.05000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_29.PDB 6.64754 -8.89000 -0.45000 -0.50000 -9.01000 -0.26000 6.00000 -13.21000 2.33000 4.17000 2.94000 0.00000 0.00000 0.00000 0.14000 0.72000 0.00000 -0.55000 0.00000 -0.49000 0.00000 2.38000 72.00000 PEX13_1N5Z-18_30.PDB 8.52944 -9.81000 -0.41000 -0.41000 -9.32000 -0.78000 6.67000 -13.54000 1.74000 4.28000 3.45000 0.00000 0.00000 0.00000 0.09000 0.55000 0.00000 -0.57000 0.00000 -1.01000 0.00000 2.38000 72.00000