name total energy Backbone Hbon 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 -3.92000 -51.48000 -16.93000 -79.39000 -1.15000 95.67000 -104.28000 12.76000 41.41000 100.02000 0.00000 0.00000 0.00000 2.31000 22.55000 0.00000 -2.51000 0.00000 -0.33000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_2.PDB -4.07000 -52.15000 -17.59000 -79.24000 -1.48000 96.07000 -103.69000 13.21000 41.95000 100.34000 0.00000 0.00000 0.00000 2.12000 22.50000 0.00000 -2.62000 0.00000 -0.97000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_3.PDB -4.08000 -51.45000 -16.92000 -79.31000 -1.10000 95.19000 -104.09000 13.06000 41.54000 99.82000 0.00000 0.00000 0.00000 2.13000 22.47000 0.00000 -2.54000 0.00000 -0.39000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_4.PDB -3.72000 -51.28000 -16.70000 -79.46000 -1.12000 95.67000 -104.28000 12.19000 41.44000 100.36000 0.00000 0.00000 0.00000 2.22000 22.55000 0.00000 -2.45000 0.00000 -0.31000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_5.PDB -2.44000 -51.92000 -17.35000 -79.57000 -1.64000 96.66000 -104.13000 12.85000 41.97000 100.92000 0.00000 0.00000 0.00000 2.89000 22.69000 0.00000 -2.59000 0.00000 -0.54000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_6.PDB -4.22000 -51.43000 -17.68000 -79.85000 -1.73000 96.52000 -104.66000 12.46000 42.45000 100.33000 0.00000 0.00000 0.00000 2.61000 22.68000 0.00000 -2.60000 0.00000 -0.64000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_7.PDB -5.24000 -52.15000 -17.60000 -78.89000 -1.57000 95.39000 -103.28000 12.85000 41.78000 99.99000 0.00000 0.00000 0.00000 1.86000 22.27000 0.00000 -2.60000 0.00000 -1.03000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_8.PDB -5.27000 -52.20000 -17.70000 -78.96000 -1.56000 95.92000 -103.19000 11.72000 42.07000 100.42000 0.00000 0.00000 0.00000 1.93000 22.46000 0.00000 -2.68000 0.00000 -1.06000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_9.PDB -2.10000 -51.52000 -17.04000 -80.21000 -1.20000 96.51000 -105.10000 14.13000 42.05000 101.17000 0.00000 0.00000 0.00000 2.37000 22.44000 0.00000 -2.85000 0.00000 -0.43000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_10.PDB -3.43000 -51.81000 -17.25000 -79.25000 -1.94000 96.14000 -103.56000 12.29000 42.11000 100.55000 0.00000 0.00000 0.00000 2.67000 22.52000 0.00000 -2.35000 0.00000 -1.04000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_11.PDB -5.75000 -52.97000 -18.52000 -79.19000 -2.26000 96.86000 -103.18000 12.70000 42.58000 100.35000 0.00000 0.00000 0.00000 1.67000 22.32000 0.00000 -2.47000 0.00000 -1.33000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_12.PDB -2.73000 -51.78000 -17.29000 -79.75000 -1.12000 96.08000 -104.74000 13.08000 42.47000 101.24000 0.00000 0.00000 0.00000 2.38000 22.49000 0.00000 -2.79000 0.00000 -0.51000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_13.PDB -1.52000 -51.10000 -16.49000 -80.66000 -1.16000 96.86000 -105.83000 12.60000 42.48000 101.78000 0.00000 0.00000 0.00000 3.02000 22.65000 0.00000 -2.59000 0.00000 -0.42000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_14.PDB -1.85000 -51.53000 -16.99000 -79.53000 -1.69000 96.97000 -103.96000 12.70000 42.14000 101.17000 0.00000 0.00000 0.00000 2.55000 22.44000 0.00000 -2.58000 0.00000 -1.10000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_15.PDB -3.55000 -52.68000 -18.11000 -79.25000 -1.55000 96.47000 -103.67000 12.07000 42.94000 101.18000 0.00000 0.00000 0.00000 2.49000 22.42000 0.00000 -2.31000 0.00000 -1.13000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_16.PDB -4.56000 -51.11000 -17.91000 -79.28000 -1.15000 95.48000 -103.95000 11.70000 42.20000 99.77000 0.00000 0.00000 0.00000 2.74000 22.56000 0.00000 -2.51000 0.00000 -0.55000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_17.PDB -4.11000 -51.96000 -17.44000 -79.80000 -1.59000 96.26000 -104.65000 12.61000 42.31000 101.40000 0.00000 0.00000 0.00000 2.13000 22.40000 0.00000 -2.34000 0.00000 -1.04000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_18.PDB -4.40000 -52.34000 -17.79000 -79.07000 -1.58000 95.92000 -103.41000 13.05000 41.62000 100.18000 0.00000 0.00000 0.00000 2.07000 22.58000 0.00000 -2.59000 0.00000 -0.47000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_19.PDB -3.93000 -51.05000 -17.55000 -80.40000 -1.25000 96.53000 -105.51000 12.83000 42.93000 100.12000 0.00000 0.00000 0.00000 2.51000 22.72000 0.00000 -2.52000 0.00000 -0.58000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_20.PDB -4.89000 -51.51000 -16.92000 -79.94000 -1.47000 96.16000 -104.79000 12.50000 41.91000 100.51000 0.00000 0.00000 0.00000 1.78000 22.63000 0.00000 -2.75000 0.00000 -0.38000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_21.PDB -5.27000 -53.17000 -19.55000 -80.32000 -1.84000 98.32000 -104.70000 12.74000 43.80000 101.19000 0.00000 0.00000 0.00000 1.82000 22.40000 0.00000 -2.82000 0.00000 -0.75000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_22.PDB -4.52000 -51.54000 -16.96000 -79.52000 -1.44000 95.61000 -104.26000 12.68000 41.61000 99.90000 0.00000 0.00000 0.00000 1.99000 22.47000 0.00000 -2.25000 0.00000 -0.33000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_23.PDB -5.51000 -52.20000 -17.64000 -78.91000 -1.51000 95.14000 -103.38000 11.89000 41.94000 100.35000 0.00000 0.00000 0.00000 1.97000 22.42000 0.00000 -2.26000 0.00000 -0.92000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_24.PDB -1.41000 -51.50000 -16.95000 -80.12000 -1.21000 96.72000 -104.93000 14.01000 42.05000 100.83000 0.00000 0.00000 0.00000 2.33000 22.68000 0.00000 -2.34000 0.00000 -0.30000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_25.PDB -1.57000 -51.09000 -16.55000 -79.35000 -1.11000 95.88000 -104.16000 12.31000 41.45000 99.85000 0.00000 0.00000 0.00000 3.89000 22.62000 0.00000 -2.33000 0.00000 -0.37000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_26.PDB -5.14000 -53.09000 -18.48000 -79.53000 -2.10000 96.85000 -103.68000 13.29000 42.71000 100.94000 0.00000 0.00000 0.00000 1.88000 22.70000 0.00000 -2.79000 0.00000 -1.14000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_27.PDB -1.97000 -51.42000 -16.91000 -79.74000 -1.11000 96.19000 -104.60000 13.21000 41.87000 101.29000 0.00000 0.00000 0.00000 2.48000 22.54000 0.00000 -2.80000 0.00000 -0.43000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_28.PDB -5.24000 -52.10000 -17.56000 -79.18000 -1.97000 95.88000 -103.40000 12.17000 42.12000 100.33000 0.00000 0.00000 0.00000 2.03000 22.54000 0.00000 -2.52000 0.00000 -1.05000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_29.PDB -3.45000 -52.01000 -17.47000 -80.11000 -1.09000 96.11000 -105.14000 13.11000 42.63000 100.84000 0.00000 0.00000 0.00000 2.49000 22.51000 0.00000 -2.31000 0.00000 -0.49000 0.00000 0.00000 72.00000 PEX13_1N5Z-18_30.PDB -4.44000 -51.92000 -17.29000 -78.67000 -1.85000 95.79000 -102.71000 11.48000 41.63000 100.38000 0.00000 0.00000 0.00000 2.05000 22.49000 0.00000 -2.32000 0.00000 -1.01000 0.00000 0.00000 72.00000