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-19_1.PDB -8.49000 -51.88000 -19.57000 -80.60000 -3.14000 101.54000 -103.95000 6.43000 43.96000 101.28000 0.00000 0.00000 0.00000 2.17000 22.45000 0.00000 -2.90000 0.00000 -1.81000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_2.PDB -5.77000 -52.23000 -18.66000 -80.00000 -2.38000 100.32000 -103.99000 7.61000 41.97000 102.48000 0.00000 0.00000 0.00000 3.03000 22.26000 0.00000 -2.81000 0.00000 -1.10000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_3.PDB -6.96000 -51.83000 -18.27000 -78.68000 -2.63000 98.92000 -102.00000 6.34000 41.73000 101.71000 0.00000 0.00000 0.00000 2.45000 22.31000 0.00000 -2.84000 0.00000 -1.86000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_4.PDB -6.66000 -51.95000 -19.82000 -79.48000 -2.60000 100.36000 -102.64000 6.44000 42.97000 100.91000 0.00000 0.00000 0.00000 3.24000 22.35000 0.00000 -2.66000 0.00000 -1.43000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_5.PDB -6.04000 -51.75000 -19.26000 -79.89000 -2.58000 100.74000 -103.44000 5.98000 42.88000 101.27000 0.00000 0.00000 0.00000 3.94000 22.47000 0.00000 -2.48000 0.00000 -1.46000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_6.PDB -6.08000 -51.51000 -17.92000 -79.13000 -2.62000 99.38000 -102.56000 5.72000 41.70000 101.50000 0.00000 0.00000 0.00000 3.59000 22.39000 0.00000 -2.54000 0.00000 -1.68000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_7.PDB -7.84000 -52.68000 -20.15000 -79.74000 -2.91000 100.78000 -102.94000 7.42000 43.36000 100.93000 0.00000 0.00000 0.00000 2.30000 22.57000 0.00000 -2.63000 0.00000 -1.60000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_8.PDB -6.41000 -51.73000 -18.08000 -79.89000 -2.63000 100.71000 -103.47000 5.93000 42.33000 100.40000 0.00000 0.00000 0.00000 3.82000 22.39000 0.00000 -2.47000 0.00000 -1.34000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_9.PDB -5.72000 -51.37000 -17.75000 -80.07000 -2.22000 99.67000 -104.01000 5.96000 42.37000 101.63000 0.00000 0.00000 0.00000 3.52000 22.40000 0.00000 -2.29000 0.00000 -1.16000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_10.PDB -6.86000 -51.59000 -18.30000 -79.86000 -2.34000 99.08000 -103.90000 6.16000 42.36000 101.83000 0.00000 0.00000 0.00000 3.56000 22.29000 0.00000 -2.58000 0.00000 -1.27000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_11.PDB -7.57000 -52.14000 -18.44000 -79.43000 -3.48000 100.94000 -102.37000 6.49000 42.53000 101.25000 0.00000 0.00000 0.00000 2.21000 22.48000 0.00000 -2.88000 0.00000 -2.23000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_12.PDB -7.66000 -53.07000 -19.13000 -80.68000 -2.80000 101.85000 -104.13000 5.71000 43.73000 101.26000 0.00000 0.00000 0.00000 3.86000 22.81000 0.00000 -2.64000 0.00000 -1.62000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_13.PDB -6.80000 -51.44000 -17.61000 -80.30000 -2.55000 100.59000 -104.11000 7.20000 42.31000 100.37000 0.00000 0.00000 0.00000 2.41000 22.53000 0.00000 -2.53000 0.00000 -1.13000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_14.PDB -8.41000 -52.93000 -20.74000 -79.61000 -3.06000 101.52000 -102.51000 6.50000 43.92000 101.66000 0.00000 0.00000 0.00000 2.25000 22.43000 0.00000 -3.58000 0.00000 -1.83000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_15.PDB -6.66000 -51.53000 -17.80000 -80.69000 -3.30000 101.55000 -104.11000 7.02000 43.08000 100.82000 0.00000 0.00000 0.00000 2.74000 22.56000 0.00000 -2.69000 0.00000 -1.76000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_16.PDB -2.90000 -51.85000 -19.72000 -80.36000 -2.68000 101.61000 -103.20000 9.31000 43.36000 102.23000 0.00000 0.00000 0.00000 3.13000 22.58000 0.00000 -2.96000 0.00000 -1.77000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_17.PDB -6.85000 -52.21000 -19.72000 -78.42000 -2.65000 99.65000 -101.58000 6.57000 42.44000 101.39000 0.00000 0.00000 0.00000 2.04000 22.25000 0.00000 -2.81000 0.00000 -1.55000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_18.PDB -7.00000 -51.76000 -18.27000 -80.34000 -2.28000 100.45000 -104.15000 6.61000 42.73000 101.46000 0.00000 0.00000 0.00000 2.24000 22.44000 0.00000 -2.80000 0.00000 -0.89000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_19.PDB -8.27000 -52.16000 -21.47000 -79.49000 -2.23000 100.36000 -102.71000 6.40000 43.77000 100.96000 0.00000 0.00000 0.00000 2.34000 22.46000 0.00000 -2.78000 0.00000 -1.26000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_20.PDB -8.43000 -52.09000 -19.20000 -80.98000 -3.34000 102.18000 -104.23000 6.68000 43.95000 101.02000 0.00000 0.00000 0.00000 2.31000 22.61000 0.00000 -2.74000 0.00000 -1.98000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_21.PDB -5.16000 -51.67000 -18.12000 -80.18000 -3.03000 100.84000 -103.16000 8.32000 42.45000 101.95000 0.00000 0.00000 0.00000 2.07000 22.48000 0.00000 -2.88000 0.00000 -1.75000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_22.PDB -6.85000 -52.13000 -18.53000 -78.83000 -2.74000 99.52000 -102.41000 6.10000 41.78000 101.18000 0.00000 0.00000 0.00000 3.30000 22.19000 0.00000 -2.54000 0.00000 -1.56000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_23.PDB -8.00000 -52.05000 -18.35000 -80.78000 -3.04000 101.66000 -104.27000 6.01000 43.22000 101.60000 0.00000 0.00000 0.00000 2.66000 22.57000 0.00000 -2.99000 0.00000 -1.66000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_24.PDB -6.01000 -51.60000 -17.97000 -79.96000 -2.51000 100.18000 -103.74000 6.34000 42.27000 100.90000 0.00000 0.00000 0.00000 3.73000 22.39000 0.00000 -2.40000 0.00000 -1.25000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_25.PDB -9.23000 -52.71000 -19.92000 -78.92000 -3.29000 99.91000 -101.93000 5.97000 43.09000 101.59000 0.00000 0.00000 0.00000 2.21000 22.39000 0.00000 -2.96000 0.00000 -2.26000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_26.PDB -3.28000 -51.62000 -18.04000 -80.08000 -2.20000 100.06000 -103.55000 9.04000 42.33000 102.09000 0.00000 0.00000 0.00000 2.78000 22.51000 0.00000 -2.86000 0.00000 -1.22000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_27.PDB -6.20000 -51.72000 -18.12000 -78.94000 -2.86000 99.32000 -102.52000 6.92000 41.63000 100.40000 0.00000 0.00000 0.00000 3.89000 22.41000 0.00000 -2.61000 0.00000 -1.60000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_28.PDB -8.56000 -51.52000 -19.28000 -80.51000 -2.57000 100.56000 -104.44000 6.72000 43.57000 101.64000 0.00000 0.00000 0.00000 1.97000 22.56000 0.00000 -3.00000 0.00000 -1.70000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_29.PDB -6.49000 -52.26000 -18.64000 -78.58000 -2.56000 99.81000 -101.93000 6.50000 41.95000 101.22000 0.00000 0.00000 0.00000 2.05000 22.23000 0.00000 -2.74000 0.00000 -1.31000 0.00000 0.00000 71.00000 PEX13_1N5Z-19_30.PDB -7.73000 -52.29000 -18.71000 -79.05000 -2.50000 99.42000 -102.76000 6.83000 42.14000 101.44000 0.00000 0.00000 0.00000 2.04000 22.24000 0.00000 -3.06000 0.00000 -1.22000 0.00000 0.00000 71.00000