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-20_1.PDB 4.14052 -13.82000 -1.13000 -2.88000 -11.58000 -1.56000 10.22000 -15.84000 1.80000 5.78000 3.16000 0.00000 0.00000 0.00000 0.32000 0.81000 0.00000 -0.74000 0.00000 -1.36000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_2.PDB 4.60047 -13.19000 -1.07000 -2.06000 -10.86000 -1.96000 9.58000 -14.56000 0.95000 5.59000 3.29000 0.00000 0.00000 0.00000 0.14000 0.71000 0.00000 -0.54000 0.00000 -1.71000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_3.PDB 4.18796 -13.04000 -1.18000 -2.19000 -11.26000 -2.01000 10.27000 -14.84000 1.84000 5.30000 3.22000 0.00000 0.00000 0.00000 0.19000 0.76000 0.00000 -0.97000 0.00000 -1.41000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_4.PDB 4.35829 -13.27000 -1.04000 -2.06000 -11.23000 -1.26000 9.29000 -15.44000 1.99000 5.12000 2.98000 0.00000 0.00000 0.00000 0.31000 0.79000 0.00000 -0.79000 0.00000 -1.14000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_5.PDB 4.24796 -13.51000 -1.00000 -1.98000 -11.20000 -1.52000 9.36000 -15.37000 1.83000 5.07000 2.95000 0.00000 0.00000 0.00000 0.29000 0.81000 0.00000 -0.68000 0.00000 -1.27000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_6.PDB 4.22759 -12.88000 -1.05000 -2.09000 -10.69000 -1.40000 9.33000 -14.54000 0.76000 5.39000 3.22000 0.00000 0.00000 0.00000 0.16000 0.65000 0.00000 -0.77000 0.00000 -1.20000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_7.PDB 4.45503 -13.25000 -1.09000 -2.07000 -10.90000 -1.69000 9.51000 -14.70000 0.81000 5.58000 3.18000 0.00000 0.00000 0.00000 0.17000 0.73000 0.00000 -0.52000 0.00000 -1.54000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_8.PDB 4.56378 -13.28000 -1.08000 -2.03000 -10.97000 -2.02000 9.79000 -14.76000 0.88000 6.12000 3.06000 0.00000 0.00000 0.00000 0.18000 0.72000 0.00000 -0.56000 0.00000 -1.87000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_9.PDB 4.15570 -13.07000 -1.12000 -2.16000 -10.78000 -1.27000 9.35000 -14.64000 0.65000 5.34000 3.29000 0.00000 0.00000 0.00000 0.16000 0.65000 0.00000 -0.80000 0.00000 -1.10000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_10.PDB 3.86654 -13.72000 -1.23000 -2.93000 -11.50000 -1.59000 10.06000 -15.81000 2.18000 5.83000 3.15000 0.00000 0.00000 0.00000 0.28000 0.82000 0.00000 -0.70000 0.00000 -1.47000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_11.PDB 4.11422 -13.08000 -0.98000 -2.01000 -10.61000 -1.45000 9.11000 -14.51000 0.63000 5.40000 3.28000 0.00000 0.00000 0.00000 0.14000 0.70000 0.00000 -0.75000 0.00000 -1.32000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_12.PDB 4.47568 -13.96000 -1.17000 -2.10000 -10.77000 -1.53000 9.31000 -14.78000 0.61000 5.63000 3.24000 0.00000 0.00000 0.00000 0.15000 0.69000 0.00000 -0.96000 0.00000 -1.59000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_13.PDB 4.31754 -13.11000 -1.08000 -2.79000 -11.40000 -1.55000 10.10000 -15.72000 1.93000 5.78000 3.13000 0.00000 0.00000 0.00000 0.35000 0.81000 0.00000 -0.54000 0.00000 -1.31000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_14.PDB 4.34561 -12.52000 -1.03000 -2.07000 -10.66000 -1.19000 9.04000 -14.66000 0.77000 5.35000 3.29000 0.00000 0.00000 0.00000 0.17000 0.67000 0.00000 -0.43000 0.00000 -1.11000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_15.PDB 4.20826 -13.75000 -1.22000 -2.16000 -10.92000 -1.58000 9.44000 -14.93000 0.74000 5.76000 3.35000 0.00000 0.00000 0.00000 0.14000 0.71000 0.00000 -0.79000 0.00000 -1.57000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_16.PDB 3.93093 -13.76000 -1.15000 -2.11000 -11.24000 -1.37000 9.44000 -15.63000 1.80000 5.18000 3.10000 0.00000 0.00000 0.00000 0.22000 0.80000 0.00000 -0.80000 0.00000 -1.20000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_17.PDB 4.23688 -12.48000 -1.03000 -2.07000 -10.65000 -1.04000 8.87000 -14.73000 0.81000 5.76000 3.39000 0.00000 0.00000 0.00000 0.16000 0.59000 0.00000 -0.65000 0.00000 -1.31000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_18.PDB 4.13264 -12.90000 -1.15000 -2.10000 -10.57000 -1.31000 9.07000 -14.50000 0.77000 5.18000 3.30000 0.00000 0.00000 0.00000 0.16000 0.75000 0.00000 -0.59000 0.00000 -1.15000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_19.PDB 4.00890 -12.89000 -1.83000 -2.83000 -10.96000 -1.70000 10.07000 -14.68000 1.92000 5.70000 3.23000 0.00000 0.00000 0.00000 0.21000 0.83000 0.00000 -0.47000 0.00000 -1.56000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_20.PDB 2.93253 -11.20000 -1.00000 -1.98000 -10.68000 -1.67000 8.80000 -14.61000 4.23000 4.59000 2.89000 0.00000 0.00000 0.00000 0.29000 0.75000 0.00000 -0.68000 0.00000 -1.40000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_21.PDB 2.23206 -10.58000 -1.12000 -2.08000 -10.29000 -1.86000 8.88000 -13.98000 4.13000 4.74000 3.20000 0.00000 0.00000 0.00000 0.07000 0.60000 0.00000 -0.62000 0.00000 -1.64000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_22.PDB 2.99948 -11.59000 -1.09000 -2.06000 -10.41000 -1.59000 8.84000 -14.25000 2.72000 4.71000 3.37000 0.00000 0.00000 0.00000 0.04000 0.64000 0.00000 -0.56000 0.00000 -1.30000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_23.PDB 3.32477 -11.32000 -1.16000 -2.17000 -10.91000 -1.49000 8.87000 -15.15000 4.96000 4.48000 2.98000 0.00000 0.00000 0.00000 0.21000 0.72000 0.00000 -0.71000 0.00000 -1.24000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_24.PDB 4.35516 -13.32000 -1.77000 -3.10000 -10.47000 -2.00000 9.93000 -13.76000 0.70000 6.09000 3.34000 0.00000 0.00000 0.00000 0.17000 0.70000 0.00000 -0.58000 0.00000 -1.86000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_25.PDB 4.13877 -11.60000 -1.04000 -2.06000 -9.73000 -0.86000 8.37000 -13.32000 0.53000 4.92000 3.08000 0.00000 0.00000 0.00000 0.14000 0.56000 0.00000 -0.54000 0.00000 -1.08000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_26.PDB 4.28319 -12.79000 -1.17000 -2.90000 -10.72000 -1.60000 9.86000 -14.52000 1.81000 5.51000 2.83000 0.00000 0.00000 0.00000 0.29000 0.78000 0.00000 -0.75000 0.00000 -1.43000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_27.PDB 2.19469 -10.53000 -0.99000 -1.96000 -10.19000 -1.64000 8.51000 -13.98000 4.23000 4.67000 2.97000 0.00000 0.00000 0.00000 0.04000 0.59000 0.00000 -0.72000 0.00000 -1.47000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_28.PDB 2.64145 -11.00000 -1.87000 -3.72000 -10.42000 -1.61000 9.40000 -13.89000 3.84000 6.00000 3.53000 0.00000 0.00000 0.00000 0.06000 0.58000 0.00000 -0.98000 0.00000 -1.34000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_29.PDB 4.12452 -11.07000 -1.08000 -2.06000 -10.58000 -1.59000 9.15000 -14.40000 3.70000 4.88000 2.82000 0.00000 0.00000 0.00000 0.31000 0.79000 0.00000 -0.80000 0.00000 -1.40000 0.00000 2.38000 71.00000 PEX13_1N5Z-20_30.PDB 4.20536 -12.84000 -1.18000 -2.10000 -10.39000 -1.72000 9.42000 -13.86000 0.72000 5.40000 3.05000 0.00000 0.00000 0.00000 0.14000 0.73000 0.00000 -0.65000 0.00000 -1.68000 0.00000 2.38000 71.00000