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-12_1.PDB 3.43097 -11.94000 -1.63000 -3.30000 -6.39000 -6.08000 9.32000 -6.62000 0.55000 6.17000 0.83000 0.00000 0.00000 0.00000 0.24000 0.48000 0.00000 -1.04000 0.00000 -3.99000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_2.PDB 3.29653 -13.10000 -2.54000 -4.20000 -6.01000 -5.47000 8.86000 -6.39000 0.50000 5.77000 0.71000 0.00000 0.00000 0.00000 0.12000 0.51000 0.00000 -0.91000 0.00000 -3.52000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_3.PDB 2.80399 -10.46000 -1.72000 -2.55000 -5.57000 -4.19000 7.84000 -6.37000 0.43000 5.15000 0.84000 0.00000 0.00000 0.00000 0.04000 0.29000 0.00000 -0.85000 0.00000 -3.50000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_4.PDB 4.18452 -12.77000 -2.55000 -4.26000 -5.83000 -6.12000 9.34000 -5.80000 0.49000 5.28000 0.67000 0.00000 0.00000 0.00000 0.38000 0.42000 0.00000 -0.53000 0.00000 -3.84000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_5.PDB 2.61378 -11.27000 -1.68000 -3.08000 -6.15000 -4.36000 8.48000 -6.94000 0.71000 5.46000 0.76000 0.00000 0.00000 0.00000 0.04000 0.39000 0.00000 -1.37000 0.00000 -3.15000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_6.PDB 3.15159 -14.06000 -2.53000 -6.03000 -6.55000 -5.26000 9.29000 -6.92000 0.40000 6.88000 0.87000 0.00000 0.00000 0.00000 0.08000 0.48000 0.00000 -0.92000 0.00000 -3.37000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_7.PDB 2.91779 -12.22000 -1.76000 -4.39000 -6.07000 -5.17000 8.89000 -6.62000 0.65000 5.98000 0.73000 0.00000 0.00000 0.00000 0.10000 0.43000 0.00000 -1.15000 0.00000 -3.40000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_8.PDB 3.52107 -13.96000 -2.55000 -5.42000 -6.19000 -5.56000 9.28000 -6.18000 0.63000 5.48000 0.92000 0.00000 0.00000 0.00000 0.16000 0.48000 0.00000 -1.21000 0.00000 -3.32000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_9.PDB 3.32985 -10.42000 -2.54000 -3.29000 -5.34000 -3.99000 7.54000 -5.98000 0.71000 5.55000 1.02000 0.00000 0.00000 0.00000 0.05000 0.27000 0.00000 -0.78000 0.00000 -3.37000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_10.PDB 2.39515 -12.04000 -1.30000 -4.50000 -5.23000 -4.92000 6.87000 -6.33000 0.48000 6.71000 0.71000 0.00000 0.00000 0.00000 0.01000 0.54000 0.00000 -0.95000 0.00000 -3.60000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_11.PDB 3.32503 -12.42000 -2.55000 -3.92000 -6.16000 -4.87000 8.42000 -6.77000 0.53000 6.22000 0.79000 0.00000 0.00000 0.00000 0.05000 0.40000 0.00000 -0.71000 0.00000 -3.45000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_12.PDB 3.43674 -12.98000 -2.63000 -4.50000 -6.00000 -5.46000 8.77000 -6.37000 0.60000 5.90000 0.67000 0.00000 0.00000 0.00000 0.13000 0.48000 0.00000 -0.53000 0.00000 -3.55000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_13.PDB 2.67698 -12.96000 -2.54000 -5.86000 -6.32000 -4.77000 8.94000 -6.85000 0.49000 6.94000 0.88000 0.00000 0.00000 0.00000 0.04000 0.43000 0.00000 -0.75000 0.00000 -3.16000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_14.PDB 3.22760 -10.45000 -1.31000 -4.65000 -5.98000 -4.12000 7.95000 -6.02000 0.48000 6.48000 0.73000 0.00000 0.00000 0.00000 0.11000 0.55000 0.00000 -1.11000 0.00000 -3.02000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_15.PDB 2.80445 -13.11000 -2.04000 -3.94000 -6.13000 -4.34000 6.49000 -7.16000 0.38000 6.14000 0.59000 0.00000 0.00000 0.00000 0.09000 0.37000 0.00000 -0.43000 0.00000 -2.78000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_16.PDB 3.51608 -12.32000 -2.50000 -3.95000 -5.96000 -5.72000 9.02000 -6.16000 0.62000 5.90000 0.66000 0.00000 0.00000 0.00000 0.09000 0.46000 0.00000 -0.46000 0.00000 -3.86000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_17.PDB 2.35624 -12.03000 -1.72000 -5.06000 -6.65000 -5.38000 9.21000 -7.05000 0.93000 7.22000 0.78000 0.00000 0.00000 0.00000 0.05000 0.46000 0.00000 -0.94000 0.00000 -3.41000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_18.PDB 2.70709 -12.66000 -2.08000 -3.90000 -5.67000 -4.35000 6.33000 -6.62000 0.40000 5.72000 0.50000 0.00000 0.00000 0.00000 0.15000 0.38000 0.00000 -0.52000 0.00000 -2.62000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_19.PDB 3.66811 -13.04000 -2.53000 -5.94000 -6.19000 -5.25000 9.35000 -6.48000 0.49000 6.39000 0.76000 0.00000 0.00000 0.00000 0.13000 0.47000 0.00000 -0.60000 0.00000 -3.18000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_20.PDB 3.34297 -12.80000 -2.63000 -4.37000 -5.98000 -5.89000 9.16000 -6.14000 0.53000 6.21000 0.75000 0.00000 0.00000 0.00000 0.05000 0.44000 0.00000 -0.59000 0.00000 -3.90000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_21.PDB 2.64256 -10.38000 -1.30000 -2.73000 -5.21000 -3.70000 6.57000 -6.52000 0.66000 5.28000 0.76000 0.00000 0.00000 0.00000 0.02000 0.47000 0.00000 -1.06000 0.00000 -3.16000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_22.PDB 3.58830 -10.29000 -2.47000 -2.50000 -5.29000 -4.05000 7.86000 -5.82000 0.59000 4.38000 0.95000 0.00000 0.00000 0.00000 0.13000 0.35000 0.00000 -0.85000 0.00000 -3.24000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_23.PDB 2.41880 -11.21000 -1.25000 -6.32000 -5.19000 -4.67000 7.06000 -5.77000 0.40000 7.31000 0.88000 0.00000 0.00000 0.00000 0.03000 0.27000 0.00000 -0.54000 0.00000 -3.15000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_24.PDB 3.56627 -11.45000 -1.30000 -4.25000 -5.24000 -5.08000 6.88000 -6.36000 0.65000 6.65000 0.63000 0.00000 0.00000 0.00000 0.01000 0.53000 0.00000 -0.52000 0.00000 -3.50000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_25.PDB 3.19546 -9.61000 -1.98000 -1.96000 -4.71000 -3.27000 5.41000 -5.60000 0.41000 4.33000 0.49000 0.00000 0.00000 0.00000 0.11000 0.26000 0.00000 -0.39000 0.00000 -2.45000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_26.PDB 2.83057 -12.66000 -1.85000 -3.66000 -6.09000 -4.18000 6.25000 -7.27000 0.39000 6.15000 0.58000 0.00000 0.00000 0.00000 0.09000 0.39000 0.00000 -0.30000 0.00000 -2.76000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_27.PDB 2.68564 -12.26000 -1.68000 -5.87000 -6.09000 -5.35000 9.48000 -6.34000 0.63000 6.40000 0.77000 0.00000 0.00000 0.00000 0.11000 0.45000 0.00000 -0.85000 0.00000 -3.47000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_28.PDB 3.12158 -9.78000 -1.28000 -2.61000 -5.21000 -3.44000 6.40000 -6.51000 0.52000 5.34000 0.81000 0.00000 0.00000 0.00000 0.01000 0.43000 0.00000 -0.97000 0.00000 -2.83000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_29.PDB 2.57331 -11.24000 -1.68000 -4.07000 -5.96000 -4.21000 8.58000 -6.62000 0.47000 5.65000 0.88000 0.00000 0.00000 0.00000 0.03000 0.39000 0.00000 -1.03000 0.00000 -3.26000 0.00000 2.38000 70.00000 PEX13_1N5Z-12_30.PDB 4.08796 -10.98000 -1.71000 -4.89000 -5.43000 -4.04000 8.37000 -5.66000 0.37000 4.85000 0.74000 0.00000 0.00000 0.00000 0.08000 0.38000 0.00000 -0.85000 0.00000 -2.81000 0.00000 2.38000 70.00000