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 HSE1_1OEB-16_1.PDB 5.89842 -6.61000 -1.06000 -1.86000 -7.51000 -0.83000 6.79000 -10.81000 2.37000 3.90000 3.16000 0.00000 0.00000 0.00000 0.57000 0.23000 0.00000 -0.48000 0.00000 -0.83000 0.00000 2.38000 63.00000 HSE1_1OEB-16_2.PDB 6.49620 -7.60000 -0.96000 -1.78000 -8.00000 -0.88000 7.04000 -11.43000 1.71000 4.30000 3.37000 0.00000 0.00000 0.00000 0.54000 0.33000 0.00000 -0.59000 0.00000 -0.93000 0.00000 2.38000 63.00000 HSE1_1OEB-16_3.PDB 6.15107 -6.09000 -0.95000 -1.93000 -7.48000 -0.96000 7.56000 -10.43000 1.53000 4.13000 3.22000 0.00000 0.00000 0.00000 0.58000 0.21000 0.00000 -0.42000 0.00000 -0.94000 0.00000 2.38000 63.00000 HSE1_1OEB-16_4.PDB 6.85545 -7.00000 -0.97000 -1.92000 -7.49000 -1.09000 6.97000 -10.77000 1.78000 4.27000 3.45000 0.00000 0.00000 0.00000 0.58000 0.23000 0.00000 -0.74000 0.00000 -1.07000 0.00000 2.38000 63.00000 HSE1_1OEB-16_5.PDB 6.39461 -6.45000 -1.00000 -2.20000 -7.50000 -0.69000 6.75000 -10.83000 2.55000 3.96000 3.18000 0.00000 0.00000 0.00000 0.57000 0.27000 0.00000 -0.57000 0.00000 -0.66000 0.00000 2.38000 63.00000 HSE1_1OEB-16_6.PDB 6.93355 -6.00000 -0.94000 -0.91000 -7.31000 -0.63000 6.53000 -10.64000 2.62000 3.20000 2.87000 0.00000 0.00000 0.00000 0.56000 0.23000 0.00000 -0.71000 0.00000 -0.63000 0.00000 2.38000 63.00000 HSE1_1OEB-16_7.PDB 6.41817 -6.01000 -0.75000 -0.73000 -7.42000 -0.67000 6.62000 -10.72000 2.30000 3.22000 2.98000 0.00000 0.00000 0.00000 0.59000 0.23000 0.00000 -0.74000 0.00000 -0.68000 0.00000 2.38000 63.00000 HSE1_1OEB-16_8.PDB 3.98819 -6.61000 -0.98000 -2.17000 -7.65000 -0.78000 6.91000 -11.04000 2.48000 4.11000 3.23000 0.00000 0.00000 0.00000 0.60000 0.33000 0.00000 -0.57000 0.00000 -0.76000 0.00000 2.38000 63.00000 HSE1_1OEB-16_9.PDB 6.15724 -7.21000 -0.94000 -1.98000 -8.18000 -0.93000 7.93000 -11.47000 1.74000 4.51000 3.01000 0.00000 0.00000 0.00000 0.60000 0.35000 0.00000 -0.62000 0.00000 -0.90000 0.00000 2.38000 63.00000 HSE1_1OEB-16_10.PDB 5.47869 -7.36000 -0.98000 -2.34000 -7.92000 -0.79000 7.27000 -11.24000 1.53000 4.54000 3.33000 0.00000 0.00000 0.00000 0.62000 0.26000 0.00000 -0.63000 0.00000 -0.74000 0.00000 2.38000 63.00000 HSE1_1OEB-16_11.PDB 6.41901 -7.96000 -1.00000 -2.29000 -7.81000 -0.72000 6.76000 -11.22000 1.67000 4.43000 3.22000 0.00000 0.00000 0.00000 0.57000 0.23000 0.00000 -0.82000 0.00000 -0.74000 0.00000 2.38000 63.00000 HSE1_1OEB-16_12.PDB 6.71117 -5.22000 -0.99000 -1.81000 -7.48000 -0.98000 7.65000 -10.42000 2.90000 3.97000 3.32000 0.00000 0.00000 0.00000 0.19000 0.24000 0.00000 -0.64000 0.00000 -0.93000 0.00000 2.38000 63.00000 HSE1_1OEB-16_13.PDB 6.08472 -8.65000 -0.72000 -3.50000 -8.18000 -1.46000 7.48000 -11.58000 1.71000 6.00000 3.57000 0.00000 0.00000 0.00000 0.55000 0.32000 0.00000 -1.11000 0.00000 -1.41000 0.00000 2.38000 63.00000 HSE1_1OEB-16_14.PDB 6.62755 -4.27000 -1.07000 -1.03000 -7.49000 -0.70000 7.83000 -10.30000 2.75000 3.16000 3.36000 0.00000 0.00000 0.00000 0.59000 0.35000 0.00000 -0.67000 0.00000 -0.68000 0.00000 2.38000 63.00000 HSE1_1OEB-16_15.PDB 6.40723 -6.88000 -1.02000 -1.47000 -7.64000 -0.92000 7.26000 -10.75000 1.52000 3.82000 3.49000 0.00000 0.00000 0.00000 0.58000 0.38000 0.00000 -0.85000 0.00000 -0.91000 0.00000 2.38000 63.00000 HSE1_1OEB-16_16.PDB 4.31932 -7.39000 -0.97000 -1.71000 -7.99000 -1.08000 7.38000 -11.32000 1.61000 4.53000 3.17000 0.00000 0.00000 0.00000 0.65000 0.22000 0.00000 -0.62000 0.00000 -1.04000 0.00000 2.38000 63.00000 HSE1_1OEB-16_17.PDB 6.84819 -6.58000 -0.98000 -2.70000 -7.32000 -0.87000 7.22000 -10.29000 1.46000 4.41000 3.51000 0.00000 0.00000 0.00000 0.57000 0.24000 0.00000 -0.76000 0.00000 -0.83000 0.00000 2.38000 63.00000 HSE1_1OEB-16_18.PDB 6.40963 -5.42000 -0.78000 -1.40000 -7.56000 -0.79000 6.85000 -10.93000 3.02000 3.79000 3.15000 0.00000 0.00000 0.00000 0.58000 0.26000 0.00000 -0.58000 0.00000 -0.78000 0.00000 2.38000 63.00000 HSE1_1OEB-16_19.PDB 6.50839 -6.56000 -0.75000 -2.38000 -7.43000 -1.62000 7.57000 -10.29000 1.89000 5.04000 3.25000 0.00000 0.00000 0.00000 0.60000 0.21000 0.00000 -0.93000 0.00000 -1.50000 0.00000 2.38000 63.00000 HSE1_1OEB-16_20.PDB 6.96464 -7.23000 -0.96000 -2.13000 -7.57000 -1.21000 6.96000 -10.84000 1.53000 4.48000 3.66000 0.00000 0.00000 0.00000 0.59000 0.26000 0.00000 -0.62000 0.00000 -1.11000 0.00000 2.38000 63.00000 HSE1_1OEB-16_21.PDB 4.01586 -5.70000 -0.72000 -0.68000 -7.28000 -0.96000 6.95000 -10.30000 1.63000 3.59000 3.02000 0.00000 0.00000 0.00000 0.54000 0.21000 0.00000 -0.53000 0.00000 -0.97000 0.00000 2.38000 63.00000 HSE1_1OEB-16_22.PDB 4.33263 -6.63000 -0.99000 -2.06000 -7.63000 -0.75000 6.81000 -11.12000 2.54000 4.03000 3.36000 0.00000 0.00000 0.00000 0.58000 0.33000 0.00000 -0.53000 0.00000 -0.87000 0.00000 2.38000 63.00000 HSE1_1OEB-16_23.PDB 4.24584 -6.04000 -0.98000 -0.96000 -7.25000 -0.70000 6.66000 -10.45000 2.12000 3.26000 2.88000 0.00000 0.00000 0.00000 0.59000 0.22000 0.00000 -0.50000 0.00000 -0.70000 0.00000 2.38000 63.00000 HSE1_1OEB-16_24.PDB 6.78959 -6.31000 -0.70000 -1.54000 -7.33000 -1.00000 6.80000 -10.58000 2.07000 4.02000 3.12000 0.00000 0.00000 0.00000 0.58000 0.20000 0.00000 -0.70000 0.00000 -1.04000 0.00000 2.38000 63.00000 HSE1_1OEB-16_25.PDB 6.07351 -5.06000 -0.74000 -1.74000 -7.82000 -0.65000 7.91000 -10.62000 2.31000 3.71000 3.27000 0.00000 0.00000 0.00000 0.62000 0.32000 0.00000 -0.64000 0.00000 -0.67000 0.00000 2.38000 63.00000 HSE1_1OEB-16_26.PDB 4.21746 -6.77000 -1.01000 -2.04000 -7.66000 -0.89000 6.90000 -11.09000 2.38000 4.29000 3.38000 0.00000 0.00000 0.00000 0.53000 0.24000 0.00000 -0.61000 0.00000 -0.94000 0.00000 2.38000 63.00000 HSE1_1OEB-16_27.PDB 4.86286 -6.18000 -0.96000 -0.95000 -7.24000 -0.83000 6.71000 -10.47000 2.80000 3.41000 2.90000 0.00000 0.00000 0.00000 0.10000 0.22000 0.00000 -0.76000 0.00000 -0.89000 0.00000 2.38000 63.00000 HSE1_1OEB-16_28.PDB 6.34163 -6.72000 -0.69000 -1.68000 -8.19000 -0.99000 7.87000 -11.51000 1.89000 4.56000 3.06000 0.00000 0.00000 0.00000 0.57000 0.34000 0.00000 -0.64000 0.00000 -0.97000 0.00000 2.38000 63.00000 HSE1_1OEB-16_29.PDB 6.73071 -6.91000 -1.01000 -2.02000 -7.69000 -0.79000 6.93000 -10.92000 1.71000 4.06000 3.85000 0.00000 0.00000 0.00000 0.54000 0.22000 0.00000 -0.65000 0.00000 -0.93000 0.00000 2.38000 63.00000 HSE1_1OEB-16_30.PDB 5.92299 -3.41000 -0.73000 -0.71000 -7.24000 -0.89000 8.21000 -9.60000 2.19000 3.11000 3.05000 0.00000 0.00000 0.00000 0.58000 0.28000 0.00000 -0.45000 0.00000 -0.93000 0.00000 2.38000 63.00000