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 BEM1-D1_JO8-QCF-19_1.PDB 5.95324 -7.42000 -0.66000 -2.31000 -8.70000 -0.94000 9.63000 -10.88000 0.75000 3.65000 3.08000 0.00000 0.00000 0.00000 0.05000 0.51000 0.00000 -0.50000 0.00000 -0.61000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_2.PDB 5.88464 -6.84000 -0.61000 -1.87000 -8.52000 -0.67000 9.12000 -11.03000 0.52000 3.82000 3.21000 0.00000 0.00000 0.00000 0.06000 0.43000 0.00000 -0.42000 0.00000 -0.45000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_3.PDB 6.72568 -8.82000 -1.65000 -3.03000 -9.25000 -0.57000 9.62000 -12.14000 0.82000 4.92000 3.44000 0.00000 0.00000 0.00000 0.04000 0.61000 0.00000 -0.78000 0.00000 -0.24000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_4.PDB 6.03107 -10.13000 -0.76000 -3.72000 -9.01000 -0.57000 8.87000 -12.22000 0.71000 4.42000 3.04000 0.00000 0.00000 0.00000 0.03000 0.40000 0.00000 -0.75000 0.00000 -0.18000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_5.PDB 5.63949 -6.39000 -0.68000 -2.68000 -8.46000 -0.85000 9.80000 -10.74000 0.45000 4.96000 3.12000 0.00000 0.00000 0.00000 0.13000 0.35000 0.00000 -0.64000 0.00000 -0.81000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_6.PDB 6.68910 -5.89000 -0.57000 -1.98000 -8.06000 -0.69000 9.29000 -10.24000 0.51000 3.97000 3.17000 0.00000 0.00000 0.00000 0.11000 0.32000 0.00000 -0.77000 0.00000 -0.62000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_7.PDB 5.64718 -7.42000 -0.61000 -1.45000 -9.52000 -0.43000 9.41000 -12.62000 0.67000 4.29000 3.57000 0.00000 0.00000 0.00000 0.08000 0.46000 0.00000 -0.53000 0.00000 -0.27000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_8.PDB 6.22396 -7.25000 -0.59000 -2.65000 -9.83000 -0.57000 9.95000 -13.15000 1.74000 5.01000 3.71000 0.00000 0.00000 0.00000 0.05000 0.43000 0.00000 -0.59000 0.00000 -0.34000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_9.PDB 5.90660 -7.60000 -0.61000 -3.89000 -8.84000 -0.88000 10.10000 -11.30000 0.46000 5.12000 3.33000 0.00000 0.00000 0.00000 0.05000 0.40000 0.00000 -0.51000 0.00000 -0.63000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_10.PDB 5.96563 -7.74000 -0.85000 -2.06000 -8.63000 -0.44000 8.99000 -11.42000 0.47000 4.78000 2.73000 0.00000 0.00000 0.00000 0.05000 0.39000 0.00000 -0.92000 0.00000 -0.44000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_11.PDB 6.75268 -7.30000 -0.63000 -3.91000 -8.91000 -0.90000 10.50000 -11.45000 0.70000 5.09000 3.39000 0.00000 0.00000 0.00000 0.05000 0.42000 0.00000 -0.60000 0.00000 -0.63000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_12.PDB 7.15216 -8.08000 -0.74000 -2.39000 -9.27000 -0.47000 9.69000 -12.13000 1.01000 4.47000 3.06000 0.00000 0.00000 0.00000 0.11000 0.44000 0.00000 -0.94000 0.00000 -0.48000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_13.PDB 6.10544 -8.28000 -1.56000 -3.46000 -8.71000 -0.67000 10.03000 -11.64000 0.92000 5.47000 2.71000 0.00000 0.00000 0.00000 0.04000 0.52000 0.00000 -0.96000 0.00000 -0.46000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_14.PDB 5.55698 -7.52000 -0.56000 -2.45000 -9.44000 -1.17000 11.00000 -11.30000 0.78000 3.46000 3.30000 0.00000 0.00000 0.00000 0.09000 0.60000 0.00000 -0.56000 0.00000 -0.68000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_15.PDB 5.67910 -7.70000 -0.63000 -2.48000 -8.51000 -0.80000 9.45000 -10.73000 0.54000 3.69000 3.00000 0.00000 0.00000 0.00000 0.05000 0.50000 0.00000 -0.69000 0.00000 -0.58000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_16.PDB 4.86384 -7.39000 -0.73000 -2.08000 -9.09000 -0.49000 9.67000 -11.83000 0.49000 4.43000 3.22000 0.00000 0.00000 0.00000 0.11000 0.40000 0.00000 -0.61000 0.00000 -0.47000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_17.PDB 5.40071 -7.78000 -0.63000 -2.32000 -8.34000 -0.55000 8.77000 -10.96000 0.72000 3.48000 3.13000 0.00000 0.00000 0.00000 0.03000 0.47000 0.00000 -0.70000 0.00000 -0.43000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_18.PDB 5.47956 -7.55000 -0.59000 -2.41000 -9.54000 -0.67000 10.51000 -12.30000 0.56000 4.27000 3.64000 0.00000 0.00000 0.00000 0.04000 0.52000 0.00000 -0.59000 0.00000 -0.47000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_19.PDB 5.93017 -8.40000 -1.45000 -4.10000 -9.61000 -1.49000 11.70000 -11.46000 0.51000 5.51000 4.24000 0.00000 0.00000 0.00000 0.07000 0.65000 0.00000 -1.19000 0.00000 -1.13000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_20.PDB 4.88280 -5.64000 -0.78000 -1.82000 -8.31000 -0.63000 9.56000 -10.60000 0.64000 4.22000 3.08000 0.00000 0.00000 0.00000 0.03000 0.46000 0.00000 -0.50000 0.00000 -0.53000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_21.PDB 5.76620 -6.94000 -0.95000 -4.42000 -8.96000 -1.72000 11.57000 -10.45000 0.78000 5.49000 3.36000 0.00000 0.00000 0.00000 0.07000 0.46000 0.00000 -0.48000 0.00000 -1.23000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_22.PDB 7.49832 -9.54000 -0.68000 -8.07000 -9.62000 -0.84000 11.76000 -12.50000 1.05000 7.19000 3.29000 0.00000 0.00000 0.00000 0.08000 0.52000 0.00000 -0.76000 0.00000 -0.44000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_23.PDB 6.39631 -5.93000 -0.66000 -1.89000 -7.76000 -0.30000 8.09000 -10.28000 0.29000 3.77000 3.67000 0.00000 0.00000 0.00000 0.11000 0.32000 0.00000 -0.69000 0.00000 -0.26000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_24.PDB 5.71931 -9.22000 -0.76000 -3.96000 -9.39000 -0.68000 9.36000 -12.80000 1.64000 5.11000 3.33000 0.00000 0.00000 0.00000 0.05000 0.48000 0.00000 -0.74000 0.00000 -0.36000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_25.PDB 5.22537 -8.74000 -0.67000 -2.11000 -9.36000 -0.23000 9.12000 -12.54000 0.70000 4.31000 2.90000 0.00000 0.00000 0.00000 0.11000 0.36000 0.00000 -0.70000 0.00000 -0.27000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_26.PDB 7.10766 -9.30000 -1.60000 -4.76000 -9.36000 -0.66000 10.27000 -12.15000 0.92000 5.82000 3.47000 0.00000 0.00000 0.00000 0.04000 0.40000 0.00000 -1.06000 0.00000 -0.24000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_27.PDB 5.31228 -8.39000 -1.58000 -6.38000 -9.79000 -1.36000 12.60000 -12.25000 0.59000 8.24000 3.65000 0.00000 0.00000 0.00000 0.05000 0.55000 0.00000 -1.29000 0.00000 -0.87000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_28.PDB 5.53909 -9.83000 -1.60000 -4.42000 -9.82000 -0.70000 10.86000 -12.47000 0.93000 4.97000 3.62000 0.00000 0.00000 0.00000 0.04000 0.58000 0.00000 -0.88000 0.00000 -0.36000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_29.PDB 5.64519 -7.80000 -0.68000 -2.03000 -8.49000 -0.18000 8.71000 -11.52000 0.58000 3.83000 2.58000 0.00000 0.00000 0.00000 0.12000 0.32000 0.00000 -0.55000 0.00000 -0.17000 0.00000 2.38000 65.00000 BEM1-D1_JO8-QCF-19_30.PDB 6.57050 -8.50000 -2.05000 -3.79000 -9.40000 -1.21000 12.21000 -11.36000 0.60000 5.18000 3.10000 0.00000 0.00000 0.00000 0.04000 0.63000 0.00000 -0.96000 0.00000 -0.86000 0.00000 2.38000 65.00000