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-9_1.PDB 6.71890 -8.21000 -1.32000 -3.05000 -8.83000 -2.32000 10.34000 -10.46000 0.51000 6.59000 2.41000 0.00000 0.00000 0.00000 0.05000 0.61000 0.00000 -0.95000 0.00000 -1.18000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_2.PDB 7.11473 -8.18000 -0.52000 -2.26000 -8.12000 -2.20000 8.96000 -9.97000 0.57000 5.01000 2.13000 0.00000 0.00000 0.00000 0.14000 0.63000 0.00000 -0.71000 0.00000 -1.20000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_3.PDB 6.50129 -7.75000 -0.50000 -2.26000 -8.06000 -2.59000 9.47000 -9.64000 0.53000 5.46000 1.86000 0.00000 0.00000 0.00000 0.07000 0.47000 0.00000 -0.71000 0.00000 -1.39000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_4.PDB 6.73677 -8.90000 -0.53000 -2.35000 -8.23000 -1.97000 8.70000 -10.52000 0.49000 5.36000 1.90000 0.00000 0.00000 0.00000 0.08000 0.52000 0.00000 -0.86000 0.00000 -0.98000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_5.PDB 6.95875 -8.22000 -0.51000 -2.39000 -8.19000 -2.37000 9.29000 -9.84000 0.50000 5.22000 2.04000 0.00000 0.00000 0.00000 0.12000 0.63000 0.00000 -0.88000 0.00000 -1.21000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_6.PDB 7.11912 -7.72000 -0.50000 -2.28000 -7.69000 -2.28000 8.97000 -9.34000 0.50000 5.00000 1.99000 0.00000 0.00000 0.00000 0.14000 0.56000 0.00000 -0.90000 0.00000 -1.33000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_7.PDB 5.67436 -8.55000 -0.51000 -2.36000 -8.58000 -2.07000 9.53000 -10.84000 0.54000 5.35000 2.16000 0.00000 0.00000 0.00000 0.16000 0.70000 0.00000 -0.92000 0.00000 -1.00000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_8.PDB 6.29416 -7.58000 -0.50000 -2.37000 -8.21000 -2.27000 9.47000 -9.72000 0.50000 5.36000 2.03000 0.00000 0.00000 0.00000 0.03000 0.56000 0.00000 -0.64000 0.00000 -1.25000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_9.PDB 6.98220 -8.16000 -0.51000 -2.32000 -8.48000 -2.38000 9.61000 -10.06000 0.65000 5.48000 2.01000 0.00000 0.00000 0.00000 0.04000 0.55000 0.00000 -0.92000 0.00000 -1.29000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_10.PDB 6.56719 -8.99000 -0.50000 -4.68000 -8.21000 -2.15000 9.74000 -10.18000 0.41000 6.78000 1.78000 0.00000 0.00000 0.00000 0.10000 0.40000 0.00000 -1.00000 0.00000 -1.08000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_11.PDB 6.17192 -7.15000 -0.52000 -2.79000 -8.34000 -2.06000 9.60000 -9.96000 0.30000 6.01000 2.26000 0.00000 0.00000 0.00000 0.11000 0.54000 0.00000 -0.63000 0.00000 -1.14000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_12.PDB 6.80668 -6.53000 -0.52000 -1.45000 -7.94000 -2.54000 9.47000 -9.35000 0.45000 4.89000 2.20000 0.00000 0.00000 0.00000 0.16000 0.55000 0.00000 -0.59000 0.00000 -1.33000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_13.PDB 6.31972 -9.52000 -0.50000 -3.81000 -8.82000 -2.49000 9.95000 -11.05000 0.58000 5.81000 2.17000 0.00000 0.00000 0.00000 0.11000 0.50000 0.00000 -0.34000 0.00000 -1.13000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_14.PDB 6.40749 -7.68000 -0.52000 -2.36000 -8.18000 -2.25000 9.61000 -9.74000 0.42000 5.11000 2.19000 0.00000 0.00000 0.00000 0.16000 0.59000 0.00000 -0.87000 0.00000 -1.25000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_15.PDB 6.53851 -8.25000 -0.52000 -2.31000 -7.99000 -2.05000 8.70000 -10.14000 0.66000 5.15000 1.99000 0.00000 0.00000 0.00000 0.20000 0.53000 0.00000 -0.85000 0.00000 -1.09000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_16.PDB 6.15741 -7.08000 -0.51000 -2.29000 -7.45000 -2.06000 8.59000 -8.75000 0.44000 5.02000 1.91000 0.00000 0.00000 0.00000 0.03000 0.44000 0.00000 -0.69000 0.00000 -1.32000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_17.PDB 4.39599 -8.83000 -0.53000 -3.11000 -8.38000 -2.99000 9.94000 -9.83000 0.41000 6.02000 1.95000 0.00000 0.00000 0.00000 0.04000 0.50000 0.00000 -0.56000 0.00000 -1.81000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_18.PDB 6.71804 -8.41000 -0.51000 -3.12000 -8.18000 -1.98000 9.24000 -10.21000 0.48000 5.68000 1.93000 0.00000 0.00000 0.00000 0.04000 0.40000 0.00000 -0.76000 0.00000 -1.01000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_19.PDB 6.36376 -5.70000 -0.52000 -1.43000 -7.59000 -1.97000 9.06000 -9.02000 0.41000 4.55000 2.26000 0.00000 0.00000 0.00000 0.10000 0.51000 0.00000 -0.46000 0.00000 -1.10000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_20.PDB 6.02489 -5.72000 -0.52000 -1.40000 -7.03000 -1.95000 8.20000 -8.28000 0.34000 4.52000 1.95000 0.00000 0.00000 0.00000 0.03000 0.41000 0.00000 -0.35000 0.00000 -1.23000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_21.PDB 7.09382 -8.66000 -0.52000 -3.16000 -8.29000 -1.90000 9.05000 -10.46000 0.57000 5.67000 1.97000 0.00000 0.00000 0.00000 0.07000 0.43000 0.00000 -0.72000 0.00000 -0.94000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_22.PDB 6.02544 -8.51000 -0.51000 -2.37000 -8.55000 -2.11000 9.09000 -10.70000 0.60000 5.75000 1.95000 0.00000 0.00000 0.00000 0.05000 0.50000 0.00000 -0.75000 0.00000 -0.98000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_23.PDB 6.74429 -7.21000 -0.49000 -2.70000 -8.22000 -2.41000 9.95000 -9.67000 0.47000 5.87000 2.17000 0.00000 0.00000 0.00000 0.15000 0.60000 0.00000 -0.93000 0.00000 -1.39000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_24.PDB 6.95952 -8.62000 -0.50000 -3.17000 -8.71000 -2.04000 9.86000 -10.83000 0.39000 5.84000 2.21000 0.00000 0.00000 0.00000 0.16000 0.58000 0.00000 -0.79000 0.00000 -1.04000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_25.PDB 7.22109 -8.78000 -0.50000 -3.40000 -8.74000 -3.00000 10.29000 -10.54000 0.45000 6.52000 2.31000 0.00000 0.00000 0.00000 0.17000 0.66000 0.00000 -0.56000 0.00000 -1.78000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_26.PDB 6.54460 -8.18000 -0.51000 -3.05000 -8.09000 -2.17000 9.14000 -10.14000 0.42000 5.90000 1.98000 0.00000 0.00000 0.00000 0.08000 0.46000 0.00000 -0.61000 0.00000 -1.12000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_27.PDB 6.73588 -7.48000 -0.50000 -2.25000 -8.38000 -2.27000 9.75000 -9.97000 0.58000 5.43000 2.19000 0.00000 0.00000 0.00000 0.13000 0.55000 0.00000 -0.92000 0.00000 -1.28000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_28.PDB 6.30227 -7.43000 -0.52000 -2.65000 -7.75000 -2.07000 9.08000 -9.22000 0.42000 5.47000 2.08000 0.00000 0.00000 0.00000 0.19000 0.47000 0.00000 -1.19000 0.00000 -1.27000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_29.PDB 6.79645 -8.49000 -0.52000 -2.35000 -8.59000 -2.04000 9.31000 -10.72000 0.48000 5.60000 2.09000 0.00000 0.00000 0.00000 0.06000 0.55000 0.00000 -0.82000 0.00000 -0.99000 0.00000 2.38000 64.00000 BEM1-D1_JO8-QCF-9_30.PDB 6.48576 -8.32000 -0.52000 -3.27000 -8.06000 -1.80000 8.72000 -10.26000 0.38000 5.80000 2.22000 0.00000 0.00000 0.00000 0.06000 0.43000 0.00000 -0.63000 0.00000 -0.96000 0.00000 2.38000 64.00000