name total energy Backbone Hbon 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-D2_1SEM-19_1.PDB 23.15000 -41.28000 -10.42000 -68.59000 -1.76000 86.30000 -88.65000 13.53000 33.86000 101.05000 0.00000 0.00000 0.00000 2.44000 21.47000 0.00000 -2.36000 0.00000 -0.96000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_2.PDB 22.12000 -42.31000 -10.94000 -69.57000 -2.46000 87.72000 -89.41000 12.65000 35.80000 101.10000 0.00000 0.00000 0.00000 3.21000 21.58000 0.00000 -2.12000 0.00000 -1.55000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_3.PDB 22.02000 -40.19000 -11.55000 -68.48000 -2.02000 85.72000 -88.11000 11.72000 34.17000 100.22000 0.00000 0.00000 0.00000 3.43000 21.30000 0.00000 -1.85000 0.00000 -1.05000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_4.PDB 24.28000 -38.59000 -7.69000 -69.11000 -1.78000 85.46000 -90.16000 12.15000 33.30000 100.80000 0.00000 0.00000 0.00000 3.13000 21.28000 0.00000 -2.43000 0.00000 -0.80000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_5.PDB 20.47000 -41.47000 -11.64000 -69.53000 -2.64000 87.32000 -89.47000 12.57000 35.93000 100.72000 0.00000 0.00000 0.00000 2.43000 21.48000 0.00000 -2.07000 0.00000 -1.68000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_6.PDB 22.38000 -39.44000 -9.19000 -69.40000 -1.96000 86.13000 -90.44000 12.08000 34.04000 101.06000 0.00000 0.00000 0.00000 3.00000 21.29000 0.00000 -2.30000 0.00000 -1.20000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_7.PDB 22.32000 -41.67000 -10.84000 -69.24000 -2.01000 86.89000 -89.63000 12.69000 34.28000 101.08000 0.00000 0.00000 0.00000 3.76000 21.33000 0.00000 -1.98000 0.00000 -1.02000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_8.PDB 22.43000 -41.00000 -10.06000 -69.16000 -2.04000 86.30000 -89.70000 12.64000 33.97000 102.26000 0.00000 0.00000 0.00000 2.30000 21.46000 0.00000 -2.00000 0.00000 -1.08000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_9.PDB 20.72000 -42.57000 -12.52000 -70.09000 -2.34000 88.41000 -90.33000 12.61000 36.37000 101.50000 0.00000 0.00000 0.00000 3.25000 21.41000 0.00000 -2.13000 0.00000 -1.43000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_10.PDB 21.55000 -41.09000 -10.54000 -69.88000 -2.04000 86.64000 -90.88000 13.16000 35.00000 102.03000 0.00000 0.00000 0.00000 2.73000 21.45000 0.00000 -2.14000 0.00000 -1.42000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_11.PDB 25.23000 -39.72000 -8.97000 -67.67000 -1.45000 84.51000 -87.54000 12.02000 33.69000 100.01000 0.00000 0.00000 0.00000 2.95000 21.22000 0.00000 -2.01000 0.00000 -0.62000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_12.PDB 21.17000 -41.87000 -12.72000 -68.48000 -1.88000 86.24000 -88.56000 12.50000 34.96000 101.70000 0.00000 0.00000 0.00000 2.36000 21.23000 0.00000 -1.99000 0.00000 -1.07000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_13.PDB 23.17000 -41.28000 -10.38000 -69.60000 -1.91000 87.52000 -89.70000 12.36000 34.59000 102.06000 0.00000 0.00000 0.00000 2.78000 21.94000 0.00000 -2.26000 0.00000 -1.03000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_14.PDB 25.97000 -37.98000 -7.46000 -68.00000 -1.56000 84.67000 -88.00000 11.79000 32.80000 99.17000 0.00000 0.00000 0.00000 3.10000 21.15000 0.00000 -1.73000 0.00000 -0.83000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_15.PDB 21.19000 -40.90000 -11.38000 -70.72000 -2.69000 89.35000 -90.67000 11.76000 36.06000 101.16000 0.00000 0.00000 0.00000 3.11000 21.98000 0.00000 -2.25000 0.00000 -1.64000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_16.PDB 21.22000 -42.13000 -12.96000 -69.68000 -2.73000 88.98000 -89.13000 11.86000 36.83000 100.89000 0.00000 0.00000 0.00000 3.05000 21.67000 0.00000 -2.11000 0.00000 -1.66000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_17.PDB 21.51000 -40.61000 -10.53000 -69.87000 -2.50000 87.68000 -90.10000 12.72000 35.16000 99.75000 0.00000 0.00000 0.00000 3.46000 21.36000 0.00000 -1.92000 0.00000 -1.72000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_18.PDB 21.79000 -41.05000 -10.45000 -69.83000 -2.58000 87.94000 -89.82000 12.39000 35.32000 100.39000 0.00000 0.00000 0.00000 3.08000 21.59000 0.00000 -1.86000 0.00000 -1.74000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_19.PDB 26.15000 -39.13000 -8.51000 -68.94000 -1.44000 85.03000 -89.70000 13.07000 34.05000 101.72000 0.00000 0.00000 0.00000 2.45000 21.18000 0.00000 -1.89000 0.00000 -0.56000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_20.PDB 22.02000 -42.56000 -12.03000 -69.32000 -1.73000 87.25000 -89.38000 12.57000 35.80000 101.89000 0.00000 0.00000 0.00000 2.71000 22.01000 0.00000 -2.22000 0.00000 -0.97000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_21.PDB 23.00000 -41.66000 -10.19000 -70.41000 -1.79000 87.64000 -91.36000 12.46000 34.90000 103.47000 0.00000 0.00000 0.00000 2.91000 21.69000 0.00000 -2.20000 0.00000 -0.78000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_22.PDB 22.44000 -39.35000 -10.89000 -68.03000 -1.88000 85.46000 -87.93000 12.17000 33.80000 99.89000 0.00000 0.00000 0.00000 2.40000 21.36000 0.00000 -2.15000 0.00000 -1.06000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_23.PDB 22.35000 -40.33000 -10.82000 -68.21000 -1.63000 85.86000 -88.06000 11.76000 33.62000 100.78000 0.00000 0.00000 0.00000 2.28000 21.50000 0.00000 -2.12000 0.00000 -0.79000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_24.PDB 24.30000 -39.69000 -8.19000 -68.86000 -0.87000 85.21000 -90.33000 12.45000 32.43000 101.56000 0.00000 0.00000 0.00000 3.02000 21.56000 0.00000 -1.84000 0.00000 -0.58000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_25.PDB 22.44000 -40.34000 -10.14000 -68.99000 -1.90000 86.61000 -89.15000 11.83000 34.13000 100.54000 0.00000 0.00000 0.00000 2.84000 21.41000 0.00000 -2.10000 0.00000 -0.89000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_26.PDB 21.57000 -39.54000 -10.28000 -68.81000 -2.07000 86.32000 -88.60000 11.96000 33.10000 100.24000 0.00000 0.00000 0.00000 2.66000 21.63000 0.00000 -2.08000 0.00000 -1.33000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_27.PDB 21.65000 -41.95000 -11.10000 -69.10000 -2.62000 87.54000 -88.61000 12.53000 35.65000 100.68000 0.00000 0.00000 0.00000 2.41000 21.36000 0.00000 -2.09000 0.00000 -1.69000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_28.PDB 22.74000 -40.65000 -10.35000 -70.23000 -1.85000 87.14000 -91.17000 12.17000 35.01000 103.08000 0.00000 0.00000 0.00000 3.12000 21.80000 0.00000 -2.45000 0.00000 -1.09000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_29.PDB 21.31000 -41.95000 -11.05000 -70.39000 -2.27000 88.82000 -90.40000 12.15000 36.04000 101.69000 0.00000 0.00000 0.00000 2.90000 22.04000 0.00000 -2.49000 0.00000 -1.73000 0.00000 0.00000 67.00000 BEM1-D2_1SEM-19_30.PDB 22.30000 -39.39000 -9.22000 -70.25000 -2.29000 86.89000 -91.44000 12.36000 34.13000 101.14000 0.00000 0.00000 0.00000 3.51000 21.33000 0.00000 -1.81000 0.00000 -1.32000 0.00000 0.00000 67.00000