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-23_1.PDB 14.79000 -37.15000 -7.89000 -66.36000 -1.86000 80.00000 -86.39000 9.86000 32.57000 92.49000 0.00000 0.00000 0.00000 3.00000 21.67000 0.00000 -1.98000 0.00000 -1.52000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_2.PDB 13.64000 -37.64000 -8.44000 -66.84000 -3.03000 81.08000 -86.66000 9.99000 33.17000 93.16000 0.00000 0.00000 0.00000 3.13000 21.92000 0.00000 -2.53000 0.00000 -1.75000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_3.PDB 14.55000 -37.89000 -7.88000 -66.75000 -2.60000 81.26000 -86.39000 10.08000 32.33000 93.20000 0.00000 0.00000 0.00000 3.51000 21.78000 0.00000 -2.28000 0.00000 -2.05000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_4.PDB 13.51000 -38.03000 -8.57000 -66.55000 -2.83000 81.47000 -86.03000 10.01000 33.46000 92.16000 0.00000 0.00000 0.00000 2.88000 21.68000 0.00000 -2.50000 0.00000 -1.96000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_5.PDB 15.35000 -38.55000 -8.69000 -67.15000 -1.84000 81.45000 -86.91000 10.72000 33.84000 93.56000 0.00000 0.00000 0.00000 2.99000 21.93000 0.00000 -2.18000 0.00000 -1.89000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_6.PDB 13.48000 -37.94000 -8.41000 -66.35000 -2.07000 80.42000 -86.15000 9.82000 32.48000 92.00000 0.00000 0.00000 0.00000 3.38000 21.52000 0.00000 -2.14000 0.00000 -1.56000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_7.PDB 14.84000 -38.68000 -10.22000 -67.26000 -3.57000 82.69000 -86.72000 9.93000 34.85000 94.16000 0.00000 0.00000 0.00000 3.60000 21.98000 0.00000 -1.87000 0.00000 -2.06000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_8.PDB 14.43000 -39.44000 -10.04000 -66.62000 -2.64000 82.08000 -85.97000 9.91000 34.67000 93.44000 0.00000 0.00000 0.00000 3.28000 21.93000 0.00000 -2.66000 0.00000 -1.57000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_9.PDB 13.60000 -38.82000 -9.36000 -66.66000 -2.30000 81.12000 -86.41000 10.05000 33.12000 93.67000 0.00000 0.00000 0.00000 3.02000 21.72000 0.00000 -2.24000 0.00000 -1.58000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_10.PDB 15.90000 -39.77000 -9.49000 -65.96000 -1.82000 81.37000 -85.42000 10.27000 33.54000 94.08000 0.00000 0.00000 0.00000 2.98000 21.75000 0.00000 -2.19000 0.00000 -1.69000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_11.PDB 14.86000 -39.69000 -9.45000 -66.74000 -1.67000 81.31000 -86.22000 10.10000 34.30000 93.79000 0.00000 0.00000 0.00000 3.20000 21.89000 0.00000 -2.20000 0.00000 -1.87000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_12.PDB 15.07000 -38.31000 -8.79000 -66.63000 -1.76000 80.94000 -86.59000 10.01000 33.59000 93.36000 0.00000 0.00000 0.00000 3.01000 21.56000 0.00000 -2.03000 0.00000 -1.73000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_13.PDB 15.03000 -39.33000 -9.96000 -66.74000 -1.55000 81.17000 -86.42000 9.87000 34.01000 94.50000 0.00000 0.00000 0.00000 3.43000 22.00000 0.00000 -2.16000 0.00000 -1.82000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_14.PDB 14.28000 -39.89000 -10.30000 -66.95000 -2.04000 81.78000 -86.69000 10.76000 34.80000 93.84000 0.00000 0.00000 0.00000 3.28000 21.73000 0.00000 -2.39000 0.00000 -1.93000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_15.PDB 14.39000 -38.03000 -8.75000 -66.54000 -2.15000 80.71000 -86.47000 9.85000 33.71000 92.71000 0.00000 0.00000 0.00000 2.98000 21.85000 0.00000 -2.16000 0.00000 -1.49000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_16.PDB 14.63000 -40.33000 -10.25000 -66.80000 -3.22000 83.16000 -85.86000 9.99000 34.93000 94.32000 0.00000 0.00000 0.00000 3.31000 21.93000 0.00000 -2.63000 0.00000 -1.98000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_17.PDB 15.67000 -37.58000 -8.10000 -65.92000 -1.95000 79.44000 -86.02000 10.14000 32.99000 93.35000 0.00000 0.00000 0.00000 2.90000 21.60000 0.00000 -2.01000 0.00000 -1.57000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_18.PDB 15.92000 -40.12000 -9.90000 -66.66000 -1.70000 81.96000 -86.03000 9.92000 34.54000 94.57000 0.00000 0.00000 0.00000 3.32000 21.89000 0.00000 -2.28000 0.00000 -1.72000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_19.PDB 15.08000 -37.64000 -8.03000 -66.24000 -2.15000 79.81000 -86.27000 10.00000 32.93000 93.10000 0.00000 0.00000 0.00000 3.04000 21.88000 0.00000 -2.11000 0.00000 -1.35000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_20.PDB 15.78000 -37.62000 -8.35000 -65.78000 -1.94000 79.69000 -85.67000 10.10000 32.91000 93.20000 0.00000 0.00000 0.00000 2.85000 21.75000 0.00000 -1.88000 0.00000 -1.74000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_21.PDB 15.46000 -38.52000 -8.42000 -66.40000 -1.81000 80.67000 -86.19000 10.12000 33.22000 93.97000 0.00000 0.00000 0.00000 2.98000 21.73000 0.00000 -2.20000 0.00000 -1.95000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_22.PDB 15.60000 -37.46000 -7.84000 -66.04000 -1.74000 79.81000 -86.07000 10.07000 32.39000 93.27000 0.00000 0.00000 0.00000 2.93000 21.77000 0.00000 -2.19000 0.00000 -1.53000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_23.PDB 15.07000 -38.48000 -8.85000 -65.93000 -2.23000 80.52000 -85.39000 10.03000 33.86000 92.28000 0.00000 0.00000 0.00000 2.95000 21.59000 0.00000 -2.12000 0.00000 -1.57000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_24.PDB 15.10000 -38.44000 -7.87000 -66.77000 -1.87000 80.72000 -86.71000 10.27000 33.18000 93.35000 0.00000 0.00000 0.00000 3.14000 21.97000 0.00000 -2.25000 0.00000 -1.63000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_25.PDB 14.31000 -38.61000 -8.61000 -66.33000 -2.40000 81.19000 -85.94000 10.09000 32.86000 92.31000 0.00000 0.00000 0.00000 3.18000 21.50000 0.00000 -1.76000 0.00000 -1.68000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_26.PDB 15.65000 -38.64000 -9.12000 -66.84000 -3.17000 82.36000 -86.35000 9.91000 34.27000 93.92000 0.00000 0.00000 0.00000 3.25000 22.03000 0.00000 -2.19000 0.00000 -1.74000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_27.PDB 15.61000 -38.42000 -8.31000 -66.42000 -2.22000 80.63000 -86.23000 9.98000 32.76000 94.40000 0.00000 0.00000 0.00000 3.08000 21.87000 0.00000 -1.97000 0.00000 -1.65000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_28.PDB 14.85000 -37.16000 -6.52000 -66.45000 -0.94000 79.23000 -87.10000 9.96000 31.37000 92.44000 0.00000 0.00000 0.00000 2.76000 21.80000 0.00000 -2.04000 0.00000 -0.70000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_29.PDB 14.48000 -38.01000 -8.49000 -66.34000 -3.13000 81.03000 -85.68000 10.01000 33.50000 92.89000 0.00000 0.00000 0.00000 3.02000 21.82000 0.00000 -2.52000 0.00000 -1.79000 0.00000 0.00000 65.00000 BEM1-D2_1SEM-23_30.PDB 15.56000 -38.42000 -8.28000 -65.86000 -1.84000 80.35000 -85.45000 9.90000 32.68000 93.08000 0.00000 0.00000 0.00000 3.09000 21.54000 0.00000 -1.96000 0.00000 -1.72000 0.00000 0.00000 65.00000