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-29_1.PDB 9.03000 -38.35000 -12.16000 -71.08000 -3.55000 86.49000 -91.98000 10.25000 36.47000 94.04000 0.00000 0.00000 0.00000 3.18000 21.59000 0.00000 -2.29000 0.00000 -1.99000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_2.PDB 9.59000 -38.53000 -12.73000 -71.02000 -3.63000 86.79000 -91.96000 10.22000 36.72000 93.97000 0.00000 0.00000 0.00000 3.95000 21.62000 0.00000 -2.19000 0.00000 -1.99000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_3.PDB 10.51000 -38.35000 -12.75000 -71.34000 -3.30000 86.76000 -92.20000 10.66000 36.71000 94.11000 0.00000 0.00000 0.00000 4.24000 21.60000 0.00000 -2.04000 0.00000 -1.99000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_4.PDB 9.34000 -38.70000 -12.28000 -70.98000 -3.70000 86.61000 -91.96000 10.42000 36.52000 93.99000 0.00000 0.00000 0.00000 3.42000 21.55000 0.00000 -2.04000 0.00000 -1.96000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_5.PDB 9.55000 -38.50000 -12.69000 -70.45000 -3.33000 85.69000 -91.25000 10.52000 35.87000 93.88000 0.00000 0.00000 0.00000 3.40000 21.49000 0.00000 -1.91000 0.00000 -1.69000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_6.PDB 9.96000 -39.34000 -13.90000 -71.01000 -3.59000 86.89000 -91.68000 10.11000 37.49000 95.41000 0.00000 0.00000 0.00000 3.94000 21.64000 0.00000 -2.20000 0.00000 -2.17000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_7.PDB 9.14000 -38.42000 -12.20000 -70.94000 -3.42000 85.70000 -91.77000 10.28000 35.81000 93.95000 0.00000 0.00000 0.00000 3.93000 21.70000 0.00000 -1.96000 0.00000 -1.81000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_8.PDB 10.38000 -38.85000 -12.51000 -71.82000 -4.19000 87.20000 -92.93000 11.57000 37.14000 94.84000 0.00000 0.00000 0.00000 4.30000 21.73000 0.00000 -2.01000 0.00000 -2.36000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_9.PDB 10.79000 -38.08000 -11.27000 -70.44000 -3.66000 86.08000 -91.26000 10.26000 35.38000 94.60000 0.00000 0.00000 0.00000 3.43000 21.49000 0.00000 -2.41000 0.00000 -1.85000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_10.PDB 10.23000 -37.88000 -11.76000 -71.15000 -3.41000 86.18000 -92.29000 10.22000 35.68000 95.30000 0.00000 0.00000 0.00000 3.42000 21.59000 0.00000 -2.10000 0.00000 -1.98000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_11.PDB 10.26000 -37.96000 -11.65000 -71.53000 -3.99000 86.72000 -92.61000 10.57000 36.66000 94.84000 0.00000 0.00000 0.00000 3.60000 21.52000 0.00000 -2.14000 0.00000 -2.25000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_12.PDB 11.96000 -39.84000 -10.35000 -70.44000 -1.66000 84.38000 -91.94000 10.94000 35.22000 95.37000 0.00000 0.00000 0.00000 3.55000 21.36000 0.00000 -1.91000 0.00000 -1.35000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_13.PDB 11.03000 -36.86000 -10.15000 -70.31000 -3.32000 84.48000 -91.52000 10.52000 33.93000 94.45000 0.00000 0.00000 0.00000 3.30000 21.38000 0.00000 -1.82000 0.00000 -1.68000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_14.PDB 9.68000 -38.57000 -12.55000 -71.38000 -4.11000 86.92000 -92.49000 10.30000 37.49000 94.63000 0.00000 0.00000 0.00000 4.03000 21.70000 0.00000 -2.31000 0.00000 -2.27000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_15.PDB 9.04000 -39.08000 -13.25000 -71.66000 -3.26000 86.50000 -92.58000 10.23000 37.30000 95.23000 0.00000 0.00000 0.00000 4.01000 21.68000 0.00000 -2.32000 0.00000 -2.07000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_16.PDB 10.89000 -38.13000 -12.06000 -70.99000 -3.44000 86.57000 -91.96000 10.25000 36.56000 94.80000 0.00000 0.00000 0.00000 3.43000 21.56000 0.00000 -2.03000 0.00000 -2.12000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_17.PDB 9.81000 -38.60000 -11.86000 -70.57000 -3.70000 85.74000 -91.44000 10.57000 35.76000 94.51000 0.00000 0.00000 0.00000 3.34000 21.49000 0.00000 -2.01000 0.00000 -1.92000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_18.PDB 10.05000 -39.52000 -12.80000 -71.74000 -2.99000 87.40000 -92.78000 10.53000 37.10000 95.76000 0.00000 0.00000 0.00000 3.34000 21.71000 0.00000 -2.35000 0.00000 -1.90000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_19.PDB 9.44000 -39.25000 -13.34000 -71.08000 -3.39000 86.35000 -91.58000 10.33000 37.08000 95.50000 0.00000 0.00000 0.00000 3.23000 21.71000 0.00000 -2.10000 0.00000 -2.30000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_20.PDB 9.12000 -38.30000 -12.48000 -70.72000 -3.63000 85.61000 -91.67000 10.14000 36.26000 94.50000 0.00000 0.00000 0.00000 3.43000 21.48000 0.00000 -2.13000 0.00000 -1.89000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_21.PDB 9.51000 -38.35000 -12.10000 -71.26000 -3.55000 86.17000 -92.37000 10.48000 36.81000 94.76000 0.00000 0.00000 0.00000 3.32000 21.65000 0.00000 -2.27000 0.00000 -2.11000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_22.PDB 9.25000 -39.37000 -13.42000 -70.73000 -3.33000 85.82000 -91.44000 10.11000 36.95000 95.19000 0.00000 0.00000 0.00000 3.53000 21.63000 0.00000 -2.01000 0.00000 -2.04000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_23.PDB 9.82000 -39.36000 -13.32000 -71.55000 -3.30000 87.39000 -92.38000 10.08000 37.85000 95.38000 0.00000 0.00000 0.00000 3.92000 21.65000 0.00000 -2.72000 0.00000 -2.16000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_24.PDB 9.91000 -38.79000 -12.80000 -71.47000 -3.16000 86.54000 -92.49000 10.64000 36.55000 95.63000 0.00000 0.00000 0.00000 3.63000 21.71000 0.00000 -2.40000 0.00000 -1.98000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_25.PDB 10.21000 -37.60000 -10.73000 -71.75000 -3.30000 85.82000 -93.35000 10.49000 35.30000 95.39000 0.00000 0.00000 0.00000 3.62000 21.63000 0.00000 -2.09000 0.00000 -1.60000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_26.PDB 10.52000 -40.30000 -15.25000 -71.15000 -3.33000 87.46000 -91.77000 10.73000 38.39000 96.75000 0.00000 0.00000 0.00000 3.91000 21.68000 0.00000 -2.52000 0.00000 -2.40000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_27.PDB 10.76000 -39.07000 -13.05000 -71.71000 -3.37000 87.25000 -92.58000 10.64000 37.87000 96.08000 0.00000 0.00000 0.00000 3.58000 21.72000 0.00000 -2.38000 0.00000 -2.51000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_28.PDB 10.37000 -39.10000 -13.23000 -70.84000 -3.61000 86.18000 -91.52000 10.36000 36.93000 96.02000 0.00000 0.00000 0.00000 3.80000 21.65000 0.00000 -2.31000 0.00000 -2.32000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_29.PDB 11.06000 -38.95000 -13.06000 -71.30000 -3.83000 87.70000 -92.07000 10.45000 37.75000 95.90000 0.00000 0.00000 0.00000 3.60000 21.68000 0.00000 -2.66000 0.00000 -2.48000 0.00000 0.00000 68.00000 BEM1-D2_1SEM-29_30.PDB 9.74000 -37.61000 -11.73000 -71.76000 -2.90000 86.03000 -93.38000 10.64000 35.49000 95.33000 0.00000 0.00000 0.00000 3.51000 21.57000 0.00000 -2.29000 0.00000 -1.58000 0.00000 0.00000 68.00000