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-D1_JO8-LCK-2_1.PDB 32.77000 -44.85000 -14.98000 -72.70000 -2.60000 93.30000 -90.15000 26.76000 37.26000 94.82000 0.00000 0.00000 0.00000 9.72000 17.95000 0.00000 -2.55000 0.00000 -1.27000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_2.PDB 32.33000 -44.70000 -15.52000 -70.75000 -3.10000 92.25000 -87.63000 27.32000 35.47000 94.87000 0.00000 0.00000 0.00000 8.78000 17.69000 0.00000 -3.10000 0.00000 -1.57000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_3.PDB 33.67000 -43.48000 -15.96000 -73.05000 -3.90000 93.40000 -90.41000 27.07000 38.15000 94.46000 0.00000 0.00000 0.00000 10.47000 18.06000 0.00000 -2.07000 0.00000 -1.03000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_4.PDB 32.56000 -44.91000 -15.11000 -71.02000 -2.80000 91.33000 -88.08000 25.67000 36.59000 94.20000 0.00000 0.00000 0.00000 9.99000 17.83000 0.00000 -2.21000 0.00000 -1.11000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_5.PDB 33.31000 -45.23000 -15.41000 -71.58000 -2.80000 92.56000 -88.67000 26.14000 37.07000 94.56000 0.00000 0.00000 0.00000 10.12000 17.84000 0.00000 -2.48000 0.00000 -0.95000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_6.PDB 34.03000 -45.25000 -15.40000 -70.35000 -2.87000 91.16000 -87.03000 26.82000 35.92000 94.44000 0.00000 0.00000 0.00000 10.03000 17.88000 0.00000 -2.21000 0.00000 -1.23000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_7.PDB 34.40000 -43.94000 -12.63000 -70.91000 -2.64000 91.47000 -88.36000 25.29000 34.46000 94.61000 0.00000 0.00000 0.00000 10.44000 17.63000 0.00000 -2.50000 0.00000 -0.89000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_8.PDB 34.25000 -44.02000 -14.15000 -71.13000 -3.01000 90.95000 -88.54000 27.53000 36.14000 95.09000 0.00000 0.00000 0.00000 9.22000 17.77000 0.00000 -2.65000 0.00000 -1.19000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_9.PDB 33.91000 -43.88000 -16.31000 -72.76000 -3.83000 94.22000 -90.11000 28.50000 37.20000 94.55000 0.00000 0.00000 0.00000 10.17000 17.96000 0.00000 -2.62000 0.00000 -1.23000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_10.PDB 31.73000 -45.08000 -15.23000 -72.45000 -3.14000 93.90000 -90.09000 26.23000 36.73000 94.38000 0.00000 0.00000 0.00000 10.36000 17.93000 0.00000 -2.65000 0.00000 -1.21000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_11.PDB 31.83000 -44.02000 -14.18000 -71.18000 -3.10000 90.96000 -88.33000 26.55000 35.68000 93.54000 0.00000 0.00000 0.00000 9.55000 17.92000 0.00000 -2.31000 0.00000 -1.34000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_12.PDB 33.23000 -41.21000 -14.36000 -72.45000 -2.71000 91.46000 -90.52000 27.05000 35.55000 94.33000 0.00000 0.00000 0.00000 9.37000 17.78000 0.00000 -1.95000 0.00000 -1.34000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_13.PDB 32.73000 -44.49000 -14.62000 -72.41000 -3.21000 92.56000 -90.05000 26.13000 37.54000 94.48000 0.00000 0.00000 0.00000 10.03000 17.99000 0.00000 -2.40000 0.00000 -0.83000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_14.PDB 32.30000 -44.07000 -16.92000 -72.87000 -3.47000 93.15000 -90.02000 27.95000 37.34000 95.09000 0.00000 0.00000 0.00000 10.69000 18.01000 0.00000 -2.62000 0.00000 -1.95000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_15.PDB 33.63000 -44.62000 -14.71000 -72.25000 -2.05000 91.54000 -90.12000 26.91000 36.91000 95.05000 0.00000 0.00000 0.00000 10.11000 17.81000 0.00000 -2.24000 0.00000 -0.90000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_16.PDB 33.62000 -41.92000 -14.95000 -73.99000 -3.96000 94.50000 -91.79000 27.17000 36.78000 95.02000 0.00000 0.00000 0.00000 10.90000 17.96000 0.00000 -2.61000 0.00000 -1.53000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_17.PDB 34.54000 -41.64000 -16.53000 -70.23000 -2.87000 91.13000 -87.41000 27.07000 36.00000 93.12000 0.00000 0.00000 0.00000 9.30000 17.49000 0.00000 -1.85000 0.00000 -1.53000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_18.PDB 34.49000 -42.58000 -16.96000 -72.80000 -3.78000 93.97000 -89.97000 27.04000 37.96000 94.96000 0.00000 0.00000 0.00000 10.25000 17.91000 0.00000 -2.12000 0.00000 -1.47000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_19.PDB 33.48000 -40.53000 -12.50000 -69.96000 -2.29000 88.59000 -87.68000 26.61000 33.61000 92.93000 0.00000 0.00000 0.00000 8.24000 17.63000 0.00000 -2.20000 0.00000 -1.34000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_20.PDB 35.54000 -42.66000 -16.90000 -72.82000 -3.75000 94.34000 -89.88000 27.88000 38.06000 94.92000 0.00000 0.00000 0.00000 9.97000 17.90000 0.00000 -2.21000 0.00000 -1.40000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_21.PDB 31.91000 -45.12000 -16.12000 -70.27000 -2.81000 91.27000 -87.32000 26.06000 37.32000 93.44000 0.00000 0.00000 0.00000 9.19000 17.55000 0.00000 -2.28000 0.00000 -1.46000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_22.PDB 33.95000 -44.62000 -15.68000 -71.03000 -2.96000 91.78000 -88.10000 28.89000 37.11000 93.40000 0.00000 0.00000 0.00000 9.20000 17.40000 0.00000 -2.68000 0.00000 -1.37000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_23.PDB 33.41000 -44.01000 -14.87000 -71.10000 -2.94000 91.58000 -88.42000 26.02000 36.43000 94.01000 0.00000 0.00000 0.00000 9.97000 17.86000 0.00000 -2.14000 0.00000 -1.12000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_24.PDB 32.81000 -40.30000 -13.86000 -71.66000 -4.24000 90.99000 -89.22000 26.33000 34.72000 93.31000 0.00000 0.00000 0.00000 9.98000 17.85000 0.00000 -2.04000 0.00000 -1.21000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_25.PDB 33.98000 -44.27000 -15.16000 -72.15000 -2.73000 92.15000 -89.39000 27.43000 36.66000 95.01000 0.00000 0.00000 0.00000 10.03000 17.87000 0.00000 -2.19000 0.00000 -1.41000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_26.PDB 32.40000 -44.66000 -15.52000 -71.95000 -2.40000 92.73000 -89.39000 26.79000 36.17000 94.40000 0.00000 0.00000 0.00000 10.46000 17.94000 0.00000 -2.86000 0.00000 -1.38000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_27.PDB 34.44000 -41.87000 -16.10000 -72.75000 -3.94000 93.07000 -90.61000 29.53000 36.91000 94.26000 0.00000 0.00000 0.00000 8.90000 17.92000 0.00000 -1.97000 0.00000 -1.00000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_28.PDB 33.48000 -40.32000 -13.36000 -72.78000 -3.75000 91.61000 -90.74000 26.97000 35.55000 93.99000 0.00000 0.00000 0.00000 9.61000 17.86000 0.00000 -2.11000 0.00000 -1.19000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_29.PDB 32.79000 -42.35000 -15.61000 -71.26000 -4.30000 92.17000 -87.96000 26.27000 37.40000 93.03000 0.00000 0.00000 0.00000 9.38000 17.54000 0.00000 -2.47000 0.00000 -1.50000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-2_30.PDB 32.48000 -42.73000 -12.93000 -70.99000 -2.28000 89.26000 -88.70000 26.55000 34.28000 93.98000 0.00000 0.00000 0.00000 9.16000 17.98000 0.00000 -2.02000 0.00000 -1.09000 0.00000 0.00000 66.00000