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-21_1.PDB 33.28000 -44.89000 -11.16000 -72.11000 -2.13000 91.55000 -90.52000 24.11000 32.95000 98.54000 0.00000 0.00000 0.00000 9.33000 24.86000 0.00000 -1.89000 0.00000 -0.49000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_2.PDB 31.41000 -45.70000 -12.07000 -70.66000 -1.77000 91.29000 -88.32000 22.07000 32.15000 97.80000 0.00000 0.00000 0.00000 9.36000 24.41000 0.00000 -2.40000 0.00000 -0.34000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_3.PDB 37.87000 -45.69000 -10.84000 -71.06000 -1.25000 91.70000 -88.54000 22.19000 32.96000 99.78000 0.00000 0.00000 0.00000 11.37000 25.04000 0.00000 -2.51000 0.00000 -0.22000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_4.PDB 34.55000 -44.01000 -9.30000 -71.46000 -2.04000 91.37000 -89.09000 22.64000 31.74000 98.27000 0.00000 0.00000 0.00000 9.26000 24.63000 0.00000 -2.33000 0.00000 -0.50000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_5.PDB 36.28000 -44.82000 -11.09000 -71.20000 -1.26000 90.86000 -89.18000 22.89000 32.62000 100.04000 0.00000 0.00000 0.00000 10.09000 24.86000 0.00000 -2.46000 0.00000 -0.22000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_6.PDB 35.50000 -44.87000 -9.97000 -70.98000 -1.20000 91.20000 -88.59000 21.35000 31.99000 98.69000 0.00000 0.00000 0.00000 10.58000 24.98000 0.00000 -2.57000 0.00000 -0.13000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_7.PDB 37.37000 -43.15000 -11.64000 -71.20000 -2.56000 91.66000 -88.45000 21.18000 32.16000 99.76000 0.00000 0.00000 0.00000 12.19000 24.56000 0.00000 -2.03000 0.00000 -0.56000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_8.PDB 36.10000 -44.95000 -11.27000 -71.59000 -2.21000 92.81000 -89.18000 21.30000 32.52000 100.94000 0.00000 0.00000 0.00000 10.46000 24.59000 0.00000 -2.39000 0.00000 -0.34000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_9.PDB 33.61000 -45.48000 -11.54000 -70.28000 -1.74000 90.82000 -87.64000 21.92000 32.16000 99.04000 0.00000 0.00000 0.00000 8.81000 24.55000 0.00000 -2.04000 0.00000 -0.43000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_10.PDB 35.67000 -44.84000 -10.02000 -70.10000 -1.18000 89.96000 -87.59000 22.99000 31.39000 97.97000 0.00000 0.00000 0.00000 9.96000 24.84000 0.00000 -2.53000 0.00000 -0.33000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_11.PDB 30.60000 -45.73000 -11.99000 -70.86000 -1.71000 90.92000 -88.69000 21.85000 32.36000 97.68000 0.00000 0.00000 0.00000 9.37000 24.50000 0.00000 -2.28000 0.00000 -0.33000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_12.PDB 33.55000 -46.30000 -11.44000 -70.47000 -1.39000 90.82000 -87.99000 22.64000 32.99000 98.25000 0.00000 0.00000 0.00000 10.26000 24.95000 0.00000 -3.53000 0.00000 -0.29000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_13.PDB 35.41000 -43.99000 -9.34000 -70.26000 -2.05000 91.29000 -87.30000 21.37000 31.24000 98.05000 0.00000 0.00000 0.00000 9.13000 24.30000 0.00000 -2.28000 0.00000 -0.45000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_14.PDB 34.91000 -45.58000 -10.77000 -69.94000 -1.43000 90.73000 -87.33000 22.50000 32.47000 98.10000 0.00000 0.00000 0.00000 8.73000 24.58000 0.00000 -2.40000 0.00000 -0.17000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_15.PDB 34.82000 -45.67000 -10.85000 -69.09000 -1.23000 90.33000 -85.89000 21.01000 31.68000 96.57000 0.00000 0.00000 0.00000 10.56000 24.61000 0.00000 -2.50000 0.00000 -0.09000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_16.PDB 37.79000 -44.83000 -10.00000 -70.81000 -1.15000 90.75000 -88.29000 22.82000 32.02000 99.68000 0.00000 0.00000 0.00000 10.36000 24.90000 0.00000 -2.49000 0.00000 -0.27000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_17.PDB 38.75000 -45.68000 -11.97000 -71.37000 -1.26000 92.59000 -88.70000 22.97000 33.89000 100.01000 0.00000 0.00000 0.00000 11.22000 25.11000 0.00000 -2.75000 0.00000 -0.20000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_18.PDB 36.20000 -44.88000 -10.00000 -71.02000 -1.25000 90.75000 -88.85000 23.15000 32.01000 99.92000 0.00000 0.00000 0.00000 9.99000 25.03000 0.00000 -3.30000 0.00000 -0.32000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_19.PDB 34.13000 -45.73000 -12.55000 -71.17000 -1.43000 91.47000 -88.81000 21.32000 33.49000 98.51000 0.00000 0.00000 0.00000 11.62000 25.00000 0.00000 -2.43000 0.00000 -0.15000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_20.PDB 37.33000 -44.02000 -11.14000 -71.74000 -2.53000 91.79000 -89.42000 22.16000 32.30000 101.22000 0.00000 0.00000 0.00000 11.66000 24.80000 0.00000 -2.30000 0.00000 -0.65000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_21.PDB 36.89000 -45.68000 -11.97000 -71.42000 -1.56000 91.73000 -89.33000 23.72000 33.77000 100.16000 0.00000 0.00000 0.00000 10.23000 25.02000 0.00000 -2.52000 0.00000 -0.25000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_22.PDB 36.93000 -43.94000 -9.27000 -71.05000 -1.94000 91.74000 -88.27000 21.49000 31.77000 99.91000 0.00000 0.00000 0.00000 9.43000 24.28000 0.00000 -2.50000 0.00000 -0.44000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_23.PDB 39.75000 -44.82000 -11.11000 -70.81000 -1.30000 91.84000 -88.04000 21.72000 32.59000 101.78000 0.00000 0.00000 0.00000 10.60000 24.72000 0.00000 -2.51000 0.00000 -0.20000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_24.PDB 38.11000 -44.73000 -9.92000 -70.33000 -1.12000 91.19000 -87.50000 20.75000 31.63000 100.09000 0.00000 0.00000 0.00000 10.72000 24.43000 0.00000 -2.53000 0.00000 -0.14000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_25.PDB 39.23000 -45.63000 -10.85000 -70.47000 -1.51000 91.76000 -87.77000 22.04000 32.79000 100.90000 0.00000 0.00000 0.00000 10.62000 24.69000 0.00000 -2.33000 0.00000 -0.33000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_26.PDB 38.24000 -45.70000 -10.87000 -70.11000 -1.34000 91.37000 -87.14000 22.48000 32.39000 99.52000 0.00000 0.00000 0.00000 10.59000 24.96000 0.00000 -2.70000 0.00000 -0.26000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_27.PDB 33.84000 -45.55000 -10.82000 -70.51000 -1.53000 90.86000 -87.78000 22.22000 31.59000 99.25000 0.00000 0.00000 0.00000 9.04000 24.49000 0.00000 -2.55000 0.00000 -0.38000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_28.PDB 35.69000 -43.96000 -9.29000 -71.14000 -2.06000 91.18000 -88.66000 21.75000 31.88000 99.55000 0.00000 0.00000 0.00000 9.29000 24.20000 0.00000 -2.40000 0.00000 -0.45000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_29.PDB 39.02000 -44.80000 -11.11000 -70.89000 -1.42000 91.46000 -88.36000 22.31000 32.72000 101.43000 0.00000 0.00000 0.00000 10.33000 24.67000 0.00000 -2.46000 0.00000 -0.19000 0.00000 0.00000 66.00000 BEM1-D1_JO8-LCK-21_30.PDB 37.67000 -44.88000 -11.11000 -70.34000 -1.49000 90.99000 -87.52000 22.46000 32.12000 99.66000 0.00000 0.00000 0.00000 10.50000 25.00000 0.00000 -2.47000 0.00000 -0.26000 0.00000 0.00000 66.00000