name Intraclash total energy Backbone Hbond 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_1GCQ-16_1.PDB 3.62754 -4.12000 -0.96000 -0.88000 -8.24000 -0.32000 7.63000 -11.46000 2.21000 4.48000 4.41000 0.00000 0.00000 0.00000 0.11000 0.97000 0.00000 -0.75000 0.00000 -0.36000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_2.PDB 3.21304 -3.36000 -0.04000 -0.09000 -8.06000 -0.35000 7.44000 -11.40000 2.18000 3.51000 4.23000 0.00000 0.00000 0.00000 0.02000 0.91000 0.00000 -0.42000 0.00000 -0.39000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_3.PDB 2.97586 -3.94000 -0.10000 -0.00000 -8.58000 -0.29000 7.23000 -12.62000 2.95000 3.84000 4.37000 0.00000 0.00000 0.00000 0.04000 1.18000 0.00000 -0.48000 0.00000 -0.30000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_4.PDB 3.45434 -4.18000 -0.97000 -0.88000 -7.97000 -0.35000 7.27000 -11.20000 2.31000 4.21000 4.41000 0.00000 0.00000 0.00000 0.07000 1.03000 0.00000 -0.72000 0.00000 -0.36000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_5.PDB 3.39359 -3.49000 -0.08000 -0.09000 -7.79000 -0.39000 7.17000 -11.18000 2.18000 3.29000 4.16000 0.00000 0.00000 0.00000 0.08000 0.96000 0.00000 -0.45000 0.00000 -0.37000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_6.PDB 3.20430 -3.76000 -0.08000 -0.00000 -7.73000 -0.30000 6.73000 -11.43000 2.43000 3.20000 4.15000 0.00000 0.00000 0.00000 0.02000 1.11000 0.00000 -0.46000 0.00000 -0.28000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_7.PDB 3.64831 -3.41000 -0.92000 -0.88000 -8.11000 0.16000 7.26000 -11.30000 2.23000 4.43000 4.25000 0.00000 0.00000 0.00000 0.05000 1.06000 0.00000 -0.70000 0.00000 0.13000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_8.PDB 3.56506 -3.76000 -0.96000 -0.88000 -8.37000 -0.36000 7.82000 -11.65000 2.52000 4.55000 4.59000 0.00000 0.00000 0.00000 0.06000 1.07000 0.00000 -0.69000 0.00000 -0.40000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_9.PDB 3.15027 -3.18000 -0.04000 -0.09000 -8.11000 -0.36000 7.52000 -11.48000 2.25000 3.56000 4.38000 0.00000 0.00000 0.00000 0.02000 0.91000 0.00000 -0.43000 0.00000 -0.40000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_10.PDB 3.29554 -2.69000 -0.04000 -0.09000 -7.80000 0.15000 6.97000 -11.11000 2.28000 3.31000 3.93000 0.00000 0.00000 0.00000 0.02000 0.94000 0.00000 -0.45000 0.00000 0.13000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_11.PDB 3.69152 -4.00000 -0.95000 -0.87000 -8.16000 -0.35000 7.58000 -11.40000 2.28000 4.38000 4.46000 0.00000 0.00000 0.00000 0.09000 0.95000 0.00000 -0.71000 0.00000 -0.37000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_12.PDB 3.20759 -3.34000 -0.04000 -0.09000 -8.19000 -0.35000 7.54000 -11.60000 2.21000 3.56000 4.43000 0.00000 0.00000 0.00000 0.03000 0.91000 0.00000 -0.44000 0.00000 -0.39000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_13.PDB 3.39986 -2.77000 -0.92000 -0.88000 -8.05000 -0.37000 7.71000 -11.08000 3.13000 4.32000 4.43000 0.00000 0.00000 0.00000 0.04000 0.99000 0.00000 -0.71000 0.00000 -0.38000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_14.PDB 3.26202 -3.58000 -0.05000 0.00000 -8.19000 -0.32000 7.15000 -12.00000 2.76000 3.56000 4.28000 0.00000 0.00000 0.00000 0.05000 1.16000 0.00000 -0.48000 0.00000 -0.34000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_15.PDB 3.21974 -3.08000 -0.05000 0.00000 -8.12000 0.18000 6.76000 -11.99000 2.77000 3.57000 4.01000 0.00000 0.00000 0.00000 0.03000 1.22000 0.00000 -0.47000 0.00000 0.22000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_16.PDB 3.24907 -2.18000 -0.04000 -0.09000 -7.84000 -0.33000 7.36000 -11.07000 3.15000 3.33000 4.18000 0.00000 0.00000 0.00000 0.02000 0.94000 0.00000 -0.48000 0.00000 -0.37000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_17.PDB 3.30984 -3.66000 -0.96000 -0.88000 -7.56000 0.11000 6.67000 -10.84000 2.24000 3.97000 4.17000 0.00000 0.00000 0.00000 0.04000 1.13000 0.00000 -0.75000 0.00000 0.12000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_18.PDB 3.12958 -2.58000 -0.05000 0.00000 -7.06000 -0.28000 6.46000 -10.46000 2.53000 2.99000 3.97000 0.00000 0.00000 0.00000 0.04000 0.93000 0.00000 -0.45000 0.00000 -0.29000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_19.PDB 4.79496 -4.24000 -0.96000 -0.89000 -8.90000 -0.62000 8.83000 -12.28000 2.29000 5.02000 4.47000 0.00000 0.00000 0.00000 0.11000 0.94000 0.00000 -0.85000 0.00000 -0.46000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_20.PDB 3.42156 -4.14000 -0.97000 -0.88000 -8.00000 -0.39000 7.42000 -11.23000 2.24000 4.22000 4.51000 0.00000 0.00000 0.00000 0.04000 1.05000 0.00000 -0.73000 0.00000 -0.38000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_21.PDB 4.72986 -3.47000 -0.04000 -0.09000 -8.64000 -0.51000 8.29000 -12.15000 2.40000 3.95000 4.08000 0.00000 0.00000 0.00000 0.04000 0.71000 0.00000 -0.39000 0.00000 -0.39000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_22.PDB 3.44004 -2.97000 -0.08000 -0.09000 -7.63000 0.16000 6.66000 -11.03000 2.25000 3.10000 3.93000 0.00000 0.00000 0.00000 0.05000 1.06000 0.00000 -0.43000 0.00000 0.14000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_23.PDB 3.19056 -4.10000 -0.07000 -0.09000 -7.77000 -0.50000 6.69000 -11.27000 2.60000 3.21000 3.75000 0.00000 0.00000 0.00000 0.04000 0.96000 0.00000 -0.22000 0.00000 -0.46000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_24.PDB 3.49536 -4.27000 -0.96000 -0.88000 -8.03000 -0.39000 7.40000 -11.30000 2.17000 4.26000 4.53000 0.00000 0.00000 0.00000 0.08000 1.04000 0.00000 -0.76000 0.00000 -0.38000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_25.PDB 4.17549 -4.56000 -0.92000 -0.91000 -8.94000 -0.35000 8.35000 -12.50000 2.53000 4.94000 4.32000 0.00000 0.00000 0.00000 0.05000 0.99000 0.00000 -0.69000 0.00000 -0.44000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_26.PDB 4.01737 -4.00000 -0.90000 -0.84000 -8.53000 -0.39000 8.04000 -12.01000 2.32000 4.74000 4.81000 0.00000 0.00000 0.00000 0.04000 1.07000 0.00000 -0.83000 0.00000 -0.44000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_27.PDB 3.98485 -2.75000 -0.06000 0.00000 -8.20000 -0.27000 6.99000 -12.06000 3.74000 3.58000 4.27000 0.00000 0.00000 0.00000 0.03000 1.22000 0.00000 -0.49000 0.00000 -0.29000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_28.PDB 4.10280 -2.73000 -0.08000 -0.09000 -7.42000 -0.37000 6.93000 -10.76000 2.21000 3.32000 4.31000 0.00000 0.00000 0.00000 0.01000 0.95000 0.00000 -0.39000 0.00000 -0.41000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_29.PDB 3.20688 -3.55000 -0.08000 -0.09000 -7.84000 -0.40000 7.14000 -11.29000 2.19000 3.30000 4.33000 0.00000 0.00000 0.00000 0.04000 0.96000 0.00000 -0.45000 0.00000 -0.40000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-16_30.PDB 3.97125 -3.99000 -0.04000 -0.12000 -8.99000 -0.37000 8.35000 -12.65000 2.46000 4.15000 4.05000 0.00000 0.00000 0.00000 0.03000 0.83000 0.00000 -0.41000 0.00000 -0.45000 0.00000 2.38000 67.00000