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-15_1.PDB 5.62607 -12.15000 -2.11000 -3.77000 -8.76000 -3.77000 10.06000 -10.71000 0.89000 5.46000 3.49000 0.00000 0.00000 0.00000 0.22000 1.18000 0.00000 -1.36000 0.00000 -1.80000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_2.PDB 4.82392 -10.45000 -0.42000 -3.27000 -8.26000 -3.18000 8.81000 -10.22000 0.66000 4.88000 2.50000 0.00000 0.00000 0.00000 0.23000 1.33000 0.00000 -0.42000 0.00000 -1.77000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_3.PDB 4.54059 -7.98000 -0.41000 -1.19000 -7.21000 -1.54000 7.14000 -9.45000 0.44000 3.63000 2.86000 0.00000 0.00000 0.00000 0.12000 1.01000 0.00000 -0.83000 0.00000 -1.55000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_4.PDB 4.26947 -13.59000 -3.83000 -4.07000 -9.11000 -3.20000 11.31000 -10.44000 0.62000 6.30000 2.53000 0.00000 0.00000 0.00000 0.19000 1.07000 0.00000 -1.29000 0.00000 -2.60000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_5.PDB 4.63925 -9.89000 -0.42000 -3.14000 -8.07000 -3.13000 8.89000 -9.93000 0.62000 5.03000 2.50000 0.00000 0.00000 0.00000 0.18000 1.26000 0.00000 -0.62000 0.00000 -1.79000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_6.PDB 4.87453 -10.56000 -0.41000 -3.31000 -8.38000 -3.23000 9.10000 -10.41000 0.47000 5.40000 2.47000 0.00000 0.00000 0.00000 0.20000 1.17000 0.00000 -0.58000 0.00000 -1.87000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_7.PDB 4.93045 -9.93000 -0.36000 -2.17000 -8.44000 -3.74000 9.68000 -10.18000 0.90000 5.25000 2.53000 0.00000 0.00000 0.00000 0.20000 1.28000 0.00000 -1.29000 0.00000 -2.30000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_8.PDB 4.30215 -10.00000 -2.08000 -3.03000 -8.25000 -2.81000 9.69000 -9.97000 0.54000 5.55000 3.59000 0.00000 0.00000 0.00000 0.16000 1.14000 0.00000 -1.16000 0.00000 -2.21000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_9.PDB 4.65811 -10.29000 -0.39000 -3.05000 -8.19000 -3.26000 8.81000 -10.19000 0.54000 4.87000 2.60000 0.00000 0.00000 0.00000 0.20000 0.94000 0.00000 -0.44000 0.00000 -1.80000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_10.PDB 4.66154 -10.56000 -0.40000 -3.14000 -8.08000 -3.01000 8.64000 -10.04000 0.48000 4.61000 2.40000 0.00000 0.00000 0.00000 0.25000 1.12000 0.00000 -0.65000 0.00000 -1.61000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_11.PDB 4.84001 -11.70000 -2.09000 -3.97000 -8.51000 -4.08000 10.10000 -10.26000 0.86000 6.13000 3.50000 0.00000 0.00000 0.00000 0.13000 1.16000 0.00000 -1.35000 0.00000 -2.16000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_12.PDB 4.50465 -10.39000 -0.39000 -3.82000 -8.87000 -4.12000 10.25000 -10.59000 0.75000 6.77000 2.94000 0.00000 0.00000 0.00000 0.18000 1.27000 0.00000 -0.95000 0.00000 -2.52000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_13.PDB 4.35916 -10.29000 -0.40000 -3.01000 -8.30000 -3.38000 9.16000 -10.25000 0.48000 5.26000 2.59000 0.00000 0.00000 0.00000 0.15000 0.92000 0.00000 -0.60000 0.00000 -1.98000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_14.PDB 4.16071 -9.42000 -0.41000 -2.98000 -8.29000 -3.16000 9.49000 -10.09000 0.44000 5.27000 2.71000 0.00000 0.00000 0.00000 0.17000 1.31000 0.00000 -0.69000 0.00000 -1.87000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_15.PDB 4.40518 -10.23000 -0.43000 -2.94000 -8.24000 -3.41000 9.34000 -10.15000 0.41000 5.06000 2.44000 0.00000 0.00000 0.00000 0.19000 1.33000 0.00000 -0.60000 0.00000 -1.90000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_16.PDB 4.76871 -11.21000 -1.83000 -3.51000 -8.41000 -3.42000 9.59000 -10.28000 0.77000 5.39000 3.39000 0.00000 0.00000 0.00000 0.10000 0.98000 0.00000 -1.27000 0.00000 -1.73000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_17.PDB 4.42034 -8.08000 -1.29000 -2.17000 -8.49000 -3.22000 9.58000 -10.32000 2.14000 5.34000 3.62000 0.00000 0.00000 0.00000 0.13000 1.15000 0.00000 -1.50000 0.00000 -1.90000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_18.PDB 4.66171 -10.71000 -2.06000 -4.40000 -8.65000 -2.99000 10.54000 -10.43000 0.56000 6.63000 3.51000 0.00000 0.00000 0.00000 0.09000 1.16000 0.00000 -1.25000 0.00000 -2.27000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_19.PDB 5.41450 -10.48000 -0.40000 -2.36000 -8.01000 -4.15000 8.95000 -9.76000 0.89000 4.96000 2.24000 0.00000 0.00000 0.00000 0.20000 1.04000 0.00000 -0.73000 0.00000 -2.31000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_20.PDB 4.65661 -11.58000 -3.47000 -3.70000 -9.41000 -2.95000 11.47000 -11.02000 0.43000 6.42000 3.51000 0.00000 0.00000 0.00000 0.18000 1.25000 0.00000 -0.58000 0.00000 -2.47000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_21.PDB 4.39168 -10.78000 -0.41000 -3.15000 -8.15000 -3.30000 9.02000 -10.07000 0.46000 4.92000 2.47000 0.00000 0.00000 0.00000 0.15000 1.05000 0.00000 -0.80000 0.00000 -1.92000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_22.PDB 5.21909 -10.36000 -0.41000 -3.02000 -8.14000 -3.19000 8.90000 -10.14000 0.48000 4.94000 2.47000 0.00000 0.00000 0.00000 0.22000 0.96000 0.00000 -0.63000 0.00000 -1.83000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_23.PDB 4.48984 -13.26000 -2.11000 -4.25000 -9.61000 -4.88000 12.52000 -10.94000 0.56000 7.43000 2.62000 0.00000 0.00000 0.00000 0.19000 1.04000 0.00000 -1.77000 0.00000 -3.00000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_24.PDB 4.58911 -10.05000 -0.40000 -2.29000 -8.06000 -3.59000 9.01000 -9.86000 0.56000 4.90000 2.48000 0.00000 0.00000 0.00000 0.21000 1.03000 0.00000 -0.82000 0.00000 -2.19000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_25.PDB 4.53197 -9.84000 -2.07000 -3.79000 -8.12000 -1.69000 9.02000 -10.05000 0.57000 4.84000 3.45000 0.00000 0.00000 0.00000 0.20000 1.22000 0.00000 -1.00000 0.00000 -1.18000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_26.PDB 4.92496 -9.90000 -1.86000 -4.00000 -8.53000 -4.49000 10.88000 -9.53000 0.47000 6.95000 3.37000 0.00000 0.00000 0.00000 0.08000 1.25000 0.00000 -0.54000 0.00000 -2.71000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_27.PDB 4.28067 -10.34000 -0.42000 -2.94000 -8.44000 -3.21000 9.55000 -10.25000 0.58000 5.39000 2.25000 0.00000 0.00000 0.00000 0.18000 1.32000 0.00000 -1.14000 0.00000 -1.88000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_28.PDB 4.99063 -10.55000 -0.46000 -2.26000 -8.70000 -3.78000 9.44000 -10.85000 0.52000 5.61000 2.58000 0.00000 0.00000 0.00000 0.22000 1.40000 0.00000 -0.56000 0.00000 -2.31000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_29.PDB 5.57737 -12.52000 -2.10000 -3.82000 -8.64000 -3.90000 9.93000 -10.53000 0.84000 5.72000 2.67000 0.00000 0.00000 0.00000 0.10000 1.01000 0.00000 -1.00000 0.00000 -1.78000 0.00000 2.38000 67.00000 BEM1-D2_1GCQ-15_30.PDB 4.86996 -11.35000 -2.13000 -4.39000 -8.70000 -4.42000 10.89000 -10.25000 1.04000 6.88000 3.69000 0.00000 0.00000 0.00000 0.10000 0.99000 0.00000 -1.81000 0.00000 -2.25000 0.00000 2.38000 67.00000