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 BBC1_1TG0-12_1.PDB 2.50370 -5.99000 -0.90000 -0.93000 -5.92000 -1.56000 6.46000 -7.46000 1.03000 3.73000 1.32000 0.00000 0.00000 0.00000 0.12000 0.27000 0.00000 -0.63000 0.00000 -1.25000 0.00000 2.38000 69.00000 BBC1_1TG0-12_2.PDB 2.73339 -10.36000 -0.88000 -1.44000 -6.43000 -3.08000 6.62000 -7.65000 1.04000 3.14000 0.83000 0.00000 0.00000 0.00000 0.21000 0.62000 0.00000 -1.13000 0.00000 -1.59000 0.00000 2.38000 69.00000 BBC1_1TG0-12_3.PDB 2.82852 -9.94000 -0.96000 -1.43000 -6.75000 -3.18000 7.19000 -7.95000 1.25000 3.15000 0.97000 0.00000 0.00000 0.00000 0.23000 0.65000 0.00000 -0.69000 0.00000 -1.77000 0.00000 2.38000 69.00000 BBC1_1TG0-12_4.PDB 2.51118 -9.53000 -0.09000 -2.14000 -6.02000 -3.34000 6.23000 -7.02000 1.02000 3.39000 0.70000 0.00000 0.00000 0.00000 0.14000 0.60000 0.00000 -0.55000 0.00000 -1.85000 0.00000 2.38000 69.00000 BBC1_1TG0-12_5.PDB 2.76652 -7.53000 -0.10000 -1.50000 -6.98000 -1.48000 6.29000 -9.06000 1.89000 3.45000 1.61000 0.00000 0.00000 0.00000 0.15000 0.45000 0.00000 -0.37000 0.00000 -1.44000 0.00000 2.38000 69.00000 BBC1_1TG0-12_6.PDB 2.75962 -9.96000 -0.96000 -1.26000 -6.23000 -2.86000 6.56000 -7.47000 0.95000 3.05000 0.81000 0.00000 0.00000 0.00000 0.21000 0.59000 0.00000 -1.05000 0.00000 -1.69000 0.00000 2.38000 69.00000 BBC1_1TG0-12_7.PDB 2.63807 -9.05000 -0.99000 -2.13000 -6.33000 -2.73000 7.05000 -7.44000 1.30000 3.38000 0.80000 0.00000 0.00000 0.00000 0.18000 0.65000 0.00000 -0.55000 0.00000 -1.58000 0.00000 2.38000 69.00000 BBC1_1TG0-12_8.PDB 2.38821 -9.25000 -0.90000 -0.68000 -6.15000 -2.82000 5.92000 -7.21000 1.15000 2.89000 0.78000 0.00000 0.00000 0.00000 0.15000 0.66000 0.00000 -0.55000 0.00000 -1.82000 0.00000 2.38000 69.00000 BBC1_1TG0-12_9.PDB 2.76644 -8.02000 -0.59000 -2.64000 -7.25000 -1.64000 7.20000 -9.26000 2.43000 4.33000 1.61000 0.00000 0.00000 0.00000 0.14000 0.49000 0.00000 -0.96000 0.00000 -1.37000 0.00000 2.38000 69.00000 BBC1_1TG0-12_10.PDB 2.30693 -6.09000 -0.94000 -3.42000 -5.80000 -1.86000 6.52000 -7.00000 2.89000 3.76000 1.83000 0.00000 0.00000 0.00000 0.12000 0.43000 0.00000 -0.77000 0.00000 -1.43000 0.00000 2.38000 69.00000 BBC1_1TG0-12_11.PDB 2.58098 -6.38000 -0.62000 -1.65000 -5.57000 -1.66000 6.12000 -6.92000 0.72000 4.24000 0.92000 0.00000 0.00000 0.00000 0.11000 0.47000 0.00000 -0.59000 0.00000 -1.48000 0.00000 2.38000 69.00000 BBC1_1TG0-12_12.PDB 2.69083 -11.77000 -0.98000 -2.92000 -6.84000 -4.74000 7.75000 -7.65000 1.36000 4.70000 0.66000 0.00000 0.00000 0.00000 0.19000 0.63000 0.00000 -0.47000 0.00000 -2.82000 0.00000 2.38000 69.00000 BBC1_1TG0-12_13.PDB 2.90216 -11.88000 -1.03000 -1.27000 -7.21000 -4.71000 7.65000 -8.21000 0.98000 4.81000 0.60000 0.00000 0.00000 0.00000 0.25000 0.62000 0.00000 -1.04000 0.00000 -2.70000 0.00000 2.38000 69.00000 BBC1_1TG0-12_14.PDB 2.48756 -6.54000 -0.90000 -1.90000 -5.51000 -1.74000 6.01000 -6.93000 0.98000 4.03000 1.41000 0.00000 0.00000 0.00000 0.12000 0.40000 0.00000 -0.77000 0.00000 -1.35000 0.00000 2.38000 69.00000 BBC1_1TG0-12_15.PDB 3.24344 -8.94000 -0.94000 -1.33000 -6.76000 -3.06000 7.15000 -7.99000 1.70000 3.64000 0.98000 0.00000 0.00000 0.00000 0.17000 0.68000 0.00000 -0.83000 0.00000 -1.66000 0.00000 2.38000 69.00000 BBC1_1TG0-12_16.PDB 2.55323 -9.83000 -1.00000 -1.34000 -6.24000 -2.98000 6.40000 -7.44000 1.18000 3.14000 0.76000 0.00000 0.00000 0.00000 0.20000 0.68000 0.00000 -0.82000 0.00000 -1.71000 0.00000 2.38000 69.00000 BBC1_1TG0-12_17.PDB 2.82849 -11.93000 -1.01000 -3.19000 -6.95000 -4.61000 7.73000 -7.81000 1.30000 5.00000 0.68000 0.00000 0.00000 0.00000 0.20000 0.69000 0.00000 -0.51000 0.00000 -2.77000 0.00000 2.38000 69.00000 BBC1_1TG0-12_18.PDB 2.61943 -12.42000 -2.25000 -2.96000 -7.09000 -4.84000 8.82000 -7.85000 1.39000 4.70000 1.12000 0.00000 0.00000 0.00000 0.16000 0.72000 0.00000 -0.64000 0.00000 -2.98000 0.00000 2.38000 69.00000 BBC1_1TG0-12_19.PDB 1.89339 -9.82000 -1.04000 -1.31000 -5.88000 -2.94000 6.00000 -6.89000 0.86000 3.13000 0.74000 0.00000 0.00000 0.00000 0.15000 0.66000 0.00000 -0.98000 0.00000 -1.66000 0.00000 2.38000 69.00000 BBC1_1TG0-12_20.PDB 2.69290 -11.12000 -0.09000 -1.20000 -6.74000 -4.95000 6.59000 -7.69000 0.98000 4.59000 0.91000 0.00000 0.00000 0.00000 0.18000 0.56000 0.00000 -1.10000 0.00000 -2.60000 0.00000 2.38000 69.00000 BBC1_1TG0-12_21.PDB 3.03372 -12.08000 -1.11000 -1.10000 -7.34000 -5.03000 8.07000 -8.25000 0.96000 4.66000 0.71000 0.00000 0.00000 0.00000 0.22000 0.55000 0.00000 -1.00000 0.00000 -2.88000 0.00000 2.38000 69.00000 BBC1_1TG0-12_22.PDB 2.78695 -8.07000 -1.28000 -1.29000 -6.12000 -3.12000 7.29000 -7.31000 0.33000 5.17000 1.44000 0.00000 0.00000 0.00000 0.10000 0.43000 0.00000 -0.72000 0.00000 -2.57000 0.00000 2.38000 69.00000 BBC1_1TG0-12_23.PDB 2.39927 -5.90000 0.00000 -0.05000 -5.26000 -1.30000 4.89000 -6.84000 0.25000 3.16000 1.05000 0.00000 0.00000 0.00000 0.10000 0.25000 0.00000 -0.60000 0.00000 -1.30000 0.00000 2.38000 69.00000 BBC1_1TG0-12_24.PDB 2.45462 -6.37000 -0.90000 -0.93000 -6.05000 -1.86000 6.78000 -7.50000 1.05000 3.80000 1.45000 0.00000 0.00000 0.00000 0.11000 0.41000 0.00000 -0.88000 0.00000 -1.47000 0.00000 2.38000 69.00000 BBC1_1TG0-12_25.PDB 2.69414 -9.22000 -0.97000 -1.24000 -6.49000 -2.73000 6.62000 -7.77000 1.08000 3.32000 0.87000 0.00000 0.00000 0.00000 0.20000 0.63000 0.00000 -0.57000 0.00000 -1.54000 0.00000 2.38000 69.00000 BBC1_1TG0-12_26.PDB 1.97656 -7.43000 -0.95000 -2.65000 -5.81000 -3.39000 7.42000 -6.30000 0.88000 5.68000 1.13000 0.00000 0.00000 0.00000 0.15000 0.30000 0.00000 -0.85000 0.00000 -2.74000 0.00000 2.38000 69.00000 BBC1_1TG0-12_27.PDB 2.78066 -12.14000 -1.72000 -2.35000 -7.19000 -4.80000 8.25000 -8.02000 1.48000 4.58000 1.03000 0.00000 0.00000 0.00000 0.19000 0.73000 0.00000 -0.62000 0.00000 -2.98000 0.00000 2.38000 69.00000 BBC1_1TG0-12_28.PDB 2.72153 -9.75000 -0.56000 -1.47000 -6.51000 -4.31000 7.31000 -7.67000 0.38000 5.70000 1.20000 0.00000 0.00000 0.00000 0.17000 0.32000 0.00000 -1.25000 0.00000 -2.75000 0.00000 2.38000 69.00000 BBC1_1TG0-12_29.PDB 2.25313 -9.22000 -0.98000 -0.96000 -5.99000 -2.64000 6.04000 -7.16000 1.03000 2.92000 0.78000 0.00000 0.00000 0.00000 0.17000 0.60000 0.00000 -0.92000 0.00000 -1.51000 0.00000 2.38000 69.00000 BBC1_1TG0-12_30.PDB 2.22851 -9.15000 -1.06000 -1.55000 -6.08000 -3.16000 6.24000 -7.17000 1.84000 3.44000 0.74000 0.00000 0.00000 0.00000 0.17000 0.64000 0.00000 -0.74000 0.00000 -1.82000 0.00000 2.38000 69.00000