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_2SRC-12_1.PDB 4.23652 -8.96000 -0.29000 -0.27000 -5.23000 -1.73000 3.36000 -8.26000 0.20000 3.90000 1.37000 0.00000 0.00000 0.00000 0.06000 0.49000 0.00000 -0.16000 0.00000 -1.90000 0.00000 2.38000 68.00000 BBC1_2SRC-12_2.PDB 3.53670 -9.17000 -0.19000 -0.85000 -5.35000 -1.33000 3.28000 -8.52000 0.15000 4.03000 1.24000 0.00000 0.00000 0.00000 0.06000 0.47000 0.00000 -0.12000 0.00000 -1.56000 0.00000 2.38000 68.00000 BBC1_2SRC-12_3.PDB 3.41129 -9.24000 -0.15000 -0.91000 -5.23000 -1.26000 3.17000 -8.39000 0.17000 3.74000 1.22000 0.00000 0.00000 0.00000 0.08000 0.48000 0.00000 -0.17000 0.00000 -1.50000 0.00000 2.38000 68.00000 BBC1_2SRC-12_4.PDB 4.19430 -8.39000 -0.19000 -0.16000 -5.06000 -1.55000 3.36000 -8.02000 0.13000 3.87000 1.01000 0.00000 0.00000 0.00000 0.08000 0.50000 0.00000 -0.20000 0.00000 -1.67000 0.00000 2.38000 68.00000 BBC1_2SRC-12_5.PDB 6.38256 -9.12000 -0.26000 -1.65000 -5.92000 -1.53000 4.27000 -8.80000 0.31000 4.75000 1.67000 0.00000 0.00000 0.00000 0.13000 0.48000 0.00000 -0.34000 0.00000 -1.75000 0.00000 2.38000 68.00000 BBC1_2SRC-12_6.PDB 5.44688 -9.05000 -0.27000 -1.07000 -5.76000 -1.67000 4.02000 -8.67000 0.32000 4.48000 1.52000 0.00000 0.00000 0.00000 0.08000 0.48000 0.00000 -0.24000 0.00000 -1.79000 0.00000 2.38000 68.00000 BBC1_2SRC-12_7.PDB 6.28480 -8.83000 -0.27000 -1.75000 -5.79000 -1.41000 4.01000 -8.74000 0.51000 4.74000 1.59000 0.00000 0.00000 0.00000 0.06000 0.51000 0.00000 -0.20000 0.00000 -1.58000 0.00000 2.38000 68.00000 BBC1_2SRC-12_8.PDB 6.33434 -9.02000 -0.22000 -1.85000 -5.70000 -1.62000 4.12000 -8.58000 0.25000 4.85000 1.65000 0.00000 0.00000 0.00000 0.09000 0.49000 0.00000 -0.26000 0.00000 -1.74000 0.00000 2.38000 68.00000 BBC1_2SRC-12_9.PDB 3.44170 -9.11000 -0.19000 -0.16000 -5.32000 -1.44000 3.28000 -8.49000 0.15000 3.53000 1.22000 0.00000 0.00000 0.00000 0.10000 0.50000 0.00000 -0.17000 0.00000 -1.62000 0.00000 2.38000 68.00000 BBC1_2SRC-12_10.PDB 4.85525 -8.46000 -0.37000 -0.34000 -4.93000 -1.60000 3.23000 -7.61000 0.30000 3.45000 1.22000 0.00000 0.00000 0.00000 0.08000 0.45000 0.00000 -0.18000 0.00000 -1.71000 0.00000 2.38000 68.00000 BBC1_2SRC-12_11.PDB 3.77847 -8.33000 -0.33000 -1.18000 -4.93000 -1.18000 3.18000 -7.84000 0.21000 4.02000 1.19000 0.00000 0.00000 0.00000 0.05000 0.47000 0.00000 -0.09000 0.00000 -1.42000 0.00000 2.38000 68.00000 BBC1_2SRC-12_12.PDB 4.51487 -8.17000 -0.27000 -0.26000 -4.90000 -1.62000 3.26000 -7.55000 0.28000 3.48000 1.21000 0.00000 0.00000 0.00000 0.08000 0.46000 0.00000 -0.16000 0.00000 -1.71000 0.00000 2.38000 68.00000 BBC1_2SRC-12_13.PDB 4.55674 -8.59000 -0.21000 -0.16000 -5.19000 -1.59000 3.39000 -7.99000 0.22000 3.45000 1.37000 0.00000 0.00000 0.00000 0.09000 0.51000 0.00000 -0.24000 0.00000 -1.73000 0.00000 2.38000 68.00000 BBC1_2SRC-12_14.PDB 3.51417 -9.27000 -0.19000 -1.04000 -5.39000 -1.24000 3.31000 -8.57000 0.16000 3.95000 1.24000 0.00000 0.00000 0.00000 0.09000 0.51000 0.00000 -0.15000 0.00000 -1.46000 0.00000 2.38000 68.00000 BBC1_2SRC-12_15.PDB 4.51125 -9.13000 -0.19000 -0.16000 -5.40000 -1.48000 3.27000 -8.61000 0.20000 3.78000 1.19000 0.00000 0.00000 0.00000 0.09000 0.47000 0.00000 -0.20000 0.00000 -1.64000 0.00000 2.38000 68.00000 BBC1_2SRC-12_16.PDB 4.91280 -8.64000 -0.24000 -1.75000 -5.51000 -1.49000 3.90000 -8.37000 0.23000 4.77000 1.57000 0.00000 0.00000 0.00000 0.08000 0.42000 0.00000 -0.22000 0.00000 -1.61000 0.00000 2.38000 68.00000 BBC1_2SRC-12_17.PDB 4.49937 -7.76000 -0.19000 -0.16000 -4.84000 -1.64000 3.39000 -7.40000 0.21000 3.49000 1.20000 0.00000 0.00000 0.00000 0.08000 0.49000 0.00000 -0.18000 0.00000 -1.74000 0.00000 2.38000 68.00000 BBC1_2SRC-12_18.PDB 4.73669 -8.69000 -0.19000 -1.04000 -5.29000 -2.29000 4.16000 -7.71000 0.21000 4.66000 1.53000 0.00000 0.00000 0.00000 0.08000 0.45000 0.00000 -0.27000 0.00000 -2.54000 0.00000 2.38000 68.00000 BBC1_2SRC-12_19.PDB 4.60085 -8.30000 -0.19000 -0.16000 -5.50000 -1.57000 3.86000 -8.29000 0.23000 3.88000 1.33000 0.00000 0.00000 0.00000 0.09000 0.42000 0.00000 -0.30000 0.00000 -1.68000 0.00000 2.38000 68.00000 BBC1_2SRC-12_20.PDB 6.16723 -10.42000 -0.33000 -2.51000 -5.68000 -4.36000 6.09000 -7.58000 0.34000 5.48000 1.53000 0.00000 0.00000 0.00000 0.11000 0.52000 0.00000 -0.33000 0.00000 -3.18000 0.00000 2.38000 68.00000 BBC1_2SRC-12_21.PDB 5.26069 -8.91000 -0.30000 -1.11000 -5.76000 -1.68000 4.21000 -8.64000 0.29000 4.32000 1.64000 0.00000 0.00000 0.00000 0.19000 0.48000 0.00000 -0.34000 0.00000 -1.74000 0.00000 2.38000 68.00000 BBC1_2SRC-12_22.PDB 6.39363 -10.30000 -0.22000 -1.62000 -5.85000 -4.08000 5.74000 -7.99000 0.38000 5.09000 1.30000 0.00000 0.00000 0.00000 0.13000 0.50000 0.00000 -0.20000 0.00000 -2.99000 0.00000 2.38000 68.00000 BBC1_2SRC-12_23.PDB 4.68945 -7.72000 -0.19000 -0.96000 -5.41000 -1.56000 4.06000 -8.10000 0.20000 4.54000 1.57000 0.00000 0.00000 0.00000 0.09000 0.45000 0.00000 -0.30000 0.00000 -1.65000 0.00000 2.38000 68.00000 BBC1_2SRC-12_24.PDB 5.90697 -9.77000 -0.22000 -0.98000 -5.31000 -3.52000 4.39000 -7.55000 0.23000 5.00000 1.26000 0.00000 0.00000 0.00000 0.09000 0.47000 0.00000 -0.47000 0.00000 -2.68000 0.00000 2.38000 68.00000 BBC1_2SRC-12_25.PDB 4.11174 -8.90000 -0.29000 -0.26000 -5.16000 -1.59000 3.28000 -8.24000 0.14000 3.72000 1.32000 0.00000 0.00000 0.00000 0.08000 0.39000 0.00000 -0.17000 0.00000 -1.73000 0.00000 2.38000 68.00000 BBC1_2SRC-12_26.PDB 4.40841 -8.87000 -0.19000 -0.64000 -5.30000 -1.39000 3.22000 -8.46000 0.27000 3.98000 1.38000 0.00000 0.00000 0.00000 0.06000 0.44000 0.00000 -0.16000 0.00000 -1.63000 0.00000 2.38000 68.00000 BBC1_2SRC-12_27.PDB 4.09562 -8.98000 -0.19000 -0.81000 -5.23000 -1.26000 3.12000 -8.41000 0.19000 3.88000 1.27000 0.00000 0.00000 0.00000 0.07000 0.40000 0.00000 -0.14000 0.00000 -1.47000 0.00000 2.38000 68.00000 BBC1_2SRC-12_28.PDB 3.99953 -8.68000 -0.17000 -0.49000 -5.20000 -1.46000 3.28000 -8.30000 0.13000 3.89000 1.38000 0.00000 0.00000 0.00000 0.08000 0.41000 0.00000 -0.15000 0.00000 -1.66000 0.00000 2.38000 68.00000 BBC1_2SRC-12_29.PDB 3.14859 -8.74000 -0.19000 -0.80000 -5.32000 -1.09000 3.23000 -8.47000 0.18000 3.87000 1.21000 0.00000 0.00000 0.00000 0.07000 0.44000 0.00000 -0.09000 0.00000 -1.33000 0.00000 2.38000 68.00000 BBC1_2SRC-12_30.PDB 4.21019 -8.62000 -0.19000 -0.16000 -5.37000 -1.41000 3.45000 -8.47000 0.18000 3.75000 1.27000 0.00000 0.00000 0.00000 0.10000 0.42000 0.00000 -0.21000 0.00000 -1.56000 0.00000 2.38000 68.00000