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_1ZUK2-27_1.PDB 4.53126 -12.34000 -3.04000 -4.53000 -10.06000 -4.41000 12.21000 -11.87000 3.28000 7.85000 2.23000 0.00000 0.00000 0.00000 0.21000 1.34000 0.00000 -0.65000 0.00000 -3.57000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_2.PDB 4.32322 -13.10000 -3.06000 -4.96000 -9.83000 -5.08000 12.59000 -11.45000 2.71000 8.02000 2.28000 0.00000 0.00000 0.00000 0.15000 1.17000 0.00000 -0.52000 0.00000 -3.95000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_3.PDB 4.41222 -12.36000 -3.09000 -3.83000 -10.09000 -5.20000 12.55000 -11.75000 2.95000 7.80000 3.00000 0.00000 0.00000 0.00000 0.19000 1.31000 0.00000 -0.80000 0.00000 -4.09000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_4.PDB 3.25511 -11.45000 -2.83000 -4.39000 -9.62000 -4.79000 12.81000 -11.03000 2.43000 7.29000 2.58000 0.00000 0.00000 0.00000 0.08000 1.31000 0.00000 -0.38000 0.00000 -3.60000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_5.PDB 3.73491 -11.24000 -3.00000 -3.82000 -10.07000 -4.15000 11.52000 -11.84000 3.55000 7.89000 2.52000 0.00000 0.00000 0.00000 0.26000 1.29000 0.00000 -0.60000 0.00000 -3.49000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_6.PDB 3.55496 -11.43000 -2.16000 -2.99000 -9.21000 -3.98000 10.15000 -11.52000 1.99000 7.85000 2.89000 0.00000 0.00000 0.00000 0.11000 1.04000 0.00000 -0.72000 0.00000 -3.83000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_7.PDB 3.56372 -10.92000 -2.92000 -3.79000 -9.43000 -3.69000 10.69000 -11.58000 3.17000 7.76000 2.78000 0.00000 0.00000 0.00000 0.05000 1.29000 0.00000 -0.23000 0.00000 -3.73000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_8.PDB 3.01236 -10.71000 -2.01000 -2.07000 -9.32000 -4.35000 10.87000 -11.18000 1.85000 7.12000 2.98000 0.00000 0.00000 0.00000 0.12000 0.98000 0.00000 -1.35000 0.00000 -3.38000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_9.PDB 5.74511 -11.39000 -2.07000 -3.69000 -9.88000 -5.03000 12.60000 -11.49000 1.92000 7.72000 2.80000 0.00000 0.00000 0.00000 0.36000 1.27000 0.00000 -0.82000 0.00000 -3.80000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_10.PDB 4.66860 -10.47000 -2.75000 -3.43000 -9.16000 -3.36000 10.23000 -10.87000 2.67000 7.14000 2.56000 0.00000 0.00000 0.00000 0.26000 1.35000 0.00000 -0.96000 0.00000 -2.81000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_11.PDB 2.59515 -10.49000 -2.71000 -2.83000 -9.43000 -3.89000 10.76000 -11.32000 2.97000 6.80000 2.77000 0.00000 0.00000 0.00000 0.14000 1.24000 0.00000 -0.86000 0.00000 -2.88000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_12.PDB 4.09791 -10.24000 -2.18000 -3.59000 -9.57000 -5.01000 12.34000 -11.33000 2.80000 7.81000 2.59000 0.00000 0.00000 0.00000 0.17000 1.20000 0.00000 -0.63000 0.00000 -3.64000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_13.PDB 2.77649 -10.35000 -2.66000 -3.61000 -9.30000 -2.97000 10.36000 -11.28000 2.49000 7.38000 2.48000 0.00000 0.00000 0.00000 0.11000 1.10000 0.00000 -0.85000 0.00000 -2.49000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_14.PDB 2.82103 -11.92000 -2.77000 -2.81000 -9.21000 -3.88000 10.49000 -10.95000 2.46000 6.41000 2.61000 0.00000 0.00000 0.00000 0.11000 1.11000 0.00000 -1.28000 0.00000 -3.09000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_15.PDB 2.65755 -9.35000 -2.83000 -2.83000 -9.44000 -2.95000 10.42000 -11.44000 4.35000 5.99000 2.83000 0.00000 0.00000 0.00000 0.16000 1.27000 0.00000 -0.99000 0.00000 -2.62000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_16.PDB 3.97514 -12.02000 -3.01000 -3.80000 -10.14000 -4.89000 12.45000 -11.76000 2.46000 7.78000 2.98000 0.00000 0.00000 0.00000 0.28000 1.28000 0.00000 -0.45000 0.00000 -3.93000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_17.PDB 3.34830 -9.99000 -2.15000 -2.11000 -9.02000 -3.78000 10.56000 -10.96000 2.55000 6.06000 2.75000 0.00000 0.00000 0.00000 0.14000 1.28000 0.00000 -0.87000 0.00000 -3.15000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_18.PDB 5.70543 -10.87000 -3.01000 -2.91000 -9.40000 -3.90000 11.35000 -11.21000 2.54000 6.62000 3.16000 0.00000 0.00000 0.00000 0.35000 1.08000 0.00000 -0.81000 0.00000 -3.64000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_19.PDB 3.45837 -11.61000 -2.65000 -4.21000 -10.29000 -4.98000 13.06000 -12.00000 3.24000 7.58000 3.04000 0.00000 0.00000 0.00000 0.12000 1.32000 0.00000 -0.81000 0.00000 -3.71000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_20.PDB 3.66475 -11.16000 -2.97000 -4.67000 -10.66000 -4.82000 13.32000 -12.31000 4.25000 8.07000 3.24000 0.00000 0.00000 0.00000 0.14000 1.32000 0.00000 -1.02000 0.00000 -3.74000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_21.PDB 4.83926 -8.83000 -2.11000 -1.97000 -8.51000 -3.04000 9.25000 -10.67000 3.73000 5.68000 1.71000 0.00000 0.00000 0.00000 0.35000 1.16000 0.00000 -0.64000 0.00000 -2.61000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_22.PDB 3.71289 -9.41000 -1.83000 -1.45000 -8.43000 -3.39000 9.99000 -10.26000 2.10000 5.33000 2.07000 0.00000 0.00000 0.00000 0.14000 1.29000 0.00000 -0.69000 0.00000 -2.98000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_23.PDB 5.48003 -12.48000 -2.14000 -4.24000 -9.76000 -5.48000 12.15000 -11.57000 2.27000 8.15000 2.68000 0.00000 0.00000 0.00000 0.23000 0.94000 0.00000 -0.61000 0.00000 -4.16000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_24.PDB 2.94828 -9.38000 -2.09000 -2.08000 -8.59000 -2.93000 9.78000 -10.53000 2.51000 6.24000 1.80000 0.00000 0.00000 0.00000 0.08000 1.09000 0.00000 -0.92000 0.00000 -2.65000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_25.PDB 3.30380 -11.37000 -2.92000 -2.88000 -9.24000 -3.63000 10.97000 -11.07000 2.17000 6.52000 2.43000 0.00000 0.00000 0.00000 0.08000 1.15000 0.00000 -0.71000 0.00000 -3.10000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_26.PDB 4.04118 -13.71000 -3.31000 -5.03000 -10.32000 -5.27000 12.83000 -12.19000 3.35000 8.10000 2.75000 0.00000 0.00000 0.00000 0.16000 1.43000 0.00000 -0.83000 0.00000 -3.96000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_27.PDB 3.56605 -8.42000 -1.79000 -1.71000 -8.79000 -3.35000 10.14000 -10.68000 3.21000 5.97000 2.52000 0.00000 0.00000 0.00000 0.12000 1.16000 0.00000 -0.97000 0.00000 -3.08000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_28.PDB 4.61629 -11.04000 -2.94000 -5.43000 -9.82000 -4.70000 12.87000 -11.39000 2.72000 8.56000 3.41000 0.00000 0.00000 0.00000 0.16000 1.24000 0.00000 -0.62000 0.00000 -3.86000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_29.PDB 4.62072 -11.02000 -2.92000 -4.56000 -9.69000 -4.56000 12.06000 -11.27000 2.54000 8.52000 3.26000 0.00000 0.00000 0.00000 0.22000 1.21000 0.00000 -0.80000 0.00000 -3.81000 0.00000 2.38000 69.00000 BBC1_1ZUK2-27_30.PDB 3.35267 -9.35000 -1.91000 -3.18000 -9.55000 -3.40000 11.13000 -11.63000 3.23000 6.78000 2.33000 0.00000 0.00000 0.00000 0.10000 1.14000 0.00000 -0.46000 0.00000 -2.79000 0.00000 2.38000 69.00000