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 1ZUB2_1.PDB 13.18601 -2.64000 -4.97000 -0.56000 -9.05000 -0.80000 13.30000 -12.33000 2.89000 4.54000 5.23000 0.00000 0.00000 0.00000 0.61000 8.82000 -0.16000 -0.54000 0.00000 -0.79000 0.00000 2.38000 115.00000 1ZUB2_2.PDB 10.35052 -4.74000 -4.43000 -1.98000 -9.80000 -1.18000 14.33000 -13.39000 2.49000 5.71000 4.83000 0.00000 0.00000 0.00000 0.54000 8.58000 -0.15000 -0.53000 0.00000 -1.19000 0.00000 2.38000 115.00000 1ZUB2_3.PDB 12.02021 -1.92000 -4.94000 -0.96000 -8.73000 -0.80000 13.37000 -11.59000 2.88000 4.50000 5.40000 0.00000 0.00000 0.00000 0.66000 8.80000 -0.15000 -0.77000 0.00000 -0.76000 0.00000 2.38000 115.00000 1ZUB2_4.PDB 9.78309 -4.05000 -4.42000 -1.94000 -9.15000 -1.17000 13.98000 -12.36000 2.51000 5.24000 4.77000 0.00000 0.00000 0.00000 0.53000 8.57000 -0.15000 -0.66000 0.00000 -1.23000 0.00000 2.38000 115.00000 1ZUB2_5.PDB 11.85018 -2.17000 -4.86000 -0.65000 -8.55000 -0.75000 13.62000 -11.77000 2.91000 3.89000 5.29000 0.00000 0.00000 0.00000 0.22000 8.57000 -0.16000 -0.63000 0.00000 -0.72000 0.00000 2.38000 115.00000 1ZUB2_6.PDB 12.80062 -2.96000 -4.42000 -1.97000 -9.20000 -1.37000 15.12000 -12.43000 2.94000 4.98000 4.92000 0.00000 0.00000 0.00000 0.78000 8.45000 -0.15000 -0.80000 0.00000 -1.36000 0.00000 2.38000 115.00000 1ZUB2_7.PDB 10.69361 -2.13000 -4.99000 -0.87000 -8.30000 -0.80000 13.51000 -11.40000 2.38000 4.03000 5.14000 0.00000 0.00000 0.00000 0.60000 8.46000 -0.15000 -0.43000 0.00000 -0.83000 0.00000 2.38000 115.00000 1ZUB2_8.PDB 10.26094 -3.36000 -4.39000 -1.94000 -8.99000 -1.22000 14.67000 -12.30000 2.69000 4.89000 4.70000 0.00000 0.00000 0.00000 0.58000 8.36000 -0.15000 -0.61000 0.00000 -1.30000 0.00000 2.38000 115.00000 1ZUB2_9.PDB 10.41451 -2.33000 -4.96000 -0.78000 -9.33000 -0.57000 13.30000 -13.13000 4.27000 4.49000 5.04000 0.00000 0.00000 0.00000 0.59000 9.05000 -0.16000 -0.49000 0.00000 -0.59000 0.00000 2.38000 115.00000 1ZUB2_10.PDB 12.87231 -4.60000 -5.45000 -2.81000 -11.01000 -2.08000 16.90000 -14.68000 4.64000 6.42000 5.35000 0.00000 0.00000 0.00000 0.69000 9.14000 -0.15000 -0.83000 0.00000 -1.59000 0.00000 2.38000 115.00000 1ZUB2_11.PDB 12.61890 -2.19000 -4.84000 -0.45000 -8.43000 -1.27000 13.17000 -11.37000 2.70000 4.64000 5.09000 0.00000 0.00000 0.00000 0.63000 8.73000 -0.15000 -0.65000 0.00000 -1.25000 0.00000 2.38000 115.00000 1ZUB2_12.PDB 10.91338 -2.40000 -4.96000 -0.56000 -8.91000 -0.62000 12.41000 -12.64000 4.33000 4.16000 4.97000 0.00000 0.00000 0.00000 0.64000 9.05000 -0.15000 -0.41000 0.00000 -0.66000 0.00000 2.38000 115.00000 1ZUB2_13.PDB 12.91315 -2.96000 -4.45000 -1.95000 -9.18000 -1.89000 15.16000 -12.05000 3.07000 5.83000 4.67000 0.00000 0.00000 0.00000 0.60000 8.59000 -0.15000 -0.73000 0.00000 -1.88000 0.00000 2.38000 115.00000 1ZUB2_14.PDB 13.73714 -2.83000 -5.37000 -1.77000 -8.56000 -1.31000 14.03000 -11.20000 3.06000 4.52000 4.73000 0.00000 0.00000 0.00000 0.67000 8.79000 -0.15000 -0.59000 0.00000 -0.90000 0.00000 2.38000 115.00000 1ZUB2_15.PDB 9.86284 -2.55000 -4.84000 -1.01000 -8.05000 -0.65000 12.81000 -10.89000 2.45000 4.50000 3.98000 0.00000 0.00000 0.00000 0.54000 8.62000 -0.15000 -0.57000 0.00000 -0.68000 0.00000 2.38000 115.00000 1ZUB2_16.PDB 12.36128 -3.00000 -4.45000 -1.95000 -10.15000 -1.36000 15.42000 -13.81000 4.58000 5.44000 4.98000 0.00000 0.00000 0.00000 0.64000 9.07000 -0.15000 -0.86000 0.00000 -1.34000 0.00000 2.38000 115.00000 1ZUB2_17.PDB 10.13576 -1.62000 -4.94000 -0.80000 -9.36000 -0.62000 14.06000 -13.07000 3.98000 4.14000 5.61000 0.00000 0.00000 0.00000 0.66000 8.78000 -0.17000 -0.46000 0.00000 -0.65000 0.00000 2.38000 115.00000 1ZUB2_18.PDB 10.64431 -3.29000 -4.65000 -1.79000 -8.64000 -1.21000 14.00000 -11.32000 2.53000 5.04000 4.32000 0.00000 0.00000 0.00000 0.53000 8.39000 -0.15000 -0.60000 0.00000 -1.35000 0.00000 2.38000 115.00000 1ZUB2_19.PDB 13.03048 -3.83000 -4.46000 -1.91000 -8.44000 -1.23000 13.62000 -11.14000 2.50000 4.62000 4.46000 0.00000 0.00000 0.00000 0.60000 8.67000 -0.15000 -1.11000 0.00000 -1.18000 0.00000 2.38000 115.00000 1ZUB2_20.PDB 13.23404 -3.03000 -4.52000 -1.96000 -9.31000 -1.21000 14.61000 -12.83000 4.29000 4.48000 4.83000 0.00000 0.00000 0.00000 0.68000 8.90000 -0.15000 -0.79000 0.00000 -1.16000 0.00000 2.38000 115.00000 1ZUB2_21.PDB 12.66023 -1.39000 -4.85000 -0.43000 -7.82000 -1.29000 13.49000 -10.58000 2.65000 3.82000 5.01000 0.00000 0.00000 0.00000 0.69000 8.54000 -0.15000 -0.66000 0.00000 -1.27000 0.00000 2.38000 115.00000 1ZUB2_22.PDB 13.53239 -2.07000 -5.71000 -1.86000 -9.20000 -1.19000 14.84000 -12.67000 4.69000 4.38000 5.45000 0.00000 0.00000 0.00000 0.75000 8.90000 -0.15000 -0.56000 0.00000 -0.85000 0.00000 2.38000 115.00000 1ZUB2_23.PDB 10.45168 -2.83000 -4.43000 -1.96000 -8.58000 -1.85000 14.84000 -11.46000 2.72000 5.17000 4.71000 0.00000 0.00000 0.00000 0.60000 8.23000 -0.17000 -0.56000 0.00000 -1.86000 0.00000 2.38000 115.00000 1ZUB2_24.PDB 12.42431 -1.60000 -4.85000 -0.72000 -7.40000 -0.82000 12.66000 -10.03000 2.80000 3.36000 4.32000 0.00000 0.00000 0.00000 0.69000 8.56000 -0.16000 -0.65000 0.00000 -0.81000 0.00000 2.38000 115.00000 1ZUB2_25.PDB 12.65533 -1.54000 -4.87000 -0.76000 -7.52000 -0.76000 13.48000 -10.14000 2.64000 3.45000 3.85000 0.00000 0.00000 0.00000 0.71000 8.55000 -0.16000 -0.73000 0.00000 -0.74000 0.00000 2.38000 115.00000 1ZUB2_26.PDB 12.52430 -2.65000 -4.50000 -1.97000 -9.49000 -1.35000 15.22000 -13.03000 4.53000 4.70000 4.95000 0.00000 0.00000 0.00000 0.68000 8.86000 -0.15000 -0.88000 0.00000 -1.34000 0.00000 2.38000 115.00000 1ZUB2_27.PDB 11.29416 -3.18000 -4.94000 -0.56000 -8.82000 -0.20000 12.07000 -12.33000 2.34000 4.10000 5.29000 0.00000 0.00000 0.00000 0.61000 8.69000 -0.15000 -0.53000 0.00000 -0.05000 0.00000 2.38000 115.00000 1ZUB2_28.PDB 10.38820 -2.39000 -4.64000 -1.74000 -8.24000 -1.25000 14.22000 -11.03000 2.80000 4.62000 4.38000 0.00000 0.00000 0.00000 0.61000 8.44000 -0.15000 -0.55000 0.00000 -1.41000 0.00000 2.38000 115.00000 1ZUB2_29.PDB 13.28235 -2.61000 -4.45000 -2.00000 -8.39000 -1.40000 14.89000 -11.10000 2.69000 4.47000 4.49000 0.00000 0.00000 0.00000 0.68000 8.52000 -0.15000 -0.97000 0.00000 -1.36000 0.00000 2.38000 115.00000 1ZUB2_30.PDB 10.08434 -4.49000 -4.42000 -1.95000 -9.61000 -0.92000 13.84000 -13.14000 2.57000 5.22000 4.97000 0.00000 0.00000 0.00000 0.51000 8.59000 -0.15000 -0.65000 0.00000 -0.75000 0.00000 2.38000 115.00000