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 BZZ1-D2_2A28-3_1.PDB 3.86846 -10.56000 -2.46000 -4.15000 -10.71000 -3.35000 12.62000 -12.28000 1.11000 6.76000 5.04000 0.00000 0.00000 0.00000 0.17000 1.81000 0.00000 -1.00000 0.00000 -2.31000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_2.PDB 4.79349 -11.88000 -2.53000 -4.17000 -11.29000 -3.54000 13.23000 -13.01000 1.05000 6.85000 4.60000 0.00000 0.00000 0.00000 0.16000 1.76000 0.00000 -0.77000 0.00000 -2.46000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_3.PDB 4.11243 -10.23000 -2.54000 -5.99000 -10.26000 -3.56000 12.55000 -11.47000 1.09000 8.22000 4.92000 0.00000 0.00000 0.00000 0.15000 1.68000 0.00000 -0.81000 0.00000 -2.53000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_4.PDB 4.86589 -10.82000 -2.47000 -4.17000 -10.53000 -3.59000 12.65000 -11.96000 1.10000 6.55000 4.56000 0.00000 0.00000 0.00000 0.21000 1.69000 0.00000 -0.57000 0.00000 -2.59000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_5.PDB 4.08330 -9.13000 -2.22000 -2.19000 -10.19000 -2.21000 11.36000 -12.06000 1.03000 5.76000 4.23000 0.00000 0.00000 0.00000 0.15000 1.54000 0.00000 -1.08000 0.00000 -1.71000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_6.PDB 4.53207 -12.15000 -2.42000 -4.81000 -11.70000 -4.14000 14.69000 -13.14000 1.28000 6.68000 5.13000 0.00000 0.00000 0.00000 0.26000 2.04000 0.00000 -1.19000 0.00000 -2.81000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_7.PDB 4.97243 -13.21000 -3.75000 -4.50000 -12.16000 -3.89000 15.97000 -13.59000 0.30000 7.37000 4.43000 0.00000 0.00000 0.00000 0.20000 1.83000 0.00000 -0.86000 0.00000 -2.72000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_8.PDB 3.89491 -10.21000 -2.50000 -4.00000 -11.19000 -3.24000 13.20000 -12.80000 1.34000 6.84000 4.89000 0.00000 0.00000 0.00000 0.18000 1.76000 0.00000 -0.73000 0.00000 -2.21000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_9.PDB 3.98194 -8.58000 -2.15000 -3.89000 -9.97000 -3.18000 12.20000 -11.30000 1.05000 6.40000 4.97000 0.00000 0.00000 0.00000 0.14000 1.60000 0.00000 -0.63000 0.00000 -2.23000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_10.PDB 5.80746 -12.29000 -3.82000 -4.53000 -12.16000 -4.50000 16.67000 -13.14000 1.22000 7.13000 4.90000 0.00000 0.00000 0.00000 0.22000 1.92000 0.00000 -1.16000 0.00000 -3.15000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_11.PDB 4.65881 -9.94000 -2.50000 -2.45000 -10.37000 -3.54000 12.52000 -11.81000 0.93000 5.44000 4.57000 0.00000 0.00000 0.00000 0.27000 1.79000 0.00000 -0.46000 0.00000 -2.55000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_12.PDB 4.62102 -10.00000 -2.00000 -3.29000 -11.50000 -3.29000 13.54000 -13.17000 1.21000 6.93000 4.57000 0.00000 0.00000 0.00000 0.20000 1.77000 0.00000 -0.84000 0.00000 -2.36000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_13.PDB 4.04949 -8.93000 -2.39000 -2.38000 -10.27000 -3.23000 12.74000 -11.55000 1.12000 5.16000 4.84000 0.00000 0.00000 0.00000 0.18000 1.75000 0.00000 -0.93000 0.00000 -2.23000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_14.PDB 4.80546 -10.19000 -2.49000 -4.27000 -10.57000 -3.43000 13.19000 -11.86000 1.17000 6.34000 4.80000 0.00000 0.00000 0.00000 0.22000 1.58000 0.00000 -0.88000 0.00000 -2.40000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_15.PDB 4.93282 -11.92000 -2.50000 -4.19000 -10.99000 -3.38000 13.01000 -12.62000 0.13000 6.85000 4.54000 0.00000 0.00000 0.00000 0.21000 1.64000 0.00000 -0.73000 0.00000 -2.27000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_16.PDB 5.20653 -10.47000 -4.01000 -4.04000 -11.49000 -3.79000 15.27000 -12.52000 1.18000 7.11000 4.72000 0.00000 0.00000 0.00000 0.27000 1.83000 0.00000 -0.59000 0.00000 -2.58000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_17.PDB 4.85257 -9.97000 -2.46000 -4.18000 -10.72000 -3.20000 12.68000 -12.25000 1.21000 6.64000 5.16000 0.00000 0.00000 0.00000 0.23000 1.63000 0.00000 -0.92000 0.00000 -2.17000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_18.PDB 4.90189 -10.05000 -4.13000 -4.17000 -10.55000 -3.34000 14.28000 -11.54000 1.10000 6.48000 4.80000 0.00000 0.00000 0.00000 0.23000 1.67000 0.00000 -0.95000 0.00000 -2.26000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_19.PDB 4.01107 -9.98000 -3.53000 -3.16000 -10.47000 -3.42000 13.82000 -11.56000 0.06000 6.71000 4.74000 0.00000 0.00000 0.00000 0.18000 1.80000 0.00000 -0.87000 0.00000 -2.48000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_20.PDB 4.73590 -11.67000 -3.75000 -3.34000 -10.66000 -3.62000 13.75000 -11.99000 0.18000 6.75000 4.33000 0.00000 0.00000 0.00000 0.24000 1.78000 0.00000 -0.94000 0.00000 -2.61000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_21.PDB 4.17005 -10.65000 -2.36000 -4.08000 -10.75000 -3.32000 12.65000 -12.31000 1.11000 6.75000 5.12000 0.00000 0.00000 0.00000 0.21000 1.92000 0.00000 -1.40000 0.00000 -2.26000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_22.PDB 4.05987 -7.79000 -0.62000 -2.70000 -8.09000 -2.68000 9.59000 -9.58000 1.33000 4.87000 3.48000 0.00000 0.00000 0.00000 0.10000 1.84000 0.00000 -0.99000 0.00000 -2.48000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_23.PDB 4.75598 -13.27000 -3.18000 -5.38000 -11.95000 -3.99000 15.80000 -13.36000 0.21000 7.40000 4.98000 0.00000 0.00000 0.00000 0.25000 1.81000 0.00000 -1.24000 0.00000 -2.81000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_24.PDB 4.12620 -9.16000 -0.69000 -3.32000 -8.83000 -2.55000 9.68000 -10.65000 1.24000 5.67000 3.69000 0.00000 0.00000 0.00000 0.09000 1.60000 0.00000 -1.21000 0.00000 -2.27000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_25.PDB 4.74276 -11.38000 -2.39000 -4.90000 -10.09000 -4.69000 14.18000 -10.97000 1.27000 5.85000 4.20000 0.00000 0.00000 0.00000 0.18000 1.83000 0.00000 -0.68000 0.00000 -3.32000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_26.PDB 3.98970 -11.42000 -3.72000 -5.37000 -10.89000 -2.28000 11.98000 -13.06000 1.55000 8.42000 4.60000 0.00000 0.00000 0.00000 0.22000 1.68000 0.00000 -1.00000 0.00000 -1.85000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_27.PDB 4.07864 -10.65000 -3.36000 -3.34000 -10.32000 -3.47000 12.88000 -11.52000 0.22000 6.63000 4.41000 0.00000 0.00000 0.00000 0.17000 1.57000 0.00000 -0.51000 0.00000 -2.44000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_28.PDB 4.97746 -12.52000 -3.66000 -4.86000 -11.50000 -3.96000 16.17000 -12.68000 0.18000 7.06000 4.27000 0.00000 0.00000 0.00000 0.21000 1.88000 0.00000 -0.79000 0.00000 -2.96000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_29.PDB 4.76352 -11.60000 -2.53000 -4.21000 -10.47000 -3.68000 12.74000 -11.80000 1.02000 6.58000 4.27000 0.00000 0.00000 0.00000 0.20000 1.72000 0.00000 -1.01000 0.00000 -2.69000 0.00000 2.38000 64.00000 BZZ1-D2_2A28-3_30.PDB 4.66643 -10.58000 -2.46000 -4.14000 -10.06000 -3.34000 12.23000 -11.44000 0.93000 6.60000 4.30000 0.00000 0.00000 0.00000 0.19000 1.66000 0.00000 -0.94000 0.00000 -2.45000 0.00000 2.38000 64.00000