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 4GBQ2_1.PDB 3.05369 -13.81000 -1.85000 -5.24000 -7.96000 -1.72000 7.70000 -9.92000 0.24000 5.08000 2.57000 0.00000 0.00000 0.00000 0.02000 0.37000 0.00000 -0.82000 0.00000 -1.92000 0.00000 2.38000 67.00000 4GBQ2_2.PDB 2.98438 -12.96000 -1.13000 -5.20000 -8.06000 -1.62000 7.93000 -10.01000 0.45000 5.00000 2.42000 0.00000 0.00000 0.00000 0.01000 0.41000 0.00000 -0.93000 0.00000 -1.83000 0.00000 2.38000 67.00000 4GBQ2_3.PDB 3.93967 -17.59000 -1.69000 -5.23000 -8.34000 -2.86000 8.77000 -9.74000 0.54000 3.62000 1.57000 0.00000 0.00000 0.00000 0.02000 0.41000 0.00000 -1.83000 0.00000 -2.42000 0.00000 2.38000 67.00000 4GBQ2_4.PDB 5.10092 -17.64000 -1.87000 -6.11000 -8.70000 -3.33000 9.59000 -10.07000 0.99000 4.27000 1.98000 0.00000 0.00000 0.00000 0.01000 0.42000 0.00000 -1.62000 0.00000 -2.79000 0.00000 2.38000 67.00000 4GBQ2_5.PDB 4.07143 -17.08000 -1.90000 -5.66000 -8.08000 -2.61000 7.98000 -9.68000 0.62000 3.92000 1.55000 0.00000 0.00000 0.00000 0.01000 0.44000 0.00000 -1.02000 0.00000 -2.21000 0.00000 2.38000 67.00000 4GBQ2_6.PDB 4.33461 -17.09000 -1.97000 -5.56000 -8.09000 -2.69000 7.98000 -9.67000 0.91000 3.94000 1.56000 0.00000 0.00000 0.00000 0.01000 0.39000 0.00000 -1.18000 0.00000 -2.32000 0.00000 2.38000 67.00000 4GBQ2_7.PDB 3.66501 -16.74000 -1.82000 -5.26000 -8.25000 -2.85000 8.33000 -9.89000 0.29000 4.31000 2.00000 0.00000 0.00000 0.00000 0.01000 0.39000 0.00000 -1.01000 0.00000 -2.60000 0.00000 2.38000 67.00000 4GBQ2_8.PDB 4.63661 -15.09000 -1.93000 -5.49000 -8.00000 -2.29000 8.94000 -9.55000 0.31000 3.94000 2.33000 0.00000 0.00000 0.00000 0.02000 0.38000 0.00000 -1.28000 0.00000 -2.08000 0.00000 2.38000 67.00000 4GBQ2_9.PDB 2.94365 -14.43000 -1.64000 -5.87000 -7.91000 -2.05000 8.44000 -9.69000 0.30000 5.02000 2.58000 0.00000 0.00000 0.00000 0.00000 0.38000 0.00000 -1.51000 0.00000 -2.12000 0.00000 2.38000 67.00000 4GBQ2_10.PDB 2.80053 -16.04000 -1.80000 -6.06000 -8.01000 -2.25000 8.67000 -9.65000 0.43000 4.11000 1.60000 0.00000 0.00000 0.00000 0.01000 0.43000 0.00000 -1.06000 0.00000 -2.03000 0.00000 2.38000 67.00000 4GBQ2_11.PDB 3.76923 -14.55000 -1.96000 -6.81000 -8.73000 -2.90000 10.40000 -10.18000 0.42000 5.92000 2.89000 0.00000 0.00000 0.00000 0.01000 0.38000 0.00000 -1.00000 0.00000 -2.61000 0.00000 2.38000 67.00000 4GBQ2_12.PDB 3.21010 -14.83000 -1.82000 -6.25000 -8.31000 -2.48000 9.22000 -9.87000 0.24000 5.32000 2.42000 0.00000 0.00000 0.00000 0.04000 0.37000 0.00000 -1.08000 0.00000 -2.25000 0.00000 2.38000 67.00000 4GBQ2_13.PDB 3.77787 -15.00000 -1.89000 -4.29000 -8.49000 -3.04000 9.17000 -9.93000 0.46000 4.44000 2.44000 0.00000 0.00000 0.00000 0.01000 0.40000 0.00000 -1.18000 0.00000 -2.71000 0.00000 2.38000 67.00000 4GBQ2_14.PDB 4.21961 -14.45000 -1.79000 -6.80000 -7.90000 -2.95000 8.98000 -9.43000 0.32000 6.04000 2.11000 0.00000 0.00000 0.00000 0.01000 0.39000 0.00000 -0.37000 0.00000 -2.68000 0.00000 2.38000 67.00000 4GBQ2_15.PDB 3.93819 -12.87000 -1.77000 -1.81000 -7.65000 -2.86000 7.38000 -9.32000 0.43000 3.57000 2.44000 0.00000 0.00000 0.00000 0.01000 0.39000 0.00000 -0.73000 0.00000 -2.57000 0.00000 2.38000 67.00000 4GBQ2_16.PDB 4.04069 -16.16000 -1.87000 -5.78000 -8.55000 -3.22000 9.17000 -9.98000 0.34000 4.99000 2.69000 0.00000 0.00000 0.00000 0.01000 0.37000 0.00000 -1.14000 0.00000 -2.80000 0.00000 2.38000 67.00000 4GBQ2_17.PDB 4.31452 -13.50000 -1.95000 -5.68000 -7.99000 -3.02000 8.71000 -9.54000 0.46000 6.47000 2.21000 0.00000 0.00000 0.00000 0.03000 0.37000 0.00000 -0.34000 0.00000 -2.87000 0.00000 2.38000 67.00000 4GBQ2_18.PDB 3.95278 -14.39000 -1.84000 -4.04000 -7.99000 -3.09000 8.12000 -9.58000 0.40000 4.64000 2.56000 0.00000 0.00000 0.00000 0.01000 0.39000 0.00000 -0.82000 0.00000 -2.75000 0.00000 2.38000 67.00000 4GBQ2_19.PDB 3.58948 -13.83000 -1.84000 -5.95000 -7.81000 -1.98000 8.07000 -9.60000 0.26000 5.50000 2.61000 0.00000 0.00000 0.00000 0.01000 0.38000 0.00000 -0.99000 0.00000 -2.11000 0.00000 2.38000 67.00000 4GBQ2_20.PDB 3.53954 -13.24000 -1.77000 -5.48000 -7.54000 -1.69000 7.31000 -9.56000 0.36000 5.58000 2.49000 0.00000 0.00000 0.00000 0.00000 0.38000 0.00000 -1.04000 0.00000 -1.93000 0.00000 2.38000 67.00000 4GBQ2_21.PDB 3.04284 -13.21000 -1.84000 -2.10000 -7.54000 -2.71000 6.92000 -9.16000 0.66000 3.31000 2.27000 0.00000 0.00000 0.00000 0.01000 0.37000 0.00000 -0.77000 0.00000 -2.27000 0.00000 2.38000 67.00000 4GBQ2_22.PDB 3.22851 -16.40000 -1.75000 -5.54000 -8.14000 -2.69000 8.03000 -9.71000 0.59000 3.98000 2.21000 0.00000 0.00000 0.00000 0.01000 0.37000 0.00000 -1.14000 0.00000 -2.25000 0.00000 2.38000 67.00000 4GBQ2_23.PDB 3.64740 -13.33000 -1.99000 -6.14000 -7.75000 -1.84000 7.72000 -9.64000 0.31000 6.17000 2.60000 0.00000 0.00000 0.00000 0.01000 0.37000 0.00000 -0.75000 0.00000 -2.02000 0.00000 2.38000 67.00000 4GBQ2_24.PDB 3.09433 -16.10000 -1.80000 -4.29000 -8.39000 -2.78000 8.43000 -9.87000 0.42000 4.27000 1.76000 0.00000 0.00000 0.00000 0.00000 0.37000 0.00000 -1.50000 0.00000 -2.34000 0.00000 2.38000 67.00000 4GBQ2_25.PDB 3.63596 -14.12000 -1.99000 -5.71000 -8.47000 -2.52000 9.45000 -10.11000 0.43000 5.83000 2.63000 0.00000 0.00000 0.00000 0.01000 0.36000 0.00000 -1.12000 0.00000 -2.55000 0.00000 2.38000 67.00000 4GBQ2_26.PDB 3.64818 -13.03000 -1.86000 -2.18000 -7.82000 -3.09000 7.49000 -9.40000 0.61000 3.86000 2.52000 0.00000 0.00000 0.00000 0.01000 0.39000 0.00000 -0.56000 0.00000 -2.61000 0.00000 2.38000 67.00000 4GBQ2_27.PDB 3.17279 -15.87000 -1.73000 -6.87000 -8.26000 -2.44000 9.09000 -9.77000 0.28000 5.17000 1.79000 0.00000 0.00000 0.00000 0.04000 0.38000 0.00000 -0.94000 0.00000 -2.22000 0.00000 2.38000 67.00000 4GBQ2_28.PDB 4.76223 -15.12000 -1.77000 -4.60000 -8.39000 -2.81000 8.71000 -9.99000 0.79000 3.99000 2.55000 0.00000 0.00000 0.00000 0.01000 0.38000 0.00000 -1.29000 0.00000 -2.31000 0.00000 2.38000 67.00000 4GBQ2_29.PDB 3.70183 -13.28000 -1.78000 -5.94000 -7.69000 -1.97000 8.00000 -9.52000 0.33000 5.87000 2.66000 0.00000 0.00000 0.00000 0.03000 0.42000 0.00000 -1.19000 0.00000 -2.08000 0.00000 2.38000 67.00000 4GBQ2_30.PDB 3.43836 -14.67000 -1.71000 -4.25000 -8.16000 -2.58000 8.49000 -9.63000 0.41000 4.01000 2.19000 0.00000 0.00000 0.00000 0.00000 0.42000 0.00000 -1.16000 0.00000 -2.28000 0.00000 2.38000 67.00000