name total energy Backbone Hbon 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 BUD14_1GCQ-16_1.PDB 27.71000 -43.51000 -13.24000 -68.18000 -0.98000 84.04000 -87.39000 20.68000 38.34000 98.30000 0.00000 0.00000 0.00000 2.61000 17.79000 0.00000 -2.51000 0.00000 -0.46000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_2.PDB 28.31000 -43.74000 -11.83000 -67.83000 -0.97000 83.32000 -87.25000 20.93000 36.90000 98.86000 0.00000 0.00000 0.00000 2.81000 17.67000 0.00000 -2.46000 0.00000 -0.44000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_3.PDB 27.61000 -43.73000 -11.87000 -68.16000 -1.10000 84.50000 -87.65000 21.13000 37.27000 97.31000 0.00000 0.00000 0.00000 2.65000 17.53000 0.00000 -2.13000 0.00000 -0.63000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_4.PDB 26.61000 -45.31000 -13.49000 -68.77000 -0.81000 85.15000 -88.20000 20.63000 38.42000 98.81000 0.00000 0.00000 0.00000 2.85000 17.54000 0.00000 -2.28000 0.00000 -0.39000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_5.PDB 27.89000 -43.66000 -11.85000 -67.78000 -1.06000 83.88000 -87.26000 21.28000 36.97000 97.39000 0.00000 0.00000 0.00000 2.89000 17.65000 0.00000 -2.33000 0.00000 -0.57000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_6.PDB 29.34000 -43.03000 -11.72000 -68.21000 -1.07000 83.94000 -87.71000 22.38000 37.59000 97.15000 0.00000 0.00000 0.00000 2.47000 17.56000 0.00000 -2.04000 0.00000 -0.42000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_7.PDB 25.89000 -44.59000 -12.76000 -70.01000 -0.84000 85.74000 -90.31000 22.42000 38.27000 98.48000 0.00000 0.00000 0.00000 2.37000 17.55000 0.00000 -2.44000 0.00000 -0.45000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_8.PDB 25.48000 -43.77000 -12.85000 -69.68000 -0.96000 85.06000 -90.01000 20.66000 37.52000 99.68000 0.00000 0.00000 0.00000 2.89000 17.64000 0.00000 -2.63000 0.00000 -0.42000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_9.PDB 28.77000 -43.81000 -12.87000 -68.12000 -0.89000 84.80000 -87.47000 22.18000 37.73000 97.31000 0.00000 0.00000 0.00000 2.34000 17.50000 0.00000 -2.08000 0.00000 -0.35000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_10.PDB 29.06000 -43.60000 -11.77000 -67.43000 -0.94000 84.29000 -86.49000 21.01000 36.59000 97.47000 0.00000 0.00000 0.00000 2.54000 17.47000 0.00000 -2.12000 0.00000 -0.50000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_11.PDB 28.33000 -45.24000 -13.38000 -69.53000 -0.53000 86.32000 -89.03000 19.74000 39.23000 100.18000 0.00000 0.00000 0.00000 3.06000 17.77000 0.00000 -2.31000 0.00000 -0.19000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_12.PDB 27.05000 -43.17000 -12.93000 -69.38000 -0.95000 84.85000 -89.30000 20.29000 38.36000 99.35000 0.00000 0.00000 0.00000 2.46000 17.67000 0.00000 -2.55000 0.00000 0.01000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_13.PDB 28.59000 -43.86000 -12.88000 -68.45000 -0.88000 85.03000 -88.00000 21.86000 38.11000 97.79000 0.00000 0.00000 0.00000 2.38000 17.25000 0.00000 -2.16000 0.00000 -0.35000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_14.PDB 28.92000 -42.79000 -11.78000 -67.58000 -0.91000 83.84000 -87.23000 21.83000 36.57000 97.00000 0.00000 0.00000 0.00000 2.42000 17.53000 0.00000 -2.01000 0.00000 -0.44000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_15.PDB 28.48000 -44.25000 -12.41000 -67.72000 -0.94000 84.75000 -87.14000 21.31000 37.41000 97.54000 0.00000 0.00000 0.00000 2.67000 17.45000 0.00000 -2.19000 0.00000 -0.55000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_16.PDB 28.52000 -43.10000 -11.23000 -69.19000 -1.26000 84.20000 -89.31000 22.65000 37.82000 98.59000 0.00000 0.00000 0.00000 2.54000 17.70000 0.00000 -2.44000 0.00000 -0.76000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_17.PDB 26.06000 -43.60000 -12.62000 -69.66000 -0.67000 85.00000 -90.23000 22.16000 37.43000 98.15000 0.00000 0.00000 0.00000 2.35000 17.44000 0.00000 -2.08000 0.00000 -0.17000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_18.PDB 28.23000 -44.04000 -13.69000 -69.16000 -0.79000 85.25000 -88.65000 21.43000 38.67000 99.21000 0.00000 0.00000 0.00000 2.54000 17.63000 0.00000 -2.20000 0.00000 -0.34000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_19.PDB 28.87000 -43.50000 -11.72000 -68.37000 -0.82000 84.22000 -88.13000 21.50000 36.96000 97.20000 0.00000 0.00000 0.00000 3.53000 17.60000 0.00000 -2.07000 0.00000 0.07000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_20.PDB 26.32000 -42.88000 -11.03000 -69.26000 -0.90000 83.98000 -89.98000 22.02000 36.77000 97.42000 0.00000 0.00000 0.00000 2.50000 17.67000 0.00000 -2.26000 0.00000 -0.05000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_21.PDB 27.13000 -45.21000 -13.36000 -69.25000 -0.90000 86.02000 -88.74000 21.33000 39.17000 98.35000 0.00000 0.00000 0.00000 2.57000 17.44000 0.00000 -2.36000 0.00000 -0.48000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_22.PDB 25.93000 -44.62000 -12.77000 -70.64000 -1.09000 86.34000 -91.03000 21.87000 38.71000 99.60000 0.00000 0.00000 0.00000 2.69000 17.81000 0.00000 -2.48000 0.00000 -0.66000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_23.PDB 26.74000 -44.85000 -13.00000 -70.26000 -0.56000 86.31000 -90.14000 20.42000 39.20000 99.75000 0.00000 0.00000 0.00000 2.32000 17.45000 0.00000 -2.30000 0.00000 -0.14000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_24.PDB 26.71000 -43.09000 -11.07000 -68.67000 -0.72000 83.99000 -88.47000 20.13000 37.14000 97.31000 0.00000 0.00000 0.00000 2.23000 17.43000 0.00000 -2.20000 0.00000 0.12000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_25.PDB 26.83000 -43.76000 -11.83000 -69.71000 -1.05000 85.67000 -89.82000 21.28000 38.60000 98.05000 0.00000 0.00000 0.00000 2.46000 17.72000 0.00000 -2.48000 0.00000 -0.57000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_26.PDB 29.96000 -43.00000 -10.92000 -69.46000 -1.17000 84.42000 -89.65000 21.26000 38.31000 99.00000 0.00000 0.00000 0.00000 4.27000 17.60000 0.00000 -2.46000 0.00000 -0.65000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_27.PDB 26.89000 -42.82000 -10.97000 -68.69000 -0.87000 83.39000 -89.26000 22.94000 36.31000 96.67000 0.00000 0.00000 0.00000 2.29000 17.64000 0.00000 -2.18000 0.00000 0.07000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_28.PDB 28.83000 -43.09000 -12.07000 -67.93000 -1.02000 83.95000 -87.35000 21.00000 37.66000 97.98000 0.00000 0.00000 0.00000 2.37000 17.60000 0.00000 -2.22000 0.00000 -0.44000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_29.PDB 26.93000 -44.58000 -12.74000 -70.25000 -0.64000 85.97000 -90.48000 21.99000 38.73000 99.01000 0.00000 0.00000 0.00000 2.47000 17.53000 0.00000 -2.37000 0.00000 -0.18000 0.00000 0.00000 66.00000 BUD14_1GCQ-16_30.PDB 28.38000 -43.03000 -13.74000 -68.77000 -0.85000 84.80000 -88.51000 21.47000 38.09000 99.14000 0.00000 0.00000 0.00000 2.40000 17.62000 0.00000 -2.27000 0.00000 -0.34000 0.00000 0.00000 66.00000