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-18_1.PDB 20.68000 -43.45000 -12.06000 -70.10000 -0.80000 83.38000 -90.89000 13.85000 38.60000 101.51000 0.00000 0.00000 0.00000 3.19000 18.41000 0.00000 -2.10000 0.00000 -0.46000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_2.PDB 23.90000 -43.10000 -13.52000 -70.88000 -0.64000 83.53000 -92.08000 17.76000 39.51000 101.86000 0.00000 0.00000 0.00000 3.33000 18.59000 0.00000 -1.95000 0.00000 0.08000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_3.PDB 24.93000 -43.79000 -13.45000 -70.13000 -0.77000 83.71000 -90.60000 20.05000 38.51000 101.59000 0.00000 0.00000 0.00000 2.30000 18.61000 0.00000 -2.08000 0.00000 -0.40000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_4.PDB 24.55000 -43.21000 -14.41000 -70.74000 -0.62000 84.07000 -91.52000 19.07000 39.09000 102.45000 0.00000 0.00000 0.00000 2.33000 18.64000 0.00000 -2.05000 0.00000 0.09000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_5.PDB 24.87000 -44.92000 -15.25000 -71.08000 -0.60000 84.76000 -91.44000 17.97000 40.58000 103.83000 0.00000 0.00000 0.00000 3.66000 18.70000 0.00000 -2.25000 0.00000 -0.40000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_6.PDB 24.71000 -42.31000 -11.76000 -70.94000 -0.68000 83.17000 -92.24000 19.13000 38.00000 101.72000 0.00000 0.00000 0.00000 2.46000 18.51000 0.00000 -1.96000 0.00000 0.11000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_7.PDB 23.27000 -44.11000 -12.62000 -70.06000 -0.62000 83.75000 -90.71000 16.14000 38.21000 102.02000 0.00000 0.00000 0.00000 3.75000 18.50000 0.00000 -2.20000 0.00000 -0.28000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_8.PDB 23.55000 -43.21000 -13.54000 -70.15000 -0.78000 82.84000 -91.27000 17.95000 39.35000 101.25000 0.00000 0.00000 0.00000 3.47000 18.74000 0.00000 -1.88000 0.00000 -0.50000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_9.PDB 23.59000 -43.26000 -12.81000 -70.41000 -0.81000 82.67000 -91.77000 19.82000 38.07000 102.12000 0.00000 0.00000 0.00000 2.10000 18.72000 0.00000 -2.21000 0.00000 0.06000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_10.PDB 25.67000 -44.02000 -11.85000 -70.46000 -0.79000 84.60000 -90.93000 19.44000 37.54000 102.34000 0.00000 0.00000 0.00000 2.34000 18.74000 0.00000 -2.23000 0.00000 -0.31000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_11.PDB 24.52000 -42.41000 -11.92000 -68.97000 -0.85000 82.07000 -89.31000 18.70000 37.15000 100.31000 0.00000 0.00000 0.00000 2.47000 18.79000 0.00000 -2.31000 0.00000 -0.42000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_12.PDB 24.76000 -44.04000 -13.55000 -70.01000 -0.93000 83.87000 -90.40000 19.07000 37.98000 102.73000 0.00000 0.00000 0.00000 2.71000 18.41000 0.00000 -2.24000 0.00000 -0.41000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_13.PDB 21.87000 -43.21000 -11.76000 -69.35000 -0.51000 82.27000 -90.18000 14.14000 37.44000 101.92000 0.00000 0.00000 0.00000 3.22000 18.37000 0.00000 -2.26000 0.00000 0.14000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_14.PDB 25.08000 -44.07000 -13.68000 -69.95000 -0.82000 83.34000 -90.35000 19.40000 38.66000 102.70000 0.00000 0.00000 0.00000 2.34000 18.58000 0.00000 -2.07000 0.00000 -0.42000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_15.PDB 23.75000 -42.33000 -12.00000 -69.90000 -0.95000 82.89000 -91.23000 20.76000 37.10000 99.68000 0.00000 0.00000 0.00000 2.16000 18.46000 0.00000 -1.95000 0.00000 -0.46000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_16.PDB 24.86000 -42.43000 -11.86000 -70.28000 -0.85000 83.55000 -91.17000 17.60000 36.79000 101.93000 0.00000 0.00000 0.00000 3.53000 18.86000 0.00000 -1.96000 0.00000 0.00000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_17.PDB 23.86000 -42.31000 -12.08000 -69.98000 -0.79000 82.78000 -91.38000 20.79000 36.88000 99.85000 0.00000 0.00000 0.00000 1.96000 18.51000 0.00000 -1.94000 0.00000 0.09000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_18.PDB 23.70000 -44.10000 -13.57000 -70.47000 -0.81000 83.30000 -91.59000 20.20000 38.51000 102.45000 0.00000 0.00000 0.00000 2.24000 18.80000 0.00000 -2.15000 0.00000 -0.31000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_19.PDB 24.83000 -42.34000 -11.71000 -69.96000 -0.84000 83.03000 -90.66000 18.75000 37.48000 101.16000 0.00000 0.00000 0.00000 2.68000 18.72000 0.00000 -2.34000 0.00000 -0.41000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_20.PDB 21.84000 -43.26000 -11.76000 -70.18000 -0.77000 83.88000 -90.71000 13.14000 38.12000 101.83000 0.00000 0.00000 0.00000 4.28000 18.64000 0.00000 -2.27000 0.00000 -0.45000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_21.PDB 24.94000 -42.37000 -13.67000 -70.04000 -0.69000 83.21000 -90.99000 19.45000 37.93000 101.90000 0.00000 0.00000 0.00000 2.16000 18.56000 0.00000 -2.02000 0.00000 0.07000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_22.PDB 25.16000 -42.35000 -13.80000 -70.36000 -0.77000 83.75000 -91.42000 19.59000 38.17000 101.81000 0.00000 0.00000 0.00000 2.40000 18.59000 0.00000 -1.91000 0.00000 0.06000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_23.PDB 24.91000 -43.13000 -13.78000 -69.30000 -0.87000 82.66000 -89.87000 18.73000 38.15000 102.15000 0.00000 0.00000 0.00000 2.54000 18.46000 0.00000 -2.01000 0.00000 -0.36000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_24.PDB 23.42000 -43.15000 -13.59000 -70.09000 -0.67000 82.96000 -91.09000 17.92000 38.95000 100.73000 0.00000 0.00000 0.00000 3.69000 18.54000 0.00000 -1.82000 0.00000 -0.41000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_25.PDB 25.82000 -43.16000 -15.47000 -69.36000 -0.84000 83.63000 -89.79000 21.00000 39.34000 100.59000 0.00000 0.00000 0.00000 2.18000 18.42000 0.00000 -1.92000 0.00000 -0.37000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_26.PDB 23.01000 -43.18000 -12.80000 -70.21000 -0.64000 82.71000 -91.41000 19.08000 37.75000 100.93000 0.00000 0.00000 0.00000 2.45000 18.57000 0.00000 -1.84000 0.00000 0.17000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_27.PDB 23.66000 -42.10000 -12.68000 -69.81000 -0.83000 82.97000 -91.04000 19.69000 37.52000 100.21000 0.00000 0.00000 0.00000 2.17000 18.54000 0.00000 -2.06000 0.00000 -0.37000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_28.PDB 22.38000 -43.27000 -12.96000 -71.31000 -0.95000 84.18000 -92.51000 18.85000 38.53000 101.73000 0.00000 0.00000 0.00000 2.79000 18.93000 0.00000 -2.23000 0.00000 -0.46000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_29.PDB 23.91000 -42.38000 -14.15000 -69.74000 -0.90000 82.53000 -90.89000 19.25000 38.66000 101.48000 0.00000 0.00000 0.00000 2.54000 18.67000 0.00000 -2.02000 0.00000 -0.47000 0.00000 0.00000 67.00000 BUD14_1GCQ-18_30.PDB 22.54000 -42.32000 -13.66000 -71.65000 -0.81000 83.68000 -93.57000 19.87000 39.01000 101.79000 0.00000 0.00000 0.00000 2.21000 18.69000 0.00000 -2.05000 0.00000 0.05000 0.00000 0.00000 67.00000