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-21_1.PDB 19.23000 -45.45000 -10.70000 -70.19000 -0.89000 85.12000 -91.23000 12.09000 37.60000 102.88000 0.00000 0.00000 0.00000 2.40000 25.22000 0.00000 -2.09000 0.00000 -0.32000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_2.PDB 17.56000 -46.09000 -11.44000 -70.80000 -0.93000 85.60000 -91.83000 12.43000 38.98000 102.43000 0.00000 0.00000 0.00000 1.92000 25.64000 0.00000 -2.35000 0.00000 -0.38000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_3.PDB 19.69000 -47.21000 -12.52000 -71.55000 -0.96000 87.13000 -92.75000 14.26000 38.96000 104.98000 0.00000 0.00000 0.00000 2.44000 25.69000 0.00000 -2.54000 0.00000 -0.55000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_4.PDB 17.94000 -48.08000 -12.91000 -71.36000 -1.78000 88.76000 -92.03000 13.20000 38.52000 104.05000 0.00000 0.00000 0.00000 2.65000 25.44000 0.00000 -2.37000 0.00000 -0.69000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_5.PDB 18.29000 -46.85000 -11.36000 -71.23000 -1.64000 87.01000 -92.09000 13.78000 39.20000 102.42000 0.00000 0.00000 0.00000 1.96000 25.62000 0.00000 -2.16000 0.00000 -0.74000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_6.PDB 20.21000 -46.10000 -11.31000 -71.60000 -0.96000 86.22000 -92.98000 14.31000 39.16000 104.47000 0.00000 0.00000 0.00000 1.82000 25.87000 0.00000 -2.37000 0.00000 -0.44000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_7.PDB 17.09000 -45.48000 -12.44000 -68.96000 -1.00000 83.93000 -89.55000 11.28000 37.56000 102.18000 0.00000 0.00000 0.00000 2.35000 25.00000 0.00000 -2.44000 0.00000 -0.35000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_8.PDB 16.44000 -46.09000 -13.14000 -69.42000 -0.95000 84.31000 -90.07000 12.09000 38.62000 102.17000 0.00000 0.00000 0.00000 1.84000 25.33000 0.00000 -2.53000 0.00000 -0.39000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_9.PDB 21.35000 -46.36000 -10.80000 -70.92000 -0.44000 86.42000 -91.86000 12.48000 37.28000 104.26000 0.00000 0.00000 0.00000 3.41000 25.56000 0.00000 -2.23000 0.00000 0.12000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_10.PDB 17.92000 -45.49000 -10.95000 -69.20000 -1.54000 84.68000 -89.65000 10.99000 37.28000 102.44000 0.00000 0.00000 0.00000 2.57000 25.15000 0.00000 -2.39000 0.00000 -0.82000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_11.PDB 18.69000 -46.63000 -12.82000 -70.85000 -0.42000 86.36000 -91.70000 12.85000 38.48000 102.92000 0.00000 0.00000 0.00000 2.58000 25.85000 0.00000 -2.20000 0.00000 0.13000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_12.PDB 21.06000 -46.47000 -11.69000 -71.31000 -1.26000 87.52000 -92.49000 13.85000 38.23000 103.24000 0.00000 0.00000 0.00000 3.98000 25.65000 0.00000 -2.22000 0.00000 -0.32000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_13.PDB 17.79000 -45.53000 -10.86000 -69.78000 -0.94000 85.12000 -90.58000 11.04000 37.77000 102.29000 0.00000 0.00000 0.00000 2.34000 25.36000 0.00000 -2.62000 0.00000 -0.44000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_14.PDB 16.57000 -45.98000 -13.01000 -70.98000 -1.34000 87.18000 -92.10000 11.23000 40.03000 102.21000 0.00000 0.00000 0.00000 1.98000 25.54000 0.00000 -2.18000 0.00000 -0.46000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_15.PDB 17.37000 -46.07000 -12.06000 -69.89000 -1.50000 85.19000 -90.43000 12.51000 38.84000 102.48000 0.00000 0.00000 0.00000 1.96000 25.37000 0.00000 -2.83000 0.00000 -0.82000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_16.PDB 18.27000 -46.49000 -11.70000 -71.06000 -0.94000 86.47000 -92.23000 12.69000 39.31000 102.40000 0.00000 0.00000 0.00000 2.15000 26.01000 0.00000 -2.03000 0.00000 -0.30000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_17.PDB 19.08000 -46.31000 -11.61000 -70.30000 -1.15000 85.94000 -91.21000 10.45000 38.50000 105.22000 0.00000 0.00000 0.00000 2.48000 25.02000 0.00000 -2.53000 0.00000 -0.40000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_18.PDB 20.10000 -46.35000 -11.68000 -70.22000 -0.92000 86.27000 -90.72000 10.22000 38.26000 105.20000 0.00000 0.00000 0.00000 2.80000 25.13000 0.00000 -2.44000 0.00000 -0.33000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_19.PDB 18.02000 -46.06000 -13.15000 -70.42000 -0.97000 85.75000 -91.23000 11.33000 39.62000 103.77000 0.00000 0.00000 0.00000 1.88000 25.16000 0.00000 -2.10000 0.00000 -0.38000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_20.PDB 21.20000 -47.15000 -12.58000 -71.16000 -1.17000 87.15000 -92.04000 14.51000 38.95000 105.24000 0.00000 0.00000 0.00000 2.45000 25.59000 0.00000 -2.44000 0.00000 -0.57000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_21.PDB 21.01000 -46.85000 -12.25000 -70.92000 -1.06000 87.37000 -91.61000 12.90000 39.06000 104.68000 0.00000 0.00000 0.00000 1.90000 25.47000 0.00000 -1.86000 0.00000 -0.35000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_22.PDB 17.37000 -47.98000 -13.38000 -70.33000 -1.81000 88.16000 -90.76000 11.90000 38.29000 104.12000 0.00000 0.00000 0.00000 2.00000 25.57000 0.00000 -2.23000 0.00000 -0.61000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_23.PDB 21.16000 -46.89000 -13.85000 -71.82000 -1.52000 88.23000 -92.73000 16.39000 39.76000 104.60000 0.00000 0.00000 0.00000 1.98000 25.98000 0.00000 -2.40000 0.00000 -0.59000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_24.PDB 19.46000 -46.31000 -13.36000 -69.64000 -0.91000 85.21000 -90.37000 13.83000 37.88000 103.42000 0.00000 0.00000 0.00000 2.50000 25.46000 0.00000 -2.32000 0.00000 -0.46000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_25.PDB 17.49000 -47.27000 -15.39000 -70.24000 -2.05000 88.21000 -90.24000 14.04000 38.36000 102.48000 0.00000 0.00000 0.00000 2.52000 25.70000 0.00000 -2.31000 0.00000 -0.62000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_26.PDB 16.41000 -48.60000 -14.88000 -71.08000 -2.24000 88.47000 -91.02000 13.98000 40.40000 102.81000 0.00000 0.00000 0.00000 1.90000 26.03000 0.00000 -2.44000 0.00000 -0.88000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_27.PDB 19.15000 -46.91000 -13.80000 -70.06000 -1.02000 85.32000 -90.77000 14.94000 38.90000 103.65000 0.00000 0.00000 0.00000 1.88000 25.81000 0.00000 -2.37000 0.00000 -0.60000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_28.PDB 18.70000 -46.28000 -11.58000 -70.13000 -1.01000 85.74000 -91.11000 12.97000 37.55000 102.54000 0.00000 0.00000 0.00000 2.45000 25.32000 0.00000 -2.10000 0.00000 -0.35000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_29.PDB 18.04000 -46.02000 -11.29000 -70.55000 -1.09000 85.53000 -91.40000 12.92000 38.82000 101.98000 0.00000 0.00000 0.00000 1.70000 25.59000 0.00000 -2.11000 0.00000 -0.45000 0.00000 0.00000 67.00000 BUD14_1GCQ-21_30.PDB 23.50000 -45.51000 -9.92000 -70.68000 -0.41000 85.24000 -91.81000 14.05000 36.62000 104.74000 0.00000 0.00000 0.00000 3.25000 25.61000 0.00000 -2.13000 0.00000 0.06000 0.00000 0.00000 67.00000