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-28_1.PDB 13.48000 -42.70000 -11.96000 -71.60000 0.11000 85.11000 -94.13000 9.75000 39.42000 98.99000 0.00000 0.00000 0.00000 3.38000 18.88000 0.00000 -2.68000 0.00000 -0.23000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_2.PDB 13.52000 -42.73000 -12.28000 -70.47000 -0.01000 84.74000 -91.88000 8.51000 39.65000 98.19000 0.00000 0.00000 0.00000 2.74000 18.81000 0.00000 -2.62000 0.00000 -0.33000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_3.PDB 12.62000 -42.87000 -10.37000 -71.23000 0.33000 84.35000 -93.33000 8.52000 39.06000 97.68000 0.00000 0.00000 0.00000 2.80000 18.96000 0.00000 -2.37000 0.00000 0.05000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_4.PDB 14.03000 -42.62000 -11.93000 -72.10000 0.22000 85.67000 -94.59000 9.21000 39.17000 100.23000 0.00000 0.00000 0.00000 3.55000 20.12000 0.00000 -2.70000 0.00000 -0.08000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_5.PDB 12.93000 -42.01000 -11.62000 -70.28000 -0.11000 83.82000 -92.02000 8.55000 39.08000 97.18000 0.00000 0.00000 0.00000 3.30000 18.85000 0.00000 -2.53000 0.00000 -0.43000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_6.PDB 13.22000 -43.32000 -13.43000 -71.09000 -0.12000 85.93000 -92.67000 7.92000 40.84000 98.99000 0.00000 0.00000 0.00000 3.25000 19.70000 0.00000 -2.74000 0.00000 -0.34000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_7.PDB 15.72000 -42.20000 -9.74000 -71.27000 0.36000 85.28000 -93.27000 7.83000 38.28000 99.68000 0.00000 0.00000 0.00000 3.06000 20.02000 0.00000 -2.38000 0.00000 0.09000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_8.PDB 13.94000 -41.74000 -12.27000 -70.75000 0.31000 84.36000 -92.53000 9.06000 38.22000 98.54000 0.00000 0.00000 0.00000 3.50000 18.57000 0.00000 -2.77000 0.00000 0.00000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_9.PDB 14.10000 -42.25000 -9.75000 -71.57000 0.25000 84.63000 -94.07000 9.41000 39.01000 97.49000 0.00000 0.00000 0.00000 3.50000 18.84000 0.00000 -2.60000 0.00000 0.06000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_10.PDB 14.44000 -42.73000 -10.23000 -70.90000 0.41000 84.28000 -92.93000 7.99000 38.80000 98.62000 0.00000 0.00000 0.00000 3.42000 19.74000 0.00000 -2.41000 0.00000 0.11000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_11.PDB 12.97000 -42.81000 -10.34000 -71.94000 0.36000 84.04000 -95.15000 9.85000 39.55000 98.64000 0.00000 0.00000 0.00000 3.04000 19.32000 0.00000 -2.29000 0.00000 0.02000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_12.PDB 13.78000 -42.79000 -12.89000 -70.77000 -0.27000 84.41000 -92.45000 8.63000 40.92000 99.47000 0.00000 0.00000 0.00000 3.04000 19.62000 0.00000 -2.86000 0.00000 -0.66000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_13.PDB 12.23000 -42.75000 -11.96000 -70.89000 0.37000 84.88000 -93.10000 9.24000 38.50000 97.68000 0.00000 0.00000 0.00000 2.67000 19.63000 0.00000 -2.57000 0.00000 0.16000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_14.PDB 14.71000 -42.62000 -10.60000 -71.46000 0.07000 85.49000 -93.85000 9.58000 39.27000 98.17000 0.00000 0.00000 0.00000 3.38000 18.86000 0.00000 -2.67000 0.00000 -0.04000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_15.PDB 13.15000 -42.83000 -12.79000 -70.79000 0.16000 84.80000 -92.23000 8.58000 40.07000 97.99000 0.00000 0.00000 0.00000 3.24000 19.68000 0.00000 -2.98000 0.00000 -0.10000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_16.PDB 13.97000 -42.05000 -10.14000 -70.04000 -0.00000 83.78000 -91.90000 8.48000 38.21000 97.52000 0.00000 0.00000 0.00000 3.20000 18.71000 0.00000 -2.83000 0.00000 -0.25000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_17.PDB 13.50000 -41.99000 -10.04000 -71.60000 -0.25000 83.90000 -94.76000 9.34000 39.32000 98.64000 0.00000 0.00000 0.00000 3.89000 18.93000 0.00000 -2.35000 0.00000 -0.60000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_18.PDB 13.03000 -41.94000 -12.76000 -70.43000 0.26000 84.48000 -91.70000 8.47000 38.24000 96.92000 0.00000 0.00000 0.00000 4.51000 18.87000 0.00000 -2.89000 0.00000 -0.13000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_19.PDB 11.99000 -42.68000 -11.99000 -70.80000 0.18000 84.54000 -92.76000 10.09000 38.74000 96.02000 0.00000 0.00000 0.00000 3.20000 19.03000 0.00000 -2.65000 0.00000 0.09000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_20.PDB 13.34000 -42.59000 -14.78000 -70.76000 0.09000 85.53000 -92.28000 8.31000 40.69000 99.11000 0.00000 0.00000 0.00000 3.16000 19.53000 0.00000 -2.91000 0.00000 -0.25000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_21.PDB 15.08000 -41.95000 -10.05000 -70.45000 0.02000 83.76000 -92.48000 8.92000 38.79000 97.77000 0.00000 0.00000 0.00000 3.46000 18.54000 0.00000 -2.45000 0.00000 -0.27000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_22.PDB 12.28000 -41.95000 -12.04000 -70.14000 0.15000 83.87000 -91.80000 7.73000 38.74000 97.95000 0.00000 0.00000 0.00000 2.58000 19.52000 0.00000 -2.68000 0.00000 -0.13000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_23.PDB 13.84000 -42.79000 -12.12000 -71.25000 0.23000 85.93000 -92.93000 9.01000 38.90000 98.63000 0.00000 0.00000 0.00000 2.80000 20.40000 0.00000 -2.59000 0.00000 -0.01000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_24.PDB 13.16000 -43.69000 -11.28000 -71.72000 0.28000 84.51000 -94.59000 11.58000 38.96000 97.77000 0.00000 0.00000 0.00000 3.65000 19.34000 0.00000 -2.45000 0.00000 0.14000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_25.PDB 15.31000 -42.57000 -10.07000 -70.84000 0.44000 84.16000 -93.06000 9.50000 38.62000 99.03000 0.00000 0.00000 0.00000 2.33000 18.96000 0.00000 -2.38000 0.00000 0.14000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_26.PDB 13.71000 -42.83000 -12.13000 -71.34000 0.17000 85.21000 -93.68000 9.90000 39.07000 98.56000 0.00000 0.00000 0.00000 3.26000 19.10000 0.00000 -2.36000 0.00000 -0.11000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_27.PDB 12.32000 -42.59000 -11.82000 -70.30000 -0.24000 85.30000 -91.63000 8.59000 39.10000 95.90000 0.00000 0.00000 0.00000 3.08000 18.69000 0.00000 -2.71000 0.00000 -0.35000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_28.PDB 14.18000 -41.99000 -9.46000 -71.53000 0.13000 84.38000 -94.43000 8.19000 38.40000 100.12000 0.00000 0.00000 0.00000 3.14000 20.49000 0.00000 -2.55000 0.00000 -0.23000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_29.PDB 13.41000 -42.20000 -9.71000 -70.73000 0.24000 84.19000 -92.70000 8.59000 38.04000 96.80000 0.00000 0.00000 0.00000 3.51000 18.99000 0.00000 -2.72000 0.00000 0.10000 0.00000 0.00000 67.00000 BUD14_1GCQ-28_30.PDB 13.10000 -42.60000 -12.67000 -70.90000 -0.24000 85.67000 -92.38000 7.82000 39.81000 98.40000 0.00000 0.00000 0.00000 3.19000 19.91000 0.00000 -2.64000 0.00000 -0.36000 0.00000 0.00000 67.00000