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-19_1.PDB 14.87000 -43.68000 -14.71000 -67.69000 -1.19000 83.35000 -87.88000 11.31000 38.25000 98.06000 0.00000 0.00000 0.00000 2.01000 17.54000 0.00000 -2.25000 0.00000 -0.72000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_2.PDB 16.54000 -42.92000 -10.88000 -67.57000 -0.62000 81.86000 -87.83000 11.62000 35.43000 97.91000 0.00000 0.00000 0.00000 1.77000 17.69000 0.00000 -2.06000 0.00000 -0.17000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_3.PDB 15.67000 -43.40000 -13.68000 -67.77000 -0.98000 83.26000 -87.92000 11.39000 37.41000 98.25000 0.00000 0.00000 0.00000 1.85000 17.78000 0.00000 -2.29000 0.00000 -0.45000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_4.PDB 16.11000 -43.49000 -11.42000 -67.63000 -0.76000 82.17000 -87.59000 11.54000 35.99000 98.05000 0.00000 0.00000 0.00000 1.73000 17.70000 0.00000 -2.15000 0.00000 -0.32000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_5.PDB 15.70000 -43.49000 -11.43000 -67.03000 -0.79000 81.37000 -86.93000 11.25000 35.80000 97.72000 0.00000 0.00000 0.00000 1.68000 17.51000 0.00000 -2.15000 0.00000 -0.29000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_6.PDB 15.70000 -43.46000 -11.41000 -66.98000 -0.73000 81.28000 -86.93000 11.52000 35.78000 97.49000 0.00000 0.00000 0.00000 1.62000 17.51000 0.00000 -2.17000 0.00000 -0.31000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_7.PDB 16.24000 -43.03000 -10.92000 -67.64000 -0.66000 82.01000 -87.66000 11.15000 35.41000 98.20000 0.00000 0.00000 0.00000 1.70000 17.61000 0.00000 -2.13000 0.00000 -0.18000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_8.PDB 15.80000 -43.51000 -12.17000 -67.22000 -1.01000 81.73000 -87.35000 11.64000 36.48000 98.14000 0.00000 0.00000 0.00000 1.57000 17.57000 0.00000 -1.96000 0.00000 -0.54000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_9.PDB 16.45000 -43.48000 -11.39000 -66.84000 -0.83000 80.84000 -86.86000 12.14000 35.97000 97.82000 0.00000 0.00000 0.00000 1.79000 17.48000 0.00000 -2.35000 0.00000 -0.36000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_10.PDB 16.25000 -43.19000 -11.09000 -67.95000 -0.61000 81.87000 -88.27000 11.20000 36.00000 98.20000 0.00000 0.00000 0.00000 2.23000 17.60000 0.00000 -2.03000 0.00000 -0.12000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_11.PDB 17.00000 -43.39000 -12.00000 -67.93000 -1.00000 82.62000 -88.15000 12.03000 36.90000 98.68000 0.00000 0.00000 0.00000 1.77000 17.66000 0.00000 -2.02000 0.00000 -0.52000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_12.PDB 15.46000 -43.30000 -11.88000 -67.75000 -0.94000 82.12000 -87.84000 11.04000 36.66000 98.44000 0.00000 0.00000 0.00000 1.85000 17.64000 0.00000 -2.55000 0.00000 -0.38000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_13.PDB 16.61000 -42.83000 -10.79000 -66.80000 -0.81000 80.78000 -86.73000 10.55000 36.22000 97.72000 0.00000 0.00000 0.00000 1.72000 17.40000 0.00000 -2.09000 0.00000 -0.33000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_14.PDB 15.60000 -43.81000 -14.11000 -67.60000 -1.07000 83.11000 -87.64000 12.26000 37.44000 98.15000 0.00000 0.00000 0.00000 1.86000 17.64000 0.00000 -2.40000 0.00000 -0.59000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_15.PDB 15.57000 -43.45000 -11.47000 -67.52000 -0.74000 82.02000 -87.64000 11.56000 35.94000 97.58000 0.00000 0.00000 0.00000 1.76000 17.60000 0.00000 -2.20000 0.00000 -0.27000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_16.PDB 15.94000 -43.36000 -11.30000 -66.85000 -0.96000 80.98000 -86.86000 11.26000 35.94000 97.78000 0.00000 0.00000 0.00000 1.73000 17.50000 0.00000 -2.05000 0.00000 -0.36000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_17.PDB 16.97000 -43.40000 -12.02000 -66.75000 -0.97000 81.27000 -86.52000 11.66000 36.49000 97.77000 0.00000 0.00000 0.00000 1.84000 17.45000 0.00000 -1.98000 0.00000 -0.44000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_18.PDB 15.63000 -43.51000 -11.43000 -66.94000 -0.79000 81.08000 -86.99000 11.24000 35.80000 97.99000 0.00000 0.00000 0.00000 1.63000 17.51000 0.00000 -2.17000 0.00000 -0.28000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_19.PDB 16.81000 -43.01000 -10.91000 -67.77000 -0.62000 81.84000 -87.88000 11.44000 35.78000 98.01000 0.00000 0.00000 0.00000 2.05000 17.75000 0.00000 -1.97000 0.00000 -0.16000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_20.PDB 16.98000 -43.48000 -12.20000 -68.13000 -1.13000 82.69000 -88.14000 12.46000 37.20000 98.97000 0.00000 0.00000 0.00000 1.75000 17.59000 0.00000 -2.43000 0.00000 -0.58000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_21.PDB 16.46000 -44.21000 -12.83000 -67.69000 -0.96000 82.53000 -87.75000 11.26000 37.30000 99.81000 0.00000 0.00000 0.00000 1.65000 17.54000 0.00000 -2.04000 0.00000 -0.61000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_22.PDB 17.10000 -43.38000 -11.29000 -68.37000 -0.75000 82.51000 -88.45000 11.25000 36.38000 98.73000 0.00000 0.00000 0.00000 2.94000 17.77000 0.00000 -2.29000 0.00000 -0.18000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_23.PDB 15.63000 -42.93000 -10.84000 -67.79000 -0.51000 81.66000 -87.87000 10.99000 35.54000 98.01000 0.00000 0.00000 0.00000 1.65000 17.52000 0.00000 -2.10000 0.00000 -0.17000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_24.PDB 16.89000 -43.40000 -12.19000 -67.77000 -0.94000 82.05000 -87.69000 11.13000 36.93000 98.91000 0.00000 0.00000 0.00000 2.66000 17.53000 0.00000 -2.40000 0.00000 -0.39000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_25.PDB 15.63000 -43.42000 -11.89000 -67.53000 -1.10000 82.04000 -87.58000 11.64000 36.63000 98.05000 0.00000 0.00000 0.00000 1.73000 17.44000 0.00000 -2.35000 0.00000 -0.60000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_26.PDB 15.62000 -43.38000 -11.40000 -67.66000 -0.76000 81.74000 -87.80000 11.45000 36.18000 97.95000 0.00000 0.00000 0.00000 1.62000 17.49000 0.00000 -2.02000 0.00000 -0.30000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_27.PDB 16.53000 -43.43000 -11.35000 -66.98000 -0.74000 81.60000 -86.72000 11.75000 35.61000 97.61000 0.00000 0.00000 0.00000 1.63000 17.53000 0.00000 -2.22000 0.00000 -0.25000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_28.PDB 14.94000 -43.66000 -13.84000 -68.21000 -0.90000 83.04000 -88.40000 11.68000 37.82000 98.53000 0.00000 0.00000 0.00000 1.85000 17.59000 0.00000 -2.42000 0.00000 -0.56000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_29.PDB 17.20000 -43.45000 -11.41000 -68.33000 -0.83000 82.35000 -88.59000 12.65000 36.47000 98.95000 0.00000 0.00000 0.00000 1.78000 17.71000 0.00000 -2.13000 0.00000 -0.27000 0.00000 0.00000 66.00000 BUD14_1GCQ-19_30.PDB 17.25000 -43.25000 -11.82000 -68.35000 -1.05000 82.84000 -88.45000 12.26000 36.95000 99.08000 0.00000 0.00000 0.00000 1.97000 17.57000 0.00000 -2.34000 0.00000 -0.59000 0.00000 0.00000 66.00000