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-26_1.PDB 11.85000 -45.38000 -14.68000 -67.62000 -0.28000 83.57000 -86.66000 9.46000 39.04000 95.46000 0.00000 0.00000 0.00000 2.30000 17.80000 0.00000 -2.92000 0.00000 -0.43000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_2.PDB 13.00000 -42.98000 -12.54000 -66.45000 -0.69000 79.64000 -86.12000 9.84000 37.60000 95.31000 0.00000 0.00000 0.00000 2.14000 17.26000 0.00000 -1.94000 0.00000 -0.82000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_3.PDB 11.57000 -44.58000 -13.99000 -67.27000 -0.69000 82.88000 -86.56000 9.42000 38.04000 95.45000 0.00000 0.00000 0.00000 2.11000 17.78000 0.00000 -2.79000 0.00000 -0.46000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_4.PDB 11.49000 -44.52000 -13.98000 -66.97000 -1.23000 82.71000 -86.30000 9.38000 38.34000 95.32000 0.00000 0.00000 0.00000 2.12000 17.75000 0.00000 -2.92000 0.00000 -0.47000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_5.PDB 13.90000 -42.09000 -11.72000 -65.33000 -0.71000 78.07000 -85.00000 10.23000 36.38000 94.69000 0.00000 0.00000 0.00000 1.87000 16.90000 0.00000 -1.85000 0.00000 -0.63000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_6.PDB 12.04000 -42.80000 -12.44000 -66.18000 -1.00000 79.41000 -85.40000 8.86000 37.88000 94.81000 0.00000 0.00000 0.00000 2.30000 17.15000 0.00000 -2.24000 0.00000 -1.14000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_7.PDB 12.94000 -42.81000 -12.39000 -65.80000 -0.61000 79.25000 -84.89000 9.15000 37.29000 94.48000 0.00000 0.00000 0.00000 2.37000 17.23000 0.00000 -2.23000 0.00000 -0.86000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_8.PDB 12.92000 -43.61000 -13.07000 -66.82000 -1.48000 82.80000 -86.35000 9.38000 37.83000 95.33000 0.00000 0.00000 0.00000 2.21000 17.32000 0.00000 -2.77000 0.00000 -0.56000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_9.PDB 12.10000 -43.00000 -12.49000 -66.17000 -0.86000 78.94000 -85.77000 9.66000 37.48000 94.50000 0.00000 0.00000 0.00000 2.85000 17.60000 0.00000 -2.02000 0.00000 -1.02000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_10.PDB 12.17000 -42.09000 -13.34000 -66.27000 -0.46000 79.04000 -85.76000 8.48000 37.68000 95.10000 0.00000 0.00000 0.00000 2.46000 17.28000 0.00000 -2.00000 0.00000 -0.66000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_11.PDB 10.67000 -44.51000 -13.98000 -67.31000 -0.77000 82.26000 -87.05000 9.79000 38.30000 95.13000 0.00000 0.00000 0.00000 2.17000 17.62000 0.00000 -2.80000 0.00000 -0.57000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_12.PDB 10.59000 -42.89000 -12.25000 -67.21000 -1.13000 80.05000 -87.42000 9.37000 38.21000 95.20000 0.00000 0.00000 0.00000 1.81000 17.61000 0.00000 -2.11000 0.00000 -1.05000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_13.PDB 10.01000 -44.41000 -13.88000 -68.52000 -0.81000 82.96000 -88.99000 9.98000 38.80000 95.91000 0.00000 0.00000 0.00000 1.95000 17.84000 0.00000 -2.60000 0.00000 -0.37000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_14.PDB 12.55000 -42.85000 -12.33000 -65.84000 -0.61000 79.19000 -85.35000 9.26000 37.00000 95.12000 0.00000 0.00000 0.00000 1.99000 17.32000 0.00000 -2.19000 0.00000 -0.83000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_15.PDB 12.32000 -44.57000 -14.11000 -66.70000 -0.82000 82.45000 -85.90000 9.36000 37.82000 95.49000 0.00000 0.00000 0.00000 2.39000 17.70000 0.00000 -2.74000 0.00000 -0.37000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_16.PDB 13.40000 -43.50000 -12.98000 -66.40000 -0.89000 81.68000 -85.44000 10.42000 36.67000 94.38000 0.00000 0.00000 0.00000 3.11000 17.29000 0.00000 -3.00000 0.00000 -0.64000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_17.PDB 13.02000 -42.66000 -12.28000 -67.39000 -0.80000 80.49000 -87.35000 9.74000 38.09000 95.85000 0.00000 0.00000 0.00000 2.11000 17.24000 0.00000 -1.94000 0.00000 -0.84000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_18.PDB 11.77000 -42.77000 -12.40000 -66.24000 -1.49000 79.49000 -85.48000 9.00000 38.15000 94.70000 0.00000 0.00000 0.00000 2.17000 17.21000 0.00000 -2.40000 0.00000 -0.97000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_19.PDB 13.26000 -43.62000 -13.25000 -67.12000 -0.76000 82.04000 -85.99000 10.17000 38.06000 94.76000 0.00000 0.00000 0.00000 2.20000 17.21000 0.00000 -2.27000 0.00000 -0.96000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_20.PDB 11.87000 -44.68000 -14.11000 -66.86000 -0.81000 82.47000 -85.88000 10.57000 37.81000 94.36000 0.00000 0.00000 0.00000 2.19000 17.58000 0.00000 -2.70000 0.00000 -0.48000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_21.PDB 13.36000 -42.90000 -12.55000 -65.95000 -0.70000 79.07000 -85.51000 9.47000 37.42000 95.50000 0.00000 0.00000 0.00000 2.25000 17.34000 0.00000 -2.13000 0.00000 -0.59000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_22.PDB 13.14000 -44.50000 -13.97000 -66.25000 -1.43000 81.93000 -85.53000 10.33000 38.31000 94.41000 0.00000 0.00000 0.00000 2.69000 17.50000 0.00000 -2.36000 0.00000 -0.50000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_23.PDB 13.24000 -42.90000 -12.45000 -65.76000 -0.85000 79.26000 -84.87000 9.05000 37.59000 94.58000 0.00000 0.00000 0.00000 2.81000 17.30000 0.00000 -2.25000 0.00000 -0.96000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_24.PDB 14.60000 -44.48000 -13.97000 -67.08000 -1.28000 82.69000 -86.48000 12.16000 38.60000 94.95000 0.00000 0.00000 0.00000 2.32000 17.70000 0.00000 -2.33000 0.00000 -0.51000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_25.PDB 12.20000 -43.42000 -12.81000 -65.96000 -0.82000 81.30000 -85.24000 9.54000 36.30000 94.46000 0.00000 0.00000 0.00000 2.05000 17.52000 0.00000 -2.63000 0.00000 -0.59000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_26.PDB 13.36000 -41.93000 -11.50000 -65.00000 -1.45000 78.55000 -84.29000 8.91000 36.60000 94.21000 0.00000 0.00000 0.00000 2.09000 16.87000 0.00000 -2.05000 0.00000 -0.77000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_27.PDB 11.02000 -42.74000 -12.34000 -66.61000 -1.21000 79.44000 -87.04000 9.48000 37.93000 95.03000 0.00000 0.00000 0.00000 1.80000 17.25000 0.00000 -1.95000 0.00000 -0.78000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_28.PDB 12.85000 -42.05000 -13.44000 -66.52000 -0.88000 79.47000 -86.19000 9.61000 38.69000 95.06000 0.00000 0.00000 0.00000 1.98000 16.96000 0.00000 -2.12000 0.00000 -0.76000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_29.PDB 10.83000 -42.82000 -12.38000 -67.41000 -1.31000 80.32000 -87.83000 9.67000 38.67000 95.51000 0.00000 0.00000 0.00000 1.73000 17.52000 0.00000 -2.18000 0.00000 -1.14000 0.00000 0.00000 66.00000 BUD14_1GCQ-26_30.PDB 10.27000 -44.53000 -14.01000 -66.49000 -0.84000 81.72000 -85.66000 9.26000 37.71000 94.28000 0.00000 0.00000 0.00000 2.19000 17.56000 0.00000 -2.80000 0.00000 -0.56000 0.00000 0.00000 66.00000