name Intraclash total energy Backbone Hbond 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 2.85074 -7.32000 -1.73000 -3.23000 -6.29000 -0.55000 7.03000 -7.96000 0.36000 4.69000 2.00000 0.00000 0.00000 0.00000 0.06000 0.79000 0.00000 -1.28000 0.00000 -0.43000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_2.PDB 3.19086 -5.09000 -0.07000 -1.76000 -6.14000 -0.69000 5.03000 -8.45000 0.63000 4.69000 2.64000 0.00000 0.00000 0.00000 0.02000 0.41000 0.00000 -0.18000 0.00000 -0.82000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_3.PDB 2.80991 -7.36000 -1.73000 -3.36000 -6.37000 -0.58000 7.14000 -8.03000 0.25000 4.79000 2.03000 0.00000 0.00000 0.00000 0.07000 0.79000 0.00000 -1.13000 0.00000 -0.46000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_4.PDB 2.72512 -7.79000 -1.71000 -3.39000 -6.62000 -0.61000 7.02000 -8.34000 0.34000 4.91000 2.18000 0.00000 0.00000 0.00000 0.08000 0.77000 0.00000 -1.18000 0.00000 -0.47000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_5.PDB 3.25291 -4.32000 -0.00000 -1.76000 -6.00000 -0.61000 5.11000 -8.17000 0.76000 4.61000 2.53000 0.00000 0.00000 0.00000 0.02000 0.15000 0.00000 -0.17000 0.00000 -0.63000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_6.PDB 2.35145 -5.93000 -0.87000 -2.63000 -6.13000 -1.06000 5.40000 -7.94000 0.59000 5.98000 2.31000 0.00000 0.00000 0.00000 0.06000 0.39000 0.00000 -0.50000 0.00000 -1.14000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_7.PDB 2.44599 -5.18000 -0.93000 -2.63000 -5.94000 -0.77000 5.50000 -7.68000 0.91000 5.49000 2.27000 0.00000 0.00000 0.00000 0.04000 0.44000 0.00000 -0.58000 0.00000 -0.86000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_8.PDB 3.23707 -6.41000 -0.86000 -2.53000 -6.66000 -0.69000 7.30000 -8.54000 0.33000 4.38000 2.25000 0.00000 0.00000 0.00000 0.09000 0.34000 0.00000 -0.90000 0.00000 -0.56000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_9.PDB 3.22529 -6.58000 -1.00000 -2.63000 -6.83000 -0.90000 5.70000 -9.12000 1.04000 6.05000 2.51000 0.00000 0.00000 0.00000 0.12000 0.81000 0.00000 -0.49000 0.00000 -1.02000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_10.PDB 1.77661 -5.27000 -0.05000 -3.43000 -5.66000 -0.55000 4.82000 -7.68000 0.88000 4.66000 2.42000 0.00000 0.00000 0.00000 0.07000 0.28000 0.00000 -0.10000 0.00000 -0.66000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_11.PDB 3.11382 -7.82000 -1.71000 -3.38000 -6.91000 -0.69000 7.29000 -8.98000 0.48000 5.30000 2.41000 0.00000 0.00000 0.00000 0.08000 0.60000 0.00000 -1.15000 0.00000 -0.57000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_12.PDB 2.36682 -7.44000 -0.96000 -2.44000 -6.86000 -1.00000 5.98000 -9.34000 0.33000 6.01000 2.40000 0.00000 0.00000 0.00000 0.05000 0.77000 0.00000 -0.56000 0.00000 -1.05000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_13.PDB 2.73254 -8.87000 -1.65000 -3.32000 -7.41000 -0.53000 7.29000 -9.96000 0.38000 5.39000 2.25000 0.00000 0.00000 0.00000 0.08000 0.80000 0.00000 -1.00000 0.00000 -0.37000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_14.PDB 2.89483 -6.25000 -0.96000 -2.56000 -5.88000 -0.65000 5.26000 -7.94000 0.22000 5.25000 2.38000 0.00000 0.00000 0.00000 0.02000 0.52000 0.00000 -0.57000 0.00000 -0.83000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_15.PDB 2.91975 -6.88000 -1.70000 -3.44000 -6.03000 -0.53000 6.84000 -7.70000 0.27000 4.70000 2.12000 0.00000 0.00000 0.00000 0.07000 0.69000 0.00000 -1.10000 0.00000 -0.37000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_16.PDB 3.71826 -6.16000 -1.73000 -3.41000 -7.23000 -0.68000 8.02000 -9.06000 1.84000 5.30000 2.24000 0.00000 0.00000 0.00000 0.29000 0.32000 0.00000 -1.09000 0.00000 -0.64000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_17.PDB 3.15472 -4.51000 0.00000 -1.74000 -6.35000 -0.74000 5.49000 -8.49000 0.57000 4.86000 2.85000 0.00000 0.00000 0.00000 0.08000 0.26000 0.00000 -0.20000 0.00000 -0.84000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_18.PDB 2.44504 -5.71000 -0.83000 -2.59000 -6.15000 -0.97000 5.63000 -7.87000 0.61000 5.93000 2.29000 0.00000 0.00000 0.00000 0.06000 0.43000 0.00000 -0.85000 0.00000 -0.97000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_19.PDB 2.47549 -4.98000 -1.66000 -3.40000 -7.04000 -0.88000 7.75000 -8.54000 1.88000 6.04000 2.34000 0.00000 0.00000 0.00000 0.05000 0.43000 0.00000 -0.54000 0.00000 -0.96000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_20.PDB 2.75731 -6.55000 -1.72000 -3.36000 -7.15000 -0.64000 7.73000 -8.93000 1.85000 5.20000 2.02000 0.00000 0.00000 0.00000 0.10000 0.56000 0.00000 -1.17000 0.00000 -0.48000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_21.PDB 3.10355 -5.43000 -0.95000 -2.72000 -6.38000 -0.53000 5.66000 -8.51000 0.48000 5.61000 2.87000 0.00000 0.00000 0.00000 0.02000 0.53000 0.00000 -0.39000 0.00000 -0.59000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_22.PDB 2.88766 -5.65000 -1.69000 -3.37000 -6.42000 -0.58000 6.64000 -8.29000 1.95000 5.00000 1.95000 0.00000 0.00000 0.00000 0.19000 0.51000 0.00000 -0.53000 0.00000 -0.50000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_23.PDB 2.94346 -5.84000 -0.94000 -2.62000 -6.31000 -0.93000 5.74000 -8.25000 0.73000 5.90000 2.38000 0.00000 0.00000 0.00000 0.12000 0.57000 0.00000 -0.70000 0.00000 -0.96000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_24.PDB 2.64699 -4.07000 -1.69000 -3.38000 -6.72000 -0.60000 7.05000 -8.49000 3.67000 5.02000 2.16000 0.00000 0.00000 0.00000 0.11000 0.69000 0.00000 -0.70000 0.00000 -0.51000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_25.PDB 2.77749 -6.81000 -1.41000 -3.01000 -6.25000 -0.70000 7.17000 -7.95000 0.45000 4.43000 2.03000 0.00000 0.00000 0.00000 0.05000 0.52000 0.00000 -1.03000 0.00000 -0.59000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_26.PDB 2.48726 -5.05000 0.00000 -1.71000 -5.47000 -0.63000 4.37000 -7.43000 0.50000 4.36000 2.04000 0.00000 0.00000 0.00000 0.04000 0.10000 0.00000 -0.35000 0.00000 -0.77000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_27.PDB 2.64211 -6.62000 0.00000 -1.72000 -6.10000 -0.65000 4.44000 -8.76000 0.32000 4.66000 2.19000 0.00000 0.00000 0.00000 0.03000 0.31000 0.00000 -0.25000 0.00000 -0.78000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_28.PDB 2.61770 -6.38000 -0.00000 -3.52000 -6.32000 -0.64000 5.34000 -8.46000 0.42000 5.48000 2.30000 0.00000 0.00000 0.00000 0.02000 0.16000 0.00000 -0.23000 0.00000 -0.76000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_29.PDB 2.79327 -7.72000 -0.92000 -2.58000 -7.51000 -1.09000 6.46000 -10.29000 0.55000 6.58000 2.75000 0.00000 0.00000 0.00000 0.03000 0.74000 0.00000 -0.57000 0.00000 -1.14000 0.00000 2.38000 66.00000 BUD14_1GCQ-26_30.PDB 2.53555 -7.89000 -1.70000 -3.39000 -6.59000 -0.73000 6.93000 -8.43000 0.66000 5.05000 1.99000 0.00000 0.00000 0.00000 0.09000 0.55000 0.00000 -1.21000 0.00000 -0.56000 0.00000 2.38000 66.00000