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-23_1.PDB 2.26741 -8.22000 -3.15000 -3.09000 -6.28000 -0.42000 5.59000 -8.60000 0.09000 5.37000 3.10000 0.00000 0.00000 0.00000 0.05000 0.49000 0.00000 -0.35000 0.00000 -0.53000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_2.PDB 1.81129 -8.71000 -3.21000 -3.85000 -6.29000 -0.48000 5.69000 -8.44000 0.11000 6.00000 2.95000 0.00000 0.00000 0.00000 0.04000 0.41000 0.00000 -0.62000 0.00000 -0.61000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_3.PDB 1.56157 -6.47000 -2.24000 -2.97000 -6.16000 -0.68000 5.88000 -8.11000 0.36000 5.87000 2.85000 0.00000 0.00000 0.00000 0.05000 0.77000 0.00000 -0.45000 0.00000 -0.87000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_4.PDB 2.84115 -9.64000 -4.10000 -4.73000 -7.08000 -0.55000 7.33000 -9.00000 0.56000 6.96000 2.91000 0.00000 0.00000 0.00000 0.06000 0.72000 0.00000 -1.13000 0.00000 -0.87000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_5.PDB 2.43067 -8.08000 -3.10000 -3.43000 -6.26000 -0.48000 5.65000 -8.53000 0.19000 5.87000 2.97000 0.00000 0.00000 0.00000 0.03000 0.42000 0.00000 -0.39000 0.00000 -0.59000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_6.PDB 1.61048 -9.42000 -4.00000 -3.96000 -6.65000 -0.31000 6.21000 -8.86000 0.26000 5.48000 3.15000 0.00000 0.00000 0.00000 0.06000 0.62000 0.00000 -0.33000 0.00000 -0.48000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_7.PDB 2.27870 -6.53000 -2.22000 -2.19000 -5.97000 -0.47000 5.21000 -8.11000 0.20000 4.78000 2.91000 0.00000 0.00000 0.00000 0.05000 0.58000 0.00000 -0.18000 0.00000 -0.53000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_8.PDB 2.04672 -8.68000 -3.54000 -3.51000 -6.46000 -0.49000 6.47000 -8.66000 0.23000 5.16000 3.10000 0.00000 0.00000 0.00000 0.03000 0.71000 0.00000 -0.39000 0.00000 -0.63000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_9.PDB 1.77229 -8.68000 -3.20000 -3.13000 -6.62000 -0.33000 5.96000 -8.73000 0.16000 5.49000 2.78000 0.00000 0.00000 0.00000 0.04000 0.43000 0.00000 -0.62000 0.00000 -0.48000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_10.PDB 2.30128 -6.92000 -2.41000 -2.33000 -6.53000 -0.47000 5.80000 -8.84000 0.94000 5.20000 2.72000 0.00000 0.00000 0.00000 0.04000 0.70000 0.00000 -0.42000 0.00000 -0.62000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_11.PDB 1.78075 -8.97000 -4.05000 -4.03000 -6.52000 -0.33000 6.60000 -8.50000 0.21000 5.99000 2.63000 0.00000 0.00000 0.00000 0.05000 0.68000 0.00000 -0.57000 0.00000 -0.44000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_12.PDB 2.47182 -9.30000 -3.13000 -3.05000 -6.75000 -0.46000 6.08000 -9.08000 0.25000 5.13000 2.74000 0.00000 0.00000 0.00000 0.13000 0.69000 0.00000 -0.61000 0.00000 -0.56000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_13.PDB 2.73006 -7.65000 -2.37000 -2.25000 -6.63000 -0.30000 5.28000 -9.37000 0.53000 5.08000 3.07000 0.00000 0.00000 0.00000 0.04000 0.74000 0.00000 -0.39000 0.00000 -0.34000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_14.PDB 2.14661 -7.21000 -2.44000 -2.31000 -6.30000 -0.27000 5.16000 -8.81000 0.28000 4.88000 3.07000 0.00000 0.00000 0.00000 0.06000 0.81000 0.00000 -0.16000 0.00000 -0.38000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_15.PDB 2.70711 -8.82000 -3.27000 -3.16000 -6.42000 -0.47000 5.29000 -8.85000 1.21000 4.59000 3.14000 0.00000 0.00000 0.00000 0.05000 0.65000 0.00000 -0.37000 0.00000 -0.55000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_16.PDB 1.46442 -6.80000 -2.17000 -2.07000 -5.90000 -0.35000 5.40000 -8.05000 0.14000 4.61000 2.64000 0.00000 0.00000 0.00000 0.02000 0.54000 0.00000 -0.65000 0.00000 -0.43000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_17.PDB 2.94328 -8.19000 -2.40000 -2.58000 -5.97000 -0.47000 4.57000 -8.50000 0.28000 4.76000 3.18000 0.00000 0.00000 0.00000 0.04000 0.44000 0.00000 -0.54000 0.00000 -0.55000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_18.PDB 2.30075 -6.29000 -1.92000 -2.67000 -5.67000 -1.10000 5.81000 -7.33000 0.19000 5.89000 2.21000 0.00000 0.00000 0.00000 0.02000 0.62000 0.00000 -0.40000 0.00000 -1.32000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_19.PDB 2.77633 -5.78000 -1.52000 -2.28000 -5.38000 -0.73000 4.64000 -7.40000 0.31000 5.00000 2.97000 0.00000 0.00000 0.00000 0.04000 0.55000 0.00000 -0.49000 0.00000 -0.94000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_20.PDB 2.05618 -9.25000 -4.00000 -3.94000 -7.14000 -0.36000 6.56000 -9.47000 0.32000 6.18000 3.21000 0.00000 0.00000 0.00000 0.08000 0.63000 0.00000 -0.14000 0.00000 -0.52000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_21.PDB 2.24894 -7.30000 -2.35000 -3.44000 -5.92000 -0.71000 5.44000 -7.74000 0.11000 5.87000 3.26000 0.00000 0.00000 0.00000 0.11000 0.53000 0.00000 -0.97000 0.00000 -0.96000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_22.PDB 1.53133 -5.44000 -1.46000 -2.42000 -5.28000 -0.84000 4.82000 -7.09000 0.11000 5.35000 2.62000 0.00000 0.00000 0.00000 0.06000 0.42000 0.00000 -0.29000 0.00000 -1.02000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_23.PDB 2.21988 -5.25000 -1.54000 -2.19000 -4.92000 -0.71000 4.41000 -6.79000 0.07000 4.86000 2.99000 0.00000 0.00000 0.00000 0.02000 0.43000 0.00000 -0.52000 0.00000 -0.92000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_24.PDB 2.34533 -6.99000 -2.25000 -3.00000 -5.58000 -0.75000 4.97000 -7.56000 0.14000 5.28000 3.35000 0.00000 0.00000 0.00000 0.12000 0.53000 0.00000 -0.67000 0.00000 -1.04000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_25.PDB 2.31005 -6.62000 -2.24000 -3.02000 -5.89000 -0.88000 5.32000 -7.92000 0.92000 5.64000 3.27000 0.00000 0.00000 0.00000 0.04000 0.40000 0.00000 -0.80000 0.00000 -1.08000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_26.PDB 2.12807 -6.61000 -2.17000 -2.10000 -6.28000 -0.54000 5.82000 -8.64000 0.33000 5.08000 2.69000 0.00000 0.00000 0.00000 0.03000 0.66000 0.00000 -0.25000 0.00000 -0.58000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_27.PDB 1.84578 -5.64000 -1.39000 -2.16000 -5.95000 -0.73000 5.36000 -7.94000 0.13000 5.28000 3.15000 0.00000 0.00000 0.00000 0.12000 0.55000 0.00000 -0.53000 0.00000 -0.98000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_28.PDB 2.20626 -5.78000 -0.62000 -0.53000 -5.44000 -0.40000 4.13000 -8.04000 0.16000 3.33000 2.33000 0.00000 0.00000 0.00000 0.03000 0.49000 0.00000 -0.18000 0.00000 -0.54000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_29.PDB 1.45247 -5.75000 -1.52000 -1.60000 -5.46000 -0.39000 4.27000 -7.84000 0.12000 4.35000 2.94000 0.00000 0.00000 0.00000 0.02000 0.40000 0.00000 -0.20000 0.00000 -0.46000 0.00000 2.38000 64.00000 BUD14_1GCQ-23_30.PDB 1.40873 -6.15000 -0.65000 -0.55000 -5.51000 -0.33000 4.21000 -8.04000 0.15000 3.31000 2.18000 0.00000 0.00000 0.00000 0.03000 0.50000 0.00000 -0.48000 0.00000 -0.47000 0.00000 2.38000 64.00000