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-15_1.PDB 3.11734 -4.44000 -2.08000 -2.08000 -7.70000 0.17000 8.33000 -10.20000 1.19000 3.57000 4.83000 0.00000 0.00000 0.00000 0.04000 0.51000 0.00000 -0.57000 0.00000 0.06000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_2.PDB 2.03030 -4.71000 -2.06000 -2.03000 -6.10000 -0.00000 6.47000 -8.15000 0.22000 3.31000 3.99000 0.00000 0.00000 0.00000 0.03000 0.47000 0.00000 -0.37000 0.00000 -0.02000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_3.PDB 2.83137 -5.26000 -1.66000 -1.69000 -7.64000 0.18000 8.31000 -10.21000 0.31000 3.13000 4.15000 0.00000 0.00000 0.00000 0.03000 0.31000 0.00000 -0.30000 0.00000 0.12000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_4.PDB 2.05145 -4.46000 -2.34000 -2.30000 -6.44000 0.22000 6.94000 -8.49000 0.24000 3.32000 4.90000 0.00000 0.00000 0.00000 0.05000 0.43000 0.00000 -0.75000 0.00000 0.19000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_5.PDB 3.08201 -4.89000 -2.05000 -2.05000 -6.72000 0.03000 6.80000 -9.21000 0.34000 3.69000 4.53000 0.00000 0.00000 0.00000 0.04000 0.42000 0.00000 -0.29000 0.00000 -0.02000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_6.PDB 3.17563 -5.41000 -2.09000 -2.06000 -7.46000 0.09000 7.98000 -9.96000 0.38000 3.43000 4.62000 0.00000 0.00000 0.00000 0.06000 0.40000 0.00000 -0.41000 0.00000 0.00000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_7.PDB 1.97962 -4.79000 -2.03000 -2.04000 -6.89000 -0.05000 7.25000 -9.21000 0.18000 3.75000 4.67000 0.00000 0.00000 0.00000 0.05000 0.42000 0.00000 -0.38000 0.00000 -0.09000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_8.PDB 2.99811 -4.68000 -2.03000 -2.00000 -6.97000 0.13000 7.28000 -9.38000 0.23000 3.77000 4.63000 0.00000 0.00000 0.00000 0.04000 0.40000 0.00000 -0.43000 0.00000 0.05000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_9.PDB 3.00668 -4.72000 -2.41000 -2.37000 -7.21000 0.11000 7.44000 -9.73000 0.32000 3.92000 5.43000 0.00000 0.00000 0.00000 0.05000 0.39000 0.00000 -0.32000 0.00000 0.05000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_10.PDB 3.71703 -2.83000 -1.24000 -1.21000 -7.04000 0.09000 7.69000 -9.42000 0.98000 3.31000 3.99000 0.00000 0.00000 0.00000 0.26000 0.49000 0.00000 -0.27000 0.00000 0.03000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_11.PDB 3.20547 -3.97000 -2.52000 -2.52000 -7.22000 -0.03000 7.86000 -9.57000 0.29000 3.95000 6.13000 0.00000 0.00000 0.00000 0.06000 0.44000 0.00000 -0.39000 0.00000 -0.02000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_12.PDB 2.79545 -5.50000 -1.53000 -1.56000 -7.57000 -0.04000 7.93000 -10.14000 0.29000 3.04000 4.17000 0.00000 0.00000 0.00000 0.05000 0.28000 0.00000 -0.18000 0.00000 0.04000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_13.PDB 2.82795 -5.41000 -2.07000 -2.06000 -7.28000 0.10000 7.61000 -9.78000 0.26000 3.42000 4.72000 0.00000 0.00000 0.00000 0.06000 0.41000 0.00000 -0.42000 0.00000 0.01000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_14.PDB 1.76611 -5.13000 -1.67000 -1.69000 -7.16000 0.01000 7.89000 -9.39000 0.26000 2.92000 3.81000 0.00000 0.00000 0.00000 0.04000 0.33000 0.00000 -0.22000 0.00000 0.07000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_15.PDB 2.07691 -4.23000 -2.06000 -2.03000 -6.48000 0.15000 7.40000 -8.49000 0.75000 2.88000 3.91000 0.00000 0.00000 0.00000 0.05000 0.48000 0.00000 -0.40000 0.00000 0.10000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_16.PDB 1.80658 -4.57000 -1.55000 -1.57000 -7.55000 0.19000 8.36000 -10.01000 0.19000 3.15000 4.37000 0.00000 0.00000 0.00000 0.02000 0.35000 0.00000 -0.27000 0.00000 0.11000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_17.PDB 2.78804 -4.95000 -1.51000 -1.54000 -7.48000 0.08000 7.92000 -10.02000 0.24000 3.15000 4.32000 0.00000 0.00000 0.00000 0.03000 0.24000 0.00000 -0.20000 0.00000 0.09000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_18.PDB 2.12574 -4.91000 -2.08000 -2.06000 -7.11000 0.11000 7.72000 -9.42000 0.21000 3.28000 4.79000 0.00000 0.00000 0.00000 0.04000 0.45000 0.00000 -0.40000 0.00000 0.01000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_19.PDB 2.90603 -4.15000 -1.50000 -1.64000 -6.88000 0.09000 7.88000 -9.22000 0.27000 2.94000 4.02000 0.00000 0.00000 0.00000 0.04000 0.34000 0.00000 -0.24000 0.00000 0.07000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_20.PDB 3.17586 -3.84000 -2.01000 -1.99000 -6.61000 0.05000 7.21000 -8.88000 0.25000 3.45000 5.02000 0.00000 0.00000 0.00000 0.03000 0.45000 0.00000 -0.37000 0.00000 0.01000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_21.PDB 1.85497 -3.95000 -2.03000 -2.03000 -5.70000 -0.10000 6.39000 -7.67000 0.20000 3.04000 4.54000 0.00000 0.00000 0.00000 0.03000 0.54000 0.00000 -0.62000 0.00000 -0.02000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_22.PDB 2.79320 -4.70000 -1.60000 -1.60000 -7.12000 0.08000 8.00000 -9.56000 0.27000 2.99000 3.98000 0.00000 0.00000 0.00000 0.03000 0.39000 0.00000 -0.22000 0.00000 0.06000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_23.PDB 2.98400 -5.07000 -2.05000 -2.04000 -7.10000 -0.03000 7.26000 -9.53000 0.27000 3.85000 4.78000 0.00000 0.00000 0.00000 0.04000 0.41000 0.00000 -0.50000 0.00000 -0.02000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_24.PDB 1.84837 -4.99000 -2.35000 -2.34000 -7.28000 -0.01000 7.54000 -9.73000 0.17000 4.01000 5.66000 0.00000 0.00000 0.00000 0.06000 0.44000 0.00000 -0.64000 0.00000 -0.06000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_25.PDB 1.85081 -4.61000 -1.64000 -1.64000 -7.39000 0.15000 8.42000 -9.85000 0.27000 2.97000 4.21000 0.00000 0.00000 0.00000 0.04000 0.42000 0.00000 -0.26000 0.00000 0.09000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_26.PDB 3.12254 -4.18000 -2.04000 -2.02000 -6.69000 0.05000 7.59000 -8.84000 0.28000 3.07000 4.90000 0.00000 0.00000 0.00000 0.04000 0.49000 0.00000 -0.52000 0.00000 -0.00000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_27.PDB 2.98399 -4.64000 -2.08000 -2.04000 -7.14000 0.06000 8.17000 -9.42000 0.27000 3.34000 4.68000 0.00000 0.00000 0.00000 0.07000 0.54000 0.00000 -0.51000 0.00000 -0.04000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_28.PDB 1.92490 -4.44000 -2.47000 -2.44000 -6.63000 0.10000 6.89000 -8.66000 0.20000 4.20000 4.76000 0.00000 0.00000 0.00000 0.03000 0.44000 0.00000 -0.43000 0.00000 0.01000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_29.PDB 2.98860 -4.02000 -2.07000 -2.04000 -6.84000 -0.03000 7.82000 -9.04000 0.23000 3.23000 5.12000 0.00000 0.00000 0.00000 0.09000 0.50000 0.00000 -0.42000 0.00000 -0.06000 0.00000 2.38000 66.00000 BUD14_1GCQ-15_30.PDB 3.08107 -4.10000 -2.34000 -2.34000 -7.01000 0.07000 7.90000 -9.20000 0.32000 3.75000 5.48000 0.00000 0.00000 0.00000 0.03000 0.48000 0.00000 -0.77000 0.00000 0.01000 0.00000 2.38000 66.00000