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-4_1.PDB 5.12154 -4.02000 -0.42000 -2.06000 -8.72000 -1.88000 9.31000 -11.49000 5.08000 4.71000 2.87000 0.00000 0.00000 0.00000 0.10000 0.72000 0.00000 -0.08000 0.00000 -1.45000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_2.PDB 5.09125 -3.69000 -0.40000 -1.82000 -8.56000 -1.84000 9.22000 -11.37000 5.07000 4.61000 2.86000 0.00000 0.00000 0.00000 0.09000 0.72000 0.00000 -0.09000 0.00000 -1.47000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_3.PDB 5.08209 -4.64000 -0.43000 -2.64000 -8.95000 -2.07000 9.71000 -11.68000 5.26000 4.74000 3.07000 0.00000 0.00000 0.00000 0.12000 0.71000 0.00000 -0.14000 0.00000 -1.62000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_4.PDB 5.02989 -5.90000 -0.39000 -2.42000 -8.93000 -2.62000 9.97000 -11.66000 5.18000 3.91000 2.73000 0.00000 0.00000 0.00000 0.15000 0.76000 0.00000 -0.11000 0.00000 -1.70000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_5.PDB 4.80323 -4.37000 -0.43000 -1.84000 -8.29000 -2.08000 8.98000 -11.01000 4.81000 4.32000 2.72000 0.00000 0.00000 0.00000 0.09000 0.61000 0.00000 -0.14000 0.00000 -1.51000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_6.PDB 5.48751 -4.56000 -0.41000 -2.75000 -8.80000 -2.10000 9.83000 -11.37000 4.97000 4.67000 2.99000 0.00000 0.00000 0.00000 0.08000 0.72000 0.00000 -0.14000 0.00000 -1.53000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_7.PDB 4.62486 -5.25000 -0.42000 -3.48000 -8.53000 -2.61000 10.22000 -10.97000 4.62000 5.22000 2.78000 0.00000 0.00000 0.00000 0.09000 0.56000 0.00000 -0.16000 0.00000 -2.01000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_8.PDB 5.46422 -5.28000 -0.41000 -1.78000 -8.57000 -2.65000 9.66000 -11.19000 5.05000 3.85000 2.49000 0.00000 0.00000 0.00000 0.10000 0.74000 0.00000 -0.08000 0.00000 -1.74000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_9.PDB 4.38248 -5.08000 -0.39000 -1.40000 -8.40000 -2.13000 8.87000 -11.30000 5.31000 3.67000 2.39000 0.00000 0.00000 0.00000 0.10000 0.61000 0.00000 -0.22000 0.00000 -1.60000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_10.PDB 4.47757 -6.09000 -0.39000 -2.11000 -8.98000 -2.63000 9.67000 -11.79000 5.25000 4.17000 2.51000 0.00000 0.00000 0.00000 0.11000 0.67000 0.00000 -0.07000 0.00000 -1.82000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_11.PDB 4.56827 -5.57000 -0.45000 -1.50000 -8.39000 -2.59000 9.24000 -10.86000 5.52000 3.10000 2.31000 0.00000 0.00000 0.00000 0.11000 0.73000 0.00000 -0.21000 0.00000 -1.85000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_12.PDB 6.00278 -4.87000 -0.36000 -1.14000 -8.58000 -2.92000 9.12000 -11.06000 5.05000 4.38000 2.51000 0.00000 0.00000 0.00000 0.41000 0.56000 0.00000 -0.48000 0.00000 -1.80000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_13.PDB 5.45267 -5.62000 -0.47000 -2.20000 -8.64000 -2.81000 10.09000 -10.97000 5.27000 3.65000 2.43000 0.00000 0.00000 0.00000 0.11000 0.81000 0.00000 -0.10000 0.00000 -1.98000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_14.PDB 5.11485 -2.57000 -1.13000 -2.43000 -9.27000 -1.84000 9.76000 -11.90000 6.78000 6.28000 3.16000 0.00000 0.00000 0.00000 0.14000 0.88000 0.00000 -0.53000 0.00000 -1.57000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_15.PDB 5.24239 -4.83000 -0.42000 -2.49000 -8.72000 -2.11000 9.32000 -11.50000 5.49000 4.48000 2.86000 0.00000 0.00000 0.00000 0.10000 0.62000 0.00000 -0.10000 0.00000 -1.74000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_16.PDB 4.96188 -5.15000 -0.38000 -2.38000 -8.70000 -2.71000 9.59000 -11.43000 6.13000 3.86000 2.68000 0.00000 0.00000 0.00000 0.09000 0.60000 0.00000 -0.08000 0.00000 -1.82000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_17.PDB 5.30336 -4.25000 -0.14000 -1.45000 -8.05000 -1.94000 8.54000 -10.67000 4.57000 4.03000 2.48000 0.00000 0.00000 0.00000 0.10000 0.59000 0.00000 -0.15000 0.00000 -1.58000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_18.PDB 4.89221 -5.02000 -0.38000 -1.70000 -8.62000 -2.47000 9.79000 -11.15000 4.81000 3.81000 2.50000 0.00000 0.00000 0.00000 0.12000 0.73000 0.00000 -0.06000 0.00000 -1.66000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_19.PDB 4.44443 -5.12000 -0.40000 -2.56000 -8.39000 -2.10000 9.32000 -11.04000 4.88000 4.13000 2.74000 0.00000 0.00000 0.00000 0.09000 0.60000 0.00000 -0.15000 0.00000 -1.64000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_20.PDB 6.67724 -1.85000 -1.37000 -2.62000 -9.28000 -2.73000 12.45000 -11.48000 6.17000 5.51000 2.98000 0.00000 0.00000 0.00000 0.48000 0.65000 0.00000 -0.18000 0.00000 -1.77000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_21.PDB 4.55946 -4.75000 -0.43000 -1.30000 -8.78000 -2.46000 9.51000 -11.43000 5.29000 3.95000 2.48000 0.00000 0.00000 0.00000 0.14000 0.78000 0.00000 -0.06000 0.00000 -1.67000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_22.PDB 5.91993 -4.77000 -0.41000 -0.79000 -8.32000 -1.94000 8.64000 -11.19000 5.07000 3.30000 2.37000 0.00000 0.00000 0.00000 0.13000 0.69000 0.00000 -0.20000 0.00000 -1.44000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_23.PDB 4.57946 -4.97000 -0.42000 -2.70000 -8.22000 -2.13000 9.20000 -10.69000 4.77000 4.19000 2.67000 0.00000 0.00000 0.00000 0.08000 0.53000 0.00000 -0.12000 0.00000 -1.61000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_24.PDB 5.02539 -5.12000 -0.43000 -2.69000 -8.05000 -2.17000 9.38000 -10.40000 4.43000 4.02000 2.50000 0.00000 0.00000 0.00000 0.06000 0.60000 0.00000 -0.19000 0.00000 -1.58000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_25.PDB 5.12976 -5.06000 -0.39000 -1.76000 -8.28000 -2.40000 9.42000 -10.77000 4.98000 3.51000 2.40000 0.00000 0.00000 0.00000 0.12000 0.67000 0.00000 -0.06000 0.00000 -1.84000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_26.PDB 4.67929 -4.19000 -0.39000 -0.50000 -8.56000 -2.29000 9.29000 -11.18000 5.13000 3.57000 2.37000 0.00000 0.00000 0.00000 0.11000 0.70000 0.00000 -0.20000 0.00000 -1.54000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_27.PDB 5.59005 -4.31000 -0.13000 -2.36000 -8.15000 -2.13000 9.01000 -10.53000 4.81000 4.64000 2.50000 0.00000 0.00000 0.00000 0.12000 0.67000 0.00000 -0.19000 0.00000 -1.91000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_28.PDB 4.49104 -5.09000 -0.47000 -2.01000 -8.38000 -2.07000 8.93000 -11.01000 5.47000 3.73000 2.27000 0.00000 0.00000 0.00000 0.09000 0.60000 0.00000 -0.13000 0.00000 -1.50000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_29.PDB 4.57065 -6.38000 -0.45000 -2.70000 -8.48000 -2.97000 9.62000 -10.94000 5.35000 3.77000 2.41000 0.00000 0.00000 0.00000 0.09000 0.62000 0.00000 -0.16000 0.00000 -1.93000 0.00000 2.38000 67.00000 BUD14_1GCQ-4_30.PDB 5.27660 -2.05000 -0.38000 -0.77000 -8.30000 -1.52000 8.24000 -10.85000 5.06000 4.90000 2.78000 0.00000 0.00000 0.00000 0.23000 0.47000 0.00000 0.00000 0.00000 -1.44000 0.00000 2.38000 67.00000