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-5_1.PDB 6.09361 -9.55000 -2.18000 -3.55000 -9.22000 -1.70000 8.84000 -12.49000 2.94000 6.25000 3.25000 0.00000 0.00000 0.00000 0.09000 1.01000 0.00000 -0.61000 0.00000 -1.16000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_2.PDB 5.85298 -8.75000 -2.18000 -3.47000 -9.22000 -1.49000 8.70000 -12.54000 3.84000 5.90000 3.23000 0.00000 0.00000 0.00000 0.11000 1.07000 0.00000 -0.55000 0.00000 -1.08000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_3.PDB 6.40391 -9.55000 -2.31000 -3.61000 -9.62000 -1.99000 9.52000 -12.69000 3.29000 6.40000 3.20000 0.00000 0.00000 0.00000 0.12000 1.11000 0.00000 -0.70000 0.00000 -1.14000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_4.PDB 5.46357 -10.28000 -1.44000 -2.69000 -9.23000 -1.49000 7.78000 -13.21000 3.34000 5.22000 2.83000 0.00000 0.00000 0.00000 0.07000 1.06000 0.00000 -0.34000 0.00000 -1.10000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_5.PDB 6.58436 -8.65000 -2.23000 -3.50000 -9.27000 -1.58000 9.04000 -12.47000 3.64000 5.75000 3.26000 0.00000 0.00000 0.00000 0.08000 1.02000 0.00000 -0.32000 0.00000 -1.05000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_6.PDB 6.82531 -11.00000 -1.45000 -2.82000 -9.18000 -1.70000 7.91000 -13.06000 2.97000 5.15000 2.72000 0.00000 0.00000 0.00000 0.13000 1.15000 0.00000 -0.51000 0.00000 -1.17000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_7.PDB 7.18366 -10.84000 -1.50000 -2.75000 -9.20000 -1.66000 8.11000 -13.04000 2.49000 5.28000 2.90000 0.00000 0.00000 0.00000 0.12000 1.11000 0.00000 -0.60000 0.00000 -1.00000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_8.PDB 6.28669 -10.18000 -2.18000 -3.51000 -9.09000 -1.71000 8.97000 -12.18000 1.92000 5.75000 3.23000 0.00000 0.00000 0.00000 0.15000 1.02000 0.00000 -0.34000 0.00000 -1.20000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_9.PDB 4.52116 -8.94000 -2.19000 -3.48000 -9.44000 -1.67000 8.83000 -12.85000 3.75000 6.18000 3.33000 0.00000 0.00000 0.00000 0.08000 0.99000 0.00000 -0.34000 0.00000 -1.14000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_10.PDB 6.24159 -9.35000 -2.35000 -3.44000 -9.52000 -1.58000 9.12000 -12.80000 3.49000 5.80000 3.25000 0.00000 0.00000 0.00000 0.10000 1.16000 0.00000 -0.27000 0.00000 -1.14000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_11.PDB 5.93064 -9.60000 -2.25000 -3.50000 -9.09000 -1.89000 9.23000 -12.06000 2.53000 5.76000 3.18000 0.00000 0.00000 0.00000 0.09000 1.05000 0.00000 -0.37000 0.00000 -1.24000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_12.PDB 5.80997 -8.80000 -1.46000 -2.76000 -9.48000 -1.81000 8.97000 -12.85000 3.76000 5.43000 2.82000 0.00000 0.00000 0.00000 0.11000 1.04000 0.00000 -0.34000 0.00000 -1.19000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_13.PDB 6.89119 -10.68000 -1.39000 -2.50000 -9.15000 -1.68000 8.01000 -13.03000 2.21000 5.19000 2.97000 0.00000 0.00000 0.00000 0.09000 1.15000 0.00000 -0.27000 0.00000 -1.16000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_14.PDB 6.54948 -8.30000 -2.24000 -2.04000 -9.42000 -1.54000 9.21000 -12.59000 2.94000 5.52000 3.26000 0.00000 0.00000 0.00000 0.10000 1.08000 0.00000 -0.40000 0.00000 -1.10000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_15.PDB 7.22354 -9.72000 -1.49000 -2.42000 -9.72000 -2.15000 9.63000 -12.84000 2.65000 5.50000 2.70000 0.00000 0.00000 0.00000 0.13000 1.09000 0.00000 -0.48000 0.00000 -1.22000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_16.PDB 6.62373 -9.57000 -2.17000 -3.54000 -9.36000 -1.55000 8.82000 -12.70000 2.62000 6.40000 3.57000 0.00000 0.00000 0.00000 0.08000 1.02000 0.00000 -0.75000 0.00000 -1.00000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_17.PDB 6.61619 -9.48000 -2.33000 -3.59000 -9.62000 -1.50000 9.26000 -12.91000 3.24000 5.84000 3.20000 0.00000 0.00000 0.00000 0.17000 1.14000 0.00000 -0.31000 0.00000 -0.92000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_18.PDB 6.41152 -10.66000 -1.41000 -2.72000 -9.08000 -1.75000 7.78000 -12.97000 2.99000 5.19000 2.74000 0.00000 0.00000 0.00000 0.09000 1.06000 0.00000 -0.30000 0.00000 -1.21000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_19.PDB 6.67822 -10.78000 -1.42000 -2.67000 -8.97000 -1.50000 7.59000 -12.89000 2.49000 5.05000 2.90000 0.00000 0.00000 0.00000 0.12000 1.19000 0.00000 -0.36000 0.00000 -1.12000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_20.PDB 5.20223 -10.44000 -1.50000 -2.75000 -9.14000 -1.39000 7.76000 -13.05000 2.89000 4.88000 2.98000 0.00000 0.00000 0.00000 0.16000 1.24000 0.00000 -0.29000 0.00000 -0.99000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_21.PDB 6.22129 -11.22000 -1.44000 -2.75000 -9.39000 -1.55000 7.93000 -13.43000 2.85000 5.00000 2.78000 0.00000 0.00000 0.00000 0.14000 1.15000 0.00000 -0.29000 0.00000 -1.06000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_22.PDB 5.61786 -9.94000 -2.18000 -3.49000 -9.14000 -1.64000 8.91000 -12.29000 2.70000 5.43000 3.19000 0.00000 0.00000 0.00000 0.11000 1.17000 0.00000 -0.43000 0.00000 -1.10000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_23.PDB 5.98785 -9.01000 -2.26000 -3.41000 -9.35000 -1.66000 8.96000 -12.64000 3.52000 6.03000 3.25000 0.00000 0.00000 0.00000 0.11000 1.06000 0.00000 -0.43000 0.00000 -1.13000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_24.PDB 6.72878 -9.61000 -2.18000 -3.32000 -9.41000 -1.60000 9.01000 -12.71000 2.81000 5.84000 3.27000 0.00000 0.00000 0.00000 0.13000 1.10000 0.00000 -0.37000 0.00000 -1.07000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_25.PDB 5.11944 -7.76000 -2.21000 -3.38000 -9.50000 -1.46000 8.91000 -12.90000 4.59000 6.26000 3.34000 0.00000 0.00000 0.00000 0.08000 0.99000 0.00000 -0.42000 0.00000 -1.05000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_26.PDB 6.37656 -10.93000 -1.58000 -2.90000 -9.69000 -1.49000 8.17000 -13.88000 3.42000 5.26000 3.02000 0.00000 0.00000 0.00000 0.12000 1.16000 0.00000 -0.42000 0.00000 -0.96000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_27.PDB 5.36981 -9.58000 -1.49000 -1.30000 -8.61000 -1.21000 7.23000 -12.28000 2.43000 4.20000 2.73000 0.00000 0.00000 0.00000 0.16000 1.15000 0.00000 -0.32000 0.00000 -1.11000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_28.PDB 6.15275 -9.33000 -2.19000 -3.56000 -9.13000 -1.83000 9.18000 -12.19000 2.86000 5.64000 3.21000 0.00000 0.00000 0.00000 0.08000 1.09000 0.00000 -0.24000 0.00000 -1.16000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_29.PDB 5.21470 -10.93000 -1.50000 -2.79000 -9.36000 -1.73000 7.96000 -13.39000 3.27000 5.26000 2.85000 0.00000 0.00000 0.00000 0.09000 1.09000 0.00000 -0.38000 0.00000 -1.20000 0.00000 2.38000 67.00000 BUD14_1GCQ-5_30.PDB 5.32980 -9.67000 -1.48000 -2.76000 -8.93000 -1.59000 8.19000 -12.54000 2.67000 4.87000 2.89000 0.00000 0.00000 0.00000 0.13000 1.13000 0.00000 -0.14000 0.00000 -0.98000 0.00000 2.38000 67.00000