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-18_1.PDB 3.99879 -2.97000 -1.79000 -3.46000 -9.92000 -0.42000 9.21000 -13.09000 4.26000 6.66000 5.78000 0.00000 0.00000 0.00000 0.50000 0.77000 0.00000 -0.25000 0.00000 -0.46000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_2.PDB 3.70035 0.37000 -1.73000 -3.50000 -9.48000 -0.21000 8.05000 -12.72000 8.22000 5.28000 5.93000 0.00000 0.00000 0.00000 0.79000 0.99000 0.00000 -0.33000 0.00000 0.08000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_3.PDB 3.12692 1.01000 -1.83000 -4.64000 -9.49000 -0.32000 8.99000 -12.08000 10.07000 6.53000 4.61000 0.00000 0.00000 0.00000 0.16000 1.02000 0.00000 -0.59000 0.00000 -0.40000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_4.PDB 2.43384 1.22000 -1.80000 -4.40000 -9.21000 -0.11000 8.78000 -11.88000 9.55000 4.67000 5.44000 0.00000 0.00000 0.00000 0.28000 1.04000 0.00000 -0.21000 0.00000 0.09000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_5.PDB 3.19964 -0.25000 -2.63000 -4.38000 -9.44000 -0.30000 8.86000 -12.03000 8.59000 5.77000 5.67000 0.00000 0.00000 0.00000 0.81000 1.00000 0.00000 -0.79000 0.00000 -0.40000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_6.PDB 3.60506 0.54000 -0.89000 -3.46000 -10.04000 -0.13000 8.45000 -13.51000 9.28000 5.99000 4.68000 0.00000 0.00000 0.00000 0.31000 0.87000 0.00000 -0.24000 0.00000 0.11000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_7.PDB 4.33262 -0.72000 -2.69000 -4.32000 -9.34000 -0.26000 9.06000 -12.16000 6.68000 6.23000 6.19000 0.00000 0.00000 0.00000 0.64000 0.87000 0.00000 -0.47000 0.00000 -0.28000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_8.PDB 3.94105 0.39000 -0.96000 -2.69000 -8.41000 -0.44000 6.83000 -11.57000 8.35000 4.29000 5.02000 0.00000 0.00000 0.00000 0.78000 1.10000 0.00000 -0.31000 0.00000 -0.50000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_9.PDB 2.91611 1.41000 -1.84000 -4.52000 -9.77000 -0.29000 8.37000 -13.14000 10.49000 6.02000 6.24000 0.00000 0.00000 0.00000 0.17000 1.17000 0.00000 -0.39000 0.00000 0.06000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_10.PDB 3.24956 2.33000 -2.54000 -3.49000 -8.56000 -0.32000 8.55000 -10.94000 9.98000 4.38000 5.81000 0.00000 0.00000 0.00000 0.21000 1.11000 0.00000 -0.44000 0.00000 -0.31000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_11.PDB 3.38578 0.71000 -1.01000 -3.63000 -8.41000 -0.39000 7.90000 -10.85000 9.22000 5.30000 3.38000 0.00000 0.00000 0.00000 0.24000 1.18000 0.00000 -0.65000 0.00000 -0.42000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_12.PDB 2.74721 0.55000 -2.62000 -5.26000 -8.74000 -0.44000 8.84000 -11.22000 9.68000 5.36000 5.65000 0.00000 0.00000 0.00000 0.30000 0.83000 0.00000 -0.58000 0.00000 -0.41000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_13.PDB 4.14312 -2.24000 -1.80000 -3.46000 -8.33000 -0.06000 7.63000 -11.16000 4.44000 5.23000 5.32000 0.00000 0.00000 0.00000 0.52000 0.78000 0.00000 -0.72000 0.00000 0.14000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_14.PDB 4.23466 0.17000 -2.61000 -5.39000 -8.86000 -0.36000 8.58000 -11.28000 9.04000 6.26000 5.76000 0.00000 0.00000 0.00000 0.15000 0.98000 0.00000 -0.69000 0.00000 -0.42000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_15.PDB 5.07082 1.48000 -0.04000 -2.86000 -9.59000 -0.45000 8.41000 -13.03000 10.37000 5.29000 3.95000 0.00000 0.00000 0.00000 0.18000 0.81000 0.00000 -0.30000 0.00000 -0.46000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_16.PDB 3.56517 0.33000 -1.01000 -3.57000 -8.79000 -0.26000 8.33000 -11.57000 7.84000 4.17000 4.91000 0.00000 0.00000 0.00000 0.54000 1.20000 0.00000 -0.29000 0.00000 0.00000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_17.PDB 3.83490 1.39000 -0.06000 -2.95000 -10.14000 -0.23000 8.56000 -13.91000 10.41000 5.45000 4.29000 0.00000 0.00000 0.00000 0.16000 0.93000 0.00000 -0.28000 0.00000 0.09000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_18.PDB 3.47105 0.52000 -2.67000 -5.29000 -9.61000 -0.33000 8.71000 -12.71000 10.38000 6.24000 6.38000 0.00000 0.00000 0.00000 0.22000 1.11000 0.00000 -0.51000 0.00000 -0.31000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_19.PDB 4.63337 0.15000 -0.93000 -3.42000 -9.90000 -0.36000 9.16000 -12.93000 9.21000 5.79000 4.22000 0.00000 0.00000 0.00000 0.32000 1.03000 0.00000 -0.62000 0.00000 -0.41000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_20.PDB 4.81481 -3.58000 -1.86000 -3.47000 -8.79000 -0.38000 8.55000 -11.44000 3.54000 5.66000 4.90000 0.00000 0.00000 0.00000 0.83000 1.04000 0.00000 -0.68000 0.00000 -0.45000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_21.PDB 3.39433 1.13000 -0.92000 -3.64000 -8.91000 -0.16000 8.27000 -11.91000 9.63000 3.87000 4.92000 0.00000 0.00000 0.00000 0.23000 0.95000 0.00000 -0.32000 0.00000 0.07000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_22.PDB 3.99085 0.66000 -0.91000 -3.82000 -8.82000 -0.20000 8.29000 -11.86000 9.32000 3.92000 4.73000 0.00000 0.00000 0.00000 0.21000 0.94000 0.00000 -0.27000 0.00000 0.06000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_23.PDB 3.44329 0.88000 -1.72000 -5.49000 -8.64000 -0.39000 8.37000 -11.27000 9.24000 5.83000 5.36000 0.00000 0.00000 0.00000 0.26000 0.88000 0.00000 -0.31000 0.00000 -0.36000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_24.PDB 4.05478 0.36000 -1.75000 -3.54000 -9.08000 -0.34000 8.02000 -12.03000 8.38000 5.07000 5.44000 0.00000 0.00000 0.00000 0.82000 0.92000 0.00000 -0.22000 0.00000 -0.41000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_25.PDB 4.12563 2.14000 -0.90000 -4.64000 -8.58000 -0.36000 8.29000 -11.26000 10.54000 5.42000 4.08000 0.00000 0.00000 0.00000 0.15000 0.88000 0.00000 -0.25000 0.00000 -0.37000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_26.PDB 3.33009 0.55000 -1.77000 -4.49000 -9.96000 -0.16000 8.82000 -13.27000 9.51000 5.89000 5.68000 0.00000 0.00000 0.00000 0.31000 1.00000 0.00000 -0.18000 0.00000 0.17000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_27.PDB 4.08642 1.06000 -0.07000 -3.77000 -10.00000 -0.36000 8.80000 -13.59000 10.25000 6.03000 4.28000 0.00000 0.00000 0.00000 0.20000 0.94000 0.00000 -0.33000 0.00000 -0.37000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_28.PDB 4.90178 -1.34000 -1.84000 -4.67000 -10.15000 -0.44000 9.25000 -13.36000 9.20000 5.89000 5.60000 0.00000 0.00000 0.00000 0.34000 1.22000 0.00000 -0.70000 0.00000 -0.46000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_29.PDB 4.17187 0.02000 -0.96000 -4.10000 -9.01000 -0.44000 7.78000 -12.20000 9.06000 4.95000 5.40000 0.00000 0.00000 0.00000 0.24000 1.08000 0.00000 -0.24000 0.00000 -0.47000 0.00000 2.38000 67.00000 BUD14_1GCQ-18_30.PDB 3.33555 -0.63000 -0.92000 -3.61000 -10.62000 -0.28000 8.74000 -14.58000 10.10000 4.88000 5.72000 0.00000 0.00000 0.00000 0.24000 1.11000 0.00000 -0.38000 0.00000 0.05000 0.00000 2.38000 67.00000