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-29_1.PDB 3.21827 -11.55000 -1.07000 -3.39000 -7.82000 -1.76000 7.36000 -10.28000 0.22000 5.66000 1.62000 0.00000 0.00000 0.00000 0.06000 0.39000 0.00000 -1.01000 0.00000 -1.16000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_2.PDB 3.08374 -7.18000 -1.59000 -6.33000 -7.36000 -1.27000 8.17000 -9.67000 3.84000 6.74000 2.81000 0.00000 0.00000 0.00000 0.02000 0.60000 0.00000 -1.28000 0.00000 -1.27000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_3.PDB 2.93116 -9.43000 -1.07000 -2.75000 -7.71000 -1.43000 7.09000 -9.95000 0.36000 5.75000 2.40000 0.00000 0.00000 0.00000 0.02000 0.31000 0.00000 -0.71000 0.00000 -1.41000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_4.PDB 4.14688 -11.88000 -1.48000 -3.12000 -8.25000 -2.21000 8.69000 -10.47000 0.57000 5.46000 1.36000 0.00000 0.00000 0.00000 0.21000 0.55000 0.00000 -1.40000 0.00000 -1.26000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_5.PDB 2.69612 -8.80000 -1.03000 -2.72000 -7.34000 -1.32000 6.33000 -9.72000 0.17000 6.08000 2.73000 0.00000 0.00000 0.00000 0.05000 0.28000 0.00000 -0.68000 0.00000 -1.34000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_6.PDB 3.10012 -9.71000 -1.05000 -3.54000 -7.67000 -1.50000 7.17000 -10.03000 0.22000 6.65000 2.26000 0.00000 0.00000 0.00000 0.05000 0.24000 0.00000 -0.82000 0.00000 -1.43000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_7.PDB 3.27117 -9.81000 -1.92000 -3.53000 -8.16000 -1.73000 8.59000 -10.22000 0.75000 6.12000 2.49000 0.00000 0.00000 0.00000 0.04000 0.38000 0.00000 -0.76000 0.00000 -1.48000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_8.PDB 3.50034 -10.94000 -0.25000 -3.24000 -8.55000 -2.46000 8.91000 -10.59000 0.16000 5.59000 1.60000 0.00000 0.00000 0.00000 0.04000 0.57000 0.00000 -0.61000 0.00000 -1.55000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_9.PDB 3.58191 -10.25000 -1.19000 -3.51000 -8.25000 -2.04000 8.02000 -10.33000 0.33000 6.04000 2.71000 0.00000 0.00000 0.00000 0.10000 0.58000 0.00000 -0.75000 0.00000 -1.37000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_10.PDB 3.24553 -6.98000 -1.61000 -4.10000 -8.02000 -1.12000 8.06000 -10.39000 4.05000 6.24000 2.04000 0.00000 0.00000 0.00000 0.05000 0.58000 0.00000 -1.02000 0.00000 -1.17000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_11.PDB 2.25351 -9.62000 -0.88000 -4.25000 -7.59000 -1.49000 6.68000 -9.52000 0.07000 6.81000 2.40000 0.00000 0.00000 0.00000 0.02000 0.30000 0.00000 -1.07000 0.00000 -0.81000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_12.PDB 2.25841 -10.24000 -0.99000 -3.39000 -7.74000 -1.52000 7.04000 -10.14000 0.10000 6.54000 2.28000 0.00000 0.00000 0.00000 0.02000 0.23000 0.00000 -1.08000 0.00000 -1.35000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_13.PDB 3.11027 -8.51000 -0.92000 -3.22000 -7.19000 -1.18000 6.48000 -9.40000 0.11000 5.77000 2.60000 0.00000 0.00000 0.00000 0.03000 0.29000 0.00000 -0.49000 0.00000 -1.11000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_14.PDB 4.34032 -11.69000 -1.52000 -3.91000 -8.33000 -1.78000 8.76000 -10.57000 0.25000 6.47000 1.54000 0.00000 0.00000 0.00000 0.22000 0.47000 0.00000 -1.58000 0.00000 -1.25000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_15.PDB 2.06858 -8.71000 -1.09000 -3.49000 -7.46000 -1.34000 6.81000 -9.76000 0.29000 6.68000 2.78000 0.00000 0.00000 0.00000 0.02000 0.27000 0.00000 -0.71000 0.00000 -1.45000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_16.PDB 4.09830 -9.98000 -1.09000 -3.45000 -8.60000 -2.31000 8.63000 -10.54000 1.09000 6.24000 2.48000 0.00000 0.00000 0.00000 0.05000 0.66000 0.00000 -1.06000 0.00000 -1.43000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_17.PDB 2.20824 -9.10000 -1.01000 -3.43000 -7.84000 -1.24000 7.25000 -10.12000 0.06000 6.83000 2.57000 0.00000 0.00000 0.00000 0.02000 0.30000 0.00000 -0.98000 0.00000 -1.21000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_18.PDB 3.33984 -9.47000 -1.07000 -3.11000 -7.63000 -1.50000 7.20000 -9.84000 0.26000 5.90000 2.56000 0.00000 0.00000 0.00000 0.04000 0.25000 0.00000 -0.88000 0.00000 -1.40000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_19.PDB 3.03676 -9.15000 -1.16000 -2.75000 -7.82000 -1.64000 7.19000 -10.12000 0.47000 6.00000 2.70000 0.00000 0.00000 0.00000 0.02000 0.27000 0.00000 -0.71000 0.00000 -1.33000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_20.PDB 3.76765 -7.79000 -1.58000 -3.21000 -8.07000 -1.43000 7.82000 -10.47000 4.29000 5.25000 1.61000 0.00000 0.00000 0.00000 0.04000 0.68000 0.00000 -0.95000 0.00000 -1.09000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_21.PDB 3.06104 -9.37000 -1.72000 -4.04000 -7.97000 -1.23000 8.34000 -10.03000 0.32000 6.28000 2.48000 0.00000 0.00000 0.00000 0.02000 0.36000 0.00000 -0.59000 0.00000 -1.22000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_22.PDB 3.16892 -9.22000 -1.55000 -3.97000 -7.61000 -1.31000 7.84000 -9.58000 0.23000 6.83000 2.41000 0.00000 0.00000 0.00000 0.03000 0.33000 0.00000 -1.16000 0.00000 -1.38000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_23.PDB 3.90782 -8.49000 -1.59000 -3.98000 -8.18000 -1.67000 7.89000 -10.51000 3.91000 6.04000 1.60000 0.00000 0.00000 0.00000 0.04000 0.64000 0.00000 -1.32000 0.00000 -0.72000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_24.PDB 2.15699 -8.41000 -0.89000 -3.37000 -7.63000 -1.14000 6.59000 -9.92000 0.09000 6.82000 2.71000 0.00000 0.00000 0.00000 0.02000 0.34000 0.00000 -0.51000 0.00000 -1.16000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_25.PDB 4.55750 -9.19000 -1.06000 -3.40000 -7.49000 -1.40000 6.81000 -9.72000 0.28000 6.11000 2.67000 0.00000 0.00000 0.00000 0.03000 0.28000 0.00000 -0.71000 0.00000 -1.31000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_26.PDB 2.41025 -9.22000 -1.10000 -2.79000 -7.53000 -1.25000 6.74000 -9.87000 0.15000 6.17000 2.49000 0.00000 0.00000 0.00000 0.06000 0.24000 0.00000 -0.99000 0.00000 -1.30000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_27.PDB 3.01146 -8.39000 -1.54000 -4.81000 -8.34000 -1.57000 8.18000 -10.49000 3.92000 6.44000 1.84000 0.00000 0.00000 0.00000 0.03000 0.59000 0.00000 -1.45000 0.00000 -0.61000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_28.PDB 2.56498 -9.18000 -0.76000 -3.96000 -7.38000 -0.52000 6.28000 -9.54000 0.13000 5.77000 1.87000 0.00000 0.00000 0.00000 0.02000 0.15000 0.00000 -0.49000 0.00000 -0.58000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_29.PDB 3.36954 -9.35000 -1.12000 -3.37000 -7.33000 -1.27000 6.44000 -9.59000 0.31000 5.71000 2.73000 0.00000 0.00000 0.00000 0.03000 0.32000 0.00000 -0.70000 0.00000 -1.18000 0.00000 2.38000 67.00000 BUD14_1GCQ-29_30.PDB 3.74939 -11.52000 -1.56000 -4.81000 -7.85000 -1.96000 8.52000 -9.94000 0.23000 6.31000 2.25000 0.00000 0.00000 0.00000 0.16000 0.26000 0.00000 -1.54000 0.00000 -1.33000 0.00000 2.38000 67.00000