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_1SEM-26_1.PDB 1.84295 -6.03000 -1.79000 -1.74000 -6.40000 -2.02000 7.34000 -7.77000 0.29000 4.67000 3.36000 0.00000 0.00000 0.00000 0.10000 0.54000 0.00000 -1.25000 0.00000 -0.83000 0.00000 2.38000 66.00000 BUD14_1SEM-26_2.PDB 1.84061 -6.90000 -2.36000 -2.33000 -7.00000 -2.01000 8.39000 -8.31000 0.42000 5.50000 2.89000 0.00000 0.00000 0.00000 0.17000 0.39000 0.00000 -1.32000 0.00000 -0.93000 0.00000 2.38000 66.00000 BUD14_1SEM-26_3.PDB 1.83808 -8.29000 -1.84000 -1.79000 -7.44000 -2.18000 7.77000 -9.46000 0.15000 5.55000 3.05000 0.00000 0.00000 0.00000 0.13000 0.77000 0.00000 -1.34000 0.00000 -0.89000 0.00000 2.38000 66.00000 BUD14_1SEM-26_4.PDB 1.60581 -6.47000 -1.75000 -1.71000 -6.59000 -1.95000 7.35000 -8.09000 0.18000 4.83000 3.05000 0.00000 0.00000 0.00000 0.13000 0.43000 0.00000 -1.24000 0.00000 -0.68000 0.00000 2.38000 66.00000 BUD14_1SEM-26_5.PDB 1.91850 -8.98000 -1.87000 -1.83000 -7.61000 -2.15000 8.31000 -9.62000 0.09000 5.38000 2.61000 0.00000 0.00000 0.00000 0.15000 0.64000 0.00000 -1.54000 0.00000 -0.90000 0.00000 2.38000 66.00000 BUD14_1SEM-26_6.PDB 1.97427 -8.20000 -2.63000 -2.65000 -7.89000 -2.16000 9.89000 -9.09000 0.16000 5.51000 2.44000 0.00000 0.00000 0.00000 0.30000 0.71000 0.00000 -1.00000 0.00000 -1.09000 0.00000 2.38000 66.00000 BUD14_1SEM-26_7.PDB 1.90653 -6.51000 -1.58000 -1.57000 -7.02000 -2.34000 7.92000 -8.51000 0.33000 5.23000 3.25000 0.00000 0.00000 0.00000 0.14000 0.64000 0.00000 -1.51000 0.00000 -0.84000 0.00000 2.38000 66.00000 BUD14_1SEM-26_8.PDB 2.20644 -9.31000 -1.82000 -1.83000 -7.26000 -1.48000 7.20000 -9.25000 0.29000 3.79000 2.64000 0.00000 0.00000 0.00000 0.23000 0.61000 0.00000 -1.00000 0.00000 -0.81000 0.00000 2.38000 66.00000 BUD14_1SEM-26_9.PDB 2.20219 -8.57000 -1.81000 -1.86000 -8.10000 -2.13000 9.07000 -9.79000 0.38000 5.16000 2.66000 0.00000 0.00000 0.00000 0.21000 0.65000 0.00000 -1.11000 0.00000 -1.25000 0.00000 2.38000 66.00000 BUD14_1SEM-26_10.PDB 1.64810 -5.15000 -0.34000 -0.28000 -5.97000 -1.72000 5.22000 -7.80000 0.14000 4.39000 2.64000 0.00000 0.00000 0.00000 0.12000 0.21000 0.00000 -0.59000 0.00000 -0.95000 0.00000 2.38000 66.00000 BUD14_1SEM-26_11.PDB 1.55328 -8.00000 -1.75000 -1.75000 -6.50000 -1.53000 7.09000 -7.90000 0.36000 3.40000 2.56000 0.00000 0.00000 0.00000 0.16000 0.57000 0.00000 -1.25000 0.00000 -0.88000 0.00000 2.38000 66.00000 BUD14_1SEM-26_12.PDB 2.18897 -4.72000 -0.31000 -0.25000 -6.32000 -1.39000 4.89000 -8.53000 1.36000 4.17000 2.79000 0.00000 0.00000 0.00000 0.06000 0.21000 0.00000 -0.59000 0.00000 -0.60000 0.00000 2.38000 66.00000 BUD14_1SEM-26_13.PDB 1.98102 -7.84000 -1.88000 -1.86000 -7.53000 -1.80000 7.82000 -9.63000 0.41000 5.21000 3.34000 0.00000 0.00000 0.00000 0.14000 0.73000 0.00000 -1.31000 0.00000 -0.75000 0.00000 2.38000 66.00000 BUD14_1SEM-26_14.PDB 1.45568 -7.01000 -0.35000 -1.20000 -7.38000 -2.69000 7.99000 -9.42000 0.18000 4.81000 2.62000 0.00000 0.00000 0.00000 0.15000 0.30000 0.00000 -0.48000 0.00000 -1.24000 0.00000 2.38000 66.00000 BUD14_1SEM-26_15.PDB 1.43536 -4.66000 -0.34000 -0.91000 -6.37000 -2.04000 6.49000 -7.77000 0.13000 5.03000 2.99000 0.00000 0.00000 0.00000 0.07000 0.18000 0.00000 -0.77000 0.00000 -1.16000 0.00000 2.38000 66.00000 BUD14_1SEM-26_16.PDB 1.59967 -7.19000 -0.31000 -1.10000 -6.96000 -2.00000 6.22000 -9.01000 0.09000 5.21000 2.49000 0.00000 0.00000 0.00000 0.08000 0.25000 0.00000 -0.73000 0.00000 -1.16000 0.00000 2.38000 66.00000 BUD14_1SEM-26_17.PDB 2.07620 -6.15000 -1.76000 -1.71000 -6.71000 -2.01000 7.67000 -8.06000 0.11000 5.13000 3.21000 0.00000 0.00000 0.00000 0.14000 0.51000 0.00000 -1.29000 0.00000 -0.87000 0.00000 2.38000 66.00000 BUD14_1SEM-26_18.PDB 1.60921 -6.99000 -0.31000 -0.87000 -7.04000 -2.27000 6.44000 -9.02000 0.19000 5.26000 2.55000 0.00000 0.00000 0.00000 0.09000 0.27000 0.00000 -0.68000 0.00000 -1.34000 0.00000 2.38000 66.00000 BUD14_1SEM-26_19.PDB 1.48999 -4.17000 -0.32000 -1.13000 -5.83000 -1.22000 5.98000 -7.24000 0.17000 4.90000 2.67000 0.00000 0.00000 0.00000 0.02000 0.23000 0.00000 -0.73000 0.00000 -1.45000 0.00000 2.38000 66.00000 BUD14_1SEM-26_20.PDB 1.52224 -6.93000 -1.75000 -1.79000 -6.80000 -2.06000 8.57000 -7.93000 0.24000 4.26000 2.31000 0.00000 0.00000 0.00000 0.14000 0.49000 0.00000 -0.97000 0.00000 -1.15000 0.00000 2.38000 66.00000 BUD14_1SEM-26_21.PDB 1.65981 -6.59000 -1.75000 -1.77000 -6.82000 -2.15000 8.37000 -8.06000 0.31000 4.33000 2.85000 0.00000 0.00000 0.00000 0.17000 0.65000 0.00000 -0.89000 0.00000 -1.19000 0.00000 2.38000 66.00000 BUD14_1SEM-26_22.PDB 1.86660 -4.67000 -0.30000 -0.24000 -6.41000 -1.64000 5.52000 -8.48000 1.08000 4.57000 2.49000 0.00000 0.00000 0.00000 0.05000 0.31000 0.00000 -0.48000 0.00000 -0.84000 0.00000 2.38000 66.00000 BUD14_1SEM-26_23.PDB 1.60183 -9.46000 -2.01000 -2.05000 -7.61000 -2.15000 8.91000 -8.64000 0.06000 3.47000 2.78000 0.00000 0.00000 0.00000 0.19000 0.73000 0.00000 -1.57000 0.00000 -0.85000 0.00000 2.38000 66.00000 BUD14_1SEM-26_24.PDB 1.44338 -4.64000 -1.18000 -1.11000 -6.32000 -1.67000 6.59000 -7.72000 0.12000 5.43000 3.06000 0.00000 0.00000 0.00000 0.05000 0.31000 0.00000 -0.92000 0.00000 -0.96000 0.00000 2.38000 66.00000 BUD14_1SEM-26_25.PDB 1.45999 -5.23000 -2.23000 -2.22000 -6.73000 -1.83000 8.52000 -7.99000 0.21000 5.51000 2.91000 0.00000 0.00000 0.00000 0.11000 0.31000 0.00000 -0.96000 0.00000 -0.51000 0.00000 2.38000 66.00000 BUD14_1SEM-26_26.PDB 1.63834 -7.20000 -1.80000 -1.75000 -6.94000 -1.89000 7.35000 -9.01000 0.45000 4.78000 3.46000 0.00000 0.00000 0.00000 0.07000 0.49000 0.00000 -1.16000 0.00000 -0.76000 0.00000 2.38000 66.00000 BUD14_1SEM-26_27.PDB 2.07049 -6.13000 -1.87000 -2.29000 -6.82000 -1.85000 7.74000 -8.16000 0.30000 5.21000 3.57000 0.00000 0.00000 0.00000 0.07000 0.52000 0.00000 -1.21000 0.00000 -0.82000 0.00000 2.38000 66.00000 BUD14_1SEM-26_28.PDB 1.90348 -5.51000 -1.00000 -0.92000 -7.04000 -1.23000 6.66000 -9.11000 0.45000 5.49000 2.83000 0.00000 0.00000 0.00000 0.06000 0.52000 0.00000 -0.42000 0.00000 -1.28000 0.00000 2.38000 66.00000 BUD14_1SEM-26_29.PDB 1.43477 -5.24000 -1.35000 -1.30000 -6.22000 -1.73000 7.16000 -7.58000 0.04000 4.26000 3.16000 0.00000 0.00000 0.00000 0.10000 0.48000 0.00000 -1.38000 0.00000 -0.40000 0.00000 2.38000 66.00000 BUD14_1SEM-26_30.PDB 1.55979 -7.63000 -0.34000 -2.79000 -6.87000 -1.66000 6.16000 -9.01000 0.14000 5.36000 2.68000 0.00000 0.00000 0.00000 0.07000 0.30000 0.00000 -0.66000 0.00000 -0.72000 0.00000 2.38000 66.00000