name total energy Backbone Hbon 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_1CKB-11_1.PDB 7.68000 -42.67000 -20.56000 -66.98000 -2.04000 82.61000 -85.81000 8.46000 40.90000 93.19000 0.00000 0.00000 0.00000 4.00000 20.37000 0.00000 -2.10000 0.00000 -1.32000 0.00000 0.00000 64.00000 BUD14_1CKB-11_2.PDB 10.01000 -43.77000 -17.27000 -67.08000 -3.15000 83.37000 -86.04000 10.60000 39.72000 93.75000 0.00000 0.00000 0.00000 3.22000 20.85000 0.00000 -2.44000 0.00000 -0.89000 0.00000 0.00000 64.00000 BUD14_1CKB-11_3.PDB 8.56000 -41.32000 -18.45000 -66.64000 -1.87000 81.35000 -86.25000 9.20000 39.65000 92.86000 0.00000 0.00000 0.00000 2.90000 20.67000 0.00000 -2.05000 0.00000 -0.83000 0.00000 0.00000 64.00000 BUD14_1CKB-11_4.PDB 6.24000 -43.23000 -18.34000 -67.43000 -1.82000 82.64000 -86.35000 8.94000 40.37000 91.35000 0.00000 0.00000 0.00000 2.97000 20.80000 0.00000 -1.88000 0.00000 -0.98000 0.00000 0.00000 64.00000 BUD14_1CKB-11_5.PDB 9.12000 -41.91000 -16.91000 -66.68000 -1.67000 80.07000 -86.47000 9.19000 39.43000 93.90000 0.00000 0.00000 0.00000 2.97000 20.79000 0.00000 -2.06000 0.00000 -0.75000 0.00000 0.00000 64.00000 BUD14_1CKB-11_6.PDB 12.60000 -43.72000 -17.26000 -67.41000 -1.91000 83.32000 -86.47000 13.04000 39.50000 93.14000 0.00000 0.00000 0.00000 3.38000 21.10000 0.00000 -2.38000 0.00000 -0.63000 0.00000 0.00000 64.00000 BUD14_1CKB-11_7.PDB 7.04000 -44.47000 -19.66000 -68.42000 -2.31000 85.35000 -87.58000 10.76000 40.08000 93.60000 0.00000 0.00000 0.00000 3.09000 20.99000 0.00000 -2.44000 0.00000 -0.96000 0.00000 0.00000 64.00000 BUD14_1CKB-11_8.PDB 7.42000 -41.92000 -17.72000 -66.97000 -1.65000 81.20000 -86.69000 9.25000 39.65000 92.21000 0.00000 0.00000 0.00000 2.67000 20.93000 0.00000 -2.03000 0.00000 -0.58000 0.00000 0.00000 64.00000 BUD14_1CKB-11_9.PDB 9.28000 -42.30000 -18.13000 -66.71000 -2.07000 82.00000 -85.73000 8.98000 39.43000 94.14000 0.00000 0.00000 0.00000 2.96000 20.68000 0.00000 -1.94000 0.00000 -1.34000 0.00000 0.00000 64.00000 BUD14_1CKB-11_10.PDB 7.28000 -44.59000 -19.75000 -67.52000 -2.03000 84.14000 -86.55000 7.92000 40.86000 94.20000 0.00000 0.00000 0.00000 3.72000 20.47000 0.00000 -1.85000 0.00000 -1.27000 0.00000 0.00000 64.00000 BUD14_1CKB-11_11.PDB 7.06000 -42.50000 -20.73000 -67.07000 -2.45000 83.62000 -85.88000 9.12000 40.91000 92.05000 0.00000 0.00000 0.00000 3.30000 20.59000 0.00000 -2.00000 0.00000 -1.30000 0.00000 0.00000 64.00000 BUD14_1CKB-11_12.PDB 7.14000 -43.18000 -17.54000 -67.38000 -2.25000 82.83000 -86.21000 9.43000 39.72000 92.65000 0.00000 0.00000 0.00000 2.83000 20.70000 0.00000 -2.34000 0.00000 -1.42000 0.00000 0.00000 64.00000 BUD14_1CKB-11_13.PDB 8.12000 -41.90000 -16.74000 -66.78000 -1.48000 79.90000 -86.66000 9.19000 39.39000 93.04000 0.00000 0.00000 0.00000 2.76000 20.80000 0.00000 -2.10000 0.00000 -0.51000 0.00000 0.00000 64.00000 BUD14_1CKB-11_14.PDB 7.69000 -41.91000 -17.73000 -66.97000 -1.96000 80.99000 -86.98000 9.49000 39.70000 93.09000 0.00000 0.00000 0.00000 2.90000 20.76000 0.00000 -2.12000 0.00000 -0.83000 0.00000 0.00000 64.00000 BUD14_1CKB-11_15.PDB 8.31000 -41.65000 -18.39000 -66.73000 -2.65000 82.47000 -85.64000 9.25000 40.05000 91.86000 0.00000 0.00000 0.00000 3.08000 20.55000 0.00000 -1.99000 0.00000 -1.35000 0.00000 0.00000 64.00000 BUD14_1CKB-11_16.PDB 8.97000 -43.65000 -18.10000 -67.53000 -3.30000 84.28000 -86.41000 10.31000 40.41000 93.17000 0.00000 0.00000 0.00000 3.24000 20.88000 0.00000 -2.40000 0.00000 -1.05000 0.00000 0.00000 64.00000 BUD14_1CKB-11_17.PDB 6.06000 -41.16000 -18.68000 -65.49000 -1.69000 78.64000 -85.17000 9.57000 39.35000 91.44000 0.00000 0.00000 0.00000 2.06000 20.47000 0.00000 -1.99000 0.00000 -0.81000 0.00000 0.00000 64.00000 BUD14_1CKB-11_18.PDB 9.43000 -41.91000 -17.49000 -66.84000 -1.86000 81.28000 -86.47000 9.20000 39.73000 93.92000 0.00000 0.00000 0.00000 2.86000 20.89000 0.00000 -2.15000 0.00000 -0.84000 0.00000 0.00000 64.00000 BUD14_1CKB-11_19.PDB 5.70000 -42.36000 -20.18000 -67.13000 -2.12000 82.56000 -86.35000 9.02000 40.40000 91.98000 0.00000 0.00000 0.00000 2.95000 20.64000 0.00000 -1.97000 0.00000 -1.11000 0.00000 0.00000 64.00000 BUD14_1CKB-11_20.PDB 8.97000 -41.88000 -17.65000 -67.01000 -1.97000 81.15000 -86.98000 8.69000 39.68000 94.05000 0.00000 0.00000 0.00000 3.56000 20.58000 0.00000 -1.85000 0.00000 -0.82000 0.00000 0.00000 64.00000 BUD14_1CKB-11_21.PDB 6.88000 -41.83000 -15.89000 -67.54000 -2.13000 81.37000 -87.29000 9.06000 39.28000 92.49000 0.00000 0.00000 0.00000 2.98000 20.90000 0.00000 -2.58000 0.00000 -1.06000 0.00000 0.00000 64.00000 BUD14_1CKB-11_22.PDB 7.80000 -41.22000 -18.77000 -66.65000 -2.43000 81.45000 -86.44000 9.30000 39.48000 92.16000 0.00000 0.00000 0.00000 3.46000 20.48000 0.00000 -1.70000 0.00000 -0.85000 0.00000 0.00000 64.00000 BUD14_1CKB-11_23.PDB 7.74000 -42.63000 -19.38000 -66.37000 -1.86000 81.59000 -85.28000 8.30000 40.09000 92.52000 0.00000 0.00000 0.00000 3.52000 20.30000 0.00000 -1.76000 0.00000 -1.00000 0.00000 0.00000 64.00000 BUD14_1CKB-11_24.PDB 8.54000 -42.32000 -18.16000 -67.57000 -1.91000 82.57000 -86.66000 8.89000 39.90000 93.70000 0.00000 0.00000 0.00000 3.03000 20.97000 0.00000 -1.92000 0.00000 -1.02000 0.00000 0.00000 64.00000 BUD14_1CKB-11_25.PDB 7.58000 -43.07000 -17.83000 -66.71000 -3.65000 83.22000 -85.89000 10.43000 39.42000 91.59000 0.00000 0.00000 0.00000 3.13000 20.73000 0.00000 -2.34000 0.00000 -0.72000 0.00000 0.00000 64.00000 BUD14_1CKB-11_26.PDB 6.78000 -43.21000 -20.08000 -67.41000 -2.04000 82.98000 -86.53000 9.01000 41.03000 93.17000 0.00000 0.00000 0.00000 2.97000 20.73000 0.00000 -2.08000 0.00000 -1.04000 0.00000 0.00000 64.00000 BUD14_1CKB-11_27.PDB 5.46000 -42.29000 -16.61000 -67.74000 -2.17000 82.79000 -86.60000 8.98000 39.72000 89.87000 0.00000 0.00000 0.00000 3.02000 20.91000 0.00000 -2.34000 0.00000 -1.17000 0.00000 0.00000 64.00000 BUD14_1CKB-11_28.PDB 6.73000 -41.92000 -16.94000 -65.67000 -1.58000 78.84000 -85.24000 8.91000 38.62000 92.06000 0.00000 0.00000 0.00000 2.33000 20.57000 0.00000 -1.97000 0.00000 -0.70000 0.00000 0.00000 64.00000 BUD14_1CKB-11_29.PDB 8.31000 -41.85000 -16.72000 -67.14000 -1.99000 81.82000 -86.80000 8.12000 39.25000 93.36000 0.00000 0.00000 0.00000 3.53000 20.60000 0.00000 -2.30000 0.00000 -0.97000 0.00000 0.00000 64.00000 BUD14_1CKB-11_30.PDB 8.26000 -40.33000 -18.83000 -66.68000 -2.25000 81.40000 -86.19000 8.63000 40.16000 91.98000 0.00000 0.00000 0.00000 3.30000 20.68000 0.00000 -2.13000 0.00000 -0.80000 0.00000 0.00000 64.00000