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_1CKA-13_1.PDB 7.54000 -42.34000 -16.62000 -68.64000 -3.18000 84.44000 -87.63000 9.99000 39.60000 92.66000 0.00000 0.00000 0.00000 3.41000 18.14000 0.00000 -3.03000 0.00000 -1.13000 0.00000 0.00000 65.00000 BUD14_1CKA-13_2.PDB 9.44000 -42.38000 -17.71000 -68.02000 -1.99000 84.39000 -86.50000 9.90000 39.33000 92.66000 0.00000 0.00000 0.00000 3.61000 18.12000 0.00000 -2.77000 0.00000 -1.06000 0.00000 0.00000 65.00000 BUD14_1CKA-13_3.PDB 6.55000 -39.94000 -14.85000 -66.87000 -2.32000 80.17000 -86.19000 8.59000 37.00000 91.08000 0.00000 0.00000 0.00000 3.09000 17.73000 0.00000 -2.44000 0.00000 -0.77000 0.00000 0.00000 65.00000 BUD14_1CKA-13_4.PDB 8.26000 -39.97000 -14.13000 -65.33000 -2.78000 79.07000 -84.00000 8.75000 36.87000 90.75000 0.00000 0.00000 0.00000 3.07000 17.75000 0.00000 -2.92000 0.00000 -1.11000 0.00000 0.00000 65.00000 BUD14_1CKA-13_5.PDB 6.63000 -41.64000 -16.42000 -68.29000 -4.00000 84.09000 -87.18000 10.41000 39.13000 91.15000 0.00000 0.00000 0.00000 3.78000 18.02000 0.00000 -3.39000 0.00000 -1.03000 0.00000 0.00000 65.00000 BUD14_1CKA-13_6.PDB 9.14000 -42.36000 -16.56000 -68.54000 -2.17000 84.71000 -87.54000 9.97000 39.69000 92.54000 0.00000 0.00000 0.00000 3.54000 18.00000 0.00000 -3.08000 0.00000 -1.08000 0.00000 0.00000 65.00000 BUD14_1CKA-13_7.PDB 8.01000 -42.43000 -16.61000 -68.05000 -3.94000 84.06000 -86.85000 9.97000 40.03000 92.24000 0.00000 0.00000 0.00000 3.44000 17.98000 0.00000 -2.79000 0.00000 -1.04000 0.00000 0.00000 65.00000 BUD14_1CKA-13_8.PDB 9.00000 -42.49000 -17.34000 -68.00000 -2.87000 84.57000 -86.42000 9.84000 39.31000 92.61000 0.00000 0.00000 0.00000 3.49000 18.07000 0.00000 -2.66000 0.00000 -1.05000 0.00000 0.00000 65.00000 BUD14_1CKA-13_9.PDB 5.94000 -39.92000 -14.03000 -67.00000 -1.35000 79.34000 -86.74000 8.65000 37.18000 90.29000 0.00000 0.00000 0.00000 2.89000 17.70000 0.00000 -2.77000 0.00000 -0.59000 0.00000 0.00000 65.00000 BUD14_1CKA-13_10.PDB 6.58000 -40.74000 -15.51000 -66.98000 -2.13000 80.19000 -86.34000 8.45000 37.85000 91.25000 0.00000 0.00000 0.00000 3.30000 17.70000 0.00000 -2.27000 0.00000 -0.49000 0.00000 0.00000 65.00000 BUD14_1CKA-13_11.PDB 7.48000 -41.64000 -15.92000 -67.28000 -3.73000 83.36000 -85.58000 9.98000 38.45000 91.26000 0.00000 0.00000 0.00000 3.76000 17.95000 0.00000 -4.06000 0.00000 -1.10000 0.00000 0.00000 65.00000 BUD14_1CKA-13_12.PDB 9.65000 -42.49000 -16.61000 -67.93000 -2.97000 84.18000 -86.39000 9.89000 39.44000 92.65000 0.00000 0.00000 0.00000 3.73000 17.96000 0.00000 -2.77000 0.00000 -1.06000 0.00000 0.00000 65.00000 BUD14_1CKA-13_13.PDB 9.10000 -39.92000 -14.12000 -65.41000 -2.45000 79.07000 -84.08000 8.53000 36.45000 91.05000 0.00000 0.00000 0.00000 3.14000 17.59000 0.00000 -2.29000 0.00000 -0.88000 0.00000 0.00000 65.00000 BUD14_1CKA-13_14.PDB 4.73000 -39.97000 -15.71000 -68.10000 -2.80000 80.81000 -87.95000 8.98000 39.00000 91.51000 0.00000 0.00000 0.00000 3.21000 17.75000 0.00000 -3.13000 0.00000 -1.11000 0.00000 0.00000 65.00000 BUD14_1CKA-13_15.PDB 5.93000 -41.66000 -16.83000 -68.46000 -4.01000 84.17000 -87.46000 10.09000 39.25000 91.16000 0.00000 0.00000 0.00000 3.70000 17.95000 0.00000 -3.00000 0.00000 -1.02000 0.00000 0.00000 65.00000 BUD14_1CKA-13_16.PDB 6.67000 -39.89000 -14.07000 -66.16000 -2.86000 79.32000 -85.12000 8.63000 37.22000 90.18000 0.00000 0.00000 0.00000 2.90000 17.65000 0.00000 -2.58000 0.00000 -0.92000 0.00000 0.00000 65.00000 BUD14_1CKA-13_17.PDB 7.95000 -39.92000 -15.08000 -65.99000 -2.24000 79.54000 -84.77000 8.42000 36.75000 90.98000 0.00000 0.00000 0.00000 3.34000 17.65000 0.00000 -2.37000 0.00000 -0.72000 0.00000 0.00000 65.00000 BUD14_1CKA-13_18.PDB 5.82000 -41.79000 -15.93000 -69.08000 -3.78000 84.38000 -88.35000 10.09000 39.70000 91.48000 0.00000 0.00000 0.00000 3.43000 18.01000 0.00000 -3.27000 0.00000 -1.05000 0.00000 0.00000 65.00000 BUD14_1CKA-13_19.PDB 7.50000 -41.56000 -16.97000 -67.82000 -3.06000 83.77000 -86.34000 9.88000 39.00000 91.50000 0.00000 0.00000 0.00000 3.41000 17.93000 0.00000 -3.26000 0.00000 -1.06000 0.00000 0.00000 65.00000 BUD14_1CKA-13_20.PDB 5.41000 -39.92000 -14.09000 -66.50000 -2.36000 78.96000 -86.01000 8.74000 37.00000 90.04000 0.00000 0.00000 0.00000 2.92000 17.60000 0.00000 -2.76000 0.00000 -0.61000 0.00000 0.00000 65.00000 BUD14_1CKA-13_21.PDB 7.89000 -41.65000 -16.71000 -67.14000 -3.49000 83.47000 -85.42000 10.00000 38.19000 91.33000 0.00000 0.00000 0.00000 3.51000 17.95000 0.00000 -3.17000 0.00000 -1.03000 0.00000 0.00000 65.00000 BUD14_1CKA-13_22.PDB 5.03000 -39.91000 -16.61000 -67.74000 -1.42000 80.60000 -87.54000 8.79000 38.50000 90.51000 0.00000 0.00000 0.00000 3.16000 17.65000 0.00000 -2.68000 0.00000 -0.62000 0.00000 0.00000 65.00000 BUD14_1CKA-13_23.PDB 6.23000 -39.91000 -15.26000 -66.25000 -2.32000 79.15000 -85.31000 8.72000 37.77000 90.10000 0.00000 0.00000 0.00000 2.97000 17.62000 0.00000 -2.88000 0.00000 -0.55000 0.00000 0.00000 65.00000 BUD14_1CKA-13_24.PDB 8.03000 -39.05000 -13.15000 -65.86000 -2.20000 78.85000 -84.94000 8.96000 35.63000 90.16000 0.00000 0.00000 0.00000 2.89000 17.55000 0.00000 -2.71000 0.00000 -0.55000 0.00000 0.00000 65.00000 BUD14_1CKA-13_25.PDB 8.13000 -40.95000 -15.21000 -69.20000 -3.01000 83.86000 -88.88000 9.93000 39.78000 92.38000 0.00000 0.00000 0.00000 3.50000 18.04000 0.00000 -3.01000 0.00000 -1.04000 0.00000 0.00000 65.00000 BUD14_1CKA-13_26.PDB 6.26000 -42.42000 -19.35000 -69.00000 -3.40000 85.94000 -87.75000 9.97000 40.14000 92.59000 0.00000 0.00000 0.00000 3.37000 18.12000 0.00000 -2.71000 0.00000 -1.10000 0.00000 0.00000 65.00000 BUD14_1CKA-13_27.PDB 7.30000 -42.33000 -19.19000 -68.61000 -3.35000 85.56000 -87.04000 9.81000 39.94000 92.84000 0.00000 0.00000 0.00000 3.55000 18.10000 0.00000 -2.77000 0.00000 -1.11000 0.00000 0.00000 65.00000 BUD14_1CKA-13_28.PDB 9.09000 -41.02000 -15.97000 -68.83000 -2.97000 84.57000 -87.94000 9.76000 39.43000 92.34000 0.00000 0.00000 0.00000 3.49000 18.14000 0.00000 -2.74000 0.00000 -1.02000 0.00000 0.00000 65.00000 BUD14_1CKA-13_29.PDB 6.57000 -39.34000 -14.33000 -67.97000 -2.18000 80.15000 -88.01000 8.67000 37.79000 91.19000 0.00000 0.00000 0.00000 3.31000 17.77000 0.00000 -2.22000 0.00000 -0.47000 0.00000 0.00000 65.00000 BUD14_1CKA-13_30.PDB 6.26000 -39.81000 -17.06000 -67.10000 -2.03000 80.62000 -86.46000 8.84000 37.61000 91.83000 0.00000 0.00000 0.00000 3.03000 17.57000 0.00000 -2.39000 0.00000 -0.82000 0.00000 0.00000 65.00000