data_6ntx_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6ntx _Structure_validation_residue.Date_analyzed 2019-07-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.827 0 CA-C-O 119.711 -0.185 . . . . 89.36 111.255 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 29.0 tp -65.07 -39.03 92.66 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 119.728 -0.789 . . . . 95.62 110.351 170.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 27.3 mp0 -54.97 -39.71 69.25 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.31 -0.556 . . . . 93.61 110.483 168.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . -60.96 -46.94 93.56 Favored Glycine 0 C--N 1.337 0.601 0 C-N-CA 120.191 -1.004 . . . . 66.23 112.484 179.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 80.8 mt-10 -59.6 -47.05 87.07 Favored 'General case' 0 C--O 1.235 0.308 0 O-C-N 122.159 -0.612 . . . . 96.17 111.188 179.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 36.4 t -54.44 -44.78 68.67 Favored 'Isoleucine or valine' 0 C--O 1.244 0.812 0 CA-C-O 121.625 0.726 . . . . 58.56 109.979 175.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -60.69 -39.83 89.95 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.28 -0.568 . . . . 93.06 110.979 179.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 22.0 mttt -64.74 -43.06 94.59 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.798 0.295 . . . . 104.58 111.798 178.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' ILE . . . . . . . . . . . . . 86.9 mt -60.52 -41.25 87.05 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 O-C-N 122.008 -0.432 . . . . 54.32 109.985 178.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -59.57 -44.05 93.42 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 119.992 -0.683 . . . . 148.1 111.322 175.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 38.8 m -65.75 -40.3 91.96 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 118.031 -1.467 . . . . 66.87 110.568 179.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -63.83 -41.03 97.94 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 120.417 -0.513 . . . . 39.59 111.183 -179.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' LEU . . . . . . . . . . . . . 21.7 tp -67.35 -40.34 85.83 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 119.6 -0.84 . . . . 47.36 111.225 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 67.7 mt -58.59 -35.56 72.61 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 118.712 -1.195 . . . . 54.67 110.141 175.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 50.3 m -70.54 -38.67 74.22 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 118.962 -1.095 . . . . 53.88 111.449 177.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 76.7 m -59.86 -43.74 94.53 Favored 'General case' 0 C--O 1.25 1.111 0 C-N-CA 119.498 -0.881 . . . . 40.26 111.997 173.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -57.12 -39.56 75.38 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-N 118.153 0.433 . . . . 39.09 110.759 178.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' LYS . . . . . 0.433 ' HD3' ' CZ2' ' C' ' 473' ' ' TRP . 59.1 mttt -68.92 -32.35 71.9 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 120.696 0.284 . . . . 114.32 111.568 178.639 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' ALA . . . . . . . . . . . . . . . -62.46 -41.77 98.99 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 119.773 -0.771 . . . . 33.81 111.557 171.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 38.2 t -67.22 -43.41 88.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 119.591 -0.844 . . . . 37.27 110.149 -177.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 54.5 t -57.9 -48.83 82.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.886 0.85 . . . . 42.09 111.331 179.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 53.6 p -68.69 -28.99 67.34 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 118.442 -1.303 . . . . 64.95 111.535 -177.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 40.7 tp -68.62 -41.42 79.53 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 120.988 -1.07 . . . . 44.38 109.833 175.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 14.9 t -54.61 -44.28 72.97 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 123.136 0.574 . . . . 58.25 111.445 171.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' ASN . . . . . 0.431 ' ND2' ' O ' ' A' ' 301' ' ' HOH . 88.4 m-20 -66.26 -34.63 78.44 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 117.912 -1.515 . . . . 50.7 110.229 179.182 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' GLY . . . . . . . . . . . . . . . -56.89 -46.72 90.3 Favored Glycine 0 C--N 1.334 0.463 0 C-N-CA 119.873 -1.156 . . . . 39.18 113.225 171.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' VAL . . . . . . . . . . . . . 65.3 t -67.68 -33.29 60.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 C-N-CA 119.979 -0.688 . . . . 40.57 111.303 -176.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' SER . . . . . . . . . . . . . . . -66.57 -43.02 86.12 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.858 -0.526 . . . . 49.4 111.617 178.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' VAL . . . . . . . . . . . . . 54.9 t -59.03 -50.01 81.24 Favored 'Isoleucine or valine' 0 C--N 1.345 0.37 0 CA-C-O 121.769 0.795 . . . . 50.29 109.987 175.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 58.4 tp -60.15 -39.57 86.83 Favored 'General case' 0 C--O 1.241 0.634 0 O-C-N 121.613 -0.68 . . . . 53.75 111.097 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 72.4 m -59.71 -44.25 93.8 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 119.401 -0.919 . . . . 55.46 110.647 177.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 5.9 m -57.81 -43.77 85.91 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-O 121.152 0.501 . . . . 75.01 111.325 177.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -66.06 -34.06 77.22 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.118 -0.633 . . . . 134.59 111.447 179.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 19.4 t -67.19 -37.79 79.86 Favored 'Isoleucine or valine' 0 C--O 1.243 0.712 0 C-N-CA 118.627 -1.229 . . . . 57.19 109.968 -179.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 82.9 mt -74.6 -35.96 62.98 Favored 'General case' 0 C--O 1.233 0.23 0 O-C-N 121.989 -0.445 . . . . 86.64 111.29 179.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -56.63 -28.16 59.95 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 119.336 -0.946 . . . . 79.55 110.352 171.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' LEU . . . . . . . . . . . . . 3.5 tp -83.74 -36.16 23.85 Favored 'General case' 0 C--N 1.341 0.214 0 N-CA-C 112.047 0.388 . . . . 112.02 112.047 -173.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' LYS . . . . . . . . . . . . . 5.3 tttp -62.33 -42.61 99.52 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.052 -1.059 . . . . 108.3 110.61 170.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' ASN . . . . . . . . . . . . . 61.8 m-20 -57.87 -45.29 86.54 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.38 0.609 . . . . 115.4 110.708 176.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -59.15 -42.94 91.9 Favored 'General case' 0 C--O 1.203 -1.366 0 N-CA-C 107.02 -1.474 . . . . 181.44 107.02 176.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 199' ' ' ILE . . . . . . . . . . . . . . . -63.17 -58.36 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 107.446 -1.316 . . . . 107.28 107.446 -179.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -48.51 -51.71 26.04 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.47 1.108 . . . . 108.63 111.692 179.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.965 0 N-CA-C 108.712 -0.847 . . . . 117.9 108.712 179.136 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 158' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.008 . . . . . . . . 81.71 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 159' ' ' HIS . . . . . 0.402 ' O ' ' N ' ' B' ' 162' ' ' GLY . . . -74.12 -66.32 0.73 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.387 1.075 . . . . 82.06 110.701 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 160' ' ' LEU . . . . . . . . . . . . . . . -50.51 -32.22 17.66 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 119.6 -0.84 . . . . 91.59 112.15 178.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 161' ' ' GLU . . . . . . . . . . . . . . . -69.52 -37.29 77.06 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 119.64 -0.824 . . . . 84.0 110.775 173.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 162' ' ' GLY . . . . . 0.402 ' N ' ' O ' ' B' ' 159' ' ' HIS . . . -60.63 -37.12 92.92 Favored Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 119.632 -1.27 . . . . 75.31 111.788 178.506 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 163' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -66.26 -48.48 70.35 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 122.532 0.333 . . . . 110.11 110.822 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 164' ' ' VAL . . . . . . . . . . . . . 55.0 t -56.08 -38.56 53.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 C-N-CA 119.792 -0.763 . . . . 84.58 110.523 174.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 165' ' ' ASN . . . . . . . . . . . . . . . -66.05 -36.27 82.78 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 119.727 -0.789 . . . . 68.41 110.969 174.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 166' ' ' LYS . . . . . . . . . . . . . . . -66.35 -40.09 89.59 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.505 -0.878 . . . . 79.38 110.927 176.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 167' ' ' ILE . . . . . . . . . . . . . 3.5 mm -62.66 -49.38 83.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 120.036 -0.666 . . . . 74.16 109.898 177.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 168' ' ' LYS . . . . . . . . . . . . . 25.4 tttm -53.59 -41.2 66.32 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 121.966 -0.458 . . . . 91.2 110.99 179.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 169' ' ' SER . . . . . . . . . . . . . 3.6 m -69.77 -37.43 76.39 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.085 -0.646 . . . . 87.59 111.174 178.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.67 -37.43 87.56 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 118.611 -1.236 . . . . 44.99 109.753 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 10.1 tp -73.09 -38.65 66.31 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 119.6 -0.84 . . . . 51.91 112.1 -175.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 54.9 mt -61.29 -31.4 71.23 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 120.348 -0.541 . . . . 66.75 111.641 176.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 23.1 m -73.37 -44.13 59.26 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 120.528 -0.469 . . . . 58.76 111.509 176.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 174' ' ' THR . . . . . . . . . . . . . 35.7 m -55.45 -44.68 76.6 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 108.885 -0.783 . . . . 40.54 108.885 174.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 33.8 m-20 -58.38 -40.76 83.19 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.14 -0.482 . . . . 43.85 111.259 -179.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . . . -67.28 -36.66 82.02 Favored 'General case' 0 C--N 1.348 0.52 0 C-N-CA 120.312 -0.555 . . . . 61.77 110.849 176.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 177' ' ' ALA . . . . . . . . . . . . . . . -55.13 -40.41 70.5 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.03 -0.668 . . . . 42.93 111.932 170.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 178' ' ' VAL . . . . . . . . . . . . . 75.5 t -68.65 -41.96 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 118.736 -1.186 . . . . 38.75 110.868 -177.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 44.2 t -60.66 -47.05 94.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 O-C-N 122.085 -0.384 . . . . 51.49 110.75 178.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 55.7 m -59.21 -46.17 89.17 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 119.244 -0.983 . . . . 67.72 112.43 178.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 67.9 tp -58.93 -44.81 91.43 Favored 'General case' 0 CA--C 1.518 -0.277 0 O-C-N 121.356 -0.84 . . . . 50.02 111.221 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 182' ' ' SER . . . . . . . . . . . . . 2.2 p -68.28 -30.96 70.09 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 118.917 -1.113 . . . . 68.83 110.607 -175.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 183' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -62.86 -43.46 98.74 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 119.847 -0.741 . . . . 57.19 110.635 169.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 184' ' ' GLY . . . . . . . . . . . . . . . -57.27 -42.98 93.77 Favored Glycine 0 C--O 1.222 -0.599 0 C-N-CA 120.011 -1.09 . . . . 41.22 113.214 175.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 185' ' ' VAL . . . . . . . . . . . . . 94.0 t -66.52 -37.29 79.27 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 C-N-CA 118.516 -1.274 . . . . 41.51 111.574 179.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 186' ' ' SER . . . . . . . . . . . . . 63.5 m -64.4 -49.75 70.32 Favored 'General case' 0 C--O 1.237 0.427 0 O-C-N 120.917 -1.115 . . . . 63.99 111.334 -179.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 187' ' ' VAL . . . . . . . . . . . . . 90.9 t -48.65 -50.91 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 C-N-CA 120.216 -0.594 . . . . 59.23 109.918 171.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 188' ' ' LEU . . . . . . . . . . . . . 57.5 tp -61.0 -39.91 91.52 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 119.314 -0.954 . . . . 57.59 111.754 -176.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 189' ' ' THR . . . . . . . . . . . . . 73.8 m -60.83 -45.84 92.89 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 121.039 0.447 . . . . 55.03 110.204 178.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 48.9 m -57.93 -40.85 81.45 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.463 -0.335 . . . . 79.88 111.604 174.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 191' ' ' LYS . . . . . . . . . . . . . . . -66.63 -38.72 87.49 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 119.781 -0.768 . . . . 66.36 110.455 -178.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 11.2 t -59.19 -39.0 77.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 CA-C-N 116.693 -0.231 . . . . 62.65 110.619 -179.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . . . -75.32 -28.42 59.66 Favored 'General case' 0 C--O 1.239 0.521 0 O-C-N 121.715 -0.616 . . . . 82.89 112.14 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 194' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -61.83 -40.13 94.22 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 119.758 -0.777 . . . . 83.71 110.453 170.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 195' ' ' LEU . . . . . . . . . . . . . . . -67.09 -30.64 70.72 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 120.052 -0.659 . . . . 87.3 111.686 -178.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . . . -50.65 -49.31 57.32 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 118.911 -1.116 . . . . 96.71 109.656 168.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 197' ' ' ASN . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.381 0 CA-C-O 121.441 0.639 . . . . 107.56 111.595 168.53 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 451' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.674 0 N-CA-C 109.968 -0.382 . . . . 124.15 109.968 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 452' ' ' ASP . . . . . 0.516 ' OD1' ' NZ ' ' D' ' 464' ' ' LYS . 38.9 t0 -136.82 69.3 58.62 Favored Pre-proline 0 C--O 1.241 0.628 0 N-CA-C 106.85 -1.537 . . . . 121.18 106.85 177.214 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 453' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -54.46 -24.51 36.06 Favored 'Trans proline' 0 C--O 1.174 -2.698 0 N-CA-C 117.858 2.215 . . . . 97.0 117.858 -174.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 454' ' ' ILE . . . . . . . . . . . . . 65.0 mt -75.78 -41.01 39.99 Favored 'Isoleucine or valine' 0 C--O 1.164 -3.415 0 CA-C-N 119.83 1.195 . . . . 82.83 112.555 -177.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 455' ' ' ASP . . . . . 0.429 ' O ' ' OD1' ' C' ' 455' ' ' ASP . 65.4 t0 -77.11 -28.93 54.56 Favored 'General case' 0 C--O 1.177 -2.73 0 C-N-CA 120.158 -0.617 . . . . 146.76 112.205 -178.378 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 456' ' ' ILE . . . . . . . . . . . . . . . -73.24 -39.49 56.19 Favored 'Isoleucine or valine' 0 C--O 1.168 -3.221 0 N-CA-C 108.406 -0.961 . . . . 85.88 108.406 176.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 457' ' ' SER . . . . . . . . . . . . . 16.4 t -60.6 -43.19 97.68 Favored 'General case' 0 C--N 1.311 -1.091 0 C-N-CA 121.279 -0.168 . . . . 78.36 110.68 -178.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 458' ' ' ILE . . . . . . . . . . . . . 75.9 mt -70.41 -47.13 67.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 C-N-CA 119.805 -0.758 . . . . 96.79 110.648 -172.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 459' ' ' VAL . . . . . . . . . . . . . 60.3 t -59.65 -49.89 82.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 O-C-N 121.927 -0.483 . . . . 81.27 110.79 174.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 460' ' ' LEU . . . . . . . . . . . . . . . -58.61 -40.33 82.97 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 119.781 -0.768 . . . . 64.66 110.928 -176.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 461' ' ' ASN . . . . . . . . . . . . . 61.3 m-20 -72.62 -37.05 68.17 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 119.942 -0.703 . . . . 87.01 111.493 -177.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . . . -61.29 -52.07 66.26 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 116.851 -1.939 . . . . 57.07 109.095 175.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 463' ' ' ILE . . . . . . . . . . . . . 85.5 mt -64.89 -48.08 85.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 O-C-N 121.455 -0.778 . . . . 57.84 110.874 -176.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 464' ' ' LYS . . . . . . . . . . . . . 18.3 tttm -60.75 -32.1 71.41 Favored 'General case' 0 C--O 1.242 0.662 0 C-N-CA 119.143 -1.023 . . . . 181.54 111.313 -176.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 465' ' ' SER . . . . . . . . . . . . . 53.8 p -73.69 -25.39 60.21 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 117.708 -1.597 . . . . 67.42 110.656 -176.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 466' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -74.77 -43.2 56.1 Favored 'General case' 0 C--O 1.177 -2.728 0 CA-C-O 118.02 -0.991 . . . . 76.59 108.794 176.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 467' ' ' LEU . . . . . . . . . . . . . 56.6 mt -69.67 -36.8 76.33 Favored 'General case' 0 C--O 1.188 -2.172 0 CA-C-N 119.336 0.971 . . . . 57.75 109.184 -177.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 25.9 tp10 -69.85 -39.77 76.2 Favored 'General case' 0 C--O 1.185 -2.312 0 CA-C-O 117.465 -1.255 . . . . 85.58 107.859 -179.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 469' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -63.83 -40.35 96.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 118.721 0.691 . . . . 59.17 110.965 175.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 470' ' ' SER . . . . . . . . . . . . . 44.0 t -61.17 -39.57 90.64 Favored 'General case' 0 C--O 1.232 0.182 0 O-C-N 121.482 -0.761 . . . . 50.04 110.192 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 471' ' ' LYS . . . . . . . . . . . . . . . -72.31 -29.48 63.89 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 118.942 -1.103 . . . . 46.83 111.398 -176.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 472' ' ' GLU . . . . . 0.676 ' OE1' ' NH1' ' C' ' 475' ' ' ARG . 30.8 mm-40 -73.23 -37.33 66.43 Favored 'General case' 0 CA--C 1.512 -0.485 0 C-N-CA 119.189 -1.004 . . . . 74.98 110.933 179.207 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 473' ' ' TRP . . . . . 0.433 ' CZ2' ' HD3' ' A' ' 176' ' ' LYS . 61.5 m95 -61.8 -40.61 95.86 Favored 'General case' 0 C--N 1.349 0.586 0 C-N-CA 120.107 -0.637 . . . . 57.32 110.786 174.693 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 474' ' ' ILE . . . . . . . . . . . . . 27.7 mm -61.24 -44.41 98.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 C-N-CA 119.452 -0.899 . . . . 45.38 109.842 175.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 475' ' ' ARG . . . . . 0.676 ' NH1' ' OE1' ' C' ' 472' ' ' GLU . 49.4 mtt85 -62.67 -39.0 92.57 Favored 'General case' 0 CA--C 1.504 -0.813 0 C-N-CA 119.365 -0.934 . . . . 80.41 108.961 -177.004 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 476' ' ' ARG . . . . . . . . . . . . . . . -59.74 -44.11 93.92 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.366 -0.379 . . . . 37.73 110.952 173.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 477' ' ' SER . . . . . . . . . . . . . 45.7 t -65.17 -45.88 83.08 Favored 'General case' 0 C--N 1.346 0.421 0 C-N-CA 119.658 -0.817 . . . . 35.87 110.853 -177.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 478' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -59.62 -43.75 93.69 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 120.36 -0.536 . . . . 45.39 111.754 175.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 479' ' ' LYS . . . . . . . . . . . . . . . -59.36 -45.13 92.27 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 119.394 -0.923 . . . . 65.92 110.655 -178.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 480' ' ' ILE . . . . . . . . . . . . . 92.1 mt -64.21 -39.06 84.16 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.65 0 CA-C-O 121.478 0.656 . . . . 63.94 109.449 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 59.2 mt -69.47 -19.7 63.75 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 118.152 -1.419 . . . . 63.27 111.884 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 482' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -79.81 -9.44 59.66 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 117.911 -1.516 . . . . 70.36 112.157 176.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 483' ' ' SER . . . . . . . . . . . . . 15.2 p -92.16 25.9 2.72 Favored 'General case' 0 C--O 1.24 0.582 0 C-N-CA 123.494 0.717 . . . . 88.43 112.452 175.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 484' ' ' ILE . . . . . . . . . . . . . 93.3 mt -117.8 -51.83 4.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.545 -0.539 . . . . 114.38 109.545 175.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 485' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 115.632 -0.713 . . . . 105.64 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 458' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 116.775 -1.583 . . . . 93.09 110.425 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 459' ' ' VAL . . . . . . . . . . . . . . . -75.88 -22.72 16.05 Favored 'Isoleucine or valine' 0 C--O 1.184 -2.351 0 N-CA-C 108.197 -1.038 . . . . 97.78 108.197 -178.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . . . -69.64 -41.67 75.28 Favored 'General case' 0 C--O 1.2 -1.509 0 N-CA-C 107.196 -1.409 . . . . 67.73 107.196 177.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . . . -64.24 -41.64 96.9 Favored 'General case' 0 C--O 1.181 -2.549 0 CA-C-O 117.084 -1.436 . . . . 83.67 109.518 -178.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 462' ' ' LYS . . . . . . . . . . . . . . . -65.92 -40.81 91.78 Favored 'General case' 0 C--O 1.193 -1.918 0 C-N-CA 124.614 1.165 . . . . 74.22 109.057 -179.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 463' ' ' ILE . . . . . . . . . . . . . 23.3 mt -67.25 -39.47 82.99 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.33 0 N-CA-C 106.08 -1.822 . . . . 69.35 106.08 177.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 464' ' ' LYS . . . . . 0.516 ' NZ ' ' OD1' ' C' ' 452' ' ' ASP . 72.2 tttt -68.77 -23.95 64.37 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 123.988 0.805 . . . . 96.65 111.102 -176.748 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 465' ' ' SER . . . . . . . . . . . . . . . -69.5 -46.82 65.7 Favored 'General case' 0 C--O 1.19 -2.061 0 C-N-CA 123.791 0.837 . . . . 62.07 108.78 179.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -63.22 -38.55 91.6 Favored 'General case' 0 C--O 1.169 -3.147 0 C-N-CA 126.089 1.756 . . . . 80.88 110.988 179.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 467' ' ' LEU . . . . . . . . . . . . . 40.2 mt -73.26 -34.72 65.98 Favored 'General case' 0 C--O 1.188 -2.146 0 CA-C-O 117.889 -1.053 . . . . 62.44 108.462 -179.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 468' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -72.57 -39.53 67.34 Favored 'General case' 0 C--N 1.322 -0.62 0 O-C-N 123.826 0.704 . . . . 141.61 110.61 179.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 469' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -58.31 -43.74 88.25 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.182 -0.607 . . . . 75.04 109.744 171.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 470' ' ' SER . . . . . . . . . . . . . 7.3 t -55.34 -51.73 65.82 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 121.584 0.707 . . . . 53.13 110.249 178.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 8.9 mttt -61.03 -32.11 71.73 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 116.078 -0.51 . . . . 89.61 111.471 -176.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 472' ' ' GLU . . . . . 0.461 ' OE2' ' NH1' ' D' ' 475' ' ' ARG . 18.6 tp10 -72.46 -42.59 64.81 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 111.654 0.242 . . . . 89.83 111.654 -178.84 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 473' ' ' TRP . . . . . . . . . . . . . 70.2 m95 -57.99 -39.5 78.4 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 119.942 -0.703 . . . . 77.42 110.263 173.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 474' ' ' ILE . . . . . . . . . . . . . 28.8 mm -66.14 -37.09 78.99 Favored 'Isoleucine or valine' 0 C--O 1.242 0.707 0 C-N-CA 118.542 -1.263 . . . . 44.73 109.873 178.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 475' ' ' ARG . . . . . 0.461 ' NH1' ' OE2' ' D' ' 472' ' ' GLU . 11.1 mtt85 -62.65 -46.8 86.53 Favored 'General case' 0 C--O 1.174 -2.893 0 CA-C-O 117.169 -1.396 . . . . 110.84 107.755 178.831 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 476' ' ' ARG . . . . . . . . . . . . . 42.1 ttt180 -57.29 -51.11 70.69 Favored 'General case' 0 C--O 1.185 -2.33 0 CA-C-O 117.148 -1.406 . . . . 99.86 108.672 176.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 40.6 t -57.99 -48.11 80.99 Favored 'General case' 0 C--O 1.154 -3.969 0 CA-C-N 120.32 1.418 . . . . 53.65 109.969 179.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 478' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -61.11 -35.26 76.54 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 119.956 1.253 . . . . 52.7 110.382 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . . . -67.3 -50.99 58.05 Favored 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 121.867 -0.521 . . . . 54.35 110.766 -179.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 480' ' ' ILE . . . . . . . . . . . . . 46.0 mt -50.93 -36.43 15.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 C-N-CA 120.386 -0.526 . . . . 71.87 110.465 174.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 481' ' ' LEU . . . . . . . . . . . . . 39.2 mt -80.52 -36.86 32.64 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 117.735 -1.586 . . . . 59.95 112.689 -172.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 482' ' ' ASP . . . . . . . . . . . . . . . -62.28 -16.36 53.36 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 119.79 -0.764 . . . . 74.84 111.47 -175.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 483' ' ' SER . . . . . . . . . . . . . 59.9 p -88.55 50.95 2.06 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 122.797 1.284 . . . . 82.79 110.829 173.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 484' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.384 0 CA-C-N 115.627 -0.715 . . . . 101.43 109.393 179.353 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . 0.431 ' O ' ' ND2' ' A' ' 183' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.827 0 CA-C-O 119.711 -0.185 . . . . 74.32 111.255 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 29.0 tp -65.07 -39.03 92.66 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 119.728 -0.789 . . . . 78.84 110.351 170.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 27.3 mp0 -54.97 -39.71 69.25 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.31 -0.556 . . . . 79.72 110.483 168.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . -60.96 -46.94 93.56 Favored Glycine 0 C--N 1.337 0.601 0 C-N-CA 120.191 -1.004 . . . . 54.35 112.484 179.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' GLU . . . . . 0.483 ' HG2' HG23 ' C' ' 484' ' ' ILE . 80.8 mt-10 -59.6 -47.05 87.07 Favored 'General case' 0 C--O 1.235 0.308 0 O-C-N 122.159 -0.612 . . . . 91.05 111.188 179.777 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 36.4 t -54.44 -44.78 68.67 Favored 'Isoleucine or valine' 0 C--O 1.244 0.812 0 CA-C-O 121.625 0.726 . . . . 47.96 109.979 175.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -60.69 -39.83 89.95 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.28 -0.568 . . . . 76.71 110.979 179.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 22.0 mttt -64.74 -43.06 94.59 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.798 0.295 . . . . 86.31 111.798 178.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' ILE . . . . . . . . . . . . . 86.9 mt -60.52 -41.25 87.05 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 O-C-N 122.008 -0.432 . . . . 44.43 109.985 178.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -59.57 -44.05 93.42 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 119.992 -0.683 . . . . 122.58 111.322 175.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 38.8 m -65.75 -40.3 91.96 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 118.031 -1.467 . . . . 54.88 110.568 179.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -63.83 -41.03 97.94 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 120.417 -0.513 . . . . 32.15 111.183 -179.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' LEU . . . . . . . . . . . . . 21.7 tp -67.35 -40.34 85.83 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 119.6 -0.84 . . . . 38.62 111.225 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 67.7 mt -58.59 -35.56 72.61 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 118.712 -1.195 . . . . 44.72 110.141 175.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 50.3 m -70.54 -38.67 74.22 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 118.962 -1.095 . . . . 44.06 111.449 177.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 76.7 m -59.86 -43.74 94.53 Favored 'General case' 0 C--O 1.25 1.111 0 C-N-CA 119.498 -0.881 . . . . 32.71 111.997 173.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -57.12 -39.56 75.38 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-N 118.153 0.433 . . . . 31.73 110.759 178.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 176' ' ' LYS . . . . . 0.456 ' HD3' ' CZ2' ' C' ' 473' ' ' TRP . 59.1 mttt -68.92 -32.35 71.9 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 120.696 0.284 . . . . 94.42 111.568 178.639 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 177' ' ' ALA . . . . . . . . . . . . . . . -62.46 -41.77 98.99 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 119.773 -0.771 . . . . 27.34 111.557 171.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 38.2 t -67.22 -43.41 88.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 119.591 -0.844 . . . . 30.21 110.149 -177.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 54.5 t -57.9 -48.83 82.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.886 0.85 . . . . 34.23 111.331 179.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 53.6 p -68.69 -28.99 67.34 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 118.442 -1.303 . . . . 53.29 111.535 -177.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 40.7 tp -68.62 -41.42 79.53 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 120.988 -1.07 . . . . 36.14 109.833 175.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 14.9 t -54.61 -44.28 72.97 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 123.136 0.574 . . . . 47.7 111.445 171.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 183' ' ' ASN . . . . . 0.431 ' ND2' ' O ' ' A' ' 301' ' ' HOH . 88.4 m-20 -66.26 -34.63 78.44 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 117.912 -1.515 . . . . 46.81 110.229 179.182 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 184' ' ' GLY . . . . . . . . . . . . . . . -56.89 -46.72 90.3 Favored Glycine 0 C--N 1.334 0.463 0 C-N-CA 119.873 -1.156 . . . . 31.89 113.225 171.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' VAL . . . . . . . . . . . . . 65.3 t -67.68 -33.29 60.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 C-N-CA 119.979 -0.688 . . . . 32.97 111.303 -176.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 186' ' ' SER . . . . . . . . . . . . . . . -66.57 -43.02 86.12 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.858 -0.526 . . . . 40.32 111.617 178.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 187' ' ' VAL . . . . . . . . . . . . . 54.9 t -59.03 -50.01 81.24 Favored 'Isoleucine or valine' 0 C--N 1.345 0.37 0 CA-C-O 121.769 0.795 . . . . 41.07 109.987 175.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 58.4 tp -60.15 -39.57 86.83 Favored 'General case' 0 C--O 1.241 0.634 0 O-C-N 121.613 -0.68 . . . . 43.95 111.097 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 72.4 m -59.71 -44.25 93.8 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 119.401 -0.919 . . . . 45.38 110.647 177.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 5.9 m -57.81 -43.77 85.91 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-O 121.152 0.501 . . . . 61.66 111.325 177.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -66.06 -34.06 77.22 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.118 -0.633 . . . . 111.32 111.447 179.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 19.4 t -67.19 -37.79 79.86 Favored 'Isoleucine or valine' 0 C--O 1.243 0.712 0 C-N-CA 118.627 -1.229 . . . . 53.57 109.968 -179.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 82.9 mt -74.6 -35.96 62.98 Favored 'General case' 0 C--O 1.233 0.23 0 O-C-N 121.989 -0.445 . . . . 71.36 111.29 179.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 194' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -56.63 -28.16 59.95 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 119.336 -0.946 . . . . 79.55 110.352 171.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 195' ' ' LEU . . . . . . . . . . . . . 3.5 tp -83.74 -36.16 23.85 Favored 'General case' 0 C--N 1.341 0.214 0 N-CA-C 112.047 0.388 . . . . 92.51 112.047 -173.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 196' ' ' LYS . . . . . . . . . . . . . 5.3 tttp -62.33 -42.61 99.52 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.052 -1.059 . . . . 89.41 110.61 170.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 197' ' ' ASN . . . . . . . . . . . . . 61.8 m-20 -57.87 -45.29 86.54 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.38 0.609 . . . . 95.83 110.708 176.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -59.15 -42.94 91.9 Favored 'General case' 0 C--O 1.203 -1.366 0 N-CA-C 107.02 -1.474 . . . . 150.36 107.02 176.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 199' ' ' ILE . . . . . . . . . . . . . . . -63.17 -58.36 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 107.446 -1.316 . . . . 107.28 107.446 -179.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -48.51 -51.71 26.04 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.47 1.108 . . . . 106.95 111.692 179.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.965 0 N-CA-C 108.712 -0.847 . . . . 97.49 108.712 179.136 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 158' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.008 . . . . . . . . 81.71 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 159' ' ' HIS . . . . . 0.402 ' O ' ' N ' ' B' ' 162' ' ' GLY . . . -74.12 -66.32 0.73 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.387 1.075 . . . . 80.15 110.701 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 160' ' ' LEU . . . . . . . . . . . . . . . -50.51 -32.22 17.66 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 119.6 -0.84 . . . . 75.49 112.15 178.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 161' ' ' GLU . . . . . . . . . . . . . . . -69.52 -37.29 77.06 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 119.64 -0.824 . . . . 69.24 110.775 173.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 162' ' ' GLY . . . . . 0.402 ' N ' ' O ' ' B' ' 159' ' ' HIS . . . -60.63 -37.12 92.92 Favored Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 119.632 -1.27 . . . . 61.92 111.788 178.506 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 163' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -66.26 -48.48 70.35 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 122.532 0.333 . . . . 110.11 110.822 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 164' ' ' VAL . . . . . . . . . . . . . 55.0 t -56.08 -38.56 53.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 C-N-CA 119.792 -0.763 . . . . 69.64 110.523 174.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 165' ' ' ASN . . . . . . . . . . . . . . . -66.05 -36.27 82.78 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 119.727 -0.789 . . . . 60.07 110.969 174.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 166' ' ' LYS . . . . . . . . . . . . . . . -66.35 -40.09 89.59 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.505 -0.878 . . . . 65.31 110.927 176.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 167' ' ' ILE . . . . . . . . . . . . . 3.5 mm -62.66 -49.38 83.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 120.036 -0.666 . . . . 60.96 109.898 177.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 168' ' ' LYS . . . . . 0.43 ' HE2' ' O ' ' D' ' 481' ' ' LEU . 25.4 tttm -53.59 -41.2 66.32 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 121.966 -0.458 . . . . 75.16 110.99 179.796 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 169' ' ' SER . . . . . . . . . . . . . 3.6 m -69.77 -37.43 76.39 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.085 -0.646 . . . . 72.15 111.174 178.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.67 -37.43 87.56 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 118.611 -1.236 . . . . 36.65 109.753 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 10.1 tp -73.09 -38.65 66.31 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 119.6 -0.84 . . . . 42.42 112.1 -175.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 54.9 mt -61.29 -31.4 71.23 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 120.348 -0.541 . . . . 54.78 111.641 176.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 23.1 m -73.37 -44.13 59.26 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 120.528 -0.469 . . . . 48.13 111.509 176.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 174' ' ' THR . . . . . . . . . . . . . 35.7 m -55.45 -44.68 76.6 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 108.885 -0.783 . . . . 32.95 108.885 174.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 33.8 m-20 -58.38 -40.76 83.19 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.14 -0.482 . . . . 37.72 111.259 -179.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . . . -67.28 -36.66 82.02 Favored 'General case' 0 C--N 1.348 0.52 0 C-N-CA 120.312 -0.555 . . . . 50.63 110.849 176.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 177' ' ' ALA . . . . . . . . . . . . . . . -55.13 -40.41 70.5 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.03 -0.668 . . . . 42.93 111.932 170.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 178' ' ' VAL . . . . . . . . . . . . . 75.5 t -68.65 -41.96 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 118.736 -1.186 . . . . 31.45 110.868 -177.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 44.2 t -60.66 -47.05 94.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 O-C-N 122.085 -0.384 . . . . 42.07 110.75 178.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 55.7 m -59.21 -46.17 89.17 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 119.244 -0.983 . . . . 55.59 112.43 178.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 67.9 tp -58.93 -44.81 91.43 Favored 'General case' 0 CA--C 1.518 -0.277 0 O-C-N 121.356 -0.84 . . . . 40.84 111.221 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 182' ' ' SER . . . . . . . . . . . . . 2.2 p -68.28 -30.96 70.09 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 118.917 -1.113 . . . . 56.52 110.607 -175.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 183' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -62.86 -43.46 98.74 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 119.847 -0.741 . . . . 52.53 110.635 169.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 184' ' ' GLY . . . . . . . . . . . . . . . -57.27 -42.98 93.77 Favored Glycine 0 C--O 1.222 -0.599 0 C-N-CA 120.011 -1.09 . . . . 33.51 113.214 175.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 185' ' ' VAL . . . . . . . . . . . . . 94.0 t -66.52 -37.29 79.27 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 C-N-CA 118.516 -1.274 . . . . 34.56 111.574 179.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 186' ' ' SER . . . . . . . . . . . . . 63.5 m -64.4 -49.75 70.32 Favored 'General case' 0 C--O 1.237 0.427 0 O-C-N 120.917 -1.115 . . . . 52.48 111.334 -179.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 187' ' ' VAL . . . . . . . . . . . . . 90.9 t -48.65 -50.91 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 C-N-CA 120.216 -0.594 . . . . 48.52 109.918 171.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 188' ' ' LEU . . . . . . . . . . . . . 57.5 tp -61.0 -39.91 91.52 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 119.314 -0.954 . . . . 47.15 111.754 -176.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 189' ' ' THR . . . . . . . . . . . . . 73.8 m -60.83 -45.84 92.89 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 121.039 0.447 . . . . 45.01 110.204 178.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 48.9 m -57.93 -40.85 81.45 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.463 -0.335 . . . . 65.73 111.604 174.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 191' ' ' LYS . . . . . . . . . . . . . . . -66.63 -38.72 87.49 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 119.781 -0.768 . . . . 66.36 110.455 -178.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 11.2 t -59.19 -39.0 77.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 CA-C-N 116.693 -0.231 . . . . 62.65 110.619 -179.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . . . -75.32 -28.42 59.66 Favored 'General case' 0 C--O 1.239 0.521 0 O-C-N 121.715 -0.616 . . . . 73.61 112.14 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 194' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -61.83 -40.13 94.22 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 119.758 -0.777 . . . . 83.71 110.453 170.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 195' ' ' LEU . . . . . . . . . . . . . . . -67.09 -30.64 70.72 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 120.052 -0.659 . . . . 77.25 111.686 -178.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . . . -50.65 -49.31 57.32 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 118.911 -1.116 . . . . 96.71 109.656 168.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 197' ' ' ASN . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.381 0 CA-C-O 121.441 0.639 . . . . 88.79 111.595 168.53 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 451' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.674 0 N-CA-C 109.968 -0.382 . . . . 124.15 109.968 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 452' ' ' ASP . . . . . 0.514 ' OD1' ' NZ ' ' D' ' 464' ' ' LYS . 38.9 t0 -136.82 69.3 58.62 Favored Pre-proline 0 C--O 1.241 0.628 0 N-CA-C 106.85 -1.537 . . . . 100.14 106.85 177.214 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 453' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -54.46 -24.51 36.06 Favored 'Trans proline' 0 C--O 1.174 -2.698 0 N-CA-C 117.858 2.215 . . . . 80.0 117.858 -174.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 454' ' ' ILE . . . . . . . . . . . . . 65.0 mt -75.78 -41.01 39.99 Favored 'Isoleucine or valine' 0 C--O 1.164 -3.415 0 CA-C-N 119.83 1.195 . . . . 68.18 112.555 -177.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 455' ' ' ASP . . . . . 0.429 ' O ' ' OD1' ' C' ' 455' ' ' ASP . 65.4 t0 -77.11 -28.93 54.56 Favored 'General case' 0 C--O 1.177 -2.73 0 C-N-CA 120.158 -0.617 . . . . 146.76 112.205 -178.378 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 456' ' ' ILE . . . . . . . . . . . . . . . -73.24 -39.49 56.19 Favored 'Isoleucine or valine' 0 C--O 1.168 -3.221 0 N-CA-C 108.406 -0.961 . . . . 70.73 108.406 176.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 457' ' ' SER . . . . . . . . . . . . . 16.4 t -60.6 -43.19 97.68 Favored 'General case' 0 C--N 1.311 -1.091 0 C-N-CA 121.279 -0.168 . . . . 64.46 110.68 -178.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 458' ' ' ILE . . . . . . . . . . . . . 75.9 mt -70.41 -47.13 67.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 C-N-CA 119.805 -0.758 . . . . 79.81 110.648 -172.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 459' ' ' VAL . . . . . . . . . . . . . 60.3 t -59.65 -49.89 82.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 O-C-N 121.927 -0.483 . . . . 66.88 110.79 174.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 460' ' ' LEU . . . . . . . . . . . . . . . -58.61 -40.33 82.97 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 119.781 -0.768 . . . . 58.03 110.928 -176.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 461' ' ' ASN . . . . . . . . . . . . . 61.3 m-20 -72.62 -37.05 68.17 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 119.942 -0.703 . . . . 71.66 111.493 -177.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . . . -61.29 -52.07 66.26 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 116.851 -1.939 . . . . 46.88 109.095 175.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 463' ' ' ILE . . . . . . . . . . . . . 85.5 mt -64.89 -48.08 85.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 O-C-N 121.455 -0.778 . . . . 47.36 110.874 -176.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 464' ' ' LYS . . . . . . . . . . . . . 18.3 tttm -60.75 -32.1 71.41 Favored 'General case' 0 C--O 1.242 0.662 0 C-N-CA 119.143 -1.023 . . . . 150.44 111.313 -176.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 465' ' ' SER . . . . . . . . . . . . . 53.8 p -73.69 -25.39 60.21 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 117.708 -1.597 . . . . 55.34 110.656 -176.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 466' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -74.77 -43.2 56.1 Favored 'General case' 0 C--O 1.177 -2.728 0 CA-C-O 118.02 -0.991 . . . . 62.98 108.794 176.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 467' ' ' LEU . . . . . . . . . . . . . 56.6 mt -69.67 -36.8 76.33 Favored 'General case' 0 C--O 1.188 -2.172 0 CA-C-N 119.336 0.971 . . . . 47.29 109.184 -177.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 25.9 tp10 -69.85 -39.77 76.2 Favored 'General case' 0 C--O 1.185 -2.312 0 CA-C-O 117.465 -1.255 . . . . 71.63 107.859 -179.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 469' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -63.83 -40.35 96.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 118.721 0.691 . . . . 57.75 110.965 175.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 470' ' ' SER . . . . . . . . . . . . . 44.0 t -61.17 -39.57 90.64 Favored 'General case' 0 C--O 1.232 0.182 0 O-C-N 121.482 -0.761 . . . . 40.86 110.192 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 471' ' ' LYS . . . . . . . . . . . . . . . -72.31 -29.48 63.89 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 118.942 -1.103 . . . . 44.05 111.398 -176.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 472' ' ' GLU . . . . . 0.676 ' OE1' ' NH1' ' C' ' 475' ' ' ARG . 30.8 mm-40 -73.23 -37.33 66.43 Favored 'General case' 0 CA--C 1.512 -0.485 0 C-N-CA 119.189 -1.004 . . . . 65.81 110.933 179.207 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 473' ' ' TRP . . . . . 0.456 ' CZ2' ' HD3' ' A' ' 176' ' ' LYS . 61.5 m95 -61.8 -40.61 95.86 Favored 'General case' 0 C--N 1.349 0.586 0 C-N-CA 120.107 -0.637 . . . . 46.93 110.786 174.693 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 474' ' ' ILE . . . . . . . . . . . . . 27.7 mm -61.24 -44.41 98.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 C-N-CA 119.452 -0.899 . . . . 36.98 109.842 175.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 475' ' ' ARG . . . . . 0.676 ' NH1' ' OE1' ' C' ' 472' ' ' GLU . 49.4 mtt85 -62.67 -39.0 92.57 Favored 'General case' 0 CA--C 1.504 -0.813 0 C-N-CA 119.365 -0.934 . . . . 66.16 108.961 -177.004 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 476' ' ' ARG . . . . . . . . . . . . . . . -59.74 -44.11 93.92 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.366 -0.379 . . . . 37.27 110.952 173.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 477' ' ' SER . . . . . . . . . . . . . 45.7 t -65.17 -45.88 83.08 Favored 'General case' 0 C--N 1.346 0.421 0 C-N-CA 119.658 -0.817 . . . . 29.4 110.853 -177.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 478' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -59.62 -43.75 93.69 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 120.36 -0.536 . . . . 41.46 111.754 175.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 479' ' ' LYS . . . . . . . . . . . . . . . -59.36 -45.13 92.27 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 119.394 -0.923 . . . . 58.33 110.655 -178.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 480' ' ' ILE . . . . . . . . . . . . . 92.1 mt -64.21 -39.06 84.16 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.65 0 CA-C-O 121.478 0.656 . . . . 52.45 109.449 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 59.2 mt -69.47 -19.7 63.75 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 118.152 -1.419 . . . . 51.88 111.884 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 482' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -79.81 -9.44 59.66 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 117.911 -1.516 . . . . 70.36 112.157 176.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 483' ' ' SER . . . . . . . . . . . . . 15.2 p -92.16 25.9 2.72 Favored 'General case' 0 C--O 1.24 0.582 0 C-N-CA 123.494 0.717 . . . . 88.43 112.452 175.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 484' ' ' ILE . . . . . 0.483 HG23 ' HG2' ' A' ' 163' ' ' GLU . 93.3 mt -117.8 -51.83 4.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.545 -0.539 . . . . 114.38 109.545 175.876 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 485' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 115.632 -0.713 . . . . 87.19 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 458' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 116.775 -1.583 . . . . 92.57 110.425 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 459' ' ' VAL . . . . . . . . . . . . . . . -75.88 -22.72 16.05 Favored 'Isoleucine or valine' 0 C--O 1.184 -2.351 0 N-CA-C 108.197 -1.038 . . . . 80.64 108.197 -178.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . . . -69.64 -41.67 75.28 Favored 'General case' 0 C--O 1.2 -1.509 0 N-CA-C 107.196 -1.409 . . . . 67.73 107.196 177.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . . . -64.24 -41.64 96.9 Favored 'General case' 0 C--O 1.181 -2.549 0 CA-C-O 117.084 -1.436 . . . . 68.89 109.518 -178.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 462' ' ' LYS . . . . . . . . . . . . . . . -65.92 -40.81 91.78 Favored 'General case' 0 C--O 1.193 -1.918 0 C-N-CA 124.614 1.165 . . . . 61.01 109.057 -179.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 463' ' ' ILE . . . . . . . . . . . . . 23.3 mt -67.25 -39.47 82.99 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.33 0 N-CA-C 106.08 -1.822 . . . . 56.95 106.08 177.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 464' ' ' LYS . . . . . 0.514 ' NZ ' ' OD1' ' C' ' 452' ' ' ASP . 72.2 tttt -68.77 -23.95 64.37 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 123.988 0.805 . . . . 79.7 111.102 -176.748 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 465' ' ' SER . . . . . . . . . . . . . . . -69.5 -46.82 65.7 Favored 'General case' 0 C--O 1.19 -2.061 0 C-N-CA 123.791 0.837 . . . . 50.88 108.78 179.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -63.22 -38.55 91.6 Favored 'General case' 0 C--O 1.169 -3.147 0 C-N-CA 126.089 1.756 . . . . 80.88 110.988 179.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 467' ' ' LEU . . . . . . . . . . . . . 40.2 mt -73.26 -34.72 65.98 Favored 'General case' 0 C--O 1.188 -2.146 0 CA-C-O 117.889 -1.053 . . . . 51.19 108.462 -179.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 468' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -72.57 -39.53 67.34 Favored 'General case' 0 C--N 1.322 -0.62 0 O-C-N 123.826 0.704 . . . . 132.12 110.61 179.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 469' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -58.31 -43.74 88.25 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.182 -0.607 . . . . 75.04 109.744 171.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 470' ' ' SER . . . . . . . . . . . . . 7.3 t -55.34 -51.73 65.82 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 121.584 0.707 . . . . 43.44 110.249 178.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 8.9 mttt -61.03 -32.11 71.73 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 116.078 -0.51 . . . . 73.83 111.471 -176.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 472' ' ' GLU . . . . . 0.461 ' OE2' ' NH1' ' D' ' 475' ' ' ARG . 18.6 tp10 -72.46 -42.59 64.81 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 111.654 0.242 . . . . 89.83 111.654 -178.84 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 473' ' ' TRP . . . . . . . . . . . . . 70.2 m95 -57.99 -39.5 78.4 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 119.942 -0.703 . . . . 63.68 110.263 173.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 474' ' ' ILE . . . . . . . . . . . . . 28.8 mm -66.14 -37.09 78.99 Favored 'Isoleucine or valine' 0 C--O 1.242 0.707 0 C-N-CA 118.542 -1.263 . . . . 44.73 109.873 178.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 475' ' ' ARG . . . . . 0.461 ' NH1' ' OE2' ' D' ' 472' ' ' GLU . 11.1 mtt85 -62.65 -46.8 86.53 Favored 'General case' 0 C--O 1.174 -2.893 0 CA-C-O 117.169 -1.396 . . . . 91.53 107.755 178.831 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 476' ' ' ARG . . . . . . . . . . . . . 42.1 ttt180 -57.29 -51.11 70.69 Favored 'General case' 0 C--O 1.185 -2.33 0 CA-C-O 117.148 -1.406 . . . . 82.37 108.672 176.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 40.6 t -57.99 -48.11 80.99 Favored 'General case' 0 C--O 1.154 -3.969 0 CA-C-N 120.32 1.418 . . . . 43.87 109.969 179.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 478' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -61.11 -35.26 76.54 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 119.956 1.253 . . . . 49.27 110.382 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . . . -67.3 -50.99 58.05 Favored 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 121.867 -0.521 . . . . 47.8 110.766 -179.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 480' ' ' ILE . . . . . . . . . . . . . 46.0 mt -50.93 -36.43 15.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 C-N-CA 120.386 -0.526 . . . . 59.05 110.465 174.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 481' ' ' LEU . . . . . 0.43 ' O ' ' HE2' ' B' ' 168' ' ' LYS . 39.2 mt -80.52 -36.86 32.64 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 117.735 -1.586 . . . . 54.98 112.689 -172.821 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 482' ' ' ASP . . . . . . . . . . . . . . . -62.28 -16.36 53.36 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 119.79 -0.764 . . . . 70.61 111.47 -175.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 483' ' ' SER . . . . . . . . . . . . . 59.9 p -88.55 50.95 2.06 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 122.797 1.284 . . . . 75.46 110.829 173.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 484' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.384 0 CA-C-N 115.627 -0.715 . . . . 83.68 109.393 179.353 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . 0.431 ' O ' ' ND2' ' A' ' 183' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.827 0 CA-C-O 119.711 -0.185 . . . . 74.319999999999993 111.255 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' LEU . . . . . . . . . . . . . 29.0 tp -65.07 -39.03 92.66 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 119.728 -0.789 . . . . 78.840000000000003 110.351 170.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 27.3 mp0 -54.97 -39.71 69.25 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.31 -0.556 . . . . 79.719999999999999 110.483 168.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . -60.96 -46.94 93.56 Favored Glycine 0 C--N 1.337 0.601 0 C-N-CA 120.191 -1.004 . . . . 54.350000000000001 112.484 179.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' GLU . . . . . 0.483 ' HG2' HG23 ' C' ' 484' ' ' ILE . 80.8 mt-10 -59.6 -47.05 87.07 Favored 'General case' 0 C--O 1.235 0.308 0 O-C-N 122.159 -0.612 . . . . 91.049999999999997 111.188 179.777 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 36.4 t -54.44 -44.78 68.67 Favored 'Isoleucine or valine' 0 C--O 1.244 0.812 0 CA-C-O 121.625 0.726 . . . . 47.960000000000001 109.979 175.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -60.69 -39.83 89.95 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.28 -0.568 . . . . 76.709999999999994 110.979 179.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 22.0 mttt -64.74 -43.06 94.59 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.798 0.295 . . . . 86.310000000000002 111.798 178.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' ILE . . . . . . . . . . . . . 86.9 mt -60.52 -41.25 87.05 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 O-C-N 122.008 -0.432 . . . . 44.43 109.985 178.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' LYS . . . . . . . . . . . . . 78.8 tttt -59.57 -44.05 93.42 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 119.992 -0.683 . . . . 122.58 111.322 175.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 38.8 m -65.75 -40.3 91.96 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 118.031 -1.467 . . . . 54.880000000000003 110.568 179.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -63.83 -41.03 97.94 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 120.417 -0.513 . . . . 32.149999999999999 111.183 -179.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' LEU . . . . . . . . . . . . . 21.7 tp -67.35 -40.34 85.83 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 119.6 -0.84 . . . . 38.619999999999997 111.225 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 67.7 mt -58.59 -35.56 72.61 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 118.712 -1.195 . . . . 44.719999999999999 110.141 175.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 50.3 m -70.54 -38.67 74.22 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 118.962 -1.095 . . . . 44.060000000000002 111.449 177.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 76.7 m -59.86 -43.74 94.53 Favored 'General case' 0 C--O 1.25 1.111 0 C-N-CA 119.498 -0.881 . . . . 32.710000000000001 111.997 173.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -57.12 -39.56 75.38 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-N 118.153 0.433 . . . . 31.73 110.759 178.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' LYS . . . . . 0.456 ' HD3' ' CZ2' ' C' ' 473' ' ' TRP . 59.1 mttt -68.92 -32.35 71.9 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 120.696 0.284 . . . . 94.420000000000002 111.568 178.639 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' ALA . . . . . . . . . . . . . . . -62.46 -41.77 98.99 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 119.773 -0.771 . . . . 27.34 111.557 171.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 38.2 t -67.22 -43.41 88.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 119.591 -0.844 . . . . 30.210000000000001 110.149 -177.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 54.5 t -57.9 -48.83 82.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.886 0.85 . . . . 34.229999999999997 111.331 179.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' SER . . . . . . . . . . . . . 53.6 p -68.69 -28.99 67.34 Favored 'General case' 0 C--N 1.317 -0.847 0 C-N-CA 118.442 -1.303 . . . . 53.289999999999999 111.535 -177.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' LEU . . . . . . . . . . . . . 40.7 tp -68.62 -41.42 79.53 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 120.988 -1.07 . . . . 36.140000000000001 109.833 175.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' SER . . . . . . . . . . . . . 14.9 t -54.61 -44.28 72.97 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 123.136 0.574 . . . . 47.700000000000003 111.445 171.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' ASN . . . . . 0.431 ' ND2' ' O ' ' A' ' 301' ' ' HOH . 88.4 m-20 -66.26 -34.63 78.44 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 117.912 -1.515 . . . . 46.810000000000002 110.229 179.182 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' GLY . . . . . . . . . . . . . . . -56.89 -46.72 90.3 Favored Glycine 0 C--N 1.334 0.463 0 C-N-CA 119.873 -1.156 . . . . 31.890000000000001 113.225 171.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' VAL . . . . . . . . . . . . . 65.3 t -67.68 -33.29 60.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 C-N-CA 119.979 -0.688 . . . . 32.969999999999999 111.303 -176.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' SER . . . . . . . . . . . . . . . -66.57 -43.02 86.12 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.858 -0.526 . . . . 40.32 111.617 178.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' VAL . . . . . . . . . . . . . 54.9 t -59.03 -50.01 81.24 Favored 'Isoleucine or valine' 0 C--N 1.345 0.37 0 CA-C-O 121.769 0.795 . . . . 41.07 109.987 175.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 58.4 tp -60.15 -39.57 86.83 Favored 'General case' 0 C--O 1.241 0.634 0 O-C-N 121.613 -0.68 . . . . 43.950000000000003 111.097 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' THR . . . . . . . . . . . . . 72.4 m -59.71 -44.25 93.8 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 119.401 -0.919 . . . . 45.380000000000003 110.647 177.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' SER . . . . . . . . . . . . . 5.9 m -57.81 -43.77 85.91 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-O 121.152 0.501 . . . . 61.659999999999997 111.325 177.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -66.06 -34.06 77.22 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.118 -0.633 . . . . 111.31999999999999 111.447 179.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 19.4 t -67.19 -37.79 79.86 Favored 'Isoleucine or valine' 0 C--O 1.243 0.712 0 C-N-CA 118.627 -1.229 . . . . 53.57 109.968 -179.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 82.9 mt -74.6 -35.96 62.98 Favored 'General case' 0 C--O 1.233 0.23 0 O-C-N 121.989 -0.445 . . . . 71.359999999999999 111.29 179.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -56.63 -28.16 59.95 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 119.336 -0.946 . . . . 79.549999999999997 110.352 171.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' LEU . . . . . . . . . . . . . 3.5 tp -83.74 -36.16 23.85 Favored 'General case' 0 C--N 1.341 0.214 0 N-CA-C 112.047 0.388 . . . . 92.510000000000005 112.047 -173.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' LYS . . . . . . . . . . . . . 5.3 tttp -62.33 -42.61 99.52 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 119.052 -1.059 . . . . 89.409999999999997 110.61 170.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' ASN . . . . . . . . . . . . . 61.8 m-20 -57.87 -45.29 86.54 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.38 0.609 . . . . 95.829999999999998 110.708 176.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -59.15 -42.94 91.9 Favored 'General case' 0 C--O 1.203 -1.366 0 N-CA-C 107.02 -1.474 . . . . 150.36000000000001 107.02 176.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 199' ' ' ILE . . . . . . . . . . . . . . . -63.17 -58.36 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 N-CA-C 107.446 -1.316 . . . . 107.28 107.446 -179.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -48.51 -51.71 26.04 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.47 1.108 . . . . 106.95 111.692 179.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.965 0 N-CA-C 108.712 -0.847 . . . . 97.489999999999995 108.712 179.136 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 158' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.008 . . . . . . . . 81.709999999999994 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 159' ' ' HIS . . . . . 0.402 ' O ' ' N ' ' B' ' 162' ' ' GLY . . . -74.12 -66.32 0.73 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.387 1.075 . . . . 80.150000000000006 110.701 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 160' ' ' LEU . . . . . . . . . . . . . . . -50.51 -32.22 17.66 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 119.6 -0.84 . . . . 75.489999999999995 112.15 178.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 161' ' ' GLU . . . . . . . . . . . . . . . -69.52 -37.29 77.06 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 119.64 -0.824 . . . . 69.239999999999995 110.775 173.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 162' ' ' GLY . . . . . 0.402 ' N ' ' O ' ' B' ' 159' ' ' HIS . . . -60.63 -37.12 92.92 Favored Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 119.632 -1.27 . . . . 61.920000000000002 111.788 178.506 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 163' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -66.26 -48.48 70.35 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 122.532 0.333 . . . . 110.11 110.822 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 164' ' ' VAL . . . . . . . . . . . . . 55.0 t -56.08 -38.56 53.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 C-N-CA 119.792 -0.763 . . . . 69.640000000000001 110.523 174.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 165' ' ' ASN . . . . . . . . . . . . . . . -66.05 -36.27 82.78 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 119.727 -0.789 . . . . 60.07 110.969 174.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 166' ' ' LYS . . . . . . . . . . . . . . . -66.35 -40.09 89.59 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.505 -0.878 . . . . 65.310000000000002 110.927 176.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 167' ' ' ILE . . . . . . . . . . . . . 3.5 mm -62.66 -49.38 83.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 120.036 -0.666 . . . . 60.960000000000001 109.898 177.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 168' ' ' LYS . . . . . 0.43 ' HE2' ' O ' ' D' ' 481' ' ' LEU . 25.4 tttm -53.59 -41.2 66.32 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 121.966 -0.458 . . . . 75.159999999999997 110.99 179.796 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 169' ' ' SER . . . . . . . . . . . . . 3.6 m -69.77 -37.43 76.39 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.085 -0.646 . . . . 72.150000000000006 111.174 178.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 170' ' ' ALA . . . . . . . . . . . . . . . -64.67 -37.43 87.56 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 118.611 -1.236 . . . . 36.649999999999999 109.753 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 10.1 tp -73.09 -38.65 66.31 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 119.6 -0.84 . . . . 42.420000000000002 112.1 -175.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 54.9 mt -61.29 -31.4 71.23 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 120.348 -0.541 . . . . 54.780000000000001 111.641 176.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 23.1 m -73.37 -44.13 59.26 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 120.528 -0.469 . . . . 48.130000000000003 111.509 176.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 174' ' ' THR . . . . . . . . . . . . . 35.7 m -55.45 -44.68 76.6 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 108.885 -0.783 . . . . 32.950000000000003 108.885 174.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 175' ' ' ASN . . . . . . . . . . . . . 33.8 m-20 -58.38 -40.76 83.19 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.14 -0.482 . . . . 37.719999999999999 111.259 -179.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 176' ' ' LYS . . . . . . . . . . . . . . . -67.28 -36.66 82.02 Favored 'General case' 0 C--N 1.348 0.52 0 C-N-CA 120.312 -0.555 . . . . 50.630000000000003 110.849 176.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 177' ' ' ALA . . . . . . . . . . . . . . . -55.13 -40.41 70.5 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.03 -0.668 . . . . 42.93 111.932 170.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 178' ' ' VAL . . . . . . . . . . . . . 75.5 t -68.65 -41.96 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 118.736 -1.186 . . . . 31.449999999999999 110.868 -177.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 179' ' ' VAL . . . . . . . . . . . . . 44.2 t -60.66 -47.05 94.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 O-C-N 122.085 -0.384 . . . . 42.07 110.75 178.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 55.7 m -59.21 -46.17 89.17 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 119.244 -0.983 . . . . 55.590000000000003 112.43 178.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 67.9 tp -58.93 -44.81 91.43 Favored 'General case' 0 CA--C 1.518 -0.277 0 O-C-N 121.356 -0.84 . . . . 40.840000000000003 111.221 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 182' ' ' SER . . . . . . . . . . . . . 2.2 p -68.28 -30.96 70.09 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 118.917 -1.113 . . . . 56.520000000000003 110.607 -175.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 183' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -62.86 -43.46 98.74 Favored 'General case' 0 C--N 1.345 0.392 0 C-N-CA 119.847 -0.741 . . . . 52.530000000000001 110.635 169.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 184' ' ' GLY . . . . . . . . . . . . . . . -57.27 -42.98 93.77 Favored Glycine 0 C--O 1.222 -0.599 0 C-N-CA 120.011 -1.09 . . . . 33.509999999999998 113.214 175.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 185' ' ' VAL . . . . . . . . . . . . . 94.0 t -66.52 -37.29 79.27 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 C-N-CA 118.516 -1.274 . . . . 34.560000000000002 111.574 179.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 186' ' ' SER . . . . . . . . . . . . . 63.5 m -64.4 -49.75 70.32 Favored 'General case' 0 C--O 1.237 0.427 0 O-C-N 120.917 -1.115 . . . . 52.479999999999997 111.334 -179.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 187' ' ' VAL . . . . . . . . . . . . . 90.9 t -48.65 -50.91 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 C-N-CA 120.216 -0.594 . . . . 48.520000000000003 109.918 171.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 188' ' ' LEU . . . . . . . . . . . . . 57.5 tp -61.0 -39.91 91.52 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 119.314 -0.954 . . . . 47.149999999999999 111.754 -176.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 189' ' ' THR . . . . . . . . . . . . . 73.8 m -60.83 -45.84 92.89 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 121.039 0.447 . . . . 45.009999999999998 110.204 178.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 190' ' ' SER . . . . . . . . . . . . . 48.9 m -57.93 -40.85 81.45 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.463 -0.335 . . . . 65.730000000000004 111.604 174.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 191' ' ' LYS . . . . . . . . . . . . . . . -66.63 -38.72 87.49 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 119.781 -0.768 . . . . 66.359999999999999 110.455 -178.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 192' ' ' VAL . . . . . . . . . . . . . 11.2 t -59.19 -39.0 77.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 CA-C-N 116.693 -0.231 . . . . 62.649999999999999 110.619 -179.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . . . -75.32 -28.42 59.66 Favored 'General case' 0 C--O 1.239 0.521 0 O-C-N 121.715 -0.616 . . . . 73.609999999999999 112.14 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 194' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -61.83 -40.13 94.22 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 119.758 -0.777 . . . . 83.709999999999994 110.453 170.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 195' ' ' LEU . . . . . . . . . . . . . . . -67.09 -30.64 70.72 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 120.052 -0.659 . . . . 77.25 111.686 -178.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . . . -50.65 -49.31 57.32 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 118.911 -1.116 . . . . 96.709999999999994 109.656 168.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 197' ' ' ASN . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.381 0 CA-C-O 121.441 0.639 . . . . 88.790000000000006 111.595 168.53 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 451' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.674 0 N-CA-C 109.968 -0.382 . . . . 124.15000000000001 109.968 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 452' ' ' ASP . . . . . 0.514 ' OD1' ' NZ ' ' D' ' 464' ' ' LYS . 38.9 t0 -136.82 69.3 58.62 Favored Pre-proline 0 C--O 1.241 0.628 0 N-CA-C 106.85 -1.537 . . . . 100.14 106.85 177.214 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 453' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -54.46 -24.51 36.06 Favored 'Trans proline' 0 C--O 1.174 -2.698 0 N-CA-C 117.858 2.215 . . . . 80.0 117.858 -174.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 454' ' ' ILE . . . . . . . . . . . . . 65.0 mt -75.78 -41.01 39.99 Favored 'Isoleucine or valine' 0 C--O 1.164 -3.415 0 CA-C-N 119.83 1.195 . . . . 68.180000000000007 112.555 -177.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 455' ' ' ASP . . . . . 0.429 ' O ' ' OD1' ' C' ' 455' ' ' ASP . 65.4 t0 -77.11 -28.93 54.56 Favored 'General case' 0 C--O 1.177 -2.73 0 C-N-CA 120.158 -0.617 . . . . 146.75999999999999 112.205 -178.378 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 456' ' ' ILE . . . . . . . . . . . . . . . -73.24 -39.49 56.19 Favored 'Isoleucine or valine' 0 C--O 1.168 -3.221 0 N-CA-C 108.406 -0.961 . . . . 70.730000000000004 108.406 176.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 457' ' ' SER . . . . . . . . . . . . . 16.4 t -60.6 -43.19 97.68 Favored 'General case' 0 C--N 1.311 -1.091 0 C-N-CA 121.279 -0.168 . . . . 64.459999999999994 110.68 -178.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 458' ' ' ILE . . . . . . . . . . . . . 75.9 mt -70.41 -47.13 67.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 C-N-CA 119.805 -0.758 . . . . 79.810000000000002 110.648 -172.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 459' ' ' VAL . . . . . . . . . . . . . 60.3 t -59.65 -49.89 82.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 O-C-N 121.927 -0.483 . . . . 66.879999999999995 110.79 174.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 460' ' ' LEU . . . . . . . . . . . . . . . -58.61 -40.33 82.97 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 119.781 -0.768 . . . . 58.030000000000001 110.928 -176.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 461' ' ' ASN . . . . . . . . . . . . . 61.3 m-20 -72.62 -37.05 68.17 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 119.942 -0.703 . . . . 71.659999999999997 111.493 -177.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 462' ' ' LYS . . . . . . . . . . . . . . . -61.29 -52.07 66.26 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 116.851 -1.939 . . . . 46.880000000000003 109.095 175.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 463' ' ' ILE . . . . . . . . . . . . . 85.5 mt -64.89 -48.08 85.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 O-C-N 121.455 -0.778 . . . . 47.359999999999999 110.874 -176.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 464' ' ' LYS . . . . . . . . . . . . . 18.3 tttm -60.75 -32.1 71.41 Favored 'General case' 0 C--O 1.242 0.662 0 C-N-CA 119.143 -1.023 . . . . 150.44 111.313 -176.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 465' ' ' SER . . . . . . . . . . . . . 53.8 p -73.69 -25.39 60.21 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 117.708 -1.597 . . . . 55.340000000000003 110.656 -176.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 466' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -74.77 -43.2 56.1 Favored 'General case' 0 C--O 1.177 -2.728 0 CA-C-O 118.02 -0.991 . . . . 62.979999999999997 108.794 176.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 467' ' ' LEU . . . . . . . . . . . . . 56.6 mt -69.67 -36.8 76.33 Favored 'General case' 0 C--O 1.188 -2.172 0 CA-C-N 119.336 0.971 . . . . 47.289999999999999 109.184 -177.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 468' ' ' GLU . . . . . . . . . . . . . 25.9 tp10 -69.85 -39.77 76.2 Favored 'General case' 0 C--O 1.185 -2.312 0 CA-C-O 117.465 -1.255 . . . . 71.629999999999995 107.859 -179.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 469' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -63.83 -40.35 96.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 118.721 0.691 . . . . 57.75 110.965 175.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 470' ' ' SER . . . . . . . . . . . . . 44.0 t -61.17 -39.57 90.64 Favored 'General case' 0 C--O 1.232 0.182 0 O-C-N 121.482 -0.761 . . . . 40.859999999999999 110.192 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 471' ' ' LYS . . . . . . . . . . . . . . . -72.31 -29.48 63.89 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 118.942 -1.103 . . . . 44.049999999999997 111.398 -176.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 472' ' ' GLU . . . . . 0.676 ' OE1' ' NH1' ' C' ' 475' ' ' ARG . 30.8 mm-40 -73.23 -37.33 66.43 Favored 'General case' 0 CA--C 1.512 -0.485 0 C-N-CA 119.189 -1.004 . . . . 65.810000000000002 110.933 179.207 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 473' ' ' TRP . . . . . 0.456 ' CZ2' ' HD3' ' A' ' 176' ' ' LYS . 61.5 m95 -61.8 -40.61 95.86 Favored 'General case' 0 C--N 1.349 0.586 0 C-N-CA 120.107 -0.637 . . . . 46.93 110.786 174.693 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 474' ' ' ILE . . . . . . . . . . . . . 27.7 mm -61.24 -44.41 98.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 C-N-CA 119.452 -0.899 . . . . 36.979999999999997 109.842 175.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 475' ' ' ARG . . . . . 0.676 ' NH1' ' OE1' ' C' ' 472' ' ' GLU . 49.4 mtt85 -62.67 -39.0 92.57 Favored 'General case' 0 CA--C 1.504 -0.813 0 C-N-CA 119.365 -0.934 . . . . 66.159999999999997 108.961 -177.004 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 476' ' ' ARG . . . . . . . . . . . . . . . -59.74 -44.11 93.92 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.366 -0.379 . . . . 37.270000000000003 110.952 173.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 477' ' ' SER . . . . . . . . . . . . . 45.7 t -65.17 -45.88 83.08 Favored 'General case' 0 C--N 1.346 0.421 0 C-N-CA 119.658 -0.817 . . . . 29.399999999999999 110.853 -177.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 478' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -59.62 -43.75 93.69 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 120.36 -0.536 . . . . 41.460000000000001 111.754 175.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 479' ' ' LYS . . . . . . . . . . . . . . . -59.36 -45.13 92.27 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 119.394 -0.923 . . . . 58.329999999999998 110.655 -178.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 480' ' ' ILE . . . . . . . . . . . . . 92.1 mt -64.21 -39.06 84.16 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.65 0 CA-C-O 121.478 0.656 . . . . 52.450000000000003 109.449 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 481' ' ' LEU . . . . . . . . . . . . . 59.2 mt -69.47 -19.7 63.75 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 118.152 -1.419 . . . . 51.880000000000003 111.884 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 482' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -79.81 -9.44 59.66 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 117.911 -1.516 . . . . 70.359999999999999 112.157 176.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 483' ' ' SER . . . . . . . . . . . . . 15.2 p -92.16 25.9 2.72 Favored 'General case' 0 C--O 1.24 0.582 0 C-N-CA 123.494 0.717 . . . . 88.430000000000007 112.452 175.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 484' ' ' ILE . . . . . 0.483 HG23 ' HG2' ' A' ' 163' ' ' GLU . 93.3 mt -117.8 -51.83 4.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.545 -0.539 . . . . 114.38 109.545 175.876 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 485' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 115.632 -0.713 . . . . 87.189999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 458' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 116.775 -1.583 . . . . 92.569999999999993 110.425 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 459' ' ' VAL . . . . . . . . . . . . . . . -75.88 -22.72 16.05 Favored 'Isoleucine or valine' 0 C--O 1.184 -2.351 0 N-CA-C 108.197 -1.038 . . . . 80.640000000000001 108.197 -178.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 460' ' ' LEU . . . . . . . . . . . . . . . -69.64 -41.67 75.28 Favored 'General case' 0 C--O 1.2 -1.509 0 N-CA-C 107.196 -1.409 . . . . 67.730000000000004 107.196 177.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 461' ' ' ASN . . . . . . . . . . . . . . . -64.24 -41.64 96.9 Favored 'General case' 0 C--O 1.181 -2.549 0 CA-C-O 117.084 -1.436 . . . . 68.890000000000001 109.518 -178.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 462' ' ' LYS . . . . . . . . . . . . . . . -65.92 -40.81 91.78 Favored 'General case' 0 C--O 1.193 -1.918 0 C-N-CA 124.614 1.165 . . . . 61.009999999999998 109.057 -179.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 463' ' ' ILE . . . . . . . . . . . . . 23.3 mt -67.25 -39.47 82.99 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.33 0 N-CA-C 106.08 -1.822 . . . . 56.950000000000003 106.08 177.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 464' ' ' LYS . . . . . 0.514 ' NZ ' ' OD1' ' C' ' 452' ' ' ASP . 72.2 tttt -68.77 -23.95 64.37 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 123.988 0.805 . . . . 79.700000000000003 111.102 -176.748 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 465' ' ' SER . . . . . . . . . . . . . . . -69.5 -46.82 65.7 Favored 'General case' 0 C--O 1.19 -2.061 0 C-N-CA 123.791 0.837 . . . . 50.880000000000003 108.78 179.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 466' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -63.22 -38.55 91.6 Favored 'General case' 0 C--O 1.169 -3.147 0 C-N-CA 126.089 1.756 . . . . 80.879999999999995 110.988 179.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 467' ' ' LEU . . . . . . . . . . . . . 40.2 mt -73.26 -34.72 65.98 Favored 'General case' 0 C--O 1.188 -2.146 0 CA-C-O 117.889 -1.053 . . . . 51.189999999999998 108.462 -179.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 468' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -72.57 -39.53 67.34 Favored 'General case' 0 C--N 1.322 -0.62 0 O-C-N 123.826 0.704 . . . . 132.12 110.61 179.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 469' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -58.31 -43.74 88.25 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.182 -0.607 . . . . 75.040000000000006 109.744 171.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 470' ' ' SER . . . . . . . . . . . . . 7.3 t -55.34 -51.73 65.82 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 121.584 0.707 . . . . 43.439999999999998 110.249 178.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 471' ' ' LYS . . . . . . . . . . . . . 8.9 mttt -61.03 -32.11 71.73 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 116.078 -0.51 . . . . 73.829999999999998 111.471 -176.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 472' ' ' GLU . . . . . 0.461 ' OE2' ' NH1' ' D' ' 475' ' ' ARG . 18.6 tp10 -72.46 -42.59 64.81 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 111.654 0.242 . . . . 89.829999999999998 111.654 -178.84 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 473' ' ' TRP . . . . . . . . . . . . . 70.2 m95 -57.99 -39.5 78.4 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 119.942 -0.703 . . . . 63.68 110.263 173.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 474' ' ' ILE . . . . . . . . . . . . . 28.8 mm -66.14 -37.09 78.99 Favored 'Isoleucine or valine' 0 C--O 1.242 0.707 0 C-N-CA 118.542 -1.263 . . . . 44.729999999999997 109.873 178.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 475' ' ' ARG . . . . . 0.461 ' NH1' ' OE2' ' D' ' 472' ' ' GLU . 11.1 mtt85 -62.65 -46.8 86.53 Favored 'General case' 0 C--O 1.174 -2.893 0 CA-C-O 117.169 -1.396 . . . . 91.530000000000001 107.755 178.831 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 476' ' ' ARG . . . . . . . . . . . . . 42.1 ttt180 -57.29 -51.11 70.69 Favored 'General case' 0 C--O 1.185 -2.33 0 CA-C-O 117.148 -1.406 . . . . 82.370000000000005 108.672 176.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 477' ' ' SER . . . . . . . . . . . . . 40.6 t -57.99 -48.11 80.99 Favored 'General case' 0 C--O 1.154 -3.969 0 CA-C-N 120.32 1.418 . . . . 43.869999999999997 109.969 179.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 478' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -61.11 -35.26 76.54 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 119.956 1.253 . . . . 49.270000000000003 110.382 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 479' ' ' LYS . . . . . . . . . . . . . . . -67.3 -50.99 58.05 Favored 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 121.867 -0.521 . . . . 47.799999999999997 110.766 -179.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 480' ' ' ILE . . . . . . . . . . . . . 46.0 mt -50.93 -36.43 15.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 C-N-CA 120.386 -0.526 . . . . 59.049999999999997 110.465 174.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 481' ' ' LEU . . . . . 0.43 ' O ' ' HE2' ' B' ' 168' ' ' LYS . 39.2 mt -80.52 -36.86 32.64 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 117.735 -1.586 . . . . 54.979999999999997 112.689 -172.821 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 482' ' ' ASP . . . . . . . . . . . . . . . -62.28 -16.36 53.36 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 119.79 -0.764 . . . . 70.609999999999999 111.47 -175.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 483' ' ' SER . . . . . . . . . . . . . 59.9 p -88.55 50.95 2.06 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 122.797 1.284 . . . . 75.459999999999994 110.829 173.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 484' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.384 0 CA-C-N 115.627 -0.715 . . . . 83.680000000000007 109.393 179.353 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . 0.431 ' O ' ' ND2' ' A' ' 183' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_