data_6uhs_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 6uhs _Structure_validation_residue.Date_analyzed 2020-09-11 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 ' 8' ' ' TYR . . . . . . . . . . . . . 20.6 t80 . . . . . 0 N--CA 1.461 0.121 0 CA-C-O 121.022 0.439 . . . . 77.08 111.017 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 43.1 mm -116.6 107.11 47.24 Favored Pre-proline 0 C--O 1.238 0.49 0 N-CA-C 108.235 -1.024 . . . . 81.22 108.235 177.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -67.9 138.73 45.31 Favored 'Trans proline' 0 C--N 1.331 -0.388 0 CA-C-N 119.05 0.696 . . . . 62.67 111.268 -178.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -124.05 84.63 55.02 Favored Pre-proline 0 C--O 1.239 0.514 0 CA-C-N 115.724 -0.671 . . . . 87.94 109.743 179.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -70.86 154.33 63.43 Favored 'Trans proline' 0 C--N 1.328 -0.541 0 CA-C-O 121.782 0.659 . . . . 50.41 111.508 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' MSE . . . . . . . . . . . . . 41.5 mtp -56.97 139.83 50.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.916 -1.038 . . . . 27.74 110.683 174.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -88.49 105.83 17.88 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.426 -0.953 . . . . 48.13 108.426 179.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 15.8 mt -94.51 2.23 55.7 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 123.476 0.71 . . . . 39.02 112.596 -179.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 91.8 p -65.19 -18.57 65.42 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 113.39 0.885 . . . . 43.48 113.39 -170.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 26.4 mt -104.53 -9.82 18.06 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.812 1.042 . . . . 50.0 113.812 -177.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 1.3 m -82.55 136.74 22.3 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-N 118.871 0.76 . . . . 46.77 108.996 178.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -120.07 128.56 53.6 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.69 -0.856 . . . . 74.25 108.69 -172.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 19.9 mt -96.44 127.66 39.2 Favored Pre-proline 0 C--O 1.24 0.603 0 C-N-CA 117.848 -1.541 . . . . 59.06 110.829 -173.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.67 168.18 25.43 Favored 'Trans proline' 0 C--N 1.331 -0.389 0 CA-C-O 122.053 0.772 . . . . 44.54 110.678 175.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.4 tp10 -56.21 -38.49 71.08 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 114.849 -1.069 . . . . 82.23 112.254 -171.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.9 p -64.73 -33.44 75.97 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.171 -0.612 . . . . 41.27 111.951 -177.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 54.6 mt -83.35 -29.5 28.19 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.125 -0.63 . . . . 35.24 111.738 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 53.5 mt -60.69 -44.12 96.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 CA-C-O 121.105 0.478 . . . . 53.96 110.057 171.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -68.23 -42.42 79.78 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 122.029 -0.419 . . . . 71.83 111.289 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 37.3 tp -55.02 -43.24 73.51 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.784 -0.366 . . . . 35.16 110.847 171.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.6 t -59.96 -34.9 73.9 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.846 -0.342 . . . . 65.6 111.502 178.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -79.54 -30.63 41.82 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.251 -0.58 . . . . 76.86 112.188 -177.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.2 mtp180 -73.91 -27.91 61.28 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.244 -0.982 . . . . 64.6 111.513 175.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 80.7 mt -66.85 -51.52 54.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 C-N-CA 120.342 -0.543 . . . . 43.87 110.216 172.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.14 -37.63 72.3 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.748 -0.381 . . . . 36.59 111.158 178.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -63.07 -43.1 99.53 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.848 -0.341 . . . . 74.12 111.434 176.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 25.8 t30 -70.93 -33.0 70.09 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.378 -0.529 . . . . 42.74 112.106 -177.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.5 m -71.6 -23.59 22.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 119.297 -0.961 . . . . 42.25 110.879 178.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 -69.34 -40.52 77.51 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.832 -0.747 . . . . 53.8 110.598 171.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -67.77 -41.71 82.85 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.805 -0.358 . . . . 58.05 111.177 179.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.7 t -54.76 -42.55 62.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 CA-C-O 121.133 0.492 . . . . 40.63 110.008 173.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' TRP . . . . . . . . . . . . . 67.2 t90 -68.48 -37.33 80.03 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.597 -0.441 . . . . 49.38 111.542 -177.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.66 -45.21 60.07 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 122.208 -0.307 . . . . 46.74 111.608 -176.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.6 mmtt -57.64 -46.9 83.57 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.638 -0.425 . . . . 67.07 110.706 174.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -52.54 -48.41 66.12 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.474 -0.33 . . . . 49.22 111.64 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -87.2 -31.97 20.05 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 112.821 0.674 . . . . 73.54 112.821 -171.79 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 64.3 mt -63.25 -37.07 78.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 119.901 -0.72 . . . . 66.55 110.175 175.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -70.57 -27.74 64.36 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.14 -0.624 . . . . 69.48 111.555 175.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -71.18 -0.06 8.93 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 112.835 0.68 . . . . 82.89 112.835 171.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.97 34.8 8.03 Favored Glycine 0 N--CA 1.446 -0.641 0 N-CA-C 115.335 0.894 . . . . 74.73 115.335 -178.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 33.2 m95 -102.85 156.24 17.79 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 118.375 1.087 . . . . 69.89 110.429 176.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.6 p -143.92 164.17 31.33 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.09 -0.959 . . . . 84.68 108.983 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -73.28 138.6 45.59 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.333 -0.849 . . . . 108.8 110.734 178.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -151.64 155.29 26.06 Favored Glycine 0 N--CA 1.451 -0.358 0 N-CA-C 107.727 -2.149 . . . . 96.79 107.727 167.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -65.01 -44.4 89.37 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 118.853 -1.139 . . . . 133.13 111.219 -172.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 26.9 tttt -107.25 156.98 18.28 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.893 0.854 . . . . 114.32 109.811 172.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.6 ttt85 -96.52 124.93 40.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.044 -0.98 . . . . 96.8 110.075 -167.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -121.19 120.76 36.15 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.128 -1.064 . . . . 103.45 108.128 175.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -84.64 -13.6 51.07 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 113.462 0.912 . . . . 90.83 113.462 -170.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.1 pt -105.63 -21.57 5.33 Favored 'Isoleucine or valine' 0 C--O 1.241 0.638 0 N-CA-C 112.626 0.602 . . . . 103.74 112.626 176.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 42.8 m170 -101.09 5.8 43.03 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 118.889 0.768 . . . . 107.81 111.889 172.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.8 mttt 58.86 56.36 4.12 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 122.246 1.022 . . . . 84.6 111.439 168.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -122.47 150.91 41.86 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 114.597 -1.183 . . . . 91.52 108.809 171.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 54.5 t-80 -167.44 137.96 2.38 Favored Pre-proline 0 C--O 1.238 0.458 0 N-CA-C 108.825 -0.806 . . . . 67.06 108.825 -174.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -85.02 -15.88 5.42 Favored 'Trans proline' 0 C--O 1.234 0.315 0 N-CA-C 115.768 1.411 . . . . 72.9 115.768 -170.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 57.5 m -84.52 9.47 13.46 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.597 0.591 . . . . 56.44 112.597 -179.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 11.1 mp -81.41 67.86 7.52 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 122.855 1.312 . . . . 64.69 108.69 178.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 64.9 t -142.77 152.18 58.63 Favored Pre-proline 0 C--O 1.247 0.93 0 CA-C-N 114.416 -1.266 . . . . 62.73 109.089 -165.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -42.37 139.7 2.79 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 119.752 0.301 . . . . 59.46 111.666 166.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -55.8 -38.77 70.39 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.408 -0.517 . . . . 52.78 111.239 -174.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -66.03 -23.91 66.64 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 113.039 0.755 . . . . 84.65 113.039 -177.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -96.42 18.42 14.0 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 118.647 0.658 . . . . 89.96 112.388 178.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.3 mt -83.65 145.13 46.84 Favored Pre-proline 0 C--N 1.348 0.51 0 N-CA-C 109.751 -0.462 . . . . 58.26 109.751 169.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -66.14 151.57 83.35 Favored 'Trans proline' 0 C--N 1.33 -0.438 0 N-CA-C 110.293 -0.695 . . . . 66.46 110.293 172.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -65.54 -35.45 80.89 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.49 -0.777 . . . . 65.35 111.781 -172.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -63.89 -33.81 76.53 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.447 -0.901 . . . . 71.71 110.79 174.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -68.85 -15.53 63.52 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 112.61 0.596 . . . . 76.34 112.61 -179.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -95.32 -12.85 25.42 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 113.059 0.763 . . . . 52.84 113.059 179.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 77.7 mt-10 -63.65 -44.35 94.09 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 112.1 0.407 . . . . 66.59 112.1 -169.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -59.35 -47.03 86.95 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.124 -0.63 . . . . 65.84 111.508 -170.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -70.05 -37.63 75.6 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.129 -0.628 . . . . 48.16 111.135 -179.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 64.1 mtt180 -63.06 -41.96 99.59 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.457 -0.497 . . . . 66.75 111.466 179.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -70.62 -41.49 72.19 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.524 -0.47 . . . . 46.88 111.094 179.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 22.6 m -61.51 -47.08 87.25 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.526 -0.47 . . . . 37.71 110.999 177.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.45 -45.03 95.98 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.945 0.402 . . . . 33.29 110.916 178.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' MSE . . . . . . . . . . . . . 25.5 ttm -61.16 -40.93 95.73 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 123.163 0.585 . . . . 57.34 111.624 178.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -69.15 -35.72 76.65 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.235 -0.586 . . . . 40.86 111.342 -178.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 54.4 m -65.07 -40.85 95.27 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.297 -0.561 . . . . 34.71 111.016 175.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.1 mm -62.82 -39.78 86.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 CA-C-O 120.905 0.383 . . . . 28.98 110.137 177.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.5 mttt -65.24 -40.49 94.11 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.151 -0.62 . . . . 32.4 111.391 178.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' MSE . . . . . . . . . . . . . 35.7 mtt -56.98 -48.17 79.04 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.075 0.465 . . . . 44.83 110.257 175.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 50.2 t -58.86 -37.2 65.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 CA-C-N 115.484 -0.78 . . . . 24.85 110.15 178.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 8.8 mttt -72.08 -42.97 65.57 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.152 -0.619 . . . . 63.41 111.51 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.1 tttp -68.56 -21.0 64.57 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 119.812 -0.755 . . . . 56.4 112.338 -176.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LEU . . . . . 0.577 ' O ' ' NZ ' ' A' ' 212' ' ' LYS . 89.6 mt -81.9 -0.15 42.47 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.879 0.696 . . . . 56.42 112.879 174.07 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 87.53 39.16 7.31 Favored Glycine 0 C--O 1.239 0.419 0 N-CA-C 115.098 0.799 . . . . 49.0 115.098 175.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -112.62 136.1 52.57 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 117.687 0.744 . . . . 36.59 109.951 178.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ARG . . . . . 0.594 ' NH1' ' OE1' ' A' ' 97' ' ' GLU . 1.9 mtp-105 -83.77 139.44 32.71 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.821 -0.627 . . . . 77.8 109.619 171.902 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 23.0 mt -122.0 101.29 9.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 N-CA-C 106.35 -1.722 . . . . 36.37 106.35 174.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLU . . . . . 0.594 ' OE1' ' NH1' ' A' ' 95' ' ' ARG . 4.2 pt-20 -133.41 144.46 49.55 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.776 0.322 . . . . 85.71 110.881 -173.276 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 64.0 mttt -82.07 141.35 33.24 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 109.034 -0.728 . . . . 78.65 109.034 163.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 . . . . . 0 C--N 1.332 -0.182 0 C-N-CA 123.452 0.701 . . . . 86.63 111.932 3.001 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.533 0.322 0 CA-C-O 120.841 0.353 . . . . 82.59 111.375 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ASN . . . . . 0.415 ' OD1' ' N ' ' A' ' 120' ' ' LEU . 19.3 t-20 -73.89 161.47 30.11 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 124.017 0.927 . . . . 100.12 110.945 -176.684 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 8.1 ttmt -64.66 -44.68 89.63 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 115.186 -0.915 . . . . 83.17 111.537 -179.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' LEU . . . . . 0.415 ' N ' ' OD1' ' A' ' 118' ' ' ASN . 15.0 mt -73.38 -17.52 61.26 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 112.345 0.498 . . . . 95.51 112.345 -179.943 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -99.48 12.4 36.52 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 123.905 0.882 . . . . 105.21 112.679 -176.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -80.6 121.03 25.31 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 120.804 0.335 . . . . 66.83 110.825 -170.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 53.5 mt -124.79 116.09 26.41 Favored Pre-proline 0 C--O 1.24 0.598 0 N-CA-C 107.081 -1.451 . . . . 58.81 107.081 168.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.7 139.05 56.27 Favored 'Trans proline' 0 C--O 1.235 0.333 0 CA-C-N 119.832 0.976 . . . . 57.69 111.568 -177.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -124.91 74.1 65.29 Favored Pre-proline 0 C--O 1.235 0.33 0 CA-C-N 115.294 -0.866 . . . . 74.58 109.434 -177.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -70.73 146.22 53.57 Favored 'Trans proline' 0 C--O 1.234 0.321 0 CA-C-O 121.327 0.47 . . . . 38.04 111.471 177.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' MSE . . . . . . . . . . . . . 74.3 mtm -52.81 146.8 9.93 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.411 -0.813 . . . . 45.52 110.223 172.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -99.95 114.9 28.48 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 108.377 -0.971 . . . . 54.75 108.377 175.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 7.4 mt -101.36 10.15 40.87 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.06 -0.518 . . . . 32.37 112.315 -179.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 75.0 m -55.86 -37.08 68.3 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 111.853 0.316 . . . . 50.24 111.853 -175.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 34.5 mt -110.48 16.23 21.68 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 113.254 0.835 . . . . 35.21 113.254 -171.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 86.4 t -87.69 116.07 29.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 107.993 -1.114 . . . . 27.35 107.993 178.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ASP . . . . . 0.607 ' O ' ' NZ ' ' A' ' 204' ' ' LYS . 24.0 t70 -94.37 138.21 32.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.123 -0.489 . . . . 52.91 110.608 -177.556 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 22.1 mt -111.76 125.73 29.8 Favored Pre-proline 0 C--O 1.238 0.497 0 CA-C-N 115.955 -0.566 . . . . 29.36 110.462 179.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -62.84 158.48 42.53 Favored 'Trans proline' 0 C--N 1.331 -0.355 0 CA-C-O 121.837 0.682 . . . . 36.28 110.49 171.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -57.27 -37.39 72.3 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.039 -0.982 . . . . 64.04 111.642 -173.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 83.4 p -57.87 -41.33 82.24 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.887 -0.325 . . . . 43.56 111.365 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 48.1 mt -77.54 -24.55 49.88 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 112.737 0.643 . . . . 30.07 112.737 179.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 99.4 mt -67.55 -39.55 82.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 C-N-CA 120.266 -0.574 . . . . 29.76 110.057 175.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -72.01 -33.85 68.39 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 122.018 -0.426 . . . . 80.94 111.01 176.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' LEU . . . . . . . . . . . . . 34.4 tp -55.86 -47.37 77.42 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 120.635 -0.426 . . . . 31.58 110.139 171.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 31.2 m -54.94 -43.68 73.62 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.591 -0.277 . . . . 43.32 111.051 176.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -61.47 -40.59 95.07 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.743 -0.383 . . . . 62.1 110.925 178.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 46.7 tpt85 -65.82 -36.72 84.28 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 120.504 -0.478 . . . . 26.01 110.84 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 10.9 mm -64.35 -48.74 84.04 Favored 'Isoleucine or valine' 0 C--O 1.24 0.573 0 C-N-CA 120.449 -0.5 . . . . 27.16 110.154 177.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -56.87 -43.89 81.68 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 120.876 0.37 . . . . 26.56 111.108 -178.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -57.35 -49.92 74.63 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.782 0.325 . . . . 62.02 111.393 177.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -66.56 -36.58 83.0 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.081 -0.648 . . . . 29.28 111.658 -178.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.25 -45.87 97.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 C-N-CA 120.232 -0.587 . . . . 42.6 110.175 177.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -57.52 -32.54 67.16 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.114 -0.634 . . . . 54.04 111.435 171.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -71.43 -41.94 68.87 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.107 -0.637 . . . . 64.65 110.975 -179.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 73.9 t -61.78 -39.37 83.15 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-O 120.998 0.428 . . . . 40.72 110.209 176.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' TRP . . . . . . . . . . . . . 62.1 t90 -61.45 -48.79 79.52 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.395 -0.522 . . . . 67.73 111.047 178.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' ALA . . . . . 0.428 ' O ' ' N ' ' A' ' 158' ' ' ILE . . . -59.74 -57.34 13.32 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 120.748 -0.381 . . . . 70.78 111.209 -176.812 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -53.35 -48.1 68.82 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 121.022 -0.271 . . . . 58.84 111.612 -176.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -52.94 -47.81 67.8 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.877 0.37 . . . . 80.28 111.182 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -81.09 -38.29 27.55 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 119.767 -0.773 . . . . 99.99 111.66 -178.371 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' ILE . . . . . 0.428 ' N ' ' O ' ' A' ' 154' ' ' ALA . 9.8 mm -62.24 -28.93 45.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 120.65 -0.42 . . . . 85.84 110.831 173.79 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -68.49 -32.84 73.11 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.836 -0.746 . . . . 83.31 111.486 173.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -86.6 21.57 2.13 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.496 0.554 . . . . 101.22 112.496 176.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' GLY . . . . . . . . . . . . . . . 85.77 21.24 54.04 Favored Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 116.639 1.416 . . . . 107.34 116.639 169.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 48.2 m95 -83.83 166.68 17.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 118.823 1.311 . . . . 99.56 110.316 175.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' THR . . . . . . . . . . . . . 1.2 t -156.44 162.2 40.02 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.653 -0.703 . . . . 113.45 109.435 179.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 115.028 -0.987 . . . . 104.8 108.926 172.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? . . . . . 0 CA--C 1.522 -0.124 0 CA-C-O 121.32 0.581 . . . . 124.77 110.891 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -85.3 139.84 36.39 Favored Pre-proline 0 C--O 1.235 0.312 0 C-N-CA 129.527 3.131 . . . . 105.12 111.505 -163.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -91.71 -0.9 4.47 Favored 'Trans proline' 0 C--O 1.234 0.294 0 C-N-CA 121.149 1.233 . . . . 95.23 114.629 169.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' CYS . . . . . . . . . . . . . 10.3 m -84.26 -6.65 59.42 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 119.102 0.864 . . . . 77.52 112.564 173.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 84.8 mt -77.67 73.89 4.23 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 122.6 1.191 . . . . 71.55 107.857 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 2.0 t -137.35 158.28 72.55 Favored Pre-proline 0 C--O 1.241 0.653 0 CA-C-N 114.365 -1.289 . . . . 74.62 108.26 -178.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -47.11 137.33 17.54 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 N-CA-C 110.534 -0.602 . . . . 64.45 110.534 162.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -50.66 -39.54 51.08 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.721 -0.672 . . . . 62.91 109.864 178.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -56.18 -42.63 77.39 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.889 -0.324 . . . . 68.72 111.528 177.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -91.37 19.69 5.85 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.774 0.657 . . . . 84.69 112.774 -175.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 36.5 mt -79.59 152.24 75.17 Favored Pre-proline 0 C--N 1.326 -0.439 0 N-CA-C 109.775 -0.454 . . . . 61.98 109.775 168.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.97 141.33 36.51 Favored 'Trans proline' 0 C--O 1.235 0.345 0 N-CA-C 110.392 -0.657 . . . . 69.5 110.392 173.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -61.37 -9.53 5.55 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 113.081 0.771 . . . . 93.97 113.081 -176.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -65.92 -51.92 54.41 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 118.578 0.626 . . . . 121.99 110.9 172.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -75.77 -36.26 59.88 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 122.135 -0.353 . . . . 95.2 111.905 -178.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 7.6 mtpt -65.25 -26.06 67.94 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.442 0.534 . . . . 70.17 112.442 -179.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -72.58 -25.01 61.18 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 119.764 -0.775 . . . . 96.39 111.26 172.353 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -74.98 -51.68 13.05 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.554 -0.858 . . . . 70.96 111.339 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -58.69 -40.98 85.16 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.542 -0.463 . . . . 72.27 111.125 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 193' ' ' ARG . . . . . . . . . . . . . 4.4 ttt85 -67.4 -35.18 78.78 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 111.774 0.287 . . . . 75.38 111.774 -175.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -75.72 -24.5 56.17 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 112.53 0.567 . . . . 78.33 112.53 177.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' THR . . . . . . . . . . . . . 58.2 m -67.74 -47.73 68.45 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.13 -0.628 . . . . 40.67 110.809 172.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.97 -33.83 75.4 Favored 'General case' 0 C--O 1.24 0.57 0 O-C-N 122.169 -0.332 . . . . 28.92 111.533 178.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' MSE . . . . . . . . . . . . . 13.5 ttm -62.97 -38.25 90.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.044 0.449 . . . . 44.45 109.79 177.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -71.83 -33.73 68.71 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 119.99 -0.684 . . . . 34.13 111.78 -178.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 199' ' ' THR . . . . . . . . . . . . . 26.1 m -65.92 -43.44 88.12 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 119.854 -0.738 . . . . 25.19 111.21 174.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' ILE . . . . . . . . . . . . . 24.0 mm -61.69 -33.95 59.9 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 O-C-N 122.099 -0.376 . . . . 28.19 110.724 177.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -69.9 -37.48 76.0 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.074 -0.65 . . . . 34.41 111.566 176.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' MSE . . . . . . . . . . . . . 64.1 mtt -60.69 -40.8 93.52 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.508 -0.552 . . . . 71.94 109.508 177.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 73.1 t -62.68 -41.26 91.61 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 CA-C-N 116.062 -0.517 . . . . 37.19 110.493 178.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' LYS . . . . . 0.607 ' NZ ' ' O ' ' A' ' 133' ' ' ASP . 15.2 tttt -71.18 -44.93 64.49 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 119.978 -0.689 . . . . 55.91 111.154 -177.539 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' LYS . . . . . . . . . . . . . 42.2 tptt -62.02 -25.69 67.8 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 112.214 0.449 . . . . 52.08 112.214 175.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' LEU . . . . . . . . . . . . . 57.8 mt -84.76 13.53 5.7 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 112.71 0.633 . . . . 45.56 112.71 176.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 92.53 2.51 67.6 Favored Glycine 0 N--CA 1.447 -0.6 0 N-CA-C 116.307 1.283 . . . . 46.1 116.307 170.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -95.2 162.27 13.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 119.068 1.434 . . . . 42.67 111.577 -177.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' ARG . . . . . . . . . . . . . 5.5 ttp180 -126.17 131.69 51.96 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 114.536 -1.211 . . . . 72.94 108.437 -177.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' ILE . . . . . . . . . . . . . 9.0 mt -112.26 119.01 59.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 107.856 -1.164 . . . . 43.23 107.856 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -139.05 141.91 38.22 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.487 -0.56 . . . . 68.06 109.487 -176.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' LYS . . . . . 0.577 ' NZ ' ' O ' ' A' ' 92' ' ' LEU . 49.2 tptt -63.36 159.77 17.44 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.557 0.694 . . . . 59.18 110.423 178.287 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 . . . . . 0 N--CA 1.467 0.423 0 C-N-CA 124.076 0.95 . . . . 71.69 110.949 -176.08 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 20.6 t80 . . . . . 0 N--CA 1.461 0.121 0 CA-C-O 121.022 0.439 . . . . 77.08 111.017 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 43.1 mm -116.6 107.11 47.24 Favored Pre-proline 0 C--O 1.238 0.49 0 N-CA-C 108.235 -1.024 . . . . 81.22 108.235 177.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -67.9 138.73 45.31 Favored 'Trans proline' 0 C--N 1.331 -0.388 0 CA-C-N 119.05 0.696 . . . . 62.67 111.268 -178.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -124.05 84.63 55.02 Favored Pre-proline 0 C--O 1.239 0.514 0 CA-C-N 115.724 -0.671 . . . . 87.94 109.743 179.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -70.86 154.33 63.43 Favored 'Trans proline' 0 C--N 1.328 -0.541 0 CA-C-O 121.782 0.659 . . . . 50.41 111.508 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' MSE . . . . . . . . . . . . . 41.5 mtp -56.97 139.83 50.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.916 -1.038 . . . . 27.74 110.683 174.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -88.49 105.83 17.88 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.426 -0.953 . . . . 48.13 108.426 179.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 15.8 mt -94.51 2.23 55.7 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 123.476 0.71 . . . . 39.02 112.596 -179.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 91.8 p -65.19 -18.57 65.42 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 113.39 0.885 . . . . 43.48 113.39 -170.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 26.4 mt -104.53 -9.82 18.06 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.812 1.042 . . . . 50.0 113.812 -177.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 1.3 m -82.55 136.74 22.3 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-N 118.871 0.76 . . . . 46.77 108.996 178.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -120.07 128.56 53.6 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.69 -0.856 . . . . 74.25 108.69 -172.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . 0.466 HD12 ' HG3' ' A' ' 83' ' ' MSE . 19.9 mt -96.44 127.66 39.2 Favored Pre-proline 0 C--O 1.24 0.603 0 C-N-CA 117.848 -1.541 . . . . 59.06 110.829 -173.312 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.67 168.18 25.43 Favored 'Trans proline' 0 C--N 1.331 -0.389 0 CA-C-O 122.053 0.772 . . . . 44.54 110.678 175.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.4 tp10 -56.21 -38.49 71.08 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 114.849 -1.069 . . . . 82.23 112.254 -171.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.9 p -64.73 -33.44 75.97 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.171 -0.612 . . . . 41.27 111.951 -177.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 54.6 mt -83.35 -29.5 28.19 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.125 -0.63 . . . . 35.24 111.738 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 53.5 mt -60.69 -44.12 96.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 CA-C-O 121.105 0.478 . . . . 53.96 110.057 171.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -68.23 -42.42 79.78 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 122.029 -0.419 . . . . 71.83 111.289 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 37.3 tp -55.02 -43.24 73.51 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.784 -0.366 . . . . 35.16 110.847 171.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.6 t -59.96 -34.9 73.9 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.846 -0.342 . . . . 65.6 111.502 178.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLU . . . . . 0.523 ' HG2' ' HE ' ' A' ' 79' ' ' ARG . 4.8 mt-10 -79.54 -30.63 41.82 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.251 -0.58 . . . . 76.86 112.188 -177.924 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.2 mtp180 -73.91 -27.91 61.28 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.244 -0.982 . . . . 64.6 111.513 175.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ILE . . . . . 0.481 ' O ' HG13 ' A' ' 35' ' ' VAL . 80.7 mt -66.85 -51.52 54.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 C-N-CA 120.342 -0.543 . . . . 43.87 110.216 172.374 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.14 -37.63 72.3 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.748 -0.381 . . . . 36.59 111.158 178.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -63.07 -43.1 99.53 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.848 -0.341 . . . . 74.12 111.434 176.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ASN . . . . . 0.442 HD22 'SE ' ' A' ' 202' ' ' MSE . 25.8 t30 -70.93 -33.0 70.09 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.378 -0.529 . . . . 42.74 112.106 -177.004 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' VAL . . . . . 0.481 HG13 ' O ' ' A' ' 31' ' ' ILE . 3.5 m -71.6 -23.59 22.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 119.297 -0.961 . . . . 42.25 110.879 178.77 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 -69.34 -40.52 77.51 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.832 -0.747 . . . . 53.8 110.598 171.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -67.77 -41.71 82.85 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.805 -0.358 . . . . 58.05 111.177 179.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.7 t -54.76 -42.55 62.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 CA-C-O 121.133 0.492 . . . . 40.63 110.008 173.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' TRP . . . . . 0.427 ' HE1' ' NH1' ' A' ' 43' ' ' ARG . 67.2 t90 -68.48 -37.33 80.03 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.597 -0.441 . . . . 49.38 111.542 -177.826 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.66 -45.21 60.07 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 122.208 -0.307 . . . . 46.74 111.608 -176.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LYS . . . . . 0.671 ' HG2' ' HG2' ' A' ' 124' ' ' PRO . 2.6 mmtt -57.64 -46.9 83.57 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.638 -0.425 . . . . 67.07 110.706 174.914 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -52.54 -48.41 66.12 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.474 -0.33 . . . . 49.22 111.64 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ARG . . . . . 0.427 ' NH1' ' HE1' ' A' ' 39' ' ' TRP . 1.0 OUTLIER -87.2 -31.97 20.05 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 112.821 0.674 . . . . 73.54 112.821 -171.79 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 64.3 mt -63.25 -37.07 78.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 119.901 -0.72 . . . . 66.55 110.175 175.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -70.57 -27.74 64.36 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.14 -0.624 . . . . 69.48 111.555 175.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -71.18 -0.06 8.93 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 112.835 0.68 . . . . 82.89 112.835 171.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.97 34.8 8.03 Favored Glycine 0 N--CA 1.446 -0.641 0 N-CA-C 115.335 0.894 . . . . 74.73 115.335 -178.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 33.2 m95 -102.85 156.24 17.79 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 118.375 1.087 . . . . 69.89 110.429 176.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.6 p -143.92 164.17 31.33 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.09 -0.959 . . . . 84.68 108.983 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' TYR . . . . . 0.475 ' CD1' ' HA ' ' A' ' 62' ' ' PRO . 6.8 t80 -73.28 138.6 45.59 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.333 -0.849 . . . . 108.8 110.734 178.511 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -151.64 155.29 26.06 Favored Glycine 0 N--CA 1.451 -0.358 0 N-CA-C 107.727 -2.149 . . . . 96.79 107.727 167.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -65.01 -44.4 89.37 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 118.853 -1.139 . . . . 133.13 111.219 -172.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 26.9 tttt -107.25 156.98 18.28 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.893 0.854 . . . . 114.32 109.811 172.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.6 ttt85 -96.52 124.93 40.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.044 -0.98 . . . . 96.8 110.075 -167.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -121.19 120.76 36.15 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.128 -1.064 . . . . 103.45 108.128 175.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -84.64 -13.6 51.07 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 113.462 0.912 . . . . 90.83 113.462 -170.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.1 pt -105.63 -21.57 5.33 Favored 'Isoleucine or valine' 0 C--O 1.241 0.638 0 N-CA-C 112.626 0.602 . . . . 103.74 112.626 176.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 42.8 m170 -101.09 5.8 43.03 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 118.889 0.768 . . . . 107.81 111.889 172.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.8 mttt 58.86 56.36 4.12 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 122.246 1.022 . . . . 84.6 111.439 168.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -122.47 150.91 41.86 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 114.597 -1.183 . . . . 91.52 108.809 171.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' HIS . . . . . 0.61 ' HB3' HD13 ' A' ' 64' ' ' LEU . 54.5 t-80 -167.44 137.96 2.38 Favored Pre-proline 0 C--O 1.238 0.458 0 N-CA-C 108.825 -0.806 . . . . 67.06 108.825 -174.421 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' PRO . . . . . 0.475 ' HA ' ' CD1' ' A' ' 50' ' ' TYR . 94.3 Cg_endo -85.02 -15.88 5.42 Favored 'Trans proline' 0 C--O 1.234 0.315 0 N-CA-C 115.768 1.411 . . . . 72.9 115.768 -170.487 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 57.5 m -84.52 9.47 13.46 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.597 0.591 . . . . 56.44 112.597 -179.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LEU . . . . . 0.61 HD13 ' HB3' ' A' ' 61' ' ' HIS . 11.1 mp -81.41 67.86 7.52 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 122.855 1.312 . . . . 64.69 108.69 178.372 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' VAL . . . . . 0.522 ' CG1' ' HB2' ' A' ' 69' ' ' GLU . 64.9 t -142.77 152.18 58.63 Favored Pre-proline 0 C--O 1.247 0.93 0 CA-C-N 114.416 -1.266 . . . . 62.73 109.089 -165.333 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' PRO . . . . . 0.434 ' HD3' ' HB2' ' A' ' 122' ' ' TYR . 66.9 Cg_exo -42.37 139.7 2.79 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 119.752 0.301 . . . . 59.46 111.666 166.327 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -55.8 -38.77 70.39 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.408 -0.517 . . . . 52.78 111.239 -174.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASP . . . . . 0.421 ' OD1' ' HG3' ' A' ' 69' ' ' GLU . 2.2 p30 -66.03 -23.91 66.64 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 113.039 0.755 . . . . 84.65 113.039 -177.497 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . 0.522 ' HB2' ' CG1' ' A' ' 65' ' ' VAL . 27.8 mt-10 -96.42 18.42 14.0 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 118.647 0.658 . . . . 89.96 112.388 178.552 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.3 mt -83.65 145.13 46.84 Favored Pre-proline 0 C--N 1.348 0.51 0 N-CA-C 109.751 -0.462 . . . . 58.26 109.751 169.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -66.14 151.57 83.35 Favored 'Trans proline' 0 C--N 1.33 -0.438 0 N-CA-C 110.293 -0.695 . . . . 66.46 110.293 172.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -65.54 -35.45 80.89 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.49 -0.777 . . . . 65.35 111.781 -172.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -63.89 -33.81 76.53 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.447 -0.901 . . . . 71.71 110.79 174.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -68.85 -15.53 63.52 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 112.61 0.596 . . . . 76.34 112.61 -179.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -95.32 -12.85 25.42 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 113.059 0.763 . . . . 52.84 113.059 179.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 77.7 mt-10 -63.65 -44.35 94.09 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 112.1 0.407 . . . . 66.59 112.1 -169.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -59.35 -47.03 86.95 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.124 -0.63 . . . . 65.84 111.508 -170.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -70.05 -37.63 75.6 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.129 -0.628 . . . . 48.16 111.135 -179.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ARG . . . . . 0.523 ' HE ' ' HG2' ' A' ' 29' ' ' GLU . 64.1 mtt180 -63.06 -41.96 99.59 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.457 -0.497 . . . . 66.75 111.466 179.846 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -70.62 -41.49 72.19 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.524 -0.47 . . . . 46.88 111.094 179.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 22.6 m -61.51 -47.08 87.25 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.526 -0.47 . . . . 37.71 110.999 177.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.45 -45.03 95.98 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.945 0.402 . . . . 33.29 110.916 178.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' MSE . . . . . 0.466 ' HG3' HD12 ' A' ' 20' ' ' LEU . 25.5 ttm -61.16 -40.93 95.73 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 123.163 0.585 . . . . 57.34 111.624 178.349 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -69.15 -35.72 76.65 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.235 -0.586 . . . . 40.86 111.342 -178.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 54.4 m -65.07 -40.85 95.27 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.297 -0.561 . . . . 34.71 111.016 175.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.1 mm -62.82 -39.78 86.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 CA-C-O 120.905 0.383 . . . . 28.98 110.137 177.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . 0.41 ' HE2' ' HG2' ' A' ' 83' ' ' MSE . 7.5 mttt -65.24 -40.49 94.11 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.151 -0.62 . . . . 32.4 111.391 178.225 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' MSE . . . . . . . . . . . . . 35.7 mtt -56.98 -48.17 79.04 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.075 0.465 . . . . 44.83 110.257 175.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 50.2 t -58.86 -37.2 65.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 CA-C-N 115.484 -0.78 . . . . 24.85 110.15 178.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 8.8 mttt -72.08 -42.97 65.57 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.152 -0.619 . . . . 63.41 111.51 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.1 tttp -68.56 -21.0 64.57 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 119.812 -0.755 . . . . 56.4 112.338 -176.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LEU . . . . . 0.577 ' O ' ' NZ ' ' A' ' 212' ' ' LYS . 89.6 mt -81.9 -0.15 42.47 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.879 0.696 . . . . 56.42 112.879 174.07 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 87.53 39.16 7.31 Favored Glycine 0 C--O 1.239 0.419 0 N-CA-C 115.098 0.799 . . . . 49.0 115.098 175.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -112.62 136.1 52.57 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 117.687 0.744 . . . . 36.59 109.951 178.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 1.9 mtp-105 -83.77 139.44 32.71 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.821 -0.627 . . . . 77.8 109.619 171.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 23.0 mt -122.0 101.29 9.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 N-CA-C 106.35 -1.722 . . . . 36.37 106.35 174.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -133.41 144.46 49.55 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.776 0.322 . . . . 85.71 110.881 -173.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LYS . . . . . 0.451 ' HB3' ' HG3' ' A' ' 99' ' ' GLU . 64.0 mttt -82.07 141.35 33.24 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 109.034 -0.728 . . . . 78.65 109.034 163.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLU . . . . . 0.451 ' HG3' ' HB3' ' A' ' 98' ' ' LYS . 1.8 mt-10 . . . . . 0 C--N 1.332 -0.182 0 C-N-CA 123.452 0.701 . . . . 86.63 111.932 3.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.533 0.322 0 CA-C-O 120.841 0.353 . . . . 82.59 111.375 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -73.89 161.47 30.11 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 124.017 0.927 . . . . 100.12 110.945 -176.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LYS . . . . . 0.419 ' HD3' ' CE2' ' A' ' 50' ' ' TYR . 8.1 ttmt -64.66 -44.68 89.63 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 115.186 -0.915 . . . . 83.17 111.537 -179.639 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 15.0 mt -73.38 -17.52 61.26 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 112.345 0.498 . . . . 95.51 112.345 -179.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -99.48 12.4 36.52 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 123.905 0.882 . . . . 105.21 112.679 -176.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' TYR . . . . . 0.434 ' HB2' ' HD3' ' A' ' 66' ' ' PRO . 40.5 t80 -80.6 121.03 25.31 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 120.804 0.335 . . . . 66.83 110.825 -170.435 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 53.5 mt -124.79 116.09 26.41 Favored Pre-proline 0 C--O 1.24 0.598 0 N-CA-C 107.081 -1.451 . . . . 58.81 107.081 168.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' PRO . . . . . 0.671 ' HG2' ' HG2' ' A' ' 41' ' ' LYS . 35.2 Cg_endo -65.7 139.05 56.27 Favored 'Trans proline' 0 C--O 1.235 0.333 0 CA-C-N 119.832 0.976 . . . . 57.69 111.568 -177.914 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -124.91 74.1 65.29 Favored Pre-proline 0 C--O 1.235 0.33 0 CA-C-N 115.294 -0.866 . . . . 74.58 109.434 -177.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -70.73 146.22 53.57 Favored 'Trans proline' 0 C--O 1.234 0.321 0 CA-C-O 121.327 0.47 . . . . 38.04 111.471 177.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' MSE . . . . . . . . . . . . . 74.3 mtm -52.81 146.8 9.93 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.411 -0.813 . . . . 45.52 110.223 172.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -99.95 114.9 28.48 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 108.377 -0.971 . . . . 54.75 108.377 175.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 7.4 mt -101.36 10.15 40.87 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.06 -0.518 . . . . 32.37 112.315 -179.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 75.0 m -55.86 -37.08 68.3 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 111.853 0.316 . . . . 50.24 111.853 -175.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 34.5 mt -110.48 16.23 21.68 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 113.254 0.835 . . . . 35.21 113.254 -171.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 86.4 t -87.69 116.07 29.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 107.993 -1.114 . . . . 27.35 107.993 178.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -94.37 138.21 32.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.123 -0.489 . . . . 52.91 110.608 -177.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 22.1 mt -111.76 125.73 29.8 Favored Pre-proline 0 C--O 1.238 0.497 0 CA-C-N 115.955 -0.566 . . . . 29.36 110.462 179.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -62.84 158.48 42.53 Favored 'Trans proline' 0 C--N 1.331 -0.355 0 CA-C-O 121.837 0.682 . . . . 36.28 110.49 171.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' GLU . . . . . 0.469 ' O ' ' HG3' ' A' ' 140' ' ' GLN . 19.7 tp10 -57.27 -37.39 72.3 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.039 -0.982 . . . . 64.04 111.642 -173.393 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 83.4 p -57.87 -41.33 82.24 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.887 -0.325 . . . . 43.56 111.365 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 48.1 mt -77.54 -24.55 49.88 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 112.737 0.643 . . . . 30.07 112.737 179.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 99.4 mt -67.55 -39.55 82.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 C-N-CA 120.266 -0.574 . . . . 29.76 110.057 175.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 136' ' ' GLU . 29.7 mt-30 -72.01 -33.85 68.39 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 122.018 -0.426 . . . . 80.94 111.01 176.503 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 141' ' ' LEU . . . . . 0.536 ' O ' HG12 ' A' ' 145' ' ' ILE . 34.4 tp -55.86 -47.37 77.42 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 120.635 -0.426 . . . . 31.58 110.139 171.514 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 31.2 m -54.94 -43.68 73.62 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.591 -0.277 . . . . 43.32 111.051 176.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -61.47 -40.59 95.07 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.743 -0.383 . . . . 62.1 110.925 178.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 46.7 tpt85 -65.82 -36.72 84.28 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 120.504 -0.478 . . . . 26.01 110.84 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ILE . . . . . 0.536 HG12 ' O ' ' A' ' 141' ' ' LEU . 10.9 mm -64.35 -48.74 84.04 Favored 'Isoleucine or valine' 0 C--O 1.24 0.573 0 C-N-CA 120.449 -0.5 . . . . 27.16 110.154 177.114 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -56.87 -43.89 81.68 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 120.876 0.37 . . . . 26.56 111.108 -178.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -57.35 -49.92 74.63 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.782 0.325 . . . . 62.02 111.393 177.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -66.56 -36.58 83.0 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.081 -0.648 . . . . 29.28 111.658 -178.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.25 -45.87 97.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 C-N-CA 120.232 -0.587 . . . . 42.6 110.175 177.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -57.52 -32.54 67.16 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.114 -0.634 . . . . 54.04 111.435 171.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -71.43 -41.94 68.87 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.107 -0.637 . . . . 64.65 110.975 -179.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 73.9 t -61.78 -39.37 83.15 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-O 120.998 0.428 . . . . 40.72 110.209 176.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' TRP . . . . . 0.431 ' HE1' ' NH1' ' A' ' 157' ' ' ARG . 62.1 t90 -61.45 -48.79 79.52 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.395 -0.522 . . . . 67.73 111.047 178.996 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -59.74 -57.34 13.32 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 120.748 -0.381 . . . . 70.78 111.209 -176.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -53.35 -48.1 68.82 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 121.022 -0.271 . . . . 58.84 111.612 -176.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -52.94 -47.81 67.8 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.877 0.37 . . . . 80.28 111.182 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' ARG . . . . . 0.431 ' NH1' ' HE1' ' A' ' 153' ' ' TRP . 1.0 OUTLIER -81.09 -38.29 27.55 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 119.767 -0.773 . . . . 99.99 111.66 -178.371 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 9.8 mm -62.24 -28.93 45.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 120.65 -0.42 . . . . 85.84 110.831 173.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -68.49 -32.84 73.11 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.836 -0.746 . . . . 83.31 111.486 173.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -86.6 21.57 2.13 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.496 0.554 . . . . 101.22 112.496 176.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' GLY . . . . . . . . . . . . . . . 85.77 21.24 54.04 Favored Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 116.639 1.416 . . . . 107.34 116.639 169.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 48.2 m95 -83.83 166.68 17.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 118.823 1.311 . . . . 99.56 110.316 175.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' THR . . . . . 0.42 ' O ' ' HB3' ' A' ' 174' ' ' LYS . 1.2 t -156.44 162.2 40.02 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.653 -0.703 . . . . 113.45 109.435 179.302 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 164' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 115.028 -0.987 . . . . 104.8 108.926 172.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' LYS . . . . . 0.42 ' HB3' ' O ' ' A' ' 163' ' ' THR . 8.5 mmpt? . . . . . 0 CA--C 1.522 -0.124 0 CA-C-O 121.32 0.581 . . . . 124.77 110.891 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -85.3 139.84 36.39 Favored Pre-proline 0 C--O 1.235 0.312 0 C-N-CA 129.527 3.131 . . . . 105.12 111.505 -163.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 176' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -91.71 -0.9 4.47 Favored 'Trans proline' 0 C--O 1.234 0.294 0 C-N-CA 121.149 1.233 . . . . 95.23 114.629 169.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' CYS . . . . . . . . . . . . . 10.3 m -84.26 -6.65 59.42 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 119.102 0.864 . . . . 77.52 112.564 173.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 84.8 mt -77.67 73.89 4.23 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 122.6 1.191 . . . . 71.55 107.857 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' VAL . . . . . 0.419 HG12 ' HB2' ' A' ' 183' ' ' GLU . 2.0 t -137.35 158.28 72.55 Favored Pre-proline 0 C--O 1.241 0.653 0 CA-C-N 114.365 -1.289 . . . . 74.62 108.26 -178.128 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 180' ' ' PRO . . . . . 0.401 ' HD2' HG12 ' A' ' 179' ' ' VAL . 52.3 Cg_exo -47.11 137.33 17.54 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 N-CA-C 110.534 -0.602 . . . . 64.45 110.534 162.439 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 181' ' ' TYR . . . . . 0.54 ' CZ ' ' HG2' ' A' ' 189' ' ' LYS . 67.0 t80 -50.66 -39.54 51.08 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.721 -0.672 . . . . 62.91 109.864 178.583 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 182' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -56.18 -42.63 77.39 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.889 -0.324 . . . . 68.72 111.528 177.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 183' ' ' GLU . . . . . 0.419 ' HB2' HG12 ' A' ' 179' ' ' VAL . 20.3 mt-10 -91.37 19.69 5.85 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.774 0.657 . . . . 84.69 112.774 -175.407 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 36.5 mt -79.59 152.24 75.17 Favored Pre-proline 0 C--N 1.326 -0.439 0 N-CA-C 109.775 -0.454 . . . . 61.98 109.775 168.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' PRO . . . . . 0.443 ' HB2' ' HG2' ' A' ' 187' ' ' GLU . 73.4 Cg_endo -71.97 141.33 36.51 Favored 'Trans proline' 0 C--O 1.235 0.345 0 N-CA-C 110.392 -0.657 . . . . 69.5 110.392 173.456 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -61.37 -9.53 5.55 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 113.081 0.771 . . . . 93.97 113.081 -176.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 187' ' ' GLU . . . . . 0.443 ' HG2' ' HB2' ' A' ' 185' ' ' PRO . 1.9 pt-20 -65.92 -51.92 54.41 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 118.578 0.626 . . . . 121.99 110.9 172.817 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 188' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -75.77 -36.26 59.88 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 122.135 -0.353 . . . . 95.2 111.905 -178.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 189' ' ' LYS . . . . . 0.54 ' HG2' ' CZ ' ' A' ' 181' ' ' TYR . 7.6 mtpt -65.25 -26.06 67.94 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.442 0.534 . . . . 70.17 112.442 -179.834 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 190' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -72.58 -25.01 61.18 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 119.764 -0.775 . . . . 96.39 111.26 172.353 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 191' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -74.98 -51.68 13.05 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.554 -0.858 . . . . 70.96 111.339 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 192' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -58.69 -40.98 85.16 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.542 -0.463 . . . . 72.27 111.125 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 193' ' ' ARG . . . . . . . . . . . . . 4.4 ttt85 -67.4 -35.18 78.78 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 111.774 0.287 . . . . 75.38 111.774 -175.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 194' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -75.72 -24.5 56.17 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 112.53 0.567 . . . . 78.33 112.53 177.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 195' ' ' THR . . . . . . . . . . . . . 58.2 m -67.74 -47.73 68.45 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.13 -0.628 . . . . 40.67 110.809 172.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.97 -33.83 75.4 Favored 'General case' 0 C--O 1.24 0.57 0 O-C-N 122.169 -0.332 . . . . 28.92 111.533 178.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 197' ' ' MSE . . . . . 0.401 ' O ' ' HG3' ' A' ' 201' ' ' LYS . 13.5 ttm -62.97 -38.25 90.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.044 0.449 . . . . 44.45 109.79 177.285 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 198' ' ' ASN . . . . . 0.522 ' O ' ' HG3' ' A' ' 202' ' ' MSE . 89.9 m-20 -71.83 -33.73 68.71 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 119.99 -0.684 . . . . 34.13 111.78 -178.89 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 199' ' ' THR . . . . . . . . . . . . . 26.1 m -65.92 -43.44 88.12 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 119.854 -0.738 . . . . 25.19 111.21 174.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 200' ' ' ILE . . . . . . . . . . . . . 24.0 mm -61.69 -33.95 59.9 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 O-C-N 122.099 -0.376 . . . . 28.19 110.724 177.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 197' ' ' MSE . 84.9 mttt -69.9 -37.48 76.0 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.074 -0.65 . . . . 34.41 111.566 176.742 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 202' ' ' MSE . . . . . 0.522 ' HG3' ' O ' ' A' ' 198' ' ' ASN . 64.1 mtt -60.69 -40.8 93.52 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.508 -0.552 . . . . 71.94 109.508 177.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 73.1 t -62.68 -41.26 91.61 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 CA-C-N 116.062 -0.517 . . . . 37.19 110.493 178.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -71.18 -44.93 64.49 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 119.978 -0.689 . . . . 55.91 111.154 -177.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 205' ' ' LYS . . . . . . . . . . . . . 42.2 tptt -62.02 -25.69 67.8 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 112.214 0.449 . . . . 52.08 112.214 175.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 206' ' ' LEU . . . . . . . . . . . . . 57.8 mt -84.76 13.53 5.7 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 112.71 0.633 . . . . 45.56 112.71 176.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 92.53 2.51 67.6 Favored Glycine 0 N--CA 1.447 -0.6 0 N-CA-C 116.307 1.283 . . . . 46.1 116.307 170.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 208' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -95.2 162.27 13.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 119.068 1.434 . . . . 42.67 111.577 -177.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 209' ' ' ARG . . . . . . . . . . . . . 5.5 ttp180 -126.17 131.69 51.96 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 114.536 -1.211 . . . . 72.94 108.437 -177.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 210' ' ' ILE . . . . . . . . . . . . . 9.0 mt -112.26 119.01 59.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 107.856 -1.164 . . . . 43.23 107.856 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 211' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -139.05 141.91 38.22 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.487 -0.56 . . . . 68.06 109.487 -176.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 212' ' ' LYS . . . . . 0.577 ' NZ ' ' O ' ' A' ' 92' ' ' LEU . 49.2 tptt -63.36 159.77 17.44 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.557 0.694 . . . . 59.18 110.423 178.287 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 213' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 . . . . . 0 N--CA 1.467 0.423 0 C-N-CA 124.076 0.95 . . . . 71.69 110.949 -176.08 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 20.6 t80 . . . . . 0 N--CA 1.461 0.121 0 CA-C-O 121.022 0.439 . . . . 77.08 111.017 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 43.1 mm -116.6 107.11 47.24 Favored Pre-proline 0 C--O 1.238 0.49 0 N-CA-C 108.235 -1.024 . . . . 81.22 108.235 177.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -67.9 138.73 45.31 Favored 'Trans proline' 0 C--N 1.331 -0.388 0 CA-C-N 119.05 0.696 . . . . 62.67 111.268 -178.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -124.05 84.63 55.02 Favored Pre-proline 0 C--O 1.239 0.514 0 CA-C-N 115.724 -0.671 . . . . 87.94 109.743 179.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -70.86 154.33 63.43 Favored 'Trans proline' 0 C--N 1.328 -0.541 0 CA-C-O 121.782 0.659 . . . . 50.41 111.508 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' MSE . . . . . . . . . . . . . 41.5 mtp -56.97 139.83 50.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.916 -1.038 . . . . 27.74 110.683 174.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -88.49 105.83 17.88 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.426 -0.953 . . . . 48.13 108.426 179.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 15.8 mt -94.51 2.23 55.7 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 123.476 0.71 . . . . 39.02 112.596 -179.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 91.8 p -65.19 -18.57 65.42 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 113.39 0.885 . . . . 43.48 113.39 -170.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 26.4 mt -104.53 -9.82 18.06 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.812 1.042 . . . . 50.0 113.812 -177.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 1.3 m -82.55 136.74 22.3 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-N 118.871 0.76 . . . . 46.77 108.996 178.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -120.07 128.56 53.6 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.69 -0.856 . . . . 74.25 108.69 -172.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.466 HD12 ' HG3' ' A' ' 83' ' ' MSE . 19.9 mt -96.44 127.66 39.2 Favored Pre-proline 0 C--O 1.24 0.603 0 C-N-CA 117.848 -1.541 . . . . 59.06 110.829 -173.312 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.67 168.18 25.43 Favored 'Trans proline' 0 C--N 1.331 -0.389 0 CA-C-O 122.053 0.772 . . . . 44.54 110.678 175.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.4 tp10 -56.21 -38.49 71.08 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 114.849 -1.069 . . . . 82.23 112.254 -171.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.9 p -64.73 -33.44 75.97 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.171 -0.612 . . . . 41.27 111.951 -177.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 54.6 mt -83.35 -29.5 28.19 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.125 -0.63 . . . . 35.24 111.738 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 53.5 mt -60.69 -44.12 96.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 CA-C-O 121.105 0.478 . . . . 53.96 110.057 171.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -68.23 -42.42 79.78 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 122.029 -0.419 . . . . 71.83 111.289 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 37.3 tp -55.02 -43.24 73.51 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.784 -0.366 . . . . 35.16 110.847 171.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.6 t -59.96 -34.9 73.9 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.846 -0.342 . . . . 65.6 111.502 178.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.523 ' HG2' ' HE ' ' A' ' 79' ' ' ARG . 4.8 mt-10 -79.54 -30.63 41.82 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.251 -0.58 . . . . 76.86 112.188 -177.924 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.2 mtp180 -73.91 -27.91 61.28 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.244 -0.982 . . . . 64.6 111.513 175.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.481 ' O ' HG13 ' A' ' 35' ' ' VAL . 80.7 mt -66.85 -51.52 54.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 C-N-CA 120.342 -0.543 . . . . 43.87 110.216 172.374 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.14 -37.63 72.3 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.748 -0.381 . . . . 36.59 111.158 178.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -63.07 -43.1 99.53 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.848 -0.341 . . . . 74.12 111.434 176.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.442 HD22 'SE ' ' A' ' 202' ' ' MSE . 25.8 t30 -70.93 -33.0 70.09 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.378 -0.529 . . . . 42.74 112.106 -177.004 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.481 HG13 ' O ' ' A' ' 31' ' ' ILE . 3.5 m -71.6 -23.59 22.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 C-N-CA 119.297 -0.961 . . . . 42.25 110.879 178.77 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 -69.34 -40.52 77.51 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.832 -0.747 . . . . 53.8 110.598 171.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -67.77 -41.71 82.85 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.805 -0.358 . . . . 58.05 111.177 179.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.7 t -54.76 -42.55 62.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 CA-C-O 121.133 0.492 . . . . 40.63 110.008 173.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.427 ' HE1' ' NH1' ' A' ' 43' ' ' ARG . 67.2 t90 -68.48 -37.33 80.03 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.597 -0.441 . . . . 49.38 111.542 -177.826 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.66 -45.21 60.07 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 122.208 -0.307 . . . . 46.74 111.608 -176.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.671 ' HG2' ' HG2' ' A' ' 124' ' ' PRO . 2.6 mmtt -57.64 -46.9 83.57 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.638 -0.425 . . . . 67.07 110.706 174.914 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -52.54 -48.41 66.12 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.474 -0.33 . . . . 49.22 111.64 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.427 ' NH1' ' HE1' ' A' ' 39' ' ' TRP . 1.0 OUTLIER -87.2 -31.97 20.05 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 112.821 0.674 . . . . 73.54 112.821 -171.79 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 64.3 mt -63.25 -37.07 78.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 119.901 -0.72 . . . . 66.55 110.175 175.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -70.57 -27.74 64.36 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.14 -0.624 . . . . 69.48 111.555 175.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -71.18 -0.06 8.93 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 112.835 0.68 . . . . 82.89 112.835 171.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.97 34.8 8.03 Favored Glycine 0 N--CA 1.446 -0.641 0 N-CA-C 115.335 0.894 . . . . 74.73 115.335 -178.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 33.2 m95 -102.85 156.24 17.79 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 118.375 1.087 . . . . 69.89 110.429 176.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.6 p -143.92 164.17 31.33 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.09 -0.959 . . . . 84.68 108.983 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.475 ' CD1' ' HA ' ' A' ' 62' ' ' PRO . 6.8 t80 -73.28 138.6 45.59 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.333 -0.849 . . . . 108.8 110.734 178.511 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -151.64 155.29 26.06 Favored Glycine 0 N--CA 1.451 -0.358 0 N-CA-C 107.727 -2.149 . . . . 96.79 107.727 167.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -65.01 -44.4 89.37 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 118.853 -1.139 . . . . 133.13 111.219 -172.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 26.9 tttt -107.25 156.98 18.28 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.893 0.854 . . . . 114.32 109.811 172.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.6 ttt85 -96.52 124.93 40.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.044 -0.98 . . . . 96.8 110.075 -167.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -121.19 120.76 36.15 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.128 -1.064 . . . . 103.45 108.128 175.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -84.64 -13.6 51.07 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 113.462 0.912 . . . . 90.83 113.462 -170.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 3.1 pt -105.63 -21.57 5.33 Favored 'Isoleucine or valine' 0 C--O 1.241 0.638 0 N-CA-C 112.626 0.602 . . . . 103.74 112.626 176.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 42.8 m170 -101.09 5.8 43.03 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 118.889 0.768 . . . . 107.81 111.889 172.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 87.8 mttt 58.86 56.36 4.12 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 122.246 1.022 . . . . 84.6 111.439 168.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -122.47 150.91 41.86 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 114.597 -1.183 . . . . 91.52 108.809 171.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.61 ' HB3' HD13 ' A' ' 64' ' ' LEU . 54.5 t-80 -167.44 137.96 2.38 Favored Pre-proline 0 C--O 1.238 0.458 0 N-CA-C 108.825 -0.806 . . . . 67.06 108.825 -174.421 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.475 ' HA ' ' CD1' ' A' ' 50' ' ' TYR . 94.3 Cg_endo -85.02 -15.88 5.42 Favored 'Trans proline' 0 C--O 1.234 0.315 0 N-CA-C 115.768 1.411 . . . . 72.9 115.768 -170.487 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 57.5 m -84.52 9.47 13.46 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.597 0.591 . . . . 56.44 112.597 -179.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.61 HD13 ' HB3' ' A' ' 61' ' ' HIS . 11.1 mp -81.41 67.86 7.52 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 122.855 1.312 . . . . 64.69 108.69 178.372 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.522 ' CG1' ' HB2' ' A' ' 69' ' ' GLU . 64.9 t -142.77 152.18 58.63 Favored Pre-proline 0 C--O 1.247 0.93 0 CA-C-N 114.416 -1.266 . . . . 62.73 109.089 -165.333 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.434 ' HD3' ' HB2' ' A' ' 122' ' ' TYR . 66.9 Cg_exo -42.37 139.7 2.79 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 119.752 0.301 . . . . 59.46 111.666 166.327 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -55.8 -38.77 70.39 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.408 -0.517 . . . . 52.78 111.239 -174.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.421 ' OD1' ' HG3' ' A' ' 69' ' ' GLU . 2.2 p30 -66.03 -23.91 66.64 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 113.039 0.755 . . . . 84.65 113.039 -177.497 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.522 ' HB2' ' CG1' ' A' ' 65' ' ' VAL . 27.8 mt-10 -96.42 18.42 14.0 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 118.647 0.658 . . . . 89.96 112.388 178.552 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.3 mt -83.65 145.13 46.84 Favored Pre-proline 0 C--N 1.348 0.51 0 N-CA-C 109.751 -0.462 . . . . 58.26 109.751 169.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -66.14 151.57 83.35 Favored 'Trans proline' 0 C--N 1.33 -0.438 0 N-CA-C 110.293 -0.695 . . . . 66.46 110.293 172.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -65.54 -35.45 80.89 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.49 -0.777 . . . . 65.35 111.781 -172.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -63.89 -33.81 76.53 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.447 -0.901 . . . . 71.71 110.79 174.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -68.85 -15.53 63.52 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 112.61 0.596 . . . . 76.34 112.61 -179.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -95.32 -12.85 25.42 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 113.059 0.763 . . . . 52.84 113.059 179.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 77.7 mt-10 -63.65 -44.35 94.09 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 112.1 0.407 . . . . 66.59 112.1 -169.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -59.35 -47.03 86.95 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.124 -0.63 . . . . 65.84 111.508 -170.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -70.05 -37.63 75.6 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.129 -0.628 . . . . 48.16 111.135 -179.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.523 ' HE ' ' HG2' ' A' ' 29' ' ' GLU . 64.1 mtt180 -63.06 -41.96 99.59 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.457 -0.497 . . . . 66.75 111.466 179.846 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -70.62 -41.49 72.19 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.524 -0.47 . . . . 46.88 111.094 179.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 22.6 m -61.51 -47.08 87.25 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.526 -0.47 . . . . 37.71 110.999 177.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.45 -45.03 95.98 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.945 0.402 . . . . 33.29 110.916 178.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' MSE . . . . . 0.466 ' HG3' HD12 ' A' ' 20' ' ' LEU . 25.5 ttm -61.16 -40.93 95.73 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 123.163 0.585 . . . . 57.34 111.624 178.349 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -69.15 -35.72 76.65 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.235 -0.586 . . . . 40.86 111.342 -178.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 54.4 m -65.07 -40.85 95.27 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.297 -0.561 . . . . 34.71 111.016 175.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.1 mm -62.82 -39.78 86.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 CA-C-O 120.905 0.383 . . . . 28.98 110.137 177.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.41 ' HE2' ' HG2' ' A' ' 83' ' ' MSE . 7.5 mttt -65.24 -40.49 94.11 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.151 -0.62 . . . . 32.4 111.391 178.225 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' MSE . . . . . . . . . . . . . 35.7 mtt -56.98 -48.17 79.04 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.075 0.465 . . . . 44.83 110.257 175.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 50.2 t -58.86 -37.2 65.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 CA-C-N 115.484 -0.78 . . . . 24.85 110.15 178.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 8.8 mttt -72.08 -42.97 65.57 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.152 -0.619 . . . . 63.41 111.51 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.1 tttp -68.56 -21.0 64.57 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 119.812 -0.755 . . . . 56.4 112.338 -176.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.577 ' O ' ' NZ ' ' A' ' 212' ' ' LYS . 89.6 mt -81.9 -0.15 42.47 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.879 0.696 . . . . 56.42 112.879 174.07 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 87.53 39.16 7.31 Favored Glycine 0 C--O 1.239 0.419 0 N-CA-C 115.098 0.799 . . . . 49.0 115.098 175.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -112.62 136.1 52.57 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 117.687 0.744 . . . . 36.59 109.951 178.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 1.9 mtp-105 -83.77 139.44 32.71 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.821 -0.627 . . . . 77.8 109.619 171.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 23.0 mt -122.0 101.29 9.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 N-CA-C 106.35 -1.722 . . . . 36.37 106.35 174.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -133.41 144.46 49.55 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.776 0.322 . . . . 85.71 110.881 -173.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.451 ' HB3' ' HG3' ' A' ' 99' ' ' GLU . 64.0 mttt -82.07 141.35 33.24 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 109.034 -0.728 . . . . 78.65 109.034 163.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.451 ' HG3' ' HB3' ' A' ' 98' ' ' LYS . 1.8 mt-10 . . . . . 0 C--N 1.332 -0.182 0 C-N-CA 123.452 0.701 . . . . 86.63 111.932 3.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.533 0.322 0 CA-C-O 120.841 0.353 . . . . 82.59 111.375 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -73.89 161.47 30.11 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 124.017 0.927 . . . . 100.12 110.945 -176.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.419 ' HD3' ' CE2' ' A' ' 50' ' ' TYR . 8.1 ttmt -64.66 -44.68 89.63 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-N 115.186 -0.915 . . . . 83.17 111.537 -179.639 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 15.0 mt -73.38 -17.52 61.26 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 112.345 0.498 . . . . 95.51 112.345 -179.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -99.48 12.4 36.52 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 123.905 0.882 . . . . 105.21 112.679 -176.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' TYR . . . . . 0.434 ' HB2' ' HD3' ' A' ' 66' ' ' PRO . 40.5 t80 -80.6 121.03 25.31 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 120.804 0.335 . . . . 66.83 110.825 -170.435 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 53.5 mt -124.79 116.09 26.41 Favored Pre-proline 0 C--O 1.24 0.598 0 N-CA-C 107.081 -1.451 . . . . 58.81 107.081 168.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.671 ' HG2' ' HG2' ' A' ' 41' ' ' LYS . 35.2 Cg_endo -65.7 139.05 56.27 Favored 'Trans proline' 0 C--O 1.235 0.333 0 CA-C-N 119.832 0.976 . . . . 57.69 111.568 -177.914 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -124.91 74.1 65.29 Favored Pre-proline 0 C--O 1.235 0.33 0 CA-C-N 115.294 -0.866 . . . . 74.58 109.434 -177.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -70.73 146.22 53.57 Favored 'Trans proline' 0 C--O 1.234 0.321 0 CA-C-O 121.327 0.47 . . . . 38.04 111.471 177.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' MSE . . . . . . . . . . . . . 74.3 mtm -52.81 146.8 9.93 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.411 -0.813 . . . . 45.52 110.223 172.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -99.95 114.9 28.48 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 108.377 -0.971 . . . . 54.75 108.377 175.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 7.4 mt -101.36 10.15 40.87 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.06 -0.518 . . . . 32.37 112.315 -179.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 75.0 m -55.86 -37.08 68.3 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 111.853 0.316 . . . . 50.24 111.853 -175.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 34.5 mt -110.48 16.23 21.68 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 113.254 0.835 . . . . 35.21 113.254 -171.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 86.4 t -87.69 116.07 29.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 107.993 -1.114 . . . . 27.35 107.993 178.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -94.37 138.21 32.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.123 -0.489 . . . . 52.91 110.608 -177.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 22.1 mt -111.76 125.73 29.8 Favored Pre-proline 0 C--O 1.238 0.497 0 CA-C-N 115.955 -0.566 . . . . 29.36 110.462 179.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -62.84 158.48 42.53 Favored 'Trans proline' 0 C--N 1.331 -0.355 0 CA-C-O 121.837 0.682 . . . . 36.28 110.49 171.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.469 ' O ' ' HG3' ' A' ' 140' ' ' GLN . 19.7 tp10 -57.27 -37.39 72.3 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 115.039 -0.982 . . . . 64.04 111.642 -173.393 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 83.4 p -57.87 -41.33 82.24 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.887 -0.325 . . . . 43.56 111.365 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 48.1 mt -77.54 -24.55 49.88 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 112.737 0.643 . . . . 30.07 112.737 179.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 99.4 mt -67.55 -39.55 82.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 C-N-CA 120.266 -0.574 . . . . 29.76 110.057 175.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 136' ' ' GLU . 29.7 mt-30 -72.01 -33.85 68.39 Favored 'General case' 0 C--O 1.236 0.383 0 O-C-N 122.018 -0.426 . . . . 80.94 111.01 176.503 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' LEU . . . . . 0.536 ' O ' HG12 ' A' ' 145' ' ' ILE . 34.4 tp -55.86 -47.37 77.42 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 120.635 -0.426 . . . . 31.58 110.139 171.514 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' SER . . . . . . . . . . . . . 31.2 m -54.94 -43.68 73.62 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 116.591 -0.277 . . . . 43.32 111.051 176.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -61.47 -40.59 95.07 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.743 -0.383 . . . . 62.1 110.925 178.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 46.7 tpt85 -65.82 -36.72 84.28 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 120.504 -0.478 . . . . 26.01 110.84 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.536 HG12 ' O ' ' A' ' 141' ' ' LEU . 10.9 mm -64.35 -48.74 84.04 Favored 'Isoleucine or valine' 0 C--O 1.24 0.573 0 C-N-CA 120.449 -0.5 . . . . 27.16 110.154 177.114 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -56.87 -43.89 81.68 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 120.876 0.37 . . . . 26.56 111.108 -178.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -57.35 -49.92 74.63 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.782 0.325 . . . . 62.02 111.393 177.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -66.56 -36.58 83.0 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.081 -0.648 . . . . 29.28 111.658 -178.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 54.5 t -62.25 -45.87 97.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 C-N-CA 120.232 -0.587 . . . . 42.6 110.175 177.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -57.52 -32.54 67.16 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.114 -0.634 . . . . 54.04 111.435 171.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -71.43 -41.94 68.87 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.107 -0.637 . . . . 64.65 110.975 -179.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 73.9 t -61.78 -39.37 83.15 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-O 120.998 0.428 . . . . 40.72 110.209 176.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' TRP . . . . . 0.431 ' HE1' ' NH1' ' A' ' 157' ' ' ARG . 62.1 t90 -61.45 -48.79 79.52 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.395 -0.522 . . . . 67.73 111.047 178.996 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -59.74 -57.34 13.32 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 120.748 -0.381 . . . . 70.78 111.209 -176.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -53.35 -48.1 68.82 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 121.022 -0.271 . . . . 58.84 111.612 -176.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -52.94 -47.81 67.8 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.877 0.37 . . . . 80.28 111.182 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' ARG . . . . . 0.431 ' NH1' ' HE1' ' A' ' 153' ' ' TRP . 1.0 OUTLIER -81.09 -38.29 27.55 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 119.767 -0.773 . . . . 99.99 111.66 -178.371 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 9.8 mm -62.24 -28.93 45.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 120.65 -0.42 . . . . 85.84 110.831 173.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -68.49 -32.84 73.11 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.836 -0.746 . . . . 83.31 111.486 173.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -86.6 21.57 2.13 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 112.496 0.554 . . . . 101.22 112.496 176.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' GLY . . . . . . . . . . . . . . . 85.77 21.24 54.04 Favored Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 116.639 1.416 . . . . 107.34 116.639 169.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' TRP . . . . . . . . . . . . . 48.2 m95 -83.83 166.68 17.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 118.823 1.311 . . . . 99.56 110.316 175.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' THR . . . . . 0.42 ' O ' ' HB3' ' A' ' 174' ' ' LYS . 1.2 t -156.44 162.2 40.02 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.653 -0.703 . . . . 113.45 109.435 179.302 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 115.028 -0.987 . . . . 104.8 108.926 172.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.42 ' HB3' ' O ' ' A' ' 163' ' ' THR . 8.5 mmpt? . . . . . 0 CA--C 1.522 -0.124 0 CA-C-O 121.32 0.581 . . . . 124.77 110.891 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -85.3 139.84 36.39 Favored Pre-proline 0 C--O 1.235 0.312 0 C-N-CA 129.527 3.131 . . . . 105.12 111.505 -163.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -91.71 -0.9 4.47 Favored 'Trans proline' 0 C--O 1.234 0.294 0 C-N-CA 121.149 1.233 . . . . 95.23 114.629 169.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' CYS . . . . . . . . . . . . . 10.3 m -84.26 -6.65 59.42 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 119.102 0.864 . . . . 77.52 112.564 173.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 84.8 mt -77.67 73.89 4.23 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 122.6 1.191 . . . . 71.55 107.857 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' VAL . . . . . 0.419 HG12 ' HB2' ' A' ' 183' ' ' GLU . 2.0 t -137.35 158.28 72.55 Favored Pre-proline 0 C--O 1.241 0.653 0 CA-C-N 114.365 -1.289 . . . . 74.62 108.26 -178.128 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' PRO . . . . . 0.401 ' HD2' HG12 ' A' ' 179' ' ' VAL . 52.3 Cg_exo -47.11 137.33 17.54 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 N-CA-C 110.534 -0.602 . . . . 64.45 110.534 162.439 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' TYR . . . . . 0.54 ' CZ ' ' HG2' ' A' ' 189' ' ' LYS . 67.0 t80 -50.66 -39.54 51.08 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.721 -0.672 . . . . 62.91 109.864 178.583 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -56.18 -42.63 77.39 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.889 -0.324 . . . . 68.72 111.528 177.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' GLU . . . . . 0.419 ' HB2' HG12 ' A' ' 179' ' ' VAL . 20.3 mt-10 -91.37 19.69 5.85 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 112.774 0.657 . . . . 84.69 112.774 -175.407 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' LEU . . . . . . . . . . . . . 36.5 mt -79.59 152.24 75.17 Favored Pre-proline 0 C--N 1.326 -0.439 0 N-CA-C 109.775 -0.454 . . . . 61.98 109.775 168.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' PRO . . . . . 0.443 ' HB2' ' HG2' ' A' ' 187' ' ' GLU . 73.4 Cg_endo -71.97 141.33 36.51 Favored 'Trans proline' 0 C--O 1.235 0.345 0 N-CA-C 110.392 -0.657 . . . . 69.5 110.392 173.456 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -61.37 -9.53 5.55 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 113.081 0.771 . . . . 93.97 113.081 -176.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' GLU . . . . . 0.443 ' HG2' ' HB2' ' A' ' 185' ' ' PRO . 1.9 pt-20 -65.92 -51.92 54.41 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 118.578 0.626 . . . . 121.99 110.9 172.817 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -75.77 -36.26 59.88 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 122.135 -0.353 . . . . 95.2 111.905 -178.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' LYS . . . . . 0.54 ' HG2' ' CZ ' ' A' ' 181' ' ' TYR . 7.6 mtpt -65.25 -26.06 67.94 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.442 0.534 . . . . 70.17 112.442 -179.834 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -72.58 -25.01 61.18 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 119.764 -0.775 . . . . 96.39 111.26 172.353 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -74.98 -51.68 13.05 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.554 -0.858 . . . . 70.96 111.339 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -58.69 -40.98 85.16 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.542 -0.463 . . . . 72.27 111.125 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 193' ' ' ARG . . . . . . . . . . . . . 4.4 ttt85 -67.4 -35.18 78.78 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 111.774 0.287 . . . . 75.38 111.774 -175.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -75.72 -24.5 56.17 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 112.53 0.567 . . . . 78.33 112.53 177.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' THR . . . . . . . . . . . . . 58.2 m -67.74 -47.73 68.45 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.13 -0.628 . . . . 40.67 110.809 172.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -67.97 -33.83 75.4 Favored 'General case' 0 C--O 1.24 0.57 0 O-C-N 122.169 -0.332 . . . . 28.92 111.533 178.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' MSE . . . . . 0.401 ' O ' ' HG3' ' A' ' 201' ' ' LYS . 13.5 ttm -62.97 -38.25 90.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.044 0.449 . . . . 44.45 109.79 177.285 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' ASN . . . . . 0.522 ' O ' ' HG3' ' A' ' 202' ' ' MSE . 89.9 m-20 -71.83 -33.73 68.71 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 119.99 -0.684 . . . . 34.13 111.78 -178.89 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 199' ' ' THR . . . . . . . . . . . . . 26.1 m -65.92 -43.44 88.12 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 119.854 -0.738 . . . . 25.19 111.21 174.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' ILE . . . . . . . . . . . . . 24.0 mm -61.69 -33.95 59.9 Favored 'Isoleucine or valine' 0 C--O 1.238 0.477 0 O-C-N 122.099 -0.376 . . . . 28.19 110.724 177.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 197' ' ' MSE . 84.9 mttt -69.9 -37.48 76.0 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.074 -0.65 . . . . 34.41 111.566 176.742 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' MSE . . . . . 0.522 ' HG3' ' O ' ' A' ' 198' ' ' ASN . 64.1 mtt -60.69 -40.8 93.52 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.508 -0.552 . . . . 71.94 109.508 177.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 73.1 t -62.68 -41.26 91.61 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 CA-C-N 116.062 -0.517 . . . . 37.19 110.493 178.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -71.18 -44.93 64.49 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 119.978 -0.689 . . . . 55.91 111.154 -177.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' LYS . . . . . . . . . . . . . 42.2 tptt -62.02 -25.69 67.8 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 112.214 0.449 . . . . 52.08 112.214 175.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' LEU . . . . . . . . . . . . . 57.8 mt -84.76 13.53 5.7 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 112.71 0.633 . . . . 45.56 112.71 176.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' GLY . . . . . . . . . . . . . . . 92.53 2.51 67.6 Favored Glycine 0 N--CA 1.447 -0.6 0 N-CA-C 116.307 1.283 . . . . 46.1 116.307 170.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -95.2 162.27 13.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 119.068 1.434 . . . . 42.67 111.577 -177.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' ARG . . . . . . . . . . . . . 5.5 ttp180 -126.17 131.69 51.96 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 114.536 -1.211 . . . . 72.94 108.437 -177.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' ILE . . . . . . . . . . . . . 9.0 mt -112.26 119.01 59.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 107.856 -1.164 . . . . 43.23 107.856 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -139.05 141.91 38.22 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.487 -0.56 . . . . 68.06 109.487 -176.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' LYS . . . . . 0.577 ' NZ ' ' O ' ' A' ' 92' ' ' LEU . 49.2 tptt -63.36 159.77 17.44 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.557 0.694 . . . . 59.18 110.423 178.287 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 . . . . . 0 N--CA 1.467 0.423 0 C-N-CA 124.076 0.95 . . . . 71.69 110.949 -176.08 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_