data_6g6v_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 6g6v _Structure_validation_residue.Date_analyzed 2019-04-05 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 ' 1' ' ' MET . . . . . 0.417 ' N ' ' OD2' ' A' ' 29' ' ' ASP . 3.4 ptp . . . . . 0 CA--C 1.533 0.297 0 CA-C-O 120.734 0.302 . . . . 108.48 110.933 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 79.0 p -89.43 148.06 23.68 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.967 -0.753 . . . . 60.13 108.967 171.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -155.61 136.0 4.87 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.848 -0.691 . . . . 46.68 112.364 -179.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -118.94 141.56 48.55 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.897 -0.408 . . . . 41.27 109.897 179.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.3 t -104.79 128.72 58.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 108.723 -0.843 . . . . 34.36 108.723 171.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 72.6 m -106.72 101.47 36.81 Favored Pre-proline 0 C--N 1.327 -0.395 0 N-CA-C 109.026 -0.731 . . . . 37.89 109.026 173.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -97.46 157.21 0.99 Allowed 'Trans proline' 0 C--N 1.343 0.268 0 O-C-N 122.492 0.733 . . . . 36.7 111.122 -172.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 170.52 176.26 39.82 Favored Glycine 0 C--O 1.236 0.265 0 N-CA-C 110.806 -0.918 . . . . 38.97 110.806 179.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.1 p -89.4 -25.05 21.76 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 119.715 -0.794 . . . . 48.69 111.081 176.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 42.42 60.99 2.16 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.563 0.745 . . . . 41.68 112.624 178.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -127.39 69.84 75.27 Favored Pre-proline 0 CA--C 1.538 0.511 0 CA-C-N 115.29 -0.868 . . . . 50.21 111.405 -173.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -100.61 171.96 7.86 Favored 'Cis proline' 0 N--CA 1.463 -0.302 0 O-C-N 122.004 0.476 . . . . 42.1 111.584 1.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.9 p -60.86 144.36 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 N-CA-C 109.762 -0.459 . . . . 36.61 109.762 171.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.0 p -116.66 173.27 6.72 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.896 -0.409 . . . . 36.93 109.896 -178.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.9 mt -68.46 -23.38 64.59 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 119.569 -0.852 . . . . 37.06 111.187 176.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.22 -47.2 83.19 Favored Glycine 0 C--O 1.227 -0.304 0 N-CA-C 108.744 -1.743 . . . . 31.25 108.744 174.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 33.4 m170 -56.77 -45.89 81.82 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 112.599 0.592 . . . . 38.67 112.599 175.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.8 t -62.88 -37.69 79.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 119.98 -0.688 . . . . 39.7 111.12 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASP . . . . . 0.766 ' OD1' ' O ' ' A' ' 301' ' ' HOH . 35.7 t70 -57.14 -45.89 83.17 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 122.473 0.309 . . . . 42.45 110.632 175.432 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 38.8 mm -61.18 -46.34 96.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 CA-C-O 120.566 0.222 . . . . 40.69 111.373 175.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 17.5 m-30 -56.11 -45.49 79.45 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 120.409 -0.517 . . . . 35.25 111.404 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -63.72 -41.68 98.03 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.154 0.502 . . . . 50.3 110.028 -177.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 54.2 mtp180 -71.74 -37.54 70.54 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.06 -0.656 . . . . 45.12 111.498 -179.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.0 -44.89 95.76 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 119.874 -0.73 . . . . 36.7 111.989 171.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.6 -23.6 67.32 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.138 0.421 . . . . 46.53 112.138 -176.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -78.46 -17.89 55.66 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.239 0.829 . . . . 43.01 113.239 179.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.4 mm-40 -113.32 -15.67 12.63 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 114.096 1.147 . . . . 51.89 114.096 -174.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -119.48 145.98 45.82 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 110.45 -0.204 . . . . 45.39 110.45 -177.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASP . . . . . 0.417 ' OD2' ' N ' ' A' ' 1' ' ' MET . 67.6 m-20 -58.38 -40.38 82.17 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 120.552 -0.459 . . . . 71.88 110.846 178.337 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 73.9 tt0 -135.8 146.66 47.8 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.528 -0.305 . . . . 95.71 111.488 179.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 93.3 t -125.97 132.71 70.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 N-CA-C 108.274 -1.01 . . . . 44.11 108.274 174.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 84.9 t -116.95 118.85 60.16 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 N-CA-C 107.507 -1.294 . . . . 44.53 107.507 175.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.5 t -85.53 117.97 31.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 106.338 -1.727 . . . . 39.42 106.338 173.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.27 114.9 29.45 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.891 -0.411 . . . . 43.26 109.891 -179.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 21.9 mt -90.93 117.82 34.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 109.196 -0.668 . . . . 50.55 109.196 179.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 14.4 mt . . . . . 0 N--CA 1.464 0.273 0 N-CA-C 114.309 1.225 . . . . 75.28 114.309 -173.985 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.15 0 N-CA-C 112.175 -0.37 . . . . 72.66 112.175 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 35.3 ttm -90.21 -39.69 12.64 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 112.801 0.667 . . . . 67.19 112.801 -177.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -113.95 142.49 46.08 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 116.142 -0.481 . . . . 54.68 109.975 -178.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -76.12 172.5 12.69 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 119.331 -0.948 . . . . 95.57 110.183 176.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.5 -50.0 63.66 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 113.967 1.099 . . . . 70.63 113.967 -174.697 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -61.18 -40.5 94.16 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.122 0.786 . . . . 101.27 113.122 -177.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -62.37 -45.63 92.29 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 109.675 -0.491 . . . . 88.62 109.675 177.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 69.7 mtt180 -59.36 -46.47 88.54 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.5 0.556 . . . . 54.17 112.5 -177.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 86.4 mt -58.17 -52.24 61.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.009 -0.542 . . . . 63.86 111.611 177.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.37 -43.71 83.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.068 -0.515 . . . . 51.19 111.148 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 78.7 mtm -63.67 -40.17 96.16 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.655 -0.418 . . . . 51.35 110.955 -179.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 67.5 t -66.89 -49.05 77.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 C-N-CA 119.566 -0.854 . . . . 43.24 109.439 177.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -56.68 -48.56 77.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.842 0.353 . . . . 71.73 111.827 179.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLU . . . . . 0.425 ' OE2' ' NH2' ' A' ' 151' ' ' ARG . 88.8 mt-10 -62.86 -23.46 67.32 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.455 0.539 . . . . 68.83 112.455 -178.174 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.3 m -95.96 -2.2 47.53 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 113.657 0.984 . . . . 46.08 113.657 -176.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.0 p -131.06 19.79 4.94 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.551 0.945 . . . . 47.25 113.551 -173.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 49.9 p -61.87 -20.66 63.96 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.853 0.316 . . . . 55.63 111.853 -179.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 27.0 p-80 -84.01 8.81 14.1 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.44 -0.346 . . . . 53.73 111.757 177.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 93.9 mt -121.09 86.65 42.79 Favored Pre-proline 0 CA--C 1.537 0.455 0 CA-C-O 120.648 0.261 . . . . 52.13 111.015 -179.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -62.93 -28.35 75.18 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 121.569 1.513 . . . . 58.88 115.357 -171.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -95.67 19.32 11.36 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.565 0.58 . . . . 48.64 112.565 -177.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 8.8 tt -114.49 135.82 53.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.944 0.402 . . . . 47.35 110.194 179.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ARG . . . . . 0.627 ' NH2' ' OE1' ' A' ' 67' ' ' GLN . 0.3 OUTLIER -127.51 152.78 47.15 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.363 -0.535 . . . . 79.66 110.104 174.619 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -111.86 131.7 62.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 N-CA-C 110.119 -0.326 . . . . 51.61 110.119 -178.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLN . . . . . 0.627 ' OE1' ' NH2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -136.9 143.56 43.02 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 110.084 -0.339 . . . . 81.95 110.084 -177.709 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 66.2 t -78.16 136.5 23.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 107.747 -1.205 . . . . 70.23 107.747 169.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -112.65 158.05 14.55 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 121.428 -0.415 . . . . 53.29 112.066 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 30.3 t-80 -144.69 141.51 29.36 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 122.763 -0.257 . . . . 97.18 110.589 173.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 80.9 -164.59 46.66 Favored Glycine 0 CA--C 1.517 0.209 0 N-CA-C 111.059 -0.817 . . . . 45.59 111.059 -178.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 76.5 mt -61.24 140.48 57.94 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.887 0.344 . . . . 44.73 111.769 -174.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 64.7 t -57.43 -41.52 78.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 120.366 -0.533 . . . . 39.35 111.375 175.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 25.3 m -63.52 -30.58 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 113.26 0.837 . . . . 34.18 113.26 -177.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -70.69 -35.19 72.66 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.625 -0.88 . . . . 66.44 108.625 176.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -65.51 -47.38 76.16 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.015 -0.735 . . . . 48.51 109.015 177.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 72.4 t -56.15 -52.28 52.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 N-CA-C 112.408 0.522 . . . . 39.7 112.408 177.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 51.1 mtp85 -66.54 -37.69 85.54 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 119.707 -0.797 . . . . 80.75 112.155 -177.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 32.0 m -63.81 -38.57 91.59 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.252 0.834 . . . . 65.73 113.252 177.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 69.7 m -75.86 -2.01 28.03 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.228 0.455 . . . . 109.17 112.228 178.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 64.79 18.16 63.74 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 110.948 -0.861 . . . . 55.64 110.948 -175.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 23.4 mmt -77.02 171.76 14.29 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 107.63 -1.248 . . . . 80.75 107.63 177.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 70.3 p -127.04 -2.99 6.43 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 114.329 1.233 . . . . 54.0 114.329 -164.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -173.25 160.14 3.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.21 0.529 . . . . 41.06 111.769 -173.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.6 mt -109.68 138.17 38.47 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 N-CA-C 105.843 -1.91 . . . . 32.27 105.843 174.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 54.4 t -124.23 132.6 71.1 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.311 0 N-CA-C 108.08 -1.081 . . . . 34.17 108.08 175.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.9 ptmt -144.81 160.41 41.3 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.005 0.743 . . . . 49.64 113.005 172.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -89.83 149.38 20.41 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 109.804 -1.318 . . . . 35.37 109.804 -175.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 73.8 mt -130.59 137.84 49.85 Favored 'General case' 0 CA--C 1.499 -1.008 0 N-CA-C 108.687 -0.857 . . . . 43.77 108.687 177.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 39.0 mtm180 -108.18 -39.0 5.61 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.162 0.801 . . . . 67.67 113.162 178.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 43.3 p -135.07 166.7 22.45 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.779 -0.576 . . . . 45.47 111.235 -170.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -63.14 -32.95 85.89 Favored Glycine 0 CA--C 1.519 0.317 0 N-CA-C 111.316 -0.714 . . . . 45.03 111.316 174.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . 0.252 0.1 OUTLIER -71.69 -33.93 69.23 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 117.872 -1.531 . . . . 63.41 113.319 176.225 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -54.5 -48.32 72.01 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 121.85 0.833 . . . . 63.43 109.488 167.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -58.42 -42.23 86.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.534 -0.757 . . . . 48.4 111.776 -173.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.25 -35.79 80.27 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 113.721 1.008 . . . . 81.88 113.721 -175.703 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -75.64 -42.17 52.22 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 118.959 -1.097 . . . . 87.76 111.018 176.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -69.09 -29.01 67.02 Favored 'General case' 0 C--O 1.217 -0.619 0 C-N-CA 119.66 -0.816 . . . . 50.24 109.398 178.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -58.63 -49.41 77.59 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 120.724 -0.39 . . . . 50.46 111.248 176.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -59.02 -44.36 91.71 Favored 'General case' 0 C--O 1.248 1.006 0 CA-C-O 121.833 0.825 . . . . 57.68 110.075 -178.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 29.8 tpp -63.83 -41.43 97.84 Favored 'General case' 0 C--O 1.244 0.774 0 CA-C-N 115.539 -0.755 . . . . 58.97 111.075 -179.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.11 -41.43 86.24 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 119.764 -0.774 . . . . 25.01 111.428 -178.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -63.07 -43.65 97.98 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 121.474 0.654 . . . . 61.16 109.817 177.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 59.2 tpp -60.81 -48.48 81.63 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.695 -0.684 . . . . 34.46 110.464 177.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -60.32 -36.59 78.29 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.857 0.688 . . . . 32.62 112.857 179.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -66.37 -43.68 85.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 59.23 109.854 177.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -61.75 -47.91 83.09 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 115.942 -0.572 . . . . 40.17 112.203 179.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ILE . . . . . . . . . . . . . 20.5 pt -81.81 -25.05 9.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 114.258 1.207 . . . . 42.0 114.258 -171.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -137.37 -5.61 1.81 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 114.174 1.175 . . . . 40.87 114.174 -171.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 74.11 9.37 80.31 Favored Glycine 0 CA--C 1.522 0.506 0 C-N-CA 120.749 -0.739 . . . . 40.69 112.14 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 75.0 t -85.58 129.63 37.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 O-C-N 122.664 -0.315 . . . . 38.88 111.41 -177.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -91.48 156.48 17.67 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.298 -0.41 . . . . 60.3 111.977 -177.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 89.8 m -126.74 127.67 45.45 Favored 'General case' 0 C--O 1.242 0.707 0 O-C-N 123.779 0.674 . . . . 32.96 109.444 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -109.22 129.41 55.5 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 115.689 -0.687 . . . . 43.13 109.153 175.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -104.18 147.38 27.52 Favored 'General case' 0 C--O 1.218 -0.595 0 N-CA-C 109.129 -0.693 . . . . 33.69 109.129 -178.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -126.6 136.1 61.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 108.444 -0.947 . . . . 59.43 108.444 177.216 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -72.58 135.21 45.5 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.294 -0.632 . . . . 37.06 109.294 178.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 19.0 m -58.81 151.17 22.02 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 108.549 -0.908 . . . . 72.72 108.549 178.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -64.16 143.68 98.32 Favored Pre-proline 0 C--O 1.243 0.742 0 N-CA-C 107.127 -1.435 . . . . 39.97 107.127 168.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -56.59 -41.03 80.22 Favored 'Trans proline' 0 CA--C 1.52 -0.203 0 O-C-N 122.657 0.819 . . . . 38.92 111.983 -174.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ARG . . . . . 0.467 ' NH1' ' OH ' ' A' ' 122' ' ' TYR . 0.1 OUTLIER -67.64 -13.61 62.23 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 114.674 1.361 . . . . 92.57 114.674 -176.754 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' TYR . . . . . 0.467 ' OH ' ' NH1' ' A' ' 121' ' ' ARG . 26.0 m-85 -112.32 12.3 20.2 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.761 0.652 . . . . 56.1 112.761 178.236 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 59.7 p -58.59 -32.22 68.77 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.595 0.961 . . . . 42.93 113.595 -173.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -99.18 3.16 46.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.047 0.451 . . . . 36.74 111.701 -174.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 98.6 t -93.72 126.57 46.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 113.09 0.774 . . . . 45.16 113.09 -177.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 97.4 p -138.96 158.49 44.11 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.874 -0.787 . . . . 35.4 108.874 171.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 67.9 m -57.17 -45.6 83.53 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 109.682 -0.488 . . . . 36.42 109.682 178.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 30.8 m -61.37 -51.03 70.47 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 113.187 0.81 . . . . 64.82 113.187 -177.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 44.4 tp -67.44 -40.98 85.48 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 119.883 -0.727 . . . . 45.09 110.495 -177.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -53.58 -48.11 69.5 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.878 -0.329 . . . . 36.95 111.043 174.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 44.5 mtmt -62.59 -46.08 89.96 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.349 0.87 . . . . 48.36 113.349 -179.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 71.2 mt-10 -61.85 -44.23 97.26 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.781 0.324 . . . . 88.08 111.023 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 25.8 t -63.19 -47.49 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 C-N-CA 120.45 -0.5 . . . . 41.05 111.426 176.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ALA . . . . . 0.729 ' O ' ' O ' ' A' ' 302' ' ' HOH . . . -56.94 -46.51 82.03 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.52 0.563 . . . . 50.7 112.52 177.22 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 73.1 mtm -63.09 -22.52 66.91 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.273 -0.571 . . . . 115.42 112.497 -178.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 77.3 mt -96.48 5.11 51.5 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 113.628 0.974 . . . . 59.38 113.628 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 98.56 8.26 54.81 Favored Glycine 0 CA--C 1.521 0.426 0 N-CA-C 117.361 1.704 . . . . 51.49 117.361 174.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -86.45 157.1 29.9 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 117.382 0.591 . . . . 47.42 112.587 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -101.34 108.1 19.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.009 0.433 . . . . 70.28 110.289 -175.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 29.1 m -108.33 18.64 6.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.814 -0.63 . . . . 50.05 111.903 179.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 13.0 p -61.44 -24.5 66.59 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.88 1.437 . . . . 47.9 114.88 -174.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -80.26 -2.83 46.78 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.627 -0.671 . . . . 77.13 111.644 177.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 31.2 mt -110.05 -4.71 15.7 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 120.931 -0.308 . . . . 44.33 111.484 -175.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 46.9 mt -128.47 151.97 77.54 Favored Pre-proline 0 N--CA 1.466 0.325 0 C-N-CA 122.943 0.497 . . . . 42.33 111.016 -176.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -65.28 153.41 78.38 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 120.824 1.016 . . . . 39.79 109.903 175.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' GLU . . . . . 0.431 ' N ' ' CD ' ' A' ' 147' ' ' PRO . 34.9 tp10 -60.29 -37.29 45.89 Favored Pre-proline 0 N--CA 1.47 0.53 0 N-CA-C 114.046 1.128 . . . . 61.33 114.046 -177.553 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 146' ' ' GLU . 81.3 Cg_exo -57.18 -33.87 96.72 Favored 'Trans proline' 0 C--N 1.343 0.275 0 O-C-N 122.37 0.669 . . . . 51.01 112.373 175.73 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 72.4 t -74.25 -44.89 48.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 O-C-N 123.298 0.374 . . . . 40.32 111.699 172.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -55.73 -42.14 74.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.842 0.353 . . . . 41.83 111.309 178.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 16.0 mtm105 -57.53 -50.58 72.62 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.0 -0.546 . . . . 86.89 111.638 177.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' ARG . . . . . 0.425 ' NH2' ' OE2' ' A' ' 56' ' ' GLU . 58.0 mtt85 -71.31 -31.64 67.67 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.058 0.456 . . . . 59.65 111.247 -176.867 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 13.0 tp -66.06 -47.36 74.57 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 115.881 -0.6 . . . . 54.03 111.067 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 50.8 mtt180 -59.38 -43.19 92.95 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.959 0.409 . . . . 69.48 110.179 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -62.67 -44.26 96.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.733 -0.667 . . . . 104.97 111.165 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.2 -17.53 62.52 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.897 0.703 . . . . 93.19 112.897 -178.715 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -107.97 -2.8 19.4 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.21 0.448 . . . . 87.26 112.21 176.605 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 . . . . . 0 C--O 1.234 0.239 0 N-CA-C 109.7 -0.481 . . . . 92.5 109.7 168.954 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' EO8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . 0.766 ' O ' ' OD1' ' A' ' 19' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . 0.729 ' O ' ' O ' ' A' ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 orig full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 ptp . . . . . 0 CA--C 1.533 0.297 0 CA-C-O 120.734 0.302 . . . . 108.48 110.933 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 79.0 p -89.43 148.06 23.68 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.967 -0.753 . . . . 60.13 108.967 171.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLY . . . . . 0.466 ' HA3' ' CE ' ' A' ' 82' ' ' MET . . . -155.61 136.0 4.87 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.848 -0.691 . . . . 46.68 112.364 -179.157 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -118.94 141.56 48.55 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.897 -0.408 . . . . 41.27 109.897 179.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.3 t -104.79 128.72 58.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 108.723 -0.843 . . . . 34.36 108.723 171.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 72.6 m -106.72 101.47 36.81 Favored Pre-proline 0 C--N 1.327 -0.395 0 N-CA-C 109.026 -0.731 . . . . 37.89 109.026 173.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -97.46 157.21 0.99 Allowed 'Trans proline' 0 C--N 1.343 0.268 0 O-C-N 122.492 0.733 . . . . 36.7 111.122 -172.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLY . . . . . 0.43 ' HA2' ' O23' ' A' ' 201' ' ' EO8 . . . 170.52 176.26 39.82 Favored Glycine 0 C--O 1.236 0.265 0 N-CA-C 110.806 -0.918 . . . . 38.97 110.806 179.419 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.1 p -89.4 -25.05 21.76 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 119.715 -0.794 . . . . 48.69 111.081 176.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 42.42 60.99 2.16 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.563 0.745 . . . . 41.68 112.624 178.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -127.39 69.84 75.27 Favored Pre-proline 0 CA--C 1.538 0.511 0 CA-C-N 115.29 -0.868 . . . . 50.21 111.405 -173.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -100.61 171.96 7.86 Favored 'Cis proline' 0 N--CA 1.463 -0.302 0 O-C-N 122.004 0.476 . . . . 42.1 111.584 1.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.9 p -60.86 144.36 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 N-CA-C 109.762 -0.459 . . . . 36.61 109.762 171.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.0 p -116.66 173.27 6.72 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.896 -0.409 . . . . 36.93 109.896 -178.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.9 mt -68.46 -23.38 64.59 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 119.569 -0.852 . . . . 37.06 111.187 176.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.22 -47.2 83.19 Favored Glycine 0 C--O 1.227 -0.304 0 N-CA-C 108.744 -1.743 . . . . 31.25 108.744 174.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 33.4 m170 -56.77 -45.89 81.82 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 112.599 0.592 . . . . 38.67 112.599 175.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.8 t -62.88 -37.69 79.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 119.98 -0.688 . . . . 39.7 111.12 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASP . . . . . 0.766 ' OD1' ' O ' ' A' ' 301' ' ' HOH . 35.7 t70 -57.14 -45.89 83.17 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 122.473 0.309 . . . . 42.45 110.632 175.432 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 38.8 mm -61.18 -46.34 96.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 CA-C-O 120.566 0.222 . . . . 40.69 111.373 175.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 17.5 m-30 -56.11 -45.49 79.45 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 120.409 -0.517 . . . . 35.25 111.404 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -63.72 -41.68 98.03 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.154 0.502 . . . . 50.3 110.028 -177.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ARG . . . . . 0.643 ' NH2' HG13 ' A' ' 116' ' ' VAL . 54.2 mtp180 -71.74 -37.54 70.54 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.06 -0.656 . . . . 45.12 111.498 -179.098 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.0 -44.89 95.76 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 119.874 -0.73 . . . . 36.7 111.989 171.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.6 -23.6 67.32 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.138 0.421 . . . . 46.53 112.138 -176.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -78.46 -17.89 55.66 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.239 0.829 . . . . 43.01 113.239 179.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.4 mm-40 -113.32 -15.67 12.63 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 114.096 1.147 . . . . 51.89 114.096 -174.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -119.48 145.98 45.82 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 110.45 -0.204 . . . . 45.39 110.45 -177.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -58.38 -40.38 82.17 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 120.552 -0.459 . . . . 71.88 110.846 178.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLU . . . . . 0.536 ' OE1' ' HD3' ' A' ' 65' ' ' ARG . 73.9 tt0 -135.8 146.66 47.8 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.528 -0.305 . . . . 95.71 111.488 179.308 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 93.3 t -125.97 132.71 70.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 N-CA-C 108.274 -1.01 . . . . 44.11 108.274 174.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 84.9 t -116.95 118.85 60.16 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 N-CA-C 107.507 -1.294 . . . . 44.53 107.507 175.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.5 t -85.53 117.97 31.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 106.338 -1.727 . . . . 39.42 106.338 173.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.27 114.9 29.45 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.891 -0.411 . . . . 43.26 109.891 -179.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 21.9 mt -90.93 117.82 34.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 109.196 -0.668 . . . . 50.55 109.196 179.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 14.4 mt . . . . . 0 N--CA 1.464 0.273 0 N-CA-C 114.309 1.225 . . . . 75.28 114.309 -173.985 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.15 0 N-CA-C 112.175 -0.37 . . . . 72.66 112.175 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 35.3 ttm -90.21 -39.69 12.64 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 112.801 0.667 . . . . 67.19 112.801 -177.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -113.95 142.49 46.08 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 116.142 -0.481 . . . . 54.68 109.975 -178.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -76.12 172.5 12.69 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 119.331 -0.948 . . . . 95.57 110.183 176.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LEU . . . . . 0.432 HD12 ' HA ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -52.5 -50.0 63.66 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 113.967 1.099 . . . . 70.63 113.967 -174.697 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -61.18 -40.5 94.16 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.122 0.786 . . . . 101.27 113.122 -177.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -62.37 -45.63 92.29 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 109.675 -0.491 . . . . 88.62 109.675 177.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 69.7 mtt180 -59.36 -46.47 88.54 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.5 0.556 . . . . 54.17 112.5 -177.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ILE . . . . . 0.755 HD11 ' CG2' ' A' ' 68' ' ' VAL . 86.4 mt -58.17 -52.24 61.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.009 -0.542 . . . . 63.86 111.611 177.453 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.37 -43.71 83.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.068 -0.515 . . . . 51.19 111.148 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' MET . . . . . 0.405 ' CG ' ' HD2' ' A' ' 151' ' ' ARG . 78.7 mtm -63.67 -40.17 96.16 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.655 -0.418 . . . . 51.35 110.955 -179.648 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 67.5 t -66.89 -49.05 77.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 C-N-CA 119.566 -0.854 . . . . 43.24 109.439 177.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -56.68 -48.56 77.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.842 0.353 . . . . 71.73 111.827 179.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -62.86 -23.46 67.32 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.455 0.539 . . . . 68.83 112.455 -178.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.3 m -95.96 -2.2 47.53 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 113.657 0.984 . . . . 46.08 113.657 -176.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.0 p -131.06 19.79 4.94 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.551 0.945 . . . . 47.25 113.551 -173.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 49.9 p -61.87 -20.66 63.96 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.853 0.316 . . . . 55.63 111.853 -179.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 27.0 p-80 -84.01 8.81 14.1 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.44 -0.346 . . . . 53.73 111.757 177.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 93.9 mt -121.09 86.65 42.79 Favored Pre-proline 0 CA--C 1.537 0.455 0 CA-C-O 120.648 0.261 . . . . 52.13 111.015 -179.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -62.93 -28.35 75.18 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 121.569 1.513 . . . . 58.88 115.357 -171.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -95.67 19.32 11.36 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.565 0.58 . . . . 48.64 112.565 -177.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 8.8 tt -114.49 135.82 53.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.944 0.402 . . . . 47.35 110.194 179.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ARG . . . . . 0.627 ' NH2' ' OE1' ' A' ' 67' ' ' GLN . 0.3 OUTLIER -127.51 152.78 47.15 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.363 -0.535 . . . . 79.66 110.104 174.619 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -111.86 131.7 62.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 N-CA-C 110.119 -0.326 . . . . 51.61 110.119 -178.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLN . . . . . 0.627 ' OE1' ' NH2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -136.9 143.56 43.02 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 110.084 -0.339 . . . . 81.95 110.084 -177.709 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 68' ' ' VAL . . . . . 0.755 ' CG2' HD11 ' A' ' 51' ' ' ILE . 66.2 t -78.16 136.5 23.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 107.747 -1.205 . . . . 70.23 107.747 169.456 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -112.65 158.05 14.55 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 121.428 -0.415 . . . . 53.29 112.066 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' HIS . . . . . 0.873 ' HB2' ' O ' ' A' ' 350' ' ' HOH . 30.3 t-80 -144.69 141.51 29.36 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 122.763 -0.257 . . . . 97.18 110.589 173.811 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 80.9 -164.59 46.66 Favored Glycine 0 CA--C 1.517 0.209 0 N-CA-C 111.059 -0.817 . . . . 45.59 111.059 -178.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 76.5 mt -61.24 140.48 57.94 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.887 0.344 . . . . 44.73 111.769 -174.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 64.7 t -57.43 -41.52 78.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 120.366 -0.533 . . . . 39.35 111.375 175.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 25.3 m -63.52 -30.58 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 113.26 0.837 . . . . 34.18 113.26 -177.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -70.69 -35.19 72.66 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.625 -0.88 . . . . 66.44 108.625 176.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -65.51 -47.38 76.16 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.015 -0.735 . . . . 48.51 109.015 177.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 72.4 t -56.15 -52.28 52.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 N-CA-C 112.408 0.522 . . . . 39.7 112.408 177.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 51.1 mtp85 -66.54 -37.69 85.54 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 119.707 -0.797 . . . . 80.75 112.155 -177.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 32.0 m -63.81 -38.57 91.59 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.252 0.834 . . . . 65.73 113.252 177.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 69.7 m -75.86 -2.01 28.03 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.228 0.455 . . . . 109.17 112.228 178.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 64.79 18.16 63.74 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 110.948 -0.861 . . . . 55.64 110.948 -175.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' MET . . . . . 0.466 ' CE ' ' HA3' ' A' ' 3' ' ' GLY . 23.4 mmt -77.02 171.76 14.29 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 107.63 -1.248 . . . . 80.75 107.63 177.711 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 70.3 p -127.04 -2.99 6.43 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 114.329 1.233 . . . . 54.0 114.329 -164.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -173.25 160.14 3.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.21 0.529 . . . . 41.06 111.769 -173.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.6 mt -109.68 138.17 38.47 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 N-CA-C 105.843 -1.91 . . . . 32.27 105.843 174.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 54.4 t -124.23 132.6 71.1 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.311 0 N-CA-C 108.08 -1.081 . . . . 34.17 108.08 175.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.9 ptmt -144.81 160.41 41.3 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.005 0.743 . . . . 49.64 113.005 172.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -89.83 149.38 20.41 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 109.804 -1.318 . . . . 35.37 109.804 -175.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 73.8 mt -130.59 137.84 49.85 Favored 'General case' 0 CA--C 1.499 -1.008 0 N-CA-C 108.687 -0.857 . . . . 43.77 108.687 177.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ARG . . . . . 0.513 ' HD2' ' O ' ' A' ' 123' ' ' SER . 39.0 mtm180 -108.18 -39.0 5.61 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.162 0.801 . . . . 67.67 113.162 178.39 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 43.3 p -135.07 166.7 22.45 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.779 -0.576 . . . . 45.47 111.235 -170.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -63.14 -32.95 85.89 Favored Glycine 0 CA--C 1.519 0.317 0 N-CA-C 111.316 -0.714 . . . . 45.03 111.316 174.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . 0.252 0.1 OUTLIER -71.69 -33.93 69.23 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 117.872 -1.531 . . . . 63.41 113.319 176.225 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -54.5 -48.32 72.01 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 121.85 0.833 . . . . 63.43 109.488 167.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -58.42 -42.23 86.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.534 -0.757 . . . . 48.4 111.776 -173.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.25 -35.79 80.27 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 113.721 1.008 . . . . 81.88 113.721 -175.703 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -75.64 -42.17 52.22 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 118.959 -1.097 . . . . 87.76 111.018 176.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -69.09 -29.01 67.02 Favored 'General case' 0 C--O 1.217 -0.619 0 C-N-CA 119.66 -0.816 . . . . 50.24 109.398 178.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LEU . . . . . 0.603 ' O ' ' HG2' ' A' ' 103' ' ' GLN . 3.0 tm? -58.63 -49.41 77.59 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 120.724 -0.39 . . . . 50.46 111.248 176.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -59.02 -44.36 91.71 Favored 'General case' 0 C--O 1.248 1.006 0 CA-C-O 121.833 0.825 . . . . 57.68 110.075 -178.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 29.8 tpp -63.83 -41.43 97.84 Favored 'General case' 0 C--O 1.244 0.774 0 CA-C-N 115.539 -0.755 . . . . 58.97 111.075 -179.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.11 -41.43 86.24 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 119.764 -0.774 . . . . 25.01 111.428 -178.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLN . . . . . 0.603 ' HG2' ' O ' ' A' ' 99' ' ' LEU . 13.4 mm-40 -63.07 -43.65 97.98 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 121.474 0.654 . . . . 61.16 109.817 177.916 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 59.2 tpp -60.81 -48.48 81.63 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.695 -0.684 . . . . 34.46 110.464 177.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -60.32 -36.59 78.29 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.857 0.688 . . . . 32.62 112.857 179.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -66.37 -43.68 85.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 59.23 109.854 177.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -61.75 -47.91 83.09 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 115.942 -0.572 . . . . 40.17 112.203 179.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ILE . . . . . . . . . . . . . 20.5 pt -81.81 -25.05 9.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 114.258 1.207 . . . . 42.0 114.258 -171.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -137.37 -5.61 1.81 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 114.174 1.175 . . . . 40.87 114.174 -171.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 74.11 9.37 80.31 Favored Glycine 0 CA--C 1.522 0.506 0 C-N-CA 120.749 -0.739 . . . . 40.69 112.14 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 75.0 t -85.58 129.63 37.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 O-C-N 122.664 -0.315 . . . . 38.88 111.41 -177.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -91.48 156.48 17.67 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.298 -0.41 . . . . 60.3 111.977 -177.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 89.8 m -126.74 127.67 45.45 Favored 'General case' 0 C--O 1.242 0.707 0 O-C-N 123.779 0.674 . . . . 32.96 109.444 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -109.22 129.41 55.5 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 115.689 -0.687 . . . . 43.13 109.153 175.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -104.18 147.38 27.52 Favored 'General case' 0 C--O 1.218 -0.595 0 N-CA-C 109.129 -0.693 . . . . 33.69 109.129 -178.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' VAL . . . . . 0.643 HG13 ' NH2' ' A' ' 23' ' ' ARG . 1.0 OUTLIER -126.6 136.1 61.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 108.444 -0.947 . . . . 59.43 108.444 177.216 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -72.58 135.21 45.5 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.294 -0.632 . . . . 37.06 109.294 178.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . 0.687 HG22 ' O ' ' A' ' 119' ' ' ALA . 19.0 m -58.81 151.17 22.02 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 108.549 -0.908 . . . . 72.72 108.549 178.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ALA . . . . . 0.687 ' O ' HG22 ' A' ' 118' ' ' THR . . . -64.16 143.68 98.32 Favored Pre-proline 0 C--O 1.243 0.742 0 N-CA-C 107.127 -1.435 . . . . 39.97 107.127 168.889 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -56.59 -41.03 80.22 Favored 'Trans proline' 0 CA--C 1.52 -0.203 0 O-C-N 122.657 0.819 . . . . 38.92 111.983 -174.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ARG . . . . . 0.467 ' NH1' ' OH ' ' A' ' 122' ' ' TYR . 0.1 OUTLIER -67.64 -13.61 62.23 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 114.674 1.361 . . . . 92.57 114.674 -176.754 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 122' ' ' TYR . . . . . 0.467 ' OH ' ' NH1' ' A' ' 121' ' ' ARG . 26.0 m-85 -112.32 12.3 20.2 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.761 0.652 . . . . 56.1 112.761 178.236 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' SER . . . . . 0.513 ' O ' ' HD2' ' A' ' 90' ' ' ARG . 59.7 p -58.59 -32.22 68.77 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.595 0.961 . . . . 42.93 113.595 -173.58 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -99.18 3.16 46.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.047 0.451 . . . . 36.74 111.701 -174.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 98.6 t -93.72 126.57 46.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 113.09 0.774 . . . . 45.16 113.09 -177.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 97.4 p -138.96 158.49 44.11 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.874 -0.787 . . . . 35.4 108.874 171.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 67.9 m -57.17 -45.6 83.53 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 109.682 -0.488 . . . . 36.42 109.682 178.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 30.8 m -61.37 -51.03 70.47 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 113.187 0.81 . . . . 64.82 113.187 -177.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 44.4 tp -67.44 -40.98 85.48 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 119.883 -0.727 . . . . 45.09 110.495 -177.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -53.58 -48.11 69.5 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.878 -0.329 . . . . 36.95 111.043 174.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 44.5 mtmt -62.59 -46.08 89.96 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.349 0.87 . . . . 48.36 113.349 -179.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 71.2 mt-10 -61.85 -44.23 97.26 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.781 0.324 . . . . 88.08 111.023 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 25.8 t -63.19 -47.49 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 C-N-CA 120.45 -0.5 . . . . 41.05 111.426 176.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ALA . . . . . 0.729 ' O ' ' O ' ' A' ' 302' ' ' HOH . . . -56.94 -46.51 82.03 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.52 0.563 . . . . 50.7 112.52 177.22 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 73.1 mtm -63.09 -22.52 66.91 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.273 -0.571 . . . . 115.42 112.497 -178.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 77.3 mt -96.48 5.11 51.5 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 113.628 0.974 . . . . 59.38 113.628 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 98.56 8.26 54.81 Favored Glycine 0 CA--C 1.521 0.426 0 N-CA-C 117.361 1.704 . . . . 51.49 117.361 174.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -86.45 157.1 29.9 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 117.382 0.591 . . . . 47.42 112.587 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -101.34 108.1 19.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.009 0.433 . . . . 70.28 110.289 -175.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 29.1 m -108.33 18.64 6.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.814 -0.63 . . . . 50.05 111.903 179.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 13.0 p -61.44 -24.5 66.59 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.88 1.437 . . . . 47.9 114.88 -174.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -80.26 -2.83 46.78 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.627 -0.671 . . . . 77.13 111.644 177.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 31.2 mt -110.05 -4.71 15.7 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 120.931 -0.308 . . . . 44.33 111.484 -175.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 46.9 mt -128.47 151.97 77.54 Favored Pre-proline 0 N--CA 1.466 0.325 0 C-N-CA 122.943 0.497 . . . . 42.33 111.016 -176.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -65.28 153.41 78.38 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 120.824 1.016 . . . . 39.79 109.903 175.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' GLU . . . . . 0.431 ' N ' ' CD ' ' A' ' 147' ' ' PRO . 34.9 tp10 -60.29 -37.29 45.89 Favored Pre-proline 0 N--CA 1.47 0.53 0 N-CA-C 114.046 1.128 . . . . 61.33 114.046 -177.553 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 147' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 146' ' ' GLU . 81.3 Cg_exo -57.18 -33.87 96.72 Favored 'Trans proline' 0 C--N 1.343 0.275 0 O-C-N 122.37 0.669 . . . . 51.01 112.373 175.73 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 72.4 t -74.25 -44.89 48.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 O-C-N 123.298 0.374 . . . . 40.32 111.699 172.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -55.73 -42.14 74.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.842 0.353 . . . . 41.83 111.309 178.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 16.0 mtm105 -57.53 -50.58 72.62 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.0 -0.546 . . . . 86.89 111.638 177.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' ARG . . . . . 0.415 HH11 ' HG3' ' A' ' 151' ' ' ARG . 58.0 mtt85 -71.31 -31.64 67.67 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.058 0.456 . . . . 59.65 111.247 -176.867 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 13.0 tp -66.06 -47.36 74.57 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 115.881 -0.6 . . . . 54.03 111.067 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 50.8 mtt180 -59.38 -43.19 92.95 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.959 0.409 . . . . 69.48 110.179 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -62.67 -44.26 96.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.733 -0.667 . . . . 104.97 111.165 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' ARG . . . . . 0.424 ' HE ' ' HB3' ' A' ' 155' ' ' ARG . 0.0 OUTLIER -71.2 -17.53 62.52 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.897 0.703 . . . . 93.19 112.897 -178.715 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -107.97 -2.8 19.4 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.21 0.448 . . . . 87.26 112.21 176.605 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 . . . . . 0 C--O 1.234 0.239 0 N-CA-C 109.7 -0.481 . . . . 92.5 109.7 168.954 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' EO8 . . . . . 0.43 ' O23' ' HA2' ' A' ' 8' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . 0.766 ' O ' ' OD1' ' A' ' 19' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . 0.729 ' O ' ' O ' ' A' ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 build full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 350' ' ' HOH . . . . . 0.873 ' O ' ' HB2' ' A' ' 70' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 ptp . . . . . 0 CA--C 1.533 0.297 0 CA-C-O 120.734 0.302 . . . . 108.48 110.933 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 79.0 p -89.43 148.06 23.68 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 108.967 -0.753 . . . . 60.13 108.967 171.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.466 ' HA3' ' CE ' ' A' ' 82' ' ' MET . . . -155.61 136.0 4.87 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.848 -0.691 . . . . 46.68 112.364 -179.157 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -118.94 141.56 48.55 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.897 -0.408 . . . . 41.27 109.897 179.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.3 t -104.79 128.72 58.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 108.723 -0.843 . . . . 34.36 108.723 171.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 72.6 m -106.72 101.47 36.81 Favored Pre-proline 0 C--N 1.327 -0.395 0 N-CA-C 109.026 -0.731 . . . . 37.89 109.026 173.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -97.46 157.21 0.99 Allowed 'Trans proline' 0 C--N 1.343 0.268 0 O-C-N 122.492 0.733 . . . . 36.7 111.122 -172.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.43 ' HA2' ' O23' ' A' ' 201' ' ' EO8 . . . 170.52 176.26 39.82 Favored Glycine 0 C--O 1.236 0.265 0 N-CA-C 110.806 -0.918 . . . . 38.97 110.806 179.419 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.1 p -89.4 -25.05 21.76 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 119.715 -0.794 . . . . 48.69 111.081 176.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 42.42 60.99 2.16 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.563 0.745 . . . . 41.68 112.624 178.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -127.39 69.84 75.27 Favored Pre-proline 0 CA--C 1.538 0.511 0 CA-C-N 115.29 -0.868 . . . . 50.21 111.405 -173.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -100.61 171.96 7.86 Favored 'Cis proline' 0 N--CA 1.463 -0.302 0 O-C-N 122.004 0.476 . . . . 42.1 111.584 1.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.9 p -60.86 144.36 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 N-CA-C 109.762 -0.459 . . . . 36.61 109.762 171.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.0 p -116.66 173.27 6.72 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 109.896 -0.409 . . . . 36.93 109.896 -178.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.9 mt -68.46 -23.38 64.59 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 119.569 -0.852 . . . . 37.06 111.187 176.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.22 -47.2 83.19 Favored Glycine 0 C--O 1.227 -0.304 0 N-CA-C 108.744 -1.743 . . . . 31.25 108.744 174.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 33.4 m170 -56.77 -45.89 81.82 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 112.599 0.592 . . . . 38.67 112.599 175.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.8 t -62.88 -37.69 79.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 119.98 -0.688 . . . . 39.7 111.12 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.766 ' OD1' ' O ' ' A' ' 301' ' ' HOH . 35.7 t70 -57.14 -45.89 83.17 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 122.473 0.309 . . . . 42.45 110.632 175.432 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 38.8 mm -61.18 -46.34 96.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 CA-C-O 120.566 0.222 . . . . 40.69 111.373 175.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 17.5 m-30 -56.11 -45.49 79.45 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 120.409 -0.517 . . . . 35.25 111.404 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -63.72 -41.68 98.03 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.154 0.502 . . . . 50.3 110.028 -177.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.643 ' NH2' HG13 ' A' ' 116' ' ' VAL . 54.2 mtp180 -71.74 -37.54 70.54 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.06 -0.656 . . . . 45.12 111.498 -179.098 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.0 -44.89 95.76 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 119.874 -0.73 . . . . 36.7 111.989 171.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.6 -23.6 67.32 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.138 0.421 . . . . 46.53 112.138 -176.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -78.46 -17.89 55.66 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.239 0.829 . . . . 43.01 113.239 179.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.4 mm-40 -113.32 -15.67 12.63 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 114.096 1.147 . . . . 51.89 114.096 -174.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -119.48 145.98 45.82 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 110.45 -0.204 . . . . 45.39 110.45 -177.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -58.38 -40.38 82.17 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 120.552 -0.459 . . . . 71.88 110.846 178.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.536 ' OE1' ' HD3' ' A' ' 65' ' ' ARG . 73.9 tt0 -135.8 146.66 47.8 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.528 -0.305 . . . . 95.71 111.488 179.308 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 93.3 t -125.97 132.71 70.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 N-CA-C 108.274 -1.01 . . . . 44.11 108.274 174.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 84.9 t -116.95 118.85 60.16 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 N-CA-C 107.507 -1.294 . . . . 44.53 107.507 175.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.5 t -85.53 117.97 31.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 106.338 -1.727 . . . . 39.42 106.338 173.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.27 114.9 29.45 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.891 -0.411 . . . . 43.26 109.891 -179.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 21.9 mt -90.93 117.82 34.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 109.196 -0.668 . . . . 50.55 109.196 179.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 14.4 mt . . . . . 0 N--CA 1.464 0.273 0 N-CA-C 114.309 1.225 . . . . 75.28 114.309 -173.985 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.15 0 N-CA-C 112.175 -0.37 . . . . 72.66 112.175 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 35.3 ttm -90.21 -39.69 12.64 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 112.801 0.667 . . . . 67.19 112.801 -177.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -113.95 142.49 46.08 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 116.142 -0.481 . . . . 54.68 109.975 -178.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -76.12 172.5 12.69 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 119.331 -0.948 . . . . 95.57 110.183 176.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.432 HD12 ' HA ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -52.5 -50.0 63.66 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 113.967 1.099 . . . . 70.63 113.967 -174.697 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -61.18 -40.5 94.16 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.122 0.786 . . . . 101.27 113.122 -177.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -62.37 -45.63 92.29 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 109.675 -0.491 . . . . 88.62 109.675 177.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 69.7 mtt180 -59.36 -46.47 88.54 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.5 0.556 . . . . 54.17 112.5 -177.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.755 HD11 ' CG2' ' A' ' 68' ' ' VAL . 86.4 mt -58.17 -52.24 61.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.009 -0.542 . . . . 63.86 111.611 177.453 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.37 -43.71 83.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.068 -0.515 . . . . 51.19 111.148 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' MET . . . . . 0.405 ' CG ' ' HD2' ' A' ' 151' ' ' ARG . 78.7 mtm -63.67 -40.17 96.16 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.655 -0.418 . . . . 51.35 110.955 -179.648 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 67.5 t -66.89 -49.05 77.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 C-N-CA 119.566 -0.854 . . . . 43.24 109.439 177.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -56.68 -48.56 77.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.842 0.353 . . . . 71.73 111.827 179.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -62.86 -23.46 67.32 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.455 0.539 . . . . 68.83 112.455 -178.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.3 m -95.96 -2.2 47.53 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 113.657 0.984 . . . . 46.08 113.657 -176.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.0 p -131.06 19.79 4.94 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.551 0.945 . . . . 47.25 113.551 -173.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 49.9 p -61.87 -20.66 63.96 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.853 0.316 . . . . 55.63 111.853 -179.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 27.0 p-80 -84.01 8.81 14.1 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.44 -0.346 . . . . 53.73 111.757 177.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 93.9 mt -121.09 86.65 42.79 Favored Pre-proline 0 CA--C 1.537 0.455 0 CA-C-O 120.648 0.261 . . . . 52.13 111.015 -179.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -62.93 -28.35 75.18 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 121.569 1.513 . . . . 58.88 115.357 -171.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -95.67 19.32 11.36 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.565 0.58 . . . . 48.64 112.565 -177.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 8.8 tt -114.49 135.82 53.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.944 0.402 . . . . 47.35 110.194 179.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.627 ' NH2' ' OE1' ' A' ' 67' ' ' GLN . 0.3 OUTLIER -127.51 152.78 47.15 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.363 -0.535 . . . . 79.66 110.104 174.619 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 21.7 t -111.86 131.7 62.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 N-CA-C 110.119 -0.326 . . . . 51.61 110.119 -178.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.627 ' OE1' ' NH2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER -136.9 143.56 43.02 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 110.084 -0.339 . . . . 81.95 110.084 -177.709 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.755 ' CG2' HD11 ' A' ' 51' ' ' ILE . 66.2 t -78.16 136.5 23.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 107.747 -1.205 . . . . 70.23 107.747 169.456 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -112.65 158.05 14.55 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 121.428 -0.415 . . . . 53.29 112.066 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.873 ' HB2' ' O ' ' A' ' 350' ' ' HOH . 30.3 t-80 -144.69 141.51 29.36 Favored 'General case' 0 C--O 1.234 0.28 0 O-C-N 122.763 -0.257 . . . . 97.18 110.589 173.811 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 80.9 -164.59 46.66 Favored Glycine 0 CA--C 1.517 0.209 0 N-CA-C 111.059 -0.817 . . . . 45.59 111.059 -178.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 76.5 mt -61.24 140.48 57.94 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.887 0.344 . . . . 44.73 111.769 -174.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 64.7 t -57.43 -41.52 78.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 120.366 -0.533 . . . . 39.35 111.375 175.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 25.3 m -63.52 -30.58 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 113.26 0.837 . . . . 34.18 113.26 -177.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -70.69 -35.19 72.66 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.625 -0.88 . . . . 66.44 108.625 176.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -65.51 -47.38 76.16 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.015 -0.735 . . . . 48.51 109.015 177.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 72.4 t -56.15 -52.28 52.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 N-CA-C 112.408 0.522 . . . . 39.7 112.408 177.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 51.1 mtp85 -66.54 -37.69 85.54 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 119.707 -0.797 . . . . 80.75 112.155 -177.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 32.0 m -63.81 -38.57 91.59 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.252 0.834 . . . . 65.73 113.252 177.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 69.7 m -75.86 -2.01 28.03 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.228 0.455 . . . . 109.17 112.228 178.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 64.79 18.16 63.74 Favored Glycine 0 N--CA 1.451 -0.316 0 N-CA-C 110.948 -0.861 . . . . 55.64 110.948 -175.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' MET . . . . . 0.466 ' CE ' ' HA3' ' A' ' 3' ' ' GLY . 23.4 mmt -77.02 171.76 14.29 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 107.63 -1.248 . . . . 80.75 107.63 177.711 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 70.3 p -127.04 -2.99 6.43 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 114.329 1.233 . . . . 54.0 114.329 -164.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -173.25 160.14 3.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.21 0.529 . . . . 41.06 111.769 -173.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.6 mt -109.68 138.17 38.47 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 N-CA-C 105.843 -1.91 . . . . 32.27 105.843 174.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 54.4 t -124.23 132.6 71.1 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.311 0 N-CA-C 108.08 -1.081 . . . . 34.17 108.08 175.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 2.9 ptmt -144.81 160.41 41.3 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.005 0.743 . . . . 49.64 113.005 172.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -89.83 149.38 20.41 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 109.804 -1.318 . . . . 35.37 109.804 -175.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 73.8 mt -130.59 137.84 49.85 Favored 'General case' 0 CA--C 1.499 -1.008 0 N-CA-C 108.687 -0.857 . . . . 43.77 108.687 177.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.513 ' HD2' ' O ' ' A' ' 123' ' ' SER . 39.0 mtm180 -108.18 -39.0 5.61 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.162 0.801 . . . . 67.67 113.162 178.39 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 43.3 p -135.07 166.7 22.45 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.779 -0.576 . . . . 45.47 111.235 -170.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -63.14 -32.95 85.89 Favored Glycine 0 CA--C 1.519 0.317 0 N-CA-C 111.316 -0.714 . . . . 45.03 111.316 174.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . 0.252 0.1 OUTLIER -71.69 -33.93 69.23 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 117.872 -1.531 . . . . 63.41 113.319 176.225 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -54.5 -48.32 72.01 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 121.85 0.833 . . . . 63.43 109.488 167.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -58.42 -42.23 86.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.534 -0.757 . . . . 48.4 111.776 -173.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.25 -35.79 80.27 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 113.721 1.008 . . . . 81.88 113.721 -175.703 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -75.64 -42.17 52.22 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 118.959 -1.097 . . . . 87.76 111.018 176.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -69.09 -29.01 67.02 Favored 'General case' 0 C--O 1.217 -0.619 0 C-N-CA 119.66 -0.816 . . . . 50.24 109.398 178.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.603 ' O ' ' HG2' ' A' ' 103' ' ' GLN . 3.0 tm? -58.63 -49.41 77.59 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 120.724 -0.39 . . . . 50.46 111.248 176.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -59.02 -44.36 91.71 Favored 'General case' 0 C--O 1.248 1.006 0 CA-C-O 121.833 0.825 . . . . 57.68 110.075 -178.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 29.8 tpp -63.83 -41.43 97.84 Favored 'General case' 0 C--O 1.244 0.774 0 CA-C-N 115.539 -0.755 . . . . 58.97 111.075 -179.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.11 -41.43 86.24 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 119.764 -0.774 . . . . 25.01 111.428 -178.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.603 ' HG2' ' O ' ' A' ' 99' ' ' LEU . 13.4 mm-40 -63.07 -43.65 97.98 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 121.474 0.654 . . . . 61.16 109.817 177.916 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 59.2 tpp -60.81 -48.48 81.63 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.695 -0.684 . . . . 34.46 110.464 177.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -60.32 -36.59 78.29 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.857 0.688 . . . . 32.62 112.857 179.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -66.37 -43.68 85.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 59.23 109.854 177.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -61.75 -47.91 83.09 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 115.942 -0.572 . . . . 40.17 112.203 179.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ILE . . . . . . . . . . . . . 20.5 pt -81.81 -25.05 9.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 114.258 1.207 . . . . 42.0 114.258 -171.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -137.37 -5.61 1.81 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 114.174 1.175 . . . . 40.87 114.174 -171.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 74.11 9.37 80.31 Favored Glycine 0 CA--C 1.522 0.506 0 C-N-CA 120.749 -0.739 . . . . 40.69 112.14 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 75.0 t -85.58 129.63 37.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 O-C-N 122.664 -0.315 . . . . 38.88 111.41 -177.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -91.48 156.48 17.67 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.298 -0.41 . . . . 60.3 111.977 -177.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 89.8 m -126.74 127.67 45.45 Favored 'General case' 0 C--O 1.242 0.707 0 O-C-N 123.779 0.674 . . . . 32.96 109.444 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -109.22 129.41 55.5 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 115.689 -0.687 . . . . 43.13 109.153 175.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -104.18 147.38 27.52 Favored 'General case' 0 C--O 1.218 -0.595 0 N-CA-C 109.129 -0.693 . . . . 33.69 109.129 -178.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.643 HG13 ' NH2' ' A' ' 23' ' ' ARG . 1.0 OUTLIER -126.6 136.1 61.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 108.444 -0.947 . . . . 59.43 108.444 177.216 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -72.58 135.21 45.5 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.294 -0.632 . . . . 37.06 109.294 178.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . 0.687 HG22 ' O ' ' A' ' 119' ' ' ALA . 19.0 m -58.81 151.17 22.02 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 108.549 -0.908 . . . . 72.72 108.549 178.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.687 ' O ' HG22 ' A' ' 118' ' ' THR . . . -64.16 143.68 98.32 Favored Pre-proline 0 C--O 1.243 0.742 0 N-CA-C 107.127 -1.435 . . . . 39.97 107.127 168.889 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -56.59 -41.03 80.22 Favored 'Trans proline' 0 CA--C 1.52 -0.203 0 O-C-N 122.657 0.819 . . . . 38.92 111.983 -174.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.467 ' NH1' ' OH ' ' A' ' 122' ' ' TYR . 0.1 OUTLIER -67.64 -13.61 62.23 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 114.674 1.361 . . . . 92.57 114.674 -176.754 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' TYR . . . . . 0.467 ' OH ' ' NH1' ' A' ' 121' ' ' ARG . 26.0 m-85 -112.32 12.3 20.2 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.761 0.652 . . . . 56.1 112.761 178.236 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' SER . . . . . 0.513 ' O ' ' HD2' ' A' ' 90' ' ' ARG . 59.7 p -58.59 -32.22 68.77 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.595 0.961 . . . . 42.93 113.595 -173.58 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -99.18 3.16 46.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.047 0.451 . . . . 36.74 111.701 -174.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 98.6 t -93.72 126.57 46.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 113.09 0.774 . . . . 45.16 113.09 -177.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 97.4 p -138.96 158.49 44.11 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.874 -0.787 . . . . 35.4 108.874 171.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 67.9 m -57.17 -45.6 83.53 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 109.682 -0.488 . . . . 36.42 109.682 178.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 30.8 m -61.37 -51.03 70.47 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 113.187 0.81 . . . . 64.82 113.187 -177.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 44.4 tp -67.44 -40.98 85.48 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 119.883 -0.727 . . . . 45.09 110.495 -177.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -53.58 -48.11 69.5 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.878 -0.329 . . . . 36.95 111.043 174.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 44.5 mtmt -62.59 -46.08 89.96 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.349 0.87 . . . . 48.36 113.349 -179.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 71.2 mt-10 -61.85 -44.23 97.26 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.781 0.324 . . . . 88.08 111.023 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 25.8 t -63.19 -47.49 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 C-N-CA 120.45 -0.5 . . . . 41.05 111.426 176.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ALA . . . . . 0.729 ' O ' ' O ' ' A' ' 302' ' ' HOH . . . -56.94 -46.51 82.03 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.52 0.563 . . . . 50.7 112.52 177.22 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 73.1 mtm -63.09 -22.52 66.91 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.273 -0.571 . . . . 115.42 112.497 -178.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 77.3 mt -96.48 5.11 51.5 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 113.628 0.974 . . . . 59.38 113.628 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . 98.56 8.26 54.81 Favored Glycine 0 CA--C 1.521 0.426 0 N-CA-C 117.361 1.704 . . . . 51.49 117.361 174.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -86.45 157.1 29.9 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 117.382 0.591 . . . . 47.42 112.587 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -101.34 108.1 19.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.009 0.433 . . . . 70.28 110.289 -175.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 29.1 m -108.33 18.64 6.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.814 -0.63 . . . . 50.05 111.903 179.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 13.0 p -61.44 -24.5 66.59 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.88 1.437 . . . . 47.9 114.88 -174.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -80.26 -2.83 46.78 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.627 -0.671 . . . . 77.13 111.644 177.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 31.2 mt -110.05 -4.71 15.7 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 120.931 -0.308 . . . . 44.33 111.484 -175.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 46.9 mt -128.47 151.97 77.54 Favored Pre-proline 0 N--CA 1.466 0.325 0 C-N-CA 122.943 0.497 . . . . 42.33 111.016 -176.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -65.28 153.41 78.38 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 120.824 1.016 . . . . 39.79 109.903 175.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.431 ' N ' ' CD ' ' A' ' 147' ' ' PRO . 34.9 tp10 -60.29 -37.29 45.89 Favored Pre-proline 0 N--CA 1.47 0.53 0 N-CA-C 114.046 1.128 . . . . 61.33 114.046 -177.553 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 146' ' ' GLU . 81.3 Cg_exo -57.18 -33.87 96.72 Favored 'Trans proline' 0 C--N 1.343 0.275 0 O-C-N 122.37 0.669 . . . . 51.01 112.373 175.73 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 72.4 t -74.25 -44.89 48.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 O-C-N 123.298 0.374 . . . . 40.32 111.699 172.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -55.73 -42.14 74.92 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.842 0.353 . . . . 41.83 111.309 178.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 16.0 mtm105 -57.53 -50.58 72.62 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.0 -0.546 . . . . 86.89 111.638 177.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' ARG . . . . . 0.415 HH11 ' HG3' ' A' ' 151' ' ' ARG . 58.0 mtt85 -71.31 -31.64 67.67 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.058 0.456 . . . . 59.65 111.247 -176.867 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' LEU . . . . . . . . . . . . . 13.0 tp -66.06 -47.36 74.57 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 115.881 -0.6 . . . . 54.03 111.067 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 50.8 mtt180 -59.38 -43.19 92.95 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.959 0.409 . . . . 69.48 110.179 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -62.67 -44.26 96.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.733 -0.667 . . . . 104.97 111.165 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' ARG . . . . . 0.424 ' HE ' ' HB3' ' A' ' 155' ' ' ARG . 0.0 OUTLIER -71.2 -17.53 62.52 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.897 0.703 . . . . 93.19 112.897 -178.715 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -107.97 -2.8 19.4 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.21 0.448 . . . . 87.26 112.21 176.605 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 . . . . . 0 C--O 1.234 0.239 0 N-CA-C 109.7 -0.481 . . . . 92.5 109.7 168.954 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' EO8 . . . . . 0.43 ' O23' ' HA2' ' A' ' 8' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . 0.766 ' O ' ' OD1' ' A' ' 19' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . 0.729 ' O ' ' O ' ' A' ' 134' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . 001 ecloud nobuild full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 350' ' ' HOH . . . . . 0.873 ' O ' ' HB2' ' A' ' 70' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_