data_1erw_residue 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 1erw _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.0 ptt? . . . . . 0 N--CA 1.468 0.431 0 N-CA-C 101.533 -3.506 . . . . 68.12 101.533 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 43.0 t -74.3 114.82 14.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 CA-C-N 123.764 2.984 . . . . 36.67 109.335 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 51.8 mttm -83.52 116.07 22.39 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 112.498 -2.137 . . . . 31.68 108.112 177.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -76.43 122.69 24.87 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.332 -0.849 . . . . 23.65 111.586 173.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 27.8 mm -100.01 121.68 51.0 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.831 0 C-N-CA 123.497 0.719 . . . . 13.86 109.938 -176.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -121.42 22.69 10.66 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 116.228 1.936 . . . . 17.47 116.228 179.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 58.7 p -169.13 160.7 9.95 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 124.696 1.198 . . . . 15.71 112.471 172.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -64.05 -36.08 82.82 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.817 1.247 . . . . 32.16 109.135 175.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 85.1 m -58.54 -49.35 77.73 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.922 0.889 . . . . 21.02 111.648 176.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.15 -40.43 96.15 Favored 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 125.346 1.459 . . . . 12.35 109.788 -179.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -63.11 -52.17 63.67 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 122.072 0.939 . . . . 18.7 112.16 177.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -59.26 -44.94 92.38 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 120.098 -1.627 . . . . 30.23 109.461 177.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -60.12 -44.11 95.14 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 118.401 -2.687 . . . . 44.45 112.234 178.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.91 -38.88 92.72 Favored 'General case' 0 C--N 1.345 0.378 0 N-CA-C 112.25 0.463 . . . . 16.47 112.25 177.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.5 mt -71.55 -25.24 62.13 Favored 'General case' 0 N--CA 1.427 -1.604 0 O-C-N 120.012 -1.68 . . . . 15.84 110.004 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -79.11 -47.5 16.0 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 120.103 1.319 . . . . 32.66 109.253 177.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.43 -20.44 64.51 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 117.747 2.499 . . . . 19.45 117.747 179.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.94 -22.26 64.15 Favored 'General case' 0 C--O 1.226 -0.183 0 O-C-N 120.981 -1.074 . . . . 19.88 111.513 -176.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 60.72 -113.32 5.43 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-O 123.867 1.815 . . . . 22.83 113.783 -176.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.26 -18.75 29.5 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 112.452 -1.874 . . . . 44.18 114.305 -177.823 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.1 mttt -65.09 142.89 58.23 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 116.839 2.163 . . . . 24.79 116.839 -174.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 53.4 tp -59.97 136.39 58.0 Favored 'General case' 0 CA--C 1.549 0.911 0 O-C-N 120.647 -1.283 . . . . 14.73 111.442 166.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.2 t -116.24 128.14 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 N-CA-C 104.222 -2.51 . . . . 12.38 104.222 173.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.5 t -112.32 129.18 68.3 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 N-CA-C 103.805 -2.665 . . . . 12.91 103.805 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 48.5 t -119.82 125.48 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 105.396 -2.075 . . . . 9.91 105.396 -177.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -96.29 111.61 23.62 Favored 'General case' 0 N--CA 1.436 -1.166 0 N-CA-C 108.373 -0.973 . . . . 15.1 108.373 171.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -87.02 112.72 22.13 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 120.03 -1.669 . . . . 11.29 107.912 170.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.5 p -125.86 169.55 12.52 Favored 'General case' 0 C--O 1.245 0.862 0 CA-C-N 120.586 1.539 . . . . 21.19 114.126 -175.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -142.56 152.36 42.51 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 103.741 -2.689 . . . . 17.14 103.741 175.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.9 p -68.73 -28.45 66.83 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.261 -0.882 . . . . 30.16 111.88 -177.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 56.6 p-90 -82.18 1.58 35.7 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 115.797 1.777 . . . . 27.14 115.797 178.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.2 t -104.49 124.34 49.1 Favored 'General case' 0 N--CA 1.421 -1.902 0 C-N-CA 117.555 -1.658 . . . . 21.81 108.815 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.73 -54.48 37.24 Favored Glycine 0 CA--C 1.531 1.06 0 CA-C-N 111.917 -2.401 . . . . 17.74 110.437 172.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_exo -47.13 -46.45 19.21 Favored 'Trans proline' 0 C--O 1.255 1.334 0 C-N-CA 124.565 3.51 . . . . 20.36 115.71 172.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.3 m -59.21 -44.81 92.26 Favored 'General case' 0 C--N 1.357 0.894 0 CA-C-N 119.158 0.89 . . . . 18.74 112.782 176.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -62.21 -38.86 90.77 Favored 'General case' 0 CA--C 1.5 -0.974 0 O-C-N 118.099 -2.875 . . . . 49.47 117.395 175.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.97 -45.39 93.86 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 124.54 1.136 . . . . 44.19 111.151 -178.95 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 8.8 tt -85.17 -10.47 11.45 Favored 'Isoleucine or valine' 0 C--O 1.254 1.319 0 N-CA-C 115.152 1.538 . . . . 17.52 115.152 -177.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.6 ttpp -60.37 -44.06 94.87 Favored Pre-proline 0 CA--C 1.546 0.802 0 N-CA-C 115.314 1.598 . . . . 41.53 115.314 -175.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -59.27 -37.29 91.94 Favored 'Trans proline' 0 C--N 1.357 0.974 0 CA-C-N 125.358 2.949 . . . . 17.8 116.399 169.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -66.7 -39.5 88.1 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.59 -0.694 . . . . 13.8 110.398 176.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -57.85 -46.19 85.16 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 122.981 1.372 . . . . 12.83 109.904 176.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -67.6 -37.48 82.61 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 115.237 -2.316 . . . . 16.92 107.962 177.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 57.8 p -69.8 -29.71 67.07 Favored 'General case' 0 N--CA 1.441 -0.893 1 CA-C-N 127.387 4.63 . . . . 18.53 111.338 179.081 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.7 mt -65.13 -36.07 83.1 Favored 'General case' 0 CA--C 1.498 -1.047 0 O-C-N 120.641 -1.287 . . . . 13.22 109.44 179.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.2 p -68.73 -21.69 64.37 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 114.779 1.4 . . . . 20.99 114.779 177.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -89.63 -18.63 26.13 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 119.498 -2.001 . . . . 38.13 109.565 174.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -83.19 -45.62 13.68 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.319 -1.488 . . . . 20.48 111.594 177.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -104.36 97.48 7.41 Favored 'General case' 0 C--O 1.216 -0.666 0 O-C-N 118.793 -2.442 . . . . 20.45 107.695 -178.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.1 m -73.37 -23.83 60.24 Favored 'General case' 0 C--N 1.315 -0.929 0 O-C-N 119.518 -1.989 . . . . 32.98 114.976 179.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -92.81 21.69 5.41 Favored 'General case' 0 C--O 1.247 0.966 0 O-C-N 125.335 1.647 . . . . 33.86 115.093 -177.681 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 79.8 t -132.47 143.6 39.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 N-CA-C 102.35 -3.204 . . . . 17.74 102.35 179.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 33.3 mm -104.55 137.42 33.73 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 O-C-N 117.159 -3.463 . . . . 22.91 104.479 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -119.17 121.76 40.48 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.171 -1.418 . . . . 12.01 107.171 -175.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -118.16 147.56 43.22 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 119.653 1.115 . . . . 15.3 109.128 -179.496 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -118.87 130.19 55.61 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 122.268 1.032 . . . . 27.14 109.717 171.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 79.2 t -126.6 110.47 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 N-CA-C 106.987 -1.486 . . . . 12.2 106.987 179.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -78.96 122.68 26.45 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 104.437 -2.431 . . . . 27.75 104.437 175.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 23.0 m -64.98 -17.5 21.95 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 N-CA-C 116.13 1.9 . . . . 18.11 116.13 -177.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -88.16 -28.41 21.24 Favored 'General case' 0 C--N 1.321 -0.669 0 O-C-N 119.079 -2.263 . . . . 34.43 110.355 174.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -70.11 -42.74 72.25 Favored 'General case' 0 CA--C 1.505 -0.762 0 O-C-N 119.527 -1.983 . . . . 22.15 114.016 171.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 66.6 m -114.42 66.14 0.67 Allowed 'General case' 0 N--CA 1.429 -1.478 0 CA-C-N 111.974 -2.375 . . . . 22.02 110.578 -174.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -68.02 -30.55 69.81 Favored 'General case' 0 N--CA 1.441 -0.913 0 N-CA-C 114.286 1.217 . . . . 32.24 114.286 -178.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -68.21 -38.81 82.32 Favored 'General case' 0 C--N 1.349 0.581 0 O-C-N 119.949 -1.719 . . . . 28.29 112.385 176.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.3 t -66.31 -46.53 86.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.836 0 N-CA-C 107.835 -1.172 . . . . 15.96 107.835 176.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.88 -45.21 86.73 Favored 'General case' 0 C--N 1.356 0.867 0 O-C-N 119.337 -2.102 . . . . 13.6 110.181 178.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.8 t -69.11 -44.41 72.5 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 124.897 1.279 . . . . 23.05 110.061 -179.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.12 -42.73 81.44 Favored 'General case' 0 C--O 1.245 0.825 0 CA-C-N 121.843 2.11 . . . . 44.83 113.562 175.601 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 73.3 m -83.95 1.19 44.73 Favored 'General case' 0 C--N 1.355 0.84 0 N-CA-C 114.624 1.342 . . . . 17.08 114.624 -178.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 54.04 47.23 23.81 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 116.69 2.107 . . . . 30.04 116.69 175.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 72.7 t -72.12 132.33 33.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-N 113.434 -1.712 . . . . 16.12 107.993 179.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.1 mmtm -110.46 -45.03 3.59 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 114.769 -1.105 . . . . 29.87 110.051 -177.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 75.6 m -121.81 161.8 22.03 Favored 'General case' 0 CA--C 1.503 -0.86 0 C-N-CA 125.115 1.366 . . . . 20.42 111.058 -168.905 -61.237 0.0 0.0 0.0 0.0 0.0 0.0 -61.237 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.3 tpp -119.64 123.82 28.36 Favored Pre-proline 0 C--N 1.309 -1.154 0 CA-C-O 115.74 -2.076 . . . . 30.7 108.598 -175.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_endo -77.78 156.37 95.24 Favored 'Cis proline' 0 CA--C 1.54 0.786 0 CA-C-N 124.694 2.712 . . . . 13.93 112.426 -12.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.6 m -120.0 136.9 54.38 Favored 'General case' 0 C--O 1.244 0.81 0 N-CA-C 106.033 -1.84 . . . . 11.67 106.033 168.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -109.99 121.15 44.58 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 107.062 -1.459 . . . . 13.68 107.062 173.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -112.35 147.46 36.33 Favored 'General case' 0 C--O 1.248 1.01 0 N-CA-C 107.684 -1.228 . . . . 13.84 107.684 172.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -120.49 136.67 54.69 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 106.579 -1.637 . . . . 13.28 106.579 -173.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -132.75 141.57 48.59 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.919 -1.141 . . . . 15.2 107.919 -175.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.2 tttp -139.37 117.21 11.61 Favored 'General case' 0 C--O 1.205 -1.283 0 N-CA-C 103.953 -2.61 . . . . 37.97 103.953 173.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 16.4 mttt 48.55 61.53 3.01 Favored 'General case' 0 C--N 1.272 -2.771 0 CA-C-N 109.726 -3.397 . . . . 43.22 110.467 -175.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.27 -4.47 11.95 Favored Glycine 0 C--N 1.341 0.854 0 CA-C-O 118.282 -1.288 . . . . 24.5 114.868 176.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -104.93 138.24 41.47 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 120.899 2.349 . . . . 42.93 107.166 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -81.54 117.9 22.31 Favored 'General case' 0 CA--C 1.502 -0.867 0 CA-C-O 126.255 2.931 . . . . 25.58 107.253 174.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.0 m -113.04 2.21 8.5 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 CA-C-N 111.347 -2.66 . . . . 15.34 117.432 -177.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -176.58 162.66 31.34 Favored Glycine 0 CA--C 1.553 2.413 0 O-C-N 119.689 -1.882 . . . . 14.33 110.316 174.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -170.52 141.63 1.95 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.154 -1.424 . . . . 29.55 107.154 -179.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -155.97 160.13 39.81 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 125.66 1.85 . . . . 14.38 108.793 165.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.9 p -113.65 160.29 18.75 Favored 'General case' 0 C--O 1.249 1.078 0 C-N-CA 124.835 1.254 . . . . 19.89 113.198 174.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 102.05 156.28 26.09 Favored Glycine 0 C--O 1.247 0.962 0 CA-C-O 121.733 0.63 . . . . 14.65 112.472 -177.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -90.57 54.68 2.78 Favored 'General case' 0 C--O 1.248 1.005 0 N-CA-C 117.957 2.577 . . . . 23.44 117.957 -177.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 37.2 t-20 -94.65 103.1 15.02 Favored 'General case' 0 C--O 1.242 0.676 0 O-C-N 119.134 -2.228 . . . . 20.0 109.198 -176.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -62.58 -39.51 93.92 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 123.719 1.723 . . . . 20.53 114.198 -177.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.16 -38.12 63.79 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 120.252 -1.53 . . . . 41.78 110.674 -176.398 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -72.17 -32.45 66.86 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 119.215 -0.994 . . . . 23.19 108.397 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 33.0 tp -63.19 -48.21 79.32 Favored 'General case' 0 CA--C 1.503 -0.828 0 O-C-N 119.107 -2.246 . . . . 14.28 110.578 179.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 66.2 tt0 -70.91 -36.8 72.85 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 122.688 1.232 . . . . 18.79 112.654 179.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.95 -40.12 92.1 Favored 'General case' 0 N--CA 1.438 -1.033 0 CA-C-O 117.177 -1.392 . . . . 18.69 109.838 176.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 27.7 m -70.35 -36.54 74.26 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 121.8 2.091 . . . . 15.07 113.497 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 49.9 mt -58.67 -44.31 89.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 106.452 -1.684 . . . . 15.06 106.452 174.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -69.95 -33.62 72.34 Favored 'General case' 0 C--N 1.315 -0.919 0 O-C-N 117.431 -3.293 . . . . 25.49 113.435 -178.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -67.15 -38.35 85.34 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 107.874 -1.158 . . . . 19.32 107.874 177.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 94.5 mt -95.52 -18.25 20.79 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 119.246 3.054 . . . . 22.01 119.246 -170.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 13.7 p . . . . . 0 C--N 1.319 -0.744 0 CA-C-N 119.771 1.169 . . . . 26.57 112.134 -172.225 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.0 ptt? . . . . . 0 N--CA 1.468 0.431 0 N-CA-C 101.533 -3.506 . . . . 68.12 101.533 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 43.0 t -74.3 114.82 14.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 CA-C-N 123.764 2.984 . . . . 36.67 109.335 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 51.8 mttm -83.52 116.07 22.39 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 112.498 -2.137 . . . . 31.68 108.112 177.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -76.43 122.69 24.87 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.332 -0.849 . . . . 23.65 111.586 173.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ILE . . . . . 0.413 ' HB ' HG22 ' A' ' 57' ' ' VAL . 27.8 mm -100.01 121.68 51.0 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.831 0 C-N-CA 123.497 0.719 . . . . 13.86 109.938 -176.005 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -121.42 22.69 10.66 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 116.228 1.936 . . . . 17.47 116.228 179.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 58.7 p -169.13 160.7 9.95 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 124.696 1.198 . . . . 15.71 112.471 172.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -64.05 -36.08 82.82 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.817 1.247 . . . . 32.16 109.135 175.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 85.1 m -58.54 -49.35 77.73 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.922 0.889 . . . . 21.02 111.648 176.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.15 -40.43 96.15 Favored 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 125.346 1.459 . . . . 12.35 109.788 -179.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -63.11 -52.17 63.67 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 122.072 0.939 . . . . 18.7 112.16 177.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -59.26 -44.94 92.38 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 120.098 -1.627 . . . . 30.23 109.461 177.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -60.12 -44.11 95.14 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 118.401 -2.687 . . . . 44.45 112.234 178.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.91 -38.88 92.72 Favored 'General case' 0 C--N 1.345 0.378 0 N-CA-C 112.25 0.463 . . . . 16.47 112.25 177.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.5 mt -71.55 -25.24 62.13 Favored 'General case' 0 N--CA 1.427 -1.604 0 O-C-N 120.012 -1.68 . . . . 15.84 110.004 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -79.11 -47.5 16.0 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 120.103 1.319 . . . . 32.66 109.253 177.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.43 -20.44 64.51 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 117.747 2.499 . . . . 19.45 117.747 179.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.94 -22.26 64.15 Favored 'General case' 0 C--O 1.226 -0.183 0 O-C-N 120.981 -1.074 . . . . 19.88 111.513 -176.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 60.72 -113.32 5.43 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-O 123.867 1.815 . . . . 22.83 113.783 -176.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.26 -18.75 29.5 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 112.452 -1.874 . . . . 44.18 114.305 -177.823 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.1 mttt -65.09 142.89 58.23 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 116.839 2.163 . . . . 24.79 116.839 -174.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 53.4 tp -59.97 136.39 58.0 Favored 'General case' 0 CA--C 1.549 0.911 0 O-C-N 120.647 -1.283 . . . . 14.73 111.442 166.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.2 t -116.24 128.14 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 N-CA-C 104.222 -2.51 . . . . 12.38 104.222 173.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.5 t -112.32 129.18 68.3 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 N-CA-C 103.805 -2.665 . . . . 12.91 103.805 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 48.5 t -119.82 125.48 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 105.396 -2.075 . . . . 9.91 105.396 -177.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -96.29 111.61 23.62 Favored 'General case' 0 N--CA 1.436 -1.166 0 N-CA-C 108.373 -0.973 . . . . 15.1 108.373 171.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -87.02 112.72 22.13 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 120.03 -1.669 . . . . 11.29 107.912 170.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.5 p -125.86 169.55 12.52 Favored 'General case' 0 C--O 1.245 0.862 0 CA-C-N 120.586 1.539 . . . . 21.19 114.126 -175.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -142.56 152.36 42.51 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 103.741 -2.689 . . . . 17.14 103.741 175.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.9 p -68.73 -28.45 66.83 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.261 -0.882 . . . . 30.16 111.88 -177.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 56.6 p-90 -82.18 1.58 35.7 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 115.797 1.777 . . . . 27.14 115.797 178.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.2 t -104.49 124.34 49.1 Favored 'General case' 0 N--CA 1.421 -1.902 0 C-N-CA 117.555 -1.658 . . . . 21.81 108.815 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.73 -54.48 37.24 Favored Glycine 0 CA--C 1.531 1.06 0 CA-C-N 111.917 -2.401 . . . . 17.74 110.437 172.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_exo -47.13 -46.45 19.21 Favored 'Trans proline' 0 C--O 1.255 1.334 0 C-N-CA 124.565 3.51 . . . . 20.36 115.71 172.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.3 m -59.21 -44.81 92.26 Favored 'General case' 0 C--N 1.357 0.894 0 CA-C-N 119.158 0.89 . . . . 18.74 112.782 176.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -62.21 -38.86 90.77 Favored 'General case' 0 CA--C 1.5 -0.974 0 O-C-N 118.099 -2.875 . . . . 49.47 117.395 175.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.97 -45.39 93.86 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 124.54 1.136 . . . . 44.19 111.151 -178.95 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 8.8 tt -85.17 -10.47 11.45 Favored 'Isoleucine or valine' 0 C--O 1.254 1.319 0 N-CA-C 115.152 1.538 . . . . 17.52 115.152 -177.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.6 ttpp -60.37 -44.06 94.87 Favored Pre-proline 0 CA--C 1.546 0.802 0 N-CA-C 115.314 1.598 . . . . 41.53 115.314 -175.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -59.27 -37.29 91.94 Favored 'Trans proline' 0 C--N 1.357 0.974 0 CA-C-N 125.358 2.949 . . . . 17.8 116.399 169.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -66.7 -39.5 88.1 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.59 -0.694 . . . . 13.8 110.398 176.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -57.85 -46.19 85.16 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 122.981 1.372 . . . . 12.83 109.904 176.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -67.6 -37.48 82.61 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 115.237 -2.316 . . . . 22.96 107.962 177.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 57.8 p -69.8 -29.71 67.07 Favored 'General case' 0 N--CA 1.441 -0.893 1 CA-C-N 127.387 4.63 . . . . 18.53 111.338 179.081 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.7 mt -65.13 -36.07 83.1 Favored 'General case' 0 CA--C 1.498 -1.047 0 O-C-N 120.641 -1.287 . . . . 13.22 109.44 179.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' SER . . . . . 0.522 ' HA ' ' CE1' ' A' ' 54' ' ' PHE . 52.2 p -68.73 -21.69 64.37 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 114.779 1.4 . . . . 20.99 114.779 177.805 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -89.63 -18.63 26.13 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 119.498 -2.001 . . . . 38.13 109.565 174.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -83.19 -45.62 13.68 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.319 -1.488 . . . . 20.48 111.594 177.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -104.36 97.48 7.41 Favored 'General case' 0 C--O 1.216 -0.666 0 O-C-N 118.793 -2.442 . . . . 20.45 107.695 -178.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.1 m -73.37 -23.83 60.24 Favored 'General case' 0 C--N 1.315 -0.929 0 O-C-N 119.518 -1.989 . . . . 32.98 114.976 179.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -92.81 21.69 5.41 Favored 'General case' 0 C--O 1.247 0.966 0 O-C-N 125.335 1.647 . . . . 33.86 115.093 -177.681 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 79.8 t -132.47 143.6 39.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 N-CA-C 102.35 -3.204 . . . . 17.74 102.35 179.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 33.3 mm -104.55 137.42 33.73 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 O-C-N 117.159 -3.463 . . . . 22.91 104.479 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PHE . . . . . 0.522 ' CE1' ' HA ' ' A' ' 46' ' ' SER . 82.5 m-85 -119.17 121.76 40.48 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.171 -1.418 . . . . 12.01 107.171 -175.335 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -118.16 147.56 43.22 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 119.653 1.115 . . . . 15.3 109.128 -179.496 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -118.87 130.19 55.61 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 122.268 1.032 . . . . 27.14 109.717 171.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . 0.413 HG22 ' HB ' ' A' ' 5' ' ' ILE . 79.2 t -126.6 110.47 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 N-CA-C 106.987 -1.486 . . . . 12.2 106.987 179.531 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -78.96 122.68 26.45 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 104.437 -2.431 . . . . 27.75 104.437 175.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 23.0 m -64.98 -17.5 21.95 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 N-CA-C 116.13 1.9 . . . . 18.11 116.13 -177.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -88.16 -28.41 21.24 Favored 'General case' 0 C--N 1.321 -0.669 0 O-C-N 119.079 -2.263 . . . . 34.43 110.355 174.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -70.11 -42.74 72.25 Favored 'General case' 0 CA--C 1.505 -0.762 0 O-C-N 119.527 -1.983 . . . . 22.15 114.016 171.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 66.6 m -114.42 66.14 0.67 Allowed 'General case' 0 N--CA 1.429 -1.478 0 CA-C-N 111.974 -2.375 . . . . 22.02 110.578 -174.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -68.02 -30.55 69.81 Favored 'General case' 0 N--CA 1.441 -0.913 0 N-CA-C 114.286 1.217 . . . . 32.24 114.286 -178.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -68.21 -38.81 82.32 Favored 'General case' 0 C--N 1.349 0.581 0 O-C-N 119.949 -1.719 . . . . 28.29 112.385 176.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.3 t -66.31 -46.53 86.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.836 0 N-CA-C 107.835 -1.172 . . . . 15.96 107.835 176.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.88 -45.21 86.73 Favored 'General case' 0 C--N 1.356 0.867 0 O-C-N 119.337 -2.102 . . . . 13.6 110.181 178.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.8 t -69.11 -44.41 72.5 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 124.897 1.279 . . . . 23.05 110.061 -179.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.12 -42.73 81.44 Favored 'General case' 0 C--O 1.245 0.825 0 CA-C-N 121.843 2.11 . . . . 44.83 113.562 175.601 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 73.3 m -83.95 1.19 44.73 Favored 'General case' 0 C--N 1.355 0.84 0 N-CA-C 114.624 1.342 . . . . 17.08 114.624 -178.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 54.04 47.23 23.81 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 116.69 2.107 . . . . 30.04 116.69 175.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 72.7 t -72.12 132.33 33.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-N 113.434 -1.712 . . . . 16.12 107.993 179.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.1 mmtm -110.46 -45.03 3.59 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 114.769 -1.105 . . . . 29.87 110.051 -177.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 75.6 m -121.81 161.8 22.03 Favored 'General case' 0 CA--C 1.503 -0.86 0 C-N-CA 125.115 1.366 . . . . 20.42 111.058 -168.905 -61.237 0.0 0.0 0.0 0.0 0.0 0.0 -61.237 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.3 tpp -119.64 123.82 28.36 Favored Pre-proline 0 C--N 1.309 -1.154 0 CA-C-O 115.74 -2.076 . . . . 30.7 108.598 -175.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_endo -77.78 156.37 95.24 Favored 'Cis proline' 0 CA--C 1.54 0.786 0 CA-C-N 124.694 2.712 . . . . 13.93 112.426 -12.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.6 m -120.0 136.9 54.38 Favored 'General case' 0 C--O 1.244 0.81 0 N-CA-C 106.033 -1.84 . . . . 11.67 106.033 168.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -109.99 121.15 44.58 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 107.062 -1.459 . . . . 13.68 107.062 173.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -112.35 147.46 36.33 Favored 'General case' 0 C--O 1.248 1.01 0 N-CA-C 107.684 -1.228 . . . . 13.84 107.684 172.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -120.49 136.67 54.69 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 106.579 -1.637 . . . . 13.28 106.579 -173.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -132.75 141.57 48.59 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.919 -1.141 . . . . 15.2 107.919 -175.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.2 tttp -139.37 117.21 11.61 Favored 'General case' 0 C--O 1.205 -1.283 0 N-CA-C 103.953 -2.61 . . . . 37.97 103.953 173.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 16.4 mttt 48.55 61.53 3.01 Favored 'General case' 0 C--N 1.272 -2.771 0 CA-C-N 109.726 -3.397 . . . . 43.22 110.467 -175.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.27 -4.47 11.95 Favored Glycine 0 C--N 1.341 0.854 0 CA-C-O 118.282 -1.288 . . . . 24.5 114.868 176.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -104.93 138.24 41.47 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 120.899 2.349 . . . . 42.93 107.166 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -81.54 117.9 22.31 Favored 'General case' 0 CA--C 1.502 -0.867 0 CA-C-O 126.255 2.931 . . . . 25.58 107.253 174.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.0 m -113.04 2.21 8.5 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 CA-C-N 111.347 -2.66 . . . . 15.34 117.432 -177.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -176.58 162.66 31.34 Favored Glycine 0 CA--C 1.553 2.413 0 O-C-N 119.689 -1.882 . . . . 14.33 110.316 174.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -170.52 141.63 1.95 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.154 -1.424 . . . . 29.55 107.154 -179.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -155.97 160.13 39.81 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 125.66 1.85 . . . . 14.38 108.793 165.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.9 p -113.65 160.29 18.75 Favored 'General case' 0 C--O 1.249 1.078 0 C-N-CA 124.835 1.254 . . . . 19.89 113.198 174.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 102.05 156.28 26.09 Favored Glycine 0 C--O 1.247 0.962 0 CA-C-O 121.733 0.63 . . . . 14.65 112.472 -177.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -90.57 54.68 2.78 Favored 'General case' 0 C--O 1.248 1.005 0 N-CA-C 117.957 2.577 . . . . 23.44 117.957 -177.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 37.2 t-20 -94.65 103.1 15.02 Favored 'General case' 0 C--O 1.242 0.676 0 O-C-N 119.134 -2.228 . . . . 20.0 109.198 -176.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -62.58 -39.51 93.92 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 123.719 1.723 . . . . 20.53 114.198 -177.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.16 -38.12 63.79 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 120.252 -1.53 . . . . 41.78 110.674 -176.398 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -72.17 -32.45 66.86 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 119.215 -0.994 . . . . 23.19 108.397 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 33.0 tp -63.19 -48.21 79.32 Favored 'General case' 0 CA--C 1.503 -0.828 0 O-C-N 119.107 -2.246 . . . . 14.28 110.578 179.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 66.2 tt0 -70.91 -36.8 72.85 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 122.688 1.232 . . . . 18.79 112.654 179.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.95 -40.12 92.1 Favored 'General case' 0 N--CA 1.438 -1.033 0 CA-C-O 117.177 -1.392 . . . . 18.69 109.838 176.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 27.7 m -70.35 -36.54 74.26 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 121.8 2.091 . . . . 15.07 113.497 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 49.9 mt -58.67 -44.31 89.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 106.452 -1.684 . . . . 15.06 106.452 174.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -69.95 -33.62 72.34 Favored 'General case' 0 C--N 1.315 -0.919 0 O-C-N 117.431 -3.293 . . . . 25.49 113.435 -178.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -67.15 -38.35 85.34 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 107.874 -1.158 . . . . 19.32 107.874 177.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 94.5 mt -95.52 -18.25 20.79 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 119.246 3.054 . . . . 22.01 119.246 -170.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 13.7 p . . . . . 0 C--N 1.319 -0.744 0 CA-C-N 119.771 1.169 . . . . 26.57 112.134 -172.225 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.0 ptt? . . . . . 0 N--CA 1.468 0.431 0 N-CA-C 101.533 -3.506 . . . . 68.12 101.533 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.415 HG21 ' HD2' ' A' ' 43' ' ' HIS . 43.0 t -74.3 114.82 14.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 CA-C-N 123.764 2.984 . . . . 36.67 109.335 177.018 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 51.8 mttm -83.52 116.07 22.39 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 112.498 -2.137 . . . . 31.68 108.112 177.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -76.43 122.69 24.87 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.332 -0.849 . . . . 23.65 111.586 173.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.413 ' HB ' HG22 ' A' ' 57' ' ' VAL . 27.8 mm -100.01 121.68 51.0 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.831 0 C-N-CA 123.497 0.719 . . . . 13.86 109.938 -176.005 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -121.42 22.69 10.66 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 116.228 1.936 . . . . 17.47 116.228 179.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 58.7 p -169.13 160.7 9.95 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 124.696 1.198 . . . . 15.71 112.471 172.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -64.05 -36.08 82.82 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.817 1.247 . . . . 32.16 109.135 175.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 85.1 m -58.54 -49.35 77.73 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.922 0.889 . . . . 21.02 111.648 176.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.15 -40.43 96.15 Favored 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 125.346 1.459 . . . . 12.35 109.788 -179.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -63.11 -52.17 63.67 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 122.072 0.939 . . . . 18.7 112.16 177.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -59.26 -44.94 92.38 Favored 'General case' 0 N--CA 1.451 -0.423 0 O-C-N 120.098 -1.627 . . . . 30.23 109.461 177.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -60.12 -44.11 95.14 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 118.401 -2.687 . . . . 44.45 112.234 178.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.91 -38.88 92.72 Favored 'General case' 0 C--N 1.345 0.378 0 N-CA-C 112.25 0.463 . . . . 16.47 112.25 177.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.5 mt -71.55 -25.24 62.13 Favored 'General case' 0 N--CA 1.427 -1.604 0 O-C-N 120.012 -1.68 . . . . 15.84 110.004 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -79.11 -47.5 16.0 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 120.103 1.319 . . . . 32.66 109.253 177.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.43 -20.44 64.51 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 117.747 2.499 . . . . 19.45 117.747 179.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.94 -22.26 64.15 Favored 'General case' 0 C--O 1.226 -0.183 0 O-C-N 120.981 -1.074 . . . . 19.88 111.513 -176.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 60.72 -113.32 5.43 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-O 123.867 1.815 . . . . 22.83 113.783 -176.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.26 -18.75 29.5 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 112.452 -1.874 . . . . 44.18 114.305 -177.823 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.1 mttt -65.09 142.89 58.23 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 116.839 2.163 . . . . 24.79 116.839 -174.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 53.4 tp -59.97 136.39 58.0 Favored 'General case' 0 CA--C 1.549 0.911 0 O-C-N 120.647 -1.283 . . . . 14.73 111.442 166.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.2 t -116.24 128.14 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 N-CA-C 104.222 -2.51 . . . . 12.38 104.222 173.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.5 t -112.32 129.18 68.3 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 N-CA-C 103.805 -2.665 . . . . 12.91 103.805 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 48.5 t -119.82 125.48 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 105.396 -2.075 . . . . 9.91 105.396 -177.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -96.29 111.61 23.62 Favored 'General case' 0 N--CA 1.436 -1.166 0 N-CA-C 108.373 -0.973 . . . . 15.1 108.373 171.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -87.02 112.72 22.13 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 120.03 -1.669 . . . . 11.29 107.912 170.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.5 p -125.86 169.55 12.52 Favored 'General case' 0 C--O 1.245 0.862 0 CA-C-N 120.586 1.539 . . . . 21.19 114.126 -175.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -142.56 152.36 42.51 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 103.741 -2.689 . . . . 17.14 103.741 175.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.9 p -68.73 -28.45 66.83 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.261 -0.882 . . . . 30.16 111.88 -177.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 56.6 p-90 -82.18 1.58 35.7 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 115.797 1.777 . . . . 27.14 115.797 178.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.2 t -104.49 124.34 49.1 Favored 'General case' 0 N--CA 1.421 -1.902 0 C-N-CA 117.555 -1.658 . . . . 21.81 108.815 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -59.73 -54.48 37.24 Favored Glycine 0 CA--C 1.531 1.06 0 CA-C-N 111.917 -2.401 . . . . 17.74 110.437 172.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_exo -47.13 -46.45 19.21 Favored 'Trans proline' 0 C--O 1.255 1.334 0 C-N-CA 124.565 3.51 . . . . 20.36 115.71 172.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.3 m -59.21 -44.81 92.26 Favored 'General case' 0 C--N 1.357 0.894 0 CA-C-N 119.158 0.89 . . . . 18.74 112.782 176.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -62.21 -38.86 90.77 Favored 'General case' 0 CA--C 1.5 -0.974 0 O-C-N 118.099 -2.875 . . . . 49.47 117.395 175.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.97 -45.39 93.86 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 124.54 1.136 . . . . 44.19 111.151 -178.95 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 8.8 tt -85.17 -10.47 11.45 Favored 'Isoleucine or valine' 0 C--O 1.254 1.319 0 N-CA-C 115.152 1.538 . . . . 17.52 115.152 -177.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.6 ttpp -60.37 -44.06 94.87 Favored Pre-proline 0 CA--C 1.546 0.802 0 N-CA-C 115.314 1.598 . . . . 41.53 115.314 -175.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -59.27 -37.29 91.94 Favored 'Trans proline' 0 C--N 1.357 0.974 0 CA-C-N 125.358 2.949 . . . . 17.8 116.399 169.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -66.7 -39.5 88.1 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.59 -0.694 . . . . 13.8 110.398 176.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -57.85 -46.19 85.16 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 122.981 1.372 . . . . 12.83 109.904 176.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.415 ' HD2' HG21 ' A' ' 2' ' ' VAL . 16.5 t-80 -67.6 -37.48 82.61 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 115.237 -2.316 . . . . 22.96 107.962 177.674 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 57.8 p -69.8 -29.71 67.07 Favored 'General case' 0 N--CA 1.441 -0.893 1 CA-C-N 127.387 4.63 . . . . 18.53 111.338 179.081 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.7 mt -65.13 -36.07 83.1 Favored 'General case' 0 CA--C 1.498 -1.047 0 O-C-N 120.641 -1.287 . . . . 13.22 109.44 179.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' SER . . . . . 0.522 ' HA ' ' CE1' ' A' ' 54' ' ' PHE . 52.2 p -68.73 -21.69 64.37 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 114.779 1.4 . . . . 20.99 114.779 177.805 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -89.63 -18.63 26.13 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 119.498 -2.001 . . . . 38.13 109.565 174.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -83.19 -45.62 13.68 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.319 -1.488 . . . . 20.48 111.594 177.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -104.36 97.48 7.41 Favored 'General case' 0 C--O 1.216 -0.666 0 O-C-N 118.793 -2.442 . . . . 20.45 107.695 -178.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.1 m -73.37 -23.83 60.24 Favored 'General case' 0 C--N 1.315 -0.929 0 O-C-N 119.518 -1.989 . . . . 32.98 114.976 179.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -92.81 21.69 5.41 Favored 'General case' 0 C--O 1.247 0.966 0 O-C-N 125.335 1.647 . . . . 33.86 115.093 -177.681 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 79.8 t -132.47 143.6 39.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 N-CA-C 102.35 -3.204 . . . . 17.74 102.35 179.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 33.3 mm -104.55 137.42 33.73 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 O-C-N 117.159 -3.463 . . . . 22.91 104.479 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.522 ' CE1' ' HA ' ' A' ' 46' ' ' SER . 82.5 m-85 -119.17 121.76 40.48 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.171 -1.418 . . . . 12.01 107.171 -175.335 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -118.16 147.56 43.22 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 119.653 1.115 . . . . 15.3 109.128 -179.496 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -118.87 130.19 55.61 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 122.268 1.032 . . . . 27.14 109.717 171.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.413 HG22 ' HB ' ' A' ' 5' ' ' ILE . 79.2 t -126.6 110.47 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 N-CA-C 106.987 -1.486 . . . . 12.2 106.987 179.531 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -78.96 122.68 26.45 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 104.437 -2.431 . . . . 27.75 104.437 175.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 23.0 m -64.98 -17.5 21.95 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 N-CA-C 116.13 1.9 . . . . 18.11 116.13 -177.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -88.16 -28.41 21.24 Favored 'General case' 0 C--N 1.321 -0.669 0 O-C-N 119.079 -2.263 . . . . 34.43 110.355 174.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -70.11 -42.74 72.25 Favored 'General case' 0 CA--C 1.505 -0.762 0 O-C-N 119.527 -1.983 . . . . 22.15 114.016 171.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 66.6 m -114.42 66.14 0.67 Allowed 'General case' 0 N--CA 1.429 -1.478 0 CA-C-N 111.974 -2.375 . . . . 22.02 110.578 -174.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -68.02 -30.55 69.81 Favored 'General case' 0 N--CA 1.441 -0.913 0 N-CA-C 114.286 1.217 . . . . 32.24 114.286 -178.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -68.21 -38.81 82.32 Favored 'General case' 0 C--N 1.349 0.581 0 O-C-N 119.949 -1.719 . . . . 28.29 112.385 176.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.3 t -66.31 -46.53 86.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.836 0 N-CA-C 107.835 -1.172 . . . . 15.96 107.835 176.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.88 -45.21 86.73 Favored 'General case' 0 C--N 1.356 0.867 0 O-C-N 119.337 -2.102 . . . . 13.6 110.181 178.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.8 t -69.11 -44.41 72.5 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 124.897 1.279 . . . . 23.05 110.061 -179.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.12 -42.73 81.44 Favored 'General case' 0 C--O 1.245 0.825 0 CA-C-N 121.843 2.11 . . . . 44.83 113.562 175.601 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 73.3 m -83.95 1.19 44.73 Favored 'General case' 0 C--N 1.355 0.84 0 N-CA-C 114.624 1.342 . . . . 17.08 114.624 -178.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 59.2 mt-10 54.04 47.23 23.81 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 116.69 2.107 . . . . 30.04 116.69 175.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 72.7 t -72.12 132.33 33.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-N 113.434 -1.712 . . . . 16.12 107.993 179.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 13.1 mmtm -110.46 -45.03 3.59 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 114.769 -1.105 . . . . 29.87 110.051 -177.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 75.6 m -121.81 161.8 22.03 Favored 'General case' 0 CA--C 1.503 -0.86 0 C-N-CA 125.115 1.366 . . . . 20.42 111.058 -168.905 -61.237 0.0 0.0 0.0 0.0 0.0 0.0 -61.237 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.3 tpp -119.64 123.82 28.36 Favored Pre-proline 0 C--N 1.309 -1.154 0 CA-C-O 115.74 -2.076 . . . . 30.7 108.598 -175.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_endo -77.78 156.37 95.24 Favored 'Cis proline' 0 CA--C 1.54 0.786 0 CA-C-N 124.694 2.712 . . . . 13.93 112.426 -12.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.6 m -120.0 136.9 54.38 Favored 'General case' 0 C--O 1.244 0.81 0 N-CA-C 106.033 -1.84 . . . . 11.67 106.033 168.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -109.99 121.15 44.58 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 107.062 -1.459 . . . . 13.68 107.062 173.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -112.35 147.46 36.33 Favored 'General case' 0 C--O 1.248 1.01 0 N-CA-C 107.684 -1.228 . . . . 13.84 107.684 172.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -120.49 136.67 54.69 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 106.579 -1.637 . . . . 13.28 106.579 -173.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -132.75 141.57 48.59 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.919 -1.141 . . . . 15.2 107.919 -175.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.2 tttp -139.37 117.21 11.61 Favored 'General case' 0 C--O 1.205 -1.283 0 N-CA-C 103.953 -2.61 . . . . 37.97 103.953 173.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 16.4 mttt 48.55 61.53 3.01 Favored 'General case' 0 C--N 1.272 -2.771 0 CA-C-N 109.726 -3.397 . . . . 43.22 110.467 -175.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.27 -4.47 11.95 Favored Glycine 0 C--N 1.341 0.854 0 CA-C-O 118.282 -1.288 . . . . 24.5 114.868 176.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -104.93 138.24 41.47 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 120.899 2.349 . . . . 42.93 107.166 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -81.54 117.9 22.31 Favored 'General case' 0 CA--C 1.502 -0.867 0 CA-C-O 126.255 2.931 . . . . 25.58 107.253 174.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.0 m -113.04 2.21 8.5 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 CA-C-N 111.347 -2.66 . . . . 15.34 117.432 -177.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -176.58 162.66 31.34 Favored Glycine 0 CA--C 1.553 2.413 0 O-C-N 119.689 -1.882 . . . . 14.33 110.316 174.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -170.52 141.63 1.95 Allowed 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.154 -1.424 . . . . 29.55 107.154 -179.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -155.97 160.13 39.81 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 125.66 1.85 . . . . 14.38 108.793 165.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 3.9 p -113.65 160.29 18.75 Favored 'General case' 0 C--O 1.249 1.078 0 C-N-CA 124.835 1.254 . . . . 19.89 113.198 174.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 102.05 156.28 26.09 Favored Glycine 0 C--O 1.247 0.962 0 CA-C-O 121.733 0.63 . . . . 14.65 112.472 -177.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -90.57 54.68 2.78 Favored 'General case' 0 C--O 1.248 1.005 0 N-CA-C 117.957 2.577 . . . . 23.44 117.957 -177.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 37.2 t-20 -94.65 103.1 15.02 Favored 'General case' 0 C--O 1.242 0.676 0 O-C-N 119.134 -2.228 . . . . 20.0 109.198 -176.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -62.58 -39.51 93.92 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 123.719 1.723 . . . . 20.53 114.198 -177.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.16 -38.12 63.79 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 120.252 -1.53 . . . . 41.78 110.674 -176.398 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -72.17 -32.45 66.86 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 119.215 -0.994 . . . . 23.19 108.397 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 33.0 tp -63.19 -48.21 79.32 Favored 'General case' 0 CA--C 1.503 -0.828 0 O-C-N 119.107 -2.246 . . . . 14.28 110.578 179.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 66.2 tt0 -70.91 -36.8 72.85 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 122.688 1.232 . . . . 18.79 112.654 179.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -60.95 -40.12 92.1 Favored 'General case' 0 N--CA 1.438 -1.033 0 CA-C-O 117.177 -1.392 . . . . 18.69 109.838 176.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 27.7 m -70.35 -36.54 74.26 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 121.8 2.091 . . . . 15.07 113.497 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 49.9 mt -58.67 -44.31 89.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 106.452 -1.684 . . . . 15.06 106.452 174.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -69.95 -33.62 72.34 Favored 'General case' 0 C--N 1.315 -0.919 0 O-C-N 117.431 -3.293 . . . . 25.49 113.435 -178.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -67.15 -38.35 85.34 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 107.874 -1.158 . . . . 19.32 107.874 177.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 94.5 mt -95.52 -18.25 20.79 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 119.246 3.054 . . . . 22.01 119.246 -170.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 13.7 p . . . . . 0 C--N 1.319 -0.744 0 CA-C-N 119.771 1.169 . . . . 26.57 112.134 -172.225 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_