data_1gd6_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 1gd6 _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' ' ' LYS . . . . . . . . . . . . . 86.2 tttt . . . . . 0 N--CA 1.492 1.656 0 N-CA-C 112.566 0.58 . . . . 43.07 112.566 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 52.0 m -114.63 122.28 46.0 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 110.004 -0.369 . . . . 37.43 110.004 178.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -85.62 153.83 22.11 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 112.906 0.706 . . . . 32.26 112.906 -179.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.8 p -85.75 166.01 16.45 Favored 'General case' 0 C--O 1.241 0.619 1 N-CA-C 99.987 -4.079 . . . . 31.61 99.987 174.619 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -52.92 -48.26 67.39 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 118.7 -1.2 . . . . 27.43 113.126 -178.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 98.7 m -75.43 -25.83 57.82 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 113.175 0.806 . . . . 29.11 113.175 -179.72 -69.576 -44.082 -79.515 104.582 2.045 104.852 -41.371 -50.899 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.67 -41.96 97.48 Favored Glycine 0 C--O 1.221 -0.674 0 N-CA-C 107.291 -2.324 . . . . 29.01 107.291 177.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 58.6 tp -60.64 -49.16 78.62 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.37 -0.488 . . . . 28.95 110.38 179.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.8 t -57.57 -37.29 57.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.57 0.7 . . . . 35.41 110.616 179.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 31.6 t-80 -65.11 -50.09 67.42 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 108.904 -0.776 . . . . 58.83 108.904 179.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -60.61 -44.44 96.29 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 121.084 -0.246 . . . . 49.41 111.476 178.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.11 -41.01 87.11 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.655 0.613 . . . . 39.95 112.655 -179.567 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 94.0 mtt180 -63.91 -42.47 97.41 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 122.116 0.96 . . . . 41.03 109.33 178.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -59.29 -22.43 61.18 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 114.794 -1.094 . . . . 53.51 111.014 -179.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -106.88 21.14 18.0 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 112.876 0.695 . . . . 41.27 112.876 -179.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.08 22.03 78.95 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 121.048 3.179 . . . . 43.15 121.048 177.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -72.61 137.74 46.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 119.73 1.765 . . . . 45.07 108.64 178.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -54.0 123.08 11.52 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 115.851 -0.613 . . . . 68.39 111.786 -178.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -58.52 -33.84 70.31 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 114.126 1.158 . . . . 48.18 114.126 -179.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -80.4 -6.61 58.32 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.597 -0.841 . . . . 57.04 111.841 -178.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.87 0.05 20.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.991 0.424 . . . . 43.04 110.104 179.9 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 39.4 tpp -54.89 -45.74 74.71 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 117.409 2.374 . . . . 38.34 117.409 -177.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 5.2 mmm-85 -58.73 -38.0 77.41 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 118.857 0.753 . . . . 45.96 110.321 -179.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -65.94 -48.55 70.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.559 -0.291 . . . . 33.85 111.368 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 55.5 m95 -57.66 -41.79 82.22 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 112.655 0.613 . . . . 30.81 112.655 -179.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 78.0 t -64.99 -42.85 95.83 Favored 'Isoleucine or valine' 0 C--O 1.245 0.858 0 N-CA-C 108.976 -0.75 . . . . 27.86 108.976 179.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 49.6 t -63.16 -46.04 89.02 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.691 -0.855 . . . . 32.76 108.691 179.324 -173.698 -94.245 -94.408 103.833 2.02 101.492 -75.705 -53.041 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.0 tt -58.06 -55.56 33.32 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.763 0.316 . . . . 29.12 111.826 179.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 50.8 t -59.07 -45.81 92.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 114.349 1.24 . . . . 26.13 114.349 179.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 86.0 mt-10 -62.19 -30.93 71.42 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 119.742 -0.783 . . . . 33.53 112.205 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.3 m-70 -88.52 -16.48 32.56 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 114.346 1.239 . . . . 33.6 114.346 179.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 -97.99 -36.67 10.05 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.14 -0.624 . . . . 40.35 112.419 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 85.5 p -139.52 2.57 2.04 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 116.159 1.911 . . . . 29.62 116.159 -177.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.1 m 60.98 34.38 19.4 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 119.921 -0.712 . . . . 31.78 109.88 -177.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 mtt85 56.7 38.24 29.39 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 113.039 0.755 . . . . 30.64 113.039 179.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 52.8 t0 -113.77 119.17 36.43 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.954 -1.128 . . . . 32.43 107.954 -178.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 62.8 p -73.36 -12.59 60.88 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 114.444 1.276 . . . . 36.63 114.444 -178.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.9 p -108.29 11.94 26.86 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 114.99 1.478 . . . . 41.73 114.99 -177.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 23.4 tttp -76.02 139.8 41.64 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 118.836 -1.146 . . . . 53.49 112.437 -179.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 32.6 p -130.99 147.78 52.66 Favored 'General case' 0 C--O 1.22 -0.454 0 N-CA-C 105.824 -1.917 . . . . 47.26 105.824 176.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -137.34 138.37 39.89 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 108.251 -1.018 . . . . 59.47 108.251 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 54.0 m -106.15 128.16 53.72 Favored 'General case' 0 CA--C 1.505 -0.771 0 N-CA-C 108.865 -0.791 . . . . 55.96 108.865 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -95.98 176.53 6.07 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.188 0.81 . . . . 59.71 113.188 -178.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.3 tpp85 -62.03 -51.0 69.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.403 -0.817 . . . . 82.02 112.34 -178.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.7 p30 -63.73 1.19 0.65 Allowed 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 115.459 1.651 . . . . 65.98 115.459 -179.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.97 1.94 67.0 Favored Glycine 0 CA--C 1.519 0.319 0 N-CA-C 116.505 1.362 . . . . 53.89 116.505 179.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 94.2 p -93.08 159.24 15.38 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 122.132 -0.628 . . . . 48.31 111.215 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.8 mttm -119.02 151.13 38.77 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.288 -0.415 . . . . 54.57 110.992 178.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -112.65 131.77 55.48 Favored 'General case' 0 C--O 1.22 -0.485 0 N-CA-C 105.168 -2.16 . . . . 41.22 105.168 178.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' TYR . . . . . 0.433 ' N ' ' CD1' ' A' ' 50' ' ' TYR . 3.3 m-85 -114.4 142.4 46.4 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 118.137 2.643 . . . . 38.54 118.137 -176.885 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 59.55 -160.45 18.49 Favored Glycine 0 C--O 1.223 -0.553 1 N-CA-C 123.905 4.322 . . . . 31.57 123.905 175.928 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -44.79 -49.39 10.74 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 124.757 1.223 . . . . 31.53 113.753 -179.499 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -97.82 9.95 41.38 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 114.829 1.418 . . . . 28.27 114.829 -177.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 46.66 56.65 6.29 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.971 -0.692 . . . . 33.12 112.833 179.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 50.4 mt -78.77 137.23 22.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.487 -0.779 . . . . 30.54 109.958 -179.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -85.02 148.42 26.18 Favored 'General case' 0 CA--C 1.539 0.553 1 N-CA-C 123.197 4.518 . . . . 41.63 123.197 -175.009 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.71 -48.66 79.75 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 117.887 2.551 . . . . 42.77 117.887 179.871 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 58.6 mtp85 -63.86 -45.58 88.82 Favored 'General case' 0 CA--C 1.492 -1.252 0 N-CA-C 115.67 1.73 . . . . 57.47 115.67 -177.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -106.04 -30.08 9.51 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 121.429 3.863 . . . . 32.07 121.429 -175.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 32.6 m95 -107.18 -30.02 9.01 Favored 'General case' 0 N--CA 1.469 0.476 1 N-CA-C 124.671 5.063 . . . . 29.63 124.671 -173.498 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 27.2 p -137.09 156.6 48.19 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.374 -0.972 . . . . 38.13 108.374 179.21 59.841 85.072 93.471 104.735 2.03 105.42 -53.247 -61.079 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.9 p -100.99 142.51 32.35 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 120.313 -0.555 . . . . 49.8 112.091 179.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -81.06 -4.46 55.29 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.214 -0.662 . . . . 62.79 109.214 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.35 -167.02 7.75 Favored Glycine 0 C--O 1.239 0.419 0 C-N-CA 121.055 -0.593 . . . . 60.29 114.257 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.25 -5.76 25.09 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 106.58 -1.637 . . . . 59.36 106.58 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 26.8 t -111.35 139.34 21.86 Favored Pre-proline 0 N--CA 1.441 -0.914 0 N-CA-C 107.424 -1.325 . . . . 55.72 107.424 179.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -65.62 143.84 76.35 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 N-CA-C 110.725 -0.529 . . . . 47.94 110.725 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -165.2 -166.86 24.87 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 119.929 -1.129 . . . . 43.39 114.796 -179.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp 65.12 177.35 0.2 Allowed 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 114.789 -0.706 . . . . 45.11 110.093 -178.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -53.51 -20.68 5.17 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 119.575 3.176 . . . . 33.21 119.575 -176.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 7.4 m -99.89 -3.79 31.7 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 118.632 -1.227 . . . . 31.67 108.89 178.366 -84.711 -177.975 86.571 103.905 2.033 103.624 54.818 -178.132 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 50.12 54.66 10.72 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.402 -0.592 . . . . 36.97 109.402 -179.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 7.8 p -147.66 155.77 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 N-CA-C 108.221 -1.029 . . . . 36.41 108.221 -177.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.2 mtpm? -88.74 134.77 33.81 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 105.353 -2.091 . . . . 55.03 105.353 178.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 76.5 m -52.0 -38.16 55.81 Favored 'General case' 0 CA--C 1.508 -0.658 0 N-CA-C 112.926 0.713 . . . . 37.98 112.926 -179.325 -61.079 -53.247 93.471 105.42 2.03 104.735 85.072 59.841 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 97.2 p -60.53 -24.66 65.52 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 121.127 -0.229 . . . . 41.44 111.589 -179.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -75.68 -0.96 22.57 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 119.368 -0.933 . . . . 44.2 111.365 178.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 44.7 mt -106.19 10.78 31.81 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 109.983 -0.377 . . . . 35.93 109.983 -179.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -115.32 13.03 16.54 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.963 -0.384 . . . . 38.56 109.963 178.97 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 81.1 p -89.05 165.5 14.49 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.919 0.711 . . . . 40.28 112.919 -178.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -71.7 -31.57 66.89 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 109.362 -0.607 . . . . 49.11 109.362 179.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ASP . . . . . 0.453 ' OD1' ' CG2' ' A' ' 84' ' ' THR . 6.8 t70 -79.95 125.7 30.08 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 105.706 -1.961 . . . . 44.31 105.706 178.092 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 27.3 pt -103.41 11.99 7.84 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 N-CA-C 116.085 1.883 . . . . 36.93 116.085 -177.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' THR . . . . . 0.453 ' CG2' ' OD1' ' A' ' 82' ' ' ASP . 0.1 OUTLIER -60.51 -40.11 90.21 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 117.127 -1.829 . . . . 39.74 113.66 -176.996 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -68.56 -40.73 80.49 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.591 -0.844 . . . . 41.68 112.466 179.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.72 90.92 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.558 -0.534 . . . . 34.47 109.558 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.03 -41.2 97.49 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-N 116.5 -0.318 . . . . 37.99 111.603 179.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.6 mtmm -65.56 -36.45 83.8 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 120.417 -0.513 . . . . 54.19 109.694 179.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 51.0 t -72.06 -39.97 68.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.44 -0.346 . . . . 33.32 111.681 -179.649 -178.132 54.818 86.571 103.624 2.033 103.905 -177.975 -84.711 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.16 -40.62 96.53 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 108.26 -1.015 . . . . 32.07 108.26 178.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.9 mtmm -65.42 -29.82 70.55 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 119.898 -0.721 . . . . 51.85 110.808 178.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -74.67 -35.93 62.81 Favored 'General case' 0 C--O 1.215 -0.751 0 C-N-CA 120.488 -0.485 . . . . 51.0 110.889 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 75.2 mt -69.91 -39.08 77.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 108.748 -0.834 . . . . 33.64 108.748 178.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -66.4 -44.23 83.59 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 121.098 0.475 . . . . 39.61 111.423 -178.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 29.4 tttt -56.76 -26.41 57.37 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 115.172 -0.922 . . . . 60.69 110.004 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 33.1 ttm180 -100.63 -31.7 11.1 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 116.521 2.045 . . . . 45.52 116.521 -179.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -123.64 1.89 8.87 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 119.232 -0.987 . . . . 42.37 113.466 -178.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.19 -149.06 0.29 Allowed 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 104.886 -2.265 . . . . 64.28 104.886 -177.087 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -87.11 -3.61 59.08 Favored 'General case' 0 CA--C 1.508 -0.659 0 N-CA-C 113.956 1.095 . . . . 41.28 113.956 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.09 -16.21 64.19 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 114.897 1.443 . . . . 51.05 114.897 -178.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.98 -19.08 64.91 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 120.557 -0.457 . . . . 40.63 111.297 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' TRP . . . . . . . . . . . . . 27.7 m-90 -105.97 116.43 31.92 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 115.602 1.704 . . . . 41.17 115.602 -178.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -56.07 -51.64 67.12 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.137 -0.483 . . . . 66.25 110.139 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -50.32 -40.26 37.57 Favored Glycine 0 C--O 1.225 -0.435 0 N-CA-C 114.921 0.728 . . . . 46.03 114.921 179.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' TRP . . . . . . . . . . . . . 90.3 t90 -72.98 -48.74 33.85 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 121.453 0.644 . . . . 45.22 109.605 179.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 22.4 ttmt -48.48 -39.79 24.28 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 114.193 1.183 . . . . 60.18 114.193 -177.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -125.63 45.34 2.62 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 116.252 1.945 . . . . 56.38 116.252 179.941 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 54.8 m-70 -159.31 -20.63 0.07 Allowed 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 116.229 -0.441 . . . . 54.8 109.985 178.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 48.4 m -116.68 24.9 10.95 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 114.093 1.146 . . . . 45.33 114.093 -177.71 -53.041 -75.705 -94.408 101.492 2.02 103.833 -94.245 -173.698 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -89.23 -29.09 19.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.26 0.552 . . . . 55.91 110.099 -179.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.79 -125.47 3.15 Favored Glycine 0 N--CA 1.445 -0.741 0 N-CA-C 110.236 -1.145 . . . . 51.31 110.236 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.86 146.82 43.82 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 113.782 1.03 . . . . 55.87 113.782 -178.723 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.5 mt -107.47 156.8 37.14 Favored Pre-proline 0 CA--C 1.535 0.397 0 N-CA-C 112.219 0.452 . . . . 43.83 112.219 -179.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -51.87 147.55 25.13 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 124.085 3.19 . . . . 37.04 114.397 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -88.25 112.39 22.74 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 106.954 -1.498 . . . . 35.62 106.954 177.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 44.9 pt -116.06 23.78 5.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 C-N-CA 119.539 -0.864 . . . . 32.48 110.735 179.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 85.0 p -68.27 -15.17 63.47 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 113.528 0.936 . . . . 34.37 113.528 -179.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 55.9 m -83.26 -16.72 45.25 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 112.465 0.542 . . . . 37.41 112.465 179.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 34.2 m . . . . . 0 C--O 1.242 0.703 0 CA-C-O 117.436 -1.269 . . . . 34.5 112.649 -177.208 -50.899 -41.371 -79.515 104.852 2.045 104.582 -44.082 -69.576 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 orig full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 86.2 tttt . . . . . 0 N--CA 1.492 1.656 0 N-CA-C 112.566 0.58 . . . . 43.07 112.566 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' THR . . . . . 0.467 ' HB ' ' O ' ' A' ' 180' ' ' HOH . 52.0 m -114.63 122.28 46.0 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 110.004 -0.369 . . . . 37.43 110.004 178.976 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' PHE . . . . . 0.506 ' CE1' ' HG3' ' A' ' 11' ' ' GLU . 97.3 m-85 -85.62 153.83 22.11 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 112.906 0.706 . . . . 32.26 112.906 -179.665 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.8 p -85.75 166.01 16.45 Favored 'General case' 0 C--O 1.241 0.619 1 N-CA-C 99.987 -4.079 . . . . 31.61 99.987 174.619 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -52.92 -48.26 67.39 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 118.7 -1.2 . . . . 27.43 113.126 -178.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 98.7 m -75.43 -25.83 57.82 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 113.175 0.806 . . . . 29.11 113.175 -179.72 -69.576 -44.082 -79.515 104.582 2.045 104.852 -41.371 -50.899 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.67 -41.96 97.48 Favored Glycine 0 C--O 1.221 -0.674 0 N-CA-C 107.291 -2.324 . . . . 29.01 107.291 177.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 58.6 tp -60.64 -49.16 78.62 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.37 -0.488 . . . . 28.95 110.38 179.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.8 t -57.57 -37.29 57.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.57 0.7 . . . . 35.41 110.616 179.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 31.6 t-80 -65.11 -50.09 67.42 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 108.904 -0.776 . . . . 58.83 108.904 179.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLU . . . . . 0.506 ' HG3' ' CE1' ' A' ' 3' ' ' PHE . 45.8 mm-40 -60.61 -44.44 96.29 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 121.084 -0.246 . . . . 49.41 111.476 178.946 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -59.11 -41.01 87.11 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.655 0.613 . . . . 39.95 112.655 -179.567 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 94.0 mtt180 -63.91 -42.47 97.41 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 122.116 0.96 . . . . 41.03 109.33 178.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -59.29 -22.43 61.18 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 114.794 -1.094 . . . . 53.51 111.014 -179.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 69.8 m80 -106.88 21.14 18.0 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 112.876 0.695 . . . . 41.27 112.876 -179.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.08 22.03 78.95 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 121.048 3.179 . . . . 43.15 121.048 177.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -72.61 137.74 46.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 119.73 1.765 . . . . 45.07 108.64 178.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -54.0 123.08 11.52 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 115.851 -0.613 . . . . 68.39 111.786 -178.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -58.52 -33.84 70.31 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 114.126 1.158 . . . . 48.18 114.126 -179.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -80.4 -6.61 58.32 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.597 -0.841 . . . . 57.04 111.841 -178.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.87 0.05 20.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.991 0.424 . . . . 43.04 110.104 179.9 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 39.4 tpp -54.89 -45.74 74.71 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 117.409 2.374 . . . . 38.34 117.409 -177.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ARG . . . . . 0.466 ' HG3' HH11 ' A' ' 23' ' ' ARG . 5.2 mmm-85 -58.73 -38.0 77.41 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 118.857 0.753 . . . . 45.96 110.321 -179.164 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -65.94 -48.55 70.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.559 -0.291 . . . . 33.85 111.368 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 55.5 m95 -57.66 -41.79 82.22 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 112.655 0.613 . . . . 30.81 112.655 -179.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 78.0 t -64.99 -42.85 95.83 Favored 'Isoleucine or valine' 0 C--O 1.245 0.858 0 N-CA-C 108.976 -0.75 . . . . 27.86 108.976 179.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 49.6 t -63.16 -46.04 89.02 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.691 -0.855 . . . . 32.76 108.691 179.324 -173.698 -94.245 -94.408 103.833 2.02 101.492 -75.705 -53.041 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . 0.484 HD11 ' CD2' ' A' ' 102' ' ' TRP . 8.0 tt -58.06 -55.56 33.32 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.763 0.316 . . . . 29.12 111.826 179.502 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 50.8 t -59.07 -45.81 92.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 114.349 1.24 . . . . 26.13 114.349 179.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 86.0 mt-10 -62.19 -30.93 71.42 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 119.742 -0.783 . . . . 33.53 112.205 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.7 m80 -88.52 -16.48 32.56 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 114.346 1.239 . . . . 33.6 114.346 179.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 -97.99 -36.67 10.05 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.14 -0.624 . . . . 40.35 112.419 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 34' ' ' SER . 85.5 p -139.52 2.57 2.04 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 116.159 1.911 . . . . 29.62 116.159 -177.902 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' SER . . . . . 0.418 ' HB2' ' O ' ' A' ' 33' ' ' SER . 39.1 m 60.98 34.38 19.4 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 119.921 -0.712 . . . . 31.78 109.88 -177.761 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 mtt85 56.7 38.24 29.39 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 113.039 0.755 . . . . 30.64 113.039 179.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 52.8 t0 -113.77 119.17 36.43 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.954 -1.128 . . . . 32.43 107.954 -178.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' THR . . . . . 0.407 HG22 ' HG ' ' A' ' 52' ' ' LEU . 62.8 p -73.36 -12.59 60.88 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 114.444 1.276 . . . . 36.63 114.444 -178.139 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.9 p -108.29 11.94 26.86 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 114.99 1.478 . . . . 41.73 114.99 -177.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 23.4 tttp -76.02 139.8 41.64 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 118.836 -1.146 . . . . 53.49 112.437 -179.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 32.6 p -130.99 147.78 52.66 Favored 'General case' 0 C--O 1.22 -0.454 0 N-CA-C 105.824 -1.917 . . . . 47.26 105.824 176.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -137.34 138.37 39.89 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 108.251 -1.018 . . . . 59.47 108.251 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 54.0 m -106.15 128.16 53.72 Favored 'General case' 0 CA--C 1.505 -0.771 0 N-CA-C 108.865 -0.791 . . . . 55.96 108.865 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -95.98 176.53 6.07 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.188 0.81 . . . . 59.71 113.188 -178.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ARG . . . . . 0.408 ' HD3' ' HA ' ' A' ' 44' ' ' ARG . 4.3 tpp85 -62.03 -51.0 69.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.403 -0.817 . . . . 82.02 112.34 -178.834 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.7 p30 -63.73 1.19 0.65 Allowed 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 115.459 1.651 . . . . 65.98 115.459 -179.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.97 1.94 67.0 Favored Glycine 0 CA--C 1.519 0.319 0 N-CA-C 116.505 1.362 . . . . 53.89 116.505 179.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 94.2 p -93.08 159.24 15.38 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 122.132 -0.628 . . . . 48.31 111.215 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.8 mttm -119.02 151.13 38.77 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.288 -0.415 . . . . 54.57 110.992 178.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -112.65 131.77 55.48 Favored 'General case' 0 C--O 1.22 -0.485 0 N-CA-C 105.168 -2.16 . . . . 41.22 105.168 178.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' TYR . . . . . 0.733 ' HD2' HD21 ' A' ' 79' ' ' LEU . 3.3 m-85 -114.4 142.4 46.4 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 118.137 2.643 . . . . 38.54 118.137 -176.885 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 59.55 -160.45 18.49 Favored Glycine 0 C--O 1.223 -0.553 1 N-CA-C 123.905 4.322 . . . . 31.57 123.905 175.928 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . 0.407 ' HG ' HG22 ' A' ' 37' ' ' THR . 0.5 OUTLIER -44.79 -49.39 10.74 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 124.757 1.223 . . . . 31.53 113.753 -179.499 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -97.82 9.95 41.38 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 114.829 1.418 . . . . 28.27 114.829 -177.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 46.66 56.65 6.29 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.971 -0.692 . . . . 33.12 112.833 179.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 50.4 mt -78.77 137.23 22.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.487 -0.779 . . . . 30.54 109.958 -179.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -85.02 148.42 26.18 Favored 'General case' 0 CA--C 1.539 0.553 1 N-CA-C 123.197 4.518 . . . . 41.63 123.197 -175.009 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.71 -48.66 79.75 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 117.887 2.551 . . . . 42.77 117.887 179.871 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 58.6 mtp85 -63.86 -45.58 88.82 Favored 'General case' 0 CA--C 1.492 -1.252 0 N-CA-C 115.67 1.73 . . . . 57.47 115.67 -177.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -106.04 -30.08 9.51 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 121.429 3.863 . . . . 32.07 121.429 -175.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' TRP . . . . . 0.44 ' O ' ' HB2' ' A' ' 71' ' ' CYS . 32.6 m95 -107.18 -30.02 9.01 Favored 'General case' 0 N--CA 1.469 0.476 1 N-CA-C 124.671 5.063 . . . . 29.63 124.671 -173.498 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 27.2 p -137.09 156.6 48.19 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.374 -0.972 . . . . 38.13 108.374 179.21 59.841 85.072 93.471 104.735 2.03 105.42 -53.247 -61.079 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.9 p -100.99 142.51 32.35 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 120.313 -0.555 . . . . 49.8 112.091 179.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -81.06 -4.46 55.29 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.214 -0.662 . . . . 62.79 109.214 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.35 -167.02 7.75 Favored Glycine 0 C--O 1.239 0.419 0 C-N-CA 121.055 -0.593 . . . . 60.29 114.257 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ALA . . . . . 0.423 ' O ' ' HE2' ' A' ' 74' ' ' LYS . . . -101.25 -5.76 25.09 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 106.58 -1.637 . . . . 59.36 106.58 179.708 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 26.8 t -111.35 139.34 21.86 Favored Pre-proline 0 N--CA 1.441 -0.914 0 N-CA-C 107.424 -1.325 . . . . 55.72 107.424 179.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -65.62 143.84 76.35 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 N-CA-C 110.725 -0.529 . . . . 47.94 110.725 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -165.2 -166.86 24.87 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 119.929 -1.129 . . . . 43.39 114.796 -179.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp 65.12 177.35 0.2 Allowed 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 114.789 -0.706 . . . . 45.11 110.093 -178.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -53.51 -20.68 5.17 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 119.575 3.176 . . . . 33.21 119.575 -176.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' CYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 60' ' ' TRP . 7.4 m -99.89 -3.79 31.7 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 118.632 -1.227 . . . . 31.67 108.89 178.366 -84.711 -177.975 86.571 103.905 2.033 103.624 54.818 -178.132 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 55.2 t30 50.12 54.66 10.72 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.402 -0.592 . . . . 36.97 109.402 -179.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 7.8 p -147.66 155.77 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 N-CA-C 108.221 -1.029 . . . . 36.41 108.221 -177.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 65' ' ' ALA . 1.2 mtpm? -88.74 134.77 33.81 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 105.353 -2.091 . . . . 55.03 105.353 178.952 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 76.5 m -52.0 -38.16 55.81 Favored 'General case' 0 CA--C 1.508 -0.658 0 N-CA-C 112.926 0.713 . . . . 37.98 112.926 -179.325 -61.079 -53.247 93.471 105.42 2.03 104.735 85.072 59.841 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 97.2 p -60.53 -24.66 65.52 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 121.127 -0.229 . . . . 41.44 111.589 -179.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -75.68 -0.96 22.57 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 119.368 -0.933 . . . . 44.2 111.365 178.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 44.7 mt -106.19 10.78 31.81 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 109.983 -0.377 . . . . 35.93 109.983 -179.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . 0.733 HD21 ' HD2' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -115.32 13.03 16.54 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.963 -0.384 . . . . 38.56 109.963 178.97 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 81.1 p -89.05 165.5 14.49 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.919 0.711 . . . . 40.28 112.919 -178.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -71.7 -31.57 66.89 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 109.362 -0.607 . . . . 49.11 109.362 179.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ASP . . . . . 0.925 ' OD1' HG23 ' A' ' 84' ' ' THR . 6.8 t70 -79.95 125.7 30.08 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 105.706 -1.961 . . . . 44.31 105.706 178.092 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 27.3 pt -103.41 11.99 7.84 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 N-CA-C 116.085 1.883 . . . . 36.93 116.085 -177.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' THR . . . . . 0.925 HG23 ' OD1' ' A' ' 82' ' ' ASP . 0.1 OUTLIER -60.51 -40.11 90.21 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 117.127 -1.829 . . . . 39.74 113.66 -176.996 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -68.56 -40.73 80.49 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.591 -0.844 . . . . 41.68 112.466 179.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.72 90.92 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.558 -0.534 . . . . 34.47 109.558 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.03 -41.2 97.49 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-N 116.5 -0.318 . . . . 37.99 111.603 179.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.6 mtmm -65.56 -36.45 83.8 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 120.417 -0.513 . . . . 54.19 109.694 179.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 51.0 t -72.06 -39.97 68.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.44 -0.346 . . . . 33.32 111.681 -179.649 -178.132 54.818 86.571 103.624 2.033 103.905 -177.975 -84.711 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.16 -40.62 96.53 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 108.26 -1.015 . . . . 32.07 108.26 178.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LYS . . . . . 0.516 ' HE3' ' O ' ' A' ' 166' ' ' HOH . 22.9 mtmm -65.42 -29.82 70.55 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 119.898 -0.721 . . . . 51.85 110.808 178.498 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -74.67 -35.93 62.81 Favored 'General case' 0 C--O 1.215 -0.751 0 C-N-CA 120.488 -0.485 . . . . 51.0 110.889 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 75.2 mt -69.91 -39.08 77.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 108.748 -0.834 . . . . 33.64 108.748 178.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -66.4 -44.23 83.59 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 121.098 0.475 . . . . 39.61 111.423 -178.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 29.4 tttt -56.76 -26.41 57.37 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 115.172 -0.922 . . . . 60.69 110.004 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 33.1 ttm180 -100.63 -31.7 11.1 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 116.521 2.045 . . . . 45.52 116.521 -179.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' HIS . . . . . 0.417 ' O ' ' HB2' ' A' ' 98' ' ' ARG . 91.3 m-70 -123.64 1.89 8.87 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 119.232 -0.987 . . . . 42.37 113.466 -178.159 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 97' ' ' HIS . 0.0 OUTLIER 64.19 -149.06 0.29 Allowed 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 104.886 -2.265 . . . . 64.28 104.886 -177.087 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 99' ' ' PHE . . . . . 0.442 ' HB3' ' CD2' ' A' ' 105' ' ' TRP . 29.8 m-85 -87.11 -3.61 59.08 Favored 'General case' 0 CA--C 1.508 -0.659 0 N-CA-C 113.956 1.095 . . . . 41.28 113.956 -179.457 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.09 -16.21 64.19 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 114.897 1.443 . . . . 51.05 114.897 -178.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.98 -19.08 64.91 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 120.557 -0.457 . . . . 40.63 111.297 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' TRP . . . . . 0.484 ' CD2' HD11 ' A' ' 28' ' ' LEU . 27.7 m-90 -105.97 116.43 31.92 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 115.602 1.704 . . . . 41.17 115.602 -178.368 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -56.07 -51.64 67.12 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.137 -0.483 . . . . 66.25 110.139 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLY . . . . . 0.496 ' O ' ' HB2' ' A' ' 108' ' ' HIS . . . -50.32 -40.26 37.57 Favored Glycine 0 C--O 1.225 -0.435 0 N-CA-C 114.921 0.728 . . . . 46.03 114.921 179.983 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' TRP . . . . . 0.442 ' CD2' ' HB3' ' A' ' 99' ' ' PHE . 90.3 t90 -72.98 -48.74 33.85 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 121.453 0.644 . . . . 45.22 109.605 179.862 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 22.4 ttmt -48.48 -39.79 24.28 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 114.193 1.183 . . . . 60.18 114.193 -177.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 25.2 p30 -125.63 45.34 2.62 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 116.252 1.945 . . . . 56.38 116.252 179.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HIS . . . . . 0.496 ' HB2' ' O ' ' A' ' 104' ' ' GLY . 54.8 m-70 -159.31 -20.63 0.07 Allowed 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 116.229 -0.441 . . . . 54.8 109.985 178.787 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 48.4 m -116.68 24.9 10.95 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 114.093 1.146 . . . . 45.33 114.093 -177.71 -53.041 -75.705 -94.408 101.492 2.02 103.833 -94.245 -173.698 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -89.23 -29.09 19.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.26 0.552 . . . . 55.91 110.099 -179.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.79 -125.47 3.15 Favored Glycine 0 N--CA 1.445 -0.741 0 N-CA-C 110.236 -1.145 . . . . 51.31 110.236 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.86 146.82 43.82 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 113.782 1.03 . . . . 55.87 113.782 -178.723 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.5 mt -107.47 156.8 37.14 Favored Pre-proline 0 CA--C 1.535 0.397 0 N-CA-C 112.219 0.452 . . . . 43.83 112.219 -179.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -51.87 147.55 25.13 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 124.085 3.19 . . . . 37.04 114.397 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -88.25 112.39 22.74 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 106.954 -1.498 . . . . 35.62 106.954 177.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 44.9 pt -116.06 23.78 5.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 C-N-CA 119.539 -0.864 . . . . 32.48 110.735 179.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 85.0 p -68.27 -15.17 63.47 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 113.528 0.936 . . . . 34.37 113.528 -179.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 55.9 m -83.26 -16.72 45.25 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 112.465 0.542 . . . . 37.41 112.465 179.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 34.2 m . . . . . 0 C--O 1.242 0.703 0 CA-C-O 117.436 -1.269 . . . . 34.5 112.649 -177.208 -50.899 -41.371 -79.515 104.852 2.045 104.582 -44.082 -69.576 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 build full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 166' ' ' HOH . . . . . 0.516 ' O ' ' HE3' ' A' ' 91' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 180' ' ' HOH . . . . . 0.467 ' O ' ' HB ' ' A' ' 2' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 86.2 tttt . . . . . 0 N--CA 1.492 1.656 0 N-CA-C 112.566 0.58 . . . . 43.07 112.566 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' THR . . . . . 0.467 ' HB ' ' O ' ' A' ' 180' ' ' HOH . 52.0 m -114.63 122.28 46.0 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 110.004 -0.369 . . . . 37.43 110.004 178.976 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.506 ' CE1' ' HG3' ' A' ' 11' ' ' GLU . 97.3 m-85 -85.62 153.83 22.11 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 112.906 0.706 . . . . 32.26 112.906 -179.665 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.8 p -85.75 166.01 16.45 Favored 'General case' 0 C--O 1.241 0.619 1 N-CA-C 99.987 -4.079 . . . . 31.61 99.987 174.619 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -52.92 -48.26 67.39 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 118.7 -1.2 . . . . 27.43 113.126 -178.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 98.7 m -75.43 -25.83 57.82 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 113.175 0.806 . . . . 29.11 113.175 -179.72 -69.576 -44.082 -79.515 104.582 2.045 104.852 -41.371 -50.899 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.67 -41.96 97.48 Favored Glycine 0 C--O 1.221 -0.674 0 N-CA-C 107.291 -2.324 . . . . 29.01 107.291 177.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 58.6 tp -60.64 -49.16 78.62 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.37 -0.488 . . . . 28.95 110.38 179.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 46.8 t -57.57 -37.29 57.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.57 0.7 . . . . 35.41 110.616 179.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 31.6 t-80 -65.11 -50.09 67.42 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 108.904 -0.776 . . . . 58.83 108.904 179.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.506 ' HG3' ' CE1' ' A' ' 3' ' ' PHE . 45.8 mm-40 -60.61 -44.44 96.29 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 121.084 -0.246 . . . . 49.41 111.476 178.946 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -59.11 -41.01 87.11 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.655 0.613 . . . . 39.95 112.655 -179.567 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 94.0 mtt180 -63.91 -42.47 97.41 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 122.116 0.96 . . . . 41.03 109.33 178.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -59.29 -22.43 61.18 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 114.794 -1.094 . . . . 53.51 111.014 -179.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.626 ' HE1' HG22 ' A' ' 84' ' ' THR . 89.5 m-70 -106.88 21.14 18.0 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 112.876 0.695 . . . . 41.27 112.876 -179.098 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.08 22.03 78.95 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 121.048 3.179 . . . . 43.15 121.048 177.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -72.61 137.74 46.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 119.73 1.765 . . . . 45.07 108.64 178.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -54.0 123.08 11.52 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 115.851 -0.613 . . . . 68.39 111.786 -178.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -58.52 -33.84 70.31 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 114.126 1.158 . . . . 48.18 114.126 -179.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -80.4 -6.61 58.32 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.597 -0.841 . . . . 57.04 111.841 -178.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.87 0.05 20.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.991 0.424 . . . . 43.04 110.104 179.9 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 39.4 tpp -54.89 -45.74 74.71 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 117.409 2.374 . . . . 38.34 117.409 -177.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.466 ' HG3' HH11 ' A' ' 23' ' ' ARG . 5.2 mmm-85 -58.73 -38.0 77.41 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 118.857 0.753 . . . . 45.96 110.321 -179.164 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -65.94 -48.55 70.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.559 -0.291 . . . . 33.85 111.368 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 55.5 m95 -57.66 -41.79 82.22 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 112.655 0.613 . . . . 30.81 112.655 -179.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 78.0 t -64.99 -42.85 95.83 Favored 'Isoleucine or valine' 0 C--O 1.245 0.858 0 N-CA-C 108.976 -0.75 . . . . 27.86 108.976 179.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 49.6 t -63.16 -46.04 89.02 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 108.691 -0.855 . . . . 32.76 108.691 179.324 -173.698 -94.245 -94.408 103.833 2.02 101.492 -75.705 -53.041 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.484 HD11 ' CD2' ' A' ' 102' ' ' TRP . 8.0 tt -58.06 -55.56 33.32 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.763 0.316 . . . . 29.12 111.826 179.502 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 50.8 t -59.07 -45.81 92.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 114.349 1.24 . . . . 26.13 114.349 179.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 86.0 mt-10 -62.19 -30.93 71.42 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 119.742 -0.783 . . . . 33.53 112.205 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 86.3 m-70 -88.52 -16.48 32.56 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 114.346 1.239 . . . . 33.6 114.346 179.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 -97.99 -36.67 10.05 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.14 -0.624 . . . . 40.35 112.419 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 34' ' ' SER . 85.5 p -139.52 2.57 2.04 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 116.159 1.911 . . . . 29.62 116.159 -177.902 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' SER . . . . . 0.418 ' HB2' ' O ' ' A' ' 33' ' ' SER . 39.1 m 60.98 34.38 19.4 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 119.921 -0.712 . . . . 31.78 109.88 -177.761 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 mtt85 56.7 38.24 29.39 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 113.039 0.755 . . . . 30.64 113.039 179.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 52.8 t0 -113.77 119.17 36.43 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.954 -1.128 . . . . 32.43 107.954 -178.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' THR . . . . . 0.407 HG22 ' HG ' ' A' ' 52' ' ' LEU . 62.8 p -73.36 -12.59 60.88 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 114.444 1.276 . . . . 36.63 114.444 -178.139 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.9 p -108.29 11.94 26.86 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 114.99 1.478 . . . . 41.73 114.99 -177.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 23.4 tttp -76.02 139.8 41.64 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 118.836 -1.146 . . . . 53.49 112.437 -179.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 32.6 p -130.99 147.78 52.66 Favored 'General case' 0 C--O 1.22 -0.454 0 N-CA-C 105.824 -1.917 . . . . 47.26 105.824 176.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -137.34 138.37 39.89 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 108.251 -1.018 . . . . 59.47 108.251 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 54.0 m -106.15 128.16 53.72 Favored 'General case' 0 CA--C 1.505 -0.771 0 N-CA-C 108.865 -0.791 . . . . 55.96 108.865 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -95.98 176.53 6.07 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 113.188 0.81 . . . . 59.71 113.188 -178.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.408 ' HD3' ' HA ' ' A' ' 44' ' ' ARG . 4.3 tpp85 -62.03 -51.0 69.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.403 -0.817 . . . . 82.02 112.34 -178.834 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.7 p30 -63.73 1.19 0.65 Allowed 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 115.459 1.651 . . . . 65.98 115.459 -179.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.97 1.94 67.0 Favored Glycine 0 CA--C 1.519 0.319 0 N-CA-C 116.505 1.362 . . . . 53.89 116.505 179.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 94.2 p -93.08 159.24 15.38 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 122.132 -0.628 . . . . 48.31 111.215 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.8 mttm -119.02 151.13 38.77 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.288 -0.415 . . . . 54.57 110.992 178.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -112.65 131.77 55.48 Favored 'General case' 0 C--O 1.22 -0.485 0 N-CA-C 105.168 -2.16 . . . . 41.22 105.168 178.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.733 ' HD2' HD21 ' A' ' 79' ' ' LEU . 3.3 m-85 -114.4 142.4 46.4 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 118.137 2.643 . . . . 38.54 118.137 -176.885 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 59.55 -160.45 18.49 Favored Glycine 0 C--O 1.223 -0.553 1 N-CA-C 123.905 4.322 . . . . 31.57 123.905 175.928 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.407 ' HG ' HG22 ' A' ' 37' ' ' THR . 0.5 OUTLIER -44.79 -49.39 10.74 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 124.757 1.223 . . . . 31.53 113.753 -179.499 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -97.82 9.95 41.38 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 114.829 1.418 . . . . 28.27 114.829 -177.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 58.0 mm-40 46.66 56.65 6.29 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.971 -0.692 . . . . 33.12 112.833 179.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 50.4 mt -78.77 137.23 22.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.487 -0.779 . . . . 30.54 109.958 -179.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -85.02 148.42 26.18 Favored 'General case' 0 CA--C 1.539 0.553 1 N-CA-C 123.197 4.518 . . . . 41.63 123.197 -175.009 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.71 -48.66 79.75 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 117.887 2.551 . . . . 42.77 117.887 179.871 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 58.6 mtp85 -63.86 -45.58 88.82 Favored 'General case' 0 CA--C 1.492 -1.252 0 N-CA-C 115.67 1.73 . . . . 57.47 115.67 -177.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -106.04 -30.08 9.51 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 121.429 3.863 . . . . 32.07 121.429 -175.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' TRP . . . . . 0.44 ' O ' ' HB2' ' A' ' 71' ' ' CYS . 32.6 m95 -107.18 -30.02 9.01 Favored 'General case' 0 N--CA 1.469 0.476 1 N-CA-C 124.671 5.063 . . . . 29.63 124.671 -173.498 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 27.2 p -137.09 156.6 48.19 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.374 -0.972 . . . . 38.13 108.374 179.21 59.841 85.072 93.471 104.735 2.03 105.42 -53.247 -61.079 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.9 p -100.99 142.51 32.35 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 120.313 -0.555 . . . . 49.8 112.091 179.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -81.06 -4.46 55.29 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.214 -0.662 . . . . 62.79 109.214 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.35 -167.02 7.75 Favored Glycine 0 C--O 1.239 0.419 0 C-N-CA 121.055 -0.593 . . . . 60.29 114.257 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.423 ' O ' ' HE2' ' A' ' 74' ' ' LYS . . . -101.25 -5.76 25.09 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 106.58 -1.637 . . . . 59.36 106.58 179.708 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 26.8 t -111.35 139.34 21.86 Favored Pre-proline 0 N--CA 1.441 -0.914 0 N-CA-C 107.424 -1.325 . . . . 55.72 107.424 179.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -65.62 143.84 76.35 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 N-CA-C 110.725 -0.529 . . . . 47.94 110.725 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -165.2 -166.86 24.87 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 119.929 -1.129 . . . . 43.39 114.796 -179.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp 65.12 177.35 0.2 Allowed 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 114.789 -0.706 . . . . 45.11 110.093 -178.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -53.51 -20.68 5.17 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 119.575 3.176 . . . . 33.21 119.575 -176.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 60' ' ' TRP . 7.4 m -99.89 -3.79 31.7 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 118.632 -1.227 . . . . 31.67 108.89 178.366 -84.711 -177.975 86.571 103.905 2.033 103.624 54.818 -178.132 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 50.12 54.66 10.72 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 109.402 -0.592 . . . . 36.97 109.402 -179.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 7.8 p -147.66 155.77 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 N-CA-C 108.221 -1.029 . . . . 36.41 108.221 -177.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 65' ' ' ALA . 1.2 mtpm? -88.74 134.77 33.81 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 105.353 -2.091 . . . . 55.03 105.353 178.952 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 76.5 m -52.0 -38.16 55.81 Favored 'General case' 0 CA--C 1.508 -0.658 0 N-CA-C 112.926 0.713 . . . . 37.98 112.926 -179.325 -61.079 -53.247 93.471 105.42 2.03 104.735 85.072 59.841 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 97.2 p -60.53 -24.66 65.52 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 121.127 -0.229 . . . . 41.44 111.589 -179.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -75.68 -0.96 22.57 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 119.368 -0.933 . . . . 44.2 111.365 178.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 44.7 mt -106.19 10.78 31.81 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 109.983 -0.377 . . . . 35.93 109.983 -179.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.733 HD21 ' HD2' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -115.32 13.03 16.54 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.963 -0.384 . . . . 38.56 109.963 178.97 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 81.1 p -89.05 165.5 14.49 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.919 0.711 . . . . 40.28 112.919 -178.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -71.7 -31.57 66.89 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 109.362 -0.607 . . . . 49.11 109.362 179.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.925 ' OD1' HG23 ' A' ' 84' ' ' THR . 6.8 t70 -79.95 125.7 30.08 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 105.706 -1.961 . . . . 44.31 105.706 178.092 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 27.3 pt -103.41 11.99 7.84 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 N-CA-C 116.085 1.883 . . . . 36.93 116.085 -177.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' THR . . . . . 0.925 HG23 ' OD1' ' A' ' 82' ' ' ASP . 0.1 OUTLIER -60.51 -40.11 90.21 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 117.127 -1.829 . . . . 39.74 113.66 -176.996 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 46.5 mttp -68.56 -40.73 80.49 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.591 -0.844 . . . . 41.68 112.466 179.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.88 -39.72 90.92 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.558 -0.534 . . . . 34.47 109.558 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.03 -41.2 97.49 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-N 116.5 -0.318 . . . . 37.99 111.603 179.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.6 mtmm -65.56 -36.45 83.8 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 120.417 -0.513 . . . . 54.19 109.694 179.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 51.0 t -72.06 -39.97 68.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.44 -0.346 . . . . 33.32 111.681 -179.649 -178.132 54.818 86.571 103.624 2.033 103.905 -177.975 -84.711 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.16 -40.62 96.53 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 108.26 -1.015 . . . . 32.07 108.26 178.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.516 ' HE3' ' O ' ' A' ' 166' ' ' HOH . 22.9 mtmm -65.42 -29.82 70.55 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 119.898 -0.721 . . . . 51.85 110.808 178.498 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -74.67 -35.93 62.81 Favored 'General case' 0 C--O 1.215 -0.751 0 C-N-CA 120.488 -0.485 . . . . 51.0 110.889 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 75.2 mt -69.91 -39.08 77.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 108.748 -0.834 . . . . 33.64 108.748 178.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -66.4 -44.23 83.59 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 121.098 0.475 . . . . 39.61 111.423 -178.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 29.4 tttt -56.76 -26.41 57.37 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 115.172 -0.922 . . . . 60.69 110.004 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 33.1 ttm180 -100.63 -31.7 11.1 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 116.521 2.045 . . . . 45.52 116.521 -179.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' HIS . . . . . 0.417 ' O ' ' HB2' ' A' ' 98' ' ' ARG . 91.3 m-70 -123.64 1.89 8.87 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 119.232 -0.987 . . . . 42.37 113.466 -178.159 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 97' ' ' HIS . 0.0 OUTLIER 64.19 -149.06 0.29 Allowed 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 104.886 -2.265 . . . . 64.28 104.886 -177.087 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.442 ' HB3' ' CD2' ' A' ' 105' ' ' TRP . 29.8 m-85 -87.11 -3.61 59.08 Favored 'General case' 0 CA--C 1.508 -0.659 0 N-CA-C 113.956 1.095 . . . . 41.28 113.956 -179.457 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -67.09 -16.21 64.19 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 114.897 1.443 . . . . 51.05 114.897 -178.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -67.98 -19.08 64.91 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 120.557 -0.457 . . . . 40.63 111.297 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' TRP . . . . . 0.484 ' CD2' HD11 ' A' ' 28' ' ' LEU . 27.7 m-90 -105.97 116.43 31.92 Favored 'General case' 0 C--O 1.218 -0.605 0 N-CA-C 115.602 1.704 . . . . 41.17 115.602 -178.368 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -56.07 -51.64 67.12 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.137 -0.483 . . . . 66.25 110.139 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.496 ' O ' ' HB2' ' A' ' 108' ' ' HIS . . . -50.32 -40.26 37.57 Favored Glycine 0 C--O 1.225 -0.435 0 N-CA-C 114.921 0.728 . . . . 46.03 114.921 179.983 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' TRP . . . . . 0.442 ' CD2' ' HB3' ' A' ' 99' ' ' PHE . 90.3 t90 -72.98 -48.74 33.85 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 121.453 0.644 . . . . 45.22 109.605 179.862 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 22.4 ttmt -48.48 -39.79 24.28 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 114.193 1.183 . . . . 60.18 114.193 -177.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ASN . . . . . 0.405 HD22 ' C ' ' A' ' 107' ' ' ASN . 0.4 OUTLIER -125.63 45.34 2.62 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 116.252 1.945 . . . . 56.38 116.252 179.941 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.496 ' HB2' ' O ' ' A' ' 104' ' ' GLY . 54.8 m-70 -159.31 -20.63 0.07 Allowed 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 116.229 -0.441 . . . . 54.8 109.985 178.787 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 48.4 m -116.68 24.9 10.95 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 114.093 1.146 . . . . 45.33 114.093 -177.71 -53.041 -75.705 -94.408 101.492 2.02 103.833 -94.245 -173.698 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -89.23 -29.09 19.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.26 0.552 . . . . 55.91 110.099 -179.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -90.79 -125.47 3.15 Favored Glycine 0 N--CA 1.445 -0.741 0 N-CA-C 110.236 -1.145 . . . . 51.31 110.236 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.86 146.82 43.82 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 113.782 1.03 . . . . 55.87 113.782 -178.723 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.5 mt -107.47 156.8 37.14 Favored Pre-proline 0 CA--C 1.535 0.397 0 N-CA-C 112.219 0.452 . . . . 43.83 112.219 -179.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -51.87 147.55 25.13 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 124.085 3.19 . . . . 37.04 114.397 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -88.25 112.39 22.74 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 106.954 -1.498 . . . . 35.62 106.954 177.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 44.9 pt -116.06 23.78 5.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 C-N-CA 119.539 -0.864 . . . . 32.48 110.735 179.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 85.0 p -68.27 -15.17 63.47 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 113.528 0.936 . . . . 34.37 113.528 -179.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 55.9 m -83.26 -16.72 45.25 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 112.465 0.542 . . . . 37.41 112.465 179.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' CYS . . . . . . . . . . . . . 34.2 m . . . . . 0 C--O 1.242 0.703 0 CA-C-O 117.436 -1.269 . . . . 34.5 112.649 -177.208 -50.899 -41.371 -79.515 104.852 2.045 104.582 -44.082 -69.576 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 . 001 ecloud nobuild full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' HOH . . . . . 0.516 ' O ' ' HE3' ' A' ' 91' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' HOH . . . . . 0.467 ' O ' ' HB ' ' A' ' 2' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_