data_1bh8_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 1bh8 _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 ' 31' ' ' LEU . . . . . . . . . . . . . 8.7 mp . . . . . 0 N--CA 1.497 1.878 0 N-CA-C 117.456 2.391 . . . . 35.93 117.456 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' PHE . . . . . 0.413 ' O ' ' N ' ' A' ' 34' ' ' LYS . 17.2 m-85 -123.87 -2.79 8.23 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 114.897 1.443 . . . . 37.35 114.897 -178.038 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.6 t -37.7 -20.94 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 117.893 2.553 . . . . 41.41 117.893 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LYS . . . . . 0.413 ' N ' ' O ' ' A' ' 32' ' ' PHE . 50.3 tttm -104.14 -32.95 8.91 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.994 1.109 . . . . 50.52 113.994 -178.898 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . 0.532 ' OE1' ' N ' ' A' ' 35' ' ' GLU . 15.8 mp0 -87.0 -33.8 19.47 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 108.805 -0.813 . . . . 40.33 108.805 179.336 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 47.4 tp -72.42 -21.55 61.24 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 104.838 -2.282 . . . . 35.0 104.838 179.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.5 ttm-85 -74.18 -39.83 62.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.972 -0.558 . . . . 41.83 110.136 -179.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 65.2 m -79.47 -6.45 56.94 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 109.136 -0.69 . . . . 49.44 109.136 178.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 49.8 ttm -94.54 -28.82 15.22 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 108.869 -0.789 . . . . 38.57 108.869 -178.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 77.0 mtp -72.94 -28.83 62.67 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.088 -1.078 . . . . 34.08 108.088 179.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 43.9 t80 -70.56 -46.91 62.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.49 -0.777 . . . . 43.12 110.406 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -64.74 -6.05 21.49 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.887 -0.673 . . . . 36.04 113.175 -179.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -111.61 -1.55 15.72 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.987 1.106 . . . . 31.81 113.987 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 119.77 7.19 9.79 Favored Glycine 0 N--CA 1.444 -0.807 0 N-CA-C 116.94 1.536 . . . . 35.92 116.94 177.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -89.82 -175.26 4.57 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 107.345 -1.354 . . . . 33.76 107.345 179.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -69.9 156.61 38.82 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.495 -1.298 . . . . 42.97 107.495 179.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 38.6 tt0 -70.18 -4.67 22.63 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 106.817 -1.549 . . . . 48.64 106.817 178.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -136.05 70.52 63.1 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 114.833 -1.076 . . . . 43.62 110.094 179.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -58.41 149.82 71.93 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 N-CA-C 114.167 0.795 . . . . 30.72 114.167 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -62.65 119.56 9.48 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.385 -0.968 . . . . 36.5 108.385 178.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . 0.4 ' O ' ' C ' ' A' ' 52' ' ' GLU . 1.8 t -47.34 -42.8 22.2 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.925 -0.769 . . . . 38.07 108.925 179.486 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . 0.4 ' C ' ' O ' ' A' ' 51' ' ' THR . 11.4 mp0 -44.09 -61.33 1.51 Allowed 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.198 -0.601 . . . . 49.72 109.933 179.81 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 72.7 m -59.65 -32.19 70.22 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 116.082 1.882 . . . . 38.21 116.082 -179.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 57.0 t -66.51 -20.72 27.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.499 0.666 . . . . 39.32 110.704 -179.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -77.07 -51.45 11.02 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.295 -1.002 . . . . 37.34 108.295 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 38.5 mt -54.04 -38.7 38.58 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-N 115.542 -0.753 . . . . 31.15 109.498 178.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.93 -42.38 81.11 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-N 115.958 -0.564 . . . . 38.17 111.978 -179.158 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -62.19 -32.95 73.64 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 119.623 -0.831 . . . . 38.91 110.792 -179.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -67.6 -57.22 6.82 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 107.753 -1.203 . . . . 33.05 107.753 178.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 80.2 mt -43.22 -38.32 2.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.067 -0.515 . . . . 31.15 110.725 -179.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 58.3 t -75.64 -47.08 34.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.988 -0.551 . . . . 27.57 111.829 -179.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 63.7 mt -60.71 -36.48 71.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 108.487 -0.931 . . . . 32.14 108.487 179.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -68.16 -51.38 46.57 Favored 'General case' 0 C--O 1.222 -0.382 0 N-CA-C 107.523 -1.288 . . . . 41.73 107.523 178.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -51.58 -59.48 4.22 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.53 0.732 . . . . 31.16 112.71 179.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.3 mt -47.64 -53.98 3.96 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 N-CA-C 109.771 -0.455 . . . . 34.99 109.771 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.5 m -47.75 -58.12 4.71 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.405 0.682 . . . . 31.73 112.786 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -48.64 -57.85 5.62 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 108.094 -1.076 . . . . 43.27 108.094 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 85.0 mmm -50.96 -45.42 60.81 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 122.891 0.476 . . . . 38.73 109.939 178.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 14.7 m -58.04 -47.08 84.19 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 115.469 -0.787 . . . . 43.5 110.737 -178.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 20.6 m170 -67.46 -43.51 80.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.802 -0.181 . . . . 40.9 110.636 178.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.98 -41.49 96.55 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.982 0.42 . . . . 34.12 111.876 179.793 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.73 -46.76 80.89 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 114.099 1.148 . . . . 41.33 114.099 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 48.3 mtm -59.31 -46.13 89.41 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 108.806 -0.813 . . . . 41.42 108.806 -179.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.4 t -48.35 -12.35 0.04 OUTLIER 'General case' 0 C--O 1.237 0.422 0 N-CA-C 115.764 1.765 . . . . 54.61 115.764 179.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 28.4 pt . . . . . 0 C--O 1.25 1.12 0 CA-C-O 117.992 -1.004 . . . . 50.18 109.705 179.881 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' PHE . . . . . . . . . . . . . 54.2 p90 . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 107.375 -1.343 . . . . 39.81 107.375 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' SER . . . . . 0.484 ' N ' ' NE2' ' B' ' 117' ' ' GLN . 94.5 p -106.73 157.57 17.62 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 115.548 1.684 . . . . 38.38 115.548 -178.392 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -58.59 -24.26 60.52 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 114.888 -1.051 . . . . 40.93 113.06 179.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -76.08 -39.1 56.13 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.438 -0.949 . . . . 47.91 108.438 179.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' GLN . . . . . 0.484 ' NE2' ' N ' ' B' ' 114' ' ' SER . 52.3 mt-30 -64.19 -40.11 95.41 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 107.303 -1.369 . . . . 43.81 107.303 179.286 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.11 -44.36 80.16 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.225 -0.898 . . . . 36.78 109.055 -179.713 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -75.22 -16.72 60.46 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.614 -0.721 . . . . 46.8 112.328 -178.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' ARG . . . . . . . . . . . . . 37.0 ttm-85 -86.23 -29.65 22.98 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 120.235 -0.586 . . . . 48.38 110.113 178.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -79.57 -29.76 41.41 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.455 0.645 . . . . 35.42 109.44 179.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' GLU . . . . . 0.446 ' OE1' ' NH2' ' B' ' 125' ' ' ARG . 43.1 tp10 -70.9 -38.7 73.0 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.231 -1.026 . . . . 39.56 108.231 -179.44 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' MET . . . . . . . . . . . . . 5.6 tpp -70.21 -40.09 74.78 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 107.048 -1.464 . . . . 50.03 107.048 179.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -57.07 -73.32 0.07 Allowed 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.205 -1.035 . . . . 40.64 108.205 178.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' ARG . . . . . 0.446 ' NH2' ' OE1' ' B' ' 122' ' ' GLU . 69.3 ttp85 -36.32 -43.6 0.38 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 116.534 2.05 . . . . 37.43 116.534 -179.521 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' ARG . . . . . . . . . . . . . 4.8 mtp180 -94.05 -17.99 22.29 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 117.942 2.571 . . . . 34.35 117.942 -177.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 54.1 p -59.3 144.16 47.23 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 109.126 -0.694 . . . . 35.86 109.126 179.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -170.92 157.51 5.39 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 109.53 -0.545 . . . . 30.42 109.53 -179.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' PHE . . . . . . . . . . . . . 88.6 m-85 -82.05 150.52 65.13 Favored Pre-proline 0 C--N 1.323 -0.581 0 C-N-CA 118.973 -1.091 . . . . 36.88 108.76 178.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' PRO . . . . . 0.509 ' CG ' ' OE2' ' A' ' 35' ' ' GLU . 54.1 Cg_exo -65.78 129.54 22.43 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 N-CA-C 108.971 -1.203 . . . . 39.46 108.971 179.654 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -54.31 -41.07 68.56 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-O 121.735 0.778 . . . . 42.38 110.124 179.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -47.26 -52.16 16.86 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 115.339 1.607 . . . . 38.76 115.339 -178.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' ALA . . . . . . . . . . . . . . . -79.06 -19.46 51.32 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 115.017 1.488 . . . . 37.61 115.017 -178.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 48.7 mm -77.91 -32.46 17.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 108.324 -0.991 . . . . 35.74 108.324 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -70.9 -46.97 61.61 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.307 -0.998 . . . . 34.39 108.307 179.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' ARG . . . . . . . . . . . . . 30.9 ttt85 -62.53 -38.4 89.83 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 113.436 0.902 . . . . 65.32 113.436 -179.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 56.3 tp -73.27 -40.66 64.42 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.178 -0.465 . . . . 39.82 110.915 -179.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' ILE . . . . . . . . . . . . . 88.3 mt -69.56 -43.4 80.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 112.311 0.486 . . . . 34.58 112.311 -179.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -71.57 -9.83 58.83 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.571 -0.452 . . . . 42.41 112.009 -179.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 60.6 p -89.41 22.6 2.86 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.563 -0.903 . . . . 40.67 108.563 179.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' ILE . . . . . . . . . . . . . 78.8 mt -142.72 -48.27 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 107.935 -1.135 . . . . 39.31 107.935 179.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 44.4 p -64.64 -39.36 93.55 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.071 -1.085 . . . . 37.76 108.071 179.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' GLY . . . . . . . . . . . . . . . 83.73 2.48 89.83 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 107.479 -2.248 . . . . 39.94 107.479 -178.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 3.6 p -138.93 174.66 10.28 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.769 1.026 . . . . 37.31 113.769 -178.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 36.8 t -69.33 145.45 52.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 114.907 -1.042 . . . . 38.31 111.762 -179.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 27.6 m -131.36 142.01 44.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.424 -0.353 . . . . 40.46 110.608 179.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 89.2 p -62.43 163.92 8.02 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.434 0.635 . . . . 44.34 111.782 -179.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -70.79 -28.37 64.61 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.909 -1.145 . . . . 56.92 107.909 179.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' ASN . . . . . 0.476 ' O ' ' N ' ' B' ' 153' ' ' ALA . 75.8 m-20 -62.38 -47.96 81.84 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.659 -0.867 . . . . 50.31 108.659 179.063 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' VAL . . . . . . . . . . . . . 72.7 t -56.85 -33.71 42.03 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.58 0 CA-C-N 115.767 -0.651 . . . . 37.36 109.658 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' VAL . . . . . . . . . . . . . 67.5 t -77.48 -48.25 24.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.24 -0.652 . . . . 34.48 109.24 178.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 67.4 mt -60.46 -51.89 67.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 108.569 -0.9 . . . . 35.71 108.569 178.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 153' ' ' ALA . . . . . 0.476 ' N ' ' O ' ' B' ' 149' ' ' ASN . . . -52.84 -51.29 61.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.556 -0.747 . . . . 33.36 110.385 179.863 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 154' ' ' MET . . . . . . . . . . . . . 50.1 tpp -59.98 -22.41 62.51 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 113.866 1.061 . . . . 29.37 113.866 -179.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 155' ' ' SER . . . . . . . . . . . . . 39.2 m -80.19 -26.53 39.17 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 113.831 1.048 . . . . 27.75 113.831 -178.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 156' ' ' GLY . . . . . . . . . . . . . . . -74.04 -51.88 8.5 Favored Glycine 0 N--CA 1.451 -0.36 0 N-CA-C 106.953 -2.459 . . . . 29.91 106.953 178.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 71.5 mt -54.22 -35.35 29.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.251 -0.474 . . . . 31.06 109.884 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 158' ' ' SER . . . . . . . . . . . . . 71.2 m -75.04 -38.29 61.48 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.564 -0.289 . . . . 33.18 111.089 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 159' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -64.7 -50.66 66.1 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 107.366 -1.346 . . . . 30.36 107.366 179.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 58.3 t -54.24 -45.06 67.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 115.389 -0.823 . . . . 31.33 109.927 179.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 161' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -55.89 -46.77 78.27 Favored 'General case' 0 C--N 1.332 -0.189 0 O-C-N 123.449 0.468 . . . . 29.94 109.992 178.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 162' ' ' VAL . . . . . . . . . . . . . 64.9 t -61.75 -48.4 88.85 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.583 0 N-CA-C 108.191 -1.04 . . . . 27.7 108.191 -179.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -48.61 -53.12 18.0 Favored Glycine 0 CA--C 1.509 -0.315 0 C-N-CA 121.116 -0.564 . . . . 26.24 112.714 -179.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -56.64 -37.4 70.7 Favored 'General case' 0 C--O 1.222 -0.375 0 N-CA-C 114.124 1.157 . . . . 37.01 114.124 179.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 58.4 t -70.06 -53.87 21.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 119.91 -0.716 . . . . 31.58 110.115 179.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 166' ' ' VAL . . . . . . . . . . . . . 88.3 t -50.55 -45.88 26.73 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 120.382 -0.527 . . . . 32.58 111.894 -179.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 167' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -60.42 -44.94 95.25 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 120.535 -0.466 . . . . 50.98 110.841 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 168' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -64.81 -49.92 68.75 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 105.385 -2.08 . . . . 42.07 105.385 179.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 169' ' ' ALA . . . . . . . . . . . . . . . -52.78 -42.08 64.68 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.327 -0.852 . . . . 28.19 111.541 -179.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 170' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.01 -46.32 74.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.909 0.385 . . . . 28.7 110.964 179.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -59.78 -37.7 79.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 38.74 109.34 179.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 172' ' ' VAL . . . . . . . . . . . . . 57.6 t -64.0 -61.36 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 N-CA-C 106.308 -1.738 . . . . 36.84 106.308 177.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 173' ' ' CYS . . . . . . . . . . . . . 44.9 t -32.53 -55.2 0.35 Allowed 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 124.137 0.975 . . . . 38.0 112.548 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 174' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -72.74 -35.93 67.62 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 117.957 2.577 . . . . 47.51 117.957 -177.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -69.82 -27.36 64.81 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 119.123 -1.031 . . . . 41.49 108.781 178.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 176' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -80.03 5.11 14.99 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 105.66 -1.978 . . . . 37.21 105.66 176.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 177' ' ' GLY . . . . . 0.412 ' O ' ' O ' ' B' ' 178' ' ' GLU . . . 88.58 -56.11 4.16 Favored Glycine 0 CA--C 1.525 0.679 0 CA-C-N 115.416 -0.811 . . . . 40.92 113.193 -179.162 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 178' ' ' GLU . . . . . 0.412 ' O ' ' O ' ' B' ' 177' ' ' GLY . 33.8 mt-10 -33.87 176.35 0.0 OUTLIER 'General case' 0 C--O 1.236 0.351 0 N-CA-C 118.829 2.9 . . . . 42.06 118.829 -178.749 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 179' ' ' MET . . . . . . . . . . . . . 86.2 mtp -136.6 156.84 76.07 Favored Pre-proline 0 N--CA 1.466 0.345 0 N-CA-C 114.216 1.191 . . . . 47.02 114.216 -178.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 180' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -63.66 163.12 25.52 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 121.781 1.654 . . . . 33.31 108.586 179.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 181' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -57.99 145.0 27.82 Favored 'Cis proline' 0 C--N 1.343 0.271 0 N-CA-C 114.535 0.936 . . . . 32.28 114.535 0.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 182' ' ' LEU . . . . . . . . . . . . . 48.6 mt -64.17 133.31 52.67 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 108.194 -1.039 . . . . 25.84 108.194 179.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 183' ' ' GLN . . . . . 0.406 ' O ' ' N ' ' B' ' 186' ' ' HIS . 17.5 mt-30 -95.2 159.06 33.72 Favored Pre-proline 0 C--O 1.24 0.565 0 CA-C-O 120.883 0.373 . . . . 34.84 111.188 -179.611 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 184' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -51.09 -27.76 22.95 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 120.18 0.587 . . . . 31.05 111.622 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -72.84 -23.64 60.78 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.273 -0.571 . . . . 34.73 110.191 -179.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 186' ' ' HIS . . . . . 0.406 ' N ' ' O ' ' B' ' 183' ' ' GLN . 61.3 m170 -78.37 -38.94 40.68 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 115.707 -0.678 . . . . 42.72 109.209 179.565 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 187' ' ' MET . . . . . . . . . . . . . 26.1 mmt -65.34 -44.17 88.59 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 115.259 -0.882 . . . . 39.54 112.727 -179.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 51.0 mtm180 -78.04 -39.14 42.85 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.867 1.062 . . . . 41.68 113.867 179.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -69.81 -10.97 60.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.334 0.588 . . . . 34.43 110.197 179.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -92.48 -41.43 10.28 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.087 -1.079 . . . . 31.87 108.087 179.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 191' ' ' VAL . . . . . . . . . . . . . 98.3 t -57.32 -40.8 76.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 C-N-CA 120.32 -0.552 . . . . 33.3 109.826 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 192' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -61.51 -51.23 69.5 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 113.572 0.953 . . . . 42.8 113.572 -178.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 193' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -58.0 -37.04 73.53 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.161 0.43 . . . . 44.68 112.161 -179.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 52.8 mt -70.77 -17.96 62.78 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 112.665 0.617 . . . . 29.36 112.665 179.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -89.16 -39.23 13.72 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.027 -1.472 . . . . 38.38 107.027 177.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 196' ' ' SER . . . . . . . . . . . . . 72.0 m -65.9 -34.57 78.43 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.959 -0.756 . . . . 39.11 108.959 178.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 197' ' ' LYS . . . . . 0.498 ' NZ ' ' O ' ' B' ' 321' ' ' HOH . 63.7 mttp -81.19 -7.16 59.51 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 106.659 -1.608 . . . . 45.16 106.659 177.826 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 198' ' ' GLY . . . . . . . . . . . . . . . 53.78 79.84 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 106.761 -2.536 . . . . 41.8 106.761 -177.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -142.14 -11.84 0.84 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.286 0.565 . . . . 51.49 110.495 -179.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 200' ' ' ILE . . . . . . . . . . . . . 36.5 pt -136.03 144.58 48.87 Favored Pre-proline 0 C--N 1.327 -0.387 0 N-CA-C 106.504 -1.665 . . . . 45.71 106.504 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo . . . . . 0 C--O 1.251 1.165 0 CA-C-O 117.078 -1.301 . . . . 50.1 111.376 -179.423 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 300' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 321' ' ' HOH . . . . . 0.498 ' O ' ' NZ ' ' B' ' 197' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LEU . . . . . 0.441 ' HB2' ' OE2' ' A' ' 58' ' ' GLU . 8.7 mp . . . . . 0 N--CA 1.497 1.878 0 N-CA-C 117.456 2.391 . . . . 35.93 117.456 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' PHE . . . . . 0.413 ' O ' ' N ' ' A' ' 34' ' ' LYS . 17.2 m-85 -123.87 -2.79 8.23 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 114.897 1.443 . . . . 37.35 114.897 -178.038 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.6 t -37.7 -20.94 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 117.893 2.553 . . . . 41.41 117.893 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LYS . . . . . 0.413 ' N ' ' O ' ' A' ' 32' ' ' PHE . 50.3 tttm -104.14 -32.95 8.91 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.994 1.109 . . . . 50.52 113.994 -178.898 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . 0.527 ' N ' ' OE1' ' A' ' 35' ' ' GLU . 15.8 mp0 -87.0 -33.8 19.47 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 108.805 -0.813 . . . . 40.33 108.805 179.336 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . 0.814 ' O ' ' HG3' ' A' ' 40' ' ' MET . 47.4 tp -72.42 -21.55 61.24 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 104.838 -2.282 . . . . 35.0 104.838 179.287 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ARG . . . . . 0.535 ' HG3' ' HG2' ' A' ' 49' ' ' PRO . 59.5 ttm-85 -74.18 -39.83 62.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.972 -0.558 . . . . 41.83 110.136 -179.694 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' CYS . . . . . 0.648 ' HB3' ' O ' ' B' ' 307' ' ' HOH . 65.2 m -79.47 -6.45 56.94 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 109.136 -0.69 . . . . 49.44 109.136 178.81 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 49.8 ttm -94.54 -28.82 15.22 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 108.869 -0.789 . . . . 38.57 108.869 -178.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' MET . . . . . 0.814 ' HG3' ' O ' ' A' ' 36' ' ' LEU . 77.0 mtp -72.94 -28.83 62.67 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.088 -1.078 . . . . 34.08 108.088 179.177 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TYR . . . . . 0.527 ' CD1' ' HA ' ' A' ' 47' ' ' GLN . 43.9 t80 -70.56 -46.91 62.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.49 -0.777 . . . . 43.12 110.406 179.32 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -64.74 -6.05 21.49 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.887 -0.673 . . . . 36.04 113.175 -179.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -111.61 -1.55 15.72 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.987 1.106 . . . . 31.81 113.987 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLY . . . . . 0.405 ' HA3' HD11 ' B' ' 170' ' ' LEU . . . 119.77 7.19 9.79 Favored Glycine 0 N--CA 1.444 -0.807 0 N-CA-C 116.94 1.536 . . . . 35.92 116.94 177.878 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASP . . . . . 0.471 ' OD2' ' HB3' ' A' ' 49' ' ' PRO . 46.6 t0 -89.82 -175.26 4.57 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 107.345 -1.354 . . . . 33.76 107.345 179.761 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASP . . . . . 0.461 ' HB2' ' HG3' ' B' ' 181' ' ' PRO . 16.1 t70 -69.9 156.61 38.82 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.495 -1.298 . . . . 42.97 107.495 179.948 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLN . . . . . 0.527 ' HA ' ' CD1' ' A' ' 41' ' ' TYR . 38.6 tt0 -70.18 -4.67 22.63 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 106.817 -1.549 . . . . 48.64 106.817 178.357 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 36.9 t30 -136.05 70.52 63.1 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 114.833 -1.076 . . . . 43.62 110.094 179.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PRO . . . . . 0.535 ' HG2' ' HG3' ' A' ' 37' ' ' ARG . 69.1 Cg_endo -58.41 149.82 71.93 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 N-CA-C 114.167 0.795 . . . . 30.72 114.167 179.889 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' TYR . . . . . 0.541 ' CD2' ' HB2' ' B' ' 181' ' ' PRO . 27.2 m-85 -62.65 119.56 9.48 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.385 -0.968 . . . . 36.5 108.385 178.713 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . 0.4 ' O ' ' C ' ' A' ' 52' ' ' GLU . 1.8 t -47.34 -42.8 22.2 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.925 -0.769 . . . . 38.07 108.925 179.486 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . 0.4 ' C ' ' O ' ' A' ' 51' ' ' THR . 11.4 mp0 -44.09 -61.33 1.51 Allowed 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.198 -0.601 . . . . 49.72 109.933 179.81 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 72.7 m -59.65 -32.19 70.22 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 116.082 1.882 . . . . 38.21 116.082 -179.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . 0.471 HG22 ' SD ' ' A' ' 40' ' ' MET . 57.0 t -66.51 -20.72 27.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.499 0.666 . . . . 39.32 110.704 -179.739 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -77.07 -51.45 11.02 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.295 -1.002 . . . . 37.34 108.295 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ILE . . . . . 0.551 HD11 ' HB3' ' B' ' 184' ' ' PRO . 38.5 mt -54.04 -38.7 38.58 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-N 115.542 -0.753 . . . . 31.15 109.498 178.797 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LEU . . . . . 0.512 ' O ' HG23 ' A' ' 61' ' ' VAL . 0.4 OUTLIER -67.93 -42.38 81.11 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-N 115.958 -0.564 . . . . 38.17 111.978 -179.158 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLU . . . . . 0.441 ' OE2' ' HB2' ' A' ' 31' ' ' LEU . 40.8 tt0 -62.19 -32.95 73.64 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 119.623 -0.831 . . . . 38.91 110.792 -179.494 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -67.6 -57.22 6.82 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 107.753 -1.203 . . . . 33.05 107.753 178.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 56' ' ' ILE . 80.2 mt -43.22 -38.32 2.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.067 -0.515 . . . . 31.15 110.725 -179.97 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 57' ' ' LEU . 58.3 t -75.64 -47.08 34.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.988 -0.551 . . . . 27.57 111.829 -179.338 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 58' ' ' GLU . 63.7 mt -60.71 -36.48 71.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 108.487 -0.931 . . . . 32.14 108.487 179.658 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -68.16 -51.38 46.57 Favored 'General case' 0 C--O 1.222 -0.382 0 N-CA-C 107.523 -1.288 . . . . 41.73 107.523 178.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -51.58 -59.48 4.22 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.53 0.732 . . . . 31.16 112.71 179.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ILE . . . . . 0.512 HD12 HD23 ' B' ' 137' ' ' LEU . 12.3 mt -47.64 -53.98 3.96 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 N-CA-C 109.771 -0.455 . . . . 34.99 109.771 179.768 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.5 m -47.75 -58.12 4.71 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.405 0.682 . . . . 31.73 112.786 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -48.64 -57.85 5.62 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 108.094 -1.076 . . . . 43.27 108.094 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 85.0 mmm -50.96 -45.42 60.81 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 122.891 0.476 . . . . 38.73 109.939 178.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . 0.508 ' O ' ' HG3' ' A' ' 73' ' ' MET . 14.7 m -58.04 -47.08 84.19 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 115.469 -0.787 . . . . 43.5 110.737 -178.941 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -67.46 -43.51 80.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.802 -0.181 . . . . 40.9 110.636 178.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LYS . . . . . 0.521 ' HE3' ' HA ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -60.98 -41.49 96.55 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.982 0.42 . . . . 34.12 111.876 179.793 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ALA . . . . . 0.511 ' O ' HG12 ' A' ' 75' ' ' ILE . . . -64.73 -46.76 80.89 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 114.099 1.148 . . . . 41.33 114.099 -179.405 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' MET . . . . . 0.508 ' HG3' ' O ' ' A' ' 69' ' ' THR . 48.3 mtm -59.31 -46.13 89.41 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 108.806 -0.813 . . . . 41.42 108.806 -179.979 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.4 t -48.35 -12.35 0.04 OUTLIER 'General case' 0 C--O 1.237 0.422 0 N-CA-C 115.764 1.765 . . . . 54.61 115.764 179.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ILE . . . . . 0.511 HG12 ' O ' ' A' ' 72' ' ' ALA . 28.4 pt . . . . . 0 C--O 1.25 1.12 0 CA-C-O 117.992 -1.004 . . . . 50.18 109.705 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' PHE . . . . . 0.569 ' HE2' ' HB2' ' B' ' 118' ' ' LEU . 54.2 p90 . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 107.375 -1.343 . . . . 39.81 107.375 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' SER . . . . . 0.511 ' OG ' ' HG3' ' B' ' 117' ' ' GLN . 94.5 p -106.73 157.57 17.62 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 115.548 1.684 . . . . 38.38 115.548 -178.392 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 115' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' B' ' 119' ' ' ASN . 28.4 tt0 -58.59 -24.26 60.52 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 114.888 -1.051 . . . . 40.93 113.06 179.322 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -76.08 -39.1 56.13 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.438 -0.949 . . . . 47.91 108.438 179.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' GLN . . . . . 0.511 ' HG3' ' OG ' ' B' ' 114' ' ' SER . 33.9 mt-30 -64.19 -40.11 95.41 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 107.303 -1.369 . . . . 43.81 107.303 179.286 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 118' ' ' LEU . . . . . 0.569 ' HB2' ' HE2' ' B' ' 113' ' ' PHE . 0.8 OUTLIER -67.11 -44.36 80.16 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.225 -0.898 . . . . 36.78 109.055 -179.713 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 119' ' ' ASN . . . . . 0.435 ' HB2' ' O ' ' B' ' 115' ' ' GLU . 1.4 t-20 -75.22 -16.72 60.46 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.614 -0.721 . . . . 46.8 112.328 -178.674 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 120' ' ' ARG . . . . . . . . . . . . . 37.0 ttm-85 -86.23 -29.65 22.98 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 120.235 -0.586 . . . . 48.38 110.113 178.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -79.57 -29.76 41.41 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.455 0.645 . . . . 35.42 109.44 179.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' GLU . . . . . 0.717 ' OE2' ' HD2' ' B' ' 126' ' ' ARG . 43.1 tp10 -70.9 -38.7 73.0 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.231 -1.026 . . . . 39.56 108.231 -179.44 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 123' ' ' MET . . . . . . . . . . . . . 5.6 tpp -70.21 -40.09 74.78 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 107.048 -1.464 . . . . 50.03 107.048 179.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -57.07 -73.32 0.07 Allowed 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.205 -1.035 . . . . 40.64 108.205 178.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' ARG . . . . . . . . . . . . . 69.3 ttp85 -36.32 -43.6 0.38 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 116.534 2.05 . . . . 37.43 116.534 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' ARG . . . . . 0.717 ' HD2' ' OE2' ' B' ' 122' ' ' GLU . 4.8 mtp180 -94.05 -17.99 22.29 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 117.942 2.571 . . . . 34.35 117.942 -177.296 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 54.1 p -59.3 144.16 47.23 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 109.126 -0.694 . . . . 35.86 109.126 179.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -170.92 157.51 5.39 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 109.53 -0.545 . . . . 30.42 109.53 -179.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' PHE . . . . . . . . . . . . . 88.6 m-85 -82.05 150.52 65.13 Favored Pre-proline 0 C--N 1.323 -0.581 0 C-N-CA 118.973 -1.091 . . . . 36.88 108.76 178.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' PRO . . . . . 0.509 ' CG ' ' OE2' ' A' ' 35' ' ' GLU . 54.1 Cg_exo -65.78 129.54 22.43 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 N-CA-C 108.971 -1.203 . . . . 39.46 108.971 179.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 131' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -54.31 -41.07 68.56 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-O 121.735 0.778 . . . . 42.38 110.124 179.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -47.26 -52.16 16.86 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 115.339 1.607 . . . . 38.76 115.339 -178.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' ALA . . . . . . . . . . . . . . . -79.06 -19.46 51.32 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 115.017 1.488 . . . . 37.61 115.017 -178.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' ILE . . . . . 0.466 ' O ' HG13 ' B' ' 138' ' ' ILE . 48.7 mm -77.91 -32.46 17.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 108.324 -0.991 . . . . 35.74 108.324 179.869 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 135' ' ' LYS . . . . . 0.495 ' O ' ' HG3' ' B' ' 139' ' ' GLN . 51.4 tttp -70.9 -46.97 61.61 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.307 -0.998 . . . . 34.39 108.307 179.379 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 136' ' ' ARG . . . . . 0.539 ' HG3' HH11 ' B' ' 136' ' ' ARG . 30.9 ttt85 -62.53 -38.4 89.83 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 113.436 0.902 . . . . 65.32 113.436 -179.824 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 137' ' ' LEU . . . . . 0.512 HD23 HD12 ' A' ' 65' ' ' ILE . 56.3 tp -73.27 -40.66 64.42 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.178 -0.465 . . . . 39.82 110.915 -179.742 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 138' ' ' ILE . . . . . 0.524 HD11 ' HG2' ' B' ' 154' ' ' MET . 88.3 mt -69.56 -43.4 80.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 112.311 0.486 . . . . 34.58 112.311 -179.551 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 139' ' ' GLN . . . . . 0.495 ' HG3' ' O ' ' B' ' 135' ' ' LYS . 25.7 mt-30 -71.57 -9.83 58.83 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.571 -0.452 . . . . 42.41 112.009 -179.392 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 60.6 p -89.41 22.6 2.86 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.563 -0.903 . . . . 40.67 108.563 179.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' ILE . . . . . . . . . . . . . 78.8 mt -142.72 -48.27 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 107.935 -1.135 . . . . 39.31 107.935 179.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 44.4 p -64.64 -39.36 93.55 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.071 -1.085 . . . . 37.76 108.071 179.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 143' ' ' GLY . . . . . . . . . . . . . . . 83.73 2.48 89.83 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 107.479 -2.248 . . . . 39.94 107.479 -178.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 3.6 p -138.93 174.66 10.28 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.769 1.026 . . . . 37.31 113.769 -178.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 36.8 t -69.33 145.45 52.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 114.907 -1.042 . . . . 38.31 111.762 -179.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 27.6 m -131.36 142.01 44.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.424 -0.353 . . . . 40.46 110.608 179.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 147' ' ' SER . . . . . 0.547 ' OG ' HG23 ' B' ' 150' ' ' VAL . 89.2 p -62.43 163.92 8.02 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.434 0.635 . . . . 44.34 111.782 -179.3 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 148' ' ' GLN . . . . . 0.617 ' O ' HG13 ' B' ' 152' ' ' ILE . 7.6 tt0 -70.79 -28.37 64.61 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.909 -1.145 . . . . 56.92 107.909 179.975 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 149' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -62.38 -47.96 81.84 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.659 -0.867 . . . . 50.31 108.659 179.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 150' ' ' VAL . . . . . 0.547 HG23 ' OG ' ' B' ' 147' ' ' SER . 72.7 t -56.85 -33.71 42.03 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.58 0 CA-C-N 115.767 -0.651 . . . . 37.36 109.658 179.127 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 151' ' ' VAL . . . . . . . . . . . . . 67.5 t -77.48 -48.25 24.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.24 -0.652 . . . . 34.48 109.24 178.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 152' ' ' ILE . . . . . 0.617 HG13 ' O ' ' B' ' 148' ' ' GLN . 67.4 mt -60.46 -51.89 67.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 108.569 -0.9 . . . . 35.71 108.569 178.825 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 153' ' ' ALA . . . . . . . . . . . . . . . -52.84 -51.29 61.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.556 -0.747 . . . . 33.36 110.385 179.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 154' ' ' MET . . . . . 0.524 ' HG2' HD11 ' B' ' 138' ' ' ILE . 50.1 tpp -59.98 -22.41 62.51 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 113.866 1.061 . . . . 29.37 113.866 -179.188 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 155' ' ' SER . . . . . . . . . . . . . 39.2 m -80.19 -26.53 39.17 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 113.831 1.048 . . . . 27.75 113.831 -178.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 156' ' ' GLY . . . . . 0.56 ' O ' HG23 ' B' ' 160' ' ' VAL . . . -74.04 -51.88 8.5 Favored Glycine 0 N--CA 1.451 -0.36 0 N-CA-C 106.953 -2.459 . . . . 29.91 106.953 178.376 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 71.5 mt -54.22 -35.35 29.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.251 -0.474 . . . . 31.06 109.884 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 158' ' ' SER . . . . . 0.604 ' O ' HG23 ' B' ' 162' ' ' VAL . 71.2 m -75.04 -38.29 61.48 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.564 -0.289 . . . . 33.18 111.089 -179.785 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 159' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -64.7 -50.66 66.1 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 107.366 -1.346 . . . . 30.36 107.366 179.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 160' ' ' VAL . . . . . 0.56 HG23 ' O ' ' B' ' 156' ' ' GLY . 58.3 t -54.24 -45.06 67.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 115.389 -0.823 . . . . 31.33 109.927 179.001 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 161' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -55.89 -46.77 78.27 Favored 'General case' 0 C--N 1.332 -0.189 0 O-C-N 123.449 0.468 . . . . 29.94 109.992 178.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 162' ' ' VAL . . . . . 0.604 HG23 ' O ' ' B' ' 158' ' ' SER . 64.9 t -61.75 -48.4 88.85 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.583 0 N-CA-C 108.191 -1.04 . . . . 27.7 108.191 -179.963 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -48.61 -53.12 18.0 Favored Glycine 0 CA--C 1.509 -0.315 0 C-N-CA 121.116 -0.564 . . . . 26.24 112.714 -179.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -56.64 -37.4 70.7 Favored 'General case' 0 C--O 1.222 -0.375 0 N-CA-C 114.124 1.157 . . . . 37.01 114.124 179.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 58.4 t -70.06 -53.87 21.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 119.91 -0.716 . . . . 31.58 110.115 179.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 166' ' ' VAL . . . . . . . . . . . . . 88.3 t -50.55 -45.88 26.73 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 120.382 -0.527 . . . . 32.58 111.894 -179.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 167' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -60.42 -44.94 95.25 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 120.535 -0.466 . . . . 50.98 110.841 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 168' ' ' GLU . . . . . 0.507 ' O ' HG23 ' B' ' 172' ' ' VAL . 20.6 tp10 -64.81 -49.92 68.75 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 105.385 -2.08 . . . . 42.07 105.385 179.248 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 169' ' ' ALA . . . . . . . . . . . . . . . -52.78 -42.08 64.68 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.327 -0.852 . . . . 28.19 111.541 -179.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 170' ' ' LEU . . . . . 1.001 HD23 HD21 ' B' ' 182' ' ' LEU . 75.7 mt -67.01 -46.32 74.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.909 0.385 . . . . 28.7 110.964 179.926 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -59.78 -37.7 79.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 38.74 109.34 179.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 172' ' ' VAL . . . . . 0.507 HG23 ' O ' ' B' ' 168' ' ' GLU . 57.6 t -64.0 -61.36 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 N-CA-C 106.308 -1.738 . . . . 36.84 106.308 177.951 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 173' ' ' CYS . . . . . . . . . . . . . 44.9 t -32.53 -55.2 0.35 Allowed 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 124.137 0.975 . . . . 38.0 112.548 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 174' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -72.74 -35.93 67.62 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 117.957 2.577 . . . . 47.51 117.957 -177.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -69.82 -27.36 64.81 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 119.123 -1.031 . . . . 41.49 108.781 178.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 176' ' ' TRP . . . . . 0.679 ' CZ2' ' HG2' ' B' ' 189' ' ' GLU . 29.6 m0 -80.03 5.11 14.99 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 105.66 -1.978 . . . . 37.21 105.66 176.803 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 177' ' ' GLY . . . . . 0.412 ' O ' ' O ' ' B' ' 178' ' ' GLU . . . 88.58 -56.11 4.16 Favored Glycine 0 CA--C 1.525 0.679 0 CA-C-N 115.416 -0.811 . . . . 40.92 113.193 -179.162 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 178' ' ' GLU . . . . . 0.412 ' O ' ' O ' ' B' ' 177' ' ' GLY . 33.8 mt-10 -33.87 176.35 0.0 OUTLIER 'General case' 0 C--O 1.236 0.351 0 N-CA-C 118.829 2.9 . . . . 42.06 118.829 -178.749 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 179' ' ' MET . . . . . . . . . . . . . 86.2 mtp -136.6 156.84 76.07 Favored Pre-proline 0 N--CA 1.466 0.345 0 N-CA-C 114.216 1.191 . . . . 47.02 114.216 -178.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 180' ' ' PRO . . . . . 0.486 ' HA ' ' C ' ' B' ' 181' ' ' PRO . 76.0 Cg_exo -63.66 163.12 25.52 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 121.781 1.654 . . . . 33.31 108.586 179.475 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 181' ' ' PRO . . . . . 0.541 ' HB2' ' CD2' ' A' ' 50' ' ' TYR . 88.6 Cg_exo -57.99 145.0 27.82 Favored 'Cis proline' 0 C--N 1.343 0.271 0 N-CA-C 114.535 0.936 . . . . 32.28 114.535 0.79 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 182' ' ' LEU . . . . . 1.001 HD21 HD23 ' B' ' 170' ' ' LEU . 48.6 mt -64.17 133.31 52.67 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 108.194 -1.039 . . . . 25.84 108.194 179.913 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 183' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -95.2 159.06 33.72 Favored Pre-proline 0 C--O 1.24 0.565 0 CA-C-O 120.883 0.373 . . . . 34.84 111.188 -179.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 184' ' ' PRO . . . . . 0.551 ' HB3' HD11 ' A' ' 56' ' ' ILE . 21.7 Cg_exo -51.09 -27.76 22.95 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 120.18 0.587 . . . . 31.05 111.622 179.792 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -72.84 -23.64 60.78 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.273 -0.571 . . . . 34.73 110.191 -179.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 61.3 m170 -78.37 -38.94 40.68 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 115.707 -0.678 . . . . 42.72 109.209 179.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 187' ' ' MET . . . . . 0.711 ' O ' HG23 ' B' ' 191' ' ' VAL . 26.1 mmt -65.34 -44.17 88.59 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 115.259 -0.882 . . . . 39.54 112.727 -179.427 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 51.0 mtm180 -78.04 -39.14 42.85 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.867 1.062 . . . . 41.68 113.867 179.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 189' ' ' GLU . . . . . 0.679 ' HG2' ' CZ2' ' B' ' 176' ' ' TRP . 18.2 tp10 -69.81 -10.97 60.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.334 0.588 . . . . 34.43 110.197 179.123 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -92.48 -41.43 10.28 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.087 -1.079 . . . . 31.87 108.087 179.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 191' ' ' VAL . . . . . 0.711 HG23 ' O ' ' B' ' 187' ' ' MET . 98.3 t -57.32 -40.8 76.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 C-N-CA 120.32 -0.552 . . . . 33.3 109.826 -179.956 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 192' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -61.51 -51.23 69.5 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 113.572 0.953 . . . . 42.8 113.572 -178.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 193' ' ' ARG . . . . . 0.562 ' O ' ' HG3' ' B' ' 197' ' ' LYS . 96.9 mtt180 -58.0 -37.04 73.53 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.161 0.43 . . . . 44.68 112.161 -179.829 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 52.8 mt -70.77 -17.96 62.78 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 112.665 0.617 . . . . 29.36 112.665 179.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -89.16 -39.23 13.72 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.027 -1.472 . . . . 38.38 107.027 177.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 196' ' ' SER . . . . . . . . . . . . . 72.0 m -65.9 -34.57 78.43 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.959 -0.756 . . . . 39.11 108.959 178.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 197' ' ' LYS . . . . . 0.562 ' HG3' ' O ' ' B' ' 193' ' ' ARG . 63.7 mttp -81.19 -7.16 59.51 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 106.659 -1.608 . . . . 45.16 106.659 177.826 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 198' ' ' GLY . . . . . . . . . . . . . . . 53.78 79.84 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 106.761 -2.536 . . . . 41.8 106.761 -177.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -142.14 -11.84 0.84 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.286 0.565 . . . . 51.49 110.495 -179.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 200' ' ' ILE . . . . . . . . . . . . . 36.5 pt -136.03 144.58 48.87 Favored Pre-proline 0 C--N 1.327 -0.387 0 N-CA-C 106.504 -1.665 . . . . 45.71 106.504 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 201' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo . . . . . 0 C--O 1.251 1.165 0 CA-C-O 117.078 -1.301 . . . . 50.1 111.376 -179.423 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 300' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 305' ' ' HOH . . . . . 0.443 ' O ' ' HD2' ' B' ' 184' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 307' ' ' HOH . . . . . 0.648 ' O ' ' HB3' ' A' ' 38' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.441 ' HB2' ' OE2' ' A' ' 58' ' ' GLU . 8.7 mp . . . . . 0 N--CA 1.497 1.878 0 N-CA-C 117.456 2.391 . . . . 35.93 117.456 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.413 ' O ' ' N ' ' A' ' 34' ' ' LYS . 17.2 m-85 -123.87 -2.79 8.23 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 114.897 1.443 . . . . 37.35 114.897 -178.038 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.6 t -37.7 -20.94 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 117.893 2.553 . . . . 41.41 117.893 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.413 ' N ' ' O ' ' A' ' 32' ' ' PHE . 50.3 tttm -104.14 -32.95 8.91 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.994 1.109 . . . . 50.52 113.994 -178.898 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.527 ' N ' ' OE1' ' A' ' 35' ' ' GLU . 15.8 mp0 -87.0 -33.8 19.47 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 108.805 -0.813 . . . . 40.33 108.805 179.336 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.814 ' O ' ' HG3' ' A' ' 40' ' ' MET . 47.4 tp -72.42 -21.55 61.24 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 104.838 -2.282 . . . . 35.0 104.838 179.287 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.535 ' HG3' ' HG2' ' A' ' 49' ' ' PRO . 59.5 ttm-85 -74.18 -39.83 62.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.972 -0.558 . . . . 41.83 110.136 -179.694 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.648 ' HB3' ' O ' ' B' ' 307' ' ' HOH . 65.2 m -79.47 -6.45 56.94 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 109.136 -0.69 . . . . 49.44 109.136 178.81 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 49.8 ttm -94.54 -28.82 15.22 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 108.869 -0.789 . . . . 38.57 108.869 -178.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' MET . . . . . 0.814 ' HG3' ' O ' ' A' ' 36' ' ' LEU . 77.0 mtp -72.94 -28.83 62.67 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.088 -1.078 . . . . 34.08 108.088 179.177 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.527 ' CD1' ' HA ' ' A' ' 47' ' ' GLN . 43.9 t80 -70.56 -46.91 62.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.49 -0.777 . . . . 43.12 110.406 179.32 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -64.74 -6.05 21.49 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.887 -0.673 . . . . 36.04 113.175 -179.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -111.61 -1.55 15.72 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.987 1.106 . . . . 31.81 113.987 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.405 ' HA3' HD11 ' B' ' 170' ' ' LEU . . . 119.77 7.19 9.79 Favored Glycine 0 N--CA 1.444 -0.807 0 N-CA-C 116.94 1.536 . . . . 35.92 116.94 177.878 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.471 ' OD2' ' HB3' ' A' ' 49' ' ' PRO . 46.6 t0 -89.82 -175.26 4.57 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 107.345 -1.354 . . . . 33.76 107.345 179.761 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.461 ' HB2' ' HG3' ' B' ' 181' ' ' PRO . 16.1 t70 -69.9 156.61 38.82 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 107.495 -1.298 . . . . 42.97 107.495 179.948 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.527 ' HA ' ' CD1' ' A' ' 41' ' ' TYR . 38.6 tt0 -70.18 -4.67 22.63 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 106.817 -1.549 . . . . 48.64 106.817 178.357 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -136.05 70.52 63.1 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 114.833 -1.076 . . . . 43.62 110.094 179.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.535 ' HG2' ' HG3' ' A' ' 37' ' ' ARG . 69.1 Cg_endo -58.41 149.82 71.93 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 N-CA-C 114.167 0.795 . . . . 30.72 114.167 179.889 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.541 ' CD2' ' HB2' ' B' ' 181' ' ' PRO . 27.2 m-85 -62.65 119.56 9.48 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.385 -0.968 . . . . 36.5 108.385 178.713 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . 0.4 ' O ' ' C ' ' A' ' 52' ' ' GLU . 1.8 t -47.34 -42.8 22.2 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.925 -0.769 . . . . 38.07 108.925 179.486 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.4 ' C ' ' O ' ' A' ' 51' ' ' THR . 11.4 mp0 -44.09 -61.33 1.51 Allowed 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.198 -0.601 . . . . 49.72 109.933 179.81 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 72.7 m -59.65 -32.19 70.22 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 116.082 1.882 . . . . 38.21 116.082 -179.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.471 HG22 ' SD ' ' A' ' 40' ' ' MET . 57.0 t -66.51 -20.72 27.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.499 0.666 . . . . 39.32 110.704 -179.739 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -77.07 -51.45 11.02 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.295 -1.002 . . . . 37.34 108.295 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.551 HD11 ' HB3' ' B' ' 184' ' ' PRO . 38.5 mt -54.04 -38.7 38.58 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-N 115.542 -0.753 . . . . 31.15 109.498 178.797 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.512 ' O ' HG23 ' A' ' 61' ' ' VAL . 0.4 OUTLIER -67.93 -42.38 81.11 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-N 115.958 -0.564 . . . . 38.17 111.978 -179.158 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.441 ' OE2' ' HB2' ' A' ' 31' ' ' LEU . 40.8 tt0 -62.19 -32.95 73.64 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 119.623 -0.831 . . . . 38.91 110.792 -179.494 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -67.6 -57.22 6.82 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 107.753 -1.203 . . . . 33.05 107.753 178.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 56' ' ' ILE . 80.2 mt -43.22 -38.32 2.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.067 -0.515 . . . . 31.15 110.725 -179.97 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 57' ' ' LEU . 58.3 t -75.64 -47.08 34.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.988 -0.551 . . . . 27.57 111.829 -179.338 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 58' ' ' GLU . 63.7 mt -60.71 -36.48 71.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 108.487 -0.931 . . . . 32.14 108.487 179.658 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -68.16 -51.38 46.57 Favored 'General case' 0 C--O 1.222 -0.382 0 N-CA-C 107.523 -1.288 . . . . 41.73 107.523 178.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -51.58 -59.48 4.22 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.53 0.732 . . . . 31.16 112.71 179.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.512 HD12 HD23 ' B' ' 137' ' ' LEU . 12.3 mt -47.64 -53.98 3.96 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 N-CA-C 109.771 -0.455 . . . . 34.99 109.771 179.768 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.5 m -47.75 -58.12 4.71 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.405 0.682 . . . . 31.73 112.786 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -48.64 -57.85 5.62 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 108.094 -1.076 . . . . 43.27 108.094 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 85.0 mmm -50.96 -45.42 60.81 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 122.891 0.476 . . . . 38.73 109.939 178.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . 0.508 ' O ' ' HG3' ' A' ' 73' ' ' MET . 14.7 m -58.04 -47.08 84.19 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 115.469 -0.787 . . . . 43.5 110.737 -178.941 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.598 ' HA ' ' HE2' ' A' ' 73' ' ' MET . 20.6 m170 -67.46 -43.51 80.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.802 -0.181 . . . . 40.9 110.636 178.537 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.521 ' HE3' ' HA ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -60.98 -41.49 96.55 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.982 0.42 . . . . 34.12 111.876 179.793 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.511 ' O ' HG12 ' A' ' 75' ' ' ILE . . . -64.73 -46.76 80.89 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 114.099 1.148 . . . . 41.33 114.099 -179.405 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' MET . . . . . 0.598 ' HE2' ' HA ' ' A' ' 70' ' ' HIS . 48.3 mtm -59.31 -46.13 89.41 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 108.806 -0.813 . . . . 41.42 108.806 -179.979 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 16.4 t -48.35 -12.35 0.04 OUTLIER 'General case' 0 C--O 1.237 0.422 0 N-CA-C 115.764 1.765 . . . . 54.61 115.764 179.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.511 HG12 ' O ' ' A' ' 72' ' ' ALA . 28.4 pt . . . . . 0 C--O 1.25 1.12 0 CA-C-O 117.992 -1.004 . . . . 50.18 109.705 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' PHE . . . . . 0.569 ' HE2' ' HB2' ' B' ' 118' ' ' LEU . 54.2 p90 . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 107.375 -1.343 . . . . 39.81 107.375 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' SER . . . . . 0.811 ' H ' HE21 ' B' ' 117' ' ' GLN . 94.5 p -106.73 157.57 17.62 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 115.548 1.684 . . . . 38.38 115.548 -178.392 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' B' ' 119' ' ' ASN . 28.4 tt0 -58.59 -24.26 60.52 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 114.888 -1.051 . . . . 40.93 113.06 179.322 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -76.08 -39.1 56.13 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.438 -0.949 . . . . 47.91 108.438 179.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' GLN . . . . . 0.811 HE21 ' H ' ' B' ' 114' ' ' SER . 52.3 mt-30 -64.19 -40.11 95.41 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 107.303 -1.369 . . . . 43.81 107.303 179.286 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' LEU . . . . . 0.569 ' HB2' ' HE2' ' B' ' 113' ' ' PHE . 0.8 OUTLIER -67.11 -44.36 80.16 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.225 -0.898 . . . . 36.78 109.055 -179.713 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' ASN . . . . . 0.435 ' HB2' ' O ' ' B' ' 115' ' ' GLU . 1.4 t-20 -75.22 -16.72 60.46 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.614 -0.721 . . . . 46.8 112.328 -178.674 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' ARG . . . . . . . . . . . . . 37.0 ttm-85 -86.23 -29.65 22.98 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 120.235 -0.586 . . . . 48.38 110.113 178.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -79.57 -29.76 41.41 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.455 0.645 . . . . 35.42 109.44 179.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' GLU . . . . . 0.717 ' OE2' ' HD2' ' B' ' 126' ' ' ARG . 43.1 tp10 -70.9 -38.7 73.0 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.231 -1.026 . . . . 39.56 108.231 -179.44 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' MET . . . . . . . . . . . . . 5.6 tpp -70.21 -40.09 74.78 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 107.048 -1.464 . . . . 50.03 107.048 179.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -57.07 -73.32 0.07 Allowed 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.205 -1.035 . . . . 40.64 108.205 178.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' ARG . . . . . . . . . . . . . 69.3 ttp85 -36.32 -43.6 0.38 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 116.534 2.05 . . . . 37.43 116.534 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' ARG . . . . . 0.717 ' HD2' ' OE2' ' B' ' 122' ' ' GLU . 4.8 mtp180 -94.05 -17.99 22.29 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 117.942 2.571 . . . . 34.35 117.942 -177.296 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 54.1 p -59.3 144.16 47.23 Favored 'General case' 0 CA--C 1.515 -0.404 0 N-CA-C 109.126 -0.694 . . . . 35.86 109.126 179.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -170.92 157.51 5.39 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 109.53 -0.545 . . . . 30.42 109.53 -179.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' PHE . . . . . . . . . . . . . 88.6 m-85 -82.05 150.52 65.13 Favored Pre-proline 0 C--N 1.323 -0.581 0 C-N-CA 118.973 -1.091 . . . . 36.88 108.76 178.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' PRO . . . . . 0.509 ' CG ' ' OE2' ' A' ' 35' ' ' GLU . 54.1 Cg_exo -65.78 129.54 22.43 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 N-CA-C 108.971 -1.203 . . . . 39.46 108.971 179.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -54.31 -41.07 68.56 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-O 121.735 0.778 . . . . 42.38 110.124 179.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -47.26 -52.16 16.86 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 115.339 1.607 . . . . 38.76 115.339 -178.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' ALA . . . . . . . . . . . . . . . -79.06 -19.46 51.32 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 115.017 1.488 . . . . 37.61 115.017 -178.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' ILE . . . . . 0.466 ' O ' HG13 ' B' ' 138' ' ' ILE . 48.7 mm -77.91 -32.46 17.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 108.324 -0.991 . . . . 35.74 108.324 179.869 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' LYS . . . . . 0.495 ' O ' ' HG3' ' B' ' 139' ' ' GLN . 51.4 tttp -70.9 -46.97 61.61 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.307 -0.998 . . . . 34.39 108.307 179.379 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' ARG . . . . . 0.539 ' HG3' HH11 ' B' ' 136' ' ' ARG . 30.9 ttt85 -62.53 -38.4 89.83 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 113.436 0.902 . . . . 65.32 113.436 -179.824 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.512 HD23 HD12 ' A' ' 65' ' ' ILE . 56.3 tp -73.27 -40.66 64.42 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.178 -0.465 . . . . 39.82 110.915 -179.742 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' ILE . . . . . 0.524 HD11 ' HG2' ' B' ' 154' ' ' MET . 88.3 mt -69.56 -43.4 80.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 112.311 0.486 . . . . 34.58 112.311 -179.551 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' GLN . . . . . 0.495 ' HG3' ' O ' ' B' ' 135' ' ' LYS . 79.1 mt-30 -71.57 -9.83 58.83 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.571 -0.452 . . . . 42.41 112.009 -179.392 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' SER . . . . . . . . . . . . . 60.6 p -89.41 22.6 2.86 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.563 -0.903 . . . . 40.67 108.563 179.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' ILE . . . . . . . . . . . . . 78.8 mt -142.72 -48.27 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 107.935 -1.135 . . . . 39.31 107.935 179.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' THR . . . . . . . . . . . . . 44.4 p -64.64 -39.36 93.55 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.071 -1.085 . . . . 37.76 108.071 179.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' GLY . . . . . . . . . . . . . . . 83.73 2.48 89.83 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 107.479 -2.248 . . . . 39.94 107.479 -178.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 3.6 p -138.93 174.66 10.28 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.769 1.026 . . . . 37.31 113.769 -178.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' SER . . . . . 0.418 ' HA ' HE21 ' B' ' 139' ' ' GLN . 36.8 t -69.33 145.45 52.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 114.907 -1.042 . . . . 38.31 111.762 -179.923 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' VAL . . . . . . . . . . . . . 27.6 m -131.36 142.01 44.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.424 -0.353 . . . . 40.46 110.608 179.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' SER . . . . . 0.547 ' OG ' HG23 ' B' ' 150' ' ' VAL . 89.2 p -62.43 163.92 8.02 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.434 0.635 . . . . 44.34 111.782 -179.3 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' GLN . . . . . 0.617 ' O ' HG13 ' B' ' 152' ' ' ILE . 7.6 tt0 -70.79 -28.37 64.61 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.909 -1.145 . . . . 56.92 107.909 179.975 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -62.38 -47.96 81.84 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.659 -0.867 . . . . 50.31 108.659 179.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' VAL . . . . . 0.547 HG23 ' OG ' ' B' ' 147' ' ' SER . 72.7 t -56.85 -33.71 42.03 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.58 0 CA-C-N 115.767 -0.651 . . . . 37.36 109.658 179.127 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' VAL . . . . . . . . . . . . . 67.5 t -77.48 -48.25 24.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.24 -0.652 . . . . 34.48 109.24 178.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 152' ' ' ILE . . . . . 0.617 HG13 ' O ' ' B' ' 148' ' ' GLN . 67.4 mt -60.46 -51.89 67.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 108.569 -0.9 . . . . 35.71 108.569 178.825 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 153' ' ' ALA . . . . . . . . . . . . . . . -52.84 -51.29 61.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.556 -0.747 . . . . 33.36 110.385 179.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 154' ' ' MET . . . . . 0.524 ' HG2' HD11 ' B' ' 138' ' ' ILE . 50.1 tpp -59.98 -22.41 62.51 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 113.866 1.061 . . . . 29.37 113.866 -179.188 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 155' ' ' SER . . . . . . . . . . . . . 39.2 m -80.19 -26.53 39.17 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 113.831 1.048 . . . . 27.75 113.831 -178.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 156' ' ' GLY . . . . . 0.56 ' O ' HG23 ' B' ' 160' ' ' VAL . . . -74.04 -51.88 8.5 Favored Glycine 0 N--CA 1.451 -0.36 0 N-CA-C 106.953 -2.459 . . . . 29.91 106.953 178.376 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 71.5 mt -54.22 -35.35 29.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.251 -0.474 . . . . 31.06 109.884 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 158' ' ' SER . . . . . 0.604 ' O ' HG23 ' B' ' 162' ' ' VAL . 71.2 m -75.04 -38.29 61.48 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.564 -0.289 . . . . 33.18 111.089 -179.785 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 159' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -64.7 -50.66 66.1 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 107.366 -1.346 . . . . 30.36 107.366 179.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 160' ' ' VAL . . . . . 0.56 HG23 ' O ' ' B' ' 156' ' ' GLY . 58.3 t -54.24 -45.06 67.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 115.389 -0.823 . . . . 31.33 109.927 179.001 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 161' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -55.89 -46.77 78.27 Favored 'General case' 0 C--N 1.332 -0.189 0 O-C-N 123.449 0.468 . . . . 29.94 109.992 178.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 162' ' ' VAL . . . . . 0.604 HG23 ' O ' ' B' ' 158' ' ' SER . 64.9 t -61.75 -48.4 88.85 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.583 0 N-CA-C 108.191 -1.04 . . . . 27.7 108.191 -179.963 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 163' ' ' GLY . . . . . . . . . . . . . . . -48.61 -53.12 18.0 Favored Glycine 0 CA--C 1.509 -0.315 0 C-N-CA 121.116 -0.564 . . . . 26.24 112.714 -179.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 164' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -56.64 -37.4 70.7 Favored 'General case' 0 C--O 1.222 -0.375 0 N-CA-C 114.124 1.157 . . . . 37.01 114.124 179.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 165' ' ' VAL . . . . . . . . . . . . . 58.4 t -70.06 -53.87 21.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 119.91 -0.716 . . . . 31.58 110.115 179.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 166' ' ' VAL . . . . . . . . . . . . . 88.3 t -50.55 -45.88 26.73 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 120.382 -0.527 . . . . 32.58 111.894 -179.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 167' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -60.42 -44.94 95.25 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 120.535 -0.466 . . . . 50.98 110.841 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 168' ' ' GLU . . . . . 0.507 ' O ' HG23 ' B' ' 172' ' ' VAL . 20.6 tp10 -64.81 -49.92 68.75 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 105.385 -2.08 . . . . 42.07 105.385 179.248 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 169' ' ' ALA . . . . . . . . . . . . . . . -52.78 -42.08 64.68 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.327 -0.852 . . . . 28.19 111.541 -179.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 170' ' ' LEU . . . . . 1.001 HD23 HD21 ' B' ' 182' ' ' LEU . 75.7 mt -67.01 -46.32 74.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.909 0.385 . . . . 28.7 110.964 179.926 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 171' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -59.78 -37.7 79.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 38.74 109.34 179.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 172' ' ' VAL . . . . . 0.507 HG23 ' O ' ' B' ' 168' ' ' GLU . 57.6 t -64.0 -61.36 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 N-CA-C 106.308 -1.738 . . . . 36.84 106.308 177.951 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 173' ' ' CYS . . . . . . . . . . . . . 44.9 t -32.53 -55.2 0.35 Allowed 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 124.137 0.975 . . . . 38.0 112.548 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 174' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -72.74 -35.93 67.62 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 117.957 2.577 . . . . 47.51 117.957 -177.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 175' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -69.82 -27.36 64.81 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 119.123 -1.031 . . . . 41.49 108.781 178.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 176' ' ' TRP . . . . . 0.679 ' CZ2' ' HG2' ' B' ' 189' ' ' GLU . 29.6 m0 -80.03 5.11 14.99 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 105.66 -1.978 . . . . 37.21 105.66 176.803 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 177' ' ' GLY . . . . . 0.412 ' O ' ' O ' ' B' ' 178' ' ' GLU . . . 88.58 -56.11 4.16 Favored Glycine 0 CA--C 1.525 0.679 0 CA-C-N 115.416 -0.811 . . . . 40.92 113.193 -179.162 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 178' ' ' GLU . . . . . 0.412 ' O ' ' O ' ' B' ' 177' ' ' GLY . 33.8 mt-10 -33.87 176.35 0.0 OUTLIER 'General case' 0 C--O 1.236 0.351 0 N-CA-C 118.829 2.9 . . . . 42.06 118.829 -178.749 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 179' ' ' MET . . . . . . . . . . . . . 86.2 mtp -136.6 156.84 76.07 Favored Pre-proline 0 N--CA 1.466 0.345 0 N-CA-C 114.216 1.191 . . . . 47.02 114.216 -178.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 180' ' ' PRO . . . . . 0.486 ' HA ' ' C ' ' B' ' 181' ' ' PRO . 76.0 Cg_exo -63.66 163.12 25.52 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 121.781 1.654 . . . . 33.31 108.586 179.475 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 181' ' ' PRO . . . . . 0.541 ' HB2' ' CD2' ' A' ' 50' ' ' TYR . 88.6 Cg_exo -57.99 145.0 27.82 Favored 'Cis proline' 0 C--N 1.343 0.271 0 N-CA-C 114.535 0.936 . . . . 32.28 114.535 0.79 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 182' ' ' LEU . . . . . 1.001 HD21 HD23 ' B' ' 170' ' ' LEU . 48.6 mt -64.17 133.31 52.67 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 108.194 -1.039 . . . . 25.84 108.194 179.913 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 183' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -95.2 159.06 33.72 Favored Pre-proline 0 C--O 1.24 0.565 0 CA-C-O 120.883 0.373 . . . . 34.84 111.188 -179.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 184' ' ' PRO . . . . . 0.551 ' HB3' HD11 ' A' ' 56' ' ' ILE . 21.7 Cg_exo -51.09 -27.76 22.95 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 120.18 0.587 . . . . 31.05 111.622 179.792 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -72.84 -23.64 60.78 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.273 -0.571 . . . . 34.73 110.191 -179.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . . 61.3 m170 -78.37 -38.94 40.68 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 115.707 -0.678 . . . . 42.72 109.209 179.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 187' ' ' MET . . . . . 0.711 ' O ' HG23 ' B' ' 191' ' ' VAL . 26.1 mmt -65.34 -44.17 88.59 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 115.259 -0.882 . . . . 39.54 112.727 -179.427 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 51.0 mtm180 -78.04 -39.14 42.85 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.867 1.062 . . . . 41.68 113.867 179.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 189' ' ' GLU . . . . . 0.679 ' HG2' ' CZ2' ' B' ' 176' ' ' TRP . 18.2 tp10 -69.81 -10.97 60.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.334 0.588 . . . . 34.43 110.197 179.123 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -92.48 -41.43 10.28 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.087 -1.079 . . . . 31.87 108.087 179.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 191' ' ' VAL . . . . . 0.711 HG23 ' O ' ' B' ' 187' ' ' MET . 98.3 t -57.32 -40.8 76.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 C-N-CA 120.32 -0.552 . . . . 33.3 109.826 -179.956 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 192' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -61.51 -51.23 69.5 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 113.572 0.953 . . . . 42.8 113.572 -178.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 193' ' ' ARG . . . . . 0.562 ' O ' ' HG3' ' B' ' 197' ' ' LYS . 96.9 mtt180 -58.0 -37.04 73.53 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.161 0.43 . . . . 44.68 112.161 -179.829 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 52.8 mt -70.77 -17.96 62.78 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 112.665 0.617 . . . . 29.36 112.665 179.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 195' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -89.16 -39.23 13.72 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.027 -1.472 . . . . 38.38 107.027 177.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 196' ' ' SER . . . . . . . . . . . . . 72.0 m -65.9 -34.57 78.43 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.959 -0.756 . . . . 39.11 108.959 178.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 197' ' ' LYS . . . . . 0.562 ' HG3' ' O ' ' B' ' 193' ' ' ARG . 63.7 mttp -81.19 -7.16 59.51 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 106.659 -1.608 . . . . 45.16 106.659 177.826 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 198' ' ' GLY . . . . . . . . . . . . . . . 53.78 79.84 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 106.761 -2.536 . . . . 41.8 106.761 -177.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 199' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -142.14 -11.84 0.84 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.286 0.565 . . . . 51.49 110.495 -179.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 200' ' ' ILE . . . . . . . . . . . . . 36.5 pt -136.03 144.58 48.87 Favored Pre-proline 0 C--N 1.327 -0.387 0 N-CA-C 106.504 -1.665 . . . . 45.71 106.504 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo . . . . . 0 C--O 1.251 1.165 0 CA-C-O 117.078 -1.301 . . . . 50.1 111.376 -179.423 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 300' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 305' ' ' HOH . . . . . 0.443 ' O ' ' HD2' ' B' ' 184' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 307' ' ' HOH . . . . . 0.648 ' O ' ' HB3' ' A' ' 38' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_