data_1vbv_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 1vbv _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 ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.943 0 CA-C-O 121.093 0.473 . . . . 70.75 110.947 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.3 t -148.72 123.11 9.66 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 107.769 -1.197 . . . . 68.4 107.769 -179.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 67.7 mmtt -69.36 -23.7 63.79 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 114.917 1.451 . . . . 59.24 114.917 -179.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' PHE . . . . . 0.546 ' O ' ' OE1' ' A' ' 10' ' ' GLN . 56.2 m-85 -112.97 -43.56 3.39 Favored 'General case' 0 N--CA 1.463 0.2 1 N-CA-C 123.286 4.55 . . . . 52.45 123.286 -176.721 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 69.06 138.43 0.08 OUTLIER Glycine 0 CA--C 1.529 0.942 0 C-N-CA 116.702 -2.666 . . . . 46.6 118.019 178.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 77.9 mt -57.33 142.44 13.04 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.589 0 N-CA-C 115.885 1.809 . . . . 44.1 115.885 -177.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 87.67 -10.56 69.4 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.895 -0.669 . . . . 41.76 113.87 -179.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLN . . . . . 0.546 ' OE1' ' O ' ' A' ' 6' ' ' PHE . 64.9 tt0 -78.81 144.67 34.87 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.692 0.997 . . . . 39.1 113.692 -179.358 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -88.09 133.04 34.08 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 106.852 -1.536 . . . . 38.92 106.852 177.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 17.6 m -135.27 170.77 18.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 C-N-CA 120.113 -0.635 . . . . 40.09 110.028 -179.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 77.7 mtt-85 -130.33 151.72 50.52 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 115.262 -0.881 . . . . 46.36 108.932 178.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HIS . . . . . 0.475 ' O ' ' N ' ' A' ' 18' ' ' GLY . 5.7 t60 -76.27 114.98 15.56 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 105.932 -1.877 . . . . 47.39 105.932 179.36 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 51.1 m -44.83 -38.59 4.65 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 113.676 0.991 . . . . 56.26 113.676 -178.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.9 tp -92.17 -49.79 6.01 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 115.012 1.486 . . . . 56.36 115.012 -179.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -89.63 -15.93 31.64 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.001 0.741 . . . . 55.19 113.001 -178.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLY . . . . . 0.475 ' N ' ' O ' ' A' ' 14' ' ' HIS . . . 67.51 14.23 64.31 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 118.444 2.137 . . . . 42.55 118.444 178.279 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -66.67 156.4 35.33 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.157 0.978 . . . . 48.4 108.376 178.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.2 tp -99.56 134.55 42.27 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 109.914 -0.402 . . . . 39.07 109.914 179.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -150.36 -176.29 23.24 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 119.917 -1.135 . . . . 35.43 112.931 178.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 65.4 t -131.9 132.31 61.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 108.965 -0.754 . . . . 39.93 108.965 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 98.0 t -75.24 120.75 25.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 108.468 -0.938 . . . . 38.05 108.468 178.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 34.4 m -104.27 -22.49 4.81 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 N-CA-C 113.311 0.856 . . . . 43.91 113.311 -179.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -162.26 158.89 24.94 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 112.314 0.487 . . . . 59.61 112.314 177.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 90.9 mt -126.39 142.8 41.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 112.867 0.691 . . . . 54.41 112.867 -178.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -119.66 109.89 37.62 Favored Pre-proline 0 N--CA 1.468 0.441 0 C-N-CA 123.111 0.564 . . . . 60.07 111.122 -179.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -77.98 172.45 15.55 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 124.807 3.672 . . . . 65.82 113.399 -179.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 81.0 t . . . . . 0 N--CA 1.468 0.469 0 CA-C-N 115.848 -0.615 . . . . 70.81 112.205 178.849 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.203 0 CA-C-O 120.482 0.182 . . . . 70.46 110.901 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ALA . . . . . 0.487 ' CB ' ' CA ' ' A' ' 50' ' ' PRO . . . -26.03 -94.74 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 114.265 1.209 . . . . 68.21 114.265 -179.41 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' PRO . . . . . 0.487 ' CA ' ' CB ' ' A' ' 49' ' ' ALA . 40.9 Cg_endo -81.79 -168.21 6.41 Favored 'Cis proline' 0 C--N 1.359 1.083 1 C-N-CA 136.853 4.105 . . . . 58.73 113.107 -0.216 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 30.2 m95 -112.6 154.44 26.01 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 109.149 -0.686 . . . . 48.62 109.149 179.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -126.18 146.06 50.12 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 115.694 1.739 . . . . 43.58 115.694 -178.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' HIS . . . . . 0.455 ' CD2' ' CE1' ' A' ' 65' ' ' HIS . 73.9 m80 -98.77 115.2 28.25 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 102.602 -3.11 . . . . 39.39 102.602 176.066 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.0 m -133.21 135.8 56.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 C-N-CA 118.995 -1.082 . . . . 40.8 111.13 179.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 87.0 t -88.87 114.99 27.97 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.443 0 N-CA-C 101.502 -3.518 . . . . 42.73 101.502 177.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 30.9 ttm -122.5 137.58 54.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.209 -0.905 . . . . 44.23 110.946 -176.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -86.79 118.44 26.19 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.114 -0.698 . . . . 55.95 109.114 179.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.9 p30 -81.61 -160.59 0.36 Allowed 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 114.477 1.288 . . . . 61.11 114.477 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -49.08 -62.63 1.43 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.374 -1.284 . . . . 72.4 110.529 178.987 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.06 -23.58 67.38 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 113.835 1.05 . . . . 70.87 113.835 -178.599 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 107.26 9.49 29.42 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 119.507 -1.33 . . . . 54.92 110.721 -179.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.4 mt -73.88 128.49 86.56 Favored Pre-proline 0 CA--C 1.514 -0.408 0 N-CA-C 109.219 -0.66 . . . . 44.29 109.219 178.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -82.57 90.85 1.02 Allowed 'Trans proline' 0 N--CA 1.462 -0.375 0 N-CA-C 104.82 -2.8 . . . . 39.42 104.82 179.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.7 t -95.55 152.41 3.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 114.437 1.273 . . . . 44.47 114.437 -177.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' HIS . . . . . 0.455 ' CE1' ' CD2' ' A' ' 53' ' ' HIS . 3.0 t60 -86.97 116.71 25.2 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.738 -1.208 . . . . 49.9 107.738 179.379 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 69.1 p -117.0 156.9 26.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.079 -0.51 . . . . 39.42 109.874 179.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -124.05 107.82 11.7 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 104.543 -2.392 . . . . 37.8 104.543 178.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 9.0 mt -121.14 151.39 39.95 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 115.288 1.588 . . . . 39.01 115.288 -177.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -80.4 148.82 30.42 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 105.653 -1.98 . . . . 41.45 105.653 178.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -49.54 -45.24 47.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.7 0.762 . . . . 44.86 110.813 -179.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.78 -10.38 1.03 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.784 -0.644 . . . . 41.53 112.353 -179.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -98.79 -3.68 35.03 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.938 1.088 . . . . 46.96 113.938 -178.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 66.6 mt -113.17 151.15 31.27 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 115.891 1.811 . . . . 43.53 115.891 -178.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.9 m -135.11 152.17 51.39 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 105.501 -2.037 . . . . 46.2 105.501 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.7 m -68.35 155.5 39.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.88 -0.415 . . . . 48.96 109.88 179.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 28.3 tp10 -105.37 124.13 49.02 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.358 -0.608 . . . . 55.12 109.358 178.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LEU . . . . . 0.528 ' N ' ' CD2' ' A' ' 77' ' ' LEU . 0.0 OUTLIER -62.63 -73.99 0.1 Allowed 'General case' 0 C--O 1.237 0.428 0 N-CA-C 113.589 0.959 . . . . 62.12 113.589 -179.631 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -56.76 149.47 18.06 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 114.215 1.191 . . . . 77.1 114.215 -178.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -102.8 -20.5 14.3 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.028 -0.987 . . . . 73.83 110.618 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -119.22 138.17 53.15 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 109.779 -0.452 . . . . 74.77 109.779 -179.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' HIS . . . . . 0.448 ' ND1' ' OD1' ' A' ' 88' ' ' ASP . 47.2 m80 -137.14 82.88 28.88 Favored Pre-proline 0 CA--C 1.516 -0.338 0 CA-C-N 116.007 -0.542 . . . . 59.01 109.941 -179.896 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_exo -45.51 -42.28 18.26 Favored 'Trans proline' 0 C--O 1.233 0.25 0 C-N-CA 124.149 3.233 . . . . 62.26 113.103 -179.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.67 -8.02 57.31 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 113.271 0.841 . . . . 78.39 113.271 -179.957 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -143.05 55.58 4.07 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.23 0.538 . . . . 60.46 111.587 -179.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -48.16 -44.51 28.37 Favored 'Trans proline' 0 CA--C 1.517 -0.367 1 C-N-CA 126.085 4.523 . . . . 56.57 112.935 -179.705 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.2 p -56.0 -30.21 61.49 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 114.697 1.369 . . . . 57.8 114.697 -177.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 31.5 mmt -77.43 -34.36 54.63 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 120.866 -0.334 . . . . 46.66 111.683 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASP . . . . . 0.448 ' OD1' ' ND1' ' A' ' 81' ' ' HIS . 73.0 m-20 -73.32 -37.15 66.26 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 106.252 -1.758 . . . . 52.25 106.252 177.103 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -39.13 93.68 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.912 0.885 . . . . 69.08 109.523 -179.649 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.96 -50.21 44.12 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 115.412 -0.813 . . . . 46.17 109.74 179.982 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -52.76 -49.2 66.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.181 -0.463 . . . . 49.3 110.322 -179.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -63.24 -47.68 81.43 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.093 0.473 . . . . 67.17 111.885 -179.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 28.4 m -56.83 -59.26 5.3 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.085 -0.709 . . . . 63.21 109.085 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ILE . . . . . 0.438 ' O ' ' N ' ' A' ' 96' ' ' LYS . 20.3 mt -52.63 -40.06 32.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.189 0 N-CA-C 113.649 0.981 . . . . 68.87 113.649 179.822 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 16.9 mtt-85 -62.98 18.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.018 0.437 . . . . 94.96 111.347 179.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . 0.438 ' N ' ' O ' ' A' ' 94' ' ' ILE . 59.4 mttp -145.34 -31.44 0.4 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.89 -0.595 . . . . 88.3 110.179 -179.877 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 117.894 -1.051 . . . . 92.14 111.71 179.873 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.943 0 CA-C-O 121.093 0.473 . . . . 70.75 110.947 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.3 t -148.72 123.11 9.66 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 107.769 -1.197 . . . . 68.4 107.769 -179.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LYS . . . . . 0.425 ' HG2' ' CD ' ' A' ' 70' ' ' GLU . 67.7 mmtt -69.36 -23.7 63.79 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 114.917 1.451 . . . . 59.24 114.917 -179.328 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' PHE . . . . . 0.546 ' O ' ' OE1' ' A' ' 10' ' ' GLN . 56.2 m-85 -112.97 -43.56 3.39 Favored 'General case' 0 N--CA 1.463 0.2 1 N-CA-C 123.286 4.55 . . . . 52.45 123.286 -176.721 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 69.06 138.43 0.08 OUTLIER Glycine 0 CA--C 1.529 0.942 0 C-N-CA 116.702 -2.666 . . . . 46.6 118.019 178.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 77.9 mt -57.33 142.44 13.04 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.589 0 N-CA-C 115.885 1.809 . . . . 44.1 115.885 -177.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 87.67 -10.56 69.4 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.895 -0.669 . . . . 41.76 113.87 -179.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLN . . . . . 0.546 ' OE1' ' O ' ' A' ' 6' ' ' PHE . 64.9 tt0 -78.81 144.67 34.87 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.692 0.997 . . . . 39.1 113.692 -179.358 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -88.09 133.04 34.08 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 106.852 -1.536 . . . . 38.92 106.852 177.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 17.6 m -135.27 170.77 18.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 C-N-CA 120.113 -0.635 . . . . 40.09 110.028 -179.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ARG . . . . . 0.463 ' HA ' ' O ' ' A' ' 19' ' ' TYR . 77.7 mtt-85 -130.33 151.72 50.52 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 115.262 -0.881 . . . . 46.36 108.932 178.432 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HIS . . . . . 0.478 ' CE1' HD23 ' A' ' 17' ' ' LEU . 24.8 t-80 -76.27 114.98 15.56 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 105.932 -1.877 . . . . 47.39 105.932 179.36 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 51.1 m -44.83 -38.59 4.65 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 113.676 0.991 . . . . 56.26 113.676 -178.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.9 tp -92.17 -49.79 6.01 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 115.012 1.486 . . . . 56.36 115.012 -179.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . 0.478 HD23 ' CE1' ' A' ' 14' ' ' HIS . 2.2 mm? -89.63 -15.93 31.64 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.001 0.741 . . . . 55.19 113.001 -178.976 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 14' ' ' HIS . . . 67.51 14.23 64.31 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 118.444 2.137 . . . . 42.55 118.444 178.279 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' TYR . . . . . 0.463 ' O ' ' HA ' ' A' ' 13' ' ' ARG . 49.2 m-85 -66.67 156.4 35.33 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.157 0.978 . . . . 48.4 108.376 178.522 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.2 tp -99.56 134.55 42.27 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 109.914 -0.402 . . . . 39.07 109.914 179.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -150.36 -176.29 23.24 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 119.917 -1.135 . . . . 35.43 112.931 178.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 65.4 t -131.9 132.31 61.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 108.965 -0.754 . . . . 39.93 108.965 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 98.0 t -75.24 120.75 25.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 108.468 -0.938 . . . . 38.05 108.468 178.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' VAL . . . . . 0.641 HG12 ' CD1' ' A' ' 94' ' ' ILE . 34.4 m -104.27 -22.49 4.81 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 N-CA-C 113.311 0.856 . . . . 43.91 113.311 -179.288 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -162.26 158.89 24.94 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 112.314 0.487 . . . . 59.61 112.314 177.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 90.9 mt -126.39 142.8 41.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 112.867 0.691 . . . . 54.41 112.867 -178.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASP . . . . . 0.462 ' O ' ' HB2' ' A' ' 50' ' ' PRO . 72.1 m-20 -119.66 109.89 37.62 Favored Pre-proline 0 N--CA 1.468 0.441 0 C-N-CA 123.111 0.564 . . . . 60.07 111.122 -179.908 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -77.98 172.45 15.55 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 124.807 3.672 . . . . 65.82 113.399 -179.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 81.0 t . . . . . 0 N--CA 1.468 0.469 0 CA-C-N 115.848 -0.615 . . . . 70.81 112.205 178.849 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.203 0 CA-C-O 120.482 0.182 . . . . 70.46 110.901 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ALA . . . . . 0.617 ' HB3' ' HA ' ' A' ' 50' ' ' PRO . . . -26.03 -94.74 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 114.265 1.209 . . . . 68.21 114.265 -179.41 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' PRO . . . . . 0.617 ' HA ' ' HB3' ' A' ' 49' ' ' ALA . 40.9 Cg_endo -81.79 -168.21 6.41 Favored 'Cis proline' 0 C--N 1.359 1.083 1 C-N-CA 136.853 4.105 . . . . 58.73 113.107 -0.216 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 30.2 m95 -112.6 154.44 26.01 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 109.149 -0.686 . . . . 48.62 109.149 179.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -126.18 146.06 50.12 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 115.694 1.739 . . . . 43.58 115.694 -178.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 82.8 m-70 -98.77 115.2 28.25 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 102.602 -3.11 . . . . 39.39 102.602 176.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.0 m -133.21 135.8 56.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 C-N-CA 118.995 -1.082 . . . . 40.8 111.13 179.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 87.0 t -88.87 114.99 27.97 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.443 0 N-CA-C 101.502 -3.518 . . . . 42.73 101.502 177.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 30.9 ttm -122.5 137.58 54.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.209 -0.905 . . . . 44.23 110.946 -176.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -86.79 118.44 26.19 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.114 -0.698 . . . . 55.95 109.114 179.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.9 p30 -81.61 -160.59 0.36 Allowed 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 114.477 1.288 . . . . 61.11 114.477 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -49.08 -62.63 1.43 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.374 -1.284 . . . . 72.4 110.529 178.987 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.06 -23.58 67.38 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 113.835 1.05 . . . . 70.87 113.835 -178.599 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 107.26 9.49 29.42 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 119.507 -1.33 . . . . 54.92 110.721 -179.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.4 mt -73.88 128.49 86.56 Favored Pre-proline 0 CA--C 1.514 -0.408 0 N-CA-C 109.219 -0.66 . . . . 44.29 109.219 178.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -82.57 90.85 1.02 Allowed 'Trans proline' 0 N--CA 1.462 -0.375 0 N-CA-C 104.82 -2.8 . . . . 39.42 104.82 179.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.7 t -95.55 152.41 3.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 114.437 1.273 . . . . 44.47 114.437 -177.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 9.1 t-160 -86.97 116.71 25.2 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.738 -1.208 . . . . 49.9 107.738 179.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 69.1 p -117.0 156.9 26.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.079 -0.51 . . . . 39.42 109.874 179.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -124.05 107.82 11.7 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 104.543 -2.392 . . . . 37.8 104.543 178.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 9.0 mt -121.14 151.39 39.95 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 115.288 1.588 . . . . 39.01 115.288 -177.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -80.4 148.82 30.42 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 105.653 -1.98 . . . . 41.45 105.653 178.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . 0.425 ' CD ' ' HG2' ' A' ' 5' ' ' LYS . 30.1 tt0 -49.54 -45.24 47.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.7 0.762 . . . . 44.86 110.813 -179.894 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.78 -10.38 1.03 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.784 -0.644 . . . . 41.53 112.353 -179.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -98.79 -3.68 35.03 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.938 1.088 . . . . 46.96 113.938 -178.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 66.6 mt -113.17 151.15 31.27 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 115.891 1.811 . . . . 43.53 115.891 -178.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.9 m -135.11 152.17 51.39 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 105.501 -2.037 . . . . 46.2 105.501 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.7 m -68.35 155.5 39.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.88 -0.415 . . . . 48.96 109.88 179.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLU . . . . . 0.43 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 28.3 tp10 -105.37 124.13 49.02 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.358 -0.608 . . . . 55.12 109.358 178.421 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LEU . . . . . 1.094 ' H ' HD22 ' A' ' 77' ' ' LEU . 0.0 OUTLIER -62.63 -73.99 0.1 Allowed 'General case' 0 C--O 1.237 0.428 0 N-CA-C 113.589 0.959 . . . . 62.12 113.589 -179.631 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.3 mt-30 -56.76 149.47 18.06 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 114.215 1.191 . . . . 77.1 114.215 -178.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -102.8 -20.5 14.3 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.028 -0.987 . . . . 73.83 110.618 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -119.22 138.17 53.15 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 109.779 -0.452 . . . . 74.77 109.779 -179.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 47.2 m80 -137.14 82.88 28.88 Favored Pre-proline 0 CA--C 1.516 -0.338 0 CA-C-N 116.007 -0.542 . . . . 59.01 109.941 -179.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_exo -45.51 -42.28 18.26 Favored 'Trans proline' 0 C--O 1.233 0.25 0 C-N-CA 124.149 3.233 . . . . 62.26 113.103 -179.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . 0.532 ' CD ' ' H ' ' A' ' 83' ' ' GLU . 0.0 OUTLIER -77.67 -8.02 57.31 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 113.271 0.841 . . . . 78.39 113.271 -179.957 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLN . . . . . 0.527 ' N ' ' HD3' ' A' ' 85' ' ' PRO . 77.8 mt-30 -143.05 55.58 4.07 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.23 0.538 . . . . 60.46 111.587 -179.733 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' PRO . . . . . 0.527 ' HD3' ' N ' ' A' ' 84' ' ' GLN . 73.0 Cg_exo -48.16 -44.51 28.37 Favored 'Trans proline' 0 CA--C 1.517 -0.367 1 C-N-CA 126.085 4.523 . . . . 56.57 112.935 -179.705 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.2 p -56.0 -30.21 61.49 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 114.697 1.369 . . . . 57.8 114.697 -177.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 31.5 mmt -77.43 -34.36 54.63 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 120.866 -0.334 . . . . 46.66 111.683 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -73.32 -37.15 66.26 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 106.252 -1.758 . . . . 52.25 106.252 177.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -39.13 93.68 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.912 0.885 . . . . 69.08 109.523 -179.649 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.96 -50.21 44.12 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 115.412 -0.813 . . . . 46.17 109.74 179.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -52.76 -49.2 66.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.181 -0.463 . . . . 49.3 110.322 -179.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -63.24 -47.68 81.43 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.093 0.473 . . . . 67.17 111.885 -179.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 28.4 m -56.83 -59.26 5.3 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.085 -0.709 . . . . 63.21 109.085 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ILE . . . . . 0.641 ' CD1' HG12 ' A' ' 24' ' ' VAL . 20.3 mt -52.63 -40.06 32.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.189 0 N-CA-C 113.649 0.981 . . . . 68.87 113.649 179.822 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 16.9 mtt-85 -62.98 18.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.018 0.437 . . . . 94.96 111.347 179.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . 0.59 ' H ' ' C ' ' A' ' 94' ' ' ILE . 59.4 mttp -145.34 -31.44 0.4 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.89 -0.595 . . . . 88.3 110.179 -179.877 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 117.894 -1.051 . . . . 92.14 111.71 179.873 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.943 0 CA-C-O 121.093 0.473 . . . . 70.75 110.947 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.3 t -148.72 123.11 9.66 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 107.769 -1.197 . . . . 68.4 107.769 -179.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.425 ' HG2' ' CD ' ' A' ' 70' ' ' GLU . 67.7 mmtt -69.36 -23.7 63.79 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 114.917 1.451 . . . . 59.24 114.917 -179.328 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.546 ' O ' ' OE1' ' A' ' 10' ' ' GLN . 56.2 m-85 -112.97 -43.56 3.39 Favored 'General case' 0 N--CA 1.463 0.2 1 N-CA-C 123.286 4.55 . . . . 52.45 123.286 -176.721 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 69.06 138.43 0.08 OUTLIER Glycine 0 CA--C 1.529 0.942 0 C-N-CA 116.702 -2.666 . . . . 46.6 118.019 178.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 77.9 mt -57.33 142.44 13.04 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.589 0 N-CA-C 115.885 1.809 . . . . 44.1 115.885 -177.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 87.67 -10.56 69.4 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.895 -0.669 . . . . 41.76 113.87 -179.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.546 ' OE1' ' O ' ' A' ' 6' ' ' PHE . 64.9 tt0 -78.81 144.67 34.87 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 113.692 0.997 . . . . 39.1 113.692 -179.358 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -88.09 133.04 34.08 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 106.852 -1.536 . . . . 38.92 106.852 177.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 17.6 m -135.27 170.77 18.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 C-N-CA 120.113 -0.635 . . . . 40.09 110.028 -179.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.463 ' HA ' ' O ' ' A' ' 19' ' ' TYR . 77.7 mtt-85 -130.33 151.72 50.52 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 115.262 -0.881 . . . . 46.36 108.932 178.432 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HIS . . . . . 0.583 ' HD2' ' H ' ' A' ' 16' ' ' LEU . 5.7 t60 -76.27 114.98 15.56 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 105.932 -1.877 . . . . 47.39 105.932 179.36 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 51.1 m -44.83 -38.59 4.65 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 113.676 0.991 . . . . 56.26 113.676 -178.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.583 ' H ' ' HD2' ' A' ' 14' ' ' HIS . 1.9 tp -92.17 -49.79 6.01 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 115.012 1.486 . . . . 56.36 115.012 -179.023 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.466 HD23 ' CE1' ' A' ' 14' ' ' HIS . 2.2 mm? -89.63 -15.93 31.64 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.001 0.741 . . . . 55.19 113.001 -178.976 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 14' ' ' HIS . . . 67.51 14.23 64.31 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 118.444 2.137 . . . . 42.55 118.444 178.279 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.463 ' O ' ' HA ' ' A' ' 13' ' ' ARG . 49.2 m-85 -66.67 156.4 35.33 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.157 0.978 . . . . 48.4 108.376 178.522 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.2 tp -99.56 134.55 42.27 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 109.914 -0.402 . . . . 39.07 109.914 179.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -150.36 -176.29 23.24 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 119.917 -1.135 . . . . 35.43 112.931 178.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 65.4 t -131.9 132.31 61.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 108.965 -0.754 . . . . 39.93 108.965 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 98.0 t -75.24 120.75 25.47 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 108.468 -0.938 . . . . 38.05 108.468 178.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.641 HG12 ' CD1' ' A' ' 94' ' ' ILE . 34.4 m -104.27 -22.49 4.81 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.154 0 N-CA-C 113.311 0.856 . . . . 43.91 113.311 -179.288 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -162.26 158.89 24.94 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 112.314 0.487 . . . . 59.61 112.314 177.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 90.9 mt -126.39 142.8 41.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 112.867 0.691 . . . . 54.41 112.867 -178.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.462 ' O ' ' HB2' ' A' ' 50' ' ' PRO . 72.1 m-20 -119.66 109.89 37.62 Favored Pre-proline 0 N--CA 1.468 0.441 0 C-N-CA 123.111 0.564 . . . . 60.07 111.122 -179.908 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -77.98 172.45 15.55 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 124.807 3.672 . . . . 65.82 113.399 -179.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 81.0 t . . . . . 0 N--CA 1.468 0.469 0 CA-C-N 115.848 -0.615 . . . . 70.81 112.205 178.849 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.203 0 CA-C-O 120.482 0.182 . . . . 70.46 110.901 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.617 ' HB3' ' HA ' ' A' ' 50' ' ' PRO . . . -26.03 -94.74 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 114.265 1.209 . . . . 68.21 114.265 -179.41 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.617 ' HA ' ' HB3' ' A' ' 49' ' ' ALA . 40.9 Cg_endo -81.79 -168.21 6.41 Favored 'Cis proline' 0 C--N 1.359 1.083 1 C-N-CA 136.853 4.105 . . . . 58.73 113.107 -0.216 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 30.2 m95 -112.6 154.44 26.01 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 109.149 -0.686 . . . . 48.62 109.149 179.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -126.18 146.06 50.12 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 115.694 1.739 . . . . 43.58 115.694 -178.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.602 ' HD2' ' CE1' ' A' ' 65' ' ' HIS . 73.9 m80 -98.77 115.2 28.25 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 102.602 -3.11 . . . . 39.39 102.602 176.066 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.0 m -133.21 135.8 56.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 C-N-CA 118.995 -1.082 . . . . 40.8 111.13 179.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 87.0 t -88.87 114.99 27.97 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.443 0 N-CA-C 101.502 -3.518 . . . . 42.73 101.502 177.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 30.9 ttm -122.5 137.58 54.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.209 -0.905 . . . . 44.23 110.946 -176.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -86.79 118.44 26.19 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.114 -0.698 . . . . 55.95 109.114 179.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.9 p30 -81.61 -160.59 0.36 Allowed 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 114.477 1.288 . . . . 61.11 114.477 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -49.08 -62.63 1.43 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.374 -1.284 . . . . 72.4 110.529 178.987 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.06 -23.58 67.38 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 113.835 1.05 . . . . 70.87 113.835 -178.599 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 107.26 9.49 29.42 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 119.507 -1.33 . . . . 54.92 110.721 -179.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 8.4 mt -73.88 128.49 86.56 Favored Pre-proline 0 CA--C 1.514 -0.408 0 N-CA-C 109.219 -0.66 . . . . 44.29 109.219 178.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -82.57 90.85 1.02 Allowed 'Trans proline' 0 N--CA 1.462 -0.375 0 N-CA-C 104.82 -2.8 . . . . 39.42 104.82 179.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.7 t -95.55 152.41 3.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 114.437 1.273 . . . . 44.47 114.437 -177.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.602 ' CE1' ' HD2' ' A' ' 53' ' ' HIS . 3.0 t60 -86.97 116.71 25.2 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.738 -1.208 . . . . 49.9 107.738 179.379 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 69.1 p -117.0 156.9 26.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.079 -0.51 . . . . 39.42 109.874 179.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -124.05 107.82 11.7 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 104.543 -2.392 . . . . 37.8 104.543 178.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 9.0 mt -121.14 151.39 39.95 Favored 'General case' 0 CA--C 1.507 -0.689 0 N-CA-C 115.288 1.588 . . . . 39.01 115.288 -177.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.723 ' H ' HE21 ' A' ' 72' ' ' GLN . . . -80.4 148.82 30.42 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 105.653 -1.98 . . . . 41.45 105.653 178.384 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.425 ' CD ' ' HG2' ' A' ' 5' ' ' LYS . 30.1 tt0 -49.54 -45.24 47.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.7 0.762 . . . . 44.86 110.813 -179.894 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.78 -10.38 1.03 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.784 -0.644 . . . . 41.53 112.353 -179.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.723 HE21 ' H ' ' A' ' 69' ' ' ALA . 50.1 mt-30 -98.79 -3.68 35.03 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.938 1.088 . . . . 46.96 113.938 -178.989 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 66.6 mt -113.17 151.15 31.27 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 115.891 1.811 . . . . 43.53 115.891 -178.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.9 m -135.11 152.17 51.39 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 105.501 -2.037 . . . . 46.2 105.501 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.7 m -68.35 155.5 39.67 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.88 -0.415 . . . . 48.96 109.88 179.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.43 ' HA ' ' OE1' ' A' ' 76' ' ' GLU . 28.3 tp10 -105.37 124.13 49.02 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 109.358 -0.608 . . . . 55.12 109.358 178.421 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LEU . . . . . 1.094 ' H ' HD22 ' A' ' 77' ' ' LEU . 0.0 OUTLIER -62.63 -73.99 0.1 Allowed 'General case' 0 C--O 1.237 0.428 0 N-CA-C 113.589 0.959 . . . . 62.12 113.589 -179.631 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -56.76 149.47 18.06 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 114.215 1.191 . . . . 77.1 114.215 -178.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -102.8 -20.5 14.3 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 115.028 -0.987 . . . . 73.83 110.618 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -119.22 138.17 53.15 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 109.779 -0.452 . . . . 74.77 109.779 -179.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 47.2 m80 -137.14 82.88 28.88 Favored Pre-proline 0 CA--C 1.516 -0.338 0 CA-C-N 116.007 -0.542 . . . . 59.01 109.941 -179.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_exo -45.51 -42.28 18.26 Favored 'Trans proline' 0 C--O 1.233 0.25 0 C-N-CA 124.149 3.233 . . . . 62.26 113.103 -179.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.532 ' CD ' ' H ' ' A' ' 83' ' ' GLU . 0.0 OUTLIER -77.67 -8.02 57.31 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 113.271 0.841 . . . . 78.39 113.271 -179.957 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.527 ' N ' ' HD3' ' A' ' 85' ' ' PRO . 77.8 mt-30 -143.05 55.58 4.07 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.23 0.538 . . . . 60.46 111.587 -179.733 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.527 ' HD3' ' N ' ' A' ' 84' ' ' GLN . 73.0 Cg_exo -48.16 -44.51 28.37 Favored 'Trans proline' 0 CA--C 1.517 -0.367 1 C-N-CA 126.085 4.523 . . . . 56.57 112.935 -179.705 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.2 p -56.0 -30.21 61.49 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 114.697 1.369 . . . . 57.8 114.697 -177.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 31.5 mmt -77.43 -34.36 54.63 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 120.866 -0.334 . . . . 46.66 111.683 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -73.32 -37.15 66.26 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 106.252 -1.758 . . . . 52.25 106.252 177.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -39.13 93.68 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.912 0.885 . . . . 69.08 109.523 -179.649 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.96 -50.21 44.12 Favored 'General case' 0 C--O 1.225 -0.218 0 CA-C-N 115.412 -0.813 . . . . 46.17 109.74 179.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -52.76 -49.2 66.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.181 -0.463 . . . . 49.3 110.322 -179.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -63.24 -47.68 81.43 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.093 0.473 . . . . 67.17 111.885 -179.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 28.4 m -56.83 -59.26 5.3 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.085 -0.709 . . . . 63.21 109.085 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.641 ' CD1' HG12 ' A' ' 24' ' ' VAL . 20.3 mt -52.63 -40.06 32.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.189 0 N-CA-C 113.649 0.981 . . . . 68.87 113.649 179.822 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 16.9 mtt-85 -62.98 18.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.018 0.437 . . . . 94.96 111.347 179.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.59 ' H ' ' C ' ' A' ' 94' ' ' ILE . 59.4 mttp -145.34 -31.44 0.4 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.89 -0.595 . . . . 88.3 110.179 -179.877 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 117.894 -1.051 . . . . 92.14 111.71 179.873 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_