data_1tig_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 1tig _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 ' 83' ' ' ILE . . . . . 0.417 ' CA ' ' H1 ' ' A' ' 232' ' ' HOH . 3.7 tt . . . . . 0 N--CA 1.517 2.908 0 CA-C-O 122.284 1.04 . . . . 36.44 108.773 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 65.7 m-20 -79.89 167.19 20.84 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-N 113.516 -1.675 . . . . 21.89 111.05 176.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 88.2 t -117.98 102.58 13.49 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.58 0 N-CA-C 107.491 -1.3 . . . . 13.79 107.491 167.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -89.21 142.52 27.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.159 0.504 . . . . 14.21 111.248 -177.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -100.81 130.61 46.86 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-O 121.725 0.774 . . . . 28.59 112.439 -176.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 43.6 t -118.38 111.68 35.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 107.063 -1.458 . . . . 18.13 107.063 174.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 86.7 mtm-85 -95.51 130.15 42.44 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 119.032 -1.067 . . . . 50.7 113.121 -177.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -117.46 144.98 44.47 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.232 -0.894 . . . . 22.36 111.227 -179.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 41.0 t -91.5 149.68 39.85 Favored Pre-proline 0 N--CA 1.468 0.428 0 CA-C-N 114.93 -1.032 . . . . 35.17 109.487 177.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.68 -21.51 21.77 Favored 'Trans proline' 0 C--N 1.331 -0.388 0 N-CA-C 109.828 -0.874 . . . . 30.07 109.828 177.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 32.4 p -98.63 29.65 3.61 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 114.522 -1.217 . . . . 29.33 112.72 178.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 10.9 tt -73.71 130.12 36.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-O 121.308 0.575 . . . . 20.79 112.365 -164.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 86.9 mt-10 -92.83 169.21 10.64 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 108.459 -0.941 . . . . 22.88 108.459 -175.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLU . . . . . 0.788 ' H ' ' H2 ' ' A' ' 178' ' ' HOH . 30.4 tp10 -59.51 -43.73 93.3 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 114.375 1.25 . . . . 33.54 114.375 -167.515 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -71.11 -43.04 68.46 Favored 'General case' 0 CA--C 1.511 -0.525 0 C-N-CA 118.874 -1.13 . . . . 29.67 112.223 -174.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -58.25 -41.16 83.63 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 112.215 0.45 . . . . 36.78 112.215 174.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -56.86 -47.9 79.35 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.6 -0.688 . . . . 16.24 111.929 173.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -66.25 -36.16 82.28 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 120.887 -0.325 . . . . 19.76 110.721 -177.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 88.4 m -63.12 -43.75 97.55 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 122.096 0.951 . . . . 24.61 112.812 176.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -68.4 -37.08 80.01 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 114.66 -1.155 . . . . 25.0 112.954 173.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 24.2 tp -64.35 -41.45 96.75 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 112.229 0.455 . . . . 15.88 112.229 175.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 46.8 ttp180 -58.94 -50.96 72.07 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.996 0.918 . . . . 38.49 109.053 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -58.41 -47.42 83.95 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 115.04 1.496 . . . . 23.72 115.04 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -54.41 -50.41 67.67 Favored 'General case' 0 C--O 1.209 -1.041 0 N-CA-C 113.581 0.956 . . . . 11.66 113.581 171.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 77.9 mtp85 -61.5 -36.63 81.02 Favored 'General case' 0 C--N 1.317 -0.808 0 O-C-N 121.277 -0.889 . . . . 15.7 111.455 176.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -64.58 -41.17 96.44 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.384 0.612 . . . . 36.59 112.621 178.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -65.78 -41.68 91.69 Favored 'General case' 0 C--O 1.21 -0.978 0 O-C-N 121.718 -0.614 . . . . 14.5 112.181 175.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 23.2 mt -68.45 -41.24 80.53 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 116.549 -0.296 . . . . 10.45 111.738 -178.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -62.15 -30.96 71.41 Favored 'General case' 0 C--O 1.219 -0.519 0 O-C-N 123.716 0.635 . . . . 31.29 111.181 175.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 18.9 mmtm -78.49 -5.0 51.34 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.451 0.908 . . . . 31.52 113.451 175.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 96.87 4.6 58.85 Favored Glycine 0 C--O 1.249 1.061 0 CA-C-O 122.278 0.932 . . . . 16.98 113.823 175.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -95.53 149.74 21.09 Favored 'General case' 0 CA--C 1.503 -0.831 0 O-C-N 121.419 -1.048 . . . . 19.52 112.622 -178.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -80.6 158.41 25.72 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 119.286 -0.966 . . . . 16.84 109.617 177.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 71.4 t -126.47 124.16 64.81 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 CA-C-O 121.784 0.802 . . . . 11.74 110.833 -176.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -105.59 110.22 22.47 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.026 -1.472 . . . . 23.52 107.026 172.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -94.59 119.15 32.8 Favored 'General case' 0 CA--C 1.506 -0.734 0 N-CA-C 107.988 -1.116 . . . . 10.4 107.988 -179.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.5 m -122.74 140.83 52.46 Favored 'General case' 0 C--O 1.211 -0.956 0 N-CA-C 114.681 1.364 . . . . 19.6 114.681 -174.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 96.6 mt -119.74 117.65 54.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 108.686 -0.857 . . . . 16.52 108.686 173.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ARG . . . . . 0.431 ' H ' ' H2 ' ' A' ' 216' ' ' HOH . 57.6 ttm-85 -99.28 112.1 24.33 Favored 'General case' 0 C--O 1.245 0.822 0 N-CA-C 108.183 -1.043 . . . . 45.56 108.183 177.33 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -79.06 132.78 36.73 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.054 -0.976 . . . . 24.79 112.853 -175.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -102.72 131.41 49.56 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.143 -1.058 . . . . 43.78 108.143 173.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.01 -174.25 40.77 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.181 -1.009 . . . . 21.81 114.874 -178.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -122.07 47.64 1.87 Allowed 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 112.994 0.738 . . . . 23.8 112.994 -172.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.0 142.29 36.6 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 118.924 -1.11 . . . . 19.6 111.811 175.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 31.2 pt -69.49 -12.26 15.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.688 0.756 . . . . 21.49 111.074 -176.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 5.1 t -110.96 1.62 17.6 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 115.632 -0.713 . . . . 28.8 112.673 -170.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 6.6 m170 -56.63 -49.95 73.48 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 115.931 1.826 . . . . 20.43 115.931 -175.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -62.22 -35.65 79.55 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 121.738 0.78 . . . . 45.2 111.604 -179.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.2 -43.02 78.99 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.517 -0.765 . . . . 37.56 112.538 178.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -82.21 -29.65 9.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 C-N-CA 118.664 -1.214 . . . . 24.64 112.078 -177.741 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -64.46 -38.38 95.7 Favored Glycine 0 C--O 1.223 -0.548 0 N-CA-C 110.357 -1.097 . . . . 16.53 110.357 174.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 31.2 tp60 -63.41 -46.71 85.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.973 0.892 . . . . 37.15 109.628 177.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' ARG . . . . . 0.448 ' CD ' ' O ' ' A' ' 201' ' ' HOH . 53.5 mmm-85 -67.12 -39.53 86.68 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.188 -0.914 . . . . 39.67 112.73 -176.839 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 67.3 t -65.3 -44.26 94.93 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.228 0 CA-C-O 121.876 0.846 . . . . 14.24 112.102 176.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 91.4 mt -71.29 -35.6 71.38 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.774 0.657 . . . . 13.1 112.774 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -63.92 -37.17 86.41 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 121.881 -0.512 . . . . 22.42 111.842 174.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -63.15 -43.37 98.54 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.244 -0.435 . . . . 32.34 111.25 175.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 33.3 tp -63.42 -45.42 91.05 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-O 121.322 0.582 . . . . 14.84 112.279 176.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 43.7 t -60.16 -48.73 80.51 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.134 1.161 . . . . 24.92 114.134 179.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -65.89 -35.72 81.41 Favored 'General case' 0 C--O 1.21 -1.018 0 C-N-CA 123.702 0.801 . . . . 39.92 112.25 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -69.67 -15.89 63.26 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.973 1.101 . . . . 14.41 113.973 176.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' CYS . . . . . . . . . . . . . 75.0 m -110.51 4.88 20.83 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.38 0.881 . . . . 12.25 113.38 178.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -57.82 -28.16 63.81 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 114.272 1.212 . . . . 12.54 114.272 -177.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -66.93 -27.17 67.27 Favored 'General case' 0 C--O 1.213 -0.835 0 N-CA-C 112.686 0.624 . . . . 19.51 112.686 179.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 30.9 pt -124.1 -4.5 6.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 N-CA-C 115.451 1.649 . . . . 13.07 115.451 -176.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -134.84 156.77 48.33 Favored 'General case' 0 C--O 1.216 -0.705 0 N-CA-C 114.297 1.221 . . . . 13.69 114.297 -175.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 36.0 m -111.41 152.27 13.36 Favored 'Isoleucine or valine' 0 C--O 1.244 0.764 0 CA-C-O 122.388 1.09 . . . . 11.09 109.538 167.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' VAL . . . . . 0.844 ' H ' ' H1 ' ' A' ' 221' ' ' HOH . 59.4 t -82.66 115.8 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 CA-C-O 121.81 0.814 . . . . 12.72 110.301 173.608 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -89.81 -38.96 13.4 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.2 -1.037 . . . . 17.04 108.2 -179.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 69.5 m -135.76 109.15 7.86 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.487 -0.779 . . . . 13.35 110.426 174.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -66.91 155.31 90.27 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 115.747 -0.66 . . . . 13.51 110.499 -178.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -45.81 130.42 12.68 Favored 'Trans proline' 0 C--N 1.363 1.309 0 N-CA-C 115.089 1.15 . . . . 15.7 115.089 -173.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 10.8 ptmm? -154.62 154.99 33.9 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.217 -0.902 . . . . 44.82 111.44 -176.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' MET . . . . . . . . . . . . . 93.6 mmm -85.26 145.45 27.54 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.115 -0.948 . . . . 39.73 111.192 -179.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -141.43 73.67 1.43 Allowed 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 106.227 -1.768 . . . . 45.49 106.227 176.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 81.33 -114.47 3.83 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 119.498 -1.334 . . . . 32.91 110.867 -173.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' ARG . . . . . 0.909 HH12 ' H1 ' ' A' ' 224' ' ' HOH . 6.9 mmm180 -106.41 24.96 11.71 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 122.169 0.985 . . . . 42.3 110.083 -179.633 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 15.0 m-20 -127.85 153.54 46.51 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 107.929 -1.137 . . . . 34.15 107.929 179.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 4.1 ttt -123.81 135.99 54.12 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 106.497 -1.668 . . . . 22.18 106.497 168.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' PHE . . . . . . . . . . . . . 34.6 p90 -139.63 162.25 35.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 122.694 1.235 . . . . 16.54 114.194 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 2.6 tp -138.54 142.0 39.28 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 103.655 -2.72 . . . . 18.36 103.655 -179.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 58.6 t -118.16 126.59 75.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 108.295 -1.002 . . . . 8.63 108.295 172.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 75.7 mt -109.29 139.45 44.21 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.599 -1.26 . . . . 9.25 107.599 174.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -117.76 147.13 40.4 Favored Pre-proline 0 C--O 1.223 -0.303 0 N-CA-C 108.18 -1.045 . . . . 10.4 108.18 174.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -62.74 140.25 79.43 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 119.996 0.464 . . . . 17.06 111.729 176.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' LYS . . . . . 0.401 ' NZ ' ' O ' ' A' ' 213' ' ' HOH . 36.9 mttp -59.3 -42.93 92.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.921 -0.581 . . . . 35.82 112.25 174.702 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -132.6 160.45 36.57 Favored 'General case' 0 C--O 1.223 -0.341 0 N-CA-C 109.493 -0.558 . . . . 40.16 109.493 -179.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.102 0 CA-C-O 117.675 -1.155 . . . . 58.11 111.422 -179.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' HOH . . . . . 0.788 ' H2 ' ' H ' ' A' ' 96' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . 0.448 ' O ' ' CD ' ' A' ' 135' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . 0.401 ' O ' ' NZ ' ' A' ' 168' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . 0.431 ' H2 ' ' H ' ' A' ' 121' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . 0.844 ' H1 ' ' H ' ' A' ' 150' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . 0.909 ' H1 ' HH12 ' A' ' 159' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . 0.417 ' H1 ' ' CA ' ' A' ' 83' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ILE . . . . . 0.433 ' HA ' ' O ' ' A' ' 232' ' ' HOH . 3.7 tt . . . . . 0 N--CA 1.517 2.908 0 CA-C-O 122.284 1.04 . . . . 36.44 108.773 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 65.7 m-20 -79.89 167.19 20.84 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-N 113.516 -1.675 . . . . 21.89 111.05 176.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 88.2 t -117.98 102.58 13.49 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.58 0 N-CA-C 107.491 -1.3 . . . . 13.79 107.491 167.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -89.21 142.52 27.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.159 0.504 . . . . 14.21 111.248 -177.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -100.81 130.61 46.86 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-O 121.725 0.774 . . . . 28.59 112.439 -176.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 43.6 t -118.38 111.68 35.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 107.063 -1.458 . . . . 18.13 107.063 174.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 86.7 mtm-85 -95.51 130.15 42.44 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 119.032 -1.067 . . . . 50.7 113.121 -177.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -117.46 144.98 44.47 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.232 -0.894 . . . . 22.36 111.227 -179.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 41.0 t -91.5 149.68 39.85 Favored Pre-proline 0 N--CA 1.468 0.428 0 CA-C-N 114.93 -1.032 . . . . 35.17 109.487 177.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.68 -21.51 21.77 Favored 'Trans proline' 0 C--N 1.331 -0.388 0 N-CA-C 109.828 -0.874 . . . . 30.07 109.828 177.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 32.4 p -98.63 29.65 3.61 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 114.522 -1.217 . . . . 29.33 112.72 178.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 10.9 tt -73.71 130.12 36.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-O 121.308 0.575 . . . . 20.79 112.365 -164.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 86.9 mt-10 -92.83 169.21 10.64 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 108.459 -0.941 . . . . 22.88 108.459 -175.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -59.51 -43.73 93.3 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 114.375 1.25 . . . . 33.54 114.375 -167.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -71.11 -43.04 68.46 Favored 'General case' 0 CA--C 1.511 -0.525 0 C-N-CA 118.874 -1.13 . . . . 29.67 112.223 -174.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -58.25 -41.16 83.63 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 112.215 0.45 . . . . 36.78 112.215 174.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -56.86 -47.9 79.35 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.6 -0.688 . . . . 16.24 111.929 173.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -66.25 -36.16 82.28 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 120.887 -0.325 . . . . 19.76 110.721 -177.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 88.4 m -63.12 -43.75 97.55 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 122.096 0.951 . . . . 24.61 112.812 176.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -68.4 -37.08 80.01 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 114.66 -1.155 . . . . 25.0 112.954 173.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 24.2 tp -64.35 -41.45 96.75 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 112.229 0.455 . . . . 15.88 112.229 175.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 46.8 ttp180 -58.94 -50.96 72.07 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.996 0.918 . . . . 38.49 109.053 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -58.41 -47.42 83.95 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 115.04 1.496 . . . . 23.72 115.04 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -54.41 -50.41 67.67 Favored 'General case' 0 C--O 1.209 -1.041 0 N-CA-C 113.581 0.956 . . . . 11.66 113.581 171.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 77.9 mtp85 -61.5 -36.63 81.02 Favored 'General case' 0 C--N 1.317 -0.808 0 O-C-N 121.277 -0.889 . . . . 15.7 111.455 176.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . 0.69 ' O ' ' HG2' ' A' ' 112' ' ' LYS . 18.6 tttm -64.58 -41.17 96.44 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.384 0.612 . . . . 36.59 112.621 178.001 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -65.78 -41.68 91.69 Favored 'General case' 0 C--O 1.21 -0.978 0 O-C-N 121.718 -0.614 . . . . 14.5 112.181 175.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 23.2 mt -68.45 -41.24 80.53 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 116.549 -0.296 . . . . 10.45 111.738 -178.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -62.15 -30.96 71.41 Favored 'General case' 0 C--O 1.219 -0.519 0 O-C-N 123.716 0.635 . . . . 31.29 111.181 175.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LYS . . . . . 0.69 ' HG2' ' O ' ' A' ' 108' ' ' LYS . 18.9 mmtm -78.49 -5.0 51.34 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.451 0.908 . . . . 31.52 113.451 175.274 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 96.87 4.6 58.85 Favored Glycine 0 C--O 1.249 1.061 0 CA-C-O 122.278 0.932 . . . . 16.98 113.823 175.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -95.53 149.74 21.09 Favored 'General case' 0 CA--C 1.503 -0.831 0 O-C-N 121.419 -1.048 . . . . 19.52 112.622 -178.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -80.6 158.41 25.72 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 119.286 -0.966 . . . . 16.84 109.617 177.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 71.4 t -126.47 124.16 64.81 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 CA-C-O 121.784 0.802 . . . . 11.74 110.833 -176.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -105.59 110.22 22.47 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.026 -1.472 . . . . 23.52 107.026 172.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -94.59 119.15 32.8 Favored 'General case' 0 CA--C 1.506 -0.734 0 N-CA-C 107.988 -1.116 . . . . 10.4 107.988 -179.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.5 m -122.74 140.83 52.46 Favored 'General case' 0 C--O 1.211 -0.956 0 N-CA-C 114.681 1.364 . . . . 19.6 114.681 -174.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 96.6 mt -119.74 117.65 54.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 108.686 -0.857 . . . . 16.52 108.686 173.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 57.6 ttm-85 -99.28 112.1 24.33 Favored 'General case' 0 C--O 1.245 0.822 0 N-CA-C 108.183 -1.043 . . . . 45.56 108.183 177.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -79.06 132.78 36.73 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.054 -0.976 . . . . 24.79 112.853 -175.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -102.72 131.41 49.56 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.143 -1.058 . . . . 43.78 108.143 173.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.01 -174.25 40.77 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.181 -1.009 . . . . 21.81 114.874 -178.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -122.07 47.64 1.87 Allowed 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 112.994 0.738 . . . . 23.8 112.994 -172.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.0 142.29 36.6 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 118.924 -1.11 . . . . 19.6 111.811 175.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 31.2 pt -69.49 -12.26 15.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.688 0.756 . . . . 21.49 111.074 -176.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' THR . . . . . 0.501 ' O ' HG23 ' A' ' 132' ' ' ILE . 5.1 t -110.96 1.62 17.6 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 115.632 -0.713 . . . . 28.8 112.673 -170.02 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -56.63 -49.95 73.48 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 115.931 1.826 . . . . 20.43 115.931 -175.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -62.22 -35.65 79.55 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 121.738 0.78 . . . . 45.2 111.604 -179.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.2 -43.02 78.99 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.517 -0.765 . . . . 37.56 112.538 178.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ILE . . . . . 0.501 HG23 ' O ' ' A' ' 128' ' ' THR . 1.0 OUTLIER -82.21 -29.65 9.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 C-N-CA 118.664 -1.214 . . . . 24.64 112.078 -177.741 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -64.46 -38.38 95.7 Favored Glycine 0 C--O 1.223 -0.548 0 N-CA-C 110.357 -1.097 . . . . 16.53 110.357 174.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 31.2 tp60 -63.41 -46.71 85.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.973 0.892 . . . . 37.15 109.628 177.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' ARG . . . . . 0.821 ' HD2' ' O ' ' A' ' 201' ' ' HOH . 53.5 mmm-85 -67.12 -39.53 86.68 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.188 -0.914 . . . . 39.67 112.73 -176.839 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 67.3 t -65.3 -44.26 94.93 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.228 0 CA-C-O 121.876 0.846 . . . . 14.24 112.102 176.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 91.4 mt -71.29 -35.6 71.38 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.774 0.657 . . . . 13.1 112.774 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -63.92 -37.17 86.41 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 121.881 -0.512 . . . . 22.42 111.842 174.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -63.15 -43.37 98.54 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.244 -0.435 . . . . 32.34 111.25 175.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 33.3 tp -63.42 -45.42 91.05 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-O 121.322 0.582 . . . . 14.84 112.279 176.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 43.7 t -60.16 -48.73 80.51 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.134 1.161 . . . . 24.92 114.134 179.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -65.89 -35.72 81.41 Favored 'General case' 0 C--O 1.21 -1.018 0 C-N-CA 123.702 0.801 . . . . 39.92 112.25 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -69.67 -15.89 63.26 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.973 1.101 . . . . 14.41 113.973 176.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' CYS . . . . . . . . . . . . . 75.0 m -110.51 4.88 20.83 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.38 0.881 . . . . 12.25 113.38 178.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -57.82 -28.16 63.81 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 114.272 1.212 . . . . 12.54 114.272 -177.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -66.93 -27.17 67.27 Favored 'General case' 0 C--O 1.213 -0.835 0 N-CA-C 112.686 0.624 . . . . 19.51 112.686 179.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 30.9 pt -124.1 -4.5 6.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 N-CA-C 115.451 1.649 . . . . 13.07 115.451 -176.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -134.84 156.77 48.33 Favored 'General case' 0 C--O 1.216 -0.705 0 N-CA-C 114.297 1.221 . . . . 13.69 114.297 -175.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 36.0 m -111.41 152.27 13.36 Favored 'Isoleucine or valine' 0 C--O 1.244 0.764 0 CA-C-O 122.388 1.09 . . . . 11.09 109.538 167.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 59.4 t -82.66 115.8 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 CA-C-O 121.81 0.814 . . . . 12.72 110.301 173.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -89.81 -38.96 13.4 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.2 -1.037 . . . . 17.04 108.2 -179.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 69.5 m -135.76 109.15 7.86 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.487 -0.779 . . . . 13.35 110.426 174.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -66.91 155.31 90.27 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 115.747 -0.66 . . . . 13.51 110.499 -178.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -45.81 130.42 12.68 Favored 'Trans proline' 0 C--N 1.363 1.309 0 N-CA-C 115.089 1.15 . . . . 15.7 115.089 -173.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 10.8 ptmm? -154.62 154.99 33.9 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.217 -0.902 . . . . 44.82 111.44 -176.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' MET . . . . . . . . . . . . . 93.6 mmm -85.26 145.45 27.54 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.115 -0.948 . . . . 39.73 111.192 -179.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -141.43 73.67 1.43 Allowed 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 106.227 -1.768 . . . . 45.49 106.227 176.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 81.33 -114.47 3.83 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 119.498 -1.334 . . . . 32.91 110.867 -173.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 6.9 mmm180 -106.41 24.96 11.71 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 122.169 0.985 . . . . 42.3 110.083 -179.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 15.0 m-20 -127.85 153.54 46.51 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 107.929 -1.137 . . . . 34.15 107.929 179.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 4.1 ttt -123.81 135.99 54.12 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 106.497 -1.668 . . . . 22.18 106.497 168.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' PHE . . . . . . . . . . . . . 34.6 p90 -139.63 162.25 35.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 122.694 1.235 . . . . 16.54 114.194 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 2.6 tp -138.54 142.0 39.28 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 103.655 -2.72 . . . . 18.36 103.655 -179.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 58.6 t -118.16 126.59 75.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 108.295 -1.002 . . . . 8.63 108.295 172.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 75.7 mt -109.29 139.45 44.21 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.599 -1.26 . . . . 9.25 107.599 174.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -117.76 147.13 40.4 Favored Pre-proline 0 C--O 1.223 -0.303 0 N-CA-C 108.18 -1.045 . . . . 10.4 108.18 174.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -62.74 140.25 79.43 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 119.996 0.464 . . . . 17.06 111.729 176.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' LYS . . . . . 0.446 ' NZ ' ' O ' ' A' ' 213' ' ' HOH . 36.9 mttp -59.3 -42.93 92.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.921 -0.581 . . . . 35.82 112.25 174.702 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 169' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -132.6 160.45 36.57 Favored 'General case' 0 C--O 1.223 -0.341 0 N-CA-C 109.493 -0.558 . . . . 40.16 109.493 -179.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.102 0 CA-C-O 117.675 -1.155 . . . . 58.11 111.422 -179.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . 0.821 ' O ' ' HD2' ' A' ' 135' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . 0.446 ' O ' ' NZ ' ' A' ' 168' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . 0.433 ' O ' ' HA ' ' A' ' 83' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.433 ' HA ' ' O ' ' A' ' 232' ' ' HOH . 3.7 tt . . . . . 0 N--CA 1.517 2.908 0 CA-C-O 122.284 1.04 . . . . 36.439999999999998 108.773 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 65.7 m-20 -79.89 167.19 20.84 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-N 113.516 -1.675 . . . . 21.890000000000001 111.05 176.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 88.2 t -117.98 102.58 13.49 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.58 0 N-CA-C 107.491 -1.3 . . . . 13.789999999999999 107.491 167.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -89.21 142.52 27.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.159 0.504 . . . . 14.210000000000001 111.248 -177.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -100.81 130.61 46.86 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-O 121.725 0.774 . . . . 28.59 112.439 -176.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 43.6 t -118.38 111.68 35.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 107.063 -1.458 . . . . 18.129999999999999 107.063 174.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 86.7 mtm-85 -95.51 130.15 42.44 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 119.032 -1.067 . . . . 50.700000000000003 113.121 -177.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -117.46 144.98 44.47 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.232 -0.894 . . . . 22.359999999999999 111.227 -179.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 41.0 t -91.5 149.68 39.85 Favored Pre-proline 0 N--CA 1.468 0.428 0 CA-C-N 114.93 -1.032 . . . . 35.170000000000002 109.487 177.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.68 -21.51 21.77 Favored 'Trans proline' 0 C--N 1.331 -0.388 0 N-CA-C 109.828 -0.874 . . . . 30.07 109.828 177.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 32.4 p -98.63 29.65 3.61 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 114.522 -1.217 . . . . 29.329999999999998 112.72 178.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 10.9 tt -73.71 130.12 36.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-O 121.308 0.575 . . . . 20.789999999999999 112.365 -164.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 86.9 mt-10 -92.83 169.21 10.64 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 108.459 -0.941 . . . . 22.879999999999999 108.459 -175.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -59.51 -43.73 93.3 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 114.375 1.25 . . . . 33.539999999999999 114.375 -167.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -71.11 -43.04 68.46 Favored 'General case' 0 CA--C 1.511 -0.525 0 C-N-CA 118.874 -1.13 . . . . 29.670000000000002 112.223 -174.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -58.25 -41.16 83.63 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 112.215 0.45 . . . . 36.780000000000001 112.215 174.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -56.86 -47.9 79.35 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.6 -0.688 . . . . 16.239999999999998 111.929 173.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -66.25 -36.16 82.28 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 120.887 -0.325 . . . . 19.760000000000002 110.721 -177.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 88.4 m -63.12 -43.75 97.55 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 122.096 0.951 . . . . 24.609999999999999 112.812 176.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -68.4 -37.08 80.01 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 114.66 -1.155 . . . . 25.0 112.954 173.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 24.2 tp -64.35 -41.45 96.75 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 112.229 0.455 . . . . 15.880000000000001 112.229 175.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 46.8 ttp180 -58.94 -50.96 72.07 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.996 0.918 . . . . 38.490000000000002 109.053 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -58.41 -47.42 83.95 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 115.04 1.496 . . . . 23.719999999999999 115.04 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -54.41 -50.41 67.67 Favored 'General case' 0 C--O 1.209 -1.041 0 N-CA-C 113.581 0.956 . . . . 11.66 113.581 171.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 77.9 mtp85 -61.5 -36.63 81.02 Favored 'General case' 0 C--N 1.317 -0.808 0 O-C-N 121.277 -0.889 . . . . 15.699999999999999 111.455 176.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.69 ' O ' ' HG2' ' A' ' 112' ' ' LYS . 18.6 tttm -64.58 -41.17 96.44 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.384 0.612 . . . . 36.590000000000003 112.621 178.001 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -65.78 -41.68 91.69 Favored 'General case' 0 C--O 1.21 -0.978 0 O-C-N 121.718 -0.614 . . . . 14.5 112.181 175.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 23.2 mt -68.45 -41.24 80.53 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 116.549 -0.296 . . . . 10.449999999999999 111.738 -178.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -62.15 -30.96 71.41 Favored 'General case' 0 C--O 1.219 -0.519 0 O-C-N 123.716 0.635 . . . . 31.289999999999999 111.181 175.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.69 ' HG2' ' O ' ' A' ' 108' ' ' LYS . 18.9 mmtm -78.49 -5.0 51.34 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 113.451 0.908 . . . . 31.52 113.451 175.274 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 96.87 4.6 58.85 Favored Glycine 0 C--O 1.249 1.061 0 CA-C-O 122.278 0.932 . . . . 16.98 113.823 175.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -95.53 149.74 21.09 Favored 'General case' 0 CA--C 1.503 -0.831 0 O-C-N 121.419 -1.048 . . . . 19.52 112.622 -178.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -80.6 158.41 25.72 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 119.286 -0.966 . . . . 16.84 109.617 177.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 71.4 t -126.47 124.16 64.81 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 CA-C-O 121.784 0.802 . . . . 11.74 110.833 -176.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -105.59 110.22 22.47 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 107.026 -1.472 . . . . 23.52 107.026 172.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -94.59 119.15 32.8 Favored 'General case' 0 CA--C 1.506 -0.734 0 N-CA-C 107.988 -1.116 . . . . 10.4 107.988 -179.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.5 m -122.74 140.83 52.46 Favored 'General case' 0 C--O 1.211 -0.956 0 N-CA-C 114.681 1.364 . . . . 19.600000000000001 114.681 -174.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 96.6 mt -119.74 117.65 54.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 108.686 -0.857 . . . . 16.52 108.686 173.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 57.6 ttm-85 -99.28 112.1 24.33 Favored 'General case' 0 C--O 1.245 0.822 0 N-CA-C 108.183 -1.043 . . . . 45.560000000000002 108.183 177.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -79.06 132.78 36.73 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.054 -0.976 . . . . 24.789999999999999 112.853 -175.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.518 ' O ' ' HE1' ' A' ' 129' ' ' HIS . 43.5 mmtm -102.72 131.41 49.56 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 108.143 -1.058 . . . . 43.780000000000001 108.143 173.218 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.01 -174.25 40.77 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.181 -1.009 . . . . 21.809999999999999 114.874 -178.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -122.07 47.64 1.87 Allowed 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 112.994 0.738 . . . . 23.800000000000001 112.994 -172.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.0 142.29 36.6 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 118.924 -1.11 . . . . 19.600000000000001 111.811 175.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 31.2 pt -69.49 -12.26 15.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.688 0.756 . . . . 21.489999999999998 111.074 -176.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' THR . . . . . 0.501 ' O ' HG23 ' A' ' 132' ' ' ILE . 5.1 t -110.96 1.62 17.6 Favored 'General case' 0 CA--C 1.549 0.935 0 CA-C-N 115.632 -0.713 . . . . 28.800000000000001 112.673 -170.02 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HIS . . . . . 0.518 ' HE1' ' O ' ' A' ' 123' ' ' LYS . 6.6 m170 -56.63 -49.95 73.48 Favored 'General case' 0 CA--C 1.513 -0.471 0 N-CA-C 115.931 1.826 . . . . 20.43 115.931 -175.545 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -62.22 -35.65 79.55 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 121.738 0.78 . . . . 45.200000000000003 111.604 -179.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.2 -43.02 78.99 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.517 -0.765 . . . . 37.560000000000002 112.538 178.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.501 HG23 ' O ' ' A' ' 128' ' ' THR . 1.0 OUTLIER -82.21 -29.65 9.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 C-N-CA 118.664 -1.214 . . . . 24.640000000000001 112.078 -177.741 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -64.46 -38.38 95.7 Favored Glycine 0 C--O 1.223 -0.548 0 N-CA-C 110.357 -1.097 . . . . 16.530000000000001 110.357 174.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 31.2 tp60 -63.41 -46.71 85.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.973 0.892 . . . . 37.149999999999999 109.628 177.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.821 ' HD2' ' O ' ' A' ' 201' ' ' HOH . 53.5 mmm-85 -67.12 -39.53 86.68 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.188 -0.914 . . . . 39.670000000000002 112.73 -176.839 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 67.3 t -65.3 -44.26 94.93 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.228 0 CA-C-O 121.876 0.846 . . . . 14.24 112.102 176.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 91.4 mt -71.29 -35.6 71.38 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.774 0.657 . . . . 13.1 112.774 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -63.92 -37.17 86.41 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 121.881 -0.512 . . . . 22.420000000000002 111.842 174.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -63.15 -43.37 98.54 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.244 -0.435 . . . . 32.340000000000003 111.25 175.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 33.3 tp -63.42 -45.42 91.05 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-O 121.322 0.582 . . . . 14.84 112.279 176.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 43.7 t -60.16 -48.73 80.51 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.134 1.161 . . . . 24.920000000000002 114.134 179.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -65.89 -35.72 81.41 Favored 'General case' 0 C--O 1.21 -1.018 0 C-N-CA 123.702 0.801 . . . . 39.920000000000002 112.25 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -69.67 -15.89 63.26 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 113.973 1.101 . . . . 14.41 113.973 176.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' CYS . . . . . . . . . . . . . 75.0 m -110.51 4.88 20.83 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.38 0.881 . . . . 12.25 113.38 178.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -57.82 -28.16 63.81 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 114.272 1.212 . . . . 12.539999999999999 114.272 -177.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -66.93 -27.17 67.27 Favored 'General case' 0 C--O 1.213 -0.835 0 N-CA-C 112.686 0.624 . . . . 19.510000000000002 112.686 179.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 30.9 pt -124.1 -4.5 6.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 N-CA-C 115.451 1.649 . . . . 13.07 115.451 -176.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -134.84 156.77 48.33 Favored 'General case' 0 C--O 1.216 -0.705 0 N-CA-C 114.297 1.221 . . . . 13.69 114.297 -175.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' VAL . . . . . . . . . . . . . 36.0 m -111.41 152.27 13.36 Favored 'Isoleucine or valine' 0 C--O 1.244 0.764 0 CA-C-O 122.388 1.09 . . . . 11.09 109.538 167.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' VAL . . . . . . . . . . . . . 59.4 t -82.66 115.8 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 CA-C-O 121.81 0.814 . . . . 12.720000000000001 110.301 173.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -89.81 -38.96 13.4 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 108.2 -1.037 . . . . 17.039999999999999 108.2 -179.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 69.5 m -135.76 109.15 7.86 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.487 -0.779 . . . . 13.35 110.426 174.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -66.91 155.31 90.27 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 115.747 -0.66 . . . . 13.51 110.499 -178.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -45.81 130.42 12.68 Favored 'Trans proline' 0 C--N 1.363 1.309 0 N-CA-C 115.089 1.15 . . . . 15.699999999999999 115.089 -173.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 10.8 ptmm? -154.62 154.99 33.9 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.217 -0.902 . . . . 44.82 111.44 -176.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' MET . . . . . . . . . . . . . 93.6 mmm -85.26 145.45 27.54 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.115 -0.948 . . . . 39.729999999999997 111.192 -179.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -141.43 73.67 1.43 Allowed 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 106.227 -1.768 . . . . 45.490000000000002 106.227 176.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 81.33 -114.47 3.83 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 119.498 -1.334 . . . . 32.909999999999997 110.867 -173.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 6.9 mmm180 -106.41 24.96 11.71 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 122.169 0.985 . . . . 42.299999999999997 110.083 -179.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 15.0 m-20 -127.85 153.54 46.51 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 107.929 -1.137 . . . . 34.149999999999999 107.929 179.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 4.1 ttt -123.81 135.99 54.12 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 106.497 -1.668 . . . . 22.18 106.497 168.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' PHE . . . . . . . . . . . . . 34.6 p90 -139.63 162.25 35.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 122.694 1.235 . . . . 16.539999999999999 114.194 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 2.6 tp -138.54 142.0 39.28 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 103.655 -2.72 . . . . 18.359999999999999 103.655 -179.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 58.6 t -118.16 126.59 75.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 108.295 -1.002 . . . . 8.6300000000000008 108.295 172.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 75.7 mt -109.29 139.45 44.21 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.599 -1.26 . . . . 9.25 107.599 174.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -117.76 147.13 40.4 Favored Pre-proline 0 C--O 1.223 -0.303 0 N-CA-C 108.18 -1.045 . . . . 10.4 108.18 174.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -62.74 140.25 79.43 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 119.996 0.464 . . . . 17.059999999999999 111.729 176.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' LYS . . . . . 0.446 ' NZ ' ' O ' ' A' ' 213' ' ' HOH . 36.9 mttp -59.3 -42.93 92.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.921 -0.581 . . . . 35.82 112.25 174.702 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -132.6 160.45 36.57 Favored 'General case' 0 C--O 1.223 -0.341 0 N-CA-C 109.493 -0.558 . . . . 40.159999999999997 109.493 -179.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.102 0 CA-C-O 117.675 -1.155 . . . . 58.109999999999999 111.422 -179.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . 0.821 ' O ' ' HD2' ' A' ' 135' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . 0.446 ' O ' ' NZ ' ' A' ' 168' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . 0.433 ' O ' ' HA ' ' A' ' 83' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_