data_1goc_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 1goc _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' MET . . . . . 0.581 ' N ' ' O ' ' A' ' 232' ' ' HOH . 5.9 tpt . . . . . 0 C--O 1.245 0.848 0 CA-C-O 122.678 1.228 . . . . 53.68 109.526 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . 0.269 1.7 mm? -68.54 28.52 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 126.969 3.271 . . . . 46.1 110.111 -179.098 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LYS . . . . . 0.463 ' N ' ' C ' ' A' ' 1' ' ' MET . 0.0 OUTLIER -75.04 135.16 41.26 Favored 'General case' 0 N--CA 1.398 -3.062 1 C-N-CA 137.682 6.393 . . . . 46.86 121.538 -176.411 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.51 141.51 50.15 Favored 'General case' 0 CA--C 1.554 1.129 1 CA-C-N 106.108 -5.042 . . . . 43.86 104.337 177.71 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.335 1.4 t -58.8 140.85 16.55 Favored 'Isoleucine or valine' 0 C--O 1.266 1.967 1 O-C-N 129.486 4.241 . . . . 34.66 100.569 173.259 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -114.18 131.97 56.26 Favored 'General case' 0 C--N 1.283 -2.308 0 O-C-N 125.737 1.898 . . . . 26.0 108.556 -179.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 67.9 mt -125.12 136.63 60.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 O-C-N 125.639 1.837 . . . . 19.6 109.528 -178.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -132.7 133.54 43.65 Favored 'General case' 0 C--N 1.292 -1.904 0 N-CA-C 103.649 -2.722 . . . . 17.14 103.649 -179.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 49.0 p -139.01 159.03 43.1 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 116.583 -2.047 . . . . 15.06 109.805 -177.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -159.21 141.52 13.8 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 128.831 3.832 . . . . 19.63 107.961 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -145.09 146.7 17.3 Favored Glycine 0 N--CA 1.478 1.443 0 O-C-N 127.963 3.289 . . . . 15.23 109.157 177.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 93.2 p -162.04 173.28 14.62 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 119.404 1.602 . . . . 19.38 111.131 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.5 m -134.48 155.09 50.98 Favored 'General case' 0 C--O 1.26 1.616 0 C-N-CA 126.556 1.942 . . . . 28.1 111.92 177.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.22 85.46 3.01 Favored 'General case' 0 CA--C 1.564 1.49 0 N-CA-C 101.684 -3.45 . . . . 25.65 101.684 175.618 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 93.92 135.9 7.86 Favored Glycine 0 N--CA 1.51 3.569 1 N-CA-C 97.761 -6.135 . . . . 21.14 97.761 -179.541 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -121.12 108.92 35.8 Favored Pre-proline 0 C--N 1.275 -2.639 1 O-C-N 130.843 4.496 . . . . 29.06 108.986 -177.891 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -83.13 149.01 65.27 Favored 'Cis proline' 0 C--N 1.319 -0.994 0 O-C-N 126.644 2.918 . . . . 21.48 114.253 -0.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -173.89 -165.99 31.4 Favored Glycine 0 N--CA 1.502 3.041 0 CA-C-O 115.636 -2.758 . . . . 15.96 106.811 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_endo -57.96 140.99 95.86 Favored 'Trans proline' 0 C--N 1.306 -1.669 0 N-CA-C 104.868 -2.781 . . . . 15.59 104.868 -178.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -138.63 170.54 23.9 Favored Glycine 0 N--CA 1.49 2.295 0 CA-C-O 115.612 -2.771 . . . . 14.6 106.407 -177.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -157.6 165.51 33.51 Favored Glycine 0 N--CA 1.511 3.677 0 N-CA-C 107.215 -2.354 . . . . 13.27 107.215 179.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -132.61 164.01 27.64 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 113.052 -1.574 . . . . 15.27 107.718 178.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -152.63 129.31 2.72 Favored Glycine 0 C--O 1.26 1.767 0 N-CA-C 104.263 -3.535 . . . . 14.44 104.263 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -141.21 147.46 38.36 Favored 'General case' 0 C--O 1.248 1.01 0 CA-C-N 112.919 -1.64 . . . . 15.73 109.013 179.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 62.5 mt -129.45 128.86 66.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.374 0 CA-C-O 115.057 -2.401 . . . . 18.46 107.098 178.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.2 mp -111.74 130.11 55.89 Favored 'General case' 0 C--O 1.261 1.677 0 O-C-N 128.245 3.466 . . . . 25.21 106.06 176.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.6 108.75 8.23 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 127.998 3.311 . . . . 34.15 111.231 -178.975 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . 0.271 0.0 OUTLIER -121.04 -123.97 0.28 Allowed 'General case' 0 C--O 1.236 0.383 0 CA-C-O 122.704 1.24 . . . . 42.4 112.224 -178.557 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.6 mtm105 -66.98 79.71 0.12 Allowed 'General case' 0 C--O 1.246 0.917 0 CA-C-N 114.767 -1.106 . . . . 41.52 112.449 -177.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 62.67 -15.04 0.07 OUTLIER Glycine 0 C--O 1.254 1.387 0 O-C-N 126.87 2.606 . . . . 40.61 115.867 179.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -99.17 152.51 19.8 Favored 'General case' 0 C--N 1.306 -1.291 0 C-N-CA 125.349 1.46 . . . . 38.47 112.021 -179.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLU . . . . . 0.681 ' OE2' ' NH1' ' A' ' 132' ' ' ARG . 0.7 OUTLIER -140.75 119.85 12.83 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 112.127 -2.306 . . . . 37.79 109.201 179.376 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.1 mttm -106.21 122.51 46.35 Favored 'General case' 0 C--N 1.305 -1.35 1 C-N-CA 132.475 4.31 . . . . 33.69 110.564 -177.756 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.8 p -107.6 157.41 18.08 Favored 'General case' 0 C--O 1.255 1.394 0 N-CA-C 106.664 -1.606 . . . . 27.3 106.664 177.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -138.95 149.36 44.66 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 115.485 -2.198 . . . . 21.29 105.152 178.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . 0.289 66.7 p -169.03 143.52 3.07 Favored 'General case' 0 C--N 1.297 -1.68 1 O-C-N 129.293 4.121 . . . . 20.59 104.392 176.855 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -154.94 148.74 25.55 Favored 'General case' 0 C--N 1.309 -1.179 0 O-C-N 127.687 3.117 . . . . 16.74 108.636 179.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -116.31 144.29 18.37 Favored Glycine 0 CA--C 1.544 1.852 0 N-CA-C 106.042 -2.823 . . . . 14.11 106.042 -179.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -123.84 129.03 50.37 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 128.407 3.063 . . . . 16.52 110.204 -177.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.6 m -56.18 -39.3 72.17 Favored 'General case' 0 C--N 1.314 -0.968 0 O-C-N 127.24 2.837 . . . . 15.87 111.175 -177.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 34.7 ttt85 -157.07 124.34 5.24 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 124.05 1.881 . . . . 19.88 112.01 -179.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 14.5 t -162.3 -155.11 0.35 Allowed 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 113.647 -1.615 . . . . 14.5 110.573 -178.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 43.4 p -136.26 168.69 18.94 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 119.923 -1.736 . . . . 13.41 106.609 178.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . 0.439 ' N ' ' O ' ' A' ' 270' ' ' HOH . 1.2 t30 -60.97 -47.39 86.68 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 125.837 2.732 . . . . 20.95 113.695 178.652 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -54.23 -53.72 49.7 Favored 'General case' 0 C--N 1.36 1.05 0 CA-C-N 109.326 -3.579 . . . . 18.94 108.453 178.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 56.7 mtp85 -53.91 -46.53 71.49 Favored 'General case' 0 C--O 1.268 2.028 1 O-C-N 129.367 4.167 . . . . 12.8 112.609 179.058 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 38.8 mmt -67.11 -37.19 83.46 Favored 'General case' 0 C--N 1.294 -1.845 0 C-N-CA 124.617 1.167 . . . . 12.1 109.141 -179.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -62.87 -43.01 99.96 Favored 'General case' 0 C--O 1.255 1.374 0 C-N-CA 117.321 -1.751 . . . . 18.04 112.326 -179.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.3 mt -67.32 -51.77 48.5 Favored 'General case' 0 C--O 1.266 1.961 0 CA-C-N 113.743 -1.572 . . . . 16.09 111.651 178.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -53.84 -38.58 64.81 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 125.029 1.455 . . . . 23.12 112.52 -179.323 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.05 -39.85 93.77 Favored 'General case' 0 C--O 1.26 1.622 0 CA-C-N 121.517 1.962 . . . . 11.7 111.768 179.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.93 -46.57 74.36 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 122.872 1.32 . . . . 15.02 110.983 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 4.1 mt -57.49 -58.99 3.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-O 122.852 1.31 . . . . 18.54 112.929 178.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.3 t -52.9 -41.75 41.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 O-C-N 119.612 -1.93 . . . . 18.38 111.585 -179.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.0 -58.75 7.27 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 124.387 1.075 . . . . 18.14 112.571 179.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 15.6 mt -62.29 -40.62 96.88 Favored 'General case' 0 C--O 1.244 0.815 0 O-C-N 125.421 1.7 . . . . 20.52 112.451 179.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -68.24 -10.24 53.15 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 125.865 1.978 . . . . 19.73 110.471 -178.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.1 -18.91 32.81 Favored 'General case' 0 C--O 1.256 1.435 0 O-C-N 123.605 0.565 . . . . 22.24 112.027 179.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 81.0 mt -73.09 126.98 31.28 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.567 -1.333 . . . . 24.48 107.98 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.74 4.62 43.19 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-O 114.5 -2.667 . . . . 30.63 112.431 -178.144 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -140.85 148.59 40.77 Favored 'General case' 0 C--N 1.287 -2.142 0 O-C-N 127.404 2.94 . . . . 44.36 110.88 -176.267 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 45.7 m-70 -55.44 112.72 1.18 Allowed 'General case' 0 C--O 1.262 1.757 0 N-CA-C 107.869 -1.16 . . . . 30.01 107.869 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 54.1 m -115.63 171.7 7.58 Favored 'General case' 0 C--O 1.213 -0.859 0 C-N-CA 114.311 -2.956 . . . . 24.63 110.017 178.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.21 113.76 26.7 Favored 'General case' 0 N--CA 1.5 2.06 3 O-C-N 130.376 4.798 . . . . 40.0 98.225 173.957 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 47.2 t -117.2 140.86 38.21 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.764 0 N-CA-C 117.529 2.418 . . . . 21.08 117.529 -174.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . 0.408 0.2 OUTLIER -113.71 114.18 46.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 N-CA-C 104.06 -2.57 . . . . 23.61 104.06 171.333 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.7 tt -111.1 114.49 27.8 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 127.467 2.979 . . . . 19.95 110.28 -179.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.2 m -101.52 122.09 43.18 Favored 'General case' 0 C--O 1.256 1.421 0 O-C-N 126.42 2.325 . . . . 19.52 111.732 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 11.5 t -152.14 149.24 28.57 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 125.495 1.747 . . . . 13.05 111.34 176.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -95.18 11.13 33.42 Favored 'General case' 0 C--N 1.3 -1.585 0 C-N-CA 127.518 2.327 . . . . 24.15 111.334 176.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.2 t -75.78 119.04 19.25 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 125.131 2.396 . . . . 13.64 112.146 -176.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -68.09 -39.02 82.97 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 112.819 -1.991 . . . . 21.31 107.611 179.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -61.65 -47.77 83.87 Favored 'General case' 0 C--O 1.27 2.175 0 N-CA-C 114.528 1.307 . . . . 17.54 114.528 179.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 25.4 t -73.22 -37.27 51.8 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.94 0 O-C-N 119.74 -1.85 . . . . 14.19 110.512 176.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 20.1 ttp-105 -59.88 -48.89 79.87 Favored 'General case' 0 C--O 1.206 -1.212 0 O-C-N 124.227 0.954 . . . . 30.93 108.953 -179.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.31 -61.62 1.71 Allowed 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 128.652 2.781 . . . . 24.05 111.573 177.976 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -57.61 -50.15 74.09 Favored 'General case' 0 C--O 1.266 1.96 0 C-N-CA 126.007 1.723 . . . . 16.41 113.931 178.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 15.2 mm -64.77 -66.46 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.778 0 CA-C-O 124.454 2.073 . . . . 21.64 112.665 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 11.4 p -49.0 -33.71 11.62 Favored 'General case' 0 C--O 1.252 1.204 0 O-C-N 120.116 -1.615 . . . . 26.79 111.319 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLN . . . . . 0.444 ' OE1' ' NE1' ' A' ' 81' ' ' TRP . 75.5 mt-30 -93.89 1.58 56.33 Favored 'General case' 0 C--O 1.262 1.756 0 N-CA-C 116.512 2.042 . . . . 32.8 116.512 -176.912 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' B GLY . . . . . . . . . . . . . . . 64.7 34.76 90.76 Favored Glycine 0 C--O 1.259 1.67 0 CA-C-O 116.851 -2.083 . . . . 23.81 110.481 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' TRP . . . . . 0.444 ' NE1' ' OE1' ' A' ' 80' ' ' GLN . 27.0 m0 -65.8 -35.68 81.39 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 116.546 -2.062 . . . . 29.24 114.447 179.432 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 62.9 mt -61.1 -39.49 82.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 O-C-N 124.037 0.836 . . . . 30.17 112.437 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -66.05 -34.98 79.31 Favored 'General case' 0 C--O 1.252 1.228 0 CA-C-O 114.982 -2.437 . . . . 35.71 109.756 177.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -62.08 -62.36 1.83 Allowed 'General case' 0 C--N 1.3 -1.569 0 O-C-N 127.28 2.863 . . . . 31.58 108.859 178.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' TRP . . . . . 0.442 ' O ' ' N ' ' A' ' 90' ' ' TRP . 45.6 m0 -49.35 -46.41 46.98 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 127.286 2.234 . . . . 25.73 115.984 -179.762 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.16 -41.38 92.67 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 111.899 -2.409 . . . . 23.16 110.044 -178.046 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 19.0 mttp -68.94 -28.08 66.32 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-O 122.213 1.006 . . . . 24.53 111.871 -177.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . 0.283 31.4 mtm180 -105.52 24.88 11.48 Favored 'General case' 0 N--CA 1.502 2.156 0 C-N-CA 115.538 -2.465 . . . . 42.04 110.715 178.252 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 66.29 32.82 83.17 Favored Glycine 0 C--O 1.262 1.85 0 O-C-N 118.611 -2.556 . . . . 22.15 117.662 178.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' TRP . . . . . 0.442 ' N ' ' O ' ' A' ' 85' ' ' TRP . 89.0 m95 63.52 40.76 7.92 Favored 'General case' 0 CA--C 1.504 -0.819 0 O-C-N 119.173 -2.369 . . . . 20.76 113.351 176.406 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 66.8 mttt -135.56 153.83 51.56 Favored 'General case' 0 C--O 1.248 0.982 0 N-CA-C 106.188 -1.782 . . . . 31.37 106.188 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.296 11.4 p -93.13 -173.98 3.42 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 126.017 2.073 . . . . 25.64 110.189 176.97 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . 0.27 . . -44.61 -55.5 5.14 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 129.148 2.979 . . . . 29.57 110.141 177.852 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.37 -20.34 4.39 Favored 'General case' 0 C--N 1.298 -1.669 1 C-N-CA 135.096 5.358 . . . . 35.69 110.954 178.438 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt 74.72 17.02 2.99 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 125.45 1.5 . . . . 30.5 107.722 -174.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . 0.546 ' NZ ' ' O ' ' A' ' 246' ' ' HOH . 0.4 OUTLIER -89.49 150.19 43.98 Favored Pre-proline 0 C--N 1.294 -1.835 0 C-N-CA 125.713 1.605 . . . . 30.92 107.746 179.666 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -65.95 143.68 73.66 Favored 'Trans proline' 0 C--N 1.315 -1.215 0 O-C-N 124.307 1.688 . . . . 19.01 107.999 -178.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.95 146.51 12.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.046 0 CA-C-O 124.468 2.08 . . . . 19.13 110.102 177.972 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 18.4 ttpt -59.42 136.38 57.95 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 124.026 1.869 . . . . 32.95 107.434 177.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 57.71 26.39 12.97 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 113.153 -1.84 . . . . 15.19 110.23 179.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.7 p -48.86 -33.8 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.552 0 O-C-N 127.826 3.204 . . . . 13.9 112.835 -178.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -56.47 -44.22 80.37 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 122.139 0.971 . . . . 13.91 110.709 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 29.3 mt -78.03 -36.42 48.61 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 125.241 1.417 . . . . 12.45 111.661 -177.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' TRP . . . . . . . . . . . . . 36.0 m95 -67.63 -38.75 84.32 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-N 119.527 1.058 . . . . 12.96 110.718 -178.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLN . . . . . 0.562 ' NE2' ' O ' ' A' ' 209' ' ' HOH . 10.1 mt-30 -57.22 -49.74 75.08 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 126.248 2.217 . . . . 18.46 109.73 176.726 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 77.0 mtp180 -55.47 -50.8 68.93 Favored 'General case' 0 C--O 1.252 1.185 0 O-C-N 126.842 2.589 . . . . 17.89 111.354 -179.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 22.8 tp -61.85 -51.95 66.14 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 113.688 -1.596 . . . . 18.95 111.041 177.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -53.17 -44.64 68.02 Favored 'General case' 0 C--O 1.256 1.425 0 C-N-CA 119.066 -1.054 . . . . 22.83 110.653 -179.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -55.51 -38.98 69.91 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 127.787 3.18 . . . . 18.96 111.221 179.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.85 -31.26 59.23 Favored 'General case' 0 C--O 1.249 1.038 0 C-N-CA 125.305 1.442 . . . . 26.2 113.291 177.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.4 -40.86 97.88 Favored 'General case' 0 C--N 1.306 -1.314 0 O-C-N 119.442 -2.036 . . . . 26.45 109.351 178.277 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -66.15 -10.28 51.49 Favored Glycine 0 C--O 1.268 2.248 0 CA-C-O 117.356 -1.802 . . . . 26.36 116.416 -179.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 70.5 mm-40 -106.77 -23.24 12.47 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 119.917 1.859 . . . . 35.9 112.314 -176.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -118.64 165.84 13.48 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 128.563 3.664 . . . . 25.29 115.709 -176.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLN . . . . . 0.504 ' NE2' ' O ' ' A' ' 279' ' ' HOH . 25.5 tt0 -108.75 111.63 23.5 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 103.223 -2.88 . . . . 36.04 103.223 178.641 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . 0.293 0.7 OUTLIER -118.81 152.86 21.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 CA-C-O 127.811 3.672 . . . . 28.81 113.717 -177.541 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 24.9 tttp -132.53 118.08 18.8 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 102.941 -2.985 . . . . 34.71 102.941 178.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -86.0 139.92 30.76 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 109.424 -3.535 . . . . 21.83 105.798 -179.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -130.41 108.0 9.65 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 101.837 -3.394 . . . . 30.13 101.837 178.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 27.6 m95 -87.11 117.86 26.12 Favored 'General case' 0 C--N 1.307 -1.249 0 O-C-N 128.942 3.901 . . . . 21.07 109.21 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 2.0 m -103.2 150.65 6.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 122.976 1.369 . . . . 25.12 110.719 -178.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 8.9 tttt -124.83 122.65 38.01 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 103.122 -2.918 . . . . 37.79 103.122 175.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 59.84 145.03 0.01 OUTLIER Glycine 0 C--O 1.211 -1.342 0 CA-C-O 123.953 1.863 . . . . 27.39 113.648 178.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 66.4 m170 -69.25 -10.1 56.23 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 128.716 2.806 . . . . 29.96 117.815 -176.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.18 118.36 10.49 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 126.913 2.633 . . . . 24.62 108.38 -179.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 82.26 10.12 84.11 Favored Glycine 0 N--CA 1.489 2.177 0 O-C-N 125.97 2.044 . . . . 24.29 110.087 179.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 49.3 m80 -134.46 68.43 72.72 Favored Pre-proline 0 C--O 1.254 1.302 0 O-C-N 124.16 0.565 . . . . 22.23 110.871 -177.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -50.3 -52.27 9.31 Favored 'Trans proline' 0 C--O 1.245 0.862 1 C-N-CA 126.345 4.696 . . . . 20.52 118.349 -177.702 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 45.0 mp0 -60.17 -32.59 71.2 Favored 'General case' 0 C--N 1.309 -1.194 0 C-N-CA 125.597 1.559 . . . . 24.14 112.207 177.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -74.61 -42.4 58.71 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-N 120.762 1.619 . . . . 21.22 108.346 179.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -53.29 -49.41 67.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 113.489 -3.148 . . . . 30.0 107.88 179.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ARG . . . . . 0.681 ' NH1' ' OE2' ' A' ' 32' ' ' GLU . 1.3 ttt180 -57.83 -46.18 85.11 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 128.809 3.818 . . . . 27.77 113.364 -179.742 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 69.5 m -54.89 -40.04 69.35 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 114.529 -1.214 . . . . 16.0 108.087 175.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . 0.27 24.7 t70 -58.05 -49.56 76.46 Favored 'General case' 0 C--O 1.24 0.561 0 O-C-N 126.895 2.622 . . . . 18.77 111.371 -179.707 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.94 -43.24 91.16 Favored 'General case' 0 C--N 1.284 -2.282 0 C-N-CA 130.783 3.633 . . . . 34.26 109.443 179.976 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 39.6 mt -63.02 -45.51 91.97 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-N 114.615 -1.175 . . . . 21.62 110.41 -178.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.77 -49.56 75.86 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 127.611 2.364 . . . . 20.11 110.5 -178.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ARG . . . . . 0.528 ' NH1' ' O ' ' A' ' 247' ' ' HOH . 18.2 mtm105 -67.29 -30.65 70.57 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 125.077 1.486 . . . . 30.32 112.606 -179.35 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.54 -48.56 47.86 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 113.422 -1.717 . . . . 20.66 110.836 177.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -68.13 -32.25 72.41 Favored 'General case' 0 N--CA 1.479 0.989 0 O-C-N 120.85 -1.156 . . . . 20.91 109.587 -179.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -58.86 -23.26 60.62 Favored 'General case' 0 C--O 1.262 1.725 0 N-CA-C 114.007 1.114 . . . . 25.72 114.007 -179.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 19.8 mmt -83.67 -29.52 27.56 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 129.034 2.933 . . . . 43.68 113.42 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -126.92 69.43 72.7 Favored Pre-proline 0 C--N 1.305 -1.34 0 N-CA-C 106.024 -1.843 . . . . 33.07 106.024 -178.792 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -72.07 147.96 49.7 Favored 'Trans proline' 0 C--O 1.276 2.405 0 CA-C-O 116.359 -1.6 . . . . 23.67 110.075 -177.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 26.6 p -142.87 10.54 1.78 Allowed 'General case' 0 C--O 1.265 1.915 0 O-C-N 126.757 2.536 . . . . 23.04 113.799 177.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -133.44 153.64 51.45 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.889 -0.507 . . . . 25.34 110.002 -177.733 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 41.2 mp0 -102.61 138.54 39.38 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 103.376 -2.824 . . . . 29.5 103.376 176.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 55.9 t0 -96.93 84.16 3.51 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 101.574 -3.491 . . . . 18.22 101.574 177.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 65.6 p -58.18 -25.6 61.75 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 116.613 2.079 . . . . 25.75 116.613 -177.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -79.15 -14.3 81.94 Favored Glycine 0 CA--C 1.534 1.25 0 O-C-N 125.498 1.749 . . . . 28.57 108.966 -179.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 53.3 t80 -72.77 120.26 18.14 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 125.704 1.473 . . . . 33.22 109.029 179.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -120.11 114.52 22.09 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 128.955 2.902 . . . . 43.14 115.419 -175.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . 0.293 94.3 t -50.92 -85.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 O-C-N 125.107 1.504 . . . . 46.04 110.264 -178.99 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 11.37 -75.26 0.0 OUTLIER 'General case' 0 C--O 1.273 2.307 0 C-N-CA 129.389 3.076 . . . . 54.71 115.617 -178.128 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . 0.255 55.6 t . . . . . 0 N--CA 1.501 2.086 0 CA-C-O 115.413 -2.232 . . . . 52.6 110.439 178.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 . . . . . 0.562 ' O ' ' NE2' ' A' ' 105' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 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 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 0 . 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 0 . 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 ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . 0.581 ' O ' ' N ' ' A' ' 1' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 orig full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 246' ' ' HOH . . . . . 0.546 ' O ' ' NZ ' ' A' ' 96' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 247' ' ' HOH . . . . . 0.528 ' O ' ' NH1' ' A' ' 138' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 270' ' ' HOH . . . . . 0.439 ' O ' ' N ' ' A' ' 44' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 276' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 279' ' ' HOH . . . . . 0.504 ' O ' ' NE2' ' A' ' 115' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 280' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 282' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 283' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 285' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 287' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . 0.996 ' HB3' HD22 ' A' ' 2' ' ' LEU . 5.9 tpt . . . . . 0 C--O 1.245 0.848 0 CA-C-O 122.678 1.228 . . . . 53.68 109.526 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LEU . . . . . 0.996 HD22 ' HB3' ' A' ' 1' ' ' MET 0.269 1.7 mm? -68.54 28.52 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 126.969 3.271 . . . . 46.1 110.111 -179.098 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LYS . . . . . 0.862 ' HE3' ' H ' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -75.04 135.16 41.26 Favored 'General case' 0 N--CA 1.398 -3.062 1 C-N-CA 137.682 6.393 . . . . 46.86 121.538 -176.411 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . 0.862 ' H ' ' HE3' ' A' ' 3' ' ' LYS . 5.2 mp0 -71.51 141.51 50.15 Favored 'General case' 0 CA--C 1.554 1.129 1 CA-C-N 106.108 -5.042 . . . . 43.86 104.337 177.71 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 5' ' ' VAL . . . . . 0.572 HG22 ' HD2' ' A' ' 28' ' ' TYR 0.335 1.4 t -58.8 140.85 16.55 Favored 'Isoleucine or valine' 0 C--O 1.266 1.967 1 O-C-N 129.486 4.241 . . . . 34.66 100.569 173.259 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -114.18 131.97 56.26 Favored 'General case' 0 C--N 1.283 -2.308 0 O-C-N 125.737 1.898 . . . . 26.0 108.556 -179.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ILE . . . . . 0.412 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 67.9 mt -125.12 136.63 60.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 O-C-N 125.639 1.837 . . . . 19.6 109.528 -178.897 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -132.7 133.54 43.65 Favored 'General case' 0 C--N 1.292 -1.904 0 N-CA-C 103.649 -2.722 . . . . 17.14 103.649 -179.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' THR . . . . . 0.489 ' HB ' ' HB1' ' A' ' 51' ' ' ALA . 49.0 p -139.01 159.03 43.1 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 116.583 -2.047 . . . . 15.06 109.805 -177.245 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -159.21 141.52 13.8 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 128.831 3.832 . . . . 19.63 107.961 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -145.09 146.7 17.3 Favored Glycine 0 N--CA 1.478 1.443 0 O-C-N 127.963 3.289 . . . . 15.23 109.157 177.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 93.2 p -162.04 173.28 14.62 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 119.404 1.602 . . . . 19.38 111.131 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.5 m -134.48 155.09 50.98 Favored 'General case' 0 C--O 1.26 1.616 0 C-N-CA 126.556 1.942 . . . . 28.1 111.92 177.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . 0.625 HD11 ' HB1' ' A' ' 141' ' ' ALA . 0.6 OUTLIER -100.22 85.46 3.01 Favored 'General case' 0 CA--C 1.564 1.49 0 N-CA-C 101.684 -3.45 . . . . 25.65 101.684 175.618 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 93.92 135.9 7.86 Favored Glycine 0 N--CA 1.51 3.569 1 N-CA-C 97.761 -6.135 . . . . 21.14 97.761 -179.541 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -121.12 108.92 35.8 Favored Pre-proline 0 C--N 1.275 -2.639 1 O-C-N 130.843 4.496 . . . . 29.06 108.986 -177.891 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -83.13 149.01 65.27 Favored 'Cis proline' 0 C--N 1.319 -0.994 0 O-C-N 126.644 2.918 . . . . 21.48 114.253 -0.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -173.89 -165.99 31.4 Favored Glycine 0 N--CA 1.502 3.041 0 CA-C-O 115.636 -2.758 . . . . 15.96 106.811 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PRO . . . . . 0.446 ' HA ' ' O ' ' A' ' 39' ' ' TYR . 3.7 Cg_endo -57.96 140.99 95.86 Favored 'Trans proline' 0 C--N 1.306 -1.669 0 N-CA-C 104.868 -2.781 . . . . 15.59 104.868 -178.999 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -138.63 170.54 23.9 Favored Glycine 0 N--CA 1.49 2.295 0 CA-C-O 115.612 -2.771 . . . . 14.6 106.407 -177.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -157.6 165.51 33.51 Favored Glycine 0 N--CA 1.511 3.677 0 N-CA-C 107.215 -2.354 . . . . 13.27 107.215 179.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' TYR . . . . . 0.46 ' O ' ' HB2' ' A' ' 36' ' ' SER . 2.4 p90 -132.61 164.01 27.64 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 113.052 -1.574 . . . . 15.27 107.718 178.151 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -152.63 129.31 2.72 Favored Glycine 0 C--O 1.26 1.767 0 N-CA-C 104.263 -3.535 . . . . 14.44 104.263 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -141.21 147.46 38.36 Favored 'General case' 0 C--O 1.248 1.01 0 CA-C-N 112.919 -1.64 . . . . 15.73 109.013 179.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ILE . . . . . 0.412 ' O ' ' HA ' ' A' ' 7' ' ' ILE . 62.5 mt -129.45 128.86 66.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.374 0 CA-C-O 115.057 -2.401 . . . . 18.46 107.098 178.406 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . 0.699 HD13 ' CE2' ' A' ' 35' ' ' PHE . 11.2 mp -111.74 130.11 55.89 Favored 'General case' 0 C--O 1.261 1.677 0 O-C-N 128.245 3.466 . . . . 25.21 106.06 176.607 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ARG . . . . . 0.449 HH21 ' HG2' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -134.6 108.75 8.23 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 127.998 3.311 . . . . 34.15 111.231 -178.975 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TYR . . . . . 0.572 ' HD2' HG22 ' A' ' 5' ' ' VAL 0.271 0.0 OUTLIER -121.04 -123.97 0.28 Allowed 'General case' 0 C--O 1.236 0.383 0 CA-C-O 122.704 1.24 . . . . 42.4 112.224 -178.557 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ARG . . . . . 0.717 ' HD2' ' O ' ' A' ' 244' ' ' HOH . 8.6 mtm105 -66.98 79.71 0.12 Allowed 'General case' 0 C--O 1.246 0.917 0 CA-C-N 114.767 -1.106 . . . . 41.52 112.449 -177.334 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 62.67 -15.04 0.07 OUTLIER Glycine 0 C--O 1.254 1.387 0 O-C-N 126.87 2.606 . . . . 40.61 115.867 179.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -99.17 152.51 19.8 Favored 'General case' 0 C--N 1.306 -1.291 0 C-N-CA 125.349 1.46 . . . . 38.47 112.021 -179.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLU . . . . . 0.681 ' OE2' ' NH1' ' A' ' 132' ' ' ARG . 0.7 OUTLIER -140.75 119.85 12.83 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 112.127 -2.306 . . . . 37.79 109.201 179.376 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.1 mttm -106.21 122.51 46.35 Favored 'General case' 0 C--N 1.305 -1.35 1 C-N-CA 132.475 4.31 . . . . 33.69 110.564 -177.756 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.8 p -107.6 157.41 18.08 Favored 'General case' 0 C--O 1.255 1.394 0 N-CA-C 106.664 -1.606 . . . . 27.3 106.664 177.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' PHE . . . . . 0.699 ' CE2' HD13 ' A' ' 26' ' ' LEU . 9.7 m-85 -138.95 149.36 44.66 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 115.485 -2.198 . . . . 21.29 105.152 178.797 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' SER . . . . . 0.46 ' HB2' ' O ' ' A' ' 22' ' ' TYR 0.289 66.7 p -169.03 143.52 3.07 Favored 'General case' 0 C--N 1.297 -1.68 1 O-C-N 129.293 4.121 . . . . 20.59 104.392 176.855 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -154.94 148.74 25.55 Favored 'General case' 0 C--N 1.309 -1.179 0 O-C-N 127.687 3.117 . . . . 16.74 108.636 179.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -116.31 144.29 18.37 Favored Glycine 0 CA--C 1.544 1.852 0 N-CA-C 106.042 -2.823 . . . . 14.11 106.042 -179.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' TYR . . . . . 0.446 ' O ' ' HA ' ' A' ' 19' ' ' PRO . 89.7 m-85 -123.84 129.03 50.37 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 128.407 3.063 . . . . 16.52 110.204 -177.092 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.6 m -56.18 -39.3 72.17 Favored 'General case' 0 C--N 1.314 -0.968 0 O-C-N 127.24 2.837 . . . . 15.87 111.175 -177.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 34.7 ttt85 -157.07 124.34 5.24 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 124.05 1.881 . . . . 19.88 112.01 -179.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 14.5 t -162.3 -155.11 0.35 Allowed 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 113.647 -1.615 . . . . 14.5 110.573 -178.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 43.4 p -136.26 168.69 18.94 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 119.923 -1.736 . . . . 13.41 106.609 178.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . 0.439 ' N ' ' O ' ' A' ' 270' ' ' HOH . 1.2 t30 -60.97 -47.39 86.68 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 125.837 2.732 . . . . 20.95 113.695 178.652 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -54.23 -53.72 49.7 Favored 'General case' 0 C--N 1.36 1.05 0 CA-C-N 109.326 -3.579 . . . . 18.94 108.453 178.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 56.7 mtp85 -53.91 -46.53 71.49 Favored 'General case' 0 C--O 1.268 2.028 1 O-C-N 129.367 4.167 . . . . 12.8 112.609 179.058 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 38.8 mmt -67.11 -37.19 83.46 Favored 'General case' 0 C--N 1.294 -1.845 0 C-N-CA 124.617 1.167 . . . . 12.1 109.141 -179.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -62.87 -43.01 99.96 Favored 'General case' 0 C--O 1.255 1.374 0 C-N-CA 117.321 -1.751 . . . . 18.04 112.326 -179.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.3 mt -67.32 -51.77 48.5 Favored 'General case' 0 C--O 1.266 1.961 0 CA-C-N 113.743 -1.572 . . . . 16.09 111.651 178.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -53.84 -38.58 64.81 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 125.029 1.455 . . . . 23.12 112.52 -179.323 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ALA . . . . . 0.489 ' HB1' ' HB ' ' A' ' 9' ' ' THR . . . -62.05 -39.85 93.77 Favored 'General case' 0 C--O 1.26 1.622 0 CA-C-N 121.517 1.962 . . . . 11.7 111.768 179.075 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ALA . . . . . 0.73 ' O ' ' HG ' ' A' ' 56' ' ' LEU . . . -66.93 -46.57 74.36 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 122.872 1.32 . . . . 15.02 110.983 -179.925 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . 0.64 HD11 ' O ' ' A' ' 103' ' ' LEU . 4.1 mt -57.49 -58.99 3.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-O 122.852 1.31 . . . . 18.54 112.929 178.135 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.3 t -52.9 -41.75 41.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 O-C-N 119.612 -1.93 . . . . 18.38 111.585 -179.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.0 -58.75 7.27 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 124.387 1.075 . . . . 18.14 112.571 179.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . 0.73 ' HG ' ' O ' ' A' ' 52' ' ' ALA . 15.6 mt -62.29 -40.62 96.88 Favored 'General case' 0 C--O 1.244 0.815 0 O-C-N 125.421 1.7 . . . . 20.52 112.451 179.85 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -68.24 -10.24 53.15 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 125.865 1.978 . . . . 19.73 110.471 -178.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.1 -18.91 32.81 Favored 'General case' 0 C--O 1.256 1.435 0 O-C-N 123.605 0.565 . . . . 22.24 112.027 179.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 81.0 mt -73.09 126.98 31.28 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.567 -1.333 . . . . 24.48 107.98 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LYS . . . . . 0.411 ' HA ' ' HD3' ' A' ' 60' ' ' LYS . 0.7 OUTLIER -100.74 4.62 43.19 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-O 114.5 -2.667 . . . . 30.63 112.431 -178.144 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -140.85 148.59 40.77 Favored 'General case' 0 C--N 1.287 -2.142 0 O-C-N 127.404 2.94 . . . . 44.36 110.88 -176.267 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 45.7 m-70 -55.44 112.72 1.18 Allowed 'General case' 0 C--O 1.262 1.757 0 N-CA-C 107.869 -1.16 . . . . 30.01 107.869 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 54.1 m -115.63 171.7 7.58 Favored 'General case' 0 C--O 1.213 -0.859 0 C-N-CA 114.311 -2.956 . . . . 24.63 110.017 178.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.21 113.76 26.7 Favored 'General case' 0 N--CA 1.5 2.06 3 O-C-N 130.376 4.798 . . . . 40.0 98.225 173.957 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 65' ' ' VAL . . . . . 0.4 ' O ' ' HA ' ' A' ' 116' ' ' ILE . 47.2 t -117.2 140.86 38.21 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.764 0 N-CA-C 117.529 2.418 . . . . 21.08 117.529 -174.513 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ILE . . . . . 0.688 HD11 ' HB2' ' A' ' 119' ' ' GLU 0.408 0.2 OUTLIER -113.71 114.18 46.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 N-CA-C 104.06 -2.57 . . . . 23.61 104.06 171.333 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LEU . . . . . 0.558 HD12 HD21 ' A' ' 56' ' ' LEU . 2.7 tt -111.1 114.49 27.8 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 127.467 2.979 . . . . 19.95 110.28 -179.062 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.2 m -101.52 122.09 43.18 Favored 'General case' 0 C--O 1.256 1.421 0 O-C-N 126.42 2.325 . . . . 19.52 111.732 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 11.5 t -152.14 149.24 28.57 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 125.495 1.747 . . . . 13.05 111.34 176.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASP . . . . . 0.421 ' HB3' HG22 ' A' ' 121' ' ' VAL . 1.8 p-10 -95.18 11.13 33.42 Favored 'General case' 0 C--N 1.3 -1.585 0 C-N-CA 127.518 2.327 . . . . 24.15 111.334 176.942 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.2 t -75.78 119.04 19.25 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 125.131 2.396 . . . . 13.64 112.146 -176.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -68.09 -39.02 82.97 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 112.819 -1.991 . . . . 21.31 107.611 179.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -61.65 -47.77 83.87 Favored 'General case' 0 C--O 1.27 2.175 0 N-CA-C 114.528 1.307 . . . . 17.54 114.528 179.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 25.4 t -73.22 -37.27 51.8 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.94 0 O-C-N 119.74 -1.85 . . . . 14.19 110.512 176.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 20.1 ttp-105 -59.88 -48.89 79.87 Favored 'General case' 0 C--O 1.206 -1.212 0 O-C-N 124.227 0.954 . . . . 30.93 108.953 -179.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.31 -61.62 1.71 Allowed 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 128.652 2.781 . . . . 24.05 111.573 177.976 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -57.61 -50.15 74.09 Favored 'General case' 0 C--O 1.266 1.96 0 C-N-CA 126.007 1.723 . . . . 16.41 113.931 178.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 15.2 mm -64.77 -66.46 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.778 0 CA-C-O 124.454 2.073 . . . . 21.64 112.665 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 11.4 p -49.0 -33.71 11.62 Favored 'General case' 0 C--O 1.252 1.204 0 O-C-N 120.116 -1.615 . . . . 26.79 111.319 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLN . . . . . 0.444 ' OE1' ' NE1' ' A' ' 81' ' ' TRP . 75.5 mt-30 -93.89 1.58 56.33 Favored 'General case' 0 C--O 1.262 1.756 0 N-CA-C 116.512 2.042 . . . . 32.8 116.512 -176.912 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' B GLY . . . . . . . . . . . . . . . 64.7 34.76 90.76 Favored Glycine 0 C--O 1.259 1.67 0 CA-C-O 116.851 -2.083 . . . . 23.81 110.481 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' TRP . . . . . 0.444 ' NE1' ' OE1' ' A' ' 80' ' ' GLN . 27.0 m0 -65.8 -35.68 81.39 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 116.546 -2.062 . . . . 29.24 114.447 179.432 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 62.9 mt -61.1 -39.49 82.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 O-C-N 124.037 0.836 . . . . 30.17 112.437 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -66.05 -34.98 79.31 Favored 'General case' 0 C--O 1.252 1.228 0 CA-C-O 114.982 -2.437 . . . . 35.71 109.756 177.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASN . . . . . 0.596 ' HB3' ' NH1' ' A' ' 88' ' ' ARG . 16.0 m-20 -62.08 -62.36 1.83 Allowed 'General case' 0 C--N 1.3 -1.569 0 O-C-N 127.28 2.863 . . . . 31.58 108.859 178.531 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' TRP . . . . . 0.447 ' CD1' HG21 ' A' ' 98' ' ' VAL . 45.6 m0 -49.35 -46.41 46.98 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 127.286 2.234 . . . . 25.73 115.984 -179.762 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.16 -41.38 92.67 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 111.899 -2.409 . . . . 23.16 110.044 -178.046 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 19.0 mttp -68.94 -28.08 66.32 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-O 122.213 1.006 . . . . 24.53 111.871 -177.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ARG . . . . . 0.596 ' NH1' ' HB3' ' A' ' 84' ' ' ASN 0.283 31.4 mtm180 -105.52 24.88 11.48 Favored 'General case' 0 N--CA 1.502 2.156 0 C-N-CA 115.538 -2.465 . . . . 42.04 110.715 178.252 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 66.29 32.82 83.17 Favored Glycine 0 C--O 1.262 1.85 0 O-C-N 118.611 -2.556 . . . . 22.15 117.662 178.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 89.0 m95 63.52 40.76 7.92 Favored 'General case' 0 CA--C 1.504 -0.819 0 O-C-N 119.173 -2.369 . . . . 20.76 113.351 176.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 66.8 mttt -135.56 153.83 51.56 Favored 'General case' 0 C--O 1.248 0.982 0 N-CA-C 106.188 -1.782 . . . . 31.37 106.188 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.296 11.4 p -93.13 -173.98 3.42 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 126.017 2.073 . . . . 25.64 110.189 176.97 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . 0.27 . . -44.61 -55.5 5.14 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 129.148 2.979 . . . . 29.57 110.141 177.852 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASP . . . . . 0.497 ' HB3' ' HB2' ' A' ' 96' ' ' LYS . 0.4 OUTLIER -53.37 -20.34 4.39 Favored 'General case' 0 C--N 1.298 -1.669 1 C-N-CA 135.096 5.358 . . . . 35.69 110.954 178.438 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt 74.72 17.02 2.99 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 125.45 1.5 . . . . 30.5 107.722 -174.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . 0.497 ' HB2' ' HB3' ' A' ' 94' ' ' ASP . 0.4 OUTLIER -89.49 150.19 43.98 Favored Pre-proline 0 C--N 1.294 -1.835 0 C-N-CA 125.713 1.605 . . . . 30.92 107.746 179.666 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -65.95 143.68 73.66 Favored 'Trans proline' 0 C--N 1.315 -1.215 0 O-C-N 124.307 1.688 . . . . 19.01 107.999 -178.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' VAL . . . . . 0.447 HG21 ' CD1' ' A' ' 85' ' ' TRP . 0.9 OUTLIER -63.95 146.51 12.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.046 0 CA-C-O 124.468 2.08 . . . . 19.13 110.102 177.972 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LYS . . . . . 0.707 ' HE3' ' ND2' ' A' ' 100' ' ' ASN . 18.4 ttpt -59.42 136.38 57.95 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 124.026 1.869 . . . . 32.95 107.434 177.786 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASN . . . . . 0.707 ' ND2' ' HE3' ' A' ' 99' ' ' LYS . 88.2 m-20 57.71 26.39 12.97 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 113.153 -1.84 . . . . 15.19 110.23 179.876 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.7 p -48.86 -33.8 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.552 0 O-C-N 127.826 3.204 . . . . 13.9 112.835 -178.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -56.47 -44.22 80.37 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 122.139 0.971 . . . . 13.91 110.709 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LEU . . . . . 0.64 ' O ' HD11 ' A' ' 53' ' ' ILE . 29.3 mt -78.03 -36.42 48.61 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 125.241 1.417 . . . . 12.45 111.661 -177.647 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' TRP . . . . . . . . . . . . . 36.0 m95 -67.63 -38.75 84.32 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-N 119.527 1.058 . . . . 12.96 110.718 -178.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLN . . . . . 0.537 ' NE2' ' O ' ' A' ' 209' ' ' HOH . 10.1 mt-30 -57.22 -49.74 75.08 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 126.248 2.217 . . . . 18.46 109.73 176.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ARG . . . . . 0.56 ' HB2' HD13 ' A' ' 53' ' ' ILE . 77.0 mtp180 -55.47 -50.8 68.93 Favored 'General case' 0 C--O 1.252 1.185 0 O-C-N 126.842 2.589 . . . . 17.89 111.354 -179.466 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 22.8 tp -61.85 -51.95 66.14 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 113.688 -1.596 . . . . 18.95 111.041 177.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -53.17 -44.64 68.02 Favored 'General case' 0 C--O 1.256 1.425 0 C-N-CA 119.066 -1.054 . . . . 22.83 110.653 -179.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -55.51 -38.98 69.91 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 127.787 3.18 . . . . 18.96 111.221 179.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.85 -31.26 59.23 Favored 'General case' 0 C--O 1.249 1.038 0 C-N-CA 125.305 1.442 . . . . 26.2 113.291 177.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.4 -40.86 97.88 Favored 'General case' 0 C--N 1.306 -1.314 0 O-C-N 119.442 -2.036 . . . . 26.45 109.351 178.277 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -66.15 -10.28 51.49 Favored Glycine 0 C--O 1.268 2.248 0 CA-C-O 117.356 -1.802 . . . . 26.36 116.416 -179.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 70.5 mm-40 -106.77 -23.24 12.47 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 119.917 1.859 . . . . 35.9 112.314 -176.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -118.64 165.84 13.48 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 128.563 3.664 . . . . 25.29 115.709 -176.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLN . . . . . 0.504 ' NE2' ' O ' ' A' ' 279' ' ' HOH . 25.5 tt0 -108.75 111.63 23.5 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 103.223 -2.88 . . . . 36.04 103.223 178.641 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ILE . . . . . 0.4 ' HA ' ' O ' ' A' ' 65' ' ' VAL 0.293 0.7 OUTLIER -118.81 152.86 21.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 CA-C-O 127.811 3.672 . . . . 28.81 113.717 -177.541 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LYS . . . . . 0.476 ' HD3' HD13 ' A' ' 66' ' ' ILE . 24.9 tttp -132.53 118.08 18.8 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 102.941 -2.985 . . . . 34.71 102.941 178.631 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -86.0 139.92 30.76 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 109.424 -3.535 . . . . 21.83 105.798 -179.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' GLU . . . . . 0.688 ' HB2' HD11 ' A' ' 66' ' ' ILE . 23.1 tt0 -130.41 108.0 9.65 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 101.837 -3.394 . . . . 30.13 101.837 178.335 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 27.6 m95 -87.11 117.86 26.12 Favored 'General case' 0 C--N 1.307 -1.249 0 O-C-N 128.942 3.901 . . . . 21.07 109.21 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' VAL . . . . . 0.421 HG22 ' HB3' ' A' ' 70' ' ' ASP . 2.0 m -103.2 150.65 6.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 122.976 1.369 . . . . 25.12 110.719 -178.999 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 8.9 tttt -124.83 122.65 38.01 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 103.122 -2.918 . . . . 37.79 103.122 175.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 59.84 145.03 0.01 OUTLIER Glycine 0 C--O 1.211 -1.342 0 CA-C-O 123.953 1.863 . . . . 27.39 113.648 178.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HIS . . . . . 0.419 ' HB3' ' OE2' ' A' ' 131' ' ' GLU . 66.4 m170 -69.25 -10.1 56.23 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 128.716 2.806 . . . . 29.96 117.815 -176.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.18 118.36 10.49 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 126.913 2.633 . . . . 24.62 108.38 -179.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 82.26 10.12 84.11 Favored Glycine 0 N--CA 1.489 2.177 0 O-C-N 125.97 2.044 . . . . 24.29 110.087 179.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -134.46 68.43 72.72 Favored Pre-proline 0 C--O 1.254 1.302 0 O-C-N 124.16 0.565 . . . . 22.23 110.871 -177.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -50.3 -52.27 9.31 Favored 'Trans proline' 0 C--O 1.245 0.862 1 C-N-CA 126.345 4.696 . . . . 20.52 118.349 -177.702 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 45.0 mp0 -60.17 -32.59 71.2 Favored 'General case' 0 C--N 1.309 -1.194 0 C-N-CA 125.597 1.559 . . . . 24.14 112.207 177.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -74.61 -42.4 58.71 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-N 120.762 1.619 . . . . 21.22 108.346 179.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLU . . . . . 0.514 ' O ' ' HB3' ' A' ' 134' ' ' ASP . 8.9 tt0 -53.29 -49.41 67.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 113.489 -3.148 . . . . 30.0 107.88 179.076 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ARG . . . . . 0.681 ' NH1' ' OE2' ' A' ' 32' ' ' GLU . 1.3 ttt180 -57.83 -46.18 85.11 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 128.809 3.818 . . . . 27.77 113.364 -179.742 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 69.5 m -54.89 -40.04 69.35 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 114.529 -1.214 . . . . 16.0 108.087 175.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ASP . . . . . 0.514 ' HB3' ' O ' ' A' ' 131' ' ' GLU 0.27 24.7 t70 -58.05 -49.56 76.46 Favored 'General case' 0 C--O 1.24 0.561 0 O-C-N 126.895 2.622 . . . . 18.77 111.371 -179.707 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.94 -43.24 91.16 Favored 'General case' 0 C--N 1.284 -2.282 0 C-N-CA 130.783 3.633 . . . . 34.26 109.443 179.976 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 39.6 mt -63.02 -45.51 91.97 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-N 114.615 -1.175 . . . . 21.62 110.41 -178.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.77 -49.56 75.86 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 127.611 2.364 . . . . 20.11 110.5 -178.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ARG . . . . . 0.528 ' NH1' ' O ' ' A' ' 247' ' ' HOH . 18.2 mtm105 -67.29 -30.65 70.57 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 125.077 1.486 . . . . 30.32 112.606 -179.35 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.54 -48.56 47.86 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 113.422 -1.717 . . . . 20.66 110.836 177.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -68.13 -32.25 72.41 Favored 'General case' 0 N--CA 1.479 0.989 0 O-C-N 120.85 -1.156 . . . . 20.91 109.587 -179.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' ALA . . . . . 0.625 ' HB1' HD11 ' A' ' 14' ' ' LEU . . . -58.86 -23.26 60.62 Favored 'General case' 0 C--O 1.262 1.725 0 N-CA-C 114.007 1.114 . . . . 25.72 114.007 -179.072 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 19.8 mmt -83.67 -29.52 27.56 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 129.034 2.933 . . . . 43.68 113.42 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -126.92 69.43 72.7 Favored Pre-proline 0 C--N 1.305 -1.34 0 N-CA-C 106.024 -1.843 . . . . 33.07 106.024 -178.792 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -72.07 147.96 49.7 Favored 'Trans proline' 0 C--O 1.276 2.405 0 CA-C-O 116.359 -1.6 . . . . 23.67 110.075 -177.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 26.6 p -142.87 10.54 1.78 Allowed 'General case' 0 C--O 1.265 1.915 0 O-C-N 126.757 2.536 . . . . 23.04 113.799 177.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -133.44 153.64 51.45 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.889 -0.507 . . . . 25.34 110.002 -177.733 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 41.2 mp0 -102.61 138.54 39.38 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 103.376 -2.824 . . . . 29.5 103.376 176.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 55.9 t0 -96.93 84.16 3.51 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 101.574 -3.491 . . . . 18.22 101.574 177.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 65.6 p -58.18 -25.6 61.75 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 116.613 2.079 . . . . 25.75 116.613 -177.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -79.15 -14.3 81.94 Favored Glycine 0 CA--C 1.534 1.25 0 O-C-N 125.498 1.749 . . . . 28.57 108.966 -179.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 53.3 t80 -72.77 120.26 18.14 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 125.704 1.473 . . . . 33.22 109.029 179.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -120.11 114.52 22.09 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 128.955 2.902 . . . . 43.14 115.419 -175.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . 0.293 94.3 t -50.92 -85.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 O-C-N 125.107 1.504 . . . . 46.04 110.264 -178.99 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 11.37 -75.26 0.0 OUTLIER 'General case' 0 C--O 1.273 2.307 0 C-N-CA 129.389 3.076 . . . . 54.71 115.617 -178.128 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . 0.255 55.6 t . . . . . 0 N--CA 1.501 2.086 0 CA-C-O 115.413 -2.232 . . . . 52.6 110.439 178.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 . . . . . 0.537 ' O ' ' NE2' ' A' ' 105' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 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 ' 217' ' ' 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 ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . 0.504 ' O ' ' N ' ' A' ' 1' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 build full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 244' ' ' HOH . . . . . 0.717 ' O ' ' HD2' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 247' ' ' HOH . . . . . 0.528 ' O ' ' NH1' ' A' ' 138' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 270' ' ' HOH . . . . . 0.439 ' O ' ' N ' ' A' ' 44' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 276' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 279' ' ' HOH . . . . . 0.504 ' O ' ' NE2' ' A' ' 115' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 280' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 282' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 283' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 285' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 287' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . 0.996 ' HB3' HD22 ' A' ' 2' ' ' LEU . 5.9 tpt . . . . . 0 C--O 1.245 0.848 0 CA-C-O 122.678 1.228 . . . . 53.68 109.526 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.996 HD22 ' HB3' ' A' ' 1' ' ' MET 0.269 1.7 mm? -68.54 28.52 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 126.969 3.271 . . . . 46.1 110.111 -179.098 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.862 ' HE3' ' H ' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -75.04 135.16 41.26 Favored 'General case' 0 N--CA 1.398 -3.062 1 C-N-CA 137.682 6.393 . . . . 46.86 121.538 -176.411 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.862 ' H ' ' HE3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -71.51 141.51 50.15 Favored 'General case' 0 CA--C 1.554 1.129 1 CA-C-N 106.108 -5.042 . . . . 43.86 104.337 177.71 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.572 HG22 ' HD2' ' A' ' 28' ' ' TYR 0.335 1.4 t -58.8 140.85 16.55 Favored 'Isoleucine or valine' 0 C--O 1.266 1.967 1 O-C-N 129.486 4.241 . . . . 34.66 100.569 173.259 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -114.18 131.97 56.26 Favored 'General case' 0 C--N 1.283 -2.308 0 O-C-N 125.737 1.898 . . . . 26.0 108.556 -179.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.412 ' HA ' ' O ' ' A' ' 25' ' ' ILE . 67.9 mt -125.12 136.63 60.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 O-C-N 125.639 1.837 . . . . 19.6 109.528 -178.897 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -132.7 133.54 43.65 Favored 'General case' 0 C--N 1.292 -1.904 0 N-CA-C 103.649 -2.722 . . . . 17.14 103.649 -179.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' THR . . . . . 0.489 ' HB ' ' HB1' ' A' ' 51' ' ' ALA . 49.0 p -139.01 159.03 43.1 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 116.583 -2.047 . . . . 15.06 109.805 -177.245 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -159.21 141.52 13.8 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 128.831 3.832 . . . . 19.63 107.961 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -145.09 146.7 17.3 Favored Glycine 0 N--CA 1.478 1.443 0 O-C-N 127.963 3.289 . . . . 15.23 109.157 177.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 93.2 p -162.04 173.28 14.62 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 119.404 1.602 . . . . 19.38 111.131 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.5 m -134.48 155.09 50.98 Favored 'General case' 0 C--O 1.26 1.616 0 C-N-CA 126.556 1.942 . . . . 28.1 111.92 177.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.625 HD11 ' HB1' ' A' ' 141' ' ' ALA . 0.6 OUTLIER -100.22 85.46 3.01 Favored 'General case' 0 CA--C 1.564 1.49 0 N-CA-C 101.684 -3.45 . . . . 25.65 101.684 175.618 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 93.92 135.9 7.86 Favored Glycine 0 N--CA 1.51 3.569 1 N-CA-C 97.761 -6.135 . . . . 21.14 97.761 -179.541 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -121.12 108.92 35.8 Favored Pre-proline 0 C--N 1.275 -2.639 1 O-C-N 130.843 4.496 . . . . 29.06 108.986 -177.891 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -83.13 149.01 65.27 Favored 'Cis proline' 0 C--N 1.319 -0.994 0 O-C-N 126.644 2.918 . . . . 21.48 114.253 -0.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -173.89 -165.99 31.4 Favored Glycine 0 N--CA 1.502 3.041 0 CA-C-O 115.636 -2.758 . . . . 15.96 106.811 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.446 ' HA ' ' O ' ' A' ' 39' ' ' TYR . 3.7 Cg_endo -57.96 140.99 95.86 Favored 'Trans proline' 0 C--N 1.306 -1.669 0 N-CA-C 104.868 -2.781 . . . . 15.59 104.868 -178.999 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -138.63 170.54 23.9 Favored Glycine 0 N--CA 1.49 2.295 0 CA-C-O 115.612 -2.771 . . . . 14.6 106.407 -177.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -157.6 165.51 33.51 Favored Glycine 0 N--CA 1.511 3.677 0 N-CA-C 107.215 -2.354 . . . . 13.27 107.215 179.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.46 ' O ' ' HB2' ' A' ' 36' ' ' SER . 2.4 p90 -132.61 164.01 27.64 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 113.052 -1.574 . . . . 15.27 107.718 178.151 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -152.63 129.31 2.72 Favored Glycine 0 C--O 1.26 1.767 0 N-CA-C 104.263 -3.535 . . . . 14.44 104.263 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -141.21 147.46 38.36 Favored 'General case' 0 C--O 1.248 1.01 0 CA-C-N 112.919 -1.64 . . . . 15.73 109.013 179.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.412 ' O ' ' HA ' ' A' ' 7' ' ' ILE . 62.5 mt -129.45 128.86 66.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.374 0 CA-C-O 115.057 -2.401 . . . . 18.46 107.098 178.406 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.699 HD13 ' CE2' ' A' ' 35' ' ' PHE . 11.2 mp -111.74 130.11 55.89 Favored 'General case' 0 C--O 1.261 1.677 0 O-C-N 128.245 3.466 . . . . 25.21 106.06 176.607 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.449 HH21 ' HG2' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -134.6 108.75 8.23 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 127.998 3.311 . . . . 34.15 111.231 -178.975 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.572 ' HD2' HG22 ' A' ' 5' ' ' VAL 0.271 0.0 OUTLIER -121.04 -123.97 0.28 Allowed 'General case' 0 C--O 1.236 0.383 0 CA-C-O 122.704 1.24 . . . . 42.4 112.224 -178.557 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.717 ' HD2' ' O ' ' A' ' 244' ' ' HOH . 8.6 mtm105 -66.98 79.71 0.12 Allowed 'General case' 0 C--O 1.246 0.917 0 CA-C-N 114.767 -1.106 . . . . 41.52 112.449 -177.334 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 62.67 -15.04 0.07 OUTLIER Glycine 0 C--O 1.254 1.387 0 O-C-N 126.87 2.606 . . . . 40.61 115.867 179.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -99.17 152.51 19.8 Favored 'General case' 0 C--N 1.306 -1.291 0 C-N-CA 125.349 1.46 . . . . 38.47 112.021 -179.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.681 ' OE2' ' NH1' ' A' ' 132' ' ' ARG . 0.7 OUTLIER -140.75 119.85 12.83 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 112.127 -2.306 . . . . 37.79 109.201 179.376 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.1 mttm -106.21 122.51 46.35 Favored 'General case' 0 C--N 1.305 -1.35 1 C-N-CA 132.475 4.31 . . . . 33.69 110.564 -177.756 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.8 p -107.6 157.41 18.08 Favored 'General case' 0 C--O 1.255 1.394 0 N-CA-C 106.664 -1.606 . . . . 27.3 106.664 177.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.699 ' CE2' HD13 ' A' ' 26' ' ' LEU . 9.7 m-85 -138.95 149.36 44.66 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 115.485 -2.198 . . . . 21.29 105.152 178.797 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' SER . . . . . 0.46 ' HB2' ' O ' ' A' ' 22' ' ' TYR 0.289 66.7 p -169.03 143.52 3.07 Favored 'General case' 0 C--N 1.297 -1.68 1 O-C-N 129.293 4.121 . . . . 20.59 104.392 176.855 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -154.94 148.74 25.55 Favored 'General case' 0 C--N 1.309 -1.179 0 O-C-N 127.687 3.117 . . . . 16.74 108.636 179.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -116.31 144.29 18.37 Favored Glycine 0 CA--C 1.544 1.852 0 N-CA-C 106.042 -2.823 . . . . 14.11 106.042 -179.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.446 ' O ' ' HA ' ' A' ' 19' ' ' PRO . 89.7 m-85 -123.84 129.03 50.37 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 128.407 3.063 . . . . 16.52 110.204 -177.092 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.6 m -56.18 -39.3 72.17 Favored 'General case' 0 C--N 1.314 -0.968 0 O-C-N 127.24 2.837 . . . . 15.87 111.175 -177.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 34.7 ttt85 -157.07 124.34 5.24 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 124.05 1.881 . . . . 19.88 112.01 -179.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 14.5 t -162.3 -155.11 0.35 Allowed 'General case' 0 N--CA 1.493 1.723 0 CA-C-N 113.647 -1.615 . . . . 14.5 110.573 -178.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 43.4 p -136.26 168.69 18.94 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 119.923 -1.736 . . . . 13.41 106.609 178.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.439 ' N ' ' O ' ' A' ' 270' ' ' HOH . 1.2 t30 -60.97 -47.39 86.68 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 125.837 2.732 . . . . 20.95 113.695 178.652 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -54.23 -53.72 49.7 Favored 'General case' 0 C--N 1.36 1.05 0 CA-C-N 109.326 -3.579 . . . . 18.94 108.453 178.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 56.7 mtp85 -53.91 -46.53 71.49 Favored 'General case' 0 C--O 1.268 2.028 1 O-C-N 129.367 4.167 . . . . 12.8 112.609 179.058 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 38.8 mmt -67.11 -37.19 83.46 Favored 'General case' 0 C--N 1.294 -1.845 0 C-N-CA 124.617 1.167 . . . . 12.1 109.141 -179.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -62.87 -43.01 99.96 Favored 'General case' 0 C--O 1.255 1.374 0 C-N-CA 117.321 -1.751 . . . . 18.04 112.326 -179.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.3 mt -67.32 -51.77 48.5 Favored 'General case' 0 C--O 1.266 1.961 0 CA-C-N 113.743 -1.572 . . . . 16.09 111.651 178.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -53.84 -38.58 64.81 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 125.029 1.455 . . . . 23.12 112.52 -179.323 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.489 ' HB1' ' HB ' ' A' ' 9' ' ' THR . . . -62.05 -39.85 93.77 Favored 'General case' 0 C--O 1.26 1.622 0 CA-C-N 121.517 1.962 . . . . 11.7 111.768 179.075 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.73 ' O ' ' HG ' ' A' ' 56' ' ' LEU . . . -66.93 -46.57 74.36 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 122.872 1.32 . . . . 15.02 110.983 -179.925 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.64 HD11 ' O ' ' A' ' 103' ' ' LEU . 4.1 mt -57.49 -58.99 3.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-O 122.852 1.31 . . . . 18.54 112.929 178.135 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.3 t -52.9 -41.75 41.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 O-C-N 119.612 -1.93 . . . . 18.38 111.585 -179.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.0 -58.75 7.27 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 124.387 1.075 . . . . 18.14 112.571 179.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.73 ' HG ' ' O ' ' A' ' 52' ' ' ALA . 15.6 mt -62.29 -40.62 96.88 Favored 'General case' 0 C--O 1.244 0.815 0 O-C-N 125.421 1.7 . . . . 20.52 112.451 179.85 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -68.24 -10.24 53.15 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 125.865 1.978 . . . . 19.73 110.471 -178.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -85.1 -18.91 32.81 Favored 'General case' 0 C--O 1.256 1.435 0 O-C-N 123.605 0.565 . . . . 22.24 112.027 179.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 81.0 mt -73.09 126.98 31.28 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.567 -1.333 . . . . 24.48 107.98 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.411 ' HA ' ' HD3' ' A' ' 60' ' ' LYS . 0.7 OUTLIER -100.74 4.62 43.19 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-O 114.5 -2.667 . . . . 30.63 112.431 -178.144 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -140.85 148.59 40.77 Favored 'General case' 0 C--N 1.287 -2.142 0 O-C-N 127.404 2.94 . . . . 44.36 110.88 -176.267 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 45.7 m-70 -55.44 112.72 1.18 Allowed 'General case' 0 C--O 1.262 1.757 0 N-CA-C 107.869 -1.16 . . . . 30.01 107.869 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 54.1 m -115.63 171.7 7.58 Favored 'General case' 0 C--O 1.213 -0.859 0 C-N-CA 114.311 -2.956 . . . . 24.63 110.017 178.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.21 113.76 26.7 Favored 'General case' 0 N--CA 1.5 2.06 3 O-C-N 130.376 4.798 . . . . 40.0 98.225 173.957 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.4 ' O ' ' HA ' ' A' ' 116' ' ' ILE . 47.2 t -117.2 140.86 38.21 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.764 0 N-CA-C 117.529 2.418 . . . . 21.08 117.529 -174.513 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.688 HD11 ' HB2' ' A' ' 119' ' ' GLU 0.408 0.2 OUTLIER -113.71 114.18 46.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 N-CA-C 104.06 -2.57 . . . . 23.61 104.06 171.333 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.558 HD12 HD21 ' A' ' 56' ' ' LEU . 2.7 tt -111.1 114.49 27.8 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 127.467 2.979 . . . . 19.95 110.28 -179.062 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.2 m -101.52 122.09 43.18 Favored 'General case' 0 C--O 1.256 1.421 0 O-C-N 126.42 2.325 . . . . 19.52 111.732 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 11.5 t -152.14 149.24 28.57 Favored 'General case' 0 C--N 1.306 -1.295 0 O-C-N 125.495 1.747 . . . . 13.05 111.34 176.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.421 ' HB3' HG22 ' A' ' 121' ' ' VAL . 1.8 p-10 -95.18 11.13 33.42 Favored 'General case' 0 C--N 1.3 -1.585 0 C-N-CA 127.518 2.327 . . . . 24.15 111.334 176.942 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.2 t -75.78 119.04 19.25 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 125.131 2.396 . . . . 13.64 112.146 -176.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -68.09 -39.02 82.97 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 112.819 -1.991 . . . . 21.31 107.611 179.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -61.65 -47.77 83.87 Favored 'General case' 0 C--O 1.27 2.175 0 N-CA-C 114.528 1.307 . . . . 17.54 114.528 179.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 25.4 t -73.22 -37.27 51.8 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.94 0 O-C-N 119.74 -1.85 . . . . 14.19 110.512 176.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 20.1 ttp-105 -59.88 -48.89 79.87 Favored 'General case' 0 C--O 1.206 -1.212 0 O-C-N 124.227 0.954 . . . . 30.93 108.953 -179.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -46.31 -61.62 1.71 Allowed 'General case' 0 C--N 1.298 -1.656 0 C-N-CA 128.652 2.781 . . . . 24.05 111.573 177.976 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -57.61 -50.15 74.09 Favored 'General case' 0 C--O 1.266 1.96 0 C-N-CA 126.007 1.723 . . . . 16.41 113.931 178.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 15.2 mm -64.77 -66.46 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.778 0 CA-C-O 124.454 2.073 . . . . 21.64 112.665 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 11.4 p -49.0 -33.71 11.62 Favored 'General case' 0 C--O 1.252 1.204 0 O-C-N 120.116 -1.615 . . . . 26.79 111.319 -179.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.444 ' OE1' ' NE1' ' A' ' 81' ' ' TRP . 75.5 mt-30 -93.89 1.58 56.33 Favored 'General case' 0 C--O 1.262 1.756 0 N-CA-C 116.512 2.042 . . . . 32.8 116.512 -176.912 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' B GLY . . . . . . . . . . . . . . . 64.7 34.76 90.76 Favored Glycine 0 C--O 1.259 1.67 0 CA-C-O 116.851 -2.083 . . . . 23.81 110.481 178.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.444 ' NE1' ' OE1' ' A' ' 80' ' ' GLN . 27.0 m0 -65.8 -35.68 81.39 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 116.546 -2.062 . . . . 29.24 114.447 179.432 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 62.9 mt -61.1 -39.49 82.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 O-C-N 124.037 0.836 . . . . 30.17 112.437 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -66.05 -34.98 79.31 Favored 'General case' 0 C--O 1.252 1.228 0 CA-C-O 114.982 -2.437 . . . . 35.71 109.756 177.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.596 ' HB3' ' NH1' ' A' ' 88' ' ' ARG . 16.0 m-20 -62.08 -62.36 1.83 Allowed 'General case' 0 C--N 1.3 -1.569 0 O-C-N 127.28 2.863 . . . . 31.58 108.859 178.531 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.447 ' CD1' HG21 ' A' ' 98' ' ' VAL . 45.6 m0 -49.35 -46.41 46.98 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 127.286 2.234 . . . . 25.73 115.984 -179.762 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.16 -41.38 92.67 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 111.899 -2.409 . . . . 23.16 110.044 -178.046 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 19.0 mttp -68.94 -28.08 66.32 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-O 122.213 1.006 . . . . 24.53 111.871 -177.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.596 ' NH1' ' HB3' ' A' ' 84' ' ' ASN 0.283 31.4 mtm180 -105.52 24.88 11.48 Favored 'General case' 0 N--CA 1.502 2.156 0 C-N-CA 115.538 -2.465 . . . . 42.04 110.715 178.252 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 66.29 32.82 83.17 Favored Glycine 0 C--O 1.262 1.85 0 O-C-N 118.611 -2.556 . . . . 22.15 117.662 178.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 89.0 m95 63.52 40.76 7.92 Favored 'General case' 0 CA--C 1.504 -0.819 0 O-C-N 119.173 -2.369 . . . . 20.76 113.351 176.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 66.8 mttt -135.56 153.83 51.56 Favored 'General case' 0 C--O 1.248 0.982 0 N-CA-C 106.188 -1.782 . . . . 31.37 106.188 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . 0.296 11.4 p -93.13 -173.98 3.42 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 126.017 2.073 . . . . 25.64 110.189 176.97 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . 0.27 . . -44.61 -55.5 5.14 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 129.148 2.979 . . . . 29.57 110.141 177.852 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.497 ' HB3' ' HB2' ' A' ' 96' ' ' LYS . 0.4 OUTLIER -53.37 -20.34 4.39 Favored 'General case' 0 C--N 1.298 -1.669 1 C-N-CA 135.096 5.358 . . . . 35.69 110.954 178.438 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 68.4 mmtt 74.72 17.02 2.99 Favored 'General case' 0 C--N 1.308 -1.237 0 C-N-CA 125.45 1.5 . . . . 30.5 107.722 -174.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.497 ' HB2' ' HB3' ' A' ' 94' ' ' ASP . 0.4 OUTLIER -89.49 150.19 43.98 Favored Pre-proline 0 C--N 1.294 -1.835 0 C-N-CA 125.713 1.605 . . . . 30.92 107.746 179.666 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -65.95 143.68 73.66 Favored 'Trans proline' 0 C--N 1.315 -1.215 0 O-C-N 124.307 1.688 . . . . 19.01 107.999 -178.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.447 HG21 ' CD1' ' A' ' 85' ' ' TRP . 0.9 OUTLIER -63.95 146.51 12.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.046 0 CA-C-O 124.468 2.08 . . . . 19.13 110.102 177.972 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.707 ' HE3' ' ND2' ' A' ' 100' ' ' ASN . 18.4 ttpt -59.42 136.38 57.95 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 124.026 1.869 . . . . 32.95 107.434 177.786 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.707 ' ND2' ' HE3' ' A' ' 99' ' ' LYS . 88.2 m-20 57.71 26.39 12.97 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 113.153 -1.84 . . . . 15.19 110.23 179.876 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.7 p -48.86 -33.8 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.552 0 O-C-N 127.826 3.204 . . . . 13.9 112.835 -178.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -56.47 -44.22 80.37 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 122.139 0.971 . . . . 13.91 110.709 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.64 ' O ' HD11 ' A' ' 53' ' ' ILE . 29.3 mt -78.03 -36.42 48.61 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 125.241 1.417 . . . . 12.45 111.661 -177.647 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' TRP . . . . . . . . . . . . . 36.0 m95 -67.63 -38.75 84.32 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-N 119.527 1.058 . . . . 12.96 110.718 -178.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.537 ' NE2' ' O ' ' A' ' 209' ' ' HOH . 10.1 mt-30 -57.22 -49.74 75.08 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 126.248 2.217 . . . . 18.46 109.73 176.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.56 ' HB2' HD13 ' A' ' 53' ' ' ILE . 77.0 mtp180 -55.47 -50.8 68.93 Favored 'General case' 0 C--O 1.252 1.185 0 O-C-N 126.842 2.589 . . . . 17.89 111.354 -179.466 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 22.8 tp -61.85 -51.95 66.14 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 113.688 -1.596 . . . . 18.95 111.041 177.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -53.17 -44.64 68.02 Favored 'General case' 0 C--O 1.256 1.425 0 C-N-CA 119.066 -1.054 . . . . 22.83 110.653 -179.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -55.51 -38.98 69.91 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 127.787 3.18 . . . . 18.96 111.221 179.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.85 -31.26 59.23 Favored 'General case' 0 C--O 1.249 1.038 0 C-N-CA 125.305 1.442 . . . . 26.2 113.291 177.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.4 -40.86 97.88 Favored 'General case' 0 C--N 1.306 -1.314 0 O-C-N 119.442 -2.036 . . . . 26.45 109.351 178.277 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -66.15 -10.28 51.49 Favored Glycine 0 C--O 1.268 2.248 0 CA-C-O 117.356 -1.802 . . . . 26.36 116.416 -179.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 70.5 mm-40 -106.77 -23.24 12.47 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 119.917 1.859 . . . . 35.9 112.314 -176.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -118.64 165.84 13.48 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 128.563 3.664 . . . . 25.29 115.709 -176.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLN . . . . . 0.504 ' NE2' ' O ' ' A' ' 279' ' ' HOH . 25.5 tt0 -108.75 111.63 23.5 Favored 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 103.223 -2.88 . . . . 36.04 103.223 178.641 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.4 ' HA ' ' O ' ' A' ' 65' ' ' VAL 0.293 0.7 OUTLIER -118.81 152.86 21.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 CA-C-O 127.811 3.672 . . . . 28.81 113.717 -177.541 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.476 ' HD3' HD13 ' A' ' 66' ' ' ILE . 24.9 tttp -132.53 118.08 18.8 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 102.941 -2.985 . . . . 34.71 102.941 178.631 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -86.0 139.92 30.76 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 109.424 -3.535 . . . . 21.83 105.798 -179.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.688 ' HB2' HD11 ' A' ' 66' ' ' ILE . 23.1 tt0 -130.41 108.0 9.65 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 101.837 -3.394 . . . . 30.13 101.837 178.335 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 27.6 m95 -87.11 117.86 26.12 Favored 'General case' 0 C--N 1.307 -1.249 0 O-C-N 128.942 3.901 . . . . 21.07 109.21 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.421 HG22 ' HB3' ' A' ' 70' ' ' ASP . 2.0 m -103.2 150.65 6.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 122.976 1.369 . . . . 25.12 110.719 -178.999 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 8.9 tttt -124.83 122.65 38.01 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 103.122 -2.918 . . . . 37.79 103.122 175.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 59.84 145.03 0.01 OUTLIER Glycine 0 C--O 1.211 -1.342 0 CA-C-O 123.953 1.863 . . . . 27.39 113.648 178.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HIS . . . . . 0.419 ' HB3' ' OE2' ' A' ' 131' ' ' GLU . 66.4 m170 -69.25 -10.1 56.23 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 128.716 2.806 . . . . 29.96 117.815 -176.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -67.18 118.36 10.49 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 126.913 2.633 . . . . 24.62 108.38 -179.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 82.26 10.12 84.11 Favored Glycine 0 N--CA 1.489 2.177 0 O-C-N 125.97 2.044 . . . . 24.29 110.087 179.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 49.3 m80 -134.46 68.43 72.72 Favored Pre-proline 0 C--O 1.254 1.302 0 O-C-N 124.16 0.565 . . . . 22.23 110.871 -177.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -50.3 -52.27 9.31 Favored 'Trans proline' 0 C--O 1.245 0.862 1 C-N-CA 126.345 4.696 . . . . 20.52 118.349 -177.702 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 45.0 mp0 -60.17 -32.59 71.2 Favored 'General case' 0 C--N 1.309 -1.194 0 C-N-CA 125.597 1.559 . . . . 24.14 112.207 177.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -74.61 -42.4 58.71 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-N 120.762 1.619 . . . . 21.22 108.346 179.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.514 ' O ' ' HB3' ' A' ' 134' ' ' ASP . 8.9 tt0 -53.29 -49.41 67.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 113.489 -3.148 . . . . 30.0 107.88 179.076 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.681 ' NH1' ' OE2' ' A' ' 32' ' ' GLU . 1.3 ttt180 -57.83 -46.18 85.11 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 128.809 3.818 . . . . 27.77 113.364 -179.742 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 69.5 m -54.89 -40.04 69.35 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 114.529 -1.214 . . . . 16.0 108.087 175.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.514 ' HB3' ' O ' ' A' ' 131' ' ' GLU 0.27 24.7 t70 -58.05 -49.56 76.46 Favored 'General case' 0 C--O 1.24 0.561 0 O-C-N 126.895 2.622 . . . . 18.77 111.371 -179.707 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.94 -43.24 91.16 Favored 'General case' 0 C--N 1.284 -2.282 0 C-N-CA 130.783 3.633 . . . . 34.26 109.443 179.976 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 39.6 mt -63.02 -45.51 91.97 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-N 114.615 -1.175 . . . . 21.62 110.41 -178.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.77 -49.56 75.86 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 127.611 2.364 . . . . 20.11 110.5 -178.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ARG . . . . . 0.528 ' NH1' ' O ' ' A' ' 247' ' ' HOH . 18.2 mtm105 -67.29 -30.65 70.57 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 125.077 1.486 . . . . 30.32 112.606 -179.35 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.54 -48.56 47.86 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 113.422 -1.717 . . . . 20.66 110.836 177.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -68.13 -32.25 72.41 Favored 'General case' 0 N--CA 1.479 0.989 0 O-C-N 120.85 -1.156 . . . . 20.91 109.587 -179.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' ALA . . . . . 0.625 ' HB1' HD11 ' A' ' 14' ' ' LEU . . . -58.86 -23.26 60.62 Favored 'General case' 0 C--O 1.262 1.725 0 N-CA-C 114.007 1.114 . . . . 25.72 114.007 -179.072 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 19.8 mmt -83.67 -29.52 27.56 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 129.034 2.933 . . . . 43.68 113.42 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -126.92 69.43 72.7 Favored Pre-proline 0 C--N 1.305 -1.34 0 N-CA-C 106.024 -1.843 . . . . 33.07 106.024 -178.792 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -72.07 147.96 49.7 Favored 'Trans proline' 0 C--O 1.276 2.405 0 CA-C-O 116.359 -1.6 . . . . 23.67 110.075 -177.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 26.6 p -142.87 10.54 1.78 Allowed 'General case' 0 C--O 1.265 1.915 0 O-C-N 126.757 2.536 . . . . 23.04 113.799 177.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -133.44 153.64 51.45 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.889 -0.507 . . . . 25.34 110.002 -177.733 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 41.2 mp0 -102.61 138.54 39.38 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 103.376 -2.824 . . . . 29.5 103.376 176.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 55.9 t0 -96.93 84.16 3.51 Favored 'General case' 0 C--N 1.291 -1.961 0 N-CA-C 101.574 -3.491 . . . . 18.22 101.574 177.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 65.6 p -58.18 -25.6 61.75 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 116.613 2.079 . . . . 25.75 116.613 -177.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -79.15 -14.3 81.94 Favored Glycine 0 CA--C 1.534 1.25 0 O-C-N 125.498 1.749 . . . . 28.57 108.966 -179.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 53.3 t80 -72.77 120.26 18.14 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 125.704 1.473 . . . . 33.22 109.029 179.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -120.11 114.52 22.09 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 128.955 2.902 . . . . 43.14 115.419 -175.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . 0.293 94.3 t -50.92 -85.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 O-C-N 125.107 1.504 . . . . 46.04 110.264 -178.99 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 11.37 -75.26 0.0 OUTLIER 'General case' 0 C--O 1.273 2.307 0 C-N-CA 129.389 3.076 . . . . 54.71 115.617 -178.128 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . 0.255 55.6 t . . . . . 0 N--CA 1.501 2.086 0 CA-C-O 115.413 -2.232 . . . . 52.6 110.439 178.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 . . . . . 0.537 ' O ' ' NE2' ' A' ' 105' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 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 ' 217' ' ' 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 ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . 0.504 ' O ' ' N ' ' A' ' 1' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 . 001 ecloud nobuild full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 244' ' ' HOH . . . . . 0.717 ' O ' ' HD2' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 247' ' ' HOH . . . . . 0.528 ' O ' ' NH1' ' A' ' 138' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 270' ' ' HOH . . . . . 0.439 ' O ' ' N ' ' A' ' 44' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 276' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 279' ' ' HOH . . . . . 0.504 ' O ' ' NE2' ' A' ' 115' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 280' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 282' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 283' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 285' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 287' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_