data_1vfa_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 1vfa _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' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 . . . . . 0 CA--C 1.511 -0.524 0 N-CA-C 100.481 -3.896 . . . . 44.82 100.481 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 39.1 mt -89.27 132.27 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 N-CA-C 106.451 -1.685 . . . . 24.52 106.451 -179.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.3 t -108.39 140.68 26.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 106.447 -1.686 . . . . 19.92 106.447 -179.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 57.1 mt -108.22 125.65 51.89 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.399 -0.819 . . . . 14.22 108.797 178.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 86.3 m -113.14 124.3 52.25 Favored 'General case' 0 N--CA 1.438 -1.041 0 O-C-N 121.146 -0.971 . . . . 21.61 108.56 178.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -103.16 140.75 36.93 Favored 'General case' 0 N--CA 1.438 -1.065 0 O-C-N 120.595 -1.315 . . . . 15.99 112.096 -179.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.6 m -137.45 145.6 50.07 Favored Pre-proline 0 C--N 1.317 -0.833 0 N-CA-C 106.273 -1.751 . . . . 29.81 106.273 176.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -72.46 165.39 83.22 Favored 'Cis proline' 0 CA--C 1.511 -0.658 0 CA-C-N 121.302 1.501 . . . . 20.02 111.21 -9.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.61 -31.17 61.94 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 121.47 1.941 . . . . 19.81 107.53 175.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.5 t -143.47 142.83 31.33 Favored 'General case' 0 C--N 1.348 0.507 0 N-CA-C 107.966 -1.124 . . . . 32.97 107.966 -178.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 69.0 tp -143.25 125.83 15.88 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 107.8 -1.185 . . . . 31.58 107.8 -177.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 m -97.08 137.65 35.83 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 105.023 -2.214 . . . . 34.77 105.023 174.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -155.38 153.85 31.07 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 120.078 -1.639 . . . . 22.67 108.918 -178.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.6 m -95.73 155.3 16.81 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-O 122.956 1.36 . . . . 28.06 108.799 -178.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 55.7 t -57.06 136.07 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.924 0 CA-C-N 112.793 -2.003 . . . . 22.51 106.03 173.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.65 -15.49 63.04 Favored Glycine 0 N--CA 1.432 -1.571 0 CA-C-O 116.55 -2.25 . . . . 21.8 112.294 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -79.8 156.16 27.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 121.973 2.887 . . . . 43.71 114.573 177.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 18.3 m -105.01 129.38 53.46 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 106.338 -1.727 . . . . 24.75 106.338 176.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 27.1 m -128.34 157.28 40.78 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 N-CA-C 109.063 -0.717 . . . . 24.53 109.063 -178.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.7 m -134.13 134.98 42.84 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 104.109 -2.552 . . . . 25.05 104.109 176.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 8.0 pt -123.14 145.25 30.34 Favored 'Isoleucine or valine' 0 C--O 1.245 0.839 0 N-CA-C 106.932 -1.507 . . . . 24.28 106.932 176.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 72.4 p -118.25 159.9 22.53 Favored 'General case' 0 CA--C 1.502 -0.881 0 O-C-N 120.069 -1.645 . . . . 19.59 111.274 -173.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 38.5 t -138.48 118.17 13.11 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 103.701 -2.703 . . . . 15.35 103.701 -179.039 174.986 117.707 77.807 105.337 2.009 103.553 161.003 54.953 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.7 mtm-85 -111.66 134.88 52.94 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.529 -0.76 . . . . 53.22 111.272 179.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -99.87 148.4 24.49 Favored 'General case' 0 C--O 1.242 0.677 0 C-N-CA 123.562 0.745 . . . . 16.93 111.505 -179.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.3 p -83.78 6.27 21.88 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.668 0.988 . . . . 15.49 113.668 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -164.38 156.21 28.0 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 105.019 -3.232 . . . . 13.69 105.019 -177.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -65.8 129.19 38.93 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 119.95 1.875 . . . . 14.99 110.238 -175.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 24.9 pt -110.48 7.11 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 O-C-N 120.933 -1.104 . . . . 13.88 110.823 179.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 53.89 46.19 26.2 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 121.091 -1.006 . . . . 19.14 113.606 168.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 24.4 m120 64.12 7.25 3.31 Favored 'General case' 0 C--O 1.242 0.7 0 N-CA-C 118.505 2.78 . . . . 14.98 118.505 178.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -84.21 75.07 10.23 Favored 'General case' 0 C--O 1.241 0.654 0 O-C-N 121.245 -0.909 . . . . 22.11 108.661 177.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.0 tp -134.82 132.52 38.75 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.655 -0.702 . . . . 14.54 109.734 -175.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -119.98 154.56 34.33 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 123.709 0.804 . . . . 12.05 108.949 178.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -120.27 140.73 50.79 Favored 'General case' 0 C--O 1.245 0.85 0 C-N-CA 124.339 1.055 . . . . 12.6 108.486 177.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -127.96 149.05 50.51 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 107.487 -1.301 . . . . 13.0 107.487 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -111.3 139.02 47.05 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 105.703 -1.962 . . . . 25.34 105.703 171.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -127.7 119.52 25.99 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 106.476 -1.676 . . . . 16.33 106.476 178.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.3 mmmm -92.35 160.92 14.89 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 106.68 -1.6 . . . . 38.58 106.68 177.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 53.9 tp60 -48.97 123.05 6.48 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 114.236 1.198 . . . . 42.64 114.236 -177.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 69.06 8.85 59.04 Favored Glycine 0 CA--C 1.534 1.238 0 CA-C-O 117.689 -1.617 . . . . 36.9 115.789 -178.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.9 mmtm -114.5 162.67 16.39 Favored 'General case' 0 C--O 1.248 0.981 0 CA-C-N 123.101 3.45 . . . . 40.95 107.623 -178.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.7 p -75.93 159.78 80.07 Favored Pre-proline 0 C--O 1.25 1.101 0 N-CA-C 108.328 -0.99 . . . . 24.94 108.328 174.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -59.57 150.51 75.65 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 122.993 2.462 . . . . 16.63 111.949 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -127.05 135.11 50.34 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 105.007 -2.22 . . . . 43.85 105.007 177.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 34.8 tp -65.03 133.26 51.28 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.026 -1.443 . . . . 13.71 110.536 176.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -111.97 -51.99 2.81 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 113.316 -1.766 . . . . 19.82 112.01 177.867 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 98.0 t -142.73 139.24 28.27 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.815 0 N-CA-C 105.606 -1.998 . . . . 14.7 105.606 -167.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 39.2 p90 -138.26 166.49 24.05 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 119.899 1.227 . . . . 24.1 108.918 172.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 15.1 t80 37.87 57.48 1.51 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 124.809 2.242 . . . . 21.97 111.843 -166.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 41.3 m 65.15 -51.67 0.34 Allowed 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 117.373 2.36 . . . . 11.52 117.373 179.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 71.9 p -119.96 -12.22 9.19 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 116.806 2.151 . . . . 11.98 116.806 -171.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 28.3 m -84.0 123.56 30.12 Favored 'General case' 0 C--O 1.238 0.467 0 O-C-N 119.832 -1.793 . . . . 16.95 112.068 -173.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 23.7 mt -78.28 141.86 38.21 Favored 'General case' 0 C--O 1.242 0.684 0 O-C-N 121.692 -0.63 . . . . 20.83 109.952 177.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.99 165.8 24.32 Favored 'General case' 0 C--O 1.248 1.013 0 O-C-N 121.0 -1.062 . . . . 24.96 108.483 175.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -58.42 135.94 57.35 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 120.43 -1.419 . . . . 51.87 110.408 -178.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.8 7.94 81.32 Favored Glycine 0 N--CA 1.442 -0.966 0 CA-C-O 116.335 -2.37 . . . . 32.18 114.055 177.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 58.3 t -83.64 133.73 46.11 Favored Pre-proline 0 C--O 1.237 0.43 0 CA-C-N 123.626 3.713 . . . . 26.08 104.836 175.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -65.67 149.56 87.09 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.566 2.178 . . . . 27.71 111.938 178.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.3 p -62.93 -13.53 35.68 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 113.606 -1.634 . . . . 35.74 114.176 -177.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 32.3 ptt-85 -68.91 -9.97 54.66 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 119.902 -1.749 . . . . 30.05 114.895 176.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -91.91 135.88 33.59 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 118.001 -0.999 . . . . 18.29 109.605 173.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 95.2 p -147.75 142.48 26.7 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-N 121.147 1.794 . . . . 21.1 110.556 167.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -112.89 153.8 17.31 Favored Glycine 0 C--O 1.246 0.848 0 N-CA-C 107.242 -2.343 . . . . 11.95 107.242 -178.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 80.2 p -147.95 170.35 17.9 Favored 'General case' 0 C--O 1.248 0.993 0 N-CA-C 109.008 -0.738 . . . . 15.8 109.008 175.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 142.8 169.8 12.51 Favored Glycine 0 N--CA 1.44 -1.043 0 CA-C-O 122.902 1.279 . . . . 11.29 111.109 175.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 16.5 p -168.12 164.42 13.45 Favored 'General case' 0 C--O 1.247 0.962 0 N-CA-C 106.585 -1.635 . . . . 16.44 106.585 172.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 61.92 -114.79 7.12 Favored Glycine 0 CA--C 1.523 0.563 0 C-N-CA 120.698 -0.763 . . . . 12.46 112.753 178.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 27.6 p -110.13 5.93 22.39 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-O 117.678 -1.153 . . . . 14.65 112.134 -178.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.84 122.03 29.53 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 122.085 2.221 . . . . 40.49 110.304 -171.129 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -137.7 151.1 47.88 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 107.317 -1.364 . . . . 14.17 107.317 -174.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 2.5 m -140.73 148.25 40.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 120.194 1.361 . . . . 23.92 109.119 -178.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 43.4 tp -118.97 123.91 45.73 Favored 'General case' 0 C--O 1.251 1.161 0 N-CA-C 102.984 -2.969 . . . . 16.19 102.984 172.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 6.7 ttpm? -109.8 132.7 53.91 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.115 -1.439 . . . . 36.71 107.115 178.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 27.6 mt -118.76 113.88 43.09 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 106.162 -1.792 . . . . 16.51 106.162 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -82.68 129.77 35.01 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 117.628 -1.177 . . . . 39.56 112.837 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 60.2 m 46.91 68.42 0.63 Allowed 'General case' 0 C--O 1.242 0.706 0 N-CA-C 117.716 2.487 . . . . 35.42 117.716 178.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 37.9 mt -42.47 126.08 3.42 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 115.821 1.786 . . . . 26.45 115.821 176.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -102.57 160.19 27.03 Favored Pre-proline 0 C--O 1.243 0.747 0 N-CA-C 108.004 -1.11 . . . . 22.26 108.004 173.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -55.3 -35.62 91.85 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 124.661 3.574 . . . . 23.11 113.632 -173.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 19.9 pm0 -70.63 -5.61 30.7 Favored 'General case' 0 N--CA 1.437 -1.092 0 N-CA-C 113.587 0.958 . . . . 40.82 113.587 -178.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -91.5 -10.91 39.04 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 119.457 1.026 . . . . 18.55 112.975 -179.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -73.04 148.4 44.15 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 122.07 2.214 . . . . 26.95 108.792 -177.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 145.75 -164.46 28.15 Favored Glycine 0 N--CA 1.437 -1.286 0 N-CA-C 107.326 -2.31 . . . . 16.31 107.326 -176.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 55.0 m -105.04 144.72 31.45 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 118.856 1.328 . . . . 21.54 111.765 -178.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -120.93 133.22 55.28 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 107.63 -1.248 . . . . 15.77 107.63 -178.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -126.76 136.19 52.08 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 123.37 0.668 . . . . 17.48 110.093 -178.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 20.2 p -101.07 155.55 17.93 Favored 'General case' 0 C--N 1.318 -0.804 0 O-C-N 120.461 -1.399 . . . . 12.21 108.022 169.249 54.953 161.003 77.807 103.553 2.009 105.337 117.707 174.986 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -145.09 140.33 27.97 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.181 -1.575 . . . . 18.71 107.056 -178.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -105.34 162.64 13.26 Favored 'General case' 0 C--O 1.256 1.437 0 C-N-CA 117.954 -1.499 . . . . 15.07 108.425 178.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -130.08 27.95 5.08 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-O 122.729 1.252 . . . . 15.7 109.664 178.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 74.7 t-105 -85.48 108.77 18.06 Favored 'General case' 0 C--O 1.238 0.488 0 O-C-N 118.755 -2.466 . . . . 17.52 107.735 178.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 47.9 t 57.4 -148.9 0.48 Allowed 'General case' 0 C--O 1.238 0.499 0 C-N-CA 124.32 1.048 . . . . 19.68 108.197 177.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 15.0 p -137.3 155.25 75.83 Favored Pre-proline 0 CA--C 1.548 0.895 0 CA-C-N 120.348 1.431 . . . . 27.93 109.134 173.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -72.29 157.32 97.9 Favored 'Cis proline' 0 N--CA 1.456 -0.711 0 O-C-N 116.511 -2.415 . . . . 22.65 113.421 -1.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -88.3 157.62 18.69 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 103.952 -2.61 . . . . 23.36 103.952 173.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 43.8 p -145.1 163.6 33.82 Favored 'General case' 0 C--O 1.245 0.856 0 N-CA-C 104.69 -2.337 . . . . 18.59 104.69 177.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -112.64 151.63 29.91 Favored 'General case' 0 C--O 1.258 1.513 0 O-C-N 125.801 1.938 . . . . 12.78 108.066 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -71.47 171.51 46.69 Favored Glycine 0 CA--C 1.536 1.373 0 N-CA-C 107.549 -2.22 . . . . 10.74 107.549 170.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -77.31 -7.08 86.9 Favored Glycine 0 CA--C 1.539 1.543 0 O-C-N 118.776 -2.602 . . . . 15.66 114.827 -177.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 97.5 149.06 24.83 Favored Glycine 0 N--CA 1.441 -0.977 0 CA-C-N 119.982 1.891 . . . . 12.65 113.791 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 53.3 m -125.36 124.62 41.92 Favored 'General case' 0 N--CA 1.429 -1.514 0 N-CA-C 104.3 -2.481 . . . . 16.19 104.3 173.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -96.26 117.65 31.21 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 123.1 1.429 . . . . 41.67 108.346 175.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 31.7 tp -99.25 115.27 28.75 Favored 'General case' 0 C--N 1.307 -1.271 0 N-CA-C 105.196 -2.149 . . . . 27.44 105.196 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -120.38 142.3 49.3 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 125.695 1.598 . . . . 49.02 112.149 -179.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 14.8 tt -71.67 142.21 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 CA-C-O 122.755 1.264 . . . . 43.28 110.725 -175.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 2.8 tptp -71.59 141.92 50.02 Favored 'General case' 0 CA--C 1.501 -0.909 0 CA-C-N 112.658 -2.065 . . . . 63.55 111.959 -175.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 13.4 tpt85 . . . . . 0 N--CA 1.447 -0.597 1 O-C-N 129.207 4.067 . . . . 77.99 101.222 172.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' GLN . . . . . 0.517 ' OE1' ' N ' ' B' ' 1' ' ' GLN . 0.8 OUTLIER . . . . . 0 N--CA 1.445 -0.7 0 CA-C-O 126.844 3.211 . . . . 33.42 108.35 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 54.3 t -101.78 134.19 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.695 1 CA-C-N 106.858 -4.701 . . . . 21.03 102.204 179.38 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -130.14 137.89 50.37 Favored 'General case' 0 C--N 1.307 -1.256 0 C-N-CA 123.277 0.631 . . . . 27.59 109.681 174.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 5.5 mp -133.07 125.23 29.16 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 104.907 -2.257 . . . . 14.37 104.907 170.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -133.29 130.1 38.48 Favored 'General case' 0 C--O 1.244 0.783 0 O-C-N 120.607 -1.308 . . . . 16.55 108.824 179.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 33.8 mp0 -103.04 149.15 24.86 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 106.85 -1.537 . . . . 15.03 106.85 -173.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' SER . . . . . . . . . . . . . 11.1 p -141.42 145.86 35.83 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 106.189 -1.782 . . . . 21.24 106.189 171.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . -151.16 -179.66 27.07 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 109.221 -1.552 . . . . 16.58 109.221 -176.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -82.35 -8.1 11.74 Favored 'Trans proline' 0 C--N 1.333 -0.281 0 C-N-CA 122.687 2.258 . . . . 19.23 115.471 -172.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.63 -110.12 3.12 Favored Glycine 0 C--N 1.335 0.482 0 CA-C-N 120.021 1.282 . . . . 18.86 111.404 178.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 43.2 tp -93.41 129.41 39.57 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 107.733 -1.21 . . . . 22.04 107.733 -178.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 22.7 m -136.88 156.71 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 108.276 -1.009 . . . . 21.69 108.276 179.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.8 149.17 53.15 Favored Pre-proline 0 N--CA 1.443 -0.787 0 O-C-N 120.611 -1.305 . . . . 22.31 107.949 178.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -55.41 159.67 10.22 Favored 'Trans proline' 0 CA--C 1.51 -0.679 0 C-N-CA 123.166 2.577 . . . . 27.47 113.524 171.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' SER . . . . . . . . . . . . . 67.5 m 68.72 -6.22 0.88 Allowed 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 112.708 -2.042 . . . . 36.34 112.842 -177.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 87.9 mm-40 -77.13 169.62 18.0 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.233 -1.766 . . . . 41.24 106.233 172.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 75.7 m -117.83 153.44 33.49 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 104.919 -2.252 . . . . 43.35 104.919 176.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -135.43 159.78 40.51 Favored 'General case' 0 N--CA 1.429 -1.504 0 CA-C-N 114.247 -1.342 . . . . 37.11 110.062 -169.068 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' SER . . . . . . . . . . . . . 33.7 t -131.56 137.11 48.32 Favored 'General case' 0 N--CA 1.429 -1.52 0 N-CA-C 105.854 -1.906 . . . . 33.29 105.854 166.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 92.2 mt -115.23 132.27 65.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 104.964 -2.236 . . . . 21.42 104.964 173.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' THR . . . . . . . . . . . . . 23.9 m -101.17 133.46 45.68 Favored 'General case' 0 CA--C 1.503 -0.843 0 C-N-CA 125.448 1.499 . . . . 19.71 112.537 176.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 36.3 t -109.06 111.45 23.1 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 105.18 -2.156 . . . . 12.34 105.18 168.759 174.196 106.568 75.465 105.322 2.012 103.224 169.949 53.496 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 48.0 m -97.59 127.15 43.32 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 106.535 -1.654 . . . . 15.54 106.535 177.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 14.3 m -112.65 155.57 13.86 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.72 0 C-N-CA 120.07 -0.652 . . . . 14.66 109.399 -176.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 22.6 m -144.0 145.39 32.19 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 124.238 0.961 . . . . 21.13 110.07 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' GLY . . . . . . . . . . . . . . . 94.85 -4.84 68.79 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 119.256 -1.449 . . . . 19.77 114.241 173.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' PHE . . . . . . . . . . . . . 42.1 p90 -156.19 159.05 38.62 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-N 120.693 2.247 . . . . 18.58 106.833 178.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 41.8 t -88.38 137.04 32.68 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 114.556 -1.202 . . . . 28.01 113.323 -177.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 17.6 mt -71.92 -9.59 58.56 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 119.362 -0.935 . . . . 19.21 112.873 178.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 74.0 p -85.02 -13.17 51.37 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 119.72 -1.863 . . . . 22.87 110.798 175.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . -102.11 -6.15 48.89 Favored Glycine 0 C--O 1.243 0.661 0 O-C-N 120.09 -1.631 . . . . 19.57 116.261 -176.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -143.1 160.27 40.72 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 120.607 -1.525 . . . . 29.52 108.215 -174.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.69 156.31 20.19 Favored Glycine 0 C--O 1.245 0.783 0 N-CA-C 107.887 -2.085 . . . . 13.98 107.887 175.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 64.9 t -124.52 129.62 73.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 106.04 -1.837 . . . . 12.29 106.04 175.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -107.73 149.66 27.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.621 -1.172 . . . . 14.6 108.406 -177.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' TRP . . . . . . . . . . . . . 76.4 m95 -110.97 134.24 52.75 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 106.648 -1.612 . . . . 14.34 106.648 174.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 87.4 t -136.27 141.66 40.78 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 N-CA-C 105.661 -1.977 . . . . 13.68 105.661 -175.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ARG . . . . . . . . . . . . . 35.3 ptt180 -129.46 160.74 32.22 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 121.719 2.054 . . . . 13.87 109.358 173.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -137.53 106.03 8.42 Favored Pre-proline 0 C--O 1.245 0.826 0 O-C-N 120.398 -1.439 . . . . 14.54 107.206 -179.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -55.91 149.69 50.36 Favored 'Trans proline' 0 C--O 1.243 0.769 0 C-N-CA 124.242 3.295 . . . . 14.25 109.165 171.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -49.32 123.12 9.68 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 124.092 3.195 . . . . 17.54 112.085 178.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 66.92 14.17 62.83 Favored Glycine 0 N--CA 1.439 -1.155 0 CA-C-O 116.851 -2.083 . . . . 21.69 113.141 177.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 28.7 mmtm -117.42 -175.6 2.84 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-N 121.66 2.73 . . . . 42.06 109.013 179.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . -88.43 -177.38 47.11 Favored Glycine 0 CA--C 1.525 0.699 0 O-C-N 120.005 -1.684 . . . . 14.57 112.829 -176.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 45.9 mt -82.14 139.68 34.22 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 114.577 -0.812 . . . . 12.76 109.266 -178.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 77.0 tt0 -122.08 120.82 35.43 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 107.408 -1.33 . . . . 30.11 107.408 179.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' TRP . . . . . . . . . . . . . 78.7 t90 -73.41 130.32 39.89 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 119.082 -2.261 . . . . 14.84 109.439 178.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 97.6 mt -101.12 -40.89 6.97 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 113.079 0.77 . . . . 14.12 113.079 -178.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 166.15 -172.74 41.58 Favored Glycine 0 C--O 1.249 1.065 0 N-CA-C 110.807 -0.917 . . . . 12.54 110.807 179.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' MET . . . . . . . . . . . . . 27.6 ptm -157.42 156.36 32.07 Favored 'General case' 0 CA--C 1.508 -0.65 0 O-C-N 124.604 0.826 . . . . 21.78 110.517 -177.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 tt -121.49 124.89 72.78 Favored 'Isoleucine or valine' 0 C--O 1.244 0.764 0 N-CA-C 104.423 -2.436 . . . . 13.59 104.423 172.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' TRP . . . . . . . . . . . . . 75.5 m95 -74.8 166.14 24.1 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 121.716 -0.615 . . . . 17.95 111.807 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -59.45 -31.32 70.03 Favored Glycine 0 C--N 1.337 0.598 0 N-CA-C 110.106 -1.198 . . . . 16.85 110.106 -179.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 59.4 p30 -85.99 4.21 38.77 Favored 'General case' 0 CA--C 1.513 -0.472 0 O-C-N 119.409 -2.23 . . . . 25.0 114.026 178.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 98.07 -9.53 63.51 Favored Glycine 0 N--CA 1.443 -0.868 0 O-C-N 119.832 -1.793 . . . . 16.99 113.055 173.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -69.52 148.91 48.83 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 119.613 1.707 . . . . 34.09 110.358 178.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' THR . . . . . . . . . . . . . 22.3 p -124.52 158.58 32.58 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 120.73 1.605 . . . . 19.49 110.417 179.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -144.36 147.16 33.08 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 103.867 -2.642 . . . . 22.77 103.867 175.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -131.06 158.5 40.19 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 124.083 1.897 . . . . 19.92 114.661 -175.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -61.45 126.05 25.98 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 104.48 -2.415 . . . . 25.09 104.48 169.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.26 -48.64 68.11 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 124.133 0.973 . . . . 38.19 112.644 -177.946 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.5 -34.01 76.01 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.568 1.322 . . . . 33.75 114.568 -176.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 28.2 mt -105.02 -9.53 17.81 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 115.426 1.639 . . . . 30.43 115.426 -175.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 49.9 tttp -37.85 -39.26 0.35 Allowed 'General case' 0 C--O 1.233 0.235 0 N-CA-C 117.902 2.556 . . . . 49.69 117.902 -177.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 13.7 p -71.83 -30.35 65.38 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 115.91 1.818 . . . . 40.82 115.91 -179.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ARG . . . . . . . . . . . . . 37.6 mtp180 -94.74 -5.55 45.11 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 119.647 -1.908 . . . . 30.29 112.519 -178.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 2.1 mp -112.23 149.09 32.79 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 113.697 0.999 . . . . 33.01 113.697 -172.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' SER . . . . . . . . . . . . . 37.5 t -147.67 129.43 15.18 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 107.632 -1.247 . . . . 28.82 107.632 174.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' ILE . . . . . . . . . . . . . 67.9 mt -118.87 135.01 60.64 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.629 0 O-C-N 119.188 -2.195 . . . . 15.49 106.43 178.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' SER . . . . . . . . . . . . . 85.7 p -147.01 176.57 9.82 Favored 'General case' 0 C--N 1.323 -0.585 0 O-C-N 119.999 -1.688 . . . . 17.87 107.895 176.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 46.9 pttt -151.16 163.35 39.02 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 119.688 -1.883 . . . . 15.28 106.503 -178.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -124.77 102.61 7.66 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 101.274 -3.602 . . . . 22.98 101.274 177.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -61.99 -37.62 85.49 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 119.459 -0.305 . . . . 27.1 110.827 -176.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 28.2 t -66.38 -37.63 85.72 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 115.194 1.553 . . . . 27.28 115.194 -179.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -91.41 -1.12 57.68 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 120.085 -1.635 . . . . 39.05 111.069 179.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' SER . . . . . . . . . . . . . 44.3 m 58.39 44.43 18.3 Favored 'General case' 0 C--O 1.244 0.796 0 CA-C-N 119.877 1.217 . . . . 20.5 112.187 -178.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -129.68 144.69 51.4 Favored 'General case' 0 C--O 1.253 1.25 0 C-N-CA 119.965 -0.694 . . . . 26.86 109.644 179.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' VAL . . . . . . . . . . . . . 94.5 t -120.78 138.79 50.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 102.937 -2.986 . . . . 11.91 102.937 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -117.51 146.98 43.18 Favored 'General case' 0 CA--C 1.498 -1.035 0 CA-C-N 121.03 1.741 . . . . 17.18 111.174 -177.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 27.3 tp -120.52 125.0 46.73 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 102.556 -3.127 . . . . 16.03 102.556 171.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 18.6 mtmm -122.64 138.09 54.7 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-O 123.697 1.713 . . . . 38.94 106.539 -179.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 93.4 mtp -133.03 136.79 46.19 Favored 'General case' 0 CA--C 1.495 -1.143 0 CA-C-N 113.075 -1.875 . . . . 40.48 107.349 -178.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -113.82 160.3 18.87 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.427 -1.323 . . . . 48.02 107.427 174.688 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 55.2 p 48.49 65.12 1.42 Allowed 'General case' 0 C--O 1.247 0.937 0 CA-C-O 125.088 2.375 . . . . 43.81 114.794 -178.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.3 140.3 58.01 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 111.709 -2.496 . . . . 27.1 110.701 -179.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' HIS . . . . . . . . . . . . . 12.7 m-70 -121.27 165.45 15.45 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 103.112 -2.922 . . . . 41.33 103.112 178.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 31.2 p -64.91 -28.51 69.58 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 119.4 -0.92 . . . . 28.07 110.49 -177.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 56.8 p-10 -78.41 6.54 8.22 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 114.578 1.325 . . . . 41.4 114.578 -179.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -85.94 2.02 47.76 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 121.621 -0.674 . . . . 16.98 109.887 169.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' THR . . . . . . . . . . . . . 53.5 m -62.02 123.77 19.0 Favored 'General case' 0 C--O 1.238 0.466 0 O-C-N 120.465 -1.397 . . . . 14.64 108.042 175.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -175.26 167.39 3.4 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 108.83 -0.804 . . . . 12.59 108.83 -178.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' ARG . . . . . . . . . . . . . 4.6 ttt85 -90.82 131.37 36.51 Favored 'General case' 0 C--O 1.242 0.658 0 N-CA-C 103.054 -2.943 . . . . 24.1 103.054 168.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -110.63 130.57 55.53 Favored 'General case' 0 CA--C 1.508 -0.641 0 C-N-CA 123.451 0.701 . . . . 12.7 109.675 -177.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -122.12 143.59 49.45 Favored 'General case' 0 C--O 1.248 0.977 0 C-N-CA 123.042 0.537 . . . . 19.97 111.355 -177.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' CYS . . . . . . . . . . . . . 15.1 p -108.43 154.32 22.04 Favored 'General case' 0 C--O 1.249 1.026 0 N-CA-C 106.322 -1.733 . . . . 12.2 106.322 162.867 53.496 169.949 75.465 103.224 2.012 105.322 106.568 174.196 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -151.44 138.2 18.88 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 106.365 -1.717 . . . . 10.38 106.365 -172.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' ARG . . . . . . . . . . . . . 36.3 ttp180 -77.28 140.36 40.03 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.74 -1.118 . . . . 19.15 110.843 178.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 71.7 tt0 -118.46 134.68 54.88 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 120.83 -1.169 . . . . 19.07 110.323 174.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -150.91 135.21 16.92 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 106.279 -1.748 . . . . 52.56 106.279 168.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 39.86 63.04 1.11 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 116.092 1.886 . . . . 42.52 116.092 179.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 60.05 41.67 16.93 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 117.794 2.516 . . . . 27.38 117.794 174.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.03 154.28 25.48 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 108.221 -1.029 . . . . 34.46 108.221 174.685 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 21.6 mt -107.65 96.55 6.48 Favored 'General case' 0 CA--C 1.502 -0.881 1 N-CA-C 98.385 -4.672 . . . . 13.45 98.385 177.168 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ASP . . . . . . . . . . . . . 51.0 p-10 -88.59 -26.84 21.72 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 116.244 1.942 . . . . 18.86 116.244 -172.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -129.24 135.78 49.24 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 121.095 1.77 . . . . 28.97 107.138 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' TRP . . . . . . . . . . . . . 36.7 m95 -125.19 146.45 49.5 Favored 'General case' 0 C--O 1.242 0.674 0 O-C-N 124.003 0.815 . . . . 15.06 108.916 -175.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -75.07 176.33 49.69 Favored Glycine 0 CA--C 1.534 1.224 0 N-CA-C 109.009 -1.637 . . . . 15.89 109.009 169.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.38 -15.31 59.44 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 120.338 -1.684 . . . . 25.05 113.011 179.328 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . 92.04 158.97 34.96 Favored Glycine 0 C--N 1.339 0.719 0 C-N-CA 124.988 1.28 . . . . 14.3 113.519 -179.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 10.3 t -131.02 140.77 50.16 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 104.136 -2.542 . . . . 13.58 104.136 173.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 92.4 m -90.07 126.23 35.7 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 120.359 -0.536 . . . . 22.44 111.535 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 43.2 tp -108.6 128.08 54.51 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 106.086 -1.82 . . . . 18.64 106.086 175.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' THR . . . . . . . . . . . . . 62.8 m -125.32 121.85 35.16 Favored 'General case' 0 C--O 1.245 0.858 0 N-CA-C 103.508 -2.775 . . . . 15.86 103.508 179.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 98.0 t -99.01 111.58 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 N-CA-C 104.729 -2.323 . . . . 19.3 104.729 179.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 8.2 t -148.66 131.27 15.87 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.407 -1.331 . . . . 34.86 107.407 -177.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 28.0 p . . . . . 0 C--O 1.238 0.47 0 CA-C-N 110.335 -3.121 . . . . 49.13 117.595 179.673 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 731' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 733' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 736' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 742' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 743' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 746' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 764' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 801' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 855' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 887' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 738' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 748' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 749' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 765' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 767' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 785' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 800' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 830' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 872' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 878' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 889' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 898' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 908' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 . . . . . 0 CA--C 1.511 -0.524 0 N-CA-C 100.481 -3.896 . . . . 44.82 100.481 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 39.1 mt -89.27 132.27 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 N-CA-C 106.451 -1.685 . . . . 24.52 106.451 -179.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.3 t -108.39 140.68 26.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 106.447 -1.686 . . . . 19.92 106.447 -179.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 57.1 mt -108.22 125.65 51.89 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.399 -0.819 . . . . 14.22 108.797 178.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 86.3 m -113.14 124.3 52.25 Favored 'General case' 0 N--CA 1.438 -1.041 0 O-C-N 121.146 -0.971 . . . . 21.61 108.56 178.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -103.16 140.75 36.93 Favored 'General case' 0 N--CA 1.438 -1.065 0 O-C-N 120.595 -1.315 . . . . 15.99 112.096 -179.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.6 m -137.45 145.6 50.07 Favored Pre-proline 0 C--N 1.317 -0.833 0 N-CA-C 106.273 -1.751 . . . . 29.81 106.273 176.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -72.46 165.39 83.22 Favored 'Cis proline' 0 CA--C 1.511 -0.658 0 CA-C-N 121.302 1.501 . . . . 20.02 111.21 -9.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.61 -31.17 61.94 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 121.47 1.941 . . . . 19.81 107.53 175.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.5 t -143.47 142.83 31.33 Favored 'General case' 0 C--N 1.348 0.507 0 N-CA-C 107.966 -1.124 . . . . 32.97 107.966 -178.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 69.0 tp -143.25 125.83 15.88 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 107.8 -1.185 . . . . 31.58 107.8 -177.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 m -97.08 137.65 35.83 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 105.023 -2.214 . . . . 34.77 105.023 174.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -155.38 153.85 31.07 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 120.078 -1.639 . . . . 22.67 108.918 -178.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.6 m -95.73 155.3 16.81 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-O 122.956 1.36 . . . . 28.06 108.799 -178.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 55.7 t -57.06 136.07 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.924 0 CA-C-N 112.793 -2.003 . . . . 22.51 106.03 173.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.65 -15.49 63.04 Favored Glycine 0 N--CA 1.432 -1.571 0 CA-C-O 116.55 -2.25 . . . . 21.8 112.294 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -79.8 156.16 27.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 121.973 2.887 . . . . 43.71 114.573 177.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 18.3 m -105.01 129.38 53.46 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 106.338 -1.727 . . . . 24.75 106.338 176.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 27.1 m -128.34 157.28 40.78 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 N-CA-C 109.063 -0.717 . . . . 24.53 109.063 -178.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.7 m -134.13 134.98 42.84 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 104.109 -2.552 . . . . 25.05 104.109 176.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 8.0 pt -123.14 145.25 30.34 Favored 'Isoleucine or valine' 0 C--O 1.245 0.839 0 N-CA-C 106.932 -1.507 . . . . 24.28 106.932 176.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 72.4 p -118.25 159.9 22.53 Favored 'General case' 0 CA--C 1.502 -0.881 0 O-C-N 120.069 -1.645 . . . . 19.59 111.274 -173.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 38.5 t -138.48 118.17 13.11 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 103.701 -2.703 . . . . 15.35 103.701 -179.039 174.986 117.707 77.807 105.337 2.009 103.553 161.003 54.953 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.7 mtm-85 -111.66 134.88 52.94 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.529 -0.76 . . . . 53.22 111.272 179.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -99.87 148.4 24.49 Favored 'General case' 0 C--O 1.242 0.677 0 C-N-CA 123.562 0.745 . . . . 16.93 111.505 -179.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.3 p -83.78 6.27 21.88 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.668 0.988 . . . . 15.49 113.668 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -164.38 156.21 28.0 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 105.019 -3.232 . . . . 13.69 105.019 -177.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -65.8 129.19 38.93 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 119.95 1.875 . . . . 14.99 110.238 -175.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 24.9 pt -110.48 7.11 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 O-C-N 120.933 -1.104 . . . . 13.88 110.823 179.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 53.89 46.19 26.2 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 121.091 -1.006 . . . . 19.14 113.606 168.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 24.4 m120 64.12 7.25 3.31 Favored 'General case' 0 C--O 1.242 0.7 0 N-CA-C 118.505 2.78 . . . . 14.98 118.505 178.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -84.21 75.07 10.23 Favored 'General case' 0 C--O 1.241 0.654 0 O-C-N 121.245 -0.909 . . . . 22.11 108.661 177.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.0 tp -134.82 132.52 38.75 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.655 -0.702 . . . . 14.54 109.734 -175.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -119.98 154.56 34.33 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 123.709 0.804 . . . . 12.05 108.949 178.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -120.27 140.73 50.79 Favored 'General case' 0 C--O 1.245 0.85 0 C-N-CA 124.339 1.055 . . . . 12.6 108.486 177.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -127.96 149.05 50.51 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 107.487 -1.301 . . . . 13.0 107.487 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -111.3 139.02 47.05 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 105.703 -1.962 . . . . 25.34 105.703 171.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -127.7 119.52 25.99 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 106.476 -1.676 . . . . 16.33 106.476 178.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.3 mmmm -92.35 160.92 14.89 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 106.68 -1.6 . . . . 38.58 106.68 177.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 53.9 tp60 -48.97 123.05 6.48 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 114.236 1.198 . . . . 42.64 114.236 -177.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 69.06 8.85 59.04 Favored Glycine 0 CA--C 1.534 1.238 0 CA-C-O 117.689 -1.617 . . . . 36.9 115.789 -178.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.9 mmtm -114.5 162.67 16.39 Favored 'General case' 0 C--O 1.248 0.981 0 CA-C-N 123.101 3.45 . . . . 40.95 107.623 -178.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.7 p -75.93 159.78 80.07 Favored Pre-proline 0 C--O 1.25 1.101 0 N-CA-C 108.328 -0.99 . . . . 24.94 108.328 174.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -59.57 150.51 75.65 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 122.993 2.462 . . . . 16.63 111.949 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -127.05 135.11 50.34 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 105.007 -2.22 . . . . 43.85 105.007 177.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 34.8 tp -65.03 133.26 51.28 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.026 -1.443 . . . . 13.71 110.536 176.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -111.97 -51.99 2.81 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 113.316 -1.766 . . . . 19.82 112.01 177.867 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 98.0 t -142.73 139.24 28.27 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.815 0 N-CA-C 105.606 -1.998 . . . . 14.7 105.606 -167.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 39.2 p90 -138.26 166.49 24.05 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 119.899 1.227 . . . . 24.1 108.918 172.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 15.1 t80 37.87 57.48 1.51 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 124.809 2.242 . . . . 21.97 111.843 -166.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 41.3 m 65.15 -51.67 0.34 Allowed 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 117.373 2.36 . . . . 11.52 117.373 179.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 71.9 p -119.96 -12.22 9.19 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 116.806 2.151 . . . . 11.98 116.806 -171.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 28.3 m -84.0 123.56 30.12 Favored 'General case' 0 C--O 1.238 0.467 0 O-C-N 119.832 -1.793 . . . . 16.95 112.068 -173.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 23.7 mt -78.28 141.86 38.21 Favored 'General case' 0 C--O 1.242 0.684 0 O-C-N 121.692 -0.63 . . . . 20.83 109.952 177.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.99 165.8 24.32 Favored 'General case' 0 C--O 1.248 1.013 0 O-C-N 121.0 -1.062 . . . . 24.96 108.483 175.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -58.42 135.94 57.35 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 120.43 -1.419 . . . . 51.87 110.408 -178.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.8 7.94 81.32 Favored Glycine 0 N--CA 1.442 -0.966 0 CA-C-O 116.335 -2.37 . . . . 32.18 114.055 177.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 58.3 t -83.64 133.73 46.11 Favored Pre-proline 0 C--O 1.237 0.43 0 CA-C-N 123.626 3.713 . . . . 26.08 104.836 175.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -65.67 149.56 87.09 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.566 2.178 . . . . 27.71 111.938 178.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.3 p -62.93 -13.53 35.68 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 113.606 -1.634 . . . . 35.74 114.176 -177.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 32.3 ptt-85 -68.91 -9.97 54.66 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 119.902 -1.749 . . . . 30.05 114.895 176.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -91.91 135.88 33.59 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 118.001 -0.999 . . . . 18.29 109.605 173.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 95.2 p -147.75 142.48 26.7 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-N 121.147 1.794 . . . . 21.1 110.556 167.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -112.89 153.8 17.31 Favored Glycine 0 C--O 1.246 0.848 0 N-CA-C 107.242 -2.343 . . . . 11.95 107.242 -178.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 80.2 p -147.95 170.35 17.9 Favored 'General case' 0 C--O 1.248 0.993 0 N-CA-C 109.008 -0.738 . . . . 15.8 109.008 175.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 142.8 169.8 12.51 Favored Glycine 0 N--CA 1.44 -1.043 0 CA-C-O 122.902 1.279 . . . . 11.29 111.109 175.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 16.5 p -168.12 164.42 13.45 Favored 'General case' 0 C--O 1.247 0.962 0 N-CA-C 106.585 -1.635 . . . . 16.44 106.585 172.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 61.92 -114.79 7.12 Favored Glycine 0 CA--C 1.523 0.563 0 C-N-CA 120.698 -0.763 . . . . 12.46 112.753 178.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 27.6 p -110.13 5.93 22.39 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-O 117.678 -1.153 . . . . 14.65 112.134 -178.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -128.84 122.03 29.53 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 122.085 2.221 . . . . 40.49 110.304 -171.129 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -137.7 151.1 47.88 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 107.317 -1.364 . . . . 14.17 107.317 -174.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 2.5 m -140.73 148.25 40.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 120.194 1.361 . . . . 23.92 109.119 -178.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 43.4 tp -118.97 123.91 45.73 Favored 'General case' 0 C--O 1.251 1.161 0 N-CA-C 102.984 -2.969 . . . . 16.19 102.984 172.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 6.7 ttpm? -109.8 132.7 53.91 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.115 -1.439 . . . . 36.71 107.115 178.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 27.6 mt -118.76 113.88 43.09 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 106.162 -1.792 . . . . 16.51 106.162 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -82.68 129.77 35.01 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 117.628 -1.177 . . . . 39.56 112.837 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 60.2 m 46.91 68.42 0.63 Allowed 'General case' 0 C--O 1.242 0.706 0 N-CA-C 117.716 2.487 . . . . 35.42 117.716 178.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 37.9 mt -42.47 126.08 3.42 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 115.821 1.786 . . . . 26.45 115.821 176.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -102.57 160.19 27.03 Favored Pre-proline 0 C--O 1.243 0.747 0 N-CA-C 108.004 -1.11 . . . . 22.26 108.004 173.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -55.3 -35.62 91.85 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 124.661 3.574 . . . . 23.11 113.632 -173.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 19.9 pm0 -70.63 -5.61 30.7 Favored 'General case' 0 N--CA 1.437 -1.092 0 N-CA-C 113.587 0.958 . . . . 40.82 113.587 -178.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -91.5 -10.91 39.04 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 119.457 1.026 . . . . 18.55 112.975 -179.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -73.04 148.4 44.15 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 122.07 2.214 . . . . 26.95 108.792 -177.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 145.75 -164.46 28.15 Favored Glycine 0 N--CA 1.437 -1.286 0 N-CA-C 107.326 -2.31 . . . . 16.31 107.326 -176.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 55.0 m -105.04 144.72 31.45 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 118.856 1.328 . . . . 21.54 111.765 -178.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -120.93 133.22 55.28 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 107.63 -1.248 . . . . 15.77 107.63 -178.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -126.76 136.19 52.08 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 123.37 0.668 . . . . 17.48 110.093 -178.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 20.2 p -101.07 155.55 17.93 Favored 'General case' 0 C--N 1.318 -0.804 0 O-C-N 120.461 -1.399 . . . . 12.21 108.022 169.249 54.953 161.003 77.807 103.553 2.009 105.337 117.707 174.986 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -145.09 140.33 27.97 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.181 -1.575 . . . . 18.71 107.056 -178.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 13.4 p80 -105.34 162.64 13.26 Favored 'General case' 0 C--O 1.256 1.437 0 C-N-CA 117.954 -1.499 . . . . 15.07 108.425 178.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -130.08 27.95 5.08 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-O 122.729 1.252 . . . . 15.7 109.664 178.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 74.7 t-105 -85.48 108.77 18.06 Favored 'General case' 0 C--O 1.238 0.488 0 O-C-N 118.755 -2.466 . . . . 17.52 107.735 178.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 47.9 t 57.4 -148.9 0.48 Allowed 'General case' 0 C--O 1.238 0.499 0 C-N-CA 124.32 1.048 . . . . 19.68 108.197 177.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 15.0 p -137.3 155.25 75.83 Favored Pre-proline 0 CA--C 1.548 0.895 0 CA-C-N 120.348 1.431 . . . . 27.93 109.134 173.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -72.29 157.32 97.9 Favored 'Cis proline' 0 N--CA 1.456 -0.711 0 O-C-N 116.511 -2.415 . . . . 22.65 113.421 -1.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -88.3 157.62 18.69 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 103.952 -2.61 . . . . 23.36 103.952 173.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 43.8 p -145.1 163.6 33.82 Favored 'General case' 0 C--O 1.245 0.856 0 N-CA-C 104.69 -2.337 . . . . 18.59 104.69 177.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -112.64 151.63 29.91 Favored 'General case' 0 C--O 1.258 1.513 0 O-C-N 125.801 1.938 . . . . 12.78 108.066 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -71.47 171.51 46.69 Favored Glycine 0 CA--C 1.536 1.373 0 N-CA-C 107.549 -2.22 . . . . 10.74 107.549 170.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -77.31 -7.08 86.9 Favored Glycine 0 CA--C 1.539 1.543 0 O-C-N 118.776 -2.602 . . . . 15.66 114.827 -177.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 97.5 149.06 24.83 Favored Glycine 0 N--CA 1.441 -0.977 0 CA-C-N 119.982 1.891 . . . . 12.65 113.791 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 53.3 m -125.36 124.62 41.92 Favored 'General case' 0 N--CA 1.429 -1.514 0 N-CA-C 104.3 -2.481 . . . . 16.19 104.3 173.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -96.26 117.65 31.21 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 123.1 1.429 . . . . 41.67 108.346 175.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 31.7 tp -99.25 115.27 28.75 Favored 'General case' 0 C--N 1.307 -1.271 0 N-CA-C 105.196 -2.149 . . . . 27.44 105.196 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -120.38 142.3 49.3 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 125.695 1.598 . . . . 49.02 112.149 -179.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 14.8 tt -71.67 142.21 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 CA-C-O 122.755 1.264 . . . . 43.28 110.725 -175.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 2.8 tptp -71.59 141.92 50.02 Favored 'General case' 0 CA--C 1.501 -0.909 0 CA-C-N 112.658 -2.065 . . . . 63.55 111.959 -175.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 13.4 tpt85 . . . . . 0 N--CA 1.447 -0.597 1 O-C-N 129.207 4.067 . . . . 77.99 101.222 172.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 1' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.445 -0.7 0 CA-C-O 126.844 3.211 . . . . 33.42 108.35 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 54.3 t -101.78 134.19 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.695 1 CA-C-N 106.858 -4.701 . . . . 21.03 102.204 179.38 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -130.14 137.89 50.37 Favored 'General case' 0 C--N 1.307 -1.256 0 C-N-CA 123.277 0.631 . . . . 27.59 109.681 174.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 5.5 mp -133.07 125.23 29.16 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 104.907 -2.257 . . . . 14.37 104.907 170.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -133.29 130.1 38.48 Favored 'General case' 0 C--O 1.244 0.783 0 O-C-N 120.607 -1.308 . . . . 16.55 108.824 179.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 33.8 mp0 -103.04 149.15 24.86 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 106.85 -1.537 . . . . 15.03 106.85 -173.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' SER . . . . . . . . . . . . . 11.1 p -141.42 145.86 35.83 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 106.189 -1.782 . . . . 21.24 106.189 171.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . -151.16 -179.66 27.07 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 109.221 -1.552 . . . . 16.58 109.221 -176.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -82.35 -8.1 11.74 Favored 'Trans proline' 0 C--N 1.333 -0.281 0 C-N-CA 122.687 2.258 . . . . 19.23 115.471 -172.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.63 -110.12 3.12 Favored Glycine 0 C--N 1.335 0.482 0 CA-C-N 120.021 1.282 . . . . 18.86 111.404 178.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' LEU . . . . . 0.494 HD11 ' HB3' ' B' ' 115' ' ' SER . 43.2 tp -93.41 129.41 39.57 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 107.733 -1.21 . . . . 22.04 107.733 -178.82 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 22.7 m -136.88 156.71 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 108.276 -1.009 . . . . 21.69 108.276 179.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.8 149.17 53.15 Favored Pre-proline 0 N--CA 1.443 -0.787 0 O-C-N 120.611 -1.305 . . . . 22.31 107.949 178.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -55.41 159.67 10.22 Favored 'Trans proline' 0 CA--C 1.51 -0.679 0 C-N-CA 123.166 2.577 . . . . 27.47 113.524 171.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' SER . . . . . . . . . . . . . 67.5 m 68.72 -6.22 0.88 Allowed 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 112.708 -2.042 . . . . 36.34 112.842 -177.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 87.9 mm-40 -77.13 169.62 18.0 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.233 -1.766 . . . . 41.24 106.233 172.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' SER . . . . . 0.421 ' OG ' ' HA ' ' B' ' 83' ' ' ASN . 75.7 m -117.83 153.44 33.49 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 104.919 -2.252 . . . . 43.35 104.919 176.511 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' LEU . . . . . 0.627 HD23 ' HB2' ' B' ' 82' ' ' MET . 0.0 OUTLIER -135.43 159.78 40.51 Favored 'General case' 0 N--CA 1.429 -1.504 0 CA-C-N 114.247 -1.342 . . . . 37.11 110.062 -169.068 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 19' ' ' SER . . . . . . . . . . . . . 33.7 t -131.56 137.11 48.32 Favored 'General case' 0 N--CA 1.429 -1.52 0 N-CA-C 105.854 -1.906 . . . . 33.29 105.854 166.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 92.2 mt -115.23 132.27 65.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 104.964 -2.236 . . . . 21.42 104.964 173.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' THR . . . . . . . . . . . . . 23.9 m -101.17 133.46 45.68 Favored 'General case' 0 CA--C 1.503 -0.843 0 C-N-CA 125.448 1.499 . . . . 19.71 112.537 176.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 36.3 t -109.06 111.45 23.1 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 105.18 -2.156 . . . . 12.34 105.18 168.759 174.196 106.568 75.465 105.322 2.012 103.224 169.949 53.496 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 48.0 m -97.59 127.15 43.32 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 106.535 -1.654 . . . . 15.54 106.535 177.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 14.3 m -112.65 155.57 13.86 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.72 0 C-N-CA 120.07 -0.652 . . . . 14.66 109.399 -176.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 22.6 m -144.0 145.39 32.19 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 124.238 0.961 . . . . 21.13 110.07 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' GLY . . . . . . . . . . . . . . . 94.85 -4.84 68.79 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 119.256 -1.449 . . . . 19.77 114.241 173.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' PHE . . . . . . . . . . . . . 42.1 p90 -156.19 159.05 38.62 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-N 120.693 2.247 . . . . 18.58 106.833 178.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 41.8 t -88.38 137.04 32.68 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 114.556 -1.202 . . . . 28.01 113.323 -177.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 17.6 mt -71.92 -9.59 58.56 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 119.362 -0.935 . . . . 19.21 112.873 178.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 74.0 p -85.02 -13.17 51.37 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 119.72 -1.863 . . . . 22.87 110.798 175.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . -102.11 -6.15 48.89 Favored Glycine 0 C--O 1.243 0.661 0 O-C-N 120.09 -1.631 . . . . 19.57 116.261 -176.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -143.1 160.27 40.72 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 120.607 -1.525 . . . . 29.52 108.215 -174.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.69 156.31 20.19 Favored Glycine 0 C--O 1.245 0.783 0 N-CA-C 107.887 -2.085 . . . . 13.98 107.887 175.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 64.9 t -124.52 129.62 73.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 106.04 -1.837 . . . . 12.29 106.04 175.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -107.73 149.66 27.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.621 -1.172 . . . . 14.6 108.406 -177.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' TRP . . . . . . . . . . . . . 76.4 m95 -110.97 134.24 52.75 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 106.648 -1.612 . . . . 14.34 106.648 174.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 87.4 t -136.27 141.66 40.78 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 N-CA-C 105.661 -1.977 . . . . 13.68 105.661 -175.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ARG . . . . . . . . . . . . . 35.3 ptt180 -129.46 160.74 32.22 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 121.719 2.054 . . . . 13.87 109.358 173.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -137.53 106.03 8.42 Favored Pre-proline 0 C--O 1.245 0.826 0 O-C-N 120.398 -1.439 . . . . 14.54 107.206 -179.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -55.91 149.69 50.36 Favored 'Trans proline' 0 C--O 1.243 0.769 0 C-N-CA 124.242 3.295 . . . . 14.25 109.165 171.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -49.32 123.12 9.68 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 124.092 3.195 . . . . 17.54 112.085 178.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 66.92 14.17 62.83 Favored Glycine 0 N--CA 1.439 -1.155 0 CA-C-O 116.851 -2.083 . . . . 21.69 113.141 177.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 28.7 mmtm -117.42 -175.6 2.84 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-N 121.66 2.73 . . . . 42.06 109.013 179.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . -88.43 -177.38 47.11 Favored Glycine 0 CA--C 1.525 0.699 0 O-C-N 120.005 -1.684 . . . . 14.57 112.829 -176.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 45.9 mt -82.14 139.68 34.22 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 114.577 -0.812 . . . . 12.76 109.266 -178.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 77.0 tt0 -122.08 120.82 35.43 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 107.408 -1.33 . . . . 30.11 107.408 179.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' TRP . . . . . . . . . . . . . 78.7 t90 -73.41 130.32 39.89 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 119.082 -2.261 . . . . 14.84 109.439 178.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 97.6 mt -101.12 -40.89 6.97 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 113.079 0.77 . . . . 14.12 113.079 -178.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 166.15 -172.74 41.58 Favored Glycine 0 C--O 1.249 1.065 0 N-CA-C 110.807 -0.917 . . . . 12.54 110.807 179.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' MET . . . . . . . . . . . . . 27.6 ptm -157.42 156.36 32.07 Favored 'General case' 0 CA--C 1.508 -0.65 0 O-C-N 124.604 0.826 . . . . 21.78 110.517 -177.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 tt -121.49 124.89 72.78 Favored 'Isoleucine or valine' 0 C--O 1.244 0.764 0 N-CA-C 104.423 -2.436 . . . . 13.59 104.423 172.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' TRP . . . . . . . . . . . . . 75.5 m95 -74.8 166.14 24.1 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 121.716 -0.615 . . . . 17.95 111.807 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -59.45 -31.32 70.03 Favored Glycine 0 C--N 1.337 0.598 0 N-CA-C 110.106 -1.198 . . . . 16.85 110.106 -179.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 59.4 p30 -85.99 4.21 38.77 Favored 'General case' 0 CA--C 1.513 -0.472 0 O-C-N 119.409 -2.23 . . . . 25.0 114.026 178.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 98.07 -9.53 63.51 Favored Glycine 0 N--CA 1.443 -0.868 0 O-C-N 119.832 -1.793 . . . . 16.99 113.055 173.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -69.52 148.91 48.83 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 119.613 1.707 . . . . 34.09 110.358 178.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' THR . . . . . . . . . . . . . 22.3 p -124.52 158.58 32.58 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 120.73 1.605 . . . . 19.49 110.417 179.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -144.36 147.16 33.08 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 103.867 -2.642 . . . . 22.77 103.867 175.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -131.06 158.5 40.19 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 124.083 1.897 . . . . 19.92 114.661 -175.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -61.45 126.05 25.98 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 104.48 -2.415 . . . . 25.09 104.48 169.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.26 -48.64 68.11 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 124.133 0.973 . . . . 38.19 112.644 -177.946 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.5 -34.01 76.01 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.568 1.322 . . . . 33.75 114.568 -176.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 28.2 mt -105.02 -9.53 17.81 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 115.426 1.639 . . . . 30.43 115.426 -175.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 49.9 tttp -37.85 -39.26 0.35 Allowed 'General case' 0 C--O 1.233 0.235 0 N-CA-C 117.902 2.556 . . . . 49.69 117.902 -177.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 13.7 p -71.83 -30.35 65.38 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 115.91 1.818 . . . . 40.82 115.91 -179.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ARG . . . . . . . . . . . . . 37.6 mtp180 -94.74 -5.55 45.11 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 119.647 -1.908 . . . . 30.29 112.519 -178.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' LEU . . . . . 0.485 HD12 ' HG2' ' B' ' 82' ' ' MET . 2.1 mp -112.23 149.09 32.79 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 113.697 0.999 . . . . 33.01 113.697 -172.744 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 68' ' ' SER . . . . . . . . . . . . . 37.5 t -147.67 129.43 15.18 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 107.632 -1.247 . . . . 28.82 107.632 174.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' ILE . . . . . . . . . . . . . 67.9 mt -118.87 135.01 60.64 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.629 0 O-C-N 119.188 -2.195 . . . . 15.49 106.43 178.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' SER . . . . . . . . . . . . . 85.7 p -147.01 176.57 9.82 Favored 'General case' 0 C--N 1.323 -0.585 0 O-C-N 119.999 -1.688 . . . . 17.87 107.895 176.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 46.9 pttt -151.16 163.35 39.02 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 119.688 -1.883 . . . . 15.28 106.503 -178.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -124.77 102.61 7.66 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 101.274 -3.602 . . . . 22.98 101.274 177.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -61.99 -37.62 85.49 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 119.459 -0.305 . . . . 27.1 110.827 -176.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 28.2 t -66.38 -37.63 85.72 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 115.194 1.553 . . . . 27.28 115.194 -179.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -91.41 -1.12 57.68 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 120.085 -1.635 . . . . 39.05 111.069 179.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' SER . . . . . . . . . . . . . 44.3 m 58.39 44.43 18.3 Favored 'General case' 0 C--O 1.244 0.796 0 CA-C-N 119.877 1.217 . . . . 20.5 112.187 -178.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -129.68 144.69 51.4 Favored 'General case' 0 C--O 1.253 1.25 0 C-N-CA 119.965 -0.694 . . . . 26.86 109.644 179.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' VAL . . . . . . . . . . . . . 94.5 t -120.78 138.79 50.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 102.937 -2.986 . . . . 11.91 102.937 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -117.51 146.98 43.18 Favored 'General case' 0 CA--C 1.498 -1.035 0 CA-C-N 121.03 1.741 . . . . 17.18 111.174 -177.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 27.3 tp -120.52 125.0 46.73 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 102.556 -3.127 . . . . 16.03 102.556 171.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 18.6 mtmm -122.64 138.09 54.7 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-O 123.697 1.713 . . . . 38.94 106.539 -179.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' MET . . . . . 0.627 ' HB2' HD23 ' B' ' 18' ' ' LEU . 93.4 mtp -133.03 136.79 46.19 Favored 'General case' 0 CA--C 1.495 -1.143 0 CA-C-N 113.075 -1.875 . . . . 40.48 107.349 -178.102 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 83' ' ' ASN . . . . . 0.421 ' HA ' ' OG ' ' B' ' 17' ' ' SER . 0.5 OUTLIER -113.82 160.3 18.87 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.427 -1.323 . . . . 48.02 107.427 174.688 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 55.2 p 48.49 65.12 1.42 Allowed 'General case' 0 C--O 1.247 0.937 0 CA-C-O 125.088 2.375 . . . . 43.81 114.794 -178.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' LEU . . . . . 0.404 HD11 ' HB3' ' B' ' 18' ' ' LEU . 80.7 mt -61.3 140.3 58.01 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 111.709 -2.496 . . . . 27.1 110.701 -179.652 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 86' ' ' HIS . . . . . . . . . . . . . 12.7 m-70 -121.27 165.45 15.45 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 103.112 -2.922 . . . . 41.33 103.112 178.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 31.2 p -64.91 -28.51 69.58 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 119.4 -0.92 . . . . 28.07 110.49 -177.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 56.8 p-10 -78.41 6.54 8.22 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 114.578 1.325 . . . . 41.4 114.578 -179.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -85.94 2.02 47.76 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 121.621 -0.674 . . . . 16.98 109.887 169.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' THR . . . . . . . . . . . . . 53.5 m -62.02 123.77 19.0 Favored 'General case' 0 C--O 1.238 0.466 0 O-C-N 120.465 -1.397 . . . . 14.64 108.042 175.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -175.26 167.39 3.4 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 108.83 -0.804 . . . . 12.59 108.83 -178.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' ARG . . . . . . . . . . . . . 4.6 ttt85 -90.82 131.37 36.51 Favored 'General case' 0 C--O 1.242 0.658 0 N-CA-C 103.054 -2.943 . . . . 24.1 103.054 168.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -110.63 130.57 55.53 Favored 'General case' 0 CA--C 1.508 -0.641 0 C-N-CA 123.451 0.701 . . . . 12.7 109.675 -177.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -122.12 143.59 49.45 Favored 'General case' 0 C--O 1.248 0.977 0 C-N-CA 123.042 0.537 . . . . 19.97 111.355 -177.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' CYS . . . . . . . . . . . . . 15.1 p -108.43 154.32 22.04 Favored 'General case' 0 C--O 1.249 1.026 0 N-CA-C 106.322 -1.733 . . . . 12.2 106.322 162.867 53.496 169.949 75.465 103.224 2.012 105.322 106.568 174.196 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -151.44 138.2 18.88 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 106.365 -1.717 . . . . 10.38 106.365 -172.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' ARG . . . . . 0.405 ' O ' ' HA ' ' B' ' 103' ' ' LEU . 36.3 ttp180 -77.28 140.36 40.03 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.74 -1.118 . . . . 19.15 110.843 178.096 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 71.7 tt0 -118.46 134.68 54.88 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 120.83 -1.169 . . . . 19.07 110.323 174.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' ARG . . . . . 0.455 HH12 ' NH2' ' B' ' 102' ' ' ARG . 4.8 ptm180 -150.91 135.21 16.92 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 106.279 -1.748 . . . . 52.56 106.279 168.938 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ASP . . . . . 0.422 ' HB2' ' NH1' ' B' ' 102' ' ' ARG . 57.0 m-20 39.86 63.04 1.11 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 116.092 1.886 . . . . 42.52 116.092 179.55 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 101' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 60.05 41.67 16.93 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 117.794 2.516 . . . . 27.38 117.794 174.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' ARG . . . . . 0.455 ' NH2' HH12 ' B' ' 99' ' ' ARG . 0.0 OUTLIER -159.03 154.28 25.48 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 108.221 -1.029 . . . . 34.46 108.221 174.685 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 103' ' ' LEU . . . . . 0.405 ' HA ' ' O ' ' B' ' 97' ' ' ARG . 21.6 mt -107.65 96.55 6.48 Favored 'General case' 0 CA--C 1.502 -0.881 1 N-CA-C 98.385 -4.672 . . . . 13.45 98.385 177.168 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ASP . . . . . . . . . . . . . 51.0 p-10 -88.59 -26.84 21.72 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 116.244 1.942 . . . . 18.86 116.244 -172.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -129.24 135.78 49.24 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 121.095 1.77 . . . . 28.97 107.138 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' TRP . . . . . . . . . . . . . 36.7 m95 -125.19 146.45 49.5 Favored 'General case' 0 C--O 1.242 0.674 0 O-C-N 124.003 0.815 . . . . 15.06 108.916 -175.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -75.07 176.33 49.69 Favored Glycine 0 CA--C 1.534 1.224 0 N-CA-C 109.009 -1.637 . . . . 15.89 109.009 169.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' GLN . . . . . . . . . . . . . 6.1 pm0 -77.38 -15.31 59.44 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 120.338 -1.684 . . . . 25.05 113.011 179.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . 92.04 158.97 34.96 Favored Glycine 0 C--N 1.339 0.719 0 C-N-CA 124.988 1.28 . . . . 14.3 113.519 -179.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 10.3 t -131.02 140.77 50.16 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 104.136 -2.542 . . . . 13.58 104.136 173.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 92.4 m -90.07 126.23 35.7 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 120.359 -0.536 . . . . 22.44 111.535 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 43.2 tp -108.6 128.08 54.51 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 106.086 -1.82 . . . . 18.64 106.086 175.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' THR . . . . . . . . . . . . . 62.8 m -125.32 121.85 35.16 Favored 'General case' 0 C--O 1.245 0.858 0 N-CA-C 103.508 -2.775 . . . . 15.86 103.508 179.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 98.0 t -99.01 111.58 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 N-CA-C 104.729 -2.323 . . . . 19.3 104.729 179.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' SER . . . . . 0.494 ' HB3' HD11 ' B' ' 11' ' ' LEU . 8.2 t -148.66 131.27 15.87 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.407 -1.331 . . . . 34.86 107.407 -177.465 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 28.0 p . . . . . 0 C--O 1.238 0.47 0 CA-C-N 110.335 -3.121 . . . . 49.13 117.595 179.673 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 731' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 733' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 736' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 742' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 743' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 746' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 764' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 801' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 855' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 887' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 738' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 748' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 749' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 765' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 767' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 785' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 800' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 830' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 872' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 878' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 889' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 898' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 908' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 . . . . . 0 CA--C 1.511 -0.524 0 N-CA-C 100.481 -3.896 . . . . 44.82 100.481 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 39.1 mt -89.27 132.27 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 N-CA-C 106.451 -1.685 . . . . 24.52 106.451 -179.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.3 t -108.39 140.68 26.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 106.447 -1.686 . . . . 19.92 106.447 -179.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 57.1 mt -108.22 125.65 51.89 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.399 -0.819 . . . . 14.22 108.797 178.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 86.3 m -113.14 124.3 52.25 Favored 'General case' 0 N--CA 1.438 -1.041 0 O-C-N 121.146 -0.971 . . . . 21.61 108.56 178.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -103.16 140.75 36.93 Favored 'General case' 0 N--CA 1.438 -1.065 0 O-C-N 120.595 -1.315 . . . . 15.99 112.096 -179.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.6 m -137.45 145.6 50.07 Favored Pre-proline 0 C--N 1.317 -0.833 0 N-CA-C 106.273 -1.751 . . . . 29.81 106.273 176.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -72.46 165.39 83.22 Favored 'Cis proline' 0 CA--C 1.511 -0.658 0 CA-C-N 121.302 1.501 . . . . 20.02 111.21 -9.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.61 -31.17 61.94 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 121.47 1.941 . . . . 19.81 107.53 175.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.5 t -143.47 142.83 31.33 Favored 'General case' 0 C--N 1.348 0.507 0 N-CA-C 107.966 -1.124 . . . . 32.97 107.966 -178.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 69.0 tp -143.25 125.83 15.88 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 107.8 -1.185 . . . . 31.58 107.8 -177.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 m -97.08 137.65 35.83 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 105.023 -2.214 . . . . 34.77 105.023 174.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -155.38 153.85 31.07 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 120.078 -1.639 . . . . 22.67 108.918 -178.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.6 m -95.73 155.3 16.81 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-O 122.956 1.36 . . . . 28.06 108.799 -178.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 55.7 t -57.06 136.07 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.924 0 CA-C-N 112.793 -2.003 . . . . 22.51 106.03 173.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.65 -15.49 63.04 Favored Glycine 0 N--CA 1.432 -1.571 0 CA-C-O 116.55 -2.25 . . . . 21.8 112.294 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 67.7 mt-10 -79.8 156.16 27.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 121.973 2.887 . . . . 43.71 114.573 177.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 18.3 m -105.01 129.38 53.46 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 106.338 -1.727 . . . . 24.75 106.338 176.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 27.1 m -128.34 157.28 40.78 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.459 0 N-CA-C 109.063 -0.717 . . . . 24.53 109.063 -178.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 91.7 m -134.13 134.98 42.84 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 104.109 -2.552 . . . . 25.05 104.109 176.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 8.0 pt -123.14 145.25 30.34 Favored 'Isoleucine or valine' 0 C--O 1.245 0.839 0 N-CA-C 106.932 -1.507 . . . . 24.28 106.932 176.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 72.4 p -118.25 159.9 22.53 Favored 'General case' 0 CA--C 1.502 -0.881 0 O-C-N 120.069 -1.645 . . . . 19.59 111.274 -173.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 38.5 t -138.48 118.17 13.11 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 103.701 -2.703 . . . . 15.35 103.701 -179.039 174.986 117.707 77.807 105.337 2.009 103.553 161.003 54.953 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.522 HH11 HE21 ' A' ' 70' ' ' GLN . 11.7 mtm-85 -111.66 134.88 52.94 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.529 -0.76 . . . . 53.22 111.272 179.728 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -99.87 148.4 24.49 Favored 'General case' 0 C--O 1.242 0.677 0 C-N-CA 123.562 0.745 . . . . 16.93 111.505 -179.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.3 p -83.78 6.27 21.88 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.668 0.988 . . . . 15.49 113.668 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -164.38 156.21 28.0 Favored Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 105.019 -3.232 . . . . 13.69 105.019 -177.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -65.8 129.19 38.93 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 119.95 1.875 . . . . 14.99 110.238 -175.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 24.9 pt -110.48 7.11 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 O-C-N 120.933 -1.104 . . . . 13.88 110.823 179.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 53.89 46.19 26.2 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 121.091 -1.006 . . . . 19.14 113.606 168.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 24.4 m120 64.12 7.25 3.31 Favored 'General case' 0 C--O 1.242 0.7 0 N-CA-C 118.505 2.78 . . . . 14.98 118.505 178.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -84.21 75.07 10.23 Favored 'General case' 0 C--O 1.241 0.654 0 O-C-N 121.245 -0.909 . . . . 22.11 108.661 177.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.0 tp -134.82 132.52 38.75 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.655 -0.702 . . . . 14.54 109.734 -175.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -119.98 154.56 34.33 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 123.709 0.804 . . . . 12.05 108.949 178.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -120.27 140.73 50.79 Favored 'General case' 0 C--O 1.245 0.85 0 C-N-CA 124.339 1.055 . . . . 12.6 108.486 177.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -127.96 149.05 50.51 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 107.487 -1.301 . . . . 13.0 107.487 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -111.3 139.02 47.05 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 105.703 -1.962 . . . . 25.34 105.703 171.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -127.7 119.52 25.99 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 106.476 -1.676 . . . . 16.33 106.476 178.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.3 mmmm -92.35 160.92 14.89 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 106.68 -1.6 . . . . 38.58 106.68 177.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 53.9 tp60 -48.97 123.05 6.48 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 114.236 1.198 . . . . 42.64 114.236 -177.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 69.06 8.85 59.04 Favored Glycine 0 CA--C 1.534 1.238 0 CA-C-O 117.689 -1.617 . . . . 36.9 115.789 -178.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.9 mmtm -114.5 162.67 16.39 Favored 'General case' 0 C--O 1.248 0.981 0 CA-C-N 123.101 3.45 . . . . 40.95 107.623 -178.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 83.7 p -75.93 159.78 80.07 Favored Pre-proline 0 C--O 1.25 1.101 0 N-CA-C 108.328 -0.99 . . . . 24.94 108.328 174.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -59.57 150.51 75.65 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 122.993 2.462 . . . . 16.63 111.949 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -127.05 135.11 50.34 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 105.007 -2.22 . . . . 43.85 105.007 177.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 34.8 tp -65.03 133.26 51.28 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.026 -1.443 . . . . 13.71 110.536 176.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -111.97 -51.99 2.81 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 113.316 -1.766 . . . . 19.82 112.01 177.867 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 98.0 t -142.73 139.24 28.27 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.815 0 N-CA-C 105.606 -1.998 . . . . 14.7 105.606 -167.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 39.2 p90 -138.26 166.49 24.05 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 119.899 1.227 . . . . 24.1 108.918 172.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 15.1 t80 37.87 57.48 1.51 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 124.809 2.242 . . . . 21.97 111.843 -166.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 41.3 m 65.15 -51.67 0.34 Allowed 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 117.373 2.36 . . . . 11.52 117.373 179.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 71.9 p -119.96 -12.22 9.19 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 116.806 2.151 . . . . 11.98 116.806 -171.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 28.3 m -84.0 123.56 30.12 Favored 'General case' 0 C--O 1.238 0.467 0 O-C-N 119.832 -1.793 . . . . 16.95 112.068 -173.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 23.7 mt -78.28 141.86 38.21 Favored 'General case' 0 C--O 1.242 0.684 0 O-C-N 121.692 -0.63 . . . . 20.83 109.952 177.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.99 165.8 24.32 Favored 'General case' 0 C--O 1.248 1.013 0 O-C-N 121.0 -1.062 . . . . 24.96 108.483 175.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -58.42 135.94 57.35 Favored 'General case' 0 CA--C 1.505 -0.784 0 O-C-N 120.43 -1.419 . . . . 51.87 110.408 -178.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.8 7.94 81.32 Favored Glycine 0 N--CA 1.442 -0.966 0 CA-C-O 116.335 -2.37 . . . . 32.18 114.055 177.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 58.3 t -83.64 133.73 46.11 Favored Pre-proline 0 C--O 1.237 0.43 0 CA-C-N 123.626 3.713 . . . . 26.08 104.836 175.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -65.67 149.56 87.09 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.566 2.178 . . . . 27.71 111.938 178.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.3 p -62.93 -13.53 35.68 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 113.606 -1.634 . . . . 35.74 114.176 -177.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 32.3 ptt-85 -68.91 -9.97 54.66 Favored 'General case' 0 N--CA 1.451 -0.381 0 O-C-N 119.902 -1.749 . . . . 30.05 114.895 176.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -91.91 135.88 33.59 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 118.001 -0.999 . . . . 18.29 109.605 173.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 95.2 p -147.75 142.48 26.7 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-N 121.147 1.794 . . . . 21.1 110.556 167.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -112.89 153.8 17.31 Favored Glycine 0 C--O 1.246 0.848 0 N-CA-C 107.242 -2.343 . . . . 11.95 107.242 -178.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 80.2 p -147.95 170.35 17.9 Favored 'General case' 0 C--O 1.248 0.993 0 N-CA-C 109.008 -0.738 . . . . 15.8 109.008 175.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 142.8 169.8 12.51 Favored Glycine 0 N--CA 1.44 -1.043 0 CA-C-O 122.902 1.279 . . . . 11.29 111.109 175.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 16.5 p -168.12 164.42 13.45 Favored 'General case' 0 C--O 1.247 0.962 0 N-CA-C 106.585 -1.635 . . . . 16.44 106.585 172.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 61.92 -114.79 7.12 Favored Glycine 0 CA--C 1.523 0.563 0 C-N-CA 120.698 -0.763 . . . . 12.46 112.753 178.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 27.6 p -110.13 5.93 22.39 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-O 117.678 -1.153 . . . . 14.65 112.134 -178.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.522 HE21 HH11 ' A' ' 24' ' ' ARG . 0.0 OUTLIER -128.84 122.03 29.53 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 122.085 2.221 . . . . 40.49 110.304 -171.129 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -137.7 151.1 47.88 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 107.317 -1.364 . . . . 14.17 107.317 -174.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 2.5 m -140.73 148.25 40.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 120.194 1.361 . . . . 23.92 109.119 -178.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 43.4 tp -118.97 123.91 45.73 Favored 'General case' 0 C--O 1.251 1.161 0 N-CA-C 102.984 -2.969 . . . . 16.19 102.984 172.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 6.7 ttpm? -109.8 132.7 53.91 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.115 -1.439 . . . . 36.71 107.115 178.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 27.6 mt -118.76 113.88 43.09 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 N-CA-C 106.162 -1.792 . . . . 16.51 106.162 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -82.68 129.77 35.01 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 117.628 -1.177 . . . . 39.56 112.837 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 60.2 m 46.91 68.42 0.63 Allowed 'General case' 0 C--O 1.242 0.706 0 N-CA-C 117.716 2.487 . . . . 35.42 117.716 178.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 37.9 mt -42.47 126.08 3.42 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 115.821 1.786 . . . . 26.45 115.821 176.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -102.57 160.19 27.03 Favored Pre-proline 0 C--O 1.243 0.747 0 N-CA-C 108.004 -1.11 . . . . 22.26 108.004 173.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -55.3 -35.62 91.85 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 124.661 3.574 . . . . 23.11 113.632 -173.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 19.9 pm0 -70.63 -5.61 30.7 Favored 'General case' 0 N--CA 1.437 -1.092 0 N-CA-C 113.587 0.958 . . . . 40.82 113.587 -178.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 70.6 m-20 -91.5 -10.91 39.04 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 119.457 1.026 . . . . 18.55 112.975 -179.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -73.04 148.4 44.15 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 122.07 2.214 . . . . 26.95 108.792 -177.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 145.75 -164.46 28.15 Favored Glycine 0 N--CA 1.437 -1.286 0 N-CA-C 107.326 -2.31 . . . . 16.31 107.326 -176.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 55.0 m -105.04 144.72 31.45 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 118.856 1.328 . . . . 21.54 111.765 -178.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -120.93 133.22 55.28 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 107.63 -1.248 . . . . 15.77 107.63 -178.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -126.76 136.19 52.08 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 123.37 0.668 . . . . 17.48 110.093 -178.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' CYS . . . . . . . . . . . . . 20.2 p -101.07 155.55 17.93 Favored 'General case' 0 C--N 1.318 -0.804 0 O-C-N 120.461 -1.399 . . . . 12.21 108.022 169.249 54.953 161.003 77.807 103.553 2.009 105.337 117.707 174.986 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -145.09 140.33 27.97 Favored 'General case' 0 N--CA 1.436 -1.144 0 O-C-N 120.181 -1.575 . . . . 18.71 107.056 -178.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.749 ' HD2' ' H ' ' A' ' 92' ' ' TRP . 14.7 p-80 -105.34 162.64 13.26 Favored 'General case' 0 C--O 1.256 1.437 0 C-N-CA 117.954 -1.499 . . . . 15.07 108.425 178.815 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -130.08 27.95 5.08 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-O 122.729 1.252 . . . . 15.7 109.664 178.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.749 ' H ' ' HD2' ' A' ' 90' ' ' HIS . 74.7 t-105 -85.48 108.77 18.06 Favored 'General case' 0 C--O 1.238 0.488 0 O-C-N 118.755 -2.466 . . . . 17.52 107.735 178.254 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 47.9 t 57.4 -148.9 0.48 Allowed 'General case' 0 C--O 1.238 0.499 0 C-N-CA 124.32 1.048 . . . . 19.68 108.197 177.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 15.0 p -137.3 155.25 75.83 Favored Pre-proline 0 CA--C 1.548 0.895 0 CA-C-N 120.348 1.431 . . . . 27.93 109.134 173.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -72.29 157.32 97.9 Favored 'Cis proline' 0 N--CA 1.456 -0.711 0 O-C-N 116.511 -2.415 . . . . 22.65 113.421 -1.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -88.3 157.62 18.69 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 103.952 -2.61 . . . . 23.36 103.952 173.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 43.8 p -145.1 163.6 33.82 Favored 'General case' 0 C--O 1.245 0.856 0 N-CA-C 104.69 -2.337 . . . . 18.59 104.69 177.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -112.64 151.63 29.91 Favored 'General case' 0 C--O 1.258 1.513 0 O-C-N 125.801 1.938 . . . . 12.78 108.066 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -71.47 171.51 46.69 Favored Glycine 0 CA--C 1.536 1.373 0 N-CA-C 107.549 -2.22 . . . . 10.74 107.549 170.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -77.31 -7.08 86.9 Favored Glycine 0 CA--C 1.539 1.543 0 O-C-N 118.776 -2.602 . . . . 15.66 114.827 -177.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 97.5 149.06 24.83 Favored Glycine 0 N--CA 1.441 -0.977 0 CA-C-N 119.982 1.891 . . . . 12.65 113.791 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 53.3 m -125.36 124.62 41.92 Favored 'General case' 0 N--CA 1.429 -1.514 0 N-CA-C 104.3 -2.481 . . . . 16.19 104.3 173.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -96.26 117.65 31.21 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 123.1 1.429 . . . . 41.67 108.346 175.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 31.7 tp -99.25 115.27 28.75 Favored 'General case' 0 C--N 1.307 -1.271 0 N-CA-C 105.196 -2.149 . . . . 27.44 105.196 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -120.38 142.3 49.3 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 125.695 1.598 . . . . 49.02 112.149 -179.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 14.8 tt -71.67 142.21 15.7 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 CA-C-O 122.755 1.264 . . . . 43.28 110.725 -175.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 2.8 tptp -71.59 141.92 50.02 Favored 'General case' 0 CA--C 1.501 -0.909 0 CA-C-N 112.658 -2.065 . . . . 63.55 111.959 -175.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 13.4 tpt85 . . . . . 0 N--CA 1.447 -0.597 1 O-C-N 129.207 4.067 . . . . 77.99 101.222 172.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.445 -0.7 0 CA-C-O 126.844 3.211 . . . . 33.42 108.35 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 54.3 t -101.78 134.19 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.695 1 CA-C-N 106.858 -4.701 . . . . 21.03 102.204 179.38 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -130.14 137.89 50.37 Favored 'General case' 0 C--N 1.307 -1.256 0 C-N-CA 123.277 0.631 . . . . 27.59 109.681 174.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 5.5 mp -133.07 125.23 29.16 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 104.907 -2.257 . . . . 14.37 104.907 170.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -133.29 130.1 38.48 Favored 'General case' 0 C--O 1.244 0.783 0 O-C-N 120.607 -1.308 . . . . 16.55 108.824 179.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 33.8 mp0 -103.04 149.15 24.86 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 106.85 -1.537 . . . . 15.03 106.85 -173.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' SER . . . . . . . . . . . . . 11.1 p -141.42 145.86 35.83 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 106.189 -1.782 . . . . 21.24 106.189 171.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . -151.16 -179.66 27.07 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 109.221 -1.552 . . . . 16.58 109.221 -176.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -82.35 -8.1 11.74 Favored 'Trans proline' 0 C--N 1.333 -0.281 0 C-N-CA 122.687 2.258 . . . . 19.23 115.471 -172.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.63 -110.12 3.12 Favored Glycine 0 C--N 1.335 0.482 0 CA-C-N 120.021 1.282 . . . . 18.86 111.404 178.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.494 HD11 ' HB3' ' B' ' 115' ' ' SER . 43.2 tp -93.41 129.41 39.57 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 107.733 -1.21 . . . . 22.04 107.733 -178.82 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 22.7 m -136.88 156.71 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 108.276 -1.009 . . . . 21.69 108.276 179.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.8 149.17 53.15 Favored Pre-proline 0 N--CA 1.443 -0.787 0 O-C-N 120.611 -1.305 . . . . 22.31 107.949 178.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -55.41 159.67 10.22 Favored 'Trans proline' 0 CA--C 1.51 -0.679 0 C-N-CA 123.166 2.577 . . . . 27.47 113.524 171.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' SER . . . . . . . . . . . . . 67.5 m 68.72 -6.22 0.88 Allowed 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 112.708 -2.042 . . . . 36.34 112.842 -177.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 87.9 mm-40 -77.13 169.62 18.0 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.233 -1.766 . . . . 41.24 106.233 172.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' SER . . . . . 0.421 ' OG ' ' HA ' ' B' ' 83' ' ' ASN . 75.7 m -117.83 153.44 33.49 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 104.919 -2.252 . . . . 43.35 104.919 176.511 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' LEU . . . . . 0.627 HD23 ' HB2' ' B' ' 82' ' ' MET . 0.0 OUTLIER -135.43 159.78 40.51 Favored 'General case' 0 N--CA 1.429 -1.504 0 CA-C-N 114.247 -1.342 . . . . 37.11 110.062 -169.068 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' SER . . . . . . . . . . . . . 33.7 t -131.56 137.11 48.32 Favored 'General case' 0 N--CA 1.429 -1.52 0 N-CA-C 105.854 -1.906 . . . . 33.29 105.854 166.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 92.2 mt -115.23 132.27 65.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 104.964 -2.236 . . . . 21.42 104.964 173.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' THR . . . . . . . . . . . . . 23.9 m -101.17 133.46 45.68 Favored 'General case' 0 CA--C 1.503 -0.843 0 C-N-CA 125.448 1.499 . . . . 19.71 112.537 176.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 36.3 t -109.06 111.45 23.1 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 105.18 -2.156 . . . . 12.34 105.18 168.759 174.196 106.568 75.465 105.322 2.012 103.224 169.949 53.496 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 48.0 m -97.59 127.15 43.32 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 106.535 -1.654 . . . . 15.54 106.535 177.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 14.3 m -112.65 155.57 13.86 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.72 0 C-N-CA 120.07 -0.652 . . . . 14.66 109.399 -176.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 22.6 m -144.0 145.39 32.19 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 124.238 0.961 . . . . 21.13 110.07 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' GLY . . . . . . . . . . . . . . . 94.85 -4.84 68.79 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 119.256 -1.449 . . . . 19.77 114.241 173.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' PHE . . . . . . . . . . . . . 42.1 p90 -156.19 159.05 38.62 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-N 120.693 2.247 . . . . 18.58 106.833 178.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 41.8 t -88.38 137.04 32.68 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 114.556 -1.202 . . . . 28.01 113.323 -177.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 17.6 mt -71.92 -9.59 58.56 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 119.362 -0.935 . . . . 19.21 112.873 178.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 74.0 p -85.02 -13.17 51.37 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 119.72 -1.863 . . . . 22.87 110.798 175.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . -102.11 -6.15 48.89 Favored Glycine 0 C--O 1.243 0.661 0 O-C-N 120.09 -1.631 . . . . 19.57 116.261 -176.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -143.1 160.27 40.72 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 120.607 -1.525 . . . . 29.52 108.215 -174.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.69 156.31 20.19 Favored Glycine 0 C--O 1.245 0.783 0 N-CA-C 107.887 -2.085 . . . . 13.98 107.887 175.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 64.9 t -124.52 129.62 73.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 106.04 -1.837 . . . . 12.29 106.04 175.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -107.73 149.66 27.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.621 -1.172 . . . . 14.6 108.406 -177.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' TRP . . . . . . . . . . . . . 76.4 m95 -110.97 134.24 52.75 Favored 'General case' 0 C--O 1.244 0.812 0 N-CA-C 106.648 -1.612 . . . . 14.34 106.648 174.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 87.4 t -136.27 141.66 40.78 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.483 0 N-CA-C 105.661 -1.977 . . . . 13.68 105.661 -175.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ARG . . . . . . . . . . . . . 35.3 ptt180 -129.46 160.74 32.22 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 121.719 2.054 . . . . 13.87 109.358 173.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -137.53 106.03 8.42 Favored Pre-proline 0 C--O 1.245 0.826 0 O-C-N 120.398 -1.439 . . . . 14.54 107.206 -179.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -55.91 149.69 50.36 Favored 'Trans proline' 0 C--O 1.243 0.769 0 C-N-CA 124.242 3.295 . . . . 14.25 109.165 171.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -49.32 123.12 9.68 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 124.092 3.195 . . . . 17.54 112.085 178.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 66.92 14.17 62.83 Favored Glycine 0 N--CA 1.439 -1.155 0 CA-C-O 116.851 -2.083 . . . . 21.69 113.141 177.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 28.7 mmtm -117.42 -175.6 2.84 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-N 121.66 2.73 . . . . 42.06 109.013 179.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . -88.43 -177.38 47.11 Favored Glycine 0 CA--C 1.525 0.699 0 O-C-N 120.005 -1.684 . . . . 14.57 112.829 -176.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' LEU . . . . . . . . . . . . . 45.9 mt -82.14 139.68 34.22 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 114.577 -0.812 . . . . 12.76 109.266 -178.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 77.0 tt0 -122.08 120.82 35.43 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 107.408 -1.33 . . . . 30.11 107.408 179.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' TRP . . . . . . . . . . . . . 78.7 t90 -73.41 130.32 39.89 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 119.082 -2.261 . . . . 14.84 109.439 178.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 97.6 mt -101.12 -40.89 6.97 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 113.079 0.77 . . . . 14.12 113.079 -178.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 166.15 -172.74 41.58 Favored Glycine 0 C--O 1.249 1.065 0 N-CA-C 110.807 -0.917 . . . . 12.54 110.807 179.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' MET . . . . . . . . . . . . . 27.6 ptm -157.42 156.36 32.07 Favored 'General case' 0 CA--C 1.508 -0.65 0 O-C-N 124.604 0.826 . . . . 21.78 110.517 -177.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 tt -121.49 124.89 72.78 Favored 'Isoleucine or valine' 0 C--O 1.244 0.764 0 N-CA-C 104.423 -2.436 . . . . 13.59 104.423 172.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' TRP . . . . . . . . . . . . . 75.5 m95 -74.8 166.14 24.1 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 121.716 -0.615 . . . . 17.95 111.807 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -59.45 -31.32 70.03 Favored Glycine 0 C--N 1.337 0.598 0 N-CA-C 110.106 -1.198 . . . . 16.85 110.106 -179.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 59.4 p30 -85.99 4.21 38.77 Favored 'General case' 0 CA--C 1.513 -0.472 0 O-C-N 119.409 -2.23 . . . . 25.0 114.026 178.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 98.07 -9.53 63.51 Favored Glycine 0 N--CA 1.443 -0.868 0 O-C-N 119.832 -1.793 . . . . 16.99 113.055 173.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -69.52 148.91 48.83 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 119.613 1.707 . . . . 34.09 110.358 178.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' THR . . . . . . . . . . . . . 22.3 p -124.52 158.58 32.58 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 120.73 1.605 . . . . 19.49 110.417 179.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -144.36 147.16 33.08 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 103.867 -2.642 . . . . 22.77 103.867 175.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -131.06 158.5 40.19 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 124.083 1.897 . . . . 19.92 114.661 -175.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -61.45 126.05 25.98 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 104.48 -2.415 . . . . 25.09 104.48 169.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.26 -48.64 68.11 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 124.133 0.973 . . . . 38.19 112.644 -177.946 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.5 -34.01 76.01 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 114.568 1.322 . . . . 33.75 114.568 -176.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 28.2 mt -105.02 -9.53 17.81 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 115.426 1.639 . . . . 30.43 115.426 -175.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 49.9 tttp -37.85 -39.26 0.35 Allowed 'General case' 0 C--O 1.233 0.235 0 N-CA-C 117.902 2.556 . . . . 49.69 117.902 -177.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 13.7 p -71.83 -30.35 65.38 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 115.91 1.818 . . . . 40.82 115.91 -179.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ARG . . . . . . . . . . . . . 37.6 mtp180 -94.74 -5.55 45.11 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 119.647 -1.908 . . . . 30.29 112.519 -178.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.485 HD12 ' HG2' ' B' ' 82' ' ' MET . 2.1 mp -112.23 149.09 32.79 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 113.697 0.999 . . . . 33.01 113.697 -172.744 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' SER . . . . . . . . . . . . . 37.5 t -147.67 129.43 15.18 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 107.632 -1.247 . . . . 28.82 107.632 174.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' ILE . . . . . . . . . . . . . 67.9 mt -118.87 135.01 60.64 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.629 0 O-C-N 119.188 -2.195 . . . . 15.49 106.43 178.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' SER . . . . . . . . . . . . . 85.7 p -147.01 176.57 9.82 Favored 'General case' 0 C--N 1.323 -0.585 0 O-C-N 119.999 -1.688 . . . . 17.87 107.895 176.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 46.9 pttt -151.16 163.35 39.02 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 119.688 -1.883 . . . . 15.28 106.503 -178.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -124.77 102.61 7.66 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 101.274 -3.602 . . . . 22.98 101.274 177.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -61.99 -37.62 85.49 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 119.459 -0.305 . . . . 27.1 110.827 -176.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 28.2 t -66.38 -37.63 85.72 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 115.194 1.553 . . . . 27.28 115.194 -179.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -91.41 -1.12 57.68 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 120.085 -1.635 . . . . 39.05 111.069 179.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' SER . . . . . . . . . . . . . 44.3 m 58.39 44.43 18.3 Favored 'General case' 0 C--O 1.244 0.796 0 CA-C-N 119.877 1.217 . . . . 20.5 112.187 -178.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -129.68 144.69 51.4 Favored 'General case' 0 C--O 1.253 1.25 0 C-N-CA 119.965 -0.694 . . . . 26.86 109.644 179.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' VAL . . . . . . . . . . . . . 94.5 t -120.78 138.79 50.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 102.937 -2.986 . . . . 11.91 102.937 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -117.51 146.98 43.18 Favored 'General case' 0 CA--C 1.498 -1.035 0 CA-C-N 121.03 1.741 . . . . 17.18 111.174 -177.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 27.3 tp -120.52 125.0 46.73 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 102.556 -3.127 . . . . 16.03 102.556 171.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 18.6 mtmm -122.64 138.09 54.7 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-O 123.697 1.713 . . . . 38.94 106.539 -179.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' MET . . . . . 0.627 ' HB2' HD23 ' B' ' 18' ' ' LEU . 93.4 mtp -133.03 136.79 46.19 Favored 'General case' 0 CA--C 1.495 -1.143 0 CA-C-N 113.075 -1.875 . . . . 40.48 107.349 -178.102 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' ASN . . . . . 0.421 ' HA ' ' OG ' ' B' ' 17' ' ' SER . 0.5 OUTLIER -113.82 160.3 18.87 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.427 -1.323 . . . . 48.02 107.427 174.688 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' SER . . . . . . . . . . . . . 55.2 p 48.49 65.12 1.42 Allowed 'General case' 0 C--O 1.247 0.937 0 CA-C-O 125.088 2.375 . . . . 43.81 114.794 -178.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.404 HD11 ' HB3' ' B' ' 18' ' ' LEU . 80.7 mt -61.3 140.3 58.01 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 111.709 -2.496 . . . . 27.1 110.701 -179.652 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' HIS . . . . . . . . . . . . . 12.7 m-70 -121.27 165.45 15.45 Favored 'General case' 0 CA--C 1.502 -0.892 0 N-CA-C 103.112 -2.922 . . . . 41.33 103.112 178.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 31.2 p -64.91 -28.51 69.58 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 119.4 -0.92 . . . . 28.07 110.49 -177.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ASP . . . . . . . . . . . . . 56.8 p-10 -78.41 6.54 8.22 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 114.578 1.325 . . . . 41.4 114.578 -179.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -85.94 2.02 47.76 Favored 'General case' 0 N--CA 1.449 -0.508 0 O-C-N 121.621 -0.674 . . . . 16.98 109.887 169.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' THR . . . . . . . . . . . . . 53.5 m -62.02 123.77 19.0 Favored 'General case' 0 C--O 1.238 0.466 0 O-C-N 120.465 -1.397 . . . . 14.64 108.042 175.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -175.26 167.39 3.4 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 108.83 -0.804 . . . . 12.59 108.83 -178.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' ARG . . . . . . . . . . . . . 4.6 ttt85 -90.82 131.37 36.51 Favored 'General case' 0 C--O 1.242 0.658 0 N-CA-C 103.054 -2.943 . . . . 24.1 103.054 168.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -110.63 130.57 55.53 Favored 'General case' 0 CA--C 1.508 -0.641 0 C-N-CA 123.451 0.701 . . . . 12.7 109.675 -177.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -122.12 143.59 49.45 Favored 'General case' 0 C--O 1.248 0.977 0 C-N-CA 123.042 0.537 . . . . 19.97 111.355 -177.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' CYS . . . . . . . . . . . . . 15.1 p -108.43 154.32 22.04 Favored 'General case' 0 C--O 1.249 1.026 0 N-CA-C 106.322 -1.733 . . . . 12.2 106.322 162.867 53.496 169.949 75.465 103.224 2.012 105.322 106.568 174.196 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -151.44 138.2 18.88 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 106.365 -1.717 . . . . 10.38 106.365 -172.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' ARG . . . . . 0.405 ' O ' ' HA ' ' B' ' 103' ' ' LEU . 36.3 ttp180 -77.28 140.36 40.03 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.74 -1.118 . . . . 19.15 110.843 178.096 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 71.7 tt0 -118.46 134.68 54.88 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 120.83 -1.169 . . . . 19.07 110.323 174.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' ARG . . . . . 0.455 HH12 ' NH2' ' B' ' 102' ' ' ARG . 4.8 ptm180 -150.91 135.21 16.92 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 106.279 -1.748 . . . . 52.56 106.279 168.938 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ASP . . . . . 0.422 ' HB2' ' NH1' ' B' ' 102' ' ' ARG . 57.0 m-20 39.86 63.04 1.11 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 116.092 1.886 . . . . 42.52 116.092 179.55 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 60.05 41.67 16.93 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 117.794 2.516 . . . . 27.38 117.794 174.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' ARG . . . . . 0.455 ' NH2' HH12 ' B' ' 99' ' ' ARG . 0.0 OUTLIER -159.03 154.28 25.48 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 108.221 -1.029 . . . . 34.46 108.221 174.685 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' LEU . . . . . 0.405 ' HA ' ' O ' ' B' ' 97' ' ' ARG . 21.6 mt -107.65 96.55 6.48 Favored 'General case' 0 CA--C 1.502 -0.881 1 N-CA-C 98.385 -4.672 . . . . 13.45 98.385 177.168 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ASP . . . . . . . . . . . . . 51.0 p-10 -88.59 -26.84 21.72 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 116.244 1.942 . . . . 18.86 116.244 -172.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 45.5 m-85 -129.24 135.78 49.24 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 121.095 1.77 . . . . 28.97 107.138 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' TRP . . . . . . . . . . . . . 36.7 m95 -125.19 146.45 49.5 Favored 'General case' 0 C--O 1.242 0.674 0 O-C-N 124.003 0.815 . . . . 15.06 108.916 -175.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -75.07 176.33 49.69 Favored Glycine 0 CA--C 1.534 1.224 0 N-CA-C 109.009 -1.637 . . . . 15.89 109.009 169.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.38 -15.31 59.44 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 120.338 -1.684 . . . . 25.05 113.011 179.328 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' GLY . . . . . . . . . . . . . . . 92.04 158.97 34.96 Favored Glycine 0 C--N 1.339 0.719 0 C-N-CA 124.988 1.28 . . . . 14.3 113.519 -179.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' THR . . . . . . . . . . . . . 10.3 t -131.02 140.77 50.16 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 104.136 -2.542 . . . . 13.58 104.136 173.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 92.4 m -90.07 126.23 35.7 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 120.359 -0.536 . . . . 22.44 111.535 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 43.2 tp -108.6 128.08 54.51 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 106.086 -1.82 . . . . 18.64 106.086 175.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' THR . . . . . . . . . . . . . 62.8 m -125.32 121.85 35.16 Favored 'General case' 0 C--O 1.245 0.858 0 N-CA-C 103.508 -2.775 . . . . 15.86 103.508 179.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' VAL . . . . . . . . . . . . . 98.0 t -99.01 111.58 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 N-CA-C 104.729 -2.323 . . . . 19.3 104.729 179.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' SER . . . . . 0.494 ' HB3' HD11 ' B' ' 11' ' ' LEU . 8.2 t -148.66 131.27 15.87 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.407 -1.331 . . . . 34.86 107.407 -177.465 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' SER . . . . . . . . . . . . . 28.0 p . . . . . 0 C--O 1.238 0.47 0 CA-C-N 110.335 -3.121 . . . . 49.13 117.595 179.673 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 731' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 733' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 736' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 742' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 743' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 746' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 764' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 801' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 855' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 887' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 738' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 748' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 749' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 765' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 767' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 785' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 800' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 830' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 872' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 878' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 889' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 898' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 908' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_