data_1dcf_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 1dcf _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' ' ' HIS . . . . . . . . . . . . . 17.5 t-160 . . . . . 0 N--CA 1.494 1.726 0 N-CA-C 109.281 -0.637 . . . . 100.0 109.281 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.1 ttt -146.5 112.36 5.69 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 106.428 -1.693 . . . . 88.53 106.428 -179.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 67.9 m -90.74 -28.96 17.94 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 118.828 2.899 . . . . 84.42 118.828 -177.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -132.83 145.91 51.37 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 119.739 -0.785 . . . . 84.3 110.821 178.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -121.53 39.99 3.71 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.229 -0.896 . . . . 68.75 109.027 -178.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 28.7 m -44.91 119.93 2.16 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 114.881 -1.054 . . . . 63.06 112.151 -179.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.91 -2.85 76.74 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 114.74 0.656 . . . . 60.09 114.74 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 29.9 tp -63.69 120.08 11.14 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.215 0.531 . . . . 56.09 112.215 -179.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -83.09 102.66 11.96 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.739 -0.664 . . . . 69.31 109.507 -179.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.5 m -125.79 156.04 35.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 N-CA-C 113.789 1.033 . . . . 50.3 113.789 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 50.1 tp -123.57 141.6 51.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.516 -0.766 . . . . 46.11 109.899 179.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 94.4 t -119.93 126.2 75.05 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-N 115.998 -0.546 . . . . 43.61 109.96 179.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 3.5 tmm? -118.26 112.53 20.2 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 107.675 -1.232 . . . . 57.21 107.675 -179.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -154.81 129.85 9.51 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.882 -0.784 . . . . 55.57 108.882 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . . . -68.91 -26.27 65.01 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.171 -0.212 . . . . 55.62 111.43 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASN . . . . . 0.593 ' ND2' ' C ' ' A' ' 16' ' ' ASN . 0.2 OUTLIER -86.3 126.6 34.43 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 112.458 0.54 . . . . 64.56 112.458 -179.794 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLY . . . . . 0.593 ' N ' ' ND2' ' A' ' 16' ' ' ASN . . . -64.25 -44.8 95.03 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 115.271 0.869 . . . . 50.47 115.271 -179.126 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' VAL . . . . . 0.42 ' N ' ' ND2' ' A' ' 16' ' ' ASN . 56.4 t -64.85 -48.34 84.74 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.797 0 C-N-CA 120.271 -0.571 . . . . 46.28 110.214 -179.404 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 46.2 t -60.99 -45.96 92.7 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 108.41 -0.959 . . . . 47.69 108.41 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 16.7 ttp-105 -61.04 -43.47 98.84 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.454 -0.499 . . . . 62.78 110.258 -179.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 43.1 ttm -62.05 -48.07 81.87 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.578 0.751 . . . . 57.39 111.671 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.9 t -61.49 -48.54 88.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 121.265 0.555 . . . . 44.38 109.834 -179.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 95.5 m -57.21 -44.65 83.88 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.792 -0.64 . . . . 39.51 111.191 -179.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -60.73 -42.7 97.83 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.193 -0.603 . . . . 57.57 110.79 178.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -57.87 -43.95 94.56 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 116.018 -0.537 . . . . 45.14 113.952 -178.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 70.1 mt -65.46 -44.42 87.24 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.832 0.348 . . . . 47.76 110.078 179.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 94.5 mt -64.2 -35.71 81.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.338 -0.392 . . . . 51.54 110.325 -179.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 40.2 t -68.3 -32.53 56.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 120.807 -0.357 . . . . 49.22 111.64 178.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -70.86 -26.05 63.09 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.407 -0.517 . . . . 59.11 110.079 179.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 94.0 mt -85.04 -5.67 59.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.983 -0.553 . . . . 49.95 110.9 179.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 98.83 16.41 31.05 Favored Glycine 0 N--CA 1.447 -0.607 0 N-CA-C 115.429 0.932 . . . . 59.22 115.429 179.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.1 m -86.55 152.21 22.82 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 115.601 1.704 . . . . 56.26 115.601 -179.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -98.24 101.34 12.77 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 100.845 -3.761 . . . . 64.41 100.845 176.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 5.8 t -98.66 126.06 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 N-CA-C 116.864 2.172 . . . . 54.71 116.864 -176.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 52.9 m -111.23 140.72 45.56 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 101.975 -3.343 . . . . 54.78 101.975 175.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 50.2 p -126.2 153.35 44.78 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 119.761 -0.776 . . . . 52.19 112.436 -179.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.8 m -145.1 156.47 13.78 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.635 0 N-CA-C 106.589 -1.634 . . . . 46.44 106.589 179.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.4 p -124.58 19.25 8.76 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 116.548 2.055 . . . . 48.84 116.548 -177.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 97.2 p -153.95 159.05 41.53 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.888 -1.153 . . . . 52.19 107.888 178.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -67.91 -50.18 57.62 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 120.367 -0.533 . . . . 60.9 110.786 -179.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . . . -53.45 -40.84 65.55 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.558 -0.534 . . . . 55.75 109.558 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -67.0 -40.87 87.43 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.218 -0.446 . . . . 66.28 110.602 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 18.8 t -61.09 -40.02 92.13 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.626 -0.43 . . . . 55.81 111.359 -179.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.7 mt -65.89 -30.16 70.71 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 116.13 1.9 . . . . 62.43 116.13 -179.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 78.2 mtm180 -87.85 -31.8 19.34 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.472 -0.491 . . . . 72.14 111.233 179.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 77.8 t -81.74 -38.3 15.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 115.07 1.507 . . . . 58.42 115.07 -179.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 14.6 p -57.17 115.73 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 114.331 1.234 . . . . 58.6 114.331 -178.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 81.7 p -129.6 171.28 12.77 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.227 0.537 . . . . 64.43 110.61 179.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -55.33 -20.79 12.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.083 -0.962 . . . . 76.66 110.044 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLU . . . . . 0.449 ' CG ' ' O ' ' A' 1038 ' ' HOH . 5.8 mm-40 -56.19 -44.63 79.61 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 107.402 -1.332 . . . . 77.71 107.402 179.293 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 48.5 m-70 -71.82 112.14 7.67 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 114.749 1.388 . . . . 58.51 114.749 -178.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -80.51 -22.91 40.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.627 -0.715 . . . . 57.78 110.672 178.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.6 t -146.31 141.0 21.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 112.952 0.723 . . . . 46.34 112.952 179.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 85.5 t -122.56 116.39 48.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 108.107 -1.071 . . . . 39.82 108.107 176.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -95.58 122.59 38.5 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 103.773 -2.677 . . . . 42.15 103.773 178.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 7.6 ptm -125.77 144.8 50.48 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 120.343 -0.543 . . . . 54.83 110.605 -179.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -83.65 133.61 34.82 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 120.048 -0.661 . . . . 48.89 110.162 -179.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 33.1 m -126.52 33.59 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 112.661 0.615 . . . . 49.43 112.661 -179.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 81.6 m -83.22 -3.21 57.17 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 117.112 2.264 . . . . 65.73 117.112 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 73.8 mmm -68.21 153.84 94.91 Favored Pre-proline 0 C--O 1.238 0.498 0 N-CA-C 104.856 -2.275 . . . . 67.49 104.856 176.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -64.2 152.83 79.59 Favored 'Trans proline' 0 CA--C 1.532 0.4 0 N-CA-C 109.823 -0.876 . . . . 61.47 109.823 179.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 66.58 -143.01 43.28 Favored Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.148 -1.025 . . . . 57.6 115.177 179.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.8 m -115.59 20.84 6.61 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.118 0 N-CA-C 114.713 1.375 . . . . 52.46 114.713 -178.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 73.5 mt-10 -55.07 -42.21 72.5 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.708 0.29 . . . . 71.9 110.984 179.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -81.32 -4.02 54.37 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 115.276 1.584 . . . . 59.86 115.276 -179.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -91.0 -24.85 19.96 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.064 -1.054 . . . . 50.13 110.852 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -49.93 -41.73 46.8 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 113.059 0.762 . . . . 64.53 113.059 179.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 7.3 tp -54.6 -34.57 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 112.255 0.465 . . . . 45.04 112.255 -179.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.37 -35.66 79.79 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.717 -0.475 . . . . 45.14 109.717 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 61.4 mt -67.77 -47.58 68.79 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 106.697 -1.594 . . . . 50.73 106.697 177.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -56.84 -32.37 65.7 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.483 -0.326 . . . . 78.64 110.306 179.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 74.4 mt -73.84 -31.45 31.2 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 112.146 0.424 . . . . 54.6 112.146 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' HIS . . . . . 0.635 ' CE1' ' NE ' ' A' ' 83' ' ' ARG . 67.8 m-70 -72.31 -38.01 68.8 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 108.061 -1.089 . . . . 66.46 108.061 178.285 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.5 -51.36 69.77 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.882 -0.599 . . . . 75.24 109.979 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -54.17 -52.1 62.24 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 116.577 2.066 . . . . 68.89 116.577 -178.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -78.38 -1.68 34.57 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 114.247 1.203 . . . . 72.28 114.247 -179.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.8 m . . . . . 0 C--O 1.251 1.168 0 CA-C-O 117.878 -1.058 . . . . 78.84 109.781 178.811 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 114.007 1.114 . . . . 100.0 114.007 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 59.1 mtt85 -34.35 -53.32 0.5 Allowed 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 121.553 3.908 . . . . 100.0 121.553 -177.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -68.97 149.76 48.46 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 118.363 2.727 . . . . 96.37 118.363 -178.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -55.69 141.88 36.3 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 114.536 1.31 . . . . 84.37 114.536 179.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ARG . . . . . 0.635 ' NE ' ' CE1' ' A' ' 73' ' ' HIS . 7.0 ptt-85 -73.91 142.47 79.83 Favored Pre-proline 0 C--O 1.237 0.42 0 N-CA-C 104.796 -2.298 . . . . 70.7 104.796 178.399 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -69.84 161.5 45.71 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 N-CA-C 109.958 -0.824 . . . . 57.29 109.958 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 71.1 mt -76.11 139.73 41.48 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 104.566 -2.383 . . . . 47.26 104.566 177.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 61.3 mt -107.16 126.0 51.82 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 120.857 -0.337 . . . . 42.48 110.471 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 62.6 t -120.3 131.61 72.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 N-CA-C 108.194 -1.039 . . . . 44.8 108.194 178.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -95.77 143.05 27.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.845 -0.616 . . . . 43.39 111.848 -179.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 63.2 mt -112.37 113.3 25.43 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 106.981 -1.488 . . . . 49.08 106.981 178.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 89.9 p -140.06 170.13 16.42 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 114.984 1.476 . . . . 63.77 114.984 -179.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -86.92 -1.34 85.0 Favored Glycine 0 CA--C 1.52 0.396 0 CA-C-N 115.201 -0.909 . . . . 78.66 112.914 179.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 11.4 p-10 -152.58 167.57 28.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.948 0.404 . . . . 85.35 110.359 179.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 73.1 p -136.21 11.52 3.29 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.464 -0.939 . . . . 87.91 108.464 179.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -57.75 177.15 0.12 Allowed 'General case' 0 C--O 1.232 0.176 0 C-N-CA 120.46 -0.496 . . . . 92.14 110.493 -179.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LYS . . . . . 0.4 ' O ' ' C ' ' A' ' 96' ' ' SER . 84.8 tttt -48.98 -42.82 39.06 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 121.115 -0.234 . . . . 92.19 111.38 -179.27 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' SER . . . . . 0.4 ' C ' ' O ' ' A' ' 95' ' ' LYS . 11.4 t -40.44 -66.8 0.28 Allowed 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 108.903 -0.777 . . . . 74.71 108.903 179.066 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.1 m -55.02 -56.37 20.56 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 114.488 1.292 . . . . 59.36 114.488 -179.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . . . -49.66 -49.01 49.06 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 113.294 0.85 . . . . 53.08 113.294 -179.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -52.86 -51.86 59.45 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.135 -0.32 . . . . 79.88 110.135 178.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -58.15 -47.56 82.95 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 113.7 1.0 . . . . 59.94 113.7 -178.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 91.9 m -56.59 -41.93 77.84 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 119.776 -0.77 . . . . 50.01 112.214 179.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.7 mtt -64.19 -56.44 14.7 Favored 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 112.99 0.737 . . . . 68.53 112.99 -178.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 45.2 m -62.68 -23.67 67.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.987 -0.552 . . . . 50.36 111.043 -179.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -103.8 8.59 37.13 Favored 'General case' 0 CA--C 1.504 -0.806 0 N-CA-C 116.282 1.956 . . . . 50.52 116.282 -178.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 82.91 7.21 87.55 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 121.057 3.183 . . . . 49.74 121.057 176.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -71.84 134.91 46.4 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 106.095 -1.817 . . . . 47.63 106.095 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ASP . . . . . 0.45 ' OD1' ' NH2' ' A' ' 83' ' ' ARG . 25.0 m-20 -88.32 -22.71 23.71 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.74 0.644 . . . . 49.03 112.74 -179.816 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -152.98 169.56 31.95 Favored Glycine 0 CA--C 1.502 -0.723 0 C-N-CA 119.556 -1.306 . . . . 44.2 110.399 -179.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 7.8 p -145.58 133.31 15.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 117.371 0.586 . . . . 53.03 112.249 179.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 31.4 mt -108.87 135.19 50.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.562 -0.744 . . . . 53.76 111.495 179.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . . . -87.77 136.37 32.98 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 107.286 -1.376 . . . . 54.15 107.286 178.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -100.83 153.2 37.87 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 112.787 0.662 . . . . 65.95 112.787 -179.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -66.97 155.12 84.36 Favored 'Cis proline' 0 C--N 1.347 0.468 0 N-CA-C 108.894 -1.233 . . . . 62.34 108.894 -0.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 18.9 m -91.66 158.48 2.88 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 N-CA-C 113.082 0.771 . . . . 56.39 113.082 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 68.0 p -143.01 156.92 44.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.464 -0.789 . . . . 56.3 109.238 -179.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 91.5 mt -46.35 -40.26 11.62 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 108.142 -1.058 . . . . 62.89 108.142 178.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 82.9 m-20 -54.33 -63.55 1.12 Allowed 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 114.322 1.23 . . . . 79.74 114.322 -179.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -66.9 -22.14 65.97 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 117.969 -1.492 . . . . 76.9 112.872 -179.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 66.2 mt -71.82 -48.22 52.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.088 -0.645 . . . . 62.93 110.443 178.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 55.2 mtt85 -56.24 -56.78 16.76 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.485 -0.486 . . . . 67.54 112.075 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -46.13 -50.87 14.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.046 -0.525 . . . . 78.31 112.189 -179.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 92.7 t -65.44 -54.96 22.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 111.923 0.342 . . . . 62.71 111.923 -179.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 45.6 mt -55.94 -36.9 68.27 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 119.129 -1.028 . . . . 56.28 110.521 179.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 74.0 m -64.02 -52.83 57.63 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.011 -0.676 . . . . 64.8 110.039 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -57.97 -53.49 57.66 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 120.217 -0.593 . . . . 70.7 111.092 179.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 87.7 mt -56.37 -47.89 77.98 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.636 0.606 . . . . 61.09 112.636 -179.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 83.2 mt -78.91 -28.92 43.99 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 117.005 2.224 . . . . 63.51 117.005 -178.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -79.32 147.96 69.67 Favored Pre-proline 0 C--O 1.237 0.411 0 N-CA-C 114.364 1.246 . . . . 71.27 114.364 -179.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -58.08 129.75 34.66 Favored 'Trans proline' 0 C--O 1.236 0.392 1 C-N-CA 125.716 4.277 . . . . 78.23 113.442 -179.997 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 32.7 ttm180 -132.52 140.77 48.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.133 -0.94 . . . . 90.45 108.519 178.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 65.8 t -137.5 126.46 34.53 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.76 0 N-CA-C 106.879 -1.526 . . . . 76.47 106.879 179.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 78.0 mt -88.11 100.49 12.99 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 107.895 -1.15 . . . . 79.13 107.895 179.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' TYR . . . . . 0.626 ' O ' ' CG ' ' A' ' 134' ' ' GLU . . . -83.84 175.5 9.57 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 107.652 -1.24 . . . . 82.45 107.652 179.105 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLU . . . . . 0.626 ' CG ' ' O ' ' A' ' 133' ' ' TYR . 3.4 mm-40 . . . . . 0 N--CA 1.474 0.754 0 C-N-CA 126.067 1.747 . . . . 96.25 109.702 -178.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1038 ' ' HOH . . . . . 0.449 ' O ' ' CG ' ' A' ' 50' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 1.9 t60 . . . . . 0 N--CA 1.494 1.726 0 N-CA-C 109.281 -0.637 . . . . 100.0 109.281 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' MET . . . . . 0.582 ' HB3' ' OG ' ' A' ' 124' ' ' SER . 26.1 ttt -146.5 112.36 5.69 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 106.428 -1.693 . . . . 88.53 106.428 -179.843 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' SER . . . . . 0.613 ' HA ' ' HD3' ' A' ' 120' ' ' ARG . 67.9 m -90.74 -28.96 17.94 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 118.828 2.899 . . . . 84.42 118.828 -177.115 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -132.83 145.91 51.37 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 119.739 -0.785 . . . . 84.3 110.821 178.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -121.53 39.99 3.71 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.229 -0.896 . . . . 68.75 109.027 -178.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 28.7 m -44.91 119.93 2.16 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 114.881 -1.054 . . . . 63.06 112.151 -179.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.91 -2.85 76.74 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 114.74 0.656 . . . . 60.09 114.74 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 29.9 tp -63.69 120.08 11.14 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.215 0.531 . . . . 56.09 112.215 -179.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -83.09 102.66 11.96 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.739 -0.664 . . . . 69.31 109.507 -179.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.5 m -125.79 156.04 35.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 N-CA-C 113.789 1.033 . . . . 50.3 113.789 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . 0.564 HD12 ' O ' ' A' ' 35' ' ' THR . 50.1 tp -123.57 141.6 51.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.516 -0.766 . . . . 46.11 109.899 179.896 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' VAL . . . . . 0.511 ' HB ' HG22 ' A' ' 36' ' ' THR . 94.4 t -119.93 126.2 75.05 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-N 115.998 -0.546 . . . . 43.61 109.96 179.226 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' MET . . . . . 0.728 ' HG2' HG23 ' A' ' 37' ' ' VAL . 3.5 tmm? -118.26 112.53 20.2 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 107.675 -1.232 . . . . 57.21 107.675 -179.849 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -154.81 129.85 9.51 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.882 -0.784 . . . . 55.57 108.882 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . . . -68.91 -26.27 65.01 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.171 -0.212 . . . . 55.62 111.43 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASN . . . . . 0.447 ' OD1' ' C ' ' A' ' 16' ' ' ASN . 50.9 t-20 -86.3 126.6 34.43 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 112.458 0.54 . . . . 64.56 112.458 -179.794 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLY . . . . . 0.436 ' N ' ' OD1' ' A' ' 16' ' ' ASN . . . -64.25 -44.8 95.03 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 115.271 0.869 . . . . 50.47 115.271 -179.126 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' VAL . . . . . 0.547 ' O ' HG23 ' A' ' 22' ' ' VAL . 56.4 t -64.85 -48.34 84.74 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.797 0 C-N-CA 120.271 -0.571 . . . . 46.28 110.214 -179.404 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 46.2 t -60.99 -45.96 92.7 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 108.41 -0.959 . . . . 47.69 108.41 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ARG . . . . . 0.755 ' HD2' ' HB ' ' A' ' 36' ' ' THR . 16.7 ttp-105 -61.04 -43.47 98.84 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.454 -0.499 . . . . 62.78 110.258 -179.87 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 43.1 ttm -62.05 -48.07 81.87 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.578 0.751 . . . . 57.39 111.671 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' ' 18' ' ' VAL . 90.9 t -61.49 -48.54 88.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 121.265 0.555 . . . . 44.38 109.834 -179.373 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 95.5 m -57.21 -44.65 83.88 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.792 -0.64 . . . . 39.51 111.191 -179.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -60.73 -42.7 97.83 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.193 -0.603 . . . . 57.57 110.79 178.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -57.87 -43.95 94.56 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 116.018 -0.537 . . . . 45.14 113.952 -178.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . 0.448 ' CD1' HG23 ' A' ' 114' ' ' VAL . 70.1 mt -65.46 -44.42 87.24 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.832 0.348 . . . . 47.76 110.078 179.793 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 94.5 mt -64.2 -35.71 81.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.338 -0.392 . . . . 51.54 110.325 -179.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 40.2 t -68.3 -32.53 56.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 120.807 -0.357 . . . . 49.22 111.64 178.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -70.86 -26.05 63.09 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.407 -0.517 . . . . 59.11 110.079 179.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 94.0 mt -85.04 -5.67 59.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.983 -0.553 . . . . 49.95 110.9 179.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 98.83 16.41 31.05 Favored Glycine 0 N--CA 1.447 -0.607 0 N-CA-C 115.429 0.932 . . . . 59.22 115.429 179.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.1 m -86.55 152.21 22.82 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 115.601 1.704 . . . . 56.26 115.601 -179.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -98.24 101.34 12.77 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 100.845 -3.761 . . . . 64.41 100.845 176.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 5.8 t -98.66 126.06 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 N-CA-C 116.864 2.172 . . . . 54.71 116.864 -176.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' THR . . . . . 0.564 ' O ' HD12 ' A' ' 11' ' ' LEU . 52.9 m -111.23 140.72 45.56 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 101.975 -3.343 . . . . 54.78 101.975 175.948 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' THR . . . . . 0.755 ' HB ' ' HD2' ' A' ' 20' ' ' ARG . 50.2 p -126.2 153.35 44.78 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 119.761 -0.776 . . . . 52.19 112.436 -179.347 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' VAL . . . . . 0.728 HG23 ' HG2' ' A' ' 13' ' ' MET . 20.8 m -145.1 156.47 13.78 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.635 0 N-CA-C 106.589 -1.634 . . . . 46.44 106.589 179.035 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.4 p -124.58 19.25 8.76 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 116.548 2.055 . . . . 48.84 116.548 -177.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 97.2 p -153.95 159.05 41.53 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.888 -1.153 . . . . 52.19 107.888 178.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -67.91 -50.18 57.62 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 120.367 -0.533 . . . . 60.9 110.786 -179.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . . . -53.45 -40.84 65.55 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.558 -0.534 . . . . 55.75 109.558 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -67.0 -40.87 87.43 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.218 -0.446 . . . . 66.28 110.602 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 18.8 t -61.09 -40.02 92.13 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.626 -0.43 . . . . 55.81 111.359 -179.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . 0.685 HD11 ' HD3' ' A' ' 71' ' ' ARG . 83.7 mt -65.89 -30.16 70.71 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 116.13 1.9 . . . . 62.43 116.13 -179.242 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 78.2 mtm180 -87.85 -31.8 19.34 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.472 -0.491 . . . . 72.14 111.233 179.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 77.8 t -81.74 -38.3 15.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 115.07 1.507 . . . . 58.42 115.07 -179.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' VAL . . . . . 0.479 ' O ' HG13 ' A' ' 47' ' ' VAL . 14.6 p -57.17 115.73 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 114.331 1.234 . . . . 58.6 114.331 -178.722 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 81.7 p -129.6 171.28 12.77 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.227 0.537 . . . . 64.43 110.61 179.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -55.33 -20.79 12.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.083 -0.962 . . . . 76.66 110.044 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLU . . . . . 0.873 ' HG3' ' O ' ' A' 1038 ' ' HOH . 5.8 mm-40 -56.19 -44.63 79.61 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 107.402 -1.332 . . . . 77.71 107.402 179.293 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' HIS . . . . . 0.482 ' O ' ' HB3' ' A' ' 84' ' ' PRO . 21.2 m80 -71.82 112.14 7.67 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 114.749 1.388 . . . . 58.51 114.749 -178.542 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LYS . . . . . 0.443 ' HD3' ' HA ' ' A' ' 52' ' ' LYS . 68.9 mmtt -80.51 -22.91 40.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.627 -0.715 . . . . 57.78 110.672 178.981 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.6 t -146.31 141.0 21.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 112.952 0.723 . . . . 46.34 112.952 179.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 85.5 t -122.56 116.39 48.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 108.107 -1.071 . . . . 39.82 108.107 176.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -95.58 122.59 38.5 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 103.773 -2.677 . . . . 42.15 103.773 178.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 7.6 ptm -125.77 144.8 50.48 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 120.343 -0.543 . . . . 54.83 110.605 -179.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -83.65 133.61 34.82 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 120.048 -0.661 . . . . 48.89 110.162 -179.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . 0.401 ' HA ' ' CB ' ' A' ' 65' ' ' ASN . 33.1 m -126.52 33.59 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 112.661 0.615 . . . . 49.43 112.661 -179.42 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' CYS . . . . . 0.545 ' SG ' ' HE2' ' A' ' 112' ' ' LYS . 81.6 m -83.22 -3.21 57.17 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 117.112 2.264 . . . . 65.73 117.112 -179.471 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' MET . . . . . 0.415 ' HB3' ' HE3' ' A' ' 60' ' ' MET . 73.8 mmm -68.21 153.84 94.91 Favored Pre-proline 0 C--O 1.238 0.498 0 N-CA-C 104.856 -2.275 . . . . 67.49 104.856 176.283 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PRO . . . . . 0.404 ' HD2' ' CE ' ' A' ' 60' ' ' MET . 93.2 Cg_endo -64.2 152.83 79.59 Favored 'Trans proline' 0 CA--C 1.532 0.4 0 N-CA-C 109.823 -0.876 . . . . 61.47 109.823 179.525 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 66.58 -143.01 43.28 Favored Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.148 -1.025 . . . . 57.6 115.177 179.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.8 m -115.59 20.84 6.61 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.118 0 N-CA-C 114.713 1.375 . . . . 52.46 114.713 -178.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 73.5 mt-10 -55.07 -42.21 72.5 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.708 0.29 . . . . 71.9 110.984 179.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASN . . . . . 0.401 ' CB ' ' HA ' ' A' ' 58' ' ' VAL . 52.0 m-20 -81.32 -4.02 54.37 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 115.276 1.584 . . . . 59.86 115.276 -179.503 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -91.0 -24.85 19.96 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.064 -1.054 . . . . 50.13 110.852 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -49.93 -41.73 46.8 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 113.059 0.762 . . . . 64.53 113.059 179.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ILE . . . . . 0.649 ' O ' HG13 ' A' ' 72' ' ' ILE . 7.3 tp -54.6 -34.57 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 112.255 0.465 . . . . 45.04 112.255 -179.133 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.37 -35.66 79.79 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.717 -0.475 . . . . 45.14 109.717 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . 0.488 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 61.4 mt -67.77 -47.58 68.79 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 106.697 -1.594 . . . . 50.73 106.697 177.684 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ARG . . . . . 0.685 ' HD3' HD11 ' A' ' 44' ' ' LEU . 99.5 mtt180 -56.84 -32.37 65.7 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.483 -0.326 . . . . 78.64 110.306 179.121 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . 0.649 HG13 ' O ' ' A' ' 68' ' ' ILE . 74.4 mt -73.84 -31.45 31.2 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 112.146 0.424 . . . . 54.6 112.146 -179.956 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' HIS . . . . . 0.55 ' CE1' ' HA3' ' A' ' 105' ' ' GLY . 25.7 m80 -72.31 -38.01 68.8 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 108.061 -1.089 . . . . 66.46 108.061 178.285 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 4.5 mm-40 -57.5 -51.36 69.77 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.882 -0.599 . . . . 75.24 109.979 179.841 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -54.17 -52.1 62.24 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 116.577 2.066 . . . . 68.89 116.577 -178.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -78.38 -1.68 34.57 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 114.247 1.203 . . . . 72.28 114.247 -179.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.8 m . . . . . 0 C--O 1.251 1.168 0 CA-C-O 117.878 -1.058 . . . . 78.84 109.781 178.811 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 114.007 1.114 . . . . 100.0 114.007 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 59.1 mtt85 -34.35 -53.32 0.5 Allowed 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 121.553 3.908 . . . . 100.0 121.553 -177.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -68.97 149.76 48.46 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 118.363 2.727 . . . . 96.37 118.363 -178.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -55.69 141.88 36.3 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 114.536 1.31 . . . . 84.37 114.536 179.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ARG . . . . . 0.506 ' HD2' ' CD2' ' A' ' 73' ' ' HIS . 7.0 ptt-85 -73.91 142.47 79.83 Favored Pre-proline 0 C--O 1.237 0.42 0 N-CA-C 104.796 -2.298 . . . . 70.7 104.796 178.399 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' PRO . . . . . 0.482 ' HB3' ' O ' ' A' ' 51' ' ' HIS . 40.3 Cg_endo -69.84 161.5 45.71 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 N-CA-C 109.958 -0.824 . . . . 57.29 109.958 -179.953 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . 0.57 HD13 ' HB3' ' A' ' 126' ' ' LEU . 71.1 mt -76.11 139.73 41.48 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 104.566 -2.383 . . . . 47.26 104.566 177.754 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 61.3 mt -107.16 126.0 51.82 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 120.857 -0.337 . . . . 42.48 110.471 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 62.6 t -120.3 131.61 72.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 N-CA-C 108.194 -1.039 . . . . 44.8 108.194 178.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -95.77 143.05 27.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.845 -0.616 . . . . 43.39 111.848 -179.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 63.2 mt -112.37 113.3 25.43 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 106.981 -1.488 . . . . 49.08 106.981 178.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' SER . . . . . 0.555 ' HB2' ' O ' ' A' 1035 ' ' HOH . 89.9 p -140.06 170.13 16.42 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 114.984 1.476 . . . . 63.77 114.984 -179.423 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -86.92 -1.34 85.0 Favored Glycine 0 CA--C 1.52 0.396 0 CA-C-N 115.201 -0.909 . . . . 78.66 112.914 179.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -152.58 167.57 28.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.948 0.404 . . . . 85.35 110.359 179.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 73.1 p -136.21 11.52 3.29 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.464 -0.939 . . . . 87.91 108.464 179.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASP . . . . . 0.711 ' OD1' ' HB3' ' A' ' 96' ' ' SER . 2.8 p30 -57.75 177.15 0.12 Allowed 'General case' 0 C--O 1.232 0.176 0 C-N-CA 120.46 -0.496 . . . . 92.14 110.493 -179.769 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LYS . . . . . 0.4 ' O ' ' C ' ' A' ' 96' ' ' SER . 84.8 tttt -48.98 -42.82 39.06 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 121.115 -0.234 . . . . 92.19 111.38 -179.27 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' SER . . . . . 0.711 ' HB3' ' OD1' ' A' ' 94' ' ' ASP . 11.4 t -40.44 -66.8 0.28 Allowed 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 108.903 -0.777 . . . . 74.71 108.903 179.066 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.1 m -55.02 -56.37 20.56 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 114.488 1.292 . . . . 59.36 114.488 -179.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . . . -49.66 -49.01 49.06 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 113.294 0.85 . . . . 53.08 113.294 -179.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -52.86 -51.86 59.45 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.135 -0.32 . . . . 79.88 110.135 178.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -58.15 -47.56 82.95 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 113.7 1.0 . . . . 59.94 113.7 -178.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' CYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 106' ' ' LEU . 91.9 m -56.59 -41.93 77.84 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 119.776 -0.77 . . . . 50.01 112.214 179.618 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.7 mtt -64.19 -56.44 14.7 Favored 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 112.99 0.737 . . . . 68.53 112.99 -178.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 45.2 m -62.68 -23.67 67.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.987 -0.552 . . . . 50.36 111.043 -179.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -103.8 8.59 37.13 Favored 'General case' 0 CA--C 1.504 -0.806 0 N-CA-C 116.282 1.956 . . . . 50.52 116.282 -178.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLY . . . . . 0.55 ' HA3' ' CE1' ' A' ' 73' ' ' HIS . . . 82.91 7.21 87.55 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 121.057 3.183 . . . . 49.74 121.057 176.039 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LEU . . . . . 0.469 ' HB2' ' HB3' ' A' ' 101' ' ' CYS . 2.8 mm? -71.84 134.91 46.4 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 106.095 -1.817 . . . . 47.63 106.095 177.854 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ASP . . . . . 0.45 ' OD1' ' NH2' ' A' ' 83' ' ' ARG . 25.0 m-20 -88.32 -22.71 23.71 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.74 0.644 . . . . 49.03 112.74 -179.816 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -152.98 169.56 31.95 Favored Glycine 0 CA--C 1.502 -0.723 0 C-N-CA 119.556 -1.306 . . . . 44.2 110.399 -179.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 7.8 p -145.58 133.31 15.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 117.371 0.586 . . . . 53.03 112.249 179.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 31.4 mt -108.87 135.19 50.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.562 -0.744 . . . . 53.76 111.495 179.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . . . -87.77 136.37 32.98 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 107.286 -1.376 . . . . 54.15 107.286 178.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LYS . . . . . 0.545 ' HE2' ' SG ' ' A' ' 59' ' ' CYS . 44.0 mtmt -100.83 153.2 37.87 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 112.787 0.662 . . . . 65.95 112.787 -179.45 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' PRO . . . . . 0.493 ' C ' ' HA ' ' A' ' 112' ' ' LYS . 63.2 Cg_endo -66.97 155.12 84.36 Favored 'Cis proline' 0 C--N 1.347 0.468 0 N-CA-C 108.894 -1.233 . . . . 62.34 108.894 -0.307 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' VAL . . . . . 0.448 HG23 ' CD1' ' A' ' 26' ' ' LEU . 18.9 m -91.66 158.48 2.88 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 N-CA-C 113.082 0.771 . . . . 56.39 113.082 -178.731 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 115' ' ' SER . . . . . 0.638 ' HB3' ' O ' ' A' 1009 ' ' HOH . 68.0 p -143.01 156.92 44.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.464 -0.789 . . . . 56.3 109.238 -179.339 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 91.5 mt -46.35 -40.26 11.62 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 108.142 -1.058 . . . . 62.89 108.142 178.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 82.9 m-20 -54.33 -63.55 1.12 Allowed 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 114.322 1.23 . . . . 79.74 114.322 -179.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -66.9 -22.14 65.97 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 117.969 -1.492 . . . . 76.9 112.872 -179.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 66.2 mt -71.82 -48.22 52.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.088 -0.645 . . . . 62.93 110.443 178.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ARG . . . . . 0.613 ' HD3' ' HA ' ' A' ' 3' ' ' SER . 55.2 mtt85 -56.24 -56.78 16.76 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.485 -0.486 . . . . 67.54 112.075 179.018 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -46.13 -50.87 14.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.046 -0.525 . . . . 78.31 112.189 -179.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 92.7 t -65.44 -54.96 22.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 111.923 0.342 . . . . 62.71 111.923 -179.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 45.6 mt -55.94 -36.9 68.27 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 119.129 -1.028 . . . . 56.28 110.521 179.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' SER . . . . . 0.582 ' OG ' ' HB3' ' A' ' 2' ' ' MET . 74.0 m -64.02 -52.83 57.63 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.011 -0.676 . . . . 64.8 110.039 179.301 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -57.97 -53.49 57.66 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 120.217 -0.593 . . . . 70.7 111.092 179.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' LEU . . . . . 0.57 ' HB3' HD13 ' A' ' 85' ' ' LEU . 87.7 mt -56.37 -47.89 77.98 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.636 0.606 . . . . 61.09 112.636 -179.624 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 83.2 mt -78.91 -28.92 43.99 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 117.005 2.224 . . . . 63.51 117.005 -178.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLU . . . . . 0.404 ' HA ' ' HD3' ' A' ' 129' ' ' PRO . 97.6 mt-10 -79.32 147.96 69.67 Favored Pre-proline 0 C--O 1.237 0.411 0 N-CA-C 114.364 1.246 . . . . 71.27 114.364 -179.106 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 128' ' ' GLU . 78.0 Cg_exo -58.08 129.75 34.66 Favored 'Trans proline' 0 C--O 1.236 0.392 1 C-N-CA 125.716 4.277 . . . . 78.23 113.442 -179.997 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ARG . . . . . 0.708 ' HD3' ' O ' ' A' 1026 ' ' HOH . 32.7 ttm180 -132.52 140.77 48.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.133 -0.94 . . . . 90.45 108.519 178.518 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 65.8 t -137.5 126.46 34.53 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.76 0 N-CA-C 106.879 -1.526 . . . . 76.47 106.879 179.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 78.0 mt -88.11 100.49 12.99 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 107.895 -1.15 . . . . 79.13 107.895 179.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' TYR . . . . . 0.752 ' O ' ' HG2' ' A' ' 134' ' ' GLU . . . -83.84 175.5 9.57 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 107.652 -1.24 . . . . 82.45 107.652 179.105 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLU . . . . . 0.752 ' HG2' ' O ' ' A' ' 133' ' ' TYR . 3.4 mm-40 . . . . . 0 N--CA 1.474 0.754 0 C-N-CA 126.067 1.747 . . . . 96.25 109.702 -178.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1009 ' ' HOH . . . . . 0.638 ' O ' ' HB3' ' A' ' 115' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1026 ' ' HOH . . . . . 0.708 ' O ' ' HD3' ' A' ' 130' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1031 ' ' HOH . . . . . 0.47 ' O ' ' HB3' ' A' ' 134' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1035 ' ' HOH . . . . . 0.555 ' O ' ' HB2' ' A' ' 90' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1038 ' ' HOH . . . . . 0.873 ' O ' ' HG3' ' A' ' 50' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' HIS . . . . . 0.586 ' CD2' ' H ' ' A' ' 2' ' ' MET . 17.5 t-160 . . . . . 0 N--CA 1.494 1.726 0 N-CA-C 109.281 -0.637 . . . . 100.0 109.281 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' MET . . . . . 0.586 ' H ' ' CD2' ' A' ' 1' ' ' HIS . 26.1 ttt -146.5 112.36 5.69 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 106.428 -1.693 . . . . 88.53 106.428 -179.843 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' SER . . . . . 0.613 ' HA ' ' HD3' ' A' ' 120' ' ' ARG . 67.9 m -90.74 -28.96 17.94 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 118.828 2.899 . . . . 84.42 118.828 -177.115 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -132.83 145.91 51.37 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 119.739 -0.785 . . . . 84.3 110.821 178.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -121.53 39.99 3.71 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.229 -0.896 . . . . 68.75 109.027 -178.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 28.7 m -44.91 119.93 2.16 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 114.881 -1.054 . . . . 63.06 112.151 -179.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 91.91 -2.85 76.74 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 114.74 0.656 . . . . 60.09 114.74 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 29.9 tp -63.69 120.08 11.14 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.215 0.531 . . . . 56.09 112.215 -179.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -83.09 102.66 11.96 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.739 -0.664 . . . . 69.31 109.507 -179.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.5 m -125.79 156.04 35.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 N-CA-C 113.789 1.033 . . . . 50.3 113.789 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.564 HD12 ' O ' ' A' ' 35' ' ' THR . 50.1 tp -123.57 141.6 51.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.516 -0.766 . . . . 46.11 109.899 179.896 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.511 ' HB ' HG22 ' A' ' 36' ' ' THR . 94.4 t -119.93 126.2 75.05 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 CA-C-N 115.998 -0.546 . . . . 43.61 109.96 179.226 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' MET . . . . . 0.728 ' HG2' HG23 ' A' ' 37' ' ' VAL . 3.5 tmm? -118.26 112.53 20.2 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 107.675 -1.232 . . . . 57.21 107.675 -179.849 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -154.81 129.85 9.51 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.882 -0.784 . . . . 55.57 108.882 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . . . -68.91 -26.27 65.01 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.171 -0.212 . . . . 55.62 111.43 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.943 HD22 ' N ' ' A' ' 17' ' ' GLY . 0.2 OUTLIER -86.3 126.6 34.43 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 112.458 0.54 . . . . 64.56 112.458 -179.794 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.943 ' N ' HD22 ' A' ' 16' ' ' ASN . . . -64.25 -44.8 95.03 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 115.271 0.869 . . . . 50.47 115.271 -179.126 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.555 ' H ' ' ND2' ' A' ' 16' ' ' ASN . 56.4 t -64.85 -48.34 84.74 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.797 0 C-N-CA 120.271 -0.571 . . . . 46.28 110.214 -179.404 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 46.2 t -60.99 -45.96 92.7 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 108.41 -0.959 . . . . 47.69 108.41 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.755 ' HD2' ' HB ' ' A' ' 36' ' ' THR . 16.7 ttp-105 -61.04 -43.47 98.84 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.454 -0.499 . . . . 62.78 110.258 -179.87 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 43.1 ttm -62.05 -48.07 81.87 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.578 0.751 . . . . 57.39 111.671 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' ' 18' ' ' VAL . 90.9 t -61.49 -48.54 88.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 121.265 0.555 . . . . 44.38 109.834 -179.373 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 95.5 m -57.21 -44.65 83.88 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.792 -0.64 . . . . 39.51 111.191 -179.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -60.73 -42.7 97.83 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.193 -0.603 . . . . 57.57 110.79 178.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -57.87 -43.95 94.56 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 116.018 -0.537 . . . . 45.14 113.952 -178.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.448 ' CD1' HG23 ' A' ' 114' ' ' VAL . 70.1 mt -65.46 -44.42 87.24 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.832 0.348 . . . . 47.76 110.078 179.793 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 94.5 mt -64.2 -35.71 81.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.338 -0.392 . . . . 51.54 110.325 -179.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 40.2 t -68.3 -32.53 56.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 120.807 -0.357 . . . . 49.22 111.64 178.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -70.86 -26.05 63.09 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.407 -0.517 . . . . 59.11 110.079 179.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 94.0 mt -85.04 -5.67 59.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.983 -0.553 . . . . 49.95 110.9 179.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 98.83 16.41 31.05 Favored Glycine 0 N--CA 1.447 -0.607 0 N-CA-C 115.429 0.932 . . . . 59.22 115.429 179.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.1 m -86.55 152.21 22.82 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 115.601 1.704 . . . . 56.26 115.601 -179.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -98.24 101.34 12.77 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 100.845 -3.761 . . . . 64.41 100.845 176.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 5.8 t -98.66 126.06 51.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 N-CA-C 116.864 2.172 . . . . 54.71 116.864 -176.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' THR . . . . . 0.564 ' O ' HD12 ' A' ' 11' ' ' LEU . 52.9 m -111.23 140.72 45.56 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 101.975 -3.343 . . . . 54.78 101.975 175.948 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' THR . . . . . 0.755 ' HB ' ' HD2' ' A' ' 20' ' ' ARG . 50.2 p -126.2 153.35 44.78 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 119.761 -0.776 . . . . 52.19 112.436 -179.347 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.728 HG23 ' HG2' ' A' ' 13' ' ' MET . 20.8 m -145.1 156.47 13.78 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.635 0 N-CA-C 106.589 -1.634 . . . . 46.44 106.589 179.035 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.4 p -124.58 19.25 8.76 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 116.548 2.055 . . . . 48.84 116.548 -177.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 97.2 p -153.95 159.05 41.53 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.888 -1.153 . . . . 52.19 107.888 178.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -67.91 -50.18 57.62 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 120.367 -0.533 . . . . 60.9 110.786 -179.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . . . -53.45 -40.84 65.55 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.558 -0.534 . . . . 55.75 109.558 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -67.0 -40.87 87.43 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.218 -0.446 . . . . 66.28 110.602 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 18.8 t -61.09 -40.02 92.13 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.626 -0.43 . . . . 55.81 111.359 -179.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.685 HD11 ' HD3' ' A' ' 71' ' ' ARG . 83.7 mt -65.89 -30.16 70.71 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 116.13 1.9 . . . . 62.43 116.13 -179.242 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 78.2 mtm180 -87.85 -31.8 19.34 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.472 -0.491 . . . . 72.14 111.233 179.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 77.8 t -81.74 -38.3 15.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 115.07 1.507 . . . . 58.42 115.07 -179.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.479 ' O ' HG13 ' A' ' 47' ' ' VAL . 14.6 p -57.17 115.73 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 114.331 1.234 . . . . 58.6 114.331 -178.722 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' SER . . . . . 0.725 ' H ' ' CD2' ' A' ' 51' ' ' HIS . 81.7 p -129.6 171.28 12.77 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.227 0.537 . . . . 64.43 110.61 179.585 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -55.33 -20.79 12.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.083 -0.962 . . . . 76.66 110.044 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.873 ' HG3' ' O ' ' A' 1038 ' ' HOH . 5.8 mm-40 -56.19 -44.63 79.61 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 107.402 -1.332 . . . . 77.71 107.402 179.293 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.725 ' CD2' ' H ' ' A' ' 48' ' ' SER . 48.5 m-70 -71.82 112.14 7.67 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 114.749 1.388 . . . . 58.51 114.749 -178.542 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.443 ' HD3' ' HA ' ' A' ' 52' ' ' LYS . 68.9 mmtt -80.51 -22.91 40.48 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.627 -0.715 . . . . 57.78 110.672 178.981 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.6 t -146.31 141.0 21.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 112.952 0.723 . . . . 46.34 112.952 179.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 85.5 t -122.56 116.39 48.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 108.107 -1.071 . . . . 39.82 108.107 176.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -95.58 122.59 38.5 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 103.773 -2.677 . . . . 42.15 103.773 178.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 7.6 ptm -125.77 144.8 50.48 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 120.343 -0.543 . . . . 54.83 110.605 -179.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -83.65 133.61 34.82 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 120.048 -0.661 . . . . 48.89 110.162 -179.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.401 ' HA ' ' CB ' ' A' ' 65' ' ' ASN . 33.1 m -126.52 33.59 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 112.661 0.615 . . . . 49.43 112.661 -179.42 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.545 ' SG ' ' HE2' ' A' ' 112' ' ' LYS . 81.6 m -83.22 -3.21 57.17 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 117.112 2.264 . . . . 65.73 117.112 -179.471 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' MET . . . . . 0.415 ' HB3' ' HE3' ' A' ' 60' ' ' MET . 73.8 mmm -68.21 153.84 94.91 Favored Pre-proline 0 C--O 1.238 0.498 0 N-CA-C 104.856 -2.275 . . . . 67.49 104.856 176.283 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.404 ' HD2' ' CE ' ' A' ' 60' ' ' MET . 93.2 Cg_endo -64.2 152.83 79.59 Favored 'Trans proline' 0 CA--C 1.532 0.4 0 N-CA-C 109.823 -0.876 . . . . 61.47 109.823 179.525 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 66.58 -143.01 43.28 Favored Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.148 -1.025 . . . . 57.6 115.177 179.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.8 m -115.59 20.84 6.61 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.118 0 N-CA-C 114.713 1.375 . . . . 52.46 114.713 -178.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 73.5 mt-10 -55.07 -42.21 72.5 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.708 0.29 . . . . 71.9 110.984 179.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.401 ' CB ' ' HA ' ' A' ' 58' ' ' VAL . 2.8 m120 -81.32 -4.02 54.37 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 115.276 1.584 . . . . 59.86 115.276 -179.503 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -91.0 -24.85 19.96 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.064 -1.054 . . . . 50.13 110.852 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 14.4 mm-40 -49.93 -41.73 46.8 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 113.059 0.762 . . . . 64.53 113.059 179.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.649 ' O ' HG13 ' A' ' 72' ' ' ILE . 7.3 tp -54.6 -34.57 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 112.255 0.465 . . . . 45.04 112.255 -179.133 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.37 -35.66 79.79 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.717 -0.475 . . . . 45.14 109.717 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.488 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 61.4 mt -67.77 -47.58 68.79 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 106.697 -1.594 . . . . 50.73 106.697 177.684 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.685 ' HD3' HD11 ' A' ' 44' ' ' LEU . 99.5 mtt180 -56.84 -32.37 65.7 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.483 -0.326 . . . . 78.64 110.306 179.121 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.649 HG13 ' O ' ' A' ' 68' ' ' ILE . 74.4 mt -73.84 -31.45 31.2 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 112.146 0.424 . . . . 54.6 112.146 -179.956 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.698 ' CE1' ' HE ' ' A' ' 83' ' ' ARG . 67.8 m-70 -72.31 -38.01 68.8 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 108.061 -1.089 . . . . 66.46 108.061 178.285 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 4.5 mm-40 -57.5 -51.36 69.77 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.882 -0.599 . . . . 75.24 109.979 179.841 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -54.17 -52.1 62.24 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 116.577 2.066 . . . . 68.89 116.577 -178.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -78.38 -1.68 34.57 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 114.247 1.203 . . . . 72.28 114.247 -179.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.8 m . . . . . 0 C--O 1.251 1.168 0 CA-C-O 117.878 -1.058 . . . . 78.84 109.781 178.811 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 114.007 1.114 . . . . 100.0 114.007 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 59.1 mtt85 -34.35 -53.32 0.5 Allowed 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 121.553 3.908 . . . . 100.0 121.553 -177.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -68.97 149.76 48.46 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 118.363 2.727 . . . . 96.37 118.363 -178.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -55.69 141.88 36.3 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 114.536 1.31 . . . . 84.37 114.536 179.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.698 ' HE ' ' CE1' ' A' ' 73' ' ' HIS . 7.0 ptt-85 -73.91 142.47 79.83 Favored Pre-proline 0 C--O 1.237 0.42 0 N-CA-C 104.796 -2.298 . . . . 70.7 104.796 178.399 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.482 ' HB3' ' O ' ' A' ' 51' ' ' HIS . 40.3 Cg_endo -69.84 161.5 45.71 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 N-CA-C 109.958 -0.824 . . . . 57.29 109.958 -179.953 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.57 HD13 ' HB3' ' A' ' 126' ' ' LEU . 71.1 mt -76.11 139.73 41.48 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 104.566 -2.383 . . . . 47.26 104.566 177.754 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 61.3 mt -107.16 126.0 51.82 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 120.857 -0.337 . . . . 42.48 110.471 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 62.6 t -120.3 131.61 72.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 N-CA-C 108.194 -1.039 . . . . 44.8 108.194 178.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -95.77 143.05 27.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.845 -0.616 . . . . 43.39 111.848 -179.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 63.2 mt -112.37 113.3 25.43 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 106.981 -1.488 . . . . 49.08 106.981 178.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' SER . . . . . 0.555 ' HB2' ' O ' ' A' 1035 ' ' HOH . 89.9 p -140.06 170.13 16.42 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 114.984 1.476 . . . . 63.77 114.984 -179.423 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -86.92 -1.34 85.0 Favored Glycine 0 CA--C 1.52 0.396 0 CA-C-N 115.201 -0.909 . . . . 78.66 112.914 179.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.469 HD22 ' CG ' ' A' ' 94' ' ' ASP . 11.4 p-10 -152.58 167.57 28.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.948 0.404 . . . . 85.35 110.359 179.559 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 73.1 p -136.21 11.52 3.29 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.464 -0.939 . . . . 87.91 108.464 179.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.711 ' OD1' ' HB3' ' A' ' 96' ' ' SER . 2.8 p30 -57.75 177.15 0.12 Allowed 'General case' 0 C--O 1.232 0.176 0 C-N-CA 120.46 -0.496 . . . . 92.14 110.493 -179.769 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LYS . . . . . 0.4 ' O ' ' C ' ' A' ' 96' ' ' SER . 84.8 tttt -48.98 -42.82 39.06 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 121.115 -0.234 . . . . 92.19 111.38 -179.27 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' SER . . . . . 0.711 ' HB3' ' OD1' ' A' ' 94' ' ' ASP . 11.4 t -40.44 -66.8 0.28 Allowed 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 108.903 -0.777 . . . . 74.71 108.903 179.066 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.1 m -55.02 -56.37 20.56 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 114.488 1.292 . . . . 59.36 114.488 -179.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . . . -49.66 -49.01 49.06 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 113.294 0.85 . . . . 53.08 113.294 -179.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -52.86 -51.86 59.45 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.135 -0.32 . . . . 79.88 110.135 178.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -58.15 -47.56 82.95 Favored 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 113.7 1.0 . . . . 59.94 113.7 -178.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 106' ' ' LEU . 91.9 m -56.59 -41.93 77.84 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 119.776 -0.77 . . . . 50.01 112.214 179.618 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.7 mtt -64.19 -56.44 14.7 Favored 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 112.99 0.737 . . . . 68.53 112.99 -178.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 45.2 m -62.68 -23.67 67.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.987 -0.552 . . . . 50.36 111.043 -179.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -103.8 8.59 37.13 Favored 'General case' 0 CA--C 1.504 -0.806 0 N-CA-C 116.282 1.956 . . . . 50.52 116.282 -178.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 82.91 7.21 87.55 Favored Glycine 0 N--CA 1.446 -0.64 0 N-CA-C 121.057 3.183 . . . . 49.74 121.057 176.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.469 ' HB2' ' HB3' ' A' ' 101' ' ' CYS . 2.8 mm? -71.84 134.91 46.4 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 106.095 -1.817 . . . . 47.63 106.095 177.854 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.45 ' OD1' ' NH2' ' A' ' 83' ' ' ARG . 25.0 m-20 -88.32 -22.71 23.71 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.74 0.644 . . . . 49.03 112.74 -179.816 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . -152.98 169.56 31.95 Favored Glycine 0 CA--C 1.502 -0.723 0 C-N-CA 119.556 -1.306 . . . . 44.2 110.399 -179.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 7.8 p -145.58 133.31 15.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 117.371 0.586 . . . . 53.03 112.249 179.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 31.4 mt -108.87 135.19 50.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.562 -0.744 . . . . 53.76 111.495 179.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . . . -87.77 136.37 32.98 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 107.286 -1.376 . . . . 54.15 107.286 178.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.545 ' HE2' ' SG ' ' A' ' 59' ' ' CYS . 44.0 mtmt -100.83 153.2 37.87 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 112.787 0.662 . . . . 65.95 112.787 -179.45 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.493 ' C ' ' HA ' ' A' ' 112' ' ' LYS . 63.2 Cg_endo -66.97 155.12 84.36 Favored 'Cis proline' 0 C--N 1.347 0.468 0 N-CA-C 108.894 -1.233 . . . . 62.34 108.894 -0.307 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.448 HG23 ' CD1' ' A' ' 26' ' ' LEU . 18.9 m -91.66 158.48 2.88 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 N-CA-C 113.082 0.771 . . . . 56.39 113.082 -178.731 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' SER . . . . . 0.638 ' HB3' ' O ' ' A' 1009 ' ' HOH . 68.0 p -143.01 156.92 44.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.464 -0.789 . . . . 56.3 109.238 -179.339 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 91.5 mt -46.35 -40.26 11.62 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 108.142 -1.058 . . . . 62.89 108.142 178.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 82.9 m-20 -54.33 -63.55 1.12 Allowed 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 114.322 1.23 . . . . 79.74 114.322 -179.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -66.9 -22.14 65.97 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 117.969 -1.492 . . . . 76.9 112.872 -179.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 66.2 mt -71.82 -48.22 52.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.088 -0.645 . . . . 62.93 110.443 178.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.613 ' HD3' ' HA ' ' A' ' 3' ' ' SER . 55.2 mtt85 -56.24 -56.78 16.76 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.485 -0.486 . . . . 67.54 112.075 179.018 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -46.13 -50.87 14.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.046 -0.525 . . . . 78.31 112.189 -179.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 92.7 t -65.44 -54.96 22.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 111.923 0.342 . . . . 62.71 111.923 -179.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 45.6 mt -55.94 -36.9 68.27 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 119.129 -1.028 . . . . 56.28 110.521 179.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' SER . . . . . 0.582 ' OG ' ' HB3' ' A' ' 2' ' ' MET . 74.0 m -64.02 -52.83 57.63 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.011 -0.676 . . . . 64.8 110.039 179.301 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -57.97 -53.49 57.66 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 120.217 -0.593 . . . . 70.7 111.092 179.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.57 ' HB3' HD13 ' A' ' 85' ' ' LEU . 87.7 mt -56.37 -47.89 77.98 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.636 0.606 . . . . 61.09 112.636 -179.624 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 83.2 mt -78.91 -28.92 43.99 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 117.005 2.224 . . . . 63.51 117.005 -178.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.404 ' HA ' ' HD3' ' A' ' 129' ' ' PRO . 97.6 mt-10 -79.32 147.96 69.67 Favored Pre-proline 0 C--O 1.237 0.411 0 N-CA-C 114.364 1.246 . . . . 71.27 114.364 -179.106 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 128' ' ' GLU . 78.0 Cg_exo -58.08 129.75 34.66 Favored 'Trans proline' 0 C--O 1.236 0.392 1 C-N-CA 125.716 4.277 . . . . 78.23 113.442 -179.997 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.708 ' HD3' ' O ' ' A' 1026 ' ' HOH . 32.7 ttm180 -132.52 140.77 48.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.133 -0.94 . . . . 90.45 108.519 178.518 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 65.8 t -137.5 126.46 34.53 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.76 0 N-CA-C 106.879 -1.526 . . . . 76.47 106.879 179.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 78.0 mt -88.11 100.49 12.99 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 107.895 -1.15 . . . . 79.13 107.895 179.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.752 ' O ' ' HG2' ' A' ' 134' ' ' GLU . . . -83.84 175.5 9.57 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 107.652 -1.24 . . . . 82.45 107.652 179.105 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.752 ' HG2' ' O ' ' A' ' 133' ' ' TYR . 3.4 mm-40 . . . . . 0 N--CA 1.474 0.754 0 C-N-CA 126.067 1.747 . . . . 96.25 109.702 -178.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1009 ' ' HOH . . . . . 0.638 ' O ' ' HB3' ' A' ' 115' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1026 ' ' HOH . . . . . 0.708 ' O ' ' HD3' ' A' ' 130' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1031 ' ' HOH . . . . . 0.47 ' O ' ' HB3' ' A' ' 134' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1035 ' ' HOH . . . . . 0.555 ' O ' ' HB2' ' A' ' 90' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1038 ' ' HOH . . . . . 0.873 ' O ' ' HG3' ' A' ' 50' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_