data_6588 save_study_list _Study_list.Sf_category study_list _Study_list.Sf_framecode study_list _Study_list.Entry_ID 6588 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 'Investigation of of human apolipoprotein A-I(1-186) in lipid-mimetic solution' 'Structure analysis' 'The data from the entries that make up this study were used to determine the structure of A-I(1-186) apolipoprotein' 6588 1 stop_ save_ ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6588 _Entry.Title ; 1H, 13C and 15N backbone resonance assignments of apolipoprotein A-I(1-186) in ipid-mimetic solution ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2005-04-12 _Entry.Accession_date 2005-04-12 _Entry.Last_release_date 2005-05-26 _Entry.Original_release_date 2005-05-26 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Mark Okon . S. . 6588 2 Philippe Frank . G. . 6588 3 Yves Marcel . L. . 6588 4 Robert Cushley . J. . 6588 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID . . NSERC . 6588 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6588 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 360 6588 '15N chemical shifts' 173 6588 '1H chemical shifts' 334 6588 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2005-05-26 2005-04-12 original author . 6588 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID . 6587 'apolipoprotein A-I' 6588 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6588 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 11163364 _Citation.Full_citation 'Okon M, Frank PG, Marcel YL, Cushley RJ. Secondary structure of human lipoprotein A-I(1-186) in lipid-mimetic solution. FEBS Lett. 487 (2001) 390-396' _Citation.Title 'Secondary structure of human lipoprotein A-I(1-186) in lipid-mimetic solution' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'FEBS Lett.' _Citation.Journal_name_full . _Citation.Journal_volume 487 _Citation.Journal_issue 3 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 390 _Citation.Page_last 396 _Citation.Year 2001 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Mark Okon . . . 6588 1 2 Philippe Frank . G. . 6588 1 3 Yves Marcel . L. . 6588 1 4 Robert Cushley . J. . 6588 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID apolipoprotein 6588 1 'chemical shift index' 6588 1 'nuclear magnetic resonance' 6588 1 'protein structure' 6588 1 'sodium dodecyl sulfate' 6588 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 6588 _Assembly.ID 1 _Assembly.Name 'apolipoprotein A-I(1-186)' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID protein 6588 1 stop_ loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'apolipoprotein A-I(1-186)' 1 $apolipoprotein_A-I(1-186) . . no native no no . . . 6588 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_apolipoprotein_A-I(1-186) _Entity.Sf_category entity _Entity.Sf_framecode apolipoprotein_A-I(1-186) _Entity.Entry_ID 6588 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'apolipoprotein A-I(1-186)' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; DEPPQSPWDRVKDLATVYVD VLKDSGRDYVSQFEGSALGK QLNLKLLDNWDSVTSTFSKL REQLGPVTQEFWDNLEKETE GLRQEMSKDLEEVKAKVQPY LDDFQKKWQEEMELYRQKVE PLRAELQEGARQKLHELQEK LSPLGEEMRDRARAHVDALR THLAPYSDELRQRLAARLEA LKENGG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 186 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 15093 . preB_ApoAI . . . . . 100.00 243 100.00 100.00 1.23e-129 . . . . 6588 1 2 no BMRB 6587 . apolipoprotein_A-I . . . . . 100.00 243 100.00 100.00 1.23e-129 . . . . 6588 1 3 no PDB 1AV1 . "Crystal Structure Of Human Apolipoprotein A-I" . . . . . 76.88 201 100.00 100.00 3.11e-95 . . . . 6588 1 4 no PDB 2A01 . "Crystal Structure Of Lipid-Free Human Apolipoprotein A-I" . . . . . 100.00 243 100.00 100.00 1.23e-129 . . . . 6588 1 5 no PDB 3J00 . "Structure Of The Ribosome-secye Complex In The Membrane Environment" . . . . . 76.88 200 100.00 100.00 3.18e-95 . . . . 6588 1 6 no PDB 3K2S . "Solution Structure Of Double Super Helix Model" . . . . . 100.00 243 100.00 100.00 1.23e-129 . . . . 6588 1 7 no PDB 3R2P . "2.2 Angstrom Crystal Structure Of C Terminal Truncated Human Apolipoprotein A-I Reveals The Assembly Of Hdl By Dimerization" . . . . . 98.92 185 100.00 100.00 1.88e-127 . . . . 6588 1 8 no DBJ BAF84920 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 267 100.00 100.00 1.68e-129 . . . . 6588 1 9 no DBJ BAI46675 . "apolipoprotein A-I [synthetic construct]" . . . . . 100.00 267 100.00 100.00 1.68e-129 . . . . 6588 1 10 no EMBL CAA25232 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 267 100.00 100.00 1.68e-129 . . . . 6588 1 11 no EMBL CAA25519 . "apolipoprotein AI precursor [Homo sapiens]" . . . . . 100.00 267 100.00 100.00 1.68e-129 . . . . 6588 1 12 no EMBL CAA26097 . "preproapolipoprotein AI [Homo sapiens]" . . . . . 100.00 267 100.00 100.00 1.68e-129 . . . . 6588 1 13 no EMBL CAA30377 . "ApoA-I [Homo sapiens]" . . . . . 100.00 267 100.00 100.00 1.68e-129 . . . . 6588 1 14 no GB AAA35545 . "proapo-A-I protein [Homo sapiens]" . . . . . 100.00 267 99.46 100.00 1.02e-128 . . . . 6588 1 15 no GB AAA51747 . "proapolipoprotein, partial [Homo sapiens]" . . . . . 100.00 249 100.00 100.00 2.86e-129 . . . . 6588 1 16 no GB AAA62829 . "proapolipoprotein [Homo sapiens]" . . . . . 100.00 267 100.00 100.00 1.68e-129 . . . . 6588 1 17 no GB AAB59514 . "preproapolipoprotein A-I [Homo sapiens]" . . . . . 100.00 267 100.00 100.00 1.68e-129 . . . . 6588 1 18 no GB AAH05380 . "Apolipoprotein A-I [Homo sapiens]" . . . . . 100.00 267 100.00 100.00 1.68e-129 . . . . 6588 1 19 no REF NP_000030 . "apolipoprotein A-I preproprotein [Homo sapiens]" . . . . . 100.00 267 100.00 100.00 1.68e-129 . . . . 6588 1 20 no REF XP_001153383 . "PREDICTED: apolipoprotein A-I [Pan troglodytes]" . . . . . 100.00 267 100.00 100.00 1.68e-129 . . . . 6588 1 21 no REF XP_001153517 . "PREDICTED: apolipoprotein A-I [Pan troglodytes]" . . . . . 100.00 267 100.00 100.00 1.68e-129 . . . . 6588 1 22 no REF XP_003253233 . "PREDICTED: apolipoprotein A-I isoform 1 [Nomascus leucogenys]" . . . . . 100.00 267 97.85 98.39 6.59e-127 . . . . 6588 1 23 no REF XP_003253235 . "PREDICTED: apolipoprotein A-I isoform 3 [Nomascus leucogenys]" . . . . . 100.00 267 97.85 98.39 6.59e-127 . . . . 6588 1 24 no SP G3QY98 . "RecName: Full=Apolipoprotein A-I; Short=Apo-AI; Short=ApoA-I; AltName: Full=Apolipoprotein A1; Contains: RecName: Full=Proapoli" . . . . . 100.00 267 100.00 100.00 1.68e-129 . . . . 6588 1 25 no SP P02647 . "RecName: Full=Apolipoprotein A-I; Short=Apo-AI; Short=ApoA-I; AltName: Full=Apolipoprotein A1; Contains: RecName: Full=Proapoli" . . . . . 100.00 267 100.00 100.00 1.68e-129 . . . . 6588 1 26 no SP P0DJG0 . "RecName: Full=Apolipoprotein A-I; Short=Apo-AI; Short=ApoA-I; AltName: Full=Apolipoprotein A1; Contains: RecName: Full=Proapoli" . . . . . 100.00 267 100.00 100.00 1.68e-129 . . . . 6588 1 27 no SP P0DJG1 . "RecName: Full=Apolipoprotein A-I; Short=Apo-AI; Short=ApoA-I; AltName: Full=Apolipoprotein A1; Contains: RecName: Full=Proapoli" . . . . . 100.00 267 97.85 99.46 1.32e-127 . . . . 6588 1 28 no SP P0DM91 . "RecName: Full=Apolipoprotein A-I; Short=Apo-AI; Short=ApoA-I; AltName: Full=Apolipoprotein A1; Contains: RecName: Full=Proapoli" . . . . . 100.00 267 99.46 99.46 7.66e-129 . . . . 6588 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID apolipoprotein . 6588 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . ASP . 6588 1 2 . GLU . 6588 1 3 . PRO . 6588 1 4 . PRO . 6588 1 5 . GLN . 6588 1 6 . SER . 6588 1 7 . PRO . 6588 1 8 . TRP . 6588 1 9 . ASP . 6588 1 10 . ARG . 6588 1 11 . VAL . 6588 1 12 . LYS . 6588 1 13 . ASP . 6588 1 14 . LEU . 6588 1 15 . ALA . 6588 1 16 . THR . 6588 1 17 . VAL . 6588 1 18 . TYR . 6588 1 19 . VAL . 6588 1 20 . ASP . 6588 1 21 . VAL . 6588 1 22 . LEU . 6588 1 23 . LYS . 6588 1 24 . ASP . 6588 1 25 . SER . 6588 1 26 . GLY . 6588 1 27 . ARG . 6588 1 28 . ASP . 6588 1 29 . TYR . 6588 1 30 . VAL . 6588 1 31 . SER . 6588 1 32 . GLN . 6588 1 33 . PHE . 6588 1 34 . GLU . 6588 1 35 . GLY . 6588 1 36 . SER . 6588 1 37 . ALA . 6588 1 38 . LEU . 6588 1 39 . GLY . 6588 1 40 . LYS . 6588 1 41 . GLN . 6588 1 42 . LEU . 6588 1 43 . ASN . 6588 1 44 . LEU . 6588 1 45 . LYS . 6588 1 46 . LEU . 6588 1 47 . LEU . 6588 1 48 . ASP . 6588 1 49 . ASN . 6588 1 50 . TRP . 6588 1 51 . ASP . 6588 1 52 . SER . 6588 1 53 . VAL . 6588 1 54 . THR . 6588 1 55 . SER . 6588 1 56 . THR . 6588 1 57 . PHE . 6588 1 58 . SER . 6588 1 59 . LYS . 6588 1 60 . LEU . 6588 1 61 . ARG . 6588 1 62 . GLU . 6588 1 63 . GLN . 6588 1 64 . LEU . 6588 1 65 . GLY . 6588 1 66 . PRO . 6588 1 67 . VAL . 6588 1 68 . THR . 6588 1 69 . GLN . 6588 1 70 . GLU . 6588 1 71 . PHE . 6588 1 72 . TRP . 6588 1 73 . ASP . 6588 1 74 . ASN . 6588 1 75 . LEU . 6588 1 76 . GLU . 6588 1 77 . LYS . 6588 1 78 . GLU . 6588 1 79 . THR . 6588 1 80 . GLU . 6588 1 81 . GLY . 6588 1 82 . LEU . 6588 1 83 . ARG . 6588 1 84 . GLN . 6588 1 85 . GLU . 6588 1 86 . MET . 6588 1 87 . SER . 6588 1 88 . LYS . 6588 1 89 . ASP . 6588 1 90 . LEU . 6588 1 91 . GLU . 6588 1 92 . GLU . 6588 1 93 . VAL . 6588 1 94 . LYS . 6588 1 95 . ALA . 6588 1 96 . LYS . 6588 1 97 . VAL . 6588 1 98 . GLN . 6588 1 99 . PRO . 6588 1 100 . TYR . 6588 1 101 . LEU . 6588 1 102 . ASP . 6588 1 103 . ASP . 6588 1 104 . PHE . 6588 1 105 . GLN . 6588 1 106 . LYS . 6588 1 107 . LYS . 6588 1 108 . TRP . 6588 1 109 . GLN . 6588 1 110 . GLU . 6588 1 111 . GLU . 6588 1 112 . MET . 6588 1 113 . GLU . 6588 1 114 . LEU . 6588 1 115 . TYR . 6588 1 116 . ARG . 6588 1 117 . GLN . 6588 1 118 . LYS . 6588 1 119 . VAL . 6588 1 120 . GLU . 6588 1 121 . PRO . 6588 1 122 . LEU . 6588 1 123 . ARG . 6588 1 124 . ALA . 6588 1 125 . GLU . 6588 1 126 . LEU . 6588 1 127 . GLN . 6588 1 128 . GLU . 6588 1 129 . GLY . 6588 1 130 . ALA . 6588 1 131 . ARG . 6588 1 132 . GLN . 6588 1 133 . LYS . 6588 1 134 . LEU . 6588 1 135 . HIS . 6588 1 136 . GLU . 6588 1 137 . LEU . 6588 1 138 . GLN . 6588 1 139 . GLU . 6588 1 140 . LYS . 6588 1 141 . LEU . 6588 1 142 . SER . 6588 1 143 . PRO . 6588 1 144 . LEU . 6588 1 145 . GLY . 6588 1 146 . GLU . 6588 1 147 . GLU . 6588 1 148 . MET . 6588 1 149 . ARG . 6588 1 150 . ASP . 6588 1 151 . ARG . 6588 1 152 . ALA . 6588 1 153 . ARG . 6588 1 154 . ALA . 6588 1 155 . HIS . 6588 1 156 . VAL . 6588 1 157 . ASP . 6588 1 158 . ALA . 6588 1 159 . LEU . 6588 1 160 . ARG . 6588 1 161 . THR . 6588 1 162 . HIS . 6588 1 163 . LEU . 6588 1 164 . ALA . 6588 1 165 . PRO . 6588 1 166 . TYR . 6588 1 167 . SER . 6588 1 168 . ASP . 6588 1 169 . GLU . 6588 1 170 . LEU . 6588 1 171 . ARG . 6588 1 172 . GLN . 6588 1 173 . ARG . 6588 1 174 . LEU . 6588 1 175 . ALA . 6588 1 176 . ALA . 6588 1 177 . ARG . 6588 1 178 . LEU . 6588 1 179 . GLU . 6588 1 180 . ALA . 6588 1 181 . LEU . 6588 1 182 . LYS . 6588 1 183 . GLU . 6588 1 184 . ASN . 6588 1 185 . GLY . 6588 1 186 . GLY . 6588 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . ASP 1 1 6588 1 . GLU 2 2 6588 1 . PRO 3 3 6588 1 . PRO 4 4 6588 1 . GLN 5 5 6588 1 . SER 6 6 6588 1 . PRO 7 7 6588 1 . TRP 8 8 6588 1 . ASP 9 9 6588 1 . ARG 10 10 6588 1 . VAL 11 11 6588 1 . LYS 12 12 6588 1 . ASP 13 13 6588 1 . LEU 14 14 6588 1 . ALA 15 15 6588 1 . THR 16 16 6588 1 . VAL 17 17 6588 1 . TYR 18 18 6588 1 . VAL 19 19 6588 1 . ASP 20 20 6588 1 . VAL 21 21 6588 1 . LEU 22 22 6588 1 . LYS 23 23 6588 1 . ASP 24 24 6588 1 . SER 25 25 6588 1 . GLY 26 26 6588 1 . ARG 27 27 6588 1 . ASP 28 28 6588 1 . TYR 29 29 6588 1 . VAL 30 30 6588 1 . SER 31 31 6588 1 . GLN 32 32 6588 1 . PHE 33 33 6588 1 . GLU 34 34 6588 1 . GLY 35 35 6588 1 . SER 36 36 6588 1 . ALA 37 37 6588 1 . LEU 38 38 6588 1 . GLY 39 39 6588 1 . LYS 40 40 6588 1 . GLN 41 41 6588 1 . LEU 42 42 6588 1 . ASN 43 43 6588 1 . LEU 44 44 6588 1 . LYS 45 45 6588 1 . LEU 46 46 6588 1 . LEU 47 47 6588 1 . ASP 48 48 6588 1 . ASN 49 49 6588 1 . TRP 50 50 6588 1 . ASP 51 51 6588 1 . SER 52 52 6588 1 . VAL 53 53 6588 1 . THR 54 54 6588 1 . SER 55 55 6588 1 . THR 56 56 6588 1 . PHE 57 57 6588 1 . SER 58 58 6588 1 . LYS 59 59 6588 1 . LEU 60 60 6588 1 . ARG 61 61 6588 1 . GLU 62 62 6588 1 . GLN 63 63 6588 1 . LEU 64 64 6588 1 . GLY 65 65 6588 1 . PRO 66 66 6588 1 . VAL 67 67 6588 1 . THR 68 68 6588 1 . GLN 69 69 6588 1 . GLU 70 70 6588 1 . PHE 71 71 6588 1 . TRP 72 72 6588 1 . ASP 73 73 6588 1 . ASN 74 74 6588 1 . LEU 75 75 6588 1 . GLU 76 76 6588 1 . LYS 77 77 6588 1 . GLU 78 78 6588 1 . THR 79 79 6588 1 . GLU 80 80 6588 1 . GLY 81 81 6588 1 . LEU 82 82 6588 1 . ARG 83 83 6588 1 . GLN 84 84 6588 1 . GLU 85 85 6588 1 . MET 86 86 6588 1 . SER 87 87 6588 1 . LYS 88 88 6588 1 . ASP 89 89 6588 1 . LEU 90 90 6588 1 . GLU 91 91 6588 1 . GLU 92 92 6588 1 . VAL 93 93 6588 1 . LYS 94 94 6588 1 . ALA 95 95 6588 1 . LYS 96 96 6588 1 . VAL 97 97 6588 1 . GLN 98 98 6588 1 . PRO 99 99 6588 1 . TYR 100 100 6588 1 . LEU 101 101 6588 1 . ASP 102 102 6588 1 . ASP 103 103 6588 1 . PHE 104 104 6588 1 . GLN 105 105 6588 1 . LYS 106 106 6588 1 . LYS 107 107 6588 1 . TRP 108 108 6588 1 . GLN 109 109 6588 1 . GLU 110 110 6588 1 . GLU 111 111 6588 1 . MET 112 112 6588 1 . GLU 113 113 6588 1 . LEU 114 114 6588 1 . TYR 115 115 6588 1 . ARG 116 116 6588 1 . GLN 117 117 6588 1 . LYS 118 118 6588 1 . VAL 119 119 6588 1 . GLU 120 120 6588 1 . PRO 121 121 6588 1 . LEU 122 122 6588 1 . ARG 123 123 6588 1 . ALA 124 124 6588 1 . GLU 125 125 6588 1 . LEU 126 126 6588 1 . GLN 127 127 6588 1 . GLU 128 128 6588 1 . GLY 129 129 6588 1 . ALA 130 130 6588 1 . ARG 131 131 6588 1 . GLN 132 132 6588 1 . LYS 133 133 6588 1 . LEU 134 134 6588 1 . HIS 135 135 6588 1 . GLU 136 136 6588 1 . LEU 137 137 6588 1 . GLN 138 138 6588 1 . GLU 139 139 6588 1 . LYS 140 140 6588 1 . LEU 141 141 6588 1 . SER 142 142 6588 1 . PRO 143 143 6588 1 . LEU 144 144 6588 1 . GLY 145 145 6588 1 . GLU 146 146 6588 1 . GLU 147 147 6588 1 . MET 148 148 6588 1 . ARG 149 149 6588 1 . ASP 150 150 6588 1 . ARG 151 151 6588 1 . ALA 152 152 6588 1 . ARG 153 153 6588 1 . ALA 154 154 6588 1 . HIS 155 155 6588 1 . VAL 156 156 6588 1 . ASP 157 157 6588 1 . ALA 158 158 6588 1 . LEU 159 159 6588 1 . ARG 160 160 6588 1 . THR 161 161 6588 1 . HIS 162 162 6588 1 . LEU 163 163 6588 1 . ALA 164 164 6588 1 . PRO 165 165 6588 1 . TYR 166 166 6588 1 . SER 167 167 6588 1 . ASP 168 168 6588 1 . GLU 169 169 6588 1 . LEU 170 170 6588 1 . ARG 171 171 6588 1 . GLN 172 172 6588 1 . ARG 173 173 6588 1 . LEU 174 174 6588 1 . ALA 175 175 6588 1 . ALA 176 176 6588 1 . ARG 177 177 6588 1 . LEU 178 178 6588 1 . GLU 179 179 6588 1 . ALA 180 180 6588 1 . LEU 181 181 6588 1 . LYS 182 182 6588 1 . GLU 183 183 6588 1 . ASN 184 184 6588 1 . GLY 185 185 6588 1 . GLY 186 186 6588 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 6588 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $apolipoprotein_A-I(1-186) . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 6588 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 6588 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $apolipoprotein_A-I(1-186) . 'recombinant technology' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6588 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6588 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'SDS was used to mimic lipid environment' _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'apolipoprotein A-I(1-186)' . 1 $assembly . . . . 2 . . mM . . . . 6588 1 2 SDS . 1 $assembly . . . . 280 . . mM . . . . 6588 1 stop_ save_ ####################### # Sample conditions # ####################### save_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode conditions_1 _Sample_condition_list.Entry_ID 6588 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.4 0.1 pH 6588 1 temperature 312 1 K 6588 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_600MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 600MHz_spectrometer _NMR_spectrometer.Entry_ID 6588 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 6588 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.251449530 . . . 1 $entry_citation . . 1 $entry_citation 6588 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1.0 . . . 1 $entry_citation . . 1 $entry_citation 6588 1 N 15 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.101329118 . . . 1 $entry_citation . . 1 $entry_citation 6588 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 6588 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.3 _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 1H15N_HSQC 1 $sample_1 isotropic 6588 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 ASP H H 1 8.33 0.02 . 1 . . . . 1 ASP H . 6588 1 2 . 1 1 1 1 ASP HA H 1 4.56 0.02 . 1 . . . . 1 ASP HA . 6588 1 3 . 1 1 1 1 ASP C C 13 175.9 0.2 . 1 . . . . 1 ASP C . 6588 1 4 . 1 1 1 1 ASP CA C 13 55.2 0.3 . 1 . . . . 1 ASP CA . 6588 1 5 . 1 1 1 1 ASP N N 15 121.2 0.1 . 1 . . . . 1 ASP N . 6588 1 6 . 1 1 2 2 GLU H H 1 7.98 0.02 . 1 . . . . 2 GLU H . 6588 1 7 . 1 1 2 2 GLU HA H 1 4.62 0.02 . 1 . . . . 2 GLU HA . 6588 1 8 . 1 1 2 2 GLU C C 13 173.6 0.2 . 1 . . . . 2 GLU C . 6588 1 9 . 1 1 2 2 GLU CA C 13 54.1 0.3 . 1 . . . . 2 GLU CA . 6588 1 10 . 1 1 2 2 GLU N N 15 120.2 0.1 . 1 . . . . 2 GLU N . 6588 1 11 . 1 1 4 4 PRO HA H 1 4.44 0.02 . 1 . . . . 4 PRO HA . 6588 1 12 . 1 1 4 4 PRO C C 13 176.7 0.2 . 1 . . . . 4 PRO C . 6588 1 13 . 1 1 4 4 PRO CA C 13 63.1 0.3 . 1 . . . . 4 PRO CA . 6588 1 14 . 1 1 5 5 GLN H H 1 8.21 0.02 . 1 . . . . 5 GLN H . 6588 1 15 . 1 1 5 5 GLN HA H 1 4.37 0.02 . 1 . . . . 5 GLN HA . 6588 1 16 . 1 1 5 5 GLN C C 13 175.7 0.2 . 1 . . . . 5 GLN C . 6588 1 17 . 1 1 5 5 GLN CA C 13 55.9 0.3 . 1 . . . . 5 GLN CA . 6588 1 18 . 1 1 5 5 GLN N N 15 119.6 0.1 . 1 . . . . 5 GLN N . 6588 1 19 . 1 1 6 6 SER H H 1 8.63 0.02 . 1 . . . . 6 SER H . 6588 1 20 . 1 1 6 6 SER C C 13 175.7 0.2 . 1 . . . . 6 SER C . 6588 1 21 . 1 1 6 6 SER CA C 13 56.5 0.3 . 1 . . . . 6 SER CA . 6588 1 22 . 1 1 6 6 SER N N 15 117.9 0.1 . 1 . . . . 6 SER N . 6588 1 23 . 1 1 7 7 PRO HA H 1 4.3 0.02 . 1 . . . . 7 PRO HA . 6588 1 24 . 1 1 7 7 PRO C C 13 177.6 0.2 . 1 . . . . 7 PRO C . 6588 1 25 . 1 1 7 7 PRO CA C 13 65.1 0.3 . 1 . . . . 7 PRO CA . 6588 1 26 . 1 1 8 8 TRP H H 1 7.71 0.02 . 1 . . . . 8 TRP H . 6588 1 27 . 1 1 8 8 TRP HA H 1 4.62 0.02 . 1 . . . . 8 TRP HA . 6588 1 28 . 1 1 8 8 TRP C C 13 177.4 0.2 . 1 . . . . 8 TRP C . 6588 1 29 . 1 1 8 8 TRP CA C 13 58.6 0.3 . 1 . . . . 8 TRP CA . 6588 1 30 . 1 1 8 8 TRP N N 15 116.2 0.1 . 1 . . . . 8 TRP N . 6588 1 31 . 1 1 9 9 ASP H H 1 7.74 0.02 . 1 . . . . 9 ASP H . 6588 1 32 . 1 1 9 9 ASP HA H 1 4.22 0.02 . 1 . . . . 9 ASP HA . 6588 1 33 . 1 1 9 9 ASP C C 13 178.6 0.2 . 1 . . . . 9 ASP C . 6588 1 34 . 1 1 9 9 ASP CA C 13 57.5 0.3 . 1 . . . . 9 ASP CA . 6588 1 35 . 1 1 9 9 ASP N N 15 118.5 0.1 . 1 . . . . 9 ASP N . 6588 1 36 . 1 1 10 10 ARG H H 1 7.76 0.02 . 1 . . . . 10 ARG H . 6588 1 37 . 1 1 10 10 ARG HA H 1 4.13 0.02 . 1 . . . . 10 ARG HA . 6588 1 38 . 1 1 10 10 ARG C C 13 178.7 0.2 . 1 . . . . 10 ARG C . 6588 1 39 . 1 1 10 10 ARG CA C 13 58.7 0.3 . 1 . . . . 10 ARG CA . 6588 1 40 . 1 1 10 10 ARG N N 15 118.1 0.1 . 1 . . . . 10 ARG N . 6588 1 41 . 1 1 11 11 VAL H H 1 7.89 0.02 . 1 . . . . 11 VAL H . 6588 1 42 . 1 1 11 11 VAL HA H 1 3.66 0.02 . 1 . . . . 11 VAL HA . 6588 1 43 . 1 1 11 11 VAL C C 13 177.3 0.2 . 1 . . . . 11 VAL C . 6588 1 44 . 1 1 11 11 VAL CA C 13 66.2 0.3 . 1 . . . . 11 VAL CA . 6588 1 45 . 1 1 11 11 VAL N N 15 118.3 0.1 . 1 . . . . 11 VAL N . 6588 1 46 . 1 1 12 12 LYS H H 1 8.03 0.02 . 1 . . . . 12 LYS H . 6588 1 47 . 1 1 12 12 LYS HA H 1 3.69 0.02 . 1 . . . . 12 LYS HA . 6588 1 48 . 1 1 12 12 LYS C C 13 178.9 0.2 . 1 . . . . 12 LYS C . 6588 1 49 . 1 1 12 12 LYS CA C 13 60.5 0.3 . 1 . . . . 12 LYS CA . 6588 1 50 . 1 1 12 12 LYS N N 15 119.2 0.1 . 1 . . . . 12 LYS N . 6588 1 51 . 1 1 13 13 ASP H H 1 7.88 0.02 . 1 . . . . 13 ASP H . 6588 1 52 . 1 1 13 13 ASP HA H 1 4.42 0.02 . 1 . . . . 13 ASP HA . 6588 1 53 . 1 1 13 13 ASP C C 13 178.8 0.2 . 1 . . . . 13 ASP C . 6588 1 54 . 1 1 13 13 ASP CA C 13 57.2 0.3 . 1 . . . . 13 ASP CA . 6588 1 55 . 1 1 13 13 ASP N N 15 119 0.1 . 1 . . . . 13 ASP N . 6588 1 56 . 1 1 14 14 LEU H H 1 7.87 0.02 . 1 . . . . 14 LEU H . 6588 1 57 . 1 1 14 14 LEU HA H 1 4.19 0.02 . 1 . . . . 14 LEU HA . 6588 1 58 . 1 1 14 14 LEU C C 13 178.8 0.2 . 1 . . . . 14 LEU C . 6588 1 59 . 1 1 14 14 LEU CA C 13 57.6 0.3 . 1 . . . . 14 LEU CA . 6588 1 60 . 1 1 14 14 LEU N N 15 120.2 0.1 . 1 . . . . 14 LEU N . 6588 1 61 . 1 1 15 15 ALA H H 1 8.48 0.02 . 1 . . . . 15 ALA H . 6588 1 62 . 1 1 15 15 ALA HA H 1 4.08 0.02 . 1 . . . . 15 ALA HA . 6588 1 63 . 1 1 15 15 ALA C C 13 179.1 0.2 . 1 . . . . 15 ALA C . 6588 1 64 . 1 1 15 15 ALA CA C 13 55.2 0.3 . 1 . . . . 15 ALA CA . 6588 1 65 . 1 1 15 15 ALA N N 15 119.7 0.1 . 1 . . . . 15 ALA N . 6588 1 66 . 1 1 16 16 THR H H 1 7.87 0.02 . 1 . . . . 16 THR H . 6588 1 67 . 1 1 16 16 THR HA H 1 3.95 0.02 . 1 . . . . 16 THR HA . 6588 1 68 . 1 1 16 16 THR C C 13 176.2 0.2 . 1 . . . . 16 THR C . 6588 1 69 . 1 1 16 16 THR CA C 13 66.4 0.3 . 1 . . . . 16 THR CA . 6588 1 70 . 1 1 16 16 THR N N 15 110 0.1 . 1 . . . . 16 THR N . 6588 1 71 . 1 1 17 17 VAL H H 1 7.45 0.02 . 1 . . . . 17 VAL H . 6588 1 72 . 1 1 17 17 VAL HA H 1 3.8 0.02 . 1 . . . . 17 VAL HA . 6588 1 73 . 1 1 17 17 VAL C C 13 178.2 0.2 . 1 . . . . 17 VAL C . 6588 1 74 . 1 1 17 17 VAL CA C 13 65.5 0.3 . 1 . . . . 17 VAL CA . 6588 1 75 . 1 1 17 17 VAL N N 15 120.3 0.1 . 1 . . . . 17 VAL N . 6588 1 76 . 1 1 18 18 TYR H H 1 7.78 0.02 . 1 . . . . 18 TYR H . 6588 1 77 . 1 1 18 18 TYR HA H 1 4.4 0.02 . 1 . . . . 18 TYR HA . 6588 1 78 . 1 1 18 18 TYR C C 13 177.6 0.2 . 1 . . . . 18 TYR C . 6588 1 79 . 1 1 18 18 TYR CA C 13 61.3 0.3 . 1 . . . . 18 TYR CA . 6588 1 80 . 1 1 18 18 TYR N N 15 117.8 0.1 . 1 . . . . 18 TYR N . 6588 1 81 . 1 1 19 19 VAL H H 1 8.2 0.02 . 1 . . . . 19 VAL H . 6588 1 82 . 1 1 19 19 VAL HA H 1 3.68 0.02 . 1 . . . . 19 VAL HA . 6588 1 83 . 1 1 19 19 VAL C C 13 177.2 0.2 . 1 . . . . 19 VAL C . 6588 1 84 . 1 1 19 19 VAL CA C 13 67.4 0.3 . 1 . . . . 19 VAL CA . 6588 1 85 . 1 1 19 19 VAL N N 15 119.7 0.1 . 1 . . . . 19 VAL N . 6588 1 86 . 1 1 20 20 ASP H H 1 7.9 0.02 . 1 . . . . 20 ASP H . 6588 1 87 . 1 1 20 20 ASP HA H 1 4.45 0.02 . 1 . . . . 20 ASP HA . 6588 1 88 . 1 1 20 20 ASP C C 13 178.7 0.2 . 1 . . . . 20 ASP C . 6588 1 89 . 1 1 20 20 ASP CA C 13 57.4 0.3 . 1 . . . . 20 ASP CA . 6588 1 90 . 1 1 20 20 ASP N N 15 119.1 0.1 . 1 . . . . 20 ASP N . 6588 1 91 . 1 1 21 21 VAL H H 1 7.58 0.02 . 1 . . . . 21 VAL H . 6588 1 92 . 1 1 21 21 VAL HA H 1 3.92 0.02 . 1 . . . . 21 VAL HA . 6588 1 93 . 1 1 21 21 VAL C C 13 178.7 0.2 . 1 . . . . 21 VAL C . 6588 1 94 . 1 1 21 21 VAL CA C 13 65.7 0.3 . 1 . . . . 21 VAL CA . 6588 1 95 . 1 1 21 21 VAL N N 15 118.8 0.1 . 1 . . . . 21 VAL N . 6588 1 96 . 1 1 22 22 LEU H H 1 8.01 0.02 . 1 . . . . 22 LEU H . 6588 1 97 . 1 1 22 22 LEU HA H 1 4.08 0.02 . 1 . . . . 22 LEU HA . 6588 1 98 . 1 1 22 22 LEU C C 13 179.2 0.2 . 1 . . . . 22 LEU C . 6588 1 99 . 1 1 22 22 LEU CA C 13 57.9 0.3 . 1 . . . . 22 LEU CA . 6588 1 100 . 1 1 22 22 LEU N N 15 120.7 0.1 . 1 . . . . 22 LEU N . 6588 1 101 . 1 1 23 23 LYS H H 1 8.34 0.02 . 1 . . . . 23 LYS H . 6588 1 102 . 1 1 23 23 LYS HA H 1 4 0.02 . 1 . . . . 23 LYS HA . 6588 1 103 . 1 1 23 23 LYS C C 13 178 0.2 . 1 . . . . 23 LYS C . 6588 1 104 . 1 1 23 23 LYS CA C 13 59.7 0.3 . 1 . . . . 23 LYS CA . 6588 1 105 . 1 1 23 23 LYS N N 15 118.5 0.1 . 1 . . . . 23 LYS N . 6588 1 106 . 1 1 24 24 ASP H H 1 7.99 0.02 . 1 . . . . 24 ASP H . 6588 1 107 . 1 1 24 24 ASP HA H 1 4.62 0.02 . 1 . . . . 24 ASP HA . 6588 1 108 . 1 1 24 24 ASP C C 13 178.1 0.2 . 1 . . . . 24 ASP C . 6588 1 109 . 1 1 24 24 ASP CA C 13 56.4 0.3 . 1 . . . . 24 ASP CA . 6588 1 110 . 1 1 24 24 ASP N N 15 118.5 0.1 . 1 . . . . 24 ASP N . 6588 1 111 . 1 1 25 25 SER H H 1 8.18 0.02 . 1 . . . . 25 SER H . 6588 1 112 . 1 1 25 25 SER HA H 1 4.5 0.02 . 1 . . . . 25 SER HA . 6588 1 113 . 1 1 25 25 SER C C 13 176.2 0.2 . 1 . . . . 25 SER C . 6588 1 114 . 1 1 25 25 SER CA C 13 60.7 0.3 . 1 . . . . 25 SER CA . 6588 1 115 . 1 1 25 25 SER N N 15 114.9 0.1 . 1 . . . . 25 SER N . 6588 1 116 . 1 1 26 26 GLY H H 1 8.52 0.02 . 1 . . . . 26 GLY H . 6588 1 117 . 1 1 26 26 GLY HA2 H 1 3.9 0.02 . 1 . . . . 26 GLY HA2 . 6588 1 118 . 1 1 26 26 GLY HA3 H 1 3.9 0.02 . 1 . . . . 26 GLY HA3 . 6588 1 119 . 1 1 26 26 GLY C C 13 174.7 0.2 . 1 . . . . 26 GLY C . 6588 1 120 . 1 1 26 26 GLY CA C 13 47.1 0.3 . 1 . . . . 26 GLY CA . 6588 1 121 . 1 1 26 26 GLY N N 15 110.3 0.1 . 1 . . . . 26 GLY N . 6588 1 122 . 1 1 27 27 ARG H H 1 8.15 0.02 . 1 . . . . 27 ARG H . 6588 1 123 . 1 1 27 27 ARG HA H 1 4.06 0.02 . 1 . . . . 27 ARG HA . 6588 1 124 . 1 1 27 27 ARG C C 13 177.7 0.2 . 1 . . . . 27 ARG C . 6588 1 125 . 1 1 27 27 ARG CA C 13 58.6 0.3 . 1 . . . . 27 ARG CA . 6588 1 126 . 1 1 27 27 ARG N N 15 120.2 0.1 . 1 . . . . 27 ARG N . 6588 1 127 . 1 1 28 28 ASP H H 1 8.08 0.02 . 1 . . . . 28 ASP H . 6588 1 128 . 1 1 28 28 ASP HA H 1 4.5 0.02 . 1 . . . . 28 ASP HA . 6588 1 129 . 1 1 28 28 ASP C C 13 177.9 0.2 . 1 . . . . 28 ASP C . 6588 1 130 . 1 1 28 28 ASP CA C 13 56.2 0.3 . 1 . . . . 28 ASP CA . 6588 1 131 . 1 1 28 28 ASP N N 15 120 0.1 . 1 . . . . 28 ASP N . 6588 1 132 . 1 1 29 29 TYR H H 1 8.01 0.02 . 1 . . . . 29 TYR H . 6588 1 133 . 1 1 29 29 TYR HA H 1 4.29 0.02 . 1 . . . . 29 TYR HA . 6588 1 134 . 1 1 29 29 TYR C C 13 177.9 0.2 . 1 . . . . 29 TYR C . 6588 1 135 . 1 1 29 29 TYR CA C 13 61.3 0.3 . 1 . . . . 29 TYR CA . 6588 1 136 . 1 1 29 29 TYR N N 15 120 0.1 . 1 . . . . 29 TYR N . 6588 1 137 . 1 1 30 30 VAL H H 1 7.97 0.02 . 1 . . . . 30 VAL H . 6588 1 138 . 1 1 30 30 VAL HA H 1 3.85 0.02 . 1 . . . . 30 VAL HA . 6588 1 139 . 1 1 30 30 VAL C C 13 177.8 0.2 . 1 . . . . 30 VAL C . 6588 1 140 . 1 1 30 30 VAL CA C 13 65.6 0.3 . 1 . . . . 30 VAL CA . 6588 1 141 . 1 1 30 30 VAL N N 15 116.4 0.1 . 1 . . . . 30 VAL N . 6588 1 142 . 1 1 31 31 SER H H 1 7.93 0.02 . 1 . . . . 31 SER H . 6588 1 143 . 1 1 31 31 SER HA H 1 4.32 0.02 . 1 . . . . 31 SER HA . 6588 1 144 . 1 1 31 31 SER C C 13 176.1 0.2 . 1 . . . . 31 SER C . 6588 1 145 . 1 1 31 31 SER CA C 13 61 0.3 . 1 . . . . 31 SER CA . 6588 1 146 . 1 1 31 31 SER N N 15 115.1 0.1 . 1 . . . . 31 SER N . 6588 1 147 . 1 1 32 32 GLN H H 1 7.65 0.02 . 1 . . . . 32 GLN H . 6588 1 148 . 1 1 32 32 GLN HA H 1 4.2 0.02 . 1 . . . . 32 GLN HA . 6588 1 149 . 1 1 32 32 GLN C C 13 176.5 0.2 . 1 . . . . 32 GLN C . 6588 1 150 . 1 1 32 32 GLN CA C 13 57 0.3 . 1 . . . . 32 GLN CA . 6588 1 151 . 1 1 32 32 GLN N N 15 119.3 0.1 . 1 . . . . 32 GLN N . 6588 1 152 . 1 1 33 33 PHE H H 1 7.77 0.02 . 1 . . . . 33 PHE H . 6588 1 153 . 1 1 33 33 PHE HA H 1 4.52 0.02 . 1 . . . . 33 PHE HA . 6588 1 154 . 1 1 33 33 PHE C C 13 176.4 0.2 . 1 . . . . 33 PHE C . 6588 1 155 . 1 1 33 33 PHE CA C 13 58.8 0.3 . 1 . . . . 33 PHE CA . 6588 1 156 . 1 1 33 33 PHE N N 15 119.3 0.1 . 1 . . . . 33 PHE N . 6588 1 157 . 1 1 34 34 GLU H H 1 8.09 0.02 . 1 . . . . 34 GLU H . 6588 1 158 . 1 1 34 34 GLU HA H 1 4.18 0.02 . 1 . . . . 34 GLU HA . 6588 1 159 . 1 1 34 34 GLU C C 13 177.1 0.2 . 1 . . . . 34 GLU C . 6588 1 160 . 1 1 34 34 GLU CA C 13 57.5 0.3 . 1 . . . . 34 GLU CA . 6588 1 161 . 1 1 34 34 GLU N N 15 122.3 0.1 . 1 . . . . 34 GLU N . 6588 1 162 . 1 1 35 35 GLY H H 1 7.98 0.02 . 1 . . . . 35 GLY H . 6588 1 163 . 1 1 35 35 GLY HA2 H 1 4 0.02 . 1 . . . . 35 GLY HA2 . 6588 1 164 . 1 1 35 35 GLY HA3 H 1 3.95 0.02 . 1 . . . . 35 GLY HA3 . 6588 1 165 . 1 1 35 35 GLY C C 13 174.6 0.2 . 1 . . . . 35 GLY C . 6588 1 166 . 1 1 35 35 GLY CA C 13 46 0.3 . 1 . . . . 35 GLY CA . 6588 1 167 . 1 1 35 35 GLY N N 15 109.3 0.1 . 1 . . . . 35 GLY N . 6588 1 168 . 1 1 36 36 SER H H 1 7.91 0.02 . 1 . . . . 36 SER H . 6588 1 169 . 1 1 36 36 SER HA H 1 4.45 0.02 . 1 . . . . 36 SER HA . 6588 1 170 . 1 1 36 36 SER C C 13 174.6 0.2 . 1 . . . . 36 SER C . 6588 1 171 . 1 1 36 36 SER CA C 13 59.1 0.3 . 1 . . . . 36 SER CA . 6588 1 172 . 1 1 36 36 SER N N 15 115.4 0.1 . 1 . . . . 36 SER N . 6588 1 173 . 1 1 37 37 ALA H H 1 8.29 0.02 . 1 . . . . 37 ALA H . 6588 1 174 . 1 1 37 37 ALA HA H 1 4.29 0.02 . 1 . . . . 37 ALA HA . 6588 1 175 . 1 1 37 37 ALA C C 13 178.3 0.2 . 1 . . . . 37 ALA C . 6588 1 176 . 1 1 37 37 ALA CA C 13 53.5 0.3 . 1 . . . . 37 ALA CA . 6588 1 177 . 1 1 37 37 ALA N N 15 124.9 0.1 . 1 . . . . 37 ALA N . 6588 1 178 . 1 1 38 38 LEU H H 1 7.89 0.02 . 1 . . . . 38 LEU H . 6588 1 179 . 1 1 38 38 LEU HA H 1 4.18 0.02 . 1 . . . . 38 LEU HA . 6588 1 180 . 1 1 38 38 LEU C C 13 178.2 0.2 . 1 . . . . 38 LEU C . 6588 1 181 . 1 1 38 38 LEU CA C 13 56.6 0.3 . 1 . . . . 38 LEU CA . 6588 1 182 . 1 1 38 38 LEU N N 15 118.6 0.1 . 1 . . . . 38 LEU N . 6588 1 183 . 1 1 39 39 GLY H H 1 8.17 0.02 . 1 . . . . 39 GLY H . 6588 1 184 . 1 1 39 39 GLY HA2 H 1 3.86 0.02 . 1 . . . . 39 GLY HA2 . 6588 1 185 . 1 1 39 39 GLY HA3 H 1 3.75 0.02 . 1 . . . . 39 GLY HA3 . 6588 1 186 . 1 1 39 39 GLY C C 13 175.1 0.2 . 1 . . . . 39 GLY C . 6588 1 187 . 1 1 39 39 GLY CA C 13 46.5 0.3 . 1 . . . . 39 GLY CA . 6588 1 188 . 1 1 39 39 GLY N N 15 107.2 0.1 . 1 . . . . 39 GLY N . 6588 1 189 . 1 1 40 40 LYS H H 1 7.72 0.02 . 1 . . . . 40 LYS H . 6588 1 190 . 1 1 40 40 LYS HA H 1 4.26 0.02 . 1 . . . . 40 LYS HA . 6588 1 191 . 1 1 40 40 LYS C C 13 177.1 0.2 . 1 . . . . 40 LYS C . 6588 1 192 . 1 1 40 40 LYS CA C 13 57.1 0.3 . 1 . . . . 40 LYS CA . 6588 1 193 . 1 1 40 40 LYS N N 15 119.1 0.1 . 1 . . . . 40 LYS N . 6588 1 194 . 1 1 41 41 GLN H H 1 8.04 0.02 . 1 . . . . 41 GLN H . 6588 1 195 . 1 1 41 41 GLN HA H 1 4.3 0.02 . 1 . . . . 41 GLN HA . 6588 1 196 . 1 1 41 41 GLN C C 13 176.5 0.2 . 1 . . . . 41 GLN C . 6588 1 197 . 1 1 41 41 GLN CA C 13 56.6 0.3 . 1 . . . . 41 GLN CA . 6588 1 198 . 1 1 41 41 GLN N N 15 118.1 0.1 . 1 . . . . 41 GLN N . 6588 1 199 . 1 1 42 42 LEU H H 1 7.92 0.03 . 1 . . . . 42 LEU H . 6588 1 200 . 1 1 42 42 LEU HA H 1 4.25 0.02 . 1 . . . . 42 LEU HA . 6588 1 201 . 1 1 42 42 LEU C C 13 176.9 0.2 . 1 . . . . 42 LEU C . 6588 1 202 . 1 1 42 42 LEU CA C 13 56 0.3 . 1 . . . . 42 LEU CA . 6588 1 203 . 1 1 42 42 LEU N N 15 120.7 0.1 . 1 . . . . 42 LEU N . 6588 1 204 . 1 1 43 43 ASN H H 1 8.22 0.02 . 1 . . . . 43 ASN H . 6588 1 205 . 1 1 43 43 ASN HA H 1 4.61 0.02 . 1 . . . . 43 ASN HA . 6588 1 206 . 1 1 43 43 ASN C C 13 175.3 0.2 . 1 . . . . 43 ASN C . 6588 1 207 . 1 1 43 43 ASN CA C 13 54.2 0.3 . 1 . . . . 43 ASN CA . 6588 1 208 . 1 1 43 43 ASN N N 15 118.7 0.1 . 1 . . . . 43 ASN N . 6588 1 209 . 1 1 44 44 LEU H H 1 7.85 0.02 . 1 . . . . 44 LEU H . 6588 1 210 . 1 1 44 44 LEU HA H 1 4.23 0.02 . 1 . . . . 44 LEU HA . 6588 1 211 . 1 1 44 44 LEU C C 13 177.7 0.2 . 1 . . . . 44 LEU C . 6588 1 212 . 1 1 44 44 LEU CA C 13 56.2 0.3 . 1 . . . . 44 LEU CA . 6588 1 213 . 1 1 44 44 LEU N N 15 120 0.1 . 1 . . . . 44 LEU N . 6588 1 214 . 1 1 45 45 LYS H H 1 8.15 0.02 . 1 . . . . 45 LYS H . 6588 1 215 . 1 1 45 45 LYS HA H 1 4.21 0.02 . 1 . . . . 45 LYS HA . 6588 1 216 . 1 1 45 45 LYS C C 13 178.1 0.2 . 1 . . . . 45 LYS C . 6588 1 217 . 1 1 45 45 LYS CA C 13 57.7 0.3 . 1 . . . . 45 LYS CA . 6588 1 218 . 1 1 45 45 LYS N N 15 120.7 0.1 . 1 . . . . 45 LYS N . 6588 1 219 . 1 1 46 46 LEU H H 1 7.96 0.02 . 1 . . . . 46 LEU H . 6588 1 220 . 1 1 46 46 LEU HA H 1 4.15 0.02 . 1 . . . . 46 LEU HA . 6588 1 221 . 1 1 46 46 LEU C C 13 178 0.2 . 1 . . . . 46 LEU C . 6588 1 222 . 1 1 46 46 LEU CA C 13 57.6 0.3 . 1 . . . . 46 LEU CA . 6588 1 223 . 1 1 46 46 LEU N N 15 119.8 0.1 . 1 . . . . 46 LEU N . 6588 1 224 . 1 1 47 47 LEU H H 1 7.66 0.02 . 1 . . . . 47 LEU H . 6588 1 225 . 1 1 47 47 LEU HA H 1 4.2 0.02 . 1 . . . . 47 LEU HA . 6588 1 226 . 1 1 47 47 LEU C C 13 179.1 0.2 . 1 . . . . 47 LEU C . 6588 1 227 . 1 1 47 47 LEU CA C 13 57 0.3 . 1 . . . . 47 LEU CA . 6588 1 228 . 1 1 47 47 LEU N N 15 116.6 0.1 . 1 . . . . 47 LEU N . 6588 1 229 . 1 1 48 48 ASP H H 1 8.04 0.02 . 1 . . . . 48 ASP H . 6588 1 230 . 1 1 48 48 ASP HA H 1 4.57 0.02 . 1 . . . . 48 ASP HA . 6588 1 231 . 1 1 48 48 ASP C C 13 177.2 0.2 . 1 . . . . 48 ASP C . 6588 1 232 . 1 1 48 48 ASP CA C 13 56.5 0.3 . 1 . . . . 48 ASP CA . 6588 1 233 . 1 1 48 48 ASP N N 15 119.2 0.1 . 1 . . . . 48 ASP N . 6588 1 234 . 1 1 49 49 ASN H H 1 7.86 0.02 . 1 . . . . 49 ASN H . 6588 1 235 . 1 1 49 49 ASN HA H 1 5.03 0.02 . 1 . . . . 49 ASN HA . 6588 1 236 . 1 1 49 49 ASN C C 13 175.7 0.2 . 1 . . . . 49 ASN C . 6588 1 237 . 1 1 49 49 ASN CA C 13 53.4 0.3 . 1 . . . . 49 ASN CA . 6588 1 238 . 1 1 49 49 ASN N N 15 116 0.1 . 1 . . . . 49 ASN N . 6588 1 239 . 1 1 50 50 TRP H H 1 7.95 0.02 . 1 . . . . 50 TRP H . 6588 1 240 . 1 1 50 50 TRP HA H 1 4.52 0.02 . 1 . . . . 50 TRP HA . 6588 1 241 . 1 1 50 50 TRP C C 13 177.2 0.2 . 1 . . . . 50 TRP C . 6588 1 242 . 1 1 50 50 TRP CA C 13 59.9 0.3 . 1 . . . . 50 TRP CA . 6588 1 243 . 1 1 50 50 TRP N N 15 123 0.1 . 1 . . . . 50 TRP N . 6588 1 244 . 1 1 51 51 ASP H H 1 8.54 0.02 . 1 . . . . 51 ASP H . 6588 1 245 . 1 1 51 51 ASP HA H 1 4.39 0.02 . 1 . . . . 51 ASP HA . 6588 1 246 . 1 1 51 51 ASP C C 13 178.5 0.2 . 1 . . . . 51 ASP C . 6588 1 247 . 1 1 51 51 ASP CA C 13 56.9 0.3 . 1 . . . . 51 ASP CA . 6588 1 248 . 1 1 51 51 ASP N N 15 118.4 0.1 . 1 . . . . 51 ASP N . 6588 1 249 . 1 1 52 52 SER H H 1 7.88 0.02 . 1 . . . . 52 SER H . 6588 1 250 . 1 1 52 52 SER HA H 1 4.38 0.02 . 1 . . . . 52 SER HA . 6588 1 251 . 1 1 52 52 SER C C 13 176.6 0.2 . 1 . . . . 52 SER C . 6588 1 252 . 1 1 52 52 SER CA C 13 61.2 0.3 . 1 . . . . 52 SER CA . 6588 1 253 . 1 1 52 52 SER N N 15 115.5 0.1 . 1 . . . . 52 SER N . 6588 1 254 . 1 1 53 53 VAL H H 1 7.97 0.02 . 1 . . . . 53 VAL H . 6588 1 255 . 1 1 53 53 VAL HA H 1 3.6 0.02 . 1 . . . . 53 VAL HA . 6588 1 256 . 1 1 53 53 VAL C C 13 177.9 0.2 . 1 . . . . 53 VAL C . 6588 1 257 . 1 1 53 53 VAL CA C 13 66.6 0.3 . 1 . . . . 53 VAL CA . 6588 1 258 . 1 1 53 53 VAL N N 15 123.6 0.1 . 1 . . . . 53 VAL N . 6588 1 259 . 1 1 54 54 THR H H 1 8.11 0.02 . 1 . . . . 54 THR H . 6588 1 260 . 1 1 54 54 THR HA H 1 3.8 0.02 . 1 . . . . 54 THR HA . 6588 1 261 . 1 1 54 54 THR C C 13 178 0.2 . 1 . . . . 54 THR C . 6588 1 262 . 1 1 54 54 THR CA C 13 66 0.3 . 1 . . . . 54 THR CA . 6588 1 263 . 1 1 54 54 THR N N 15 111.3 0.1 . 1 . . . . 54 THR N . 6588 1 264 . 1 1 55 55 SER H H 1 7.93 0.02 . 1 . . . . 55 SER H . 6588 1 265 . 1 1 55 55 SER HA H 1 4.29 0.02 . 1 . . . . 55 SER HA . 6588 1 266 . 1 1 55 55 SER C C 13 177.2 0.2 . 1 . . . . 55 SER C . 6588 1 267 . 1 1 55 55 SER CA C 13 61.7 0.3 . 1 . . . . 55 SER CA . 6588 1 268 . 1 1 55 55 SER N N 15 118.6 0.1 . 1 . . . . 55 SER N . 6588 1 269 . 1 1 56 56 THR H H 1 7.88 0.02 . 1 . . . . 56 THR H . 6588 1 270 . 1 1 56 56 THR HA H 1 4.35 0.02 . 1 . . . . 56 THR HA . 6588 1 271 . 1 1 56 56 THR C C 13 175.9 0.2 . 1 . . . . 56 THR C . 6588 1 272 . 1 1 56 56 THR CA C 13 67.3 0.3 . 1 . . . . 56 THR CA . 6588 1 273 . 1 1 56 56 THR N N 15 119.5 0.1 . 1 . . . . 56 THR N . 6588 1 274 . 1 1 57 57 PHE H H 1 8.38 0.02 . 1 . . . . 57 PHE H . 6588 1 275 . 1 1 57 57 PHE HA H 1 4.15 0.02 . 1 . . . . 57 PHE HA . 6588 1 276 . 1 1 57 57 PHE C C 13 177.1 0.2 . 1 . . . . 57 PHE C . 6588 1 277 . 1 1 57 57 PHE CA C 13 61.8 0.3 . 1 . . . . 57 PHE CA . 6588 1 278 . 1 1 57 57 PHE N N 15 120.9 0.1 . 1 . . . . 57 PHE N . 6588 1 279 . 1 1 58 58 SER H H 1 8.24 0.02 . 1 . . . . 58 SER H . 6588 1 280 . 1 1 58 58 SER HA H 1 4.07 0.02 . 1 . . . . 58 SER HA . 6588 1 281 . 1 1 58 58 SER C C 13 176.9 0.2 . 1 . . . . 58 SER C . 6588 1 282 . 1 1 58 58 SER CA C 13 62.1 0.3 . 1 . . . . 58 SER CA . 6588 1 283 . 1 1 58 58 SER N N 15 113.7 0.1 . 1 . . . . 58 SER N . 6588 1 284 . 1 1 59 59 LYS H H 1 7.67 0.02 . 1 . . . . 59 LYS H . 6588 1 285 . 1 1 59 59 LYS HA H 1 4.15 0.02 . 1 . . . . 59 LYS HA . 6588 1 286 . 1 1 59 59 LYS C C 13 179.2 0.2 . 1 . . . . 59 LYS C . 6588 1 287 . 1 1 59 59 LYS CA C 13 59.2 0.3 . 1 . . . . 59 LYS CA . 6588 1 288 . 1 1 59 59 LYS N N 15 121.9 0.1 . 1 . . . . 59 LYS N . 6588 1 289 . 1 1 60 60 LEU H H 1 8.02 0.02 . 1 . . . . 60 LEU H . 6588 1 290 . 1 1 60 60 LEU HA H 1 4.08 0.02 . 1 . . . . 60 LEU HA . 6588 1 291 . 1 1 60 60 LEU C C 13 178.9 0.2 . 1 . . . . 60 LEU C . 6588 1 292 . 1 1 60 60 LEU CA C 13 57.8 0.3 . 1 . . . . 60 LEU CA . 6588 1 293 . 1 1 60 60 LEU N N 15 120 0.1 . 1 . . . . 60 LEU N . 6588 1 294 . 1 1 61 61 ARG H H 1 8.26 0.02 . 1 . . . . 61 ARG H . 6588 1 295 . 1 1 61 61 ARG HA H 1 3.76 0.02 . 1 . . . . 61 ARG HA . 6588 1 296 . 1 1 61 61 ARG C C 13 178.9 0.2 . 1 . . . . 61 ARG C . 6588 1 297 . 1 1 61 61 ARG CA C 13 59.9 0.3 . 1 . . . . 61 ARG CA . 6588 1 298 . 1 1 61 61 ARG N N 15 118.3 0.1 . 1 . . . . 61 ARG N . 6588 1 299 . 1 1 62 62 GLU H H 1 7.75 0.02 . 1 . . . . 62 GLU H . 6588 1 300 . 1 1 62 62 GLU HA H 1 4.08 0.02 . 1 . . . . 62 GLU HA . 6588 1 301 . 1 1 62 62 GLU C C 13 178.4 0.2 . 1 . . . . 62 GLU C . 6588 1 302 . 1 1 62 62 GLU CA C 13 58.9 0.3 . 1 . . . . 62 GLU CA . 6588 1 303 . 1 1 62 62 GLU N N 15 118 0.1 . 1 . . . . 62 GLU N . 6588 1 304 . 1 1 63 63 GLN H H 1 7.83 0.02 . 1 . . . . 63 GLN H . 6588 1 305 . 1 1 63 63 GLN HA H 1 4.27 0.02 . 1 . . . . 63 GLN HA . 6588 1 306 . 1 1 63 63 GLN C C 13 177.4 0.2 . 1 . . . . 63 GLN C . 6588 1 307 . 1 1 63 63 GLN CA C 13 57.4 0.3 . 1 . . . . 63 GLN CA . 6588 1 308 . 1 1 63 63 GLN N N 15 116.6 0.1 . 1 . . . . 63 GLN N . 6588 1 309 . 1 1 64 64 LEU H H 1 8.1 0.02 . 1 . . . . 64 LEU H . 6588 1 310 . 1 1 64 64 LEU HA H 1 4.3 0.02 . 1 . . . . 64 LEU HA . 6588 1 311 . 1 1 64 64 LEU C C 13 178.4 0.2 . 1 . . . . 64 LEU C . 6588 1 312 . 1 1 64 64 LEU CA C 13 56.1 0.3 . 1 . . . . 64 LEU CA . 6588 1 313 . 1 1 64 64 LEU N N 15 117.5 0.1 . 1 . . . . 64 LEU N . 6588 1 314 . 1 1 65 65 GLY H H 1 8.07 0.02 . 1 . . . . 65 GLY H . 6588 1 315 . 1 1 65 65 GLY HA2 H 1 3.95 0.02 . 1 . . . . 65 GLY HA2 . 6588 1 316 . 1 1 65 65 GLY HA3 H 1 4.2 0.02 . 1 . . . . 65 GLY HA3 . 6588 1 317 . 1 1 65 65 GLY C C 13 173.6 0.2 . 1 . . . . 65 GLY C . 6588 1 318 . 1 1 65 65 GLY CA C 13 48 0.3 . 1 . . . . 65 GLY CA . 6588 1 319 . 1 1 65 65 GLY N N 15 108.5 0.1 . 1 . . . . 65 GLY N . 6588 1 320 . 1 1 66 66 PRO HA H 1 4.4 0.02 . 1 . . . . 66 PRO HA . 6588 1 321 . 1 1 66 66 PRO C C 13 178.9 0.2 . 1 . . . . 66 PRO C . 6588 1 322 . 1 1 66 66 PRO CA C 13 65.1 0.3 . 1 . . . . 66 PRO CA . 6588 1 323 . 1 1 67 67 VAL H H 1 7.52 0.02 . 1 . . . . 67 VAL H . 6588 1 324 . 1 1 67 67 VAL HA H 1 4.02 0.02 . 1 . . . . 67 VAL HA . 6588 1 325 . 1 1 67 67 VAL C C 13 177.8 0.2 . 1 . . . . 67 VAL C . 6588 1 326 . 1 1 67 67 VAL CA C 13 64.7 0.3 . 1 . . . . 67 VAL CA . 6588 1 327 . 1 1 67 67 VAL N N 15 116.7 0.1 . 1 . . . . 67 VAL N . 6588 1 328 . 1 1 68 68 THR H H 1 8.05 0.02 . 1 . . . . 68 THR H . 6588 1 329 . 1 1 68 68 THR HA H 1 4.16 0.02 . 1 . . . . 68 THR HA . 6588 1 330 . 1 1 68 68 THR C C 13 176.2 0.2 . 1 . . . . 68 THR C . 6588 1 331 . 1 1 68 68 THR CA C 13 65.1 0.3 . 1 . . . . 68 THR CA . 6588 1 332 . 1 1 68 68 THR N N 15 113.9 0.1 . 1 . . . . 68 THR N . 6588 1 333 . 1 1 69 69 GLN H H 1 8.15 0.02 . 1 . . . . 69 GLN H . 6588 1 334 . 1 1 69 69 GLN HA H 1 4.15 0.02 . 1 . . . . 69 GLN HA . 6588 1 335 . 1 1 69 69 GLN C C 13 177.8 0.2 . 1 . . . . 69 GLN C . 6588 1 336 . 1 1 69 69 GLN CA C 13 59 0.3 . 1 . . . . 69 GLN CA . 6588 1 337 . 1 1 69 69 GLN N N 15 120.5 0.1 . 1 . . . . 69 GLN N . 6588 1 338 . 1 1 70 70 GLU H H 1 7.93 0.02 . 1 . . . . 70 GLU H . 6588 1 339 . 1 1 70 70 GLU HA H 1 4.14 0.02 . 1 . . . . 70 GLU HA . 6588 1 340 . 1 1 70 70 GLU C C 13 178.2 0.2 . 1 . . . . 70 GLU C . 6588 1 341 . 1 1 70 70 GLU CA C 13 59 0.3 . 1 . . . . 70 GLU CA . 6588 1 342 . 1 1 70 70 GLU N N 15 118.6 0.1 . 1 . . . . 70 GLU N . 6588 1 343 . 1 1 71 71 PHE H H 1 7.89 0.02 . 1 . . . . 71 PHE H . 6588 1 344 . 1 1 71 71 PHE HA H 1 4.29 0.02 . 1 . . . . 71 PHE HA . 6588 1 345 . 1 1 71 71 PHE C C 13 177.5 0.2 . 1 . . . . 71 PHE C . 6588 1 346 . 1 1 71 71 PHE CA C 13 61.1 0.3 . 1 . . . . 71 PHE CA . 6588 1 347 . 1 1 71 71 PHE N N 15 119.9 0.1 . 1 . . . . 71 PHE N . 6588 1 348 . 1 1 72 72 TRP H H 1 8.12 0.02 . 1 . . . . 72 TRP H . 6588 1 349 . 1 1 72 72 TRP HA H 1 4.3 0.02 . 1 . . . . 72 TRP HA . 6588 1 350 . 1 1 72 72 TRP C C 13 178.5 0.2 . 1 . . . . 72 TRP C . 6588 1 351 . 1 1 72 72 TRP CA C 13 59.4 0.3 . 1 . . . . 72 TRP CA . 6588 1 352 . 1 1 72 72 TRP N N 15 119.5 0.1 . 1 . . . . 72 TRP N . 6588 1 353 . 1 1 73 73 ASP H H 1 8.38 0.02 . 1 . . . . 73 ASP H . 6588 1 354 . 1 1 73 73 ASP HA H 1 4.42 0.02 . 1 . . . . 73 ASP HA . 6588 1 355 . 1 1 73 73 ASP C C 13 178.1 0.2 . 1 . . . . 73 ASP C . 6588 1 356 . 1 1 73 73 ASP CA C 13 56.8 0.3 . 1 . . . . 73 ASP CA . 6588 1 357 . 1 1 73 73 ASP N N 15 118.9 0.1 . 1 . . . . 73 ASP N . 6588 1 358 . 1 1 74 74 ASN H H 1 7.82 0.02 . 1 . . . . 74 ASN H . 6588 1 359 . 1 1 74 74 ASN HA H 1 4.56 0.02 . 1 . . . . 74 ASN HA . 6588 1 360 . 1 1 74 74 ASN C C 13 176.1 0.2 . 1 . . . . 74 ASN C . 6588 1 361 . 1 1 74 74 ASN CA C 13 54.8 0.3 . 1 . . . . 74 ASN CA . 6588 1 362 . 1 1 74 74 ASN N N 15 116.9 0.1 . 1 . . . . 74 ASN N . 6588 1 363 . 1 1 75 75 LEU H H 1 7.67 0.02 . 1 . . . . 75 LEU H . 6588 1 364 . 1 1 75 75 LEU HA H 1 3.99 0.02 . 1 . . . . 75 LEU HA . 6588 1 365 . 1 1 75 75 LEU C C 13 178.1 0.2 . 1 . . . . 75 LEU C . 6588 1 366 . 1 1 75 75 LEU CA C 13 56.6 0.3 . 1 . . . . 75 LEU CA . 6588 1 367 . 1 1 75 75 LEU N N 15 121.9 0.1 . 1 . . . . 75 LEU N . 6588 1 368 . 1 1 76 76 GLU C C 13 177.78 0.2 . 1 . . . . 76 GLU C . 6588 1 369 . 1 1 76 76 GLU CA C 13 57.83 0.3 . 1 . . . . 76 GLU CA . 6588 1 370 . 1 1 77 77 LYS H H 1 7.87 0.02 . 1 . . . . 77 LYS H . 6588 1 371 . 1 1 77 77 LYS N N 15 119.6 0.1 . 1 . . . . 77 LYS N . 6588 1 372 . 1 1 78 78 GLU H H 1 8.23 0.02 . 1 . . . . 78 GLU H . 6588 1 373 . 1 1 78 78 GLU HA H 1 4.35 0.02 . 1 . . . . 78 GLU HA . 6588 1 374 . 1 1 78 78 GLU C C 13 178.9 0.2 . 1 . . . . 78 GLU C . 6588 1 375 . 1 1 78 78 GLU CA C 13 53.6 0.3 . 1 . . . . 78 GLU CA . 6588 1 376 . 1 1 78 78 GLU N N 15 119.5 0.1 . 1 . . . . 78 GLU N . 6588 1 377 . 1 1 79 79 THR H H 1 8.01 0.02 . 1 . . . . 79 THR H . 6588 1 378 . 1 1 79 79 THR HA H 1 4.35 0.02 . 1 . . . . 79 THR HA . 6588 1 379 . 1 1 79 79 THR C C 13 176.2 0.2 . 1 . . . . 79 THR C . 6588 1 380 . 1 1 79 79 THR CA C 13 62.5 0.3 . 1 . . . . 79 THR CA . 6588 1 381 . 1 1 79 79 THR N N 15 111.7 0.1 . 1 . . . . 79 THR N . 6588 1 382 . 1 1 80 80 GLU H H 1 8.14 0.02 . 1 . . . . 80 GLU H . 6588 1 383 . 1 1 80 80 GLU HA H 1 4.18 0.02 . 1 . . . . 80 GLU HA . 6588 1 384 . 1 1 80 80 GLU C C 13 177.3 0.2 . 1 . . . . 80 GLU C . 6588 1 385 . 1 1 80 80 GLU CA C 13 57.9 0.3 . 1 . . . . 80 GLU CA . 6588 1 386 . 1 1 80 80 GLU N N 15 122.7 0.1 . 1 . . . . 80 GLU N . 6588 1 387 . 1 1 81 81 GLY H H 1 8.3 0.02 . 1 . . . . 81 GLY H . 6588 1 388 . 1 1 81 81 GLY HA2 H 1 4.02 0.02 . 1 . . . . 81 GLY HA2 . 6588 1 389 . 1 1 81 81 GLY HA3 H 1 3.92 0.02 . 1 . . . . 81 GLY HA3 . 6588 1 390 . 1 1 81 81 GLY C C 13 175 0.2 . 1 . . . . 81 GLY C . 6588 1 391 . 1 1 81 81 GLY CA C 13 45.8 0.3 . 1 . . . . 81 GLY CA . 6588 1 392 . 1 1 81 81 GLY N N 15 108.8 0.1 . 1 . . . . 81 GLY N . 6588 1 393 . 1 1 82 82 LEU H H 1 8.01 0.02 . 1 . . . . 82 LEU H . 6588 1 394 . 1 1 82 82 LEU HA H 1 4.2 0.02 . 1 . . . . 82 LEU HA . 6588 1 395 . 1 1 82 82 LEU C C 13 178.3 0.2 . 1 . . . . 82 LEU C . 6588 1 396 . 1 1 82 82 LEU CA C 13 57.3 0.3 . 1 . . . . 82 LEU CA . 6588 1 397 . 1 1 82 82 LEU N N 15 122.3 0.1 . 1 . . . . 82 LEU N . 6588 1 398 . 1 1 83 83 ARG H H 1 8.2 0.02 . 1 . . . . 83 ARG H . 6588 1 399 . 1 1 83 83 ARG HA H 1 4.02 0.02 . 1 . . . . 83 ARG HA . 6588 1 400 . 1 1 83 83 ARG C C 13 177.5 0.2 . 1 . . . . 83 ARG C . 6588 1 401 . 1 1 83 83 ARG CA C 13 59.4 0.3 . 1 . . . . 83 ARG CA . 6588 1 402 . 1 1 83 83 ARG N N 15 118 0.1 . 1 . . . . 83 ARG N . 6588 1 403 . 1 1 84 84 GLN H H 1 7.94 0.02 . 1 . . . . 84 GLN H . 6588 1 404 . 1 1 84 84 GLN C C 13 177.5 0.2 . 1 . . . . 84 GLN C . 6588 1 405 . 1 1 84 84 GLN CA C 13 58.2 0.3 . 1 . . . . 84 GLN CA . 6588 1 406 . 1 1 84 84 GLN N N 15 118 0.1 . 1 . . . . 84 GLN N . 6588 1 407 . 1 1 85 85 GLU H H 1 8.1 0.02 . 1 . . . . 85 GLU H . 6588 1 408 . 1 1 85 85 GLU C C 13 178.1 0.2 . 1 . . . . 85 GLU C . 6588 1 409 . 1 1 85 85 GLU CA C 13 57.7 0.3 . 1 . . . . 85 GLU CA . 6588 1 410 . 1 1 85 85 GLU N N 15 119.2 0.1 . 1 . . . . 85 GLU N . 6588 1 411 . 1 1 86 86 MET H H 1 8.13 0.02 . 1 . . . . 86 MET H . 6588 1 412 . 1 1 86 86 MET HA H 1 4.38 0.02 . 1 . . . . 86 MET HA . 6588 1 413 . 1 1 86 86 MET C C 13 176.8 0.2 . 1 . . . . 86 MET C . 6588 1 414 . 1 1 86 86 MET CA C 13 57 0.3 . 1 . . . . 86 MET CA . 6588 1 415 . 1 1 86 86 MET N N 15 118.5 0.1 . 1 . . . . 86 MET N . 6588 1 416 . 1 1 87 87 SER H H 1 8.12 0.02 . 1 . . . . 87 SER H . 6588 1 417 . 1 1 87 87 SER HA H 1 4.3 0.02 . 1 . . . . 87 SER HA . 6588 1 418 . 1 1 87 87 SER C C 13 175.5 0.2 . 1 . . . . 87 SER C . 6588 1 419 . 1 1 87 87 SER CA C 13 60.1 0.3 . 1 . . . . 87 SER CA . 6588 1 420 . 1 1 87 87 SER N N 15 115.1 0.1 . 1 . . . . 87 SER N . 6588 1 421 . 1 1 88 88 LYS H H 1 7.84 0.02 . 1 . . . . 88 LYS H . 6588 1 422 . 1 1 88 88 LYS HA H 1 4.28 0.02 . 1 . . . . 88 LYS HA . 6588 1 423 . 1 1 88 88 LYS C C 13 176.9 0.2 . 1 . . . . 88 LYS C . 6588 1 424 . 1 1 88 88 LYS CA C 13 57.2 0.3 . 1 . . . . 88 LYS CA . 6588 1 425 . 1 1 88 88 LYS N N 15 121.8 0.1 . 1 . . . . 88 LYS N . 6588 1 426 . 1 1 89 89 ASP H H 1 8.18 0.02 . 1 . . . . 89 ASP H . 6588 1 427 . 1 1 89 89 ASP HA H 1 4.65 0.02 . 1 . . . . 89 ASP HA . 6588 1 428 . 1 1 89 89 ASP C C 13 177.4 0.2 . 1 . . . . 89 ASP C . 6588 1 429 . 1 1 89 89 ASP CA C 13 54.9 0.3 . 1 . . . . 89 ASP CA . 6588 1 430 . 1 1 89 89 ASP N N 15 120.1 0.1 . 1 . . . . 89 ASP N . 6588 1 431 . 1 1 90 90 LEU H H 1 8.43 0.02 . 1 . . . . 90 LEU H . 6588 1 432 . 1 1 90 90 LEU HA H 1 4.15 0.02 . 1 . . . . 90 LEU HA . 6588 1 433 . 1 1 90 90 LEU C C 13 178.4 0.2 . 1 . . . . 90 LEU C . 6588 1 434 . 1 1 90 90 LEU CA C 13 57.5 0.3 . 1 . . . . 90 LEU CA . 6588 1 435 . 1 1 90 90 LEU N N 15 122.2 0.1 . 1 . . . . 90 LEU N . 6588 1 436 . 1 1 91 91 GLU H H 1 8.14 0.02 . 1 . . . . 91 GLU H . 6588 1 437 . 1 1 91 91 GLU HA H 1 3.98 0.02 . 1 . . . . 91 GLU HA . 6588 1 438 . 1 1 91 91 GLU C C 13 179.5 0.2 . 1 . . . . 91 GLU C . 6588 1 439 . 1 1 91 91 GLU CA C 13 59.8 0.3 . 1 . . . . 91 GLU CA . 6588 1 440 . 1 1 91 91 GLU N N 15 118.7 0.1 . 1 . . . . 91 GLU N . 6588 1 441 . 1 1 92 92 GLU H H 1 7.95 0.02 . 1 . . . . 92 GLU H . 6588 1 442 . 1 1 92 92 GLU HA H 1 4.2 0.02 . 1 . . . . 92 GLU HA . 6588 1 443 . 1 1 92 92 GLU C C 13 179.1 0.2 . 1 . . . . 92 GLU C . 6588 1 444 . 1 1 92 92 GLU CA C 13 59 0.3 . 1 . . . . 92 GLU CA . 6588 1 445 . 1 1 92 92 GLU N N 15 119.2 0.1 . 1 . . . . 92 GLU N . 6588 1 446 . 1 1 93 93 VAL H H 1 7.87 0.02 . 1 . . . . 93 VAL H . 6588 1 447 . 1 1 93 93 VAL C C 13 178.7 0.2 . 1 . . . . 93 VAL C . 6588 1 448 . 1 1 93 93 VAL CA C 13 66.7 0.3 . 1 . . . . 93 VAL CA . 6588 1 449 . 1 1 93 93 VAL N N 15 119.7 0.1 . 1 . . . . 93 VAL N . 6588 1 450 . 1 1 94 94 LYS H H 1 8.35 0.02 . 1 . . . . 94 LYS H . 6588 1 451 . 1 1 94 94 LYS C C 13 178.1 0.2 . 1 . . . . 94 LYS C . 6588 1 452 . 1 1 94 94 LYS CA C 13 60.4 0.3 . 1 . . . . 94 LYS CA . 6588 1 453 . 1 1 94 94 LYS N N 15 118.9 0.1 . 1 . . . . 94 LYS N . 6588 1 454 . 1 1 95 95 ALA H H 1 7.63 0.02 . 1 . . . . 95 ALA H . 6588 1 455 . 1 1 95 95 ALA HA H 1 4.18 0.02 . 1 . . . . 95 ALA HA . 6588 1 456 . 1 1 95 95 ALA C C 13 180.1 0.2 . 1 . . . . 95 ALA C . 6588 1 457 . 1 1 95 95 ALA CA C 13 54.7 0.3 . 1 . . . . 95 ALA CA . 6588 1 458 . 1 1 95 95 ALA N N 15 118.2 0.1 . 1 . . . . 95 ALA N . 6588 1 459 . 1 1 96 96 LYS H H 1 7.72 0.02 . 1 . . . . 96 LYS H . 6588 1 460 . 1 1 96 96 LYS HA H 1 4.25 0.02 . 1 . . . . 96 LYS HA . 6588 1 461 . 1 1 96 96 LYS C C 13 178.2 0.2 . 1 . . . . 96 LYS C . 6588 1 462 . 1 1 96 96 LYS CA C 13 57.9 0.3 . 1 . . . . 96 LYS CA . 6588 1 463 . 1 1 96 96 LYS N N 15 116.6 0.1 . 1 . . . . 96 LYS N . 6588 1 464 . 1 1 97 97 VAL H H 1 7.8 0.02 . 1 . . . . 97 VAL H . 6588 1 465 . 1 1 97 97 VAL HA H 1 4.4 0.02 . 1 . . . . 97 VAL HA . 6588 1 466 . 1 1 97 97 VAL C C 13 177 0.2 . 1 . . . . 97 VAL C . 6588 1 467 . 1 1 97 97 VAL CA C 13 63.2 0.3 . 1 . . . . 97 VAL CA . 6588 1 468 . 1 1 97 97 VAL N N 15 111.9 0.1 . 1 . . . . 97 VAL N . 6588 1 469 . 1 1 98 98 GLN H H 1 8.03 0.02 . 1 . . . . 98 GLN H . 6588 1 470 . 1 1 98 98 GLN HA H 1 4.02 0.02 . 1 . . . . 98 GLN HA . 6588 1 471 . 1 1 98 98 GLN C C 13 174.1 0.2 . 1 . . . . 98 GLN C . 6588 1 472 . 1 1 98 98 GLN CA C 13 61 0.3 . 1 . . . . 98 GLN CA . 6588 1 473 . 1 1 98 98 GLN N N 15 121.5 0.1 . 1 . . . . 98 GLN N . 6588 1 474 . 1 1 99 99 PRO HA H 1 4.3 0.02 . 1 . . . . 99 PRO HA . 6588 1 475 . 1 1 99 99 PRO C C 13 178.7 0.2 . 1 . . . . 99 PRO C . 6588 1 476 . 1 1 99 99 PRO CA C 13 66.2 0.3 . 1 . . . . 99 PRO CA . 6588 1 477 . 1 1 100 100 TYR H H 1 7.39 0.02 . 1 . . . . 100 TYR H . 6588 1 478 . 1 1 100 100 TYR HA H 1 4.35 0.02 . 1 . . . . 100 TYR HA . 6588 1 479 . 1 1 100 100 TYR C C 13 177.9 0.2 . 1 . . . . 100 TYR C . 6588 1 480 . 1 1 100 100 TYR CA C 13 60.4 0.3 . 1 . . . . 100 TYR CA . 6588 1 481 . 1 1 100 100 TYR N N 15 114.9 0.1 . 1 . . . . 100 TYR N . 6588 1 482 . 1 1 101 101 LEU H H 1 7.78 0.02 . 1 . . . . 101 LEU H . 6588 1 483 . 1 1 101 101 LEU HA H 1 4.2 0.02 . 1 . . . . 101 LEU HA . 6588 1 484 . 1 1 101 101 LEU C C 13 178.8 0.2 . 1 . . . . 101 LEU C . 6588 1 485 . 1 1 101 101 LEU CA C 13 58.1 0.3 . 1 . . . . 101 LEU CA . 6588 1 486 . 1 1 101 101 LEU N N 15 119.4 0.1 . 1 . . . . 101 LEU N . 6588 1 487 . 1 1 102 102 ASP H H 1 8.36 0.02 . 1 . . . . 102 ASP H . 6588 1 488 . 1 1 102 102 ASP HA H 1 4.43 0.02 . 1 . . . . 102 ASP HA . 6588 1 489 . 1 1 102 102 ASP C C 13 178.7 0.2 . 1 . . . . 102 ASP C . 6588 1 490 . 1 1 102 102 ASP CA C 13 57.4 0.3 . 1 . . . . 102 ASP CA . 6588 1 491 . 1 1 102 102 ASP N N 15 119.4 0.1 . 1 . . . . 102 ASP N . 6588 1 492 . 1 1 103 103 ASP H H 1 7.85 0.02 . 1 . . . . 103 ASP H . 6588 1 493 . 1 1 103 103 ASP HA H 1 4.58 0.02 . 1 . . . . 103 ASP HA . 6588 1 494 . 1 1 103 103 ASP C C 13 178.6 0.2 . 1 . . . . 103 ASP C . 6588 1 495 . 1 1 103 103 ASP CA C 13 57.4 0.3 . 1 . . . . 103 ASP CA . 6588 1 496 . 1 1 103 103 ASP N N 15 119.2 0.1 . 1 . . . . 103 ASP N . 6588 1 497 . 1 1 104 104 PHE H H 1 8.37 0.02 . 1 . . . . 104 PHE H . 6588 1 498 . 1 1 104 104 PHE HA H 1 4.33 0.02 . 1 . . . . 104 PHE HA . 6588 1 499 . 1 1 104 104 PHE C C 13 177.1 0.2 . 1 . . . . 104 PHE C . 6588 1 500 . 1 1 104 104 PHE CA C 13 61.5 0.3 . 1 . . . . 104 PHE CA . 6588 1 501 . 1 1 104 104 PHE N N 15 120.9 0.1 . 1 . . . . 104 PHE N . 6588 1 502 . 1 1 105 105 GLN H H 1 8.59 0.02 . 1 . . . . 105 GLN H . 6588 1 503 . 1 1 105 105 GLN HA H 1 3.92 0.02 . 1 . . . . 105 GLN HA . 6588 1 504 . 1 1 105 105 GLN C C 13 178.1 0.2 . 1 . . . . 105 GLN C . 6588 1 505 . 1 1 105 105 GLN CA C 13 59.6 0.3 . 1 . . . . 105 GLN CA . 6588 1 506 . 1 1 105 105 GLN N N 15 118.2 0.1 . 1 . . . . 105 GLN N . 6588 1 507 . 1 1 106 106 LYS H H 1 7.81 0.02 . 1 . . . . 106 LYS H . 6588 1 508 . 1 1 106 106 LYS HA H 1 4.1 0.02 . 1 . . . . 106 LYS HA . 6588 1 509 . 1 1 106 106 LYS C C 13 178.7 0.2 . 1 . . . . 106 LYS C . 6588 1 510 . 1 1 106 106 LYS CA C 13 59.3 0.3 . 1 . . . . 106 LYS CA . 6588 1 511 . 1 1 106 106 LYS N N 15 118.1 0.1 . 1 . . . . 106 LYS N . 6588 1 512 . 1 1 107 107 LYS H H 1 7.87 0.02 . 1 . . . . 107 LYS H . 6588 1 513 . 1 1 107 107 LYS HA H 1 4.21 0.02 . 1 . . . . 107 LYS HA . 6588 1 514 . 1 1 107 107 LYS C C 13 178.5 0.2 . 1 . . . . 107 LYS C . 6588 1 515 . 1 1 107 107 LYS CA C 13 58.8 0.3 . 1 . . . . 107 LYS CA . 6588 1 516 . 1 1 107 107 LYS N N 15 119.7 0.1 . 1 . . . . 107 LYS N . 6588 1 517 . 1 1 108 108 TRP H H 1 8.38 0.02 . 1 . . . . 108 TRP H . 6588 1 518 . 1 1 108 108 TRP HA H 1 4.35 0.02 . 1 . . . . 108 TRP HA . 6588 1 519 . 1 1 108 108 TRP C C 13 177.5 0.2 . 1 . . . . 108 TRP C . 6588 1 520 . 1 1 108 108 TRP CA C 13 59.9 0.3 . 1 . . . . 108 TRP CA . 6588 1 521 . 1 1 108 108 TRP N N 15 119.3 0.1 . 1 . . . . 108 TRP N . 6588 1 522 . 1 1 109 109 GLN H H 1 8.07 0.02 . 1 . . . . 109 GLN H . 6588 1 523 . 1 1 109 109 GLN HA H 1 3.92 0.02 . 1 . . . . 109 GLN HA . 6588 1 524 . 1 1 109 109 GLN CA C 13 59.3 0.3 . 1 . . . . 109 GLN CA . 6588 1 525 . 1 1 109 109 GLN N N 15 117.3 0.1 . 1 . . . . 109 GLN N . 6588 1 526 . 1 1 111 111 GLU HA H 1 4.23 0.02 . 1 . . . . 111 GLU HA . 6588 1 527 . 1 1 111 111 GLU C C 13 178.2 0.2 . 1 . . . . 111 GLU C . 6588 1 528 . 1 1 111 111 GLU CA C 13 58.8 0.3 . 1 . . . . 111 GLU CA . 6588 1 529 . 1 1 112 112 MET H H 1 8.33 0.02 . 1 . . . . 112 MET H . 6588 1 530 . 1 1 112 112 MET HA H 1 4.31 0.02 . 1 . . . . 112 MET HA . 6588 1 531 . 1 1 112 112 MET C C 13 178.4 0.2 . 1 . . . . 112 MET C . 6588 1 532 . 1 1 112 112 MET CA C 13 58 0.3 . 1 . . . . 112 MET CA . 6588 1 533 . 1 1 112 112 MET N N 15 118 0.1 . 1 . . . . 112 MET N . 6588 1 534 . 1 1 113 113 GLU H H 1 7.84 0.02 . 1 . . . . 113 GLU H . 6588 1 535 . 1 1 113 113 GLU C C 13 178.7 0.2 . 1 . . . . 113 GLU C . 6588 1 536 . 1 1 113 113 GLU CA C 13 59.2 0.3 . 1 . . . . 113 GLU CA . 6588 1 537 . 1 1 113 113 GLU N N 15 118.5 0.1 . 1 . . . . 113 GLU N . 6588 1 538 . 1 1 114 114 LEU H H 1 7.59 0.02 . 1 . . . . 114 LEU H . 6588 1 539 . 1 1 114 114 LEU C C 13 179.7 0.2 . 1 . . . . 114 LEU C . 6588 1 540 . 1 1 114 114 LEU CA C 13 57.7 0.3 . 1 . . . . 114 LEU CA . 6588 1 541 . 1 1 114 114 LEU N N 15 120 0.1 . 1 . . . . 114 LEU N . 6588 1 542 . 1 1 115 115 TYR H H 1 8.12 0.02 . 1 . . . . 115 TYR H . 6588 1 543 . 1 1 115 115 TYR C C 13 177.4 0.2 . 1 . . . . 115 TYR C . 6588 1 544 . 1 1 115 115 TYR CA C 13 61.4 0.3 . 1 . . . . 115 TYR CA . 6588 1 545 . 1 1 115 115 TYR N N 15 118.6 0.1 . 1 . . . . 115 TYR N . 6588 1 546 . 1 1 116 116 ARG H H 1 8.21 0.02 . 1 . . . . 116 ARG H . 6588 1 547 . 1 1 116 116 ARG C C 13 178.5 0.2 . 1 . . . . 116 ARG C . 6588 1 548 . 1 1 116 116 ARG CA C 13 59.7 0.3 . 1 . . . . 116 ARG CA . 6588 1 549 . 1 1 116 116 ARG N N 15 119 0.1 . 1 . . . . 116 ARG N . 6588 1 550 . 1 1 117 117 GLN H H 1 7.63 0.02 . 1 . . . . 117 GLN H . 6588 1 551 . 1 1 117 117 GLN C C 13 177.6 0.2 . 1 . . . . 117 GLN C . 6588 1 552 . 1 1 117 117 GLN CA C 13 58.2 0.3 . 1 . . . . 117 GLN CA . 6588 1 553 . 1 1 117 117 GLN N N 15 116.8 0.1 . 1 . . . . 117 GLN N . 6588 1 554 . 1 1 118 118 LYS H H 1 7.8 0.02 . 1 . . . . 118 LYS H . 6588 1 555 . 1 1 118 118 LYS C C 13 177.4 0.2 . 1 . . . . 118 LYS C . 6588 1 556 . 1 1 118 118 LYS CA C 13 57.7 0.3 . 1 . . . . 118 LYS CA . 6588 1 557 . 1 1 118 118 LYS N N 15 117.4 0.1 . 1 . . . . 118 LYS N . 6588 1 558 . 1 1 119 119 VAL H H 1 7.72 0.02 . 1 . . . . 119 VAL H . 6588 1 559 . 1 1 119 119 VAL HA H 1 3.7 0.02 . 1 . . . . 119 VAL HA . 6588 1 560 . 1 1 119 119 VAL C C 13 176.4 0.2 . 1 . . . . 119 VAL C . 6588 1 561 . 1 1 119 119 VAL CA C 13 64.1 0.3 . 1 . . . . 119 VAL CA . 6588 1 562 . 1 1 119 119 VAL N N 15 114.9 0.1 . 1 . . . . 119 VAL N . 6588 1 563 . 1 1 120 120 GLU H H 1 7.94 0.02 . 1 . . . . 120 GLU H . 6588 1 564 . 1 1 120 120 GLU C C 13 178.4 0.2 . 1 . . . . 120 GLU C . 6588 1 565 . 1 1 120 120 GLU CA C 13 60.9 0.3 . 1 . . . . 120 GLU CA . 6588 1 566 . 1 1 120 120 GLU N N 15 121.8 0.1 . 1 . . . . 120 GLU N . 6588 1 567 . 1 1 122 122 LEU C C 13 178.4 0.2 . 1 . . . . 122 LEU C . 6588 1 568 . 1 1 122 122 LEU CA C 13 59.4 0.3 . 1 . . . . 122 LEU CA . 6588 1 569 . 1 1 123 123 ARG H H 1 8.12 0.02 . 1 . . . . 123 ARG H . 6588 1 570 . 1 1 123 123 ARG C C 13 177.8 0.2 . 1 . . . . 123 ARG C . 6588 1 571 . 1 1 123 123 ARG CA C 13 57.5 0.3 . 1 . . . . 123 ARG CA . 6588 1 572 . 1 1 123 123 ARG N N 15 118.9 0.1 . 1 . . . . 123 ARG N . 6588 1 573 . 1 1 124 124 ALA H H 1 8.01 0.02 . 1 . . . . 124 ALA H . 6588 1 574 . 1 1 124 124 ALA HA H 1 4.21 0.02 . 1 . . . . 124 ALA HA . 6588 1 575 . 1 1 124 124 ALA C C 13 180.2 0.2 . 1 . . . . 124 ALA C . 6588 1 576 . 1 1 124 124 ALA CA C 13 54.9 0.3 . 1 . . . . 124 ALA CA . 6588 1 577 . 1 1 124 124 ALA N N 15 120 0.1 . 1 . . . . 124 ALA N . 6588 1 578 . 1 1 125 125 GLU H H 1 7.88 0.02 . 1 . . . . 125 GLU H . 6588 1 579 . 1 1 125 125 GLU C C 13 179.1 0.2 . 1 . . . . 125 GLU C . 6588 1 580 . 1 1 125 125 GLU CA C 13 58.4 0.3 . 1 . . . . 125 GLU CA . 6588 1 581 . 1 1 125 125 GLU N N 15 117.6 0.1 . 1 . . . . 125 GLU N . 6588 1 582 . 1 1 126 126 LEU H H 1 8.12 0.02 . 1 . . . . 126 LEU H . 6588 1 583 . 1 1 126 126 LEU C C 13 178.4 0.2 . 1 . . . . 126 LEU C . 6588 1 584 . 1 1 126 126 LEU CA C 13 57.2 0.3 . 1 . . . . 126 LEU CA . 6588 1 585 . 1 1 126 126 LEU N N 15 120.5 0.1 . 1 . . . . 126 LEU N . 6588 1 586 . 1 1 127 127 GLN H H 1 8.24 0.1 . 1 . . . . 127 GLN H . 6588 1 587 . 1 1 127 127 GLN HA H 1 3.89 0.02 . 1 . . . . 127 GLN HA . 6588 1 588 . 1 1 127 127 GLN C C 13 177.6 0.2 . 1 . . . . 127 GLN C . 6588 1 589 . 1 1 127 127 GLN CA C 13 59.4 0.3 . 1 . . . . 127 GLN CA . 6588 1 590 . 1 1 127 127 GLN N N 15 118.2 0.1 . 1 . . . . 127 GLN N . 6588 1 591 . 1 1 128 128 GLU H H 1 8.02 0.02 . 1 . . . . 128 GLU H . 6588 1 592 . 1 1 128 128 GLU HA H 1 4.17 0.02 . 1 . . . . 128 GLU HA . 6588 1 593 . 1 1 128 128 GLU C C 13 178.9 0.2 . 1 . . . . 128 GLU C . 6588 1 594 . 1 1 128 128 GLU CA C 13 59 0.3 . 1 . . . . 128 GLU CA . 6588 1 595 . 1 1 128 128 GLU N N 15 118.1 0.1 . 1 . . . . 128 GLU N . 6588 1 596 . 1 1 129 129 GLY H H 1 8.33 0.02 . 1 . . . . 129 GLY H . 6588 1 597 . 1 1 129 129 GLY HA2 H 1 3.9 0.02 . 1 . . . . 129 GLY HA2 . 6588 1 598 . 1 1 129 129 GLY HA3 H 1 4 0.02 . 1 . . . . 129 GLY HA3 . 6588 1 599 . 1 1 129 129 GLY C C 13 176.1 0.2 . 1 . . . . 129 GLY C . 6588 1 600 . 1 1 129 129 GLY CA C 13 47 0.3 . 1 . . . . 129 GLY CA . 6588 1 601 . 1 1 129 129 GLY N N 15 108.2 0.1 . 1 . . . . 129 GLY N . 6588 1 602 . 1 1 130 130 ALA H H 1 8.49 0.02 . 1 . . . . 130 ALA H . 6588 1 603 . 1 1 130 130 ALA HA H 1 4.04 0.02 . 1 . . . . 130 ALA HA . 6588 1 604 . 1 1 130 130 ALA C C 13 179 0.2 . 1 . . . . 130 ALA C . 6588 1 605 . 1 1 130 130 ALA CA C 13 55.4 0.3 . 1 . . . . 130 ALA CA . 6588 1 606 . 1 1 130 130 ALA N N 15 124.1 0.1 . 1 . . . . 130 ALA N . 6588 1 607 . 1 1 131 131 ARG H H 1 8.13 0.02 . 1 . . . . 131 ARG H . 6588 1 608 . 1 1 131 131 ARG HA H 1 3.99 0.02 . 1 . . . . 131 ARG HA . 6588 1 609 . 1 1 131 131 ARG C C 13 178.6 0.2 . 1 . . . . 131 ARG C . 6588 1 610 . 1 1 131 131 ARG CA C 13 60.1 0.3 . 1 . . . . 131 ARG CA . 6588 1 611 . 1 1 131 131 ARG N N 15 116.3 0.1 . 1 . . . . 131 ARG N . 6588 1 612 . 1 1 132 132 GLN H H 1 8.03 0.02 . 1 . . . . 132 GLN H . 6588 1 613 . 1 1 132 132 GLN C C 13 177.1 0.2 . 1 . . . . 132 GLN C . 6588 1 614 . 1 1 132 132 GLN CA C 13 57.1 0.3 . 1 . . . . 132 GLN CA . 6588 1 615 . 1 1 132 132 GLN N N 15 118.1 0.1 . 1 . . . . 132 GLN N . 6588 1 616 . 1 1 133 133 LYS H H 1 8.11 0.02 . 1 . . . . 133 LYS H . 6588 1 617 . 1 1 133 133 LYS C C 13 178.9 0.2 . 1 . . . . 133 LYS C . 6588 1 618 . 1 1 133 133 LYS CA C 13 59.1 0.3 . 1 . . . . 133 LYS CA . 6588 1 619 . 1 1 133 133 LYS N N 15 119.7 0.1 . 1 . . . . 133 LYS N . 6588 1 620 . 1 1 134 134 LEU H H 1 8.25 0.05 . 1 . . . . 134 LEU H . 6588 1 621 . 1 1 134 134 LEU C C 13 178.7 0.2 . 1 . . . . 134 LEU C . 6588 1 622 . 1 1 134 134 LEU CA C 13 58.1 0.3 . 1 . . . . 134 LEU CA . 6588 1 623 . 1 1 134 134 LEU N N 15 118.9 0.1 . 1 . . . . 134 LEU N . 6588 1 624 . 1 1 135 135 HIS H H 1 8.11 0.02 . 1 . . . . 135 HIS H . 6588 1 625 . 1 1 135 135 HIS HA H 1 4.53 0.02 . 1 . . . . 135 HIS HA . 6588 1 626 . 1 1 135 135 HIS C C 13 177.6 0.2 . 1 . . . . 135 HIS C . 6588 1 627 . 1 1 135 135 HIS CA C 13 59.1 0.3 . 1 . . . . 135 HIS CA . 6588 1 628 . 1 1 135 135 HIS N N 15 116.8 0.1 . 1 . . . . 135 HIS N . 6588 1 629 . 1 1 136 136 GLU H H 1 8.13 0.02 . 1 . . . . 136 GLU H . 6588 1 630 . 1 1 136 136 GLU C C 13 178.9 0.2 . 1 . . . . 136 GLU C . 6588 1 631 . 1 1 136 136 GLU CA C 13 59.3 0.3 . 1 . . . . 136 GLU CA . 6588 1 632 . 1 1 136 136 GLU N N 15 119.9 0.1 . 1 . . . . 136 GLU N . 6588 1 633 . 1 1 137 137 LEU H H 1 8.08 0.02 . 1 . . . . 137 LEU H . 6588 1 634 . 1 1 137 137 LEU C C 13 178.5 0.2 . 1 . . . . 137 LEU C . 6588 1 635 . 1 1 137 137 LEU CA C 13 58.1 0.3 . 1 . . . . 137 LEU CA . 6588 1 636 . 1 1 137 137 LEU N N 15 119.4 0.1 . 1 . . . . 137 LEU N . 6588 1 637 . 1 1 138 138 GLN H H 1 8.33 0.02 . 1 . . . . 138 GLN H . 6588 1 638 . 1 1 138 138 GLN HA H 1 4.3 0.02 . 1 . . . . 138 GLN HA . 6588 1 639 . 1 1 138 138 GLN C C 13 178.4 0.2 . 1 . . . . 138 GLN C . 6588 1 640 . 1 1 138 138 GLN CA C 13 59.9 0.3 . 1 . . . . 138 GLN CA . 6588 1 641 . 1 1 138 138 GLN N N 15 118.1 0.1 . 1 . . . . 138 GLN N . 6588 1 642 . 1 1 139 139 GLU H H 1 7.82 0.02 . 1 . . . . 139 GLU H . 6588 1 643 . 1 1 139 139 GLU C C 13 178.7 0.2 . 1 . . . . 139 GLU C . 6588 1 644 . 1 1 139 139 GLU CA C 13 59.1 0.3 . 1 . . . . 139 GLU CA . 6588 1 645 . 1 1 139 139 GLU N N 15 117.5 0.1 . 1 . . . . 139 GLU N . 6588 1 646 . 1 1 140 140 LYS H H 1 7.79 0.02 . 1 . . . . 140 LYS H . 6588 1 647 . 1 1 140 140 LYS C C 13 177.9 0.2 . 1 . . . . 140 LYS C . 6588 1 648 . 1 1 140 140 LYS CA C 13 58.2 0.3 . 1 . . . . 140 LYS CA . 6588 1 649 . 1 1 140 140 LYS N N 15 118.1 0.1 . 1 . . . . 140 LYS N . 6588 1 650 . 1 1 141 141 LEU H H 1 7.92 0.02 . 1 . . . . 141 LEU H . 6588 1 651 . 1 1 141 141 LEU HA H 1 4.39 0.02 . 1 . . . . 141 LEU HA . 6588 1 652 . 1 1 141 141 LEU C C 13 177.8 0.2 . 1 . . . . 141 LEU C . 6588 1 653 . 1 1 141 141 LEU CA C 13 55.8 0.3 . 1 . . . . 141 LEU CA . 6588 1 654 . 1 1 141 141 LEU N N 15 115.9 0.1 . 1 . . . . 141 LEU N . 6588 1 655 . 1 1 142 142 SER H H 1 7.96 0.02 . 1 . . . . 142 SER H . 6588 1 656 . 1 1 142 142 SER C C 13 177.8 0.2 . 1 . . . . 142 SER C . 6588 1 657 . 1 1 142 142 SER CA C 13 62.2 0.3 . 1 . . . . 142 SER CA . 6588 1 658 . 1 1 142 142 SER N N 15 115.7 0.1 . 1 . . . . 142 SER N . 6588 1 659 . 1 1 143 143 PRO C C 13 178.2 0.2 . 1 . . . . 143 PRO C . 6588 1 660 . 1 1 143 143 PRO CA C 13 65.4 0.3 . 1 . . . . 143 PRO CA . 6588 1 661 . 1 1 144 144 LEU H H 1 7.69 0.02 . 1 . . . . 144 LEU H . 6588 1 662 . 1 1 144 144 LEU HA H 1 4.35 0.02 . 1 . . . . 144 LEU HA . 6588 1 663 . 1 1 144 144 LEU C C 13 178.6 0.2 . 1 . . . . 144 LEU C . 6588 1 664 . 1 1 144 144 LEU CA C 13 56.2 0.3 . 1 . . . . 144 LEU CA . 6588 1 665 . 1 1 144 144 LEU N N 15 118.1 0.1 . 1 . . . . 144 LEU N . 6588 1 666 . 1 1 145 145 GLY H H 1 8.22 0.02 . 1 . . . . 145 GLY H . 6588 1 667 . 1 1 145 145 GLY HA2 H 1 3.81 0.02 . 1 . . . . 145 GLY HA2 . 6588 1 668 . 1 1 145 145 GLY HA3 H 1 4.1 0.02 . 1 . . . . 145 GLY HA3 . 6588 1 669 . 1 1 145 145 GLY C C 13 175.2 0.2 . 1 . . . . 145 GLY C . 6588 1 670 . 1 1 145 145 GLY CA C 13 47.3 0.3 . 1 . . . . 145 GLY CA . 6588 1 671 . 1 1 145 145 GLY N N 15 107.5 0.1 . 1 . . . . 145 GLY N . 6588 1 672 . 1 1 146 146 GLU H H 1 8.23 0.02 . 1 . . . . 146 GLU H . 6588 1 673 . 1 1 146 146 GLU HA H 1 4 0.02 . 1 . . . . 146 GLU HA . 6588 1 674 . 1 1 146 146 GLU CA C 13 59.6 0.3 . 1 . . . . 146 GLU CA . 6588 1 675 . 1 1 146 146 GLU N N 15 120.3 0.1 . 1 . . . . 146 GLU N . 6588 1 676 . 1 1 147 147 GLU C C 13 179 0.2 . 1 . . . . 147 GLU C . 6588 1 677 . 1 1 147 147 GLU CA C 13 59.1 0.3 . 1 . . . . 147 GLU CA . 6588 1 678 . 1 1 148 148 MET H H 1 8.28 0.02 . 1 . . . . 148 MET H . 6588 1 679 . 1 1 148 148 MET C C 13 178.2 0.2 . 1 . . . . 148 MET C . 6588 1 680 . 1 1 148 148 MET CA C 13 58.5 0.3 . 1 . . . . 148 MET CA . 6588 1 681 . 1 1 148 148 MET N N 15 118.2 0.1 . 1 . . . . 148 MET N . 6588 1 682 . 1 1 149 149 ARG H H 1 8.22 0.02 . 1 . . . . 149 ARG H . 6588 1 683 . 1 1 149 149 ARG C C 13 178.2 0.2 . 1 . . . . 149 ARG C . 6588 1 684 . 1 1 149 149 ARG CA C 13 60.4 0.3 . 1 . . . . 149 ARG CA . 6588 1 685 . 1 1 149 149 ARG N N 15 118.9 0.1 . 1 . . . . 149 ARG N . 6588 1 686 . 1 1 150 150 ASP H H 1 8.07 0.02 . 1 . . . . 150 ASP H . 6588 1 687 . 1 1 150 150 ASP HA H 1 4.44 0.02 . 1 . . . . 150 ASP HA . 6588 1 688 . 1 1 150 150 ASP C C 13 179.5 0.2 . 1 . . . . 150 ASP C . 6588 1 689 . 1 1 150 150 ASP CA C 13 57.6 0.3 . 1 . . . . 150 ASP CA . 6588 1 690 . 1 1 150 150 ASP N N 15 118.7 0.1 . 1 . . . . 150 ASP N . 6588 1 691 . 1 1 151 151 ARG H H 1 8.18 0.02 . 1 . . . . 151 ARG H . 6588 1 692 . 1 1 151 151 ARG HA H 1 4.13 0.02 . 1 . . . . 151 ARG HA . 6588 1 693 . 1 1 151 151 ARG C C 13 179.1 0.2 . 1 . . . . 151 ARG C . 6588 1 694 . 1 1 151 151 ARG CA C 13 59.1 0.3 . 1 . . . . 151 ARG CA . 6588 1 695 . 1 1 151 151 ARG N N 15 119.9 0.1 . 1 . . . . 151 ARG N . 6588 1 696 . 1 1 152 152 ALA H H 1 8.5 0.02 . 1 . . . . 152 ALA H . 6588 1 697 . 1 1 152 152 ALA HA H 1 4.14 0.02 . 1 . . . . 152 ALA HA . 6588 1 698 . 1 1 152 152 ALA C C 13 179.4 0.2 . 1 . . . . 152 ALA C . 6588 1 699 . 1 1 152 152 ALA CA C 13 55.7 0.3 . 1 . . . . 152 ALA CA . 6588 1 700 . 1 1 152 152 ALA N N 15 122.2 0.1 . 1 . . . . 152 ALA N . 6588 1 701 . 1 1 153 153 ARG H H 1 8.39 0.02 . 1 . . . . 153 ARG H . 6588 1 702 . 1 1 153 153 ARG HA H 1 3.95 0.02 . 1 . . . . 153 ARG HA . 6588 1 703 . 1 1 153 153 ARG C C 13 178.3 0.2 . 1 . . . . 153 ARG C . 6588 1 704 . 1 1 153 153 ARG CA C 13 59.5 0.3 . 1 . . . . 153 ARG CA . 6588 1 705 . 1 1 153 153 ARG N N 15 117.4 0.1 . 1 . . . . 153 ARG N . 6588 1 706 . 1 1 154 154 ALA H H 1 7.89 0.02 . 1 . . . . 154 ALA H . 6588 1 707 . 1 1 154 154 ALA C C 13 180.7 0.2 . 1 . . . . 154 ALA C . 6588 1 708 . 1 1 154 154 ALA CA C 13 54.9 0.3 . 1 . . . . 154 ALA CA . 6588 1 709 . 1 1 154 154 ALA N N 15 120.1 0.1 . 1 . . . . 154 ALA N . 6588 1 710 . 1 1 155 155 HIS H H 1 7.94 0.02 . 1 . . . . 155 HIS H . 6588 1 711 . 1 1 155 155 HIS HA H 1 4.63 0.02 . 1 . . . . 155 HIS HA . 6588 1 712 . 1 1 155 155 HIS C C 13 176.9 0.2 . 1 . . . . 155 HIS C . 6588 1 713 . 1 1 155 155 HIS CA C 13 58.2 0.3 . 1 . . . . 155 HIS CA . 6588 1 714 . 1 1 155 155 HIS N N 15 115.9 0.1 . 1 . . . . 155 HIS N . 6588 1 715 . 1 1 156 156 VAL H H 1 8.22 0.02 . 1 . . . . 156 VAL H . 6588 1 716 . 1 1 156 156 VAL HA H 1 3.72 0.02 . 1 . . . . 156 VAL HA . 6588 1 717 . 1 1 156 156 VAL C C 13 177.4 0.2 . 1 . . . . 156 VAL C . 6588 1 718 . 1 1 156 156 VAL CA C 13 67.4 0.3 . 1 . . . . 156 VAL CA . 6588 1 719 . 1 1 156 156 VAL N N 15 120.6 0.1 . 1 . . . . 156 VAL N . 6588 1 720 . 1 1 157 157 ASP H H 1 8.43 0.02 . 1 . . . . 157 ASP H . 6588 1 721 . 1 1 157 157 ASP HA H 1 4.44 0.02 . 1 . . . . 157 ASP HA . 6588 1 722 . 1 1 157 157 ASP C C 13 178.9 0.2 . 1 . . . . 157 ASP C . 6588 1 723 . 1 1 157 157 ASP CA C 13 57.7 0.3 . 1 . . . . 157 ASP CA . 6588 1 724 . 1 1 157 157 ASP N N 15 119.9 0.1 . 1 . . . . 157 ASP N . 6588 1 725 . 1 1 158 158 ALA H H 1 7.82 0.02 . 1 . . . . 158 ALA H . 6588 1 726 . 1 1 158 158 ALA HA H 1 4.22 0.02 . 1 . . . . 158 ALA HA . 6588 1 727 . 1 1 158 158 ALA C C 13 180.5 0.2 . 1 . . . . 158 ALA C . 6588 1 728 . 1 1 158 158 ALA CA C 13 55.1 0.3 . 1 . . . . 158 ALA CA . 6588 1 729 . 1 1 158 158 ALA N N 15 122.2 0.1 . 1 . . . . 158 ALA N . 6588 1 730 . 1 1 159 159 LEU H H 1 8.1 0.02 . 1 . . . . 159 LEU H . 6588 1 731 . 1 1 159 159 LEU HA H 1 4.15 0.02 . 1 . . . . 159 LEU HA . 6588 1 732 . 1 1 159 159 LEU C C 13 179 0.2 . 1 . . . . 159 LEU C . 6588 1 733 . 1 1 159 159 LEU CA C 13 58.8 0.3 . 1 . . . . 159 LEU CA . 6588 1 734 . 1 1 159 159 LEU N N 15 120.2 0.1 . 1 . . . . 159 LEU N . 6588 1 735 . 1 1 160 160 ARG H H 1 8.58 0.02 . 1 . . . . 160 ARG H . 6588 1 736 . 1 1 160 160 ARG HA H 1 3.88 0.02 . 1 . . . . 160 ARG HA . 6588 1 737 . 1 1 160 160 ARG C C 13 178.7 0.2 . 1 . . . . 160 ARG C . 6588 1 738 . 1 1 160 160 ARG CA C 13 60.7 0.3 . 1 . . . . 160 ARG CA . 6588 1 739 . 1 1 160 160 ARG N N 15 118.2 0.1 . 1 . . . . 160 ARG N . 6588 1 740 . 1 1 161 161 THR H H 1 8.05 0.02 . 1 . . . . 161 THR H . 6588 1 741 . 1 1 161 161 THR HA H 1 4.23 0.02 . 1 . . . . 161 THR HA . 6588 1 742 . 1 1 161 161 THR C C 13 176.6 0.2 . 1 . . . . 161 THR C . 6588 1 743 . 1 1 161 161 THR CA C 13 66.1 0.3 . 1 . . . . 161 THR CA . 6588 1 744 . 1 1 161 161 THR N N 15 112.5 0.1 . 1 . . . . 161 THR N . 6588 1 745 . 1 1 162 162 HIS H H 1 7.96 0.02 . 1 . . . . 162 HIS H . 6588 1 746 . 1 1 162 162 HIS HA H 1 4.56 0.02 . 1 . . . . 162 HIS HA . 6588 1 747 . 1 1 162 162 HIS CA C 13 58.3 0.3 . 1 . . . . 162 HIS CA . 6588 1 748 . 1 1 162 162 HIS N N 15 118.4 0.1 . 1 . . . . 162 HIS N . 6588 1 749 . 1 1 163 163 LEU H H 1 8.08 0.02 . 1 . . . . 163 LEU H . 6588 1 750 . 1 1 163 163 LEU HA H 1 4.55 0.02 . 1 . . . . 163 LEU HA . 6588 1 751 . 1 1 163 163 LEU C C 13 177.8 0.2 . 1 . . . . 163 LEU C . 6588 1 752 . 1 1 163 163 LEU CA C 13 56 0.3 . 1 . . . . 163 LEU CA . 6588 1 753 . 1 1 163 163 LEU N N 15 116.2 0.1 . 1 . . . . 163 LEU N . 6588 1 754 . 1 1 164 164 ALA H H 1 7.85 0.02 . 1 . . . . 164 ALA H . 6588 1 755 . 1 1 164 164 ALA HA H 1 4.31 0.02 . 1 . . . . 164 ALA HA . 6588 1 756 . 1 1 164 164 ALA C C 13 176.6 0.2 . 1 . . . . 164 ALA C . 6588 1 757 . 1 1 164 164 ALA CA C 13 56.6 0.3 . 1 . . . . 164 ALA CA . 6588 1 758 . 1 1 164 164 ALA N N 15 122.7 0.1 . 1 . . . . 164 ALA N . 6588 1 759 . 1 1 165 165 PRO HA H 1 4.37 0.02 . 1 . . . . 165 PRO HA . 6588 1 760 . 1 1 165 165 PRO C C 13 177.9 0.2 . 1 . . . . 165 PRO C . 6588 1 761 . 1 1 165 165 PRO CA C 13 65.6 0.3 . 1 . . . . 165 PRO CA . 6588 1 762 . 1 1 166 166 TYR H H 1 7.72 0.02 . 1 . . . . 166 TYR H . 6588 1 763 . 1 1 166 166 TYR HA H 1 4.65 0.02 . 1 . . . . 166 TYR HA . 6588 1 764 . 1 1 166 166 TYR C C 13 177.1 0.2 . 1 . . . . 166 TYR C . 6588 1 765 . 1 1 166 166 TYR CA C 13 58.6 0.3 . 1 . . . . 166 TYR CA . 6588 1 766 . 1 1 166 166 TYR N N 15 115.4 0.1 . 1 . . . . 166 TYR N . 6588 1 767 . 1 1 167 167 SER H H 1 8.05 0.02 . 1 . . . . 167 SER H . 6588 1 768 . 1 1 167 167 SER HA H 1 4.44 0.02 . 1 . . . . 167 SER HA . 6588 1 769 . 1 1 167 167 SER C C 13 175.9 0.2 . 1 . . . . 167 SER C . 6588 1 770 . 1 1 167 167 SER CA C 13 62.3 0.3 . 1 . . . . 167 SER CA . 6588 1 771 . 1 1 167 167 SER N N 15 115.7 0.1 . 1 . . . . 167 SER N . 6588 1 772 . 1 1 168 168 ASP H H 1 8.32 0.02 . 1 . . . . 168 ASP H . 6588 1 773 . 1 1 168 168 ASP HA H 1 4.55 0.02 . 1 . . . . 168 ASP HA . 6588 1 774 . 1 1 168 168 ASP C C 13 178.6 0.2 . 1 . . . . 168 ASP C . 6588 1 775 . 1 1 168 168 ASP CA C 13 57.7 0.3 . 1 . . . . 168 ASP CA . 6588 1 776 . 1 1 168 168 ASP N N 15 121.1 0.1 . 1 . . . . 168 ASP N . 6588 1 777 . 1 1 169 169 GLU H H 1 7.98 0.02 . 1 . . . . 169 GLU H . 6588 1 778 . 1 1 169 169 GLU HA H 1 4.15 0.02 . 1 . . . . 169 GLU HA . 6588 1 779 . 1 1 169 169 GLU C C 13 179.1 0.2 . 1 . . . . 169 GLU C . 6588 1 780 . 1 1 169 169 GLU CA C 13 59.1 0.3 . 1 . . . . 169 GLU CA . 6588 1 781 . 1 1 169 169 GLU N N 15 120 0.1 . 1 . . . . 169 GLU N . 6588 1 782 . 1 1 170 170 LEU H H 1 8.3 0.02 . 1 . . . . 170 LEU H . 6588 1 783 . 1 1 170 170 LEU HA H 1 4.02 0.02 . 1 . . . . 170 LEU HA . 6588 1 784 . 1 1 170 170 LEU C C 13 178.7 0.2 . 1 . . . . 170 LEU C . 6588 1 785 . 1 1 170 170 LEU CA C 13 58.5 0.3 . 1 . . . . 170 LEU CA . 6588 1 786 . 1 1 170 170 LEU N N 15 119.5 0.1 . 1 . . . . 170 LEU N . 6588 1 787 . 1 1 171 171 ARG H H 1 8.35 0.02 . 1 . . . . 171 ARG H . 6588 1 788 . 1 1 171 171 ARG HA H 1 3.84 0.02 . 1 . . . . 171 ARG HA . 6588 1 789 . 1 1 171 171 ARG C C 13 178.5 0.2 . 1 . . . . 171 ARG C . 6588 1 790 . 1 1 171 171 ARG CA C 13 60.6 0.3 . 1 . . . . 171 ARG CA . 6588 1 791 . 1 1 171 171 ARG N N 15 117.8 0.1 . 1 . . . . 171 ARG N . 6588 1 792 . 1 1 172 172 GLN H H 1 7.95 0.02 . 1 . . . . 172 GLN H . 6588 1 793 . 1 1 172 172 GLN HA H 1 4.09 0.02 . 1 . . . . 172 GLN HA . 6588 1 794 . 1 1 172 172 GLN C C 13 179.5 0.2 . 1 . . . . 172 GLN C . 6588 1 795 . 1 1 172 172 GLN CA C 13 59.2 0.3 . 1 . . . . 172 GLN CA . 6588 1 796 . 1 1 172 172 GLN N N 15 117.2 0.1 . 1 . . . . 172 GLN N . 6588 1 797 . 1 1 173 173 ARG H H 1 8.22 0.02 . 1 . . . . 173 ARG H . 6588 1 798 . 1 1 173 173 ARG HA H 1 4.14 0.02 . 1 . . . . 173 ARG HA . 6588 1 799 . 1 1 173 173 ARG C C 13 179.6 0.2 . 1 . . . . 173 ARG C . 6588 1 800 . 1 1 173 173 ARG CA C 13 59.3 0.3 . 1 . . . . 173 ARG CA . 6588 1 801 . 1 1 173 173 ARG N N 15 120.4 0.1 . 1 . . . . 173 ARG N . 6588 1 802 . 1 1 174 174 LEU H H 1 8.39 0.02 . 1 . . . . 174 LEU H . 6588 1 803 . 1 1 174 174 LEU HA H 1 4.06 0.02 . 1 . . . . 174 LEU HA . 6588 1 804 . 1 1 174 174 LEU C C 13 178.5 0.2 . 1 . . . . 174 LEU C . 6588 1 805 . 1 1 174 174 LEU CA C 13 58.2 0.3 . 1 . . . . 174 LEU CA . 6588 1 806 . 1 1 174 174 LEU N N 15 119.9 0.1 . 1 . . . . 174 LEU N . 6588 1 807 . 1 1 175 175 ALA H H 1 8.44 0.02 . 1 . . . . 175 ALA H . 6588 1 808 . 1 1 175 175 ALA HA H 1 4.01 0.02 . 1 . . . . 175 ALA HA . 6588 1 809 . 1 1 175 175 ALA C C 13 180.4 0.2 . 1 . . . . 175 ALA C . 6588 1 810 . 1 1 175 175 ALA CA C 13 55.5 0.3 . 1 . . . . 175 ALA CA . 6588 1 811 . 1 1 175 175 ALA N N 15 120.8 0.1 . 1 . . . . 175 ALA N . 6588 1 812 . 1 1 176 176 ALA H H 1 7.8 0.02 . 1 . . . . 176 ALA H . 6588 1 813 . 1 1 176 176 ALA HA H 1 4.21 0.02 . 1 . . . . 176 ALA HA . 6588 1 814 . 1 1 176 176 ALA C C 13 181 0.2 . 1 . . . . 176 ALA C . 6588 1 815 . 1 1 176 176 ALA CA C 13 55 0.3 . 1 . . . . 176 ALA CA . 6588 1 816 . 1 1 176 176 ALA N N 15 118.9 0.1 . 1 . . . . 176 ALA N . 6588 1 817 . 1 1 177 177 ARG H H 1 7.81 0.02 . 1 . . . . 177 ARG H . 6588 1 818 . 1 1 177 177 ARG HA H 1 4.2 0.02 . 1 . . . . 177 ARG HA . 6588 1 819 . 1 1 177 177 ARG C C 13 178.7 0.2 . 1 . . . . 177 ARG C . 6588 1 820 . 1 1 177 177 ARG CA C 13 57.9 0.3 . 1 . . . . 177 ARG CA . 6588 1 821 . 1 1 177 177 ARG N N 15 118.7 0.1 . 1 . . . . 177 ARG N . 6588 1 822 . 1 1 178 178 LEU H H 1 8.2 0.02 . 1 . . . . 178 LEU H . 6588 1 823 . 1 1 178 178 LEU HA H 1 4.09 0.02 . 1 . . . . 178 LEU HA . 6588 1 824 . 1 1 178 178 LEU C C 13 179 0.2 . 1 . . . . 178 LEU C . 6588 1 825 . 1 1 178 178 LEU CA C 13 57.8 0.3 . 1 . . . . 178 LEU CA . 6588 1 826 . 1 1 178 178 LEU N N 15 119 0.1 . 1 . . . . 178 LEU N . 6588 1 827 . 1 1 179 179 GLU H H 1 8.04 0.02 . 1 . . . . 179 GLU H . 6588 1 828 . 1 1 179 179 GLU HA H 1 3.97 0.02 . 1 . . . . 179 GLU HA . 6588 1 829 . 1 1 179 179 GLU C C 13 178.6 0.2 . 1 . . . . 179 GLU C . 6588 1 830 . 1 1 179 179 GLU CA C 13 59.2 0.3 . 1 . . . . 179 GLU CA . 6588 1 831 . 1 1 179 179 GLU N N 15 118.5 0.1 . 1 . . . . 179 GLU N . 6588 1 832 . 1 1 180 180 ALA H H 1 7.53 0.02 . 1 . . . . 180 ALA H . 6588 1 833 . 1 1 180 180 ALA HA H 1 4.21 0.02 . 1 . . . . 180 ALA HA . 6588 1 834 . 1 1 180 180 ALA C C 13 179.5 0.2 . 1 . . . . 180 ALA C . 6588 1 835 . 1 1 180 180 ALA CA C 13 54.2 0.3 . 1 . . . . 180 ALA CA . 6588 1 836 . 1 1 180 180 ALA N N 15 119.9 0.1 . 1 . . . . 180 ALA N . 6588 1 837 . 1 1 181 181 LEU H H 1 7.66 0.02 . 1 . . . . 181 LEU H . 6588 1 838 . 1 1 181 181 LEU HA H 1 4.23 0.02 . 1 . . . . 181 LEU HA . 6588 1 839 . 1 1 181 181 LEU C C 13 178.2 0.2 . 1 . . . . 181 LEU C . 6588 1 840 . 1 1 181 181 LEU CA C 13 56.6 0.3 . 1 . . . . 181 LEU CA . 6588 1 841 . 1 1 181 181 LEU N N 15 117.8 0.1 . 1 . . . . 181 LEU N . 6588 1 842 . 1 1 182 182 LYS H H 1 7.57 0.02 . 1 . . . . 182 LYS H . 6588 1 843 . 1 1 182 182 LYS HA H 1 4.25 0.02 . 1 . . . . 182 LYS HA . 6588 1 844 . 1 1 182 182 LYS C C 13 176.9 0.2 . 1 . . . . 182 LYS C . 6588 1 845 . 1 1 182 182 LYS CA C 13 56.8 0.3 . 1 . . . . 182 LYS CA . 6588 1 846 . 1 1 182 182 LYS N N 15 117.5 0.1 . 1 . . . . 182 LYS N . 6588 1 847 . 1 1 183 183 GLU H H 1 7.84 0.02 . 1 . . . . 183 GLU H . 6588 1 848 . 1 1 183 183 GLU HA H 1 4.28 0.02 . 1 . . . . 183 GLU HA . 6588 1 849 . 1 1 183 183 GLU C C 13 175.7 0.2 . 1 . . . . 183 GLU C . 6588 1 850 . 1 1 183 183 GLU CA C 13 56.9 0.3 . 1 . . . . 183 GLU CA . 6588 1 851 . 1 1 183 183 GLU N N 15 120.5 0.1 . 1 . . . . 183 GLU N . 6588 1 852 . 1 1 184 184 ASN H H 1 8.28 0.02 . 1 . . . . 184 ASN H . 6588 1 853 . 1 1 184 184 ASN HA H 1 4.28 0.02 . 1 . . . . 184 ASN HA . 6588 1 854 . 1 1 184 184 ASN C C 13 175.9 0.2 . 1 . . . . 184 ASN C . 6588 1 855 . 1 1 184 184 ASN CA C 13 54.6 0.3 . 1 . . . . 184 ASN CA . 6588 1 856 . 1 1 184 184 ASN N N 15 121.3 0.1 . 1 . . . . 184 ASN N . 6588 1 857 . 1 1 185 185 GLY H H 1 8.29 0.02 . 1 . . . . 185 GLY H . 6588 1 858 . 1 1 185 185 GLY HA2 H 1 3.99 0.02 . 1 . . . . 185 GLY HA2 . 6588 1 859 . 1 1 185 185 GLY HA3 H 1 3.89 0.02 . 1 . . . . 185 GLY HA3 . 6588 1 860 . 1 1 185 185 GLY CA C 13 46.71 0.3 . 1 . . . . 185 GLY CA . 6588 1 861 . 1 1 185 185 GLY N N 15 109.8 0.1 . 1 . . . . 185 GLY N . 6588 1 862 . 1 1 186 186 GLY H H 1 7.99 0.02 . 1 . . . . 186 GLY H . 6588 1 863 . 1 1 186 186 GLY HA2 H 1 3.9 0.02 . 1 . . . . 186 GLY HA2 . 6588 1 864 . 1 1 186 186 GLY HA3 H 1 4.1 0.02 . 1 . . . . 186 GLY HA3 . 6588 1 865 . 1 1 186 186 GLY C C 13 179.4 0.2 . 1 . . . . 186 GLY C . 6588 1 866 . 1 1 186 186 GLY CA C 13 46.1 0.3 . 1 . . . . 186 GLY CA . 6588 1 867 . 1 1 186 186 GLY N N 15 115.4 0.1 . 1 . . . . 186 GLY N . 6588 1 stop_ save_