data_27668 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27668 _Entry.Title ; Backbone 1H and 15N Chemical Shift Assignments for bovine BLG A at pH 2.65, 3.2, and 4.0 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-10-30 _Entry.Accession_date 2018-10-30 _Entry.Last_release_date 2018-10-31 _Entry.Original_release_date 2018-10-31 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.6.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID 1 _Entry.Generated_software_label $TOPSPIN _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _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.ORCID _Entry_author.Entry_ID 1 Johnny Birch . . . . 27668 2 Lau Nielsen . D. . . 27668 3 Emil Stender . . . . 27668 4 Birte Svensson . . . . 27668 5 Birthe Kragelund . B. . . 27668 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Structural Biology and NMR Laboratory, University of Copenhagen' . 27668 2 . 'Enzyme and Protein Chemistry, Technical University of Denmark' . 27668 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 3 27668 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '15N chemical shifts' 419 27668 '1H chemical shifts' 419 27668 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 3 . . 2020-08-20 2018-10-30 update BMRB 'update entry citation' 27668 2 . . 2019-04-25 2018-10-30 update author 'update chemical shifts' 27668 1 . . 2018-11-14 2018-10-30 original author 'original release' 27668 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 10010 'bovine beta-lactoglobulin A34C mutant' 27668 PDB 1CJ5 'BOVINE BETA-LACTOGLOBULIN A' 27668 PDB 1DV9 'STRUCTURAL CHANGES ACCOMPANYING PH-INDUCED DISSOCIATION OF THE B-LACTOGLOBULIN DIMER' 27668 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27668 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 31459761 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Alginate Trisaccharide Binding Sites on the Surface of beta-Lactoglobulin Identified by NMR Spectroscopy: Implications for Molecular Network Formation ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'ACS Omega' _Citation.Journal_name_full 'ACS omega' _Citation.Journal_volume 4 _Citation.Journal_issue 4 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2470-1343 _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 6165 _Citation.Page_last 6174 _Citation.Year 2019 _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.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Emil Stender . . . . 27668 1 2 Johnny Birch J. . . . 27668 1 3 Christian Kjeldsen C. . . . 27668 1 4 Lau Nielsen L. D. . . 27668 1 5 Jens Duus J. O. . . 27668 1 6 Birthe Kragelund B. B. . . 27668 1 7 Birte Svensson B. . . . 27668 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27668 _Assembly.ID 1 _Assembly.Name 'BLG A dimer' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . 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 'BLG A' 1 $BLG_A A . yes native no yes . . . 27668 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_asym_ID_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_asym_ID_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 66 66 SG . 1 . 1 CYS 160 160 SG . 'BLG A' . 66 CYS SG . 'BLG A' . 160 CYS SG 27668 1 2 disulfide single . 1 . 1 CYS 106 106 SG . 1 . 1 CYS 119 119 SG . 'BLG A' . 106 CYS SG . 'BLG A' . 119 CYS SG 27668 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 5EEE . . X-ray 1.95 'BLG dimer' 'Bovine lactoglobulin complex with decanol' 27668 1 yes PDB 5IO5 . . X-ray 2.85 'BLG dimer' 'Unliganded form of bovine beta-lactoglobulin, ambient pressure' 27668 1 yes PDB 6FXB . . X-ray 2 'BLG A' 'Bovine beta-lactoglobulin variant A at pH 4.0' 27668 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_BLG_A _Entity.Sf_category entity _Entity.Sf_framecode BLG_A _Entity.Entry_ID 27668 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name BLG_A _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(D) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; AYVTQTMKGLDIQKVAGTWY SLAMAASDISLLDAQSAPLR VYVEELKPTPEGDLEILLQK WENDECAQKKIIAEKTKIPA VFKIDALNENKVLVLDTDYK KYLLFCMENSAEPEQSLVCQ CLVRTPEVDDEALEKFDKAL KALPMHIRLSFNPTQLEEQC HI ; _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 162 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'free and disulfide bound' _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 . 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 yes PDB 1DV9 . 'STRUCTURAL CHANGES ACCOMPANYING PH-INDUCED DISSOCIATION OF THE B-LACTOGLOBULIN DIMER' . . . . . . . . . . . . . . 27668 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 1 ALA . 27668 1 2 2 TYR . 27668 1 3 3 VAL . 27668 1 4 4 THR . 27668 1 5 5 GLN . 27668 1 6 6 THR . 27668 1 7 7 MET . 27668 1 8 8 LYS . 27668 1 9 9 GLY . 27668 1 10 10 LEU . 27668 1 11 11 ASP . 27668 1 12 12 ILE . 27668 1 13 13 GLN . 27668 1 14 14 LYS . 27668 1 15 15 VAL . 27668 1 16 16 ALA . 27668 1 17 17 GLY . 27668 1 18 18 THR . 27668 1 19 19 TRP . 27668 1 20 20 TYR . 27668 1 21 21 SER . 27668 1 22 22 LEU . 27668 1 23 23 ALA . 27668 1 24 24 MET . 27668 1 25 25 ALA . 27668 1 26 26 ALA . 27668 1 27 27 SER . 27668 1 28 28 ASP . 27668 1 29 29 ILE . 27668 1 30 30 SER . 27668 1 31 31 LEU . 27668 1 32 32 LEU . 27668 1 33 33 ASP . 27668 1 34 34 ALA . 27668 1 35 35 GLN . 27668 1 36 36 SER . 27668 1 37 37 ALA . 27668 1 38 38 PRO . 27668 1 39 39 LEU . 27668 1 40 40 ARG . 27668 1 41 41 VAL . 27668 1 42 42 TYR . 27668 1 43 43 VAL . 27668 1 44 44 GLU . 27668 1 45 45 GLU . 27668 1 46 46 LEU . 27668 1 47 47 LYS . 27668 1 48 48 PRO . 27668 1 49 49 THR . 27668 1 50 50 PRO . 27668 1 51 51 GLU . 27668 1 52 52 GLY . 27668 1 53 53 ASP . 27668 1 54 54 LEU . 27668 1 55 55 GLU . 27668 1 56 56 ILE . 27668 1 57 57 LEU . 27668 1 58 58 LEU . 27668 1 59 59 GLN . 27668 1 60 60 LYS . 27668 1 61 61 TRP . 27668 1 62 62 GLU . 27668 1 63 63 ASN . 27668 1 64 64 ASP . 27668 1 65 65 GLU . 27668 1 66 66 CYS . 27668 1 67 67 ALA . 27668 1 68 68 GLN . 27668 1 69 69 LYS . 27668 1 70 70 LYS . 27668 1 71 71 ILE . 27668 1 72 72 ILE . 27668 1 73 73 ALA . 27668 1 74 74 GLU . 27668 1 75 75 LYS . 27668 1 76 76 THR . 27668 1 77 77 LYS . 27668 1 78 78 ILE . 27668 1 79 79 PRO . 27668 1 80 80 ALA . 27668 1 81 81 VAL . 27668 1 82 82 PHE . 27668 1 83 83 LYS . 27668 1 84 84 ILE . 27668 1 85 85 ASP . 27668 1 86 86 ALA . 27668 1 87 87 LEU . 27668 1 88 88 ASN . 27668 1 89 89 GLU . 27668 1 90 90 ASN . 27668 1 91 91 LYS . 27668 1 92 92 VAL . 27668 1 93 93 LEU . 27668 1 94 94 VAL . 27668 1 95 95 LEU . 27668 1 96 96 ASP . 27668 1 97 97 THR . 27668 1 98 98 ASP . 27668 1 99 99 TYR . 27668 1 100 100 LYS . 27668 1 101 101 LYS . 27668 1 102 102 TYR . 27668 1 103 103 LEU . 27668 1 104 104 LEU . 27668 1 105 105 PHE . 27668 1 106 106 CYS . 27668 1 107 107 MET . 27668 1 108 108 GLU . 27668 1 109 109 ASN . 27668 1 110 110 SER . 27668 1 111 111 ALA . 27668 1 112 112 GLU . 27668 1 113 113 PRO . 27668 1 114 114 GLU . 27668 1 115 115 GLN . 27668 1 116 116 SER . 27668 1 117 117 LEU . 27668 1 118 118 VAL . 27668 1 119 119 CYS . 27668 1 120 120 GLN . 27668 1 121 121 CYS . 27668 1 122 122 LEU . 27668 1 123 123 VAL . 27668 1 124 124 ARG . 27668 1 125 125 THR . 27668 1 126 126 PRO . 27668 1 127 127 GLU . 27668 1 128 128 VAL . 27668 1 129 129 ASP . 27668 1 130 130 ASP . 27668 1 131 131 GLU . 27668 1 132 132 ALA . 27668 1 133 133 LEU . 27668 1 134 134 GLU . 27668 1 135 135 LYS . 27668 1 136 136 PHE . 27668 1 137 137 ASP . 27668 1 138 138 LYS . 27668 1 139 139 ALA . 27668 1 140 140 LEU . 27668 1 141 141 LYS . 27668 1 142 142 ALA . 27668 1 143 143 LEU . 27668 1 144 144 PRO . 27668 1 145 145 MET . 27668 1 146 146 HIS . 27668 1 147 147 ILE . 27668 1 148 148 ARG . 27668 1 149 149 LEU . 27668 1 150 150 SER . 27668 1 151 151 PHE . 27668 1 152 152 ASN . 27668 1 153 153 PRO . 27668 1 154 154 THR . 27668 1 155 155 GLN . 27668 1 156 156 LEU . 27668 1 157 157 GLU . 27668 1 158 158 GLU . 27668 1 159 159 GLN . 27668 1 160 160 CYS . 27668 1 161 161 HIS . 27668 1 162 162 ILE . 27668 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 . ALA 1 1 27668 1 . TYR 2 2 27668 1 . VAL 3 3 27668 1 . THR 4 4 27668 1 . GLN 5 5 27668 1 . THR 6 6 27668 1 . MET 7 7 27668 1 . LYS 8 8 27668 1 . GLY 9 9 27668 1 . LEU 10 10 27668 1 . ASP 11 11 27668 1 . ILE 12 12 27668 1 . GLN 13 13 27668 1 . LYS 14 14 27668 1 . VAL 15 15 27668 1 . ALA 16 16 27668 1 . GLY 17 17 27668 1 . THR 18 18 27668 1 . TRP 19 19 27668 1 . TYR 20 20 27668 1 . SER 21 21 27668 1 . LEU 22 22 27668 1 . ALA 23 23 27668 1 . MET 24 24 27668 1 . ALA 25 25 27668 1 . ALA 26 26 27668 1 . SER 27 27 27668 1 . ASP 28 28 27668 1 . ILE 29 29 27668 1 . SER 30 30 27668 1 . LEU 31 31 27668 1 . LEU 32 32 27668 1 . ASP 33 33 27668 1 . ALA 34 34 27668 1 . GLN 35 35 27668 1 . SER 36 36 27668 1 . ALA 37 37 27668 1 . PRO 38 38 27668 1 . LEU 39 39 27668 1 . ARG 40 40 27668 1 . VAL 41 41 27668 1 . TYR 42 42 27668 1 . VAL 43 43 27668 1 . GLU 44 44 27668 1 . GLU 45 45 27668 1 . LEU 46 46 27668 1 . LYS 47 47 27668 1 . PRO 48 48 27668 1 . THR 49 49 27668 1 . PRO 50 50 27668 1 . GLU 51 51 27668 1 . GLY 52 52 27668 1 . ASP 53 53 27668 1 . LEU 54 54 27668 1 . GLU 55 55 27668 1 . ILE 56 56 27668 1 . LEU 57 57 27668 1 . LEU 58 58 27668 1 . GLN 59 59 27668 1 . LYS 60 60 27668 1 . TRP 61 61 27668 1 . GLU 62 62 27668 1 . ASN 63 63 27668 1 . ASP 64 64 27668 1 . GLU 65 65 27668 1 . CYS 66 66 27668 1 . ALA 67 67 27668 1 . GLN 68 68 27668 1 . LYS 69 69 27668 1 . LYS 70 70 27668 1 . ILE 71 71 27668 1 . ILE 72 72 27668 1 . ALA 73 73 27668 1 . GLU 74 74 27668 1 . LYS 75 75 27668 1 . THR 76 76 27668 1 . LYS 77 77 27668 1 . ILE 78 78 27668 1 . PRO 79 79 27668 1 . ALA 80 80 27668 1 . VAL 81 81 27668 1 . PHE 82 82 27668 1 . LYS 83 83 27668 1 . ILE 84 84 27668 1 . ASP 85 85 27668 1 . ALA 86 86 27668 1 . LEU 87 87 27668 1 . ASN 88 88 27668 1 . GLU 89 89 27668 1 . ASN 90 90 27668 1 . LYS 91 91 27668 1 . VAL 92 92 27668 1 . LEU 93 93 27668 1 . VAL 94 94 27668 1 . LEU 95 95 27668 1 . ASP 96 96 27668 1 . THR 97 97 27668 1 . ASP 98 98 27668 1 . TYR 99 99 27668 1 . LYS 100 100 27668 1 . LYS 101 101 27668 1 . TYR 102 102 27668 1 . LEU 103 103 27668 1 . LEU 104 104 27668 1 . PHE 105 105 27668 1 . CYS 106 106 27668 1 . MET 107 107 27668 1 . GLU 108 108 27668 1 . ASN 109 109 27668 1 . SER 110 110 27668 1 . ALA 111 111 27668 1 . GLU 112 112 27668 1 . PRO 113 113 27668 1 . GLU 114 114 27668 1 . GLN 115 115 27668 1 . SER 116 116 27668 1 . LEU 117 117 27668 1 . VAL 118 118 27668 1 . CYS 119 119 27668 1 . GLN 120 120 27668 1 . CYS 121 121 27668 1 . LEU 122 122 27668 1 . VAL 123 123 27668 1 . ARG 124 124 27668 1 . THR 125 125 27668 1 . PRO 126 126 27668 1 . GLU 127 127 27668 1 . VAL 128 128 27668 1 . ASP 129 129 27668 1 . ASP 130 130 27668 1 . GLU 131 131 27668 1 . ALA 132 132 27668 1 . LEU 133 133 27668 1 . GLU 134 134 27668 1 . LYS 135 135 27668 1 . PHE 136 136 27668 1 . ASP 137 137 27668 1 . LYS 138 138 27668 1 . ALA 139 139 27668 1 . LEU 140 140 27668 1 . LYS 141 141 27668 1 . ALA 142 142 27668 1 . LEU 143 143 27668 1 . PRO 144 144 27668 1 . MET 145 145 27668 1 . HIS 146 146 27668 1 . ILE 147 147 27668 1 . ARG 148 148 27668 1 . LEU 149 149 27668 1 . SER 150 150 27668 1 . PHE 151 151 27668 1 . ASN 152 152 27668 1 . PRO 153 153 27668 1 . THR 154 154 27668 1 . GLN 155 155 27668 1 . LEU 156 156 27668 1 . GLU 157 157 27668 1 . GLU 158 158 27668 1 . GLN 159 159 27668 1 . CYS 160 160 27668 1 . HIS 161 161 27668 1 . ILE 162 162 27668 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 27668 _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.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.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $BLG_A . 9913 organism . 'Bos taurus' cow . . Eukaryota Metazoa Bos taurus . . . . . . . . . . . . . 27668 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 27668 _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_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.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $BLG_A . 'recombinant technology' 'Pichia pastoris' . . . Pichia pastoris . . . . . . 'pPICZ A' . . . 27668 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27668 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _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 'BLG A dimer' '[1H, 15N]' . . 1 $BLG_A . . 400 . . uM . . . . 27668 1 2 'potassium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 27668 1 3 'ammonium sulfate' '[U-99% 15N]' . . . . . . 1 . . % . . . . 27668 1 4 DSS 'natural abundance' . . . . . . 1 . . mM . . . . 27668 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 27668 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _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 'ionic strength' 50 . mM 27668 1 pH 2.65 . pH 27668 1 pressure 1 . atm 27668 1 temperature 273 . K 27668 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 27668 _Sample_condition_list.ID 2 _Sample_condition_list.Name . _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 'ionic strength' 50 . mM 27668 2 pH 3.2 . pH 27668 2 pressure 1 . atm 27668 2 temperature 273 . K 27668 2 stop_ save_ save_sample_conditions_3 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_3 _Sample_condition_list.Entry_ID 27668 _Sample_condition_list.ID 3 _Sample_condition_list.Name . _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 'ionic strength' 50 . mM 27668 3 pH 4.0 . pH 27668 3 pressure 1 . atm 27668 3 temperature 273 . K 27668 3 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 27668 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 27668 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 27668 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 27668 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 27668 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 27668 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 27668 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27668 1 2 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27668 1 3 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 3 $sample_conditions_3 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27668 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 27668 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 DSS protons . . . . ppm 0 internal direct 1 . . . . . 27668 1 N 15 DSS nitrogen . . . . ppm 0 internal direct 0.10132922 . . . . . 27668 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_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 27668 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _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 '2D 1H-15N HSQC' . . . 27668 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _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 ALA H H 1 8.15643 . . . . . . . . 1 Ala H . 27668 1 2 . 1 . 1 1 1 ALA N N 15 124.59457 . . . . . . . . 1 Ala N . 27668 1 3 . 1 . 1 3 3 VAL H H 1 7.97976 . . . . . . . . 3 Val H . 27668 1 4 . 1 . 1 3 3 VAL N N 15 120.01245 . . . . . . . . 3 Val N . 27668 1 5 . 1 . 1 4 4 THR H H 1 8.06521 . . . . . . . . 4 Thr H . 27668 1 6 . 1 . 1 4 4 THR N N 15 115.78378 . . . . . . . . 4 Thr N . 27668 1 7 . 1 . 1 5 5 GLN H H 1 8.27049 . . . . . . . . 5 Gln H . 27668 1 8 . 1 . 1 5 5 GLN N N 15 123.73629 . . . . . . . . 5 Gln N . 27668 1 9 . 1 . 1 6 6 THR H H 1 7.76571 . . . . . . . . 6 Thr H . 27668 1 10 . 1 . 1 6 6 THR N N 15 111.52551 . . . . . . . . 6 Thr N . 27668 1 11 . 1 . 1 7 7 MET H H 1 7.74564 . . . . . . . . 7 Met H . 27668 1 12 . 1 . 1 7 7 MET N N 15 120.26974 . . . . . . . . 7 Met N . 27668 1 13 . 1 . 1 8 8 LYS H H 1 8.67298 . . . . . . . . 8 Lys H . 27668 1 14 . 1 . 1 8 8 LYS N N 15 127.64492 . . . . . . . . 8 Lys N . 27668 1 15 . 1 . 1 9 9 GLY H H 1 8.56641 . . . . . . . . 9 Gly H . 27668 1 16 . 1 . 1 9 9 GLY N N 15 109.49763 . . . . . . . . 9 Gly N . 27668 1 17 . 1 . 1 10 10 LEU H H 1 7.55358 . . . . . . . . 10 Leu H . 27668 1 18 . 1 . 1 10 10 LEU N N 15 120.10352 . . . . . . . . 10 Leu N . 27668 1 19 . 1 . 1 11 11 ASP H H 1 8.62551 . . . . . . . . 11 Asp H . 27668 1 20 . 1 . 1 11 11 ASP N N 15 126.75372 . . . . . . . . 11 Asp N . 27668 1 21 . 1 . 1 12 12 ILE H H 1 8.87636 . . . . . . . . 12 Ile H . 27668 1 22 . 1 . 1 12 12 ILE N N 15 122.89097 . . . . . . . . 12 Ile N . 27668 1 23 . 1 . 1 13 13 GLN H H 1 7.96968 . . . . . . . . 13 Gln H . 27668 1 24 . 1 . 1 13 13 GLN N N 15 117.15618 . . . . . . . . 13 Gln N . 27668 1 25 . 1 . 1 14 14 LYS H H 1 7.21671 . . . . . . . . 14 Lys H . 27668 1 26 . 1 . 1 14 14 LYS N N 15 113.68596 . . . . . . . . 14 Lys N . 27668 1 27 . 1 . 1 15 15 VAL H H 1 7.39204 . . . . . . . . 15 Val H . 27668 1 28 . 1 . 1 15 15 VAL N N 15 110.22847 . . . . . . . . 15 Val N . 27668 1 29 . 1 . 1 16 16 ALA H H 1 6.80901 . . . . . . . . 16 Ala H . 27668 1 30 . 1 . 1 16 16 ALA N N 15 120.91933 . . . . . . . . 16 Ala N . 27668 1 31 . 1 . 1 17 17 GLY H H 1 9.18302 . . . . . . . . 17 Gly H . 27668 1 32 . 1 . 1 17 17 GLY N N 15 110.13558 . . . . . . . . 17 Gly N . 27668 1 33 . 1 . 1 18 18 THR H H 1 8.39327 . . . . . . . . 18 Thr H . 27668 1 34 . 1 . 1 18 18 THR N N 15 118.41612 . . . . . . . . 18 Thr N . 27668 1 35 . 1 . 1 19 19 TRP H H 1 7.45290 . . . . . . . . 19 Trp H . 27668 1 36 . 1 . 1 19 19 TRP N N 15 124.02397 . . . . . . . . 19 Trp N . 27668 1 37 . 1 . 1 20 20 TYR H H 1 9.11053 . . . . . . . . 20 Tyr H . 27668 1 38 . 1 . 1 20 20 TYR N N 15 112.15955 . . . . . . . . 20 Tyr N . 27668 1 39 . 1 . 1 21 21 SER H H 1 9.90568 . . . . . . . . 21 Ser H . 27668 1 40 . 1 . 1 21 21 SER N N 15 119.46518 . . . . . . . . 21 Ser N . 27668 1 41 . 1 . 1 23 23 ALA H H 1 7.71380 . . . . . . . . 23 Ala H . 27668 1 42 . 1 . 1 23 23 ALA N N 15 114.89985 . . . . . . . . 23 Ala N . 27668 1 43 . 1 . 1 24 24 MET H H 1 9.07795 . . . . . . . . 24 Met H . 27668 1 44 . 1 . 1 24 24 MET N N 15 114.80677 . . . . . . . . 24 Met N . 27668 1 45 . 1 . 1 25 25 ALA H H 1 9.30156 . . . . . . . . 25 Ala H . 27668 1 46 . 1 . 1 25 25 ALA N N 15 123.46674 . . . . . . . . 25 Ala N . 27668 1 47 . 1 . 1 26 26 ALA H H 1 8.31501 . . . . . . . . 26 Ala H . 27668 1 48 . 1 . 1 26 26 ALA N N 15 119.74171 . . . . . . . . 26 Ala N . 27668 1 49 . 1 . 1 27 27 SER H H 1 8.36407 . . . . . . . . 27 Ser H . 27668 1 50 . 1 . 1 27 27 SER N N 15 116.24497 . . . . . . . . 27 Ser N . 27668 1 51 . 1 . 1 28 28 ASP H H 1 7.86704 . . . . . . . . 28 Asp H . 27668 1 52 . 1 . 1 28 28 ASP N N 15 119.73086 . . . . . . . . 28 Asp N . 27668 1 53 . 1 . 1 29 29 ILE H H 1 8.80004 . . . . . . . . 29 Ile H . 27668 1 54 . 1 . 1 29 29 ILE N N 15 124.28563 . . . . . . . . 29 Ile N . 27668 1 55 . 1 . 1 30 30 SER H H 1 7.95915 . . . . . . . . 30 Ser H . 27668 1 56 . 1 . 1 30 30 SER N N 15 114.17990 . . . . . . . . 30 Ser N . 27668 1 57 . 1 . 1 31 31 LEU H H 1 7.59857 . . . . . . . . 31 Leu H . 27668 1 58 . 1 . 1 31 31 LEU N N 15 117.04072 . . . . . . . . 31 Leu N . 27668 1 59 . 1 . 1 32 32 LEU H H 1 7.05274 . . . . . . . . 32 Leu H . 27668 1 60 . 1 . 1 32 32 LEU N N 15 111.20543 . . . . . . . . 32 Leu N . 27668 1 61 . 1 . 1 33 33 ASP H H 1 7.82273 . . . . . . . . 33 Asp H . 27668 1 62 . 1 . 1 33 33 ASP N N 15 118.36838 . . . . . . . . 33 Asp N . 27668 1 63 . 1 . 1 34 34 ALA H H 1 7.63220 . . . . . . . . 34 Ala H . 27668 1 64 . 1 . 1 34 34 ALA N N 15 120.67853 . . . . . . . . 34 Ala N . 27668 1 65 . 1 . 1 35 35 GLN H H 1 9.05349 . . . . . . . . 35 Gln H . 27668 1 66 . 1 . 1 35 35 GLN N N 15 121.49879 . . . . . . . . 35 Gln N . 27668 1 67 . 1 . 1 36 36 SER H H 1 7.71685 . . . . . . . . 36 Ser H . 27668 1 68 . 1 . 1 36 36 SER N N 15 107.56900 . . . . . . . . 36 Ser N . 27668 1 69 . 1 . 1 37 37 ALA H H 1 7.53554 . . . . . . . . 37 Ala H . 27668 1 70 . 1 . 1 37 37 ALA N N 15 126.24552 . . . . . . . . 37 Ala N . 27668 1 71 . 1 . 1 39 39 LEU H H 1 7.76613 . . . . . . . . 39 Leu H . 27668 1 72 . 1 . 1 39 39 LEU N N 15 114.01620 . . . . . . . . 39 Leu N . 27668 1 73 . 1 . 1 40 40 ARG H H 1 7.41082 . . . . . . . . 40 Arg H . 27668 1 74 . 1 . 1 40 40 ARG N N 15 122.27551 . . . . . . . . 40 Arg N . 27668 1 75 . 1 . 1 41 41 VAL H H 1 6.95828 . . . . . . . . 41 Val H . 27668 1 76 . 1 . 1 41 41 VAL N N 15 117.00004 . . . . . . . . 41 Val N . 27668 1 77 . 1 . 1 42 42 TYR H H 1 8.60354 . . . . . . . . 42 Tyr H . 27668 1 78 . 1 . 1 42 42 TYR N N 15 120.57414 . . . . . . . . 42 Tyr N . 27668 1 79 . 1 . 1 43 43 VAL H H 1 8.62631 . . . . . . . . 43 Val H . 27668 1 80 . 1 . 1 43 43 VAL N N 15 125.16272 . . . . . . . . 43 Val N . 27668 1 81 . 1 . 1 44 44 GLU H H 1 8.96265 . . . . . . . . 44 Glu H . 27668 1 82 . 1 . 1 44 44 GLU N N 15 121.77781 . . . . . . . . 44 Glu N . 27668 1 83 . 1 . 1 45 45 GLU H H 1 7.61860 . . . . . . . . 45 Glu H . 27668 1 84 . 1 . 1 45 45 GLU N N 15 116.28568 . . . . . . . . 45 Glu N . 27668 1 85 . 1 . 1 46 46 LEU H H 1 8.66171 . . . . . . . . 46 Leu H . 27668 1 86 . 1 . 1 46 46 LEU N N 15 122.04242 . . . . . . . . 46 Leu N . 27668 1 87 . 1 . 1 47 47 LYS H H 1 9.15635 . . . . . . . . 47 Lys H . 27668 1 88 . 1 . 1 47 47 LYS N N 15 122.45109 . . . . . . . . 47 Lys N . 27668 1 89 . 1 . 1 49 49 THR H H 1 8.59743 . . . . . . . . 49 Thr H . 27668 1 90 . 1 . 1 49 49 THR N N 15 114.30182 . . . . . . . . 49 Thr N . 27668 1 91 . 1 . 1 51 51 GLU H H 1 7.52999 . . . . . . . . 51 Glu H . 27668 1 92 . 1 . 1 51 51 GLU N N 15 112.07266 . . . . . . . . 51 Glu N . 27668 1 93 . 1 . 1 52 52 GLY H H 1 8.28883 . . . . . . . . 52 Gly H . 27668 1 94 . 1 . 1 52 52 GLY N N 15 107.02147 . . . . . . . . 52 Gly N . 27668 1 95 . 1 . 1 53 53 ASP H H 1 7.18097 . . . . . . . . 53 Asp H . 27668 1 96 . 1 . 1 53 53 ASP N N 15 115.19377 . . . . . . . . 53 Asp N . 27668 1 97 . 1 . 1 54 54 LEU H H 1 8.80694 . . . . . . . . 54 Leu H . 27668 1 98 . 1 . 1 54 54 LEU N N 15 119.43935 . . . . . . . . 54 Leu N . 27668 1 99 . 1 . 1 55 55 GLU H H 1 8.62626 . . . . . . . . 55 Glu H . 27668 1 100 . 1 . 1 55 55 GLU N N 15 126.06353 . . . . . . . . 55 Glu N . 27668 1 101 . 1 . 1 56 56 ILE H H 1 9.26173 . . . . . . . . 56 Ile H . 27668 1 102 . 1 . 1 56 56 ILE N N 15 126.51533 . . . . . . . . 56 Ile N . 27668 1 103 . 1 . 1 57 57 LEU H H 1 8.48296 . . . . . . . . 57 Leu H . 27668 1 104 . 1 . 1 57 57 LEU N N 15 128.60409 . . . . . . . . 57 Leu N . 27668 1 105 . 1 . 1 58 58 LEU H H 1 9.06596 . . . . . . . . 58 Leu H . 27668 1 106 . 1 . 1 58 58 LEU N N 15 123.39194 . . . . . . . . 58 Leu N . 27668 1 107 . 1 . 1 59 59 GLN H H 1 9.23144 . . . . . . . . 59 Gln H . 27668 1 108 . 1 . 1 59 59 GLN N N 15 117.71479 . . . . . . . . 59 Gln N . 27668 1 109 . 1 . 1 60 60 LYS H H 1 8.95487 . . . . . . . . 60 Lys H . 27668 1 110 . 1 . 1 60 60 LYS N N 15 121.50446 . . . . . . . . 60 Lys N . 27668 1 111 . 1 . 1 61 61 TRP H H 1 9.74021 . . . . . . . . 61 Trp H . 27668 1 112 . 1 . 1 61 61 TRP N N 15 129.85600 . . . . . . . . 61 Trp N . 27668 1 113 . 1 . 1 62 62 GLU H H 1 8.74944 . . . . . . . . 62 Glu H . 27668 1 114 . 1 . 1 62 62 GLU N N 15 127.25120 . . . . . . . . 62 Glu N . 27668 1 115 . 1 . 1 64 64 ASP H H 1 8.13732 . . . . . . . . 64 Asp H . 27668 1 116 . 1 . 1 64 64 ASP N N 15 110.99922 . . . . . . . . 64 Asp N . 27668 1 117 . 1 . 1 65 65 GLU H H 1 6.75262 . . . . . . . . 65 Glu H . 27668 1 118 . 1 . 1 65 65 GLU N N 15 114.52271 . . . . . . . . 65 Glu N . 27668 1 119 . 1 . 1 66 66 CYS H H 1 8.67315 . . . . . . . . 66 Cys H . 27668 1 120 . 1 . 1 66 66 CYS N N 15 120.24011 . . . . . . . . 66 Cys N . 27668 1 121 . 1 . 1 67 67 ALA H H 1 8.97902 . . . . . . . . 67 Ala H . 27668 1 122 . 1 . 1 67 67 ALA N N 15 133.48986 . . . . . . . . 67 Ala N . 27668 1 123 . 1 . 1 68 68 GLN H H 1 8.38211 . . . . . . . . 68 Gln H . 27668 1 124 . 1 . 1 68 68 GLN N N 15 118.63500 . . . . . . . . 68 Gln N . 27668 1 125 . 1 . 1 69 69 LYS H H 1 9.15043 . . . . . . . . 69 Lys H . 27668 1 126 . 1 . 1 69 69 LYS N N 15 123.69047 . . . . . . . . 69 Lys N . 27668 1 127 . 1 . 1 70 70 LYS H H 1 8.54061 . . . . . . . . 70 Lys H . 27668 1 128 . 1 . 1 70 70 LYS N N 15 123.68471 . . . . . . . . 70 Lys N . 27668 1 129 . 1 . 1 71 71 ILE H H 1 8.95827 . . . . . . . . 71 Ile H . 27668 1 130 . 1 . 1 71 71 ILE N N 15 124.10149 . . . . . . . . 71 Ile N . 27668 1 131 . 1 . 1 72 72 ILE H H 1 8.49789 . . . . . . . . 72 Ile H . 27668 1 132 . 1 . 1 72 72 ILE N N 15 125.44535 . . . . . . . . 72 Ile N . 27668 1 133 . 1 . 1 73 73 ALA H H 1 9.26399 . . . . . . . . 73 Ala H . 27668 1 134 . 1 . 1 73 73 ALA N N 15 133.29749 . . . . . . . . 73 Ala N . 27668 1 135 . 1 . 1 74 74 GLU H H 1 9.43616 . . . . . . . . 74 Glu H . 27668 1 136 . 1 . 1 74 74 GLU N N 15 124.51227 . . . . . . . . 74 Glu N . 27668 1 137 . 1 . 1 75 75 LYS H H 1 8.48430 . . . . . . . . 75 Lys H . 27668 1 138 . 1 . 1 75 75 LYS N N 15 123.14929 . . . . . . . . 75 Lys N . 27668 1 139 . 1 . 1 76 76 THR H H 1 8.44455 . . . . . . . . 76 Thr H . 27668 1 140 . 1 . 1 76 76 THR N N 15 112.58423 . . . . . . . . 76 Thr N . 27668 1 141 . 1 . 1 77 77 LYS H H 1 8.27246 . . . . . . . . 77 Lys H . 27668 1 142 . 1 . 1 77 77 LYS N N 15 116.45166 . . . . . . . . 77 Lys N . 27668 1 143 . 1 . 1 78 78 ILE H H 1 7.97976 . . . . . . . . 78 Ile H . 27668 1 144 . 1 . 1 78 78 ILE N N 15 122.29466 . . . . . . . . 78 Ile N . 27668 1 145 . 1 . 1 80 80 ALA H H 1 7.85116 . . . . . . . . 80 Ala H . 27668 1 146 . 1 . 1 80 80 ALA N N 15 115.21697 . . . . . . . . 80 Ala N . 27668 1 147 . 1 . 1 81 81 VAL H H 1 7.28916 . . . . . . . . 81 Val H . 27668 1 148 . 1 . 1 81 81 VAL N N 15 117.36832 . . . . . . . . 81 Val N . 27668 1 149 . 1 . 1 82 82 PHE H H 1 9.53946 . . . . . . . . 82 Phe H . 27668 1 150 . 1 . 1 82 82 PHE N N 15 126.27510 . . . . . . . . 82 Phe N . 27668 1 151 . 1 . 1 83 83 LYS H H 1 9.48594 . . . . . . . . 83 Lys H . 27668 1 152 . 1 . 1 83 83 LYS N N 15 123.23708 . . . . . . . . 83 Lys N . 27668 1 153 . 1 . 1 84 84 ILE H H 1 7.76460 . . . . . . . . 84 Ile H . 27668 1 154 . 1 . 1 84 84 ILE N N 15 116.44367 . . . . . . . . 84 Ile N . 27668 1 155 . 1 . 1 85 85 ASP H H 1 8.79959 . . . . . . . . 85 Asp H . 27668 1 156 . 1 . 1 85 85 ASP N N 15 119.19504 . . . . . . . . 85 Asp N . 27668 1 157 . 1 . 1 86 86 ALA H H 1 7.22122 . . . . . . . . 86 Ala H . 27668 1 158 . 1 . 1 86 86 ALA N N 15 121.93170 . . . . . . . . 86 Ala N . 27668 1 159 . 1 . 1 87 87 LEU H H 1 9.01196 . . . . . . . . 87 Leu H . 27668 1 160 . 1 . 1 87 87 LEU N N 15 114.53929 . . . . . . . . 87 Leu N . 27668 1 161 . 1 . 1 88 88 ASN H H 1 8.68998 . . . . . . . . 88 Asn H . 27668 1 162 . 1 . 1 88 88 ASN N N 15 111.24401 . . . . . . . . 88 Asn N . 27668 1 163 . 1 . 1 89 89 GLU H H 1 8.24907 . . . . . . . . 89 Glu H . 27668 1 164 . 1 . 1 89 89 GLU N N 15 117.30760 . . . . . . . . 89 Glu N . 27668 1 165 . 1 . 1 90 90 ASN H H 1 9.10042 . . . . . . . . 90 Asn H . 27668 1 166 . 1 . 1 90 90 ASN N N 15 115.65692 . . . . . . . . 90 Asn N . 27668 1 167 . 1 . 1 91 91 LYS H H 1 8.55857 . . . . . . . . 91 Lys H . 27668 1 168 . 1 . 1 91 91 LYS N N 15 121.60317 . . . . . . . . 91 Lys N . 27668 1 169 . 1 . 1 92 92 VAL H H 1 9.05227 . . . . . . . . 92 Val H . 27668 1 170 . 1 . 1 92 92 VAL N N 15 121.20367 . . . . . . . . 92 Val N . 27668 1 171 . 1 . 1 93 93 LEU H H 1 9.42034 . . . . . . . . 93 Leu H . 27668 1 172 . 1 . 1 93 93 LEU N N 15 125.99242 . . . . . . . . 93 Leu N . 27668 1 173 . 1 . 1 94 94 VAL H H 1 9.32618 . . . . . . . . 94 Val H . 27668 1 174 . 1 . 1 94 94 VAL N N 15 123.87681 . . . . . . . . 94 Val N . 27668 1 175 . 1 . 1 95 95 LEU H H 1 8.45414 . . . . . . . . 95 Leu H . 27668 1 176 . 1 . 1 95 95 LEU N N 15 128.07003 . . . . . . . . 95 Leu N . 27668 1 177 . 1 . 1 96 96 ASP H H 1 7.20926 . . . . . . . . 96 Asp H . 27668 1 178 . 1 . 1 96 96 ASP N N 15 109.88994 . . . . . . . . 96 Asp N . 27668 1 179 . 1 . 1 97 97 THR H H 1 7.78325 . . . . . . . . 97 Thr H . 27668 1 180 . 1 . 1 97 97 THR N N 15 118.87714 . . . . . . . . 97 Thr N . 27668 1 181 . 1 . 1 98 98 ASP H H 1 6.77772 . . . . . . . . 98 Asp H . 27668 1 182 . 1 . 1 98 98 ASP N N 15 123.01581 . . . . . . . . 98 Asp N . 27668 1 183 . 1 . 1 99 99 TYR H H 1 9.03330 . . . . . . . . 99 Tyr H . 27668 1 184 . 1 . 1 99 99 TYR N N 15 117.73471 . . . . . . . . 99 Tyr N . 27668 1 185 . 1 . 1 100 100 LYS H H 1 9.00755 . . . . . . . . 100 Lys H . 27668 1 186 . 1 . 1 100 100 LYS N N 15 119.52930 . . . . . . . . 100 Lys N . 27668 1 187 . 1 . 1 101 101 LYS H H 1 9.15464 . . . . . . . . 101 Lys H . 27668 1 188 . 1 . 1 101 101 LYS N N 15 118.65722 . . . . . . . . 101 Lys N . 27668 1 189 . 1 . 1 102 102 TYR H H 1 8.92234 . . . . . . . . 102 Tyr H . 27668 1 190 . 1 . 1 102 102 TYR N N 15 116.31300 . . . . . . . . 102 Tyr N . 27668 1 191 . 1 . 1 103 103 LEU H H 1 9.15925 . . . . . . . . 103 Leu H . 27668 1 192 . 1 . 1 103 103 LEU N N 15 125.00071 . . . . . . . . 103 Leu N . 27668 1 193 . 1 . 1 104 104 LEU H H 1 9.36536 . . . . . . . . 104 Leu H . 27668 1 194 . 1 . 1 104 104 LEU N N 15 124.93146 . . . . . . . . 104 Leu N . 27668 1 195 . 1 . 1 105 105 PHE H H 1 8.88840 . . . . . . . . 105 Phe H . 27668 1 196 . 1 . 1 105 105 PHE N N 15 121.27987 . . . . . . . . 105 Phe N . 27668 1 197 . 1 . 1 106 106 CYS H H 1 9.65116 . . . . . . . . 106 Cys H . 27668 1 198 . 1 . 1 106 106 CYS N N 15 117.24096 . . . . . . . . 106 Cys N . 27668 1 199 . 1 . 1 107 107 MET H H 1 9.91503 . . . . . . . . 107 Met H . 27668 1 200 . 1 . 1 107 107 MET N N 15 120.66742 . . . . . . . . 107 Met N . 27668 1 201 . 1 . 1 108 108 GLU H H 1 8.39827 . . . . . . . . 108 Glu H . 27668 1 202 . 1 . 1 108 108 GLU N N 15 113.70119 . . . . . . . . 108 Glu N . 27668 1 203 . 1 . 1 109 109 ASN H H 1 9.38562 . . . . . . . . 109 Asn H . 27668 1 204 . 1 . 1 109 109 ASN N N 15 120.15087 . . . . . . . . 109 Asn N . 27668 1 205 . 1 . 1 110 110 SER H H 1 9.80254 . . . . . . . . 110 Ser H . 27668 1 206 . 1 . 1 110 110 SER N N 15 122.14229 . . . . . . . . 110 Ser N . 27668 1 207 . 1 . 1 111 111 ALA H H 1 8.31275 . . . . . . . . 111 Ala H . 27668 1 208 . 1 . 1 111 111 ALA N N 15 123.40470 . . . . . . . . 111 Ala N . 27668 1 209 . 1 . 1 112 112 GLU H H 1 7.74809 . . . . . . . . 112 Glu H . 27668 1 210 . 1 . 1 112 112 GLU N N 15 113.49337 . . . . . . . . 112 Glu N . 27668 1 211 . 1 . 1 114 114 GLU H H 1 8.29799 . . . . . . . . 114 Glu H . 27668 1 212 . 1 . 1 114 114 GLU N N 15 114.63679 . . . . . . . . 114 Glu N . 27668 1 213 . 1 . 1 115 115 GLN H H 1 7.80129 . . . . . . . . 115 Gln H . 27668 1 214 . 1 . 1 115 115 GLN N N 15 115.90362 . . . . . . . . 115 Gln N . 27668 1 215 . 1 . 1 116 116 SER H H 1 7.55463 . . . . . . . . 116 Ser H . 27668 1 216 . 1 . 1 116 116 SER N N 15 109.57738 . . . . . . . . 116 Ser N . 27668 1 217 . 1 . 1 117 117 LEU H H 1 7.23519 . . . . . . . . 117 Leu H . 27668 1 218 . 1 . 1 117 117 LEU N N 15 126.29035 . . . . . . . . 117 Leu N . 27668 1 219 . 1 . 1 118 118 VAL H H 1 8.81571 . . . . . . . . 118 Val H . 27668 1 220 . 1 . 1 118 118 VAL N N 15 126.07323 . . . . . . . . 118 Val N . 27668 1 221 . 1 . 1 119 119 CYS H H 1 9.40553 . . . . . . . . 119 Cys H . 27668 1 222 . 1 . 1 119 119 CYS N N 15 121.91887 . . . . . . . . 119 Cys N . 27668 1 223 . 1 . 1 120 120 GLN H H 1 9.34365 . . . . . . . . 120 Gln H . 27668 1 224 . 1 . 1 120 120 GLN N N 15 118.52032 . . . . . . . . 120 Gln N . 27668 1 225 . 1 . 1 121 121 CYS H H 1 7.85199 . . . . . . . . 121 Cys H . 27668 1 226 . 1 . 1 121 121 CYS N N 15 119.99707 . . . . . . . . 121 Cys N . 27668 1 227 . 1 . 1 122 122 LEU H H 1 9.73782 . . . . . . . . 122 Leu H . 27668 1 228 . 1 . 1 122 122 LEU N N 15 128.50498 . . . . . . . . 122 Leu N . 27668 1 229 . 1 . 1 123 123 VAL H H 1 9.45469 . . . . . . . . 123 Val H . 27668 1 230 . 1 . 1 123 123 VAL N N 15 111.39529 . . . . . . . . 123 Val N . 27668 1 231 . 1 . 1 124 124 ARG H H 1 7.92677 . . . . . . . . 124 Arg H . 27668 1 232 . 1 . 1 124 124 ARG N N 15 119.67240 . . . . . . . . 124 Arg N . 27668 1 233 . 1 . 1 125 125 THR H H 1 7.50602 . . . . . . . . 125 Thr H . 27668 1 234 . 1 . 1 125 125 THR N N 15 108.37344 . . . . . . . . 125 Thr N . 27668 1 235 . 1 . 1 127 127 GLU H H 1 8.28294 . . . . . . . . 127 Glu H . 27668 1 236 . 1 . 1 127 127 GLU N N 15 119.97738 . . . . . . . . 127 Glu N . 27668 1 237 . 1 . 1 128 128 VAL H H 1 8.34333 . . . . . . . . 128 Val H . 27668 1 238 . 1 . 1 128 128 VAL N N 15 119.18327 . . . . . . . . 128 Val N . 27668 1 239 . 1 . 1 130 130 ASP H H 1 9.09900 . . . . . . . . 130 Asp H . 27668 1 240 . 1 . 1 130 130 ASP N N 15 123.73890 . . . . . . . . 130 Asp N . 27668 1 241 . 1 . 1 131 131 GLU H H 1 8.36184 . . . . . . . . 131 Glu H . 27668 1 242 . 1 . 1 131 131 GLU N N 15 121.06660 . . . . . . . . 131 Glu N . 27668 1 243 . 1 . 1 132 132 ALA H H 1 7.59799 . . . . . . . . 132 Ala H . 27668 1 244 . 1 . 1 132 132 ALA N N 15 121.35079 . . . . . . . . 132 Ala N . 27668 1 245 . 1 . 1 133 133 LEU H H 1 7.71521 . . . . . . . . 133 Leu H . 27668 1 246 . 1 . 1 133 133 LEU N N 15 116.01863 . . . . . . . . 133 Leu N . 27668 1 247 . 1 . 1 134 134 GLU H H 1 8.03054 . . . . . . . . 134 Glu H . 27668 1 248 . 1 . 1 134 134 GLU N N 15 119.45250 . . . . . . . . 134 Glu N . 27668 1 249 . 1 . 1 136 136 PHE H H 1 8.51721 . . . . . . . . 136 Phe H . 27668 1 250 . 1 . 1 136 136 PHE N N 15 122.04570 . . . . . . . . 136 Phe N . 27668 1 251 . 1 . 1 137 137 ASP H H 1 8.74399 . . . . . . . . 137 Asp H . 27668 1 252 . 1 . 1 137 137 ASP N N 15 117.15873 . . . . . . . . 137 Asp N . 27668 1 253 . 1 . 1 138 138 LYS H H 1 7.95303 . . . . . . . . 138 Lys H . 27668 1 254 . 1 . 1 138 138 LYS N N 15 119.18843 . . . . . . . . 138 Lys N . 27668 1 255 . 1 . 1 139 139 ALA H H 1 7.82219 . . . . . . . . 139 Ala H . 27668 1 256 . 1 . 1 139 139 ALA N N 15 121.80212 . . . . . . . . 139 Ala N . 27668 1 257 . 1 . 1 140 140 LEU H H 1 7.49697 . . . . . . . . 140 Leu H . 27668 1 258 . 1 . 1 140 140 LEU N N 15 114.34566 . . . . . . . . 140 Leu N . 27668 1 259 . 1 . 1 141 141 LYS H H 1 7.15578 . . . . . . . . 141 Lys H . 27668 1 260 . 1 . 1 141 141 LYS N N 15 119.60654 . . . . . . . . 141 Lys N . 27668 1 261 . 1 . 1 142 142 ALA H H 1 7.76552 . . . . . . . . 142 Ala H . 27668 1 262 . 1 . 1 142 142 ALA N N 15 118.55108 . . . . . . . . 142 Ala N . 27668 1 263 . 1 . 1 143 143 LEU H H 1 7.71446 . . . . . . . . 143 Leu H . 27668 1 264 . 1 . 1 143 143 LEU N N 15 119.62585 . . . . . . . . 143 Leu N . 27668 1 265 . 1 . 1 145 145 MET H H 1 7.67849 . . . . . . . . 145 Met H . 27668 1 266 . 1 . 1 145 145 MET N N 15 118.05021 . . . . . . . . 145 Met N . 27668 1 267 . 1 . 1 146 146 HIS H H 1 8.79564 . . . . . . . . 146 His H . 27668 1 268 . 1 . 1 146 146 HIS N N 15 117.93502 . . . . . . . . 146 His N . 27668 1 269 . 1 . 1 147 147 ILE H H 1 7.71735 . . . . . . . . 147 Ile H . 27668 1 270 . 1 . 1 147 147 ILE N N 15 117.37379 . . . . . . . . 147 Ile N . 27668 1 271 . 1 . 1 148 148 ARG H H 1 8.35305 . . . . . . . . 148 Arg H . 27668 1 272 . 1 . 1 148 148 ARG N N 15 126.59549 . . . . . . . . 148 Arg N . 27668 1 273 . 1 . 1 149 149 LEU H H 1 9.14659 . . . . . . . . 149 Leu H . 27668 1 274 . 1 . 1 149 149 LEU N N 15 123.95753 . . . . . . . . 149 Leu N . 27668 1 275 . 1 . 1 150 150 SER H H 1 8.21158 . . . . . . . . 150 Ser H . 27668 1 276 . 1 . 1 150 150 SER N N 15 116.34615 . . . . . . . . 150 Ser N . 27668 1 277 . 1 . 1 151 151 PHE H H 1 8.10716 . . . . . . . . 151 Phe H . 27668 1 278 . 1 . 1 151 151 PHE N N 15 119.46492 . . . . . . . . 151 Phe N . 27668 1 279 . 1 . 1 152 152 ASN H H 1 8.75075 . . . . . . . . 152 Asn H . 27668 1 280 . 1 . 1 152 152 ASN N N 15 119.31841 . . . . . . . . 152 Asn N . 27668 1 281 . 1 . 1 154 154 THR H H 1 8.12013 . . . . . . . . 154 Thr H . 27668 1 282 . 1 . 1 154 154 THR N N 15 115.18378 . . . . . . . . 154 Thr N . 27668 1 283 . 1 . 1 155 155 GLN H H 1 8.32129 . . . . . . . . 155 Gln H . 27668 1 284 . 1 . 1 155 155 GLN N N 15 122.27974 . . . . . . . . 155 Gln N . 27668 1 285 . 1 . 1 156 156 LEU H H 1 8.13395 . . . . . . . . 156 Leu H . 27668 1 286 . 1 . 1 156 156 LEU N N 15 122.20493 . . . . . . . . 156 Leu N . 27668 1 287 . 1 . 1 159 159 GLN H H 1 8.24512 . . . . . . . . 159 Gln H . 27668 1 288 . 1 . 1 159 159 GLN N N 15 124.51387 . . . . . . . . 159 Gln N . 27668 1 289 . 1 . 1 161 161 HIS H H 1 8.16857 . . . . . . . . 161 His H . 27668 1 290 . 1 . 1 161 161 HIS N N 15 120.24843 . . . . . . . . 161 His N . 27668 1 stop_ save_ save_assigned_chem_shift_list_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2 _Assigned_chem_shift_list.Entry_ID 27668 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 2 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_2 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _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 2 '2D 1H-15N HSQC' . . . 27668 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _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 ALA H H 1 8.15513 . . . . . . . . 1 Ala H . 27668 2 2 . 1 . 1 1 1 ALA N N 15 124.61509 . . . . . . . . 1 Ala N . 27668 2 3 . 1 . 1 3 3 VAL H H 1 7.97976 . . . . . . . . 3 Val H . 27668 2 4 . 1 . 1 3 3 VAL N N 15 120.01245 . . . . . . . . 3 Val N . 27668 2 5 . 1 . 1 4 4 THR H H 1 8.07377 . . . . . . . . 4 Thr H . 27668 2 6 . 1 . 1 4 4 THR N N 15 115.85178 . . . . . . . . 4 Thr N . 27668 2 7 . 1 . 1 5 5 GLN H H 1 8.27416 . . . . . . . . 5 Gln H . 27668 2 8 . 1 . 1 5 5 GLN N N 15 123.79283 . . . . . . . . 5 Gln N . 27668 2 9 . 1 . 1 6 6 THR H H 1 7.75877 . . . . . . . . 6 Thr H . 27668 2 10 . 1 . 1 6 6 THR N N 15 111.52881 . . . . . . . . 6 Thr N . 27668 2 11 . 1 . 1 7 7 MET H H 1 7.75802 . . . . . . . . 7 Met H . 27668 2 12 . 1 . 1 7 7 MET N N 15 120.30241 . . . . . . . . 7 Met N . 27668 2 13 . 1 . 1 8 8 LYS H H 1 8.66832 . . . . . . . . 8 Lys H . 27668 2 14 . 1 . 1 8 8 LYS N N 15 127.59531 . . . . . . . . 8 Lys N . 27668 2 15 . 1 . 1 9 9 GLY H H 1 8.54738 . . . . . . . . 9 Gly H . 27668 2 16 . 1 . 1 9 9 GLY N N 15 109.45806 . . . . . . . . 9 Gly N . 27668 2 17 . 1 . 1 10 10 LEU H H 1 7.55047 . . . . . . . . 10 Leu H . 27668 2 18 . 1 . 1 10 10 LEU N N 15 120.19727 . . . . . . . . 10 Leu N . 27668 2 19 . 1 . 1 11 11 ASP H H 1 8.60635 . . . . . . . . 11 Asp H . 27668 2 20 . 1 . 1 11 11 ASP N N 15 127.24754 . . . . . . . . 11 Asp N . 27668 2 21 . 1 . 1 12 12 ILE H H 1 8.80935 . . . . . . . . 12 Ile H . 27668 2 22 . 1 . 1 12 12 ILE N N 15 122.62769 . . . . . . . . 12 Ile N . 27668 2 23 . 1 . 1 13 13 GLN H H 1 8.02549 . . . . . . . . 13 Gln H . 27668 2 24 . 1 . 1 13 13 GLN N N 15 117.10009 . . . . . . . . 13 Gln N . 27668 2 25 . 1 . 1 14 14 LYS H H 1 7.25340 . . . . . . . . 14 Lys H . 27668 2 26 . 1 . 1 14 14 LYS N N 15 114.02962 . . . . . . . . 14 Lys N . 27668 2 27 . 1 . 1 15 15 VAL H H 1 7.36911 . . . . . . . . 15 Val H . 27668 2 28 . 1 . 1 15 15 VAL N N 15 110.25301 . . . . . . . . 15 Val N . 27668 2 29 . 1 . 1 16 16 ALA H H 1 6.80216 . . . . . . . . 16 Ala H . 27668 2 30 . 1 . 1 16 16 ALA N N 15 120.89169 . . . . . . . . 16 Ala N . 27668 2 31 . 1 . 1 17 17 GLY H H 1 9.19018 . . . . . . . . 17 Gly H . 27668 2 32 . 1 . 1 17 17 GLY N N 15 110.17013 . . . . . . . . 17 Gly N . 27668 2 33 . 1 . 1 18 18 THR H H 1 8.37692 . . . . . . . . 18 Thr H . 27668 2 34 . 1 . 1 18 18 THR N N 15 118.36636 . . . . . . . . 18 Thr N . 27668 2 35 . 1 . 1 19 19 TRP H H 1 7.45330 . . . . . . . . 19 Trp H . 27668 2 36 . 1 . 1 19 19 TRP N N 15 123.93133 . . . . . . . . 19 Trp N . 27668 2 37 . 1 . 1 20 20 TYR H H 1 9.14050 . . . . . . . . 20 Tyr H . 27668 2 38 . 1 . 1 20 20 TYR N N 15 112.24236 . . . . . . . . 20 Tyr N . 27668 2 39 . 1 . 1 21 21 SER H H 1 9.90534 . . . . . . . . 21 Ser H . 27668 2 40 . 1 . 1 21 21 SER N N 15 119.52877 . . . . . . . . 21 Ser N . 27668 2 41 . 1 . 1 23 23 ALA H H 1 7.71961 . . . . . . . . 23 Ala H . 27668 2 42 . 1 . 1 23 23 ALA N N 15 114.87718 . . . . . . . . 23 Ala N . 27668 2 43 . 1 . 1 24 24 MET H H 1 9.07870 . . . . . . . . 24 Met H . 27668 2 44 . 1 . 1 24 24 MET N N 15 114.77261 . . . . . . . . 24 Met N . 27668 2 45 . 1 . 1 25 25 ALA H H 1 9.31257 . . . . . . . . 25 Ala H . 27668 2 46 . 1 . 1 25 25 ALA N N 15 123.56655 . . . . . . . . 25 Ala N . 27668 2 47 . 1 . 1 26 26 ALA H H 1 8.30617 . . . . . . . . 26 Ala H . 27668 2 48 . 1 . 1 26 26 ALA N N 15 119.70007 . . . . . . . . 26 Ala N . 27668 2 49 . 1 . 1 27 27 SER H H 1 8.40461 . . . . . . . . 27 Ser H . 27668 2 50 . 1 . 1 27 27 SER N N 15 116.21134 . . . . . . . . 27 Ser N . 27668 2 51 . 1 . 1 28 28 ASP H H 1 7.87465 . . . . . . . . 28 Asp H . 27668 2 52 . 1 . 1 28 28 ASP N N 15 119.69808 . . . . . . . . 28 Asp N . 27668 2 53 . 1 . 1 29 29 ILE H H 1 8.75492 . . . . . . . . 29 Ile H . 27668 2 54 . 1 . 1 29 29 ILE N N 15 124.25854 . . . . . . . . 29 Ile N . 27668 2 55 . 1 . 1 31 31 LEU H H 1 7.61089 . . . . . . . . 31 Leu H . 27668 2 56 . 1 . 1 31 31 LEU N N 15 117.39987 . . . . . . . . 31 Leu N . 27668 2 57 . 1 . 1 33 33 ASP H H 1 7.83102 . . . . . . . . 33 Asp H . 27668 2 58 . 1 . 1 33 33 ASP N N 15 118.36643 . . . . . . . . 33 Asp N . 27668 2 59 . 1 . 1 34 34 ALA H H 1 7.64566 . . . . . . . . 34 Ala H . 27668 2 60 . 1 . 1 34 34 ALA N N 15 120.76635 . . . . . . . . 34 Ala N . 27668 2 61 . 1 . 1 35 35 GLN H H 1 9.03496 . . . . . . . . 35 Gln H . 27668 2 62 . 1 . 1 35 35 GLN N N 15 121.48303 . . . . . . . . 35 Gln N . 27668 2 63 . 1 . 1 36 36 SER H H 1 7.69235 . . . . . . . . 36 Ser H . 27668 2 64 . 1 . 1 36 36 SER N N 15 107.48236 . . . . . . . . 36 Ser N . 27668 2 65 . 1 . 1 37 37 ALA H H 1 7.53841 . . . . . . . . 37 Ala H . 27668 2 66 . 1 . 1 37 37 ALA N N 15 126.28186 . . . . . . . . 37 Ala N . 27668 2 67 . 1 . 1 39 39 LEU H H 1 7.73799 . . . . . . . . 39 Leu H . 27668 2 68 . 1 . 1 39 39 LEU N N 15 114.01897 . . . . . . . . 39 Leu N . 27668 2 69 . 1 . 1 40 40 ARG H H 1 7.39867 . . . . . . . . 40 Arg H . 27668 2 70 . 1 . 1 40 40 ARG N N 15 122.19489 . . . . . . . . 40 Arg N . 27668 2 71 . 1 . 1 41 41 VAL H H 1 6.96701 . . . . . . . . 41 Val H . 27668 2 72 . 1 . 1 41 41 VAL N N 15 117.02184 . . . . . . . . 41 Val N . 27668 2 73 . 1 . 1 42 42 TYR H H 1 8.60983 . . . . . . . . 42 Tyr H . 27668 2 74 . 1 . 1 42 42 TYR N N 15 120.58926 . . . . . . . . 42 Tyr N . 27668 2 75 . 1 . 1 43 43 VAL H H 1 8.62577 . . . . . . . . 43 Val H . 27668 2 76 . 1 . 1 43 43 VAL N N 15 125.20605 . . . . . . . . 43 Val N . 27668 2 77 . 1 . 1 44 44 GLU H H 1 8.97813 . . . . . . . . 44 Glu H . 27668 2 78 . 1 . 1 44 44 GLU N N 15 121.87268 . . . . . . . . 44 Glu N . 27668 2 79 . 1 . 1 45 45 GLU H H 1 7.62164 . . . . . . . . 45 Glu H . 27668 2 80 . 1 . 1 45 45 GLU N N 15 116.32879 . . . . . . . . 45 Glu N . 27668 2 81 . 1 . 1 46 46 LEU H H 1 8.65857 . . . . . . . . 46 Leu H . 27668 2 82 . 1 . 1 46 46 LEU N N 15 122.04197 . . . . . . . . 46 Leu N . 27668 2 83 . 1 . 1 47 47 LYS H H 1 9.16081 . . . . . . . . 47 Lys H . 27668 2 84 . 1 . 1 47 47 LYS N N 15 122.52858 . . . . . . . . 47 Lys N . 27668 2 85 . 1 . 1 49 49 THR H H 1 8.62227 . . . . . . . . 49 Thr H . 27668 2 86 . 1 . 1 49 49 THR N N 15 114.47029 . . . . . . . . 49 Thr N . 27668 2 87 . 1 . 1 51 51 GLU H H 1 7.52013 . . . . . . . . 51 Glu H . 27668 2 88 . 1 . 1 51 51 GLU N N 15 112.09662 . . . . . . . . 51 Glu N . 27668 2 89 . 1 . 1 52 52 GLY H H 1 8.28401 . . . . . . . . 52 Gly H . 27668 2 90 . 1 . 1 52 52 GLY N N 15 107.30931 . . . . . . . . 52 Gly N . 27668 2 91 . 1 . 1 53 53 ASP H H 1 7.18226 . . . . . . . . 53 Asp H . 27668 2 92 . 1 . 1 53 53 ASP N N 15 115.61529 . . . . . . . . 53 Asp N . 27668 2 93 . 1 . 1 54 54 LEU H H 1 8.82055 . . . . . . . . 54 Leu H . 27668 2 94 . 1 . 1 54 54 LEU N N 15 119.38733 . . . . . . . . 54 Leu N . 27668 2 95 . 1 . 1 55 55 GLU H H 1 8.61764 . . . . . . . . 55 Glu H . 27668 2 96 . 1 . 1 55 55 GLU N N 15 126.01588 . . . . . . . . 55 Glu N . 27668 2 97 . 1 . 1 56 56 ILE H H 1 9.25039 . . . . . . . . 56 Ile H . 27668 2 98 . 1 . 1 56 56 ILE N N 15 126.40748 . . . . . . . . 56 Ile N . 27668 2 99 . 1 . 1 57 57 LEU H H 1 8.48990 . . . . . . . . 57 Leu H . 27668 2 100 . 1 . 1 57 57 LEU N N 15 128.60278 . . . . . . . . 57 Leu N . 27668 2 101 . 1 . 1 58 58 LEU H H 1 9.05558 . . . . . . . . 58 Leu H . 27668 2 102 . 1 . 1 58 58 LEU N N 15 123.35729 . . . . . . . . 58 Leu N . 27668 2 103 . 1 . 1 59 59 GLN H H 1 9.22654 . . . . . . . . 59 Gln H . 27668 2 104 . 1 . 1 59 59 GLN N N 15 117.71421 . . . . . . . . 59 Gln N . 27668 2 105 . 1 . 1 60 60 LYS H H 1 8.94218 . . . . . . . . 60 Lys H . 27668 2 106 . 1 . 1 60 60 LYS N N 15 121.49306 . . . . . . . . 60 Lys N . 27668 2 107 . 1 . 1 61 61 TRP H H 1 9.74330 . . . . . . . . 61 Trp H . 27668 2 108 . 1 . 1 61 61 TRP N N 15 129.80822 . . . . . . . . 61 Trp N . 27668 2 109 . 1 . 1 62 62 GLU H H 1 8.73756 . . . . . . . . 62 Glu H . 27668 2 110 . 1 . 1 62 62 GLU N N 15 127.39004 . . . . . . . . 62 Glu N . 27668 2 111 . 1 . 1 64 64 ASP H H 1 8.13519 . . . . . . . . 64 Asp H . 27668 2 112 . 1 . 1 64 64 ASP N N 15 110.94430 . . . . . . . . 64 Asp N . 27668 2 113 . 1 . 1 65 65 GLU H H 1 6.75853 . . . . . . . . 65 Glu H . 27668 2 114 . 1 . 1 65 65 GLU N N 15 114.53201 . . . . . . . . 65 Glu N . 27668 2 115 . 1 . 1 66 66 CYS H H 1 8.64547 . . . . . . . . 66 Cys H . 27668 2 116 . 1 . 1 66 66 CYS N N 15 120.04209 . . . . . . . . 66 Cys N . 27668 2 117 . 1 . 1 67 67 ALA H H 1 8.99387 . . . . . . . . 67 Ala H . 27668 2 118 . 1 . 1 67 67 ALA N N 15 133.50454 . . . . . . . . 67 Ala N . 27668 2 119 . 1 . 1 68 68 GLN H H 1 8.37675 . . . . . . . . 68 Gln H . 27668 2 120 . 1 . 1 68 68 GLN N N 15 118.73442 . . . . . . . . 68 Gln N . 27668 2 121 . 1 . 1 69 69 LYS H H 1 9.15749 . . . . . . . . 69 Lys H . 27668 2 122 . 1 . 1 69 69 LYS N N 15 123.57484 . . . . . . . . 69 Lys N . 27668 2 123 . 1 . 1 70 70 LYS H H 1 8.50734 . . . . . . . . 70 Lys H . 27668 2 124 . 1 . 1 70 70 LYS N N 15 123.43708 . . . . . . . . 70 Lys N . 27668 2 125 . 1 . 1 71 71 ILE H H 1 8.96885 . . . . . . . . 71 Ile H . 27668 2 126 . 1 . 1 71 71 ILE N N 15 124.28611 . . . . . . . . 71 Ile N . 27668 2 127 . 1 . 1 72 72 ILE H H 1 8.49311 . . . . . . . . 72 Ile H . 27668 2 128 . 1 . 1 72 72 ILE N N 15 125.44893 . . . . . . . . 72 Ile N . 27668 2 129 . 1 . 1 73 73 ALA H H 1 9.26928 . . . . . . . . 73 Ala H . 27668 2 130 . 1 . 1 73 73 ALA N N 15 133.45872 . . . . . . . . 73 Ala N . 27668 2 131 . 1 . 1 74 74 GLU H H 1 9.41377 . . . . . . . . 74 Glu H . 27668 2 132 . 1 . 1 74 74 GLU N N 15 124.65140 . . . . . . . . 74 Glu N . 27668 2 133 . 1 . 1 75 75 LYS H H 1 8.64130 . . . . . . . . 75 Lys H . 27668 2 134 . 1 . 1 75 75 LYS N N 15 123.30645 . . . . . . . . 75 Lys N . 27668 2 135 . 1 . 1 76 76 THR H H 1 8.42636 . . . . . . . . 76 Thr H . 27668 2 136 . 1 . 1 76 76 THR N N 15 112.56504 . . . . . . . . 76 Thr N . 27668 2 137 . 1 . 1 77 77 LYS H H 1 8.26438 . . . . . . . . 77 Lys H . 27668 2 138 . 1 . 1 77 77 LYS N N 15 116.42099 . . . . . . . . 77 Lys N . 27668 2 139 . 1 . 1 78 78 ILE H H 1 7.97836 . . . . . . . . 78 Ile H . 27668 2 140 . 1 . 1 78 78 ILE N N 15 122.32379 . . . . . . . . 78 Ile N . 27668 2 141 . 1 . 1 80 80 ALA H H 1 7.90423 . . . . . . . . 80 Ala H . 27668 2 142 . 1 . 1 80 80 ALA N N 15 115.37252 . . . . . . . . 80 Ala N . 27668 2 143 . 1 . 1 81 81 VAL H H 1 7.27416 . . . . . . . . 81 Val H . 27668 2 144 . 1 . 1 81 81 VAL N N 15 117.31658 . . . . . . . . 81 Val N . 27668 2 145 . 1 . 1 82 82 PHE H H 1 9.54668 . . . . . . . . 82 Phe H . 27668 2 146 . 1 . 1 82 82 PHE N N 15 126.39206 . . . . . . . . 82 Phe N . 27668 2 147 . 1 . 1 83 83 LYS H H 1 9.49915 . . . . . . . . 83 Lys H . 27668 2 148 . 1 . 1 83 83 LYS N N 15 123.39761 . . . . . . . . 83 Lys N . 27668 2 149 . 1 . 1 84 84 ILE H H 1 7.76509 . . . . . . . . 84 Ile H . 27668 2 150 . 1 . 1 84 84 ILE N N 15 116.44173 . . . . . . . . 84 Ile N . 27668 2 151 . 1 . 1 85 85 ASP H H 1 8.77281 . . . . . . . . 85 Asp H . 27668 2 152 . 1 . 1 85 85 ASP N N 15 119.40255 . . . . . . . . 85 Asp N . 27668 2 153 . 1 . 1 86 86 ALA H H 1 7.20700 . . . . . . . . 86 Ala H . 27668 2 154 . 1 . 1 86 86 ALA N N 15 121.92035 . . . . . . . . 86 Ala N . 27668 2 155 . 1 . 1 87 87 LEU H H 1 9.00698 . . . . . . . . 87 Leu H . 27668 2 156 . 1 . 1 87 87 LEU N N 15 114.55033 . . . . . . . . 87 Leu N . 27668 2 157 . 1 . 1 88 88 ASN H H 1 8.69559 . . . . . . . . 88 Asn H . 27668 2 158 . 1 . 1 88 88 ASN N N 15 111.25047 . . . . . . . . 88 Asn N . 27668 2 159 . 1 . 1 89 89 GLU H H 1 8.25492 . . . . . . . . 89 Glu H . 27668 2 160 . 1 . 1 89 89 GLU N N 15 117.29005 . . . . . . . . 89 Glu N . 27668 2 161 . 1 . 1 90 90 ASN H H 1 9.09337 . . . . . . . . 90 Asn H . 27668 2 162 . 1 . 1 90 90 ASN N N 15 115.64699 . . . . . . . . 90 Asn N . 27668 2 163 . 1 . 1 91 91 LYS H H 1 8.51871 . . . . . . . . 91 Lys H . 27668 2 164 . 1 . 1 91 91 LYS N N 15 121.62589 . . . . . . . . 91 Lys N . 27668 2 165 . 1 . 1 92 92 VAL H H 1 9.03542 . . . . . . . . 92 Val H . 27668 2 166 . 1 . 1 92 92 VAL N N 15 121.21825 . . . . . . . . 92 Val N . 27668 2 167 . 1 . 1 93 93 LEU H H 1 9.42337 . . . . . . . . 93 Leu H . 27668 2 168 . 1 . 1 93 93 LEU N N 15 126.00143 . . . . . . . . 93 Leu N . 27668 2 169 . 1 . 1 94 94 VAL H H 1 9.31204 . . . . . . . . 94 Val H . 27668 2 170 . 1 . 1 94 94 VAL N N 15 123.84757 . . . . . . . . 94 Val N . 27668 2 171 . 1 . 1 95 95 LEU H H 1 8.46749 . . . . . . . . 95 Leu H . 27668 2 172 . 1 . 1 95 95 LEU N N 15 128.08836 . . . . . . . . 95 Leu N . 27668 2 173 . 1 . 1 96 96 ASP H H 1 7.20874 . . . . . . . . 96 Asp H . 27668 2 174 . 1 . 1 96 96 ASP N N 15 110.24684 . . . . . . . . 96 Asp N . 27668 2 175 . 1 . 1 97 97 THR H H 1 7.77419 . . . . . . . . 97 Thr H . 27668 2 176 . 1 . 1 97 97 THR N N 15 119.13151 . . . . . . . . 97 Thr N . 27668 2 177 . 1 . 1 98 98 ASP H H 1 6.80552 . . . . . . . . 98 Asp H . 27668 2 178 . 1 . 1 98 98 ASP N N 15 123.40153 . . . . . . . . 98 Asp N . 27668 2 179 . 1 . 1 99 99 TYR H H 1 9.01859 . . . . . . . . 99 Tyr H . 27668 2 180 . 1 . 1 99 99 TYR N N 15 117.59431 . . . . . . . . 99 Tyr N . 27668 2 181 . 1 . 1 100 100 LYS H H 1 9.00026 . . . . . . . . 100 Lys H . 27668 2 182 . 1 . 1 100 100 LYS N N 15 119.78519 . . . . . . . . 100 Lys N . 27668 2 183 . 1 . 1 101 101 LYS H H 1 9.44447 . . . . . . . . 101 Lys H . 27668 2 184 . 1 . 1 101 101 LYS N N 15 119.60910 . . . . . . . . 101 Lys N . 27668 2 185 . 1 . 1 102 102 TYR H H 1 9.06486 . . . . . . . . 102 Tyr H . 27668 2 186 . 1 . 1 102 102 TYR N N 15 116.68933 . . . . . . . . 102 Tyr N . 27668 2 187 . 1 . 1 103 103 LEU H H 1 9.15197 . . . . . . . . 103 Leu H . 27668 2 188 . 1 . 1 103 103 LEU N N 15 124.92789 . . . . . . . . 103 Leu N . 27668 2 189 . 1 . 1 104 104 LEU H H 1 9.38843 . . . . . . . . 104 Leu H . 27668 2 190 . 1 . 1 104 104 LEU N N 15 124.80660 . . . . . . . . 104 Leu N . 27668 2 191 . 1 . 1 105 105 PHE H H 1 8.87907 . . . . . . . . 105 Phe H . 27668 2 192 . 1 . 1 105 105 PHE N N 15 121.26717 . . . . . . . . 105 Phe N . 27668 2 193 . 1 . 1 106 106 CYS H H 1 9.64314 . . . . . . . . 106 Cys H . 27668 2 194 . 1 . 1 106 106 CYS N N 15 117.21186 . . . . . . . . 106 Cys N . 27668 2 195 . 1 . 1 107 107 MET H H 1 9.91728 . . . . . . . . 107 Met H . 27668 2 196 . 1 . 1 107 107 MET N N 15 120.66223 . . . . . . . . 107 Met N . 27668 2 197 . 1 . 1 108 108 GLU H H 1 8.38997 . . . . . . . . 108 Glu H . 27668 2 198 . 1 . 1 108 108 GLU N N 15 113.64805 . . . . . . . . 108 Glu N . 27668 2 199 . 1 . 1 109 109 ASN H H 1 9.36177 . . . . . . . . 109 Asn H . 27668 2 200 . 1 . 1 109 109 ASN N N 15 120.15313 . . . . . . . . 109 Asn N . 27668 2 201 . 1 . 1 110 110 SER H H 1 9.80840 . . . . . . . . 110 Ser H . 27668 2 202 . 1 . 1 110 110 SER N N 15 122.11422 . . . . . . . . 110 Ser N . 27668 2 203 . 1 . 1 111 111 ALA H H 1 8.30707 . . . . . . . . 111 Ala H . 27668 2 204 . 1 . 1 111 111 ALA N N 15 123.43182 . . . . . . . . 111 Ala N . 27668 2 205 . 1 . 1 112 112 GLU H H 1 7.75128 . . . . . . . . 112 Glu H . 27668 2 206 . 1 . 1 112 112 GLU N N 15 113.53265 . . . . . . . . 112 Glu N . 27668 2 207 . 1 . 1 114 114 GLU H H 1 8.34758 . . . . . . . . 114 Glu H . 27668 2 208 . 1 . 1 114 114 GLU N N 15 114.66934 . . . . . . . . 114 Glu N . 27668 2 209 . 1 . 1 115 115 GLN H H 1 7.78226 . . . . . . . . 115 Gln H . 27668 2 210 . 1 . 1 115 115 GLN N N 15 116.03969 . . . . . . . . 115 Gln N . 27668 2 211 . 1 . 1 116 116 SER H H 1 7.56355 . . . . . . . . 116 Ser H . 27668 2 212 . 1 . 1 116 116 SER N N 15 109.70106 . . . . . . . . 116 Ser N . 27668 2 213 . 1 . 1 117 117 LEU H H 1 7.23706 . . . . . . . . 117 Leu H . 27668 2 214 . 1 . 1 117 117 LEU N N 15 126.42386 . . . . . . . . 117 Leu N . 27668 2 215 . 1 . 1 118 118 VAL H H 1 8.80504 . . . . . . . . 118 Val H . 27668 2 216 . 1 . 1 118 118 VAL N N 15 125.97194 . . . . . . . . 118 Val N . 27668 2 217 . 1 . 1 119 119 CYS H H 1 9.40513 . . . . . . . . 119 Cys H . 27668 2 218 . 1 . 1 119 119 CYS N N 15 121.93220 . . . . . . . . 119 Cys N . 27668 2 219 . 1 . 1 120 120 GLN H H 1 9.33889 . . . . . . . . 120 Gln H . 27668 2 220 . 1 . 1 120 120 GLN N N 15 118.50733 . . . . . . . . 120 Gln N . 27668 2 221 . 1 . 1 121 121 CYS H H 1 7.81454 . . . . . . . . 121 Cys H . 27668 2 222 . 1 . 1 121 121 CYS N N 15 120.03302 . . . . . . . . 121 Cys N . 27668 2 223 . 1 . 1 122 122 LEU H H 1 9.74036 . . . . . . . . 122 Leu H . 27668 2 224 . 1 . 1 122 122 LEU N N 15 128.53132 . . . . . . . . 122 Leu N . 27668 2 225 . 1 . 1 123 123 VAL H H 1 9.44376 . . . . . . . . 123 Val H . 27668 2 226 . 1 . 1 123 123 VAL N N 15 111.46400 . . . . . . . . 123 Val N . 27668 2 227 . 1 . 1 124 124 ARG H H 1 7.92638 . . . . . . . . 124 Arg H . 27668 2 228 . 1 . 1 124 124 ARG N N 15 119.72512 . . . . . . . . 124 Arg N . 27668 2 229 . 1 . 1 125 125 THR H H 1 7.54258 . . . . . . . . 125 Thr H . 27668 2 230 . 1 . 1 125 125 THR N N 15 108.41475 . . . . . . . . 125 Thr N . 27668 2 231 . 1 . 1 127 127 GLU H H 1 8.31864 . . . . . . . . 127 Glu H . 27668 2 232 . 1 . 1 127 127 GLU N N 15 120.19277 . . . . . . . . 127 Glu N . 27668 2 233 . 1 . 1 128 128 VAL H H 1 8.34442 . . . . . . . . 128 Val H . 27668 2 234 . 1 . 1 128 128 VAL N N 15 119.20428 . . . . . . . . 128 Val N . 27668 2 235 . 1 . 1 130 130 ASP H H 1 9.04431 . . . . . . . . 130 Asp H . 27668 2 236 . 1 . 1 130 130 ASP N N 15 124.29034 . . . . . . . . 130 Asp N . 27668 2 237 . 1 . 1 131 131 GLU H H 1 8.34602 . . . . . . . . 131 Glu H . 27668 2 238 . 1 . 1 131 131 GLU N N 15 121.09824 . . . . . . . . 131 Glu N . 27668 2 239 . 1 . 1 132 132 ALA H H 1 7.70245 . . . . . . . . 132 Ala H . 27668 2 240 . 1 . 1 132 132 ALA N N 15 121.78438 . . . . . . . . 132 Ala N . 27668 2 241 . 1 . 1 133 133 LEU H H 1 7.70998 . . . . . . . . 133 Leu H . 27668 2 242 . 1 . 1 133 133 LEU N N 15 116.18180 . . . . . . . . 133 Leu N . 27668 2 243 . 1 . 1 134 134 GLU H H 1 8.03682 . . . . . . . . 134 Glu H . 27668 2 244 . 1 . 1 134 134 GLU N N 15 119.47686 . . . . . . . . 134 Glu N . 27668 2 245 . 1 . 1 136 136 PHE H H 1 8.51783 . . . . . . . . 136 Phe H . 27668 2 246 . 1 . 1 136 136 PHE N N 15 122.02446 . . . . . . . . 136 Phe N . 27668 2 247 . 1 . 1 137 137 ASP H H 1 8.67915 . . . . . . . . 137 Asp H . 27668 2 248 . 1 . 1 137 137 ASP N N 15 117.51608 . . . . . . . . 137 Asp N . 27668 2 249 . 1 . 1 138 138 LYS H H 1 7.95517 . . . . . . . . 138 Lys H . 27668 2 250 . 1 . 1 138 138 LYS N N 15 119.25589 . . . . . . . . 138 Lys N . 27668 2 251 . 1 . 1 139 139 ALA H H 1 7.83725 . . . . . . . . 139 Ala H . 27668 2 252 . 1 . 1 139 139 ALA N N 15 121.77228 . . . . . . . . 139 Ala N . 27668 2 253 . 1 . 1 140 140 LEU H H 1 7.49509 . . . . . . . . 140 Leu H . 27668 2 254 . 1 . 1 140 140 LEU N N 15 114.50779 . . . . . . . . 140 Leu N . 27668 2 255 . 1 . 1 141 141 LYS H H 1 7.16443 . . . . . . . . 141 Lys H . 27668 2 256 . 1 . 1 141 141 LYS N N 15 119.71954 . . . . . . . . 141 Lys N . 27668 2 257 . 1 . 1 142 142 ALA H H 1 7.76552 . . . . . . . . 142 Ala H . 27668 2 258 . 1 . 1 142 142 ALA N N 15 118.55108 . . . . . . . . 142 Ala N . 27668 2 259 . 1 . 1 143 143 LEU H H 1 7.72264 . . . . . . . . 143 Leu H . 27668 2 260 . 1 . 1 143 143 LEU N N 15 119.70610 . . . . . . . . 143 Leu N . 27668 2 261 . 1 . 1 145 145 MET H H 1 7.66630 . . . . . . . . 145 Met H . 27668 2 262 . 1 . 1 145 145 MET N N 15 118.00383 . . . . . . . . 145 Met N . 27668 2 263 . 1 . 1 146 146 HIS H H 1 8.80079 . . . . . . . . 146 His H . 27668 2 264 . 1 . 1 146 146 HIS N N 15 117.86712 . . . . . . . . 146 His N . 27668 2 265 . 1 . 1 147 147 ILE H H 1 7.70757 . . . . . . . . 147 Ile H . 27668 2 266 . 1 . 1 147 147 ILE N N 15 117.38947 . . . . . . . . 147 Ile N . 27668 2 267 . 1 . 1 148 148 ARG H H 1 8.34201 . . . . . . . . 148 Arg H . 27668 2 268 . 1 . 1 148 148 ARG N N 15 126.81059 . . . . . . . . 148 Arg N . 27668 2 269 . 1 . 1 149 149 LEU H H 1 9.17326 . . . . . . . . 149 Leu H . 27668 2 270 . 1 . 1 149 149 LEU N N 15 124.42639 . . . . . . . . 149 Leu N . 27668 2 271 . 1 . 1 150 150 SER H H 1 8.21490 . . . . . . . . 150 Ser H . 27668 2 272 . 1 . 1 150 150 SER N N 15 116.35151 . . . . . . . . 150 Ser N . 27668 2 273 . 1 . 1 151 151 PHE H H 1 8.11461 . . . . . . . . 151 Phe H . 27668 2 274 . 1 . 1 151 151 PHE N N 15 119.50215 . . . . . . . . 151 Phe N . 27668 2 275 . 1 . 1 152 152 ASN H H 1 8.74017 . . . . . . . . 152 Asn H . 27668 2 276 . 1 . 1 152 152 ASN N N 15 119.22945 . . . . . . . . 152 Asn N . 27668 2 277 . 1 . 1 154 154 THR H H 1 8.12042 . . . . . . . . 154 Thr H . 27668 2 278 . 1 . 1 154 154 THR N N 15 115.19901 . . . . . . . . 154 Thr N . 27668 2 279 . 1 . 1 155 155 GLN H H 1 8.32252 . . . . . . . . 155 Gln H . 27668 2 280 . 1 . 1 155 155 GLN N N 15 122.29297 . . . . . . . . 155 Gln N . 27668 2 281 . 1 . 1 156 156 LEU H H 1 8.13322 . . . . . . . . 156 Leu H . 27668 2 282 . 1 . 1 156 156 LEU N N 15 122.21533 . . . . . . . . 156 Leu N . 27668 2 283 . 1 . 1 159 159 GLN H H 1 8.26104 . . . . . . . . 159 Gln H . 27668 2 284 . 1 . 1 159 159 GLN N N 15 124.67442 . . . . . . . . 159 Gln N . 27668 2 285 . 1 . 1 161 161 HIS H H 1 8.17986 . . . . . . . . 161 His H . 27668 2 286 . 1 . 1 161 161 HIS N N 15 120.29359 . . . . . . . . 161 His N . 27668 2 stop_ save_ save_assigned_chem_shift_list_3 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_3 _Assigned_chem_shift_list.Entry_ID 27668 _Assigned_chem_shift_list.ID 3 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 3 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_3 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _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 3 '2D 1H-15N HSQC' . . . 27668 3 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _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 ALA H H 1 8.15249 . . . . . . . . 1 Ala H . 27668 3 2 . 1 . 1 1 1 ALA N N 15 124.60326 . . . . . . . . 1 Ala N . 27668 3 3 . 1 . 1 3 3 VAL H H 1 7.98107 . . . . . . . . 3 Val H . 27668 3 4 . 1 . 1 3 3 VAL N N 15 120.03856 . . . . . . . . 3 Val N . 27668 3 5 . 1 . 1 4 4 THR H H 1 8.09869 . . . . . . . . 4 Thr H . 27668 3 6 . 1 . 1 4 4 THR N N 15 115.95741 . . . . . . . . 4 Thr N . 27668 3 7 . 1 . 1 5 5 GLN H H 1 8.28391 . . . . . . . . 5 Gln H . 27668 3 8 . 1 . 1 5 5 GLN N N 15 123.95411 . . . . . . . . 5 Gln N . 27668 3 9 . 1 . 1 6 6 THR H H 1 7.67919 . . . . . . . . 6 Thr H . 27668 3 10 . 1 . 1 6 6 THR N N 15 111.31498 . . . . . . . . 6 Thr N . 27668 3 11 . 1 . 1 7 7 MET H H 1 7.76694 . . . . . . . . 7 Met H . 27668 3 12 . 1 . 1 7 7 MET N N 15 120.36760 . . . . . . . . 7 Met N . 27668 3 13 . 1 . 1 8 8 LYS H H 1 8.65340 . . . . . . . . 8 Lys H . 27668 3 14 . 1 . 1 8 8 LYS N N 15 127.46774 . . . . . . . . 8 Lys N . 27668 3 15 . 1 . 1 9 9 GLY H H 1 8.51810 . . . . . . . . 9 Gly H . 27668 3 16 . 1 . 1 9 9 GLY N N 15 109.36035 . . . . . . . . 9 Gly N . 27668 3 17 . 1 . 1 10 10 LEU H H 1 7.56091 . . . . . . . . 10 Leu H . 27668 3 18 . 1 . 1 10 10 LEU N N 15 120.36403 . . . . . . . . 10 Leu N . 27668 3 19 . 1 . 1 11 11 ASP H H 1 8.58382 . . . . . . . . 11 Asp H . 27668 3 20 . 1 . 1 11 11 ASP N N 15 127.84335 . . . . . . . . 11 Asp N . 27668 3 21 . 1 . 1 12 12 ILE H H 1 8.72169 . . . . . . . . 12 Ile H . 27668 3 22 . 1 . 1 12 12 ILE N N 15 122.32619 . . . . . . . . 12 Ile N . 27668 3 23 . 1 . 1 13 13 GLN H H 1 8.09266 . . . . . . . . 13 Gln H . 27668 3 24 . 1 . 1 13 13 GLN N N 15 117.00496 . . . . . . . . 13 Gln N . 27668 3 25 . 1 . 1 14 14 LYS H H 1 7.29469 . . . . . . . . 14 Lys H . 27668 3 26 . 1 . 1 14 14 LYS N N 15 114.37819 . . . . . . . . 14 Lys N . 27668 3 27 . 1 . 1 15 15 VAL H H 1 7.34103 . . . . . . . . 15 Val H . 27668 3 28 . 1 . 1 15 15 VAL N N 15 110.25788 . . . . . . . . 15 Val N . 27668 3 29 . 1 . 1 16 16 ALA H H 1 6.78999 . . . . . . . . 16 Ala H . 27668 3 30 . 1 . 1 16 16 ALA N N 15 120.80588 . . . . . . . . 16 Ala N . 27668 3 31 . 1 . 1 17 17 GLY H H 1 9.18423 . . . . . . . . 17 Gly H . 27668 3 32 . 1 . 1 17 17 GLY N N 15 110.34642 . . . . . . . . 17 Gly N . 27668 3 33 . 1 . 1 18 18 THR H H 1 8.33500 . . . . . . . . 18 Thr H . 27668 3 34 . 1 . 1 18 18 THR N N 15 118.06956 . . . . . . . . 18 Thr N . 27668 3 35 . 1 . 1 19 19 TRP H H 1 7.47022 . . . . . . . . 19 Trp H . 27668 3 36 . 1 . 1 19 19 TRP N N 15 123.83260 . . . . . . . . 19 Trp N . 27668 3 37 . 1 . 1 20 20 TYR H H 1 9.16544 . . . . . . . . 20 Tyr H . 27668 3 38 . 1 . 1 20 20 TYR N N 15 112.35702 . . . . . . . . 20 Tyr N . 27668 3 39 . 1 . 1 21 21 SER H H 1 9.91494 . . . . . . . . 21 Ser H . 27668 3 40 . 1 . 1 21 21 SER N N 15 119.60535 . . . . . . . . 21 Ser N . 27668 3 41 . 1 . 1 23 23 ALA H H 1 7.79469 . . . . . . . . 23 Ala H . 27668 3 42 . 1 . 1 23 23 ALA N N 15 115.09779 . . . . . . . . 23 Ala N . 27668 3 43 . 1 . 1 24 24 MET H H 1 9.06504 . . . . . . . . 24 Met H . 27668 3 44 . 1 . 1 24 24 MET N N 15 114.67118 . . . . . . . . 24 Met N . 27668 3 45 . 1 . 1 25 25 ALA H H 1 9.32300 . . . . . . . . 25 Ala H . 27668 3 46 . 1 . 1 25 25 ALA N N 15 123.69839 . . . . . . . . 25 Ala N . 27668 3 47 . 1 . 1 28 28 ASP H H 1 7.87439 . . . . . . . . 28 Asp H . 27668 3 48 . 1 . 1 28 28 ASP N N 15 119.58716 . . . . . . . . 28 Asp N . 27668 3 49 . 1 . 1 31 31 LEU H H 1 7.62560 . . . . . . . . 31 Leu H . 27668 3 50 . 1 . 1 31 31 LEU N N 15 117.82315 . . . . . . . . 31 Leu N . 27668 3 51 . 1 . 1 35 35 GLN H H 1 9.02323 . . . . . . . . 35 Gln H . 27668 3 52 . 1 . 1 35 35 GLN N N 15 121.55195 . . . . . . . . 35 Gln N . 27668 3 53 . 1 . 1 36 36 SER H H 1 7.52043 . . . . . . . . 36 Ser H . 27668 3 54 . 1 . 1 36 36 SER N N 15 106.86304 . . . . . . . . 36 Ser N . 27668 3 55 . 1 . 1 37 37 ALA H H 1 7.55159 . . . . . . . . 37 Ala H . 27668 3 56 . 1 . 1 37 37 ALA N N 15 126.31237 . . . . . . . . 37 Ala N . 27668 3 57 . 1 . 1 39 39 LEU H H 1 7.71813 . . . . . . . . 39 Leu H . 27668 3 58 . 1 . 1 39 39 LEU N N 15 114.00216 . . . . . . . . 39 Leu N . 27668 3 59 . 1 . 1 40 40 ARG H H 1 7.33993 . . . . . . . . 40 Arg H . 27668 3 60 . 1 . 1 40 40 ARG N N 15 122.08390 . . . . . . . . 40 Arg N . 27668 3 61 . 1 . 1 41 41 VAL H H 1 6.93893 . . . . . . . . 41 Val H . 27668 3 62 . 1 . 1 41 41 VAL N N 15 117.04670 . . . . . . . . 41 Val N . 27668 3 63 . 1 . 1 42 42 TYR H H 1 8.61541 . . . . . . . . 42 Tyr H . 27668 3 64 . 1 . 1 42 42 TYR N N 15 120.42029 . . . . . . . . 42 Tyr N . 27668 3 65 . 1 . 1 43 43 VAL H H 1 8.62408 . . . . . . . . 43 Val H . 27668 3 66 . 1 . 1 43 43 VAL N N 15 125.05276 . . . . . . . . 43 Val N . 27668 3 67 . 1 . 1 44 44 GLU H H 1 8.99272 . . . . . . . . 44 Glu H . 27668 3 68 . 1 . 1 44 44 GLU N N 15 122.04012 . . . . . . . . 44 Glu N . 27668 3 69 . 1 . 1 45 45 GLU H H 1 7.63043 . . . . . . . . 45 Glu H . 27668 3 70 . 1 . 1 45 45 GLU N N 15 116.53426 . . . . . . . . 45 Glu N . 27668 3 71 . 1 . 1 46 46 LEU H H 1 8.64507 . . . . . . . . 46 Leu H . 27668 3 72 . 1 . 1 46 46 LEU N N 15 122.02050 . . . . . . . . 46 Leu N . 27668 3 73 . 1 . 1 47 47 LYS H H 1 9.17446 . . . . . . . . 47 Lys H . 27668 3 74 . 1 . 1 47 47 LYS N N 15 122.72570 . . . . . . . . 47 Lys N . 27668 3 75 . 1 . 1 49 49 THR H H 1 8.66702 . . . . . . . . 49 Thr H . 27668 3 76 . 1 . 1 49 49 THR N N 15 114.80277 . . . . . . . . 49 Thr N . 27668 3 77 . 1 . 1 51 51 GLU H H 1 7.51061 . . . . . . . . 51 Glu H . 27668 3 78 . 1 . 1 51 51 GLU N N 15 112.13326 . . . . . . . . 51 Glu N . 27668 3 79 . 1 . 1 52 52 GLY H H 1 8.28690 . . . . . . . . 52 Gly H . 27668 3 80 . 1 . 1 52 52 GLY N N 15 107.66962 . . . . . . . . 52 Gly N . 27668 3 81 . 1 . 1 53 53 ASP H H 1 7.18685 . . . . . . . . 53 Asp H . 27668 3 82 . 1 . 1 53 53 ASP N N 15 116.24506 . . . . . . . . 53 Asp N . 27668 3 83 . 1 . 1 54 54 LEU H H 1 8.84793 . . . . . . . . 54 Leu H . 27668 3 84 . 1 . 1 54 54 LEU N N 15 119.32414 . . . . . . . . 54 Leu N . 27668 3 85 . 1 . 1 55 55 GLU H H 1 8.57733 . . . . . . . . 55 Glu H . 27668 3 86 . 1 . 1 55 55 GLU N N 15 125.98370 . . . . . . . . 55 Glu N . 27668 3 87 . 1 . 1 56 56 ILE H H 1 9.22524 . . . . . . . . 56 Ile H . 27668 3 88 . 1 . 1 56 56 ILE N N 15 126.13213 . . . . . . . . 56 Ile N . 27668 3 89 . 1 . 1 57 57 LEU H H 1 8.51930 . . . . . . . . 57 Leu H . 27668 3 90 . 1 . 1 57 57 LEU N N 15 128.69465 . . . . . . . . 57 Leu N . 27668 3 91 . 1 . 1 58 58 LEU H H 1 9.05892 . . . . . . . . 58 Leu H . 27668 3 92 . 1 . 1 58 58 LEU N N 15 123.36032 . . . . . . . . 58 Leu N . 27668 3 93 . 1 . 1 59 59 GLN H H 1 9.22422 . . . . . . . . 59 Gln H . 27668 3 94 . 1 . 1 59 59 GLN N N 15 117.78442 . . . . . . . . 59 Gln N . 27668 3 95 . 1 . 1 60 60 LYS H H 1 8.92294 . . . . . . . . 60 Lys H . 27668 3 96 . 1 . 1 60 60 LYS N N 15 121.50050 . . . . . . . . 60 Lys N . 27668 3 97 . 1 . 1 62 62 GLU H H 1 8.72787 . . . . . . . . 62 Glu H . 27668 3 98 . 1 . 1 62 62 GLU N N 15 127.63268 . . . . . . . . 62 Glu N . 27668 3 99 . 1 . 1 64 64 ASP H H 1 8.11994 . . . . . . . . 64 Asp H . 27668 3 100 . 1 . 1 64 64 ASP N N 15 110.97099 . . . . . . . . 64 Asp N . 27668 3 101 . 1 . 1 65 65 GLU H H 1 6.76569 . . . . . . . . 65 Glu H . 27668 3 102 . 1 . 1 65 65 GLU N N 15 114.66420 . . . . . . . . 65 Glu N . 27668 3 103 . 1 . 1 66 66 CYS H H 1 8.58824 . . . . . . . . 66 Cys H . 27668 3 104 . 1 . 1 66 66 CYS N N 15 119.84009 . . . . . . . . 66 Cys N . 27668 3 105 . 1 . 1 67 67 ALA H H 1 9.00822 . . . . . . . . 67 Ala H . 27668 3 106 . 1 . 1 67 67 ALA N N 15 133.41585 . . . . . . . . 67 Ala N . 27668 3 107 . 1 . 1 68 68 GLN H H 1 8.37675 . . . . . . . . 68 Gln H . 27668 3 108 . 1 . 1 68 68 GLN N N 15 118.73442 . . . . . . . . 68 Gln N . 27668 3 109 . 1 . 1 69 69 LYS H H 1 9.16777 . . . . . . . . 69 Lys H . 27668 3 110 . 1 . 1 69 69 LYS N N 15 123.52064 . . . . . . . . 69 Lys N . 27668 3 111 . 1 . 1 70 70 LYS H H 1 8.49975 . . . . . . . . 70 Lys H . 27668 3 112 . 1 . 1 70 70 LYS N N 15 123.38297 . . . . . . . . 70 Lys N . 27668 3 113 . 1 . 1 71 71 ILE H H 1 8.98812 . . . . . . . . 71 Ile H . 27668 3 114 . 1 . 1 71 71 ILE N N 15 124.57064 . . . . . . . . 71 Ile N . 27668 3 115 . 1 . 1 72 72 ILE H H 1 8.48560 . . . . . . . . 72 Ile H . 27668 3 116 . 1 . 1 72 72 ILE N N 15 125.42674 . . . . . . . . 72 Ile N . 27668 3 117 . 1 . 1 73 73 ALA H H 1 9.29059 . . . . . . . . 73 Ala H . 27668 3 118 . 1 . 1 73 73 ALA N N 15 133.63675 . . . . . . . . 73 Ala N . 27668 3 119 . 1 . 1 74 74 GLU H H 1 9.40332 . . . . . . . . 74 Glu H . 27668 3 120 . 1 . 1 74 74 GLU N N 15 124.79317 . . . . . . . . 74 Glu N . 27668 3 121 . 1 . 1 75 75 LYS H H 1 8.86128 . . . . . . . . 75 Lys H . 27668 3 122 . 1 . 1 75 75 LYS N N 15 123.56929 . . . . . . . . 75 Lys N . 27668 3 123 . 1 . 1 76 76 THR H H 1 8.38966 . . . . . . . . 76 Thr H . 27668 3 124 . 1 . 1 76 76 THR N N 15 112.48585 . . . . . . . . 76 Thr N . 27668 3 125 . 1 . 1 77 77 LYS H H 1 8.27008 . . . . . . . . 77 Lys H . 27668 3 126 . 1 . 1 77 77 LYS N N 15 116.36791 . . . . . . . . 77 Lys N . 27668 3 127 . 1 . 1 78 78 ILE H H 1 7.97952 . . . . . . . . 78 Ile H . 27668 3 128 . 1 . 1 78 78 ILE N N 15 122.31686 . . . . . . . . 78 Ile N . 27668 3 129 . 1 . 1 80 80 ALA H H 1 7.98791 . . . . . . . . 80 Ala H . 27668 3 130 . 1 . 1 80 80 ALA N N 15 115.64130 . . . . . . . . 80 Ala N . 27668 3 131 . 1 . 1 81 81 VAL H H 1 7.25410 . . . . . . . . 81 Val H . 27668 3 132 . 1 . 1 81 81 VAL N N 15 117.25123 . . . . . . . . 81 Val N . 27668 3 133 . 1 . 1 82 82 PHE H H 1 9.56952 . . . . . . . . 82 Phe H . 27668 3 134 . 1 . 1 82 82 PHE N N 15 126.57629 . . . . . . . . 82 Phe N . 27668 3 135 . 1 . 1 83 83 LYS H H 1 9.53814 . . . . . . . . 83 Lys H . 27668 3 136 . 1 . 1 83 83 LYS N N 15 123.74872 . . . . . . . . 83 Lys N . 27668 3 137 . 1 . 1 84 84 ILE H H 1 7.75112 . . . . . . . . 84 Ile H . 27668 3 138 . 1 . 1 84 84 ILE N N 15 116.38482 . . . . . . . . 84 Ile N . 27668 3 139 . 1 . 1 85 85 ASP H H 1 8.72482 . . . . . . . . 85 Asp H . 27668 3 140 . 1 . 1 85 85 ASP N N 15 120.01021 . . . . . . . . 85 Asp N . 27668 3 141 . 1 . 1 86 86 ALA H H 1 7.18809 . . . . . . . . 86 Ala H . 27668 3 142 . 1 . 1 86 86 ALA N N 15 121.90603 . . . . . . . . 86 Ala N . 27668 3 143 . 1 . 1 87 87 LEU H H 1 9.00004 . . . . . . . . 87 Leu H . 27668 3 144 . 1 . 1 87 87 LEU N N 15 114.55674 . . . . . . . . 87 Leu N . 27668 3 145 . 1 . 1 88 88 ASN H H 1 8.71409 . . . . . . . . 88 Asn H . 27668 3 146 . 1 . 1 88 88 ASN N N 15 111.23332 . . . . . . . . 88 Asn N . 27668 3 147 . 1 . 1 89 89 GLU H H 1 8.27401 . . . . . . . . 89 Glu H . 27668 3 148 . 1 . 1 89 89 GLU N N 15 117.27395 . . . . . . . . 89 Glu N . 27668 3 149 . 1 . 1 90 90 ASN H H 1 9.08647 . . . . . . . . 90 Asn H . 27668 3 150 . 1 . 1 90 90 ASN N N 15 115.52173 . . . . . . . . 90 Asn N . 27668 3 151 . 1 . 1 91 91 LYS H H 1 8.51470 . . . . . . . . 91 Lys H . 27668 3 152 . 1 . 1 91 91 LYS N N 15 121.59359 . . . . . . . . 91 Lys N . 27668 3 153 . 1 . 1 93 93 LEU H H 1 9.44071 . . . . . . . . 93 Leu H . 27668 3 154 . 1 . 1 93 93 LEU N N 15 125.98654 . . . . . . . . 93 Leu N . 27668 3 155 . 1 . 1 94 94 VAL H H 1 9.28846 . . . . . . . . 94 Val H . 27668 3 156 . 1 . 1 94 94 VAL N N 15 123.81946 . . . . . . . . 94 Val N . 27668 3 157 . 1 . 1 95 95 LEU H H 1 8.48537 . . . . . . . . 95 Leu H . 27668 3 158 . 1 . 1 95 95 LEU N N 15 128.06782 . . . . . . . . 95 Leu N . 27668 3 159 . 1 . 1 96 96 ASP H H 1 7.21482 . . . . . . . . 96 Asp H . 27668 3 160 . 1 . 1 96 96 ASP N N 15 110.46173 . . . . . . . . 96 Asp N . 27668 3 161 . 1 . 1 97 97 THR H H 1 7.75403 . . . . . . . . 97 Thr H . 27668 3 162 . 1 . 1 97 97 THR N N 15 119.19470 . . . . . . . . 97 Thr N . 27668 3 163 . 1 . 1 98 98 ASP H H 1 6.82303 . . . . . . . . 98 Asp H . 27668 3 164 . 1 . 1 98 98 ASP N N 15 123.66726 . . . . . . . . 98 Asp N . 27668 3 165 . 1 . 1 99 99 TYR H H 1 9.00943 . . . . . . . . 99 Tyr H . 27668 3 166 . 1 . 1 99 99 TYR N N 15 117.50860 . . . . . . . . 99 Tyr N . 27668 3 167 . 1 . 1 100 100 LYS H H 1 9.00086 . . . . . . . . 100 Lys H . 27668 3 168 . 1 . 1 100 100 LYS N N 15 119.97522 . . . . . . . . 100 Lys N . 27668 3 169 . 1 . 1 101 101 LYS H H 1 9.64920 . . . . . . . . 101 Lys H . 27668 3 170 . 1 . 1 101 101 LYS N N 15 120.58140 . . . . . . . . 101 Lys N . 27668 3 171 . 1 . 1 102 102 TYR H H 1 9.16650 . . . . . . . . 102 Tyr H . 27668 3 172 . 1 . 1 102 102 TYR N N 15 116.88936 . . . . . . . . 102 Tyr N . 27668 3 173 . 1 . 1 103 103 LEU H H 1 9.15791 . . . . . . . . 103 Leu H . 27668 3 174 . 1 . 1 103 103 LEU N N 15 124.91022 . . . . . . . . 103 Leu N . 27668 3 175 . 1 . 1 104 104 LEU H H 1 9.38556 . . . . . . . . 104 Leu H . 27668 3 176 . 1 . 1 104 104 LEU N N 15 124.80012 . . . . . . . . 104 Leu N . 27668 3 177 . 1 . 1 105 105 PHE H H 1 8.86883 . . . . . . . . 105 Phe H . 27668 3 178 . 1 . 1 105 105 PHE N N 15 121.31019 . . . . . . . . 105 Phe N . 27668 3 179 . 1 . 1 106 106 CYS H H 1 9.63240 . . . . . . . . 106 Cys H . 27668 3 180 . 1 . 1 106 106 CYS N N 15 117.19327 . . . . . . . . 106 Cys N . 27668 3 181 . 1 . 1 107 107 MET H H 1 9.94944 . . . . . . . . 107 Met H . 27668 3 182 . 1 . 1 107 107 MET N N 15 120.65030 . . . . . . . . 107 Met N . 27668 3 183 . 1 . 1 108 108 GLU H H 1 8.36756 . . . . . . . . 108 Glu H . 27668 3 184 . 1 . 1 108 108 GLU N N 15 113.54010 . . . . . . . . 108 Glu N . 27668 3 185 . 1 . 1 109 109 ASN H H 1 9.31585 . . . . . . . . 109 Asn H . 27668 3 186 . 1 . 1 109 109 ASN N N 15 120.13682 . . . . . . . . 109 Asn N . 27668 3 187 . 1 . 1 110 110 SER H H 1 9.82524 . . . . . . . . 110 Ser H . 27668 3 188 . 1 . 1 110 110 SER N N 15 122.02011 . . . . . . . . 110 Ser N . 27668 3 189 . 1 . 1 111 111 ALA H H 1 8.28885 . . . . . . . . 111 Ala H . 27668 3 190 . 1 . 1 111 111 ALA N N 15 123.42175 . . . . . . . . 111 Ala N . 27668 3 191 . 1 . 1 112 112 GLU H H 1 7.77428 . . . . . . . . 112 Glu H . 27668 3 192 . 1 . 1 112 112 GLU N N 15 113.62941 . . . . . . . . 112 Glu N . 27668 3 193 . 1 . 1 114 114 GLU H H 1 8.51444 . . . . . . . . 114 Glu H . 27668 3 194 . 1 . 1 114 114 GLU N N 15 114.73890 . . . . . . . . 114 Glu N . 27668 3 195 . 1 . 1 116 116 SER H H 1 7.57996 . . . . . . . . 116 Ser H . 27668 3 196 . 1 . 1 116 116 SER N N 15 109.88050 . . . . . . . . 116 Ser N . 27668 3 197 . 1 . 1 117 117 LEU H H 1 7.24807 . . . . . . . . 117 Leu H . 27668 3 198 . 1 . 1 117 117 LEU N N 15 126.90872 . . . . . . . . 117 Leu N . 27668 3 199 . 1 . 1 118 118 VAL H H 1 8.82640 . . . . . . . . 118 Val H . 27668 3 200 . 1 . 1 118 118 VAL N N 15 125.78253 . . . . . . . . 118 Val N . 27668 3 201 . 1 . 1 119 119 CYS H H 1 9.51140 . . . . . . . . 119 Cys H . 27668 3 202 . 1 . 1 119 119 CYS N N 15 122.05082 . . . . . . . . 119 Cys N . 27668 3 203 . 1 . 1 120 120 GLN H H 1 9.32355 . . . . . . . . 120 Gln H . 27668 3 204 . 1 . 1 120 120 GLN N N 15 118.48955 . . . . . . . . 120 Gln N . 27668 3 205 . 1 . 1 122 122 LEU H H 1 9.73866 . . . . . . . . 122 Leu H . 27668 3 206 . 1 . 1 122 122 LEU N N 15 128.56131 . . . . . . . . 122 Leu N . 27668 3 207 . 1 . 1 123 123 VAL H H 1 9.44160 . . . . . . . . 123 Val H . 27668 3 208 . 1 . 1 123 123 VAL N N 15 111.54708 . . . . . . . . 123 Val N . 27668 3 209 . 1 . 1 124 124 ARG H H 1 7.93195 . . . . . . . . 124 Arg H . 27668 3 210 . 1 . 1 124 124 ARG N N 15 119.76318 . . . . . . . . 124 Arg N . 27668 3 211 . 1 . 1 125 125 THR H H 1 7.57508 . . . . . . . . 125 Thr H . 27668 3 212 . 1 . 1 125 125 THR N N 15 108.40920 . . . . . . . . 125 Thr N . 27668 3 213 . 1 . 1 127 127 GLU H H 1 8.34175 . . . . . . . . 127 Glu H . 27668 3 214 . 1 . 1 127 127 GLU N N 15 120.41194 . . . . . . . . 127 Glu N . 27668 3 215 . 1 . 1 128 128 VAL H H 1 8.34697 . . . . . . . . 128 Val H . 27668 3 216 . 1 . 1 128 128 VAL N N 15 119.25082 . . . . . . . . 128 Val N . 27668 3 217 . 1 . 1 130 130 ASP H H 1 8.91334 . . . . . . . . 130 Asp H . 27668 3 218 . 1 . 1 130 130 ASP N N 15 125.16318 . . . . . . . . 130 Asp N . 27668 3 219 . 1 . 1 131 131 GLU H H 1 8.32864 . . . . . . . . 131 Glu H . 27668 3 220 . 1 . 1 131 131 GLU N N 15 121.14207 . . . . . . . . 131 Glu N . 27668 3 221 . 1 . 1 132 132 ALA H H 1 7.88270 . . . . . . . . 132 Ala H . 27668 3 222 . 1 . 1 132 132 ALA N N 15 122.45506 . . . . . . . . 132 Ala N . 27668 3 223 . 1 . 1 133 133 LEU H H 1 7.69738 . . . . . . . . 133 Leu H . 27668 3 224 . 1 . 1 133 133 LEU N N 15 116.45833 . . . . . . . . 133 Leu N . 27668 3 225 . 1 . 1 134 134 GLU H H 1 8.05092 . . . . . . . . 134 Glu H . 27668 3 226 . 1 . 1 134 134 GLU N N 15 119.54641 . . . . . . . . 134 Glu N . 27668 3 227 . 1 . 1 136 136 PHE H H 1 8.51634 . . . . . . . . 136 Phe H . 27668 3 228 . 1 . 1 136 136 PHE N N 15 121.87362 . . . . . . . . 136 Phe N . 27668 3 229 . 1 . 1 137 137 ASP H H 1 8.57401 . . . . . . . . 137 Asp H . 27668 3 230 . 1 . 1 137 137 ASP N N 15 118.74543 . . . . . . . . 137 Asp N . 27668 3 231 . 1 . 1 138 138 LYS H H 1 7.95684 . . . . . . . . 138 Lys H . 27668 3 232 . 1 . 1 138 138 LYS N N 15 119.32023 . . . . . . . . 138 Lys N . 27668 3 233 . 1 . 1 139 139 ALA H H 1 7.85513 . . . . . . . . 139 Ala H . 27668 3 234 . 1 . 1 139 139 ALA N N 15 121.68615 . . . . . . . . 139 Ala N . 27668 3 235 . 1 . 1 140 140 LEU H H 1 7.49057 . . . . . . . . 140 Leu H . 27668 3 236 . 1 . 1 140 140 LEU N N 15 114.77317 . . . . . . . . 140 Leu N . 27668 3 237 . 1 . 1 141 141 LYS H H 1 7.16841 . . . . . . . . 141 Lys H . 27668 3 238 . 1 . 1 141 141 LYS N N 15 119.78887 . . . . . . . . 141 Lys N . 27668 3 239 . 1 . 1 142 142 ALA H H 1 7.75500 . . . . . . . . 142 Ala H . 27668 3 240 . 1 . 1 142 142 ALA N N 15 118.53939 . . . . . . . . 142 Ala N . 27668 3 241 . 1 . 1 143 143 LEU H H 1 7.72371 . . . . . . . . 143 Leu H . 27668 3 242 . 1 . 1 143 143 LEU N N 15 119.72597 . . . . . . . . 143 Leu N . 27668 3 243 . 1 . 1 145 145 MET H H 1 7.63753 . . . . . . . . 145 Met H . 27668 3 244 . 1 . 1 145 145 MET N N 15 118.12747 . . . . . . . . 145 Met N . 27668 3 245 . 1 . 1 146 146 HIS H H 1 8.81493 . . . . . . . . 146 His H . 27668 3 246 . 1 . 1 146 146 HIS N N 15 117.81650 . . . . . . . . 146 His N . 27668 3 247 . 1 . 1 149 149 LEU H H 1 9.20937 . . . . . . . . 149 Leu H . 27668 3 248 . 1 . 1 149 149 LEU N N 15 125.01044 . . . . . . . . 149 Leu N . 27668 3 249 . 1 . 1 150 150 SER H H 1 8.22909 . . . . . . . . 150 Ser H . 27668 3 250 . 1 . 1 150 150 SER N N 15 116.33363 . . . . . . . . 150 Ser N . 27668 3 251 . 1 . 1 151 151 PHE H H 1 8.14169 . . . . . . . . 151 Phe H . 27668 3 252 . 1 . 1 151 151 PHE N N 15 119.74648 . . . . . . . . 151 Phe N . 27668 3 253 . 1 . 1 152 152 ASN H H 1 8.72580 . . . . . . . . 152 Asn H . 27668 3 254 . 1 . 1 152 152 ASN N N 15 119.25046 . . . . . . . . 152 Asn N . 27668 3 255 . 1 . 1 154 154 THR H H 1 8.11869 . . . . . . . . 154 Thr H . 27668 3 256 . 1 . 1 154 154 THR N N 15 115.19077 . . . . . . . . 154 Thr N . 27668 3 257 . 1 . 1 155 155 GLN H H 1 8.30967 . . . . . . . . 155 Gln H . 27668 3 258 . 1 . 1 155 155 GLN N N 15 122.34969 . . . . . . . . 155 Gln N . 27668 3 259 . 1 . 1 156 156 LEU H H 1 8.12967 . . . . . . . . 156 Leu H . 27668 3 260 . 1 . 1 156 156 LEU N N 15 122.20482 . . . . . . . . 156 Leu N . 27668 3 261 . 1 . 1 159 159 GLN H H 1 8.30288 . . . . . . . . 159 Gln H . 27668 3 262 . 1 . 1 159 159 GLN N N 15 125.02645 . . . . . . . . 159 Gln N . 27668 3 stop_ save_