data_19489 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 19489 _Entry.Title ; NMR SOLUTION STRUCTURE OF MSP-P56S DOMAIN/VAPB in DPC ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2013-09-11 _Entry.Accession_date 2013-09-11 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Haina Qin . . . 19489 2 'Liang Zhong' Lim . . . 19489 3 Jianxing Song . . . 19489 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 19489 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'MSP-P56S DOMAIN' . 19489 VAPB . 19489 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 19489 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 230 19489 '15N chemical shifts' 118 19489 '1H chemical shifts' 620 19489 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 2 . . 2014-02-03 2013-09-11 update BMRB 'update entry citation' 19489 1 . . 2013-10-18 2013-09-11 original author 'original release' 19489 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 19489 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 23333387 _Citation.Full_citation . _Citation.Title 'ALS-causing P56S mutation and splicing variation on the hVAPB MSP domain transform its -sandwich fold into lipid-interacting helical conformations.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biochem. Biophys. Res. Commun.' _Citation.Journal_name_full 'Biochemical and biophysical research communications' _Citation.Journal_volume 431 _Citation.Journal_issue 3 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 398 _Citation.Page_last 403 _Citation.Year 2013 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Haina Qin . . . 19489 1 2 Wei Wang . . . 19489 1 3 Jianxing Song . . . 19489 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 19489 _Assembly.ID 1 _Assembly.Name 'MSP-P56S DOMAIN/VAPB' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _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 'MSP-P56S DOMAIN/VAPB' 1 $entity A . yes native no no . . . 19489 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 19489 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MAKVEQVLSLEPQHELKFRG PFTDVVTTNLKLGNPTDRNV CFKVKTTAPRRYCVRSNSGI IDAGASINVSVMLQPFDYDP NEKSKHKFMVQSMFAPTDTS DMEAVWKEAKPEDLMDSKLR CVFEL ; _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 125 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 14206.426 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2MDK . "Nmr Solution Structure Of Msp-p56s Domain/vapb In Dpc" . . . . . 100.00 125 100.00 100.00 2.87e-87 . . . . 19489 1 2 no PDB 3IKK . "Crystal Structure Analysis Of Msp Domain" . . . . . 100.00 127 99.20 99.20 3.04e-86 . . . . 19489 1 3 no DBJ BAC56577 . "similar to Vesicle-associated membrane protein-associated protein B/C [Bos taurus]" . . . . . 100.00 147 99.20 99.20 3.95e-86 . . . . 19489 1 4 no DBJ BAE89665 . "unnamed protein product [Macaca fascicularis]" . . . . . 100.00 243 99.20 99.20 2.81e-86 . . . . 19489 1 5 no DBJ BAG51174 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 243 99.20 99.20 2.81e-86 . . . . 19489 1 6 no DBJ BAI47207 . "VAMP (vesicle-associated membrane protein)-associated protein B and C [synthetic construct]" . . . . . 100.00 243 99.20 99.20 2.81e-86 . . . . 19489 1 7 no EMBL CAN13351 . "VAMP (vesicle-associated membrane protein)-associated protein B and C [Sus scrofa]" . . . . . 100.00 243 97.60 97.60 8.58e-85 . . . . 19489 1 8 no GB AAD13577 . "VAMP-associated protein B [Homo sapiens]" . . . . . 100.00 243 99.20 99.20 2.81e-86 . . . . 19489 1 9 no GB AAD13578 . "VAMP-associated protein C [Homo sapiens]" . . . . . 56.00 99 98.57 98.57 2.14e-41 . . . . 19489 1 10 no GB AAH01712 . "VAPB protein [Homo sapiens]" . . . . . 100.00 243 99.20 99.20 2.81e-86 . . . . 19489 1 11 no GB AAI33498 . "VAPB protein [Bos taurus]" . . . . . 100.00 243 99.20 99.20 2.87e-86 . . . . 19489 1 12 no GB AAP88813 . "VAMP (vesicle-associated membrane protein)-associated protein B and C [Homo sapiens]" . . . . . 100.00 243 99.20 99.20 2.81e-86 . . . . 19489 1 13 no REF NP_001075892 . "vesicle-associated membrane protein-associated protein B [Bos taurus]" . . . . . 100.00 243 99.20 99.20 2.87e-86 . . . . 19489 1 14 no REF NP_001116685 . "vesicle-associated membrane protein-associated protein B [Sus scrofa]" . . . . . 100.00 243 97.60 97.60 8.58e-85 . . . . 19489 1 15 no REF NP_001182606 . "vesicle-associated membrane protein-associated protein B/C isoform 2 [Homo sapiens]" . . . . . 56.00 99 98.57 98.57 2.14e-41 . . . . 19489 1 16 no REF NP_001244417 . "VAMP (vesicle-associated membrane protein)-associated protein B and C [Macaca mulatta]" . . . . . 100.00 243 99.20 99.20 2.81e-86 . . . . 19489 1 17 no REF NP_001274609 . "VAMP (vesicle-associated membrane protein)-associated protein B and C [Macaca fascicularis]" . . . . . 100.00 243 99.20 99.20 2.81e-86 . . . . 19489 1 18 no SP A2VDZ9 . "RecName: Full=Vesicle-associated membrane protein-associated protein B; Short=VAMP-B; Short=VAMP-associated protein B; Short=VA" . . . . . 100.00 243 99.20 99.20 2.87e-86 . . . . 19489 1 19 no SP A5GFS8 . "RecName: Full=Vesicle-associated membrane protein-associated protein B; Short=VAMP-B; Short=VAMP-associated protein B; Short=VA" . . . . . 100.00 243 97.60 97.60 8.58e-85 . . . . 19489 1 20 no SP O95292 . "RecName: Full=Vesicle-associated membrane protein-associated protein B/C; Short=VAMP-B/VAMP-C; Short=VAMP-associated protein B/" . . . . . 100.00 243 99.20 99.20 2.81e-86 . . . . 19489 1 21 no TPG DAA23133 . "TPA: vesicle-associated membrane protein-associated protein B [Bos taurus]" . . . . . 100.00 243 99.20 99.20 2.87e-86 . . . . 19489 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 . MET . 19489 1 2 . ALA . 19489 1 3 . LYS . 19489 1 4 . VAL . 19489 1 5 . GLU . 19489 1 6 . GLN . 19489 1 7 . VAL . 19489 1 8 . LEU . 19489 1 9 . SER . 19489 1 10 . LEU . 19489 1 11 . GLU . 19489 1 12 . PRO . 19489 1 13 . GLN . 19489 1 14 . HIS . 19489 1 15 . GLU . 19489 1 16 . LEU . 19489 1 17 . LYS . 19489 1 18 . PHE . 19489 1 19 . ARG . 19489 1 20 . GLY . 19489 1 21 . PRO . 19489 1 22 . PHE . 19489 1 23 . THR . 19489 1 24 . ASP . 19489 1 25 . VAL . 19489 1 26 . VAL . 19489 1 27 . THR . 19489 1 28 . THR . 19489 1 29 . ASN . 19489 1 30 . LEU . 19489 1 31 . LYS . 19489 1 32 . LEU . 19489 1 33 . GLY . 19489 1 34 . ASN . 19489 1 35 . PRO . 19489 1 36 . THR . 19489 1 37 . ASP . 19489 1 38 . ARG . 19489 1 39 . ASN . 19489 1 40 . VAL . 19489 1 41 . CYS . 19489 1 42 . PHE . 19489 1 43 . LYS . 19489 1 44 . VAL . 19489 1 45 . LYS . 19489 1 46 . THR . 19489 1 47 . THR . 19489 1 48 . ALA . 19489 1 49 . PRO . 19489 1 50 . ARG . 19489 1 51 . ARG . 19489 1 52 . TYR . 19489 1 53 . CYS . 19489 1 54 . VAL . 19489 1 55 . ARG . 19489 1 56 . SER . 19489 1 57 . ASN . 19489 1 58 . SER . 19489 1 59 . GLY . 19489 1 60 . ILE . 19489 1 61 . ILE . 19489 1 62 . ASP . 19489 1 63 . ALA . 19489 1 64 . GLY . 19489 1 65 . ALA . 19489 1 66 . SER . 19489 1 67 . ILE . 19489 1 68 . ASN . 19489 1 69 . VAL . 19489 1 70 . SER . 19489 1 71 . VAL . 19489 1 72 . MET . 19489 1 73 . LEU . 19489 1 74 . GLN . 19489 1 75 . PRO . 19489 1 76 . PHE . 19489 1 77 . ASP . 19489 1 78 . TYR . 19489 1 79 . ASP . 19489 1 80 . PRO . 19489 1 81 . ASN . 19489 1 82 . GLU . 19489 1 83 . LYS . 19489 1 84 . SER . 19489 1 85 . LYS . 19489 1 86 . HIS . 19489 1 87 . LYS . 19489 1 88 . PHE . 19489 1 89 . MET . 19489 1 90 . VAL . 19489 1 91 . GLN . 19489 1 92 . SER . 19489 1 93 . MET . 19489 1 94 . PHE . 19489 1 95 . ALA . 19489 1 96 . PRO . 19489 1 97 . THR . 19489 1 98 . ASP . 19489 1 99 . THR . 19489 1 100 . SER . 19489 1 101 . ASP . 19489 1 102 . MET . 19489 1 103 . GLU . 19489 1 104 . ALA . 19489 1 105 . VAL . 19489 1 106 . TRP . 19489 1 107 . LYS . 19489 1 108 . GLU . 19489 1 109 . ALA . 19489 1 110 . LYS . 19489 1 111 . PRO . 19489 1 112 . GLU . 19489 1 113 . ASP . 19489 1 114 . LEU . 19489 1 115 . MET . 19489 1 116 . ASP . 19489 1 117 . SER . 19489 1 118 . LYS . 19489 1 119 . LEU . 19489 1 120 . ARG . 19489 1 121 . CYS . 19489 1 122 . VAL . 19489 1 123 . PHE . 19489 1 124 . GLU . 19489 1 125 . LEU . 19489 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 . MET 1 1 19489 1 . ALA 2 2 19489 1 . LYS 3 3 19489 1 . VAL 4 4 19489 1 . GLU 5 5 19489 1 . GLN 6 6 19489 1 . VAL 7 7 19489 1 . LEU 8 8 19489 1 . SER 9 9 19489 1 . LEU 10 10 19489 1 . GLU 11 11 19489 1 . PRO 12 12 19489 1 . GLN 13 13 19489 1 . HIS 14 14 19489 1 . GLU 15 15 19489 1 . LEU 16 16 19489 1 . LYS 17 17 19489 1 . PHE 18 18 19489 1 . ARG 19 19 19489 1 . GLY 20 20 19489 1 . PRO 21 21 19489 1 . PHE 22 22 19489 1 . THR 23 23 19489 1 . ASP 24 24 19489 1 . VAL 25 25 19489 1 . VAL 26 26 19489 1 . THR 27 27 19489 1 . THR 28 28 19489 1 . ASN 29 29 19489 1 . LEU 30 30 19489 1 . LYS 31 31 19489 1 . LEU 32 32 19489 1 . GLY 33 33 19489 1 . ASN 34 34 19489 1 . PRO 35 35 19489 1 . THR 36 36 19489 1 . ASP 37 37 19489 1 . ARG 38 38 19489 1 . ASN 39 39 19489 1 . VAL 40 40 19489 1 . CYS 41 41 19489 1 . PHE 42 42 19489 1 . LYS 43 43 19489 1 . VAL 44 44 19489 1 . LYS 45 45 19489 1 . THR 46 46 19489 1 . THR 47 47 19489 1 . ALA 48 48 19489 1 . PRO 49 49 19489 1 . ARG 50 50 19489 1 . ARG 51 51 19489 1 . TYR 52 52 19489 1 . CYS 53 53 19489 1 . VAL 54 54 19489 1 . ARG 55 55 19489 1 . SER 56 56 19489 1 . ASN 57 57 19489 1 . SER 58 58 19489 1 . GLY 59 59 19489 1 . ILE 60 60 19489 1 . ILE 61 61 19489 1 . ASP 62 62 19489 1 . ALA 63 63 19489 1 . GLY 64 64 19489 1 . ALA 65 65 19489 1 . SER 66 66 19489 1 . ILE 67 67 19489 1 . ASN 68 68 19489 1 . VAL 69 69 19489 1 . SER 70 70 19489 1 . VAL 71 71 19489 1 . MET 72 72 19489 1 . LEU 73 73 19489 1 . GLN 74 74 19489 1 . PRO 75 75 19489 1 . PHE 76 76 19489 1 . ASP 77 77 19489 1 . TYR 78 78 19489 1 . ASP 79 79 19489 1 . PRO 80 80 19489 1 . ASN 81 81 19489 1 . GLU 82 82 19489 1 . LYS 83 83 19489 1 . SER 84 84 19489 1 . LYS 85 85 19489 1 . HIS 86 86 19489 1 . LYS 87 87 19489 1 . PHE 88 88 19489 1 . MET 89 89 19489 1 . VAL 90 90 19489 1 . GLN 91 91 19489 1 . SER 92 92 19489 1 . MET 93 93 19489 1 . PHE 94 94 19489 1 . ALA 95 95 19489 1 . PRO 96 96 19489 1 . THR 97 97 19489 1 . ASP 98 98 19489 1 . THR 99 99 19489 1 . SER 100 100 19489 1 . ASP 101 101 19489 1 . MET 102 102 19489 1 . GLU 103 103 19489 1 . ALA 104 104 19489 1 . VAL 105 105 19489 1 . TRP 106 106 19489 1 . LYS 107 107 19489 1 . GLU 108 108 19489 1 . ALA 109 109 19489 1 . LYS 110 110 19489 1 . PRO 111 111 19489 1 . GLU 112 112 19489 1 . ASP 113 113 19489 1 . LEU 114 114 19489 1 . MET 115 115 19489 1 . ASP 116 116 19489 1 . SER 117 117 19489 1 . LYS 118 118 19489 1 . LEU 119 119 19489 1 . ARG 120 120 19489 1 . CYS 121 121 19489 1 . VAL 122 122 19489 1 . PHE 123 123 19489 1 . GLU 124 124 19489 1 . LEU 125 125 19489 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 19489 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli . . . . . . . . . . . . . . . . . . . . . 19489 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 19489 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pGEX-4T-1 . . . . . . 19489 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 19489 _Sample.ID 1 _Sample.Type micelle _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 'MSP-P56S DOMAIN/VAPB' '[U-13C; U-15N]' . . 1 $entity . . . . . mM . . . . 19489 1 2 DPC 'natural abundance' . . . . . . 20 . . mM . . . . 19489 1 stop_ save_ ####################### # Sample conditions # ####################### save_pH4_313K _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode pH4_313K _Sample_condition_list.Entry_ID 19489 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 4 . pH 19489 1 pressure 1 . atm 19489 1 temperature 313 . K 19489 1 stop_ save_ ############################ # Computer software used # ############################ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 19489 _Software.ID 1 _Software.Name CNS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 19489 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 19489 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 19489 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 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 19489 _NMR_spectrometer_list.ID 1 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 . 800 . . . 19489 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 19489 _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 '3D CBCA(CO)NH' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $pH4_313K . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19489 1 2 '3D 1H-15N TOCSY' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $pH4_313K . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19489 1 3 '3D 1H-15N NOESY' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $pH4_313K . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19489 1 4 '3D HCCH-TOCSY' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $pH4_313K . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19489 1 5 '3D HBHA(CO)NH' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $pH4_313K . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19489 1 6 '3D HN(CO)CA' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $pH4_313K . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19489 1 7 '3D HNCACB' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $pH4_313K . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19489 1 8 '3D HNCO' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $pH4_313K . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19489 1 9 '3D C(CO)NH' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $pH4_313K . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19489 1 stop_ save_ save_NMR_spectrometer_expt _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt _NMR_spec_expt.Entry_ID 19489 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name . _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $CNS _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . 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 19489 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 TMS 'methyl carbon' . . . . ppm . internal direct 1 . . . . . . . . . 19489 1 H 1 water protons . . . . ppm . internal direct 1 . . . . . . . . . 19489 1 N 15 '[15N] ammonium chloride' nitrogen . . . . ppm . internal direct 1 . . . . . . . . . 19489 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 19489 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $pH4_313K _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 '3D CBCA(CO)NH' . . . 19489 1 2 '3D 1H-15N TOCSY' . . . 19489 1 3 '3D 1H-15N NOESY' . . . 19489 1 4 '3D HCCH-TOCSY' . . . 19489 1 5 '3D HBHA(CO)NH' . . . 19489 1 6 '3D HN(CO)CA' . . . 19489 1 7 '3D HNCACB' . . . 19489 1 8 '3D HNCO' . . . 19489 1 9 '3D C(CO)NH' . . . 19489 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET CA C 13 54.500 . . . . . . A 1 MET CA . 19489 1 2 . 1 1 1 1 MET CB C 13 32.650 . . . . . . A 1 MET CB . 19489 1 3 . 1 1 2 2 ALA H H 1 8.793 . . . . . . A 2 ALA H . 19489 1 4 . 1 1 2 2 ALA HA H 1 4.491 . . . . . . A 2 ALA HA . 19489 1 5 . 1 1 2 2 ALA HB1 H 1 1.543 . . . . . . A 2 ALA HB1 . 19489 1 6 . 1 1 2 2 ALA HB2 H 1 1.543 . . . . . . A 2 ALA HB2 . 19489 1 7 . 1 1 2 2 ALA HB3 H 1 1.543 . . . . . . A 2 ALA HB3 . 19489 1 8 . 1 1 2 2 ALA CA C 13 52.320 . . . . . . A 2 ALA CA . 19489 1 9 . 1 1 2 2 ALA CB C 13 18.810 . . . . . . A 2 ALA CB . 19489 1 10 . 1 1 2 2 ALA N N 15 127.968 . . . . . . A 2 ALA N . 19489 1 11 . 1 1 3 3 LYS H H 1 8.623 . . . . . . A 3 LYS H . 19489 1 12 . 1 1 3 3 LYS HA H 1 4.395 . . . . . . A 3 LYS HA . 19489 1 13 . 1 1 3 3 LYS HB2 H 1 1.964 . . . . . . A 3 LYS HB2 . 19489 1 14 . 1 1 3 3 LYS HG2 H 1 1.554 . . . . . . A 3 LYS HG2 . 19489 1 15 . 1 1 3 3 LYS HD2 H 1 1.638 . . . . . . A 3 LYS HD2 . 19489 1 16 . 1 1 3 3 LYS CA C 13 56.913 . . . . . . A 3 LYS CA . 19489 1 17 . 1 1 3 3 LYS CB C 13 32.120 . . . . . . A 3 LYS CB . 19489 1 18 . 1 1 3 3 LYS N N 15 120.234 . . . . . . A 3 LYS N . 19489 1 19 . 1 1 4 4 VAL H H 1 8.468 . . . . . . A 4 VAL H . 19489 1 20 . 1 1 4 4 VAL HA H 1 3.893 . . . . . . A 4 VAL HA . 19489 1 21 . 1 1 4 4 VAL HB H 1 2.217 . . . . . . A 4 VAL HB . 19489 1 22 . 1 1 4 4 VAL HG11 H 1 1.046 . . . . . . A 4 VAL HG11 . 19489 1 23 . 1 1 4 4 VAL HG12 H 1 1.046 . . . . . . A 4 VAL HG12 . 19489 1 24 . 1 1 4 4 VAL HG13 H 1 1.046 . . . . . . A 4 VAL HG13 . 19489 1 25 . 1 1 4 4 VAL HG21 H 1 1.125 . . . . . . A 4 VAL HG21 . 19489 1 26 . 1 1 4 4 VAL HG22 H 1 1.125 . . . . . . A 4 VAL HG22 . 19489 1 27 . 1 1 4 4 VAL HG23 H 1 1.125 . . . . . . A 4 VAL HG23 . 19489 1 28 . 1 1 4 4 VAL CA C 13 64.480 . . . . . . A 4 VAL CA . 19489 1 29 . 1 1 4 4 VAL CB C 13 31.270 . . . . . . A 4 VAL CB . 19489 1 30 . 1 1 4 4 VAL N N 15 119.633 . . . . . . A 4 VAL N . 19489 1 31 . 1 1 5 5 GLU H H 1 8.314 . . . . . . A 5 GLU H . 19489 1 32 . 1 1 5 5 GLU HA H 1 4.425 . . . . . . A 5 GLU HA . 19489 1 33 . 1 1 5 5 GLU HB2 H 1 2.183 . . . . . . A 5 GLU HB2 . 19489 1 34 . 1 1 5 5 GLU HB3 H 1 2.084 . . . . . . A 5 GLU HB3 . 19489 1 35 . 1 1 5 5 GLU HG2 H 1 2.454 . . . . . . A 5 GLU HG2 . 19489 1 36 . 1 1 5 5 GLU HG3 H 1 2.472 . . . . . . A 5 GLU HG3 . 19489 1 37 . 1 1 5 5 GLU CA C 13 57.770 . . . . . . A 5 GLU CA . 19489 1 38 . 1 1 5 5 GLU CB C 13 27.920 . . . . . . A 5 GLU CB . 19489 1 39 . 1 1 5 5 GLU N N 15 119.289 . . . . . . A 5 GLU N . 19489 1 40 . 1 1 6 6 GLN H H 1 8.097 . . . . . . A 6 GLN H . 19489 1 41 . 1 1 6 6 GLN HA H 1 4.292 . . . . . . A 6 GLN HA . 19489 1 42 . 1 1 6 6 GLN HB2 H 1 2.486 . . . . . . A 6 GLN HB2 . 19489 1 43 . 1 1 6 6 GLN HG2 H 1 2.237 . . . . . . A 6 GLN HG2 . 19489 1 44 . 1 1 6 6 GLN HE21 H 1 6.864 . . . . . . A 6 GLN HE21 . 19489 1 45 . 1 1 6 6 GLN HE22 H 1 7.533 . . . . . . A 6 GLN HE22 . 19489 1 46 . 1 1 6 6 GLN CA C 13 57.435 . . . . . . A 6 GLN CA . 19489 1 47 . 1 1 6 6 GLN CB C 13 28.374 . . . . . . A 6 GLN CB . 19489 1 48 . 1 1 6 6 GLN N N 15 119.030 . . . . . . A 6 GLN N . 19489 1 49 . 1 1 6 6 GLN NE2 N 15 111.276 . . . . . . A 6 GLN NE2 . 19489 1 50 . 1 1 7 7 VAL H H 1 7.974 . . . . . . A 7 VAL H . 19489 1 51 . 1 1 7 7 VAL HA H 1 3.986 . . . . . . A 7 VAL HA . 19489 1 52 . 1 1 7 7 VAL HB H 1 2.280 . . . . . . A 7 VAL HB . 19489 1 53 . 1 1 7 7 VAL HG11 H 1 1.048 . . . . . . A 7 VAL HG11 . 19489 1 54 . 1 1 7 7 VAL HG12 H 1 1.048 . . . . . . A 7 VAL HG12 . 19489 1 55 . 1 1 7 7 VAL HG13 H 1 1.048 . . . . . . A 7 VAL HG13 . 19489 1 56 . 1 1 7 7 VAL HG21 H 1 1.111 . . . . . . A 7 VAL HG21 . 19489 1 57 . 1 1 7 7 VAL HG22 H 1 1.111 . . . . . . A 7 VAL HG22 . 19489 1 58 . 1 1 7 7 VAL HG23 H 1 1.111 . . . . . . A 7 VAL HG23 . 19489 1 59 . 1 1 7 7 VAL CA C 13 63.619 . . . . . . A 7 VAL CA . 19489 1 60 . 1 1 7 7 VAL CB C 13 31.678 . . . . . . A 7 VAL CB . 19489 1 61 . 1 1 7 7 VAL N N 15 118.687 . . . . . . A 7 VAL N . 19489 1 62 . 1 1 8 8 LEU H H 1 8.039 . . . . . . A 8 LEU H . 19489 1 63 . 1 1 8 8 LEU HA H 1 4.352 . . . . . . A 8 LEU HA . 19489 1 64 . 1 1 8 8 LEU HB2 H 1 1.810 . . . . . . A 8 LEU HB2 . 19489 1 65 . 1 1 8 8 LEU HG H 1 1.692 . . . . . . A 8 LEU HG . 19489 1 66 . 1 1 8 8 LEU HD11 H 1 0.940 . . . . . . A 8 LEU HD11 . 19489 1 67 . 1 1 8 8 LEU HD12 H 1 0.940 . . . . . . A 8 LEU HD12 . 19489 1 68 . 1 1 8 8 LEU HD13 H 1 0.940 . . . . . . A 8 LEU HD13 . 19489 1 69 . 1 1 8 8 LEU HD21 H 1 1.000 . . . . . . A 8 LEU HD21 . 19489 1 70 . 1 1 8 8 LEU HD22 H 1 1.000 . . . . . . A 8 LEU HD22 . 19489 1 71 . 1 1 8 8 LEU HD23 H 1 1.000 . . . . . . A 8 LEU HD23 . 19489 1 72 . 1 1 8 8 LEU CA C 13 55.480 . . . . . . A 8 LEU CA . 19489 1 73 . 1 1 8 8 LEU CB C 13 41.400 . . . . . . A 8 LEU CB . 19489 1 74 . 1 1 8 8 LEU N N 15 120.406 . . . . . . A 8 LEU N . 19489 1 75 . 1 1 9 9 SER H H 1 7.974 . . . . . . A 9 SER H . 19489 1 76 . 1 1 9 9 SER HA H 1 4.501 . . . . . . A 9 SER HA . 19489 1 77 . 1 1 9 9 SER HB2 H 1 4.000 . . . . . . A 9 SER HB2 . 19489 1 78 . 1 1 9 9 SER CA C 13 58.510 . . . . . . A 9 SER CA . 19489 1 79 . 1 1 9 9 SER CB C 13 63.210 . . . . . . A 9 SER CB . 19489 1 80 . 1 1 9 9 SER N N 15 114.418 . . . . . . A 9 SER N . 19489 1 81 . 1 1 10 10 LEU H H 1 7.946 . . . . . . A 10 LEU H . 19489 1 82 . 1 1 10 10 LEU HA H 1 4.444 . . . . . . A 10 LEU HA . 19489 1 83 . 1 1 10 10 LEU HB2 H 1 1.846 . . . . . . A 10 LEU HB2 . 19489 1 84 . 1 1 10 10 LEU HG H 1 1.694 . . . . . . A 10 LEU HG . 19489 1 85 . 1 1 10 10 LEU HD11 H 1 1.029 . . . . . . A 10 LEU HD11 . 19489 1 86 . 1 1 10 10 LEU HD12 H 1 1.029 . . . . . . A 10 LEU HD12 . 19489 1 87 . 1 1 10 10 LEU HD13 H 1 1.029 . . . . . . A 10 LEU HD13 . 19489 1 88 . 1 1 10 10 LEU CA C 13 54.650 . . . . . . A 10 LEU CA . 19489 1 89 . 1 1 10 10 LEU CB C 13 42.170 . . . . . . A 10 LEU CB . 19489 1 90 . 1 1 10 10 LEU N N 15 122.211 . . . . . . A 10 LEU N . 19489 1 91 . 1 1 11 11 GLU H H 1 8.077 . . . . . . A 11 GLU H . 19489 1 92 . 1 1 11 11 GLU HA H 1 4.055 . . . . . . A 11 GLU HA . 19489 1 93 . 1 1 11 11 GLU HB2 H 1 1.097 . . . . . . A 11 GLU HB2 . 19489 1 94 . 1 1 11 11 GLU HB3 H 1 0.962 . . . . . . A 11 GLU HB3 . 19489 1 95 . 1 1 11 11 GLU HG2 H 1 2.255 . . . . . . A 11 GLU HG2 . 19489 1 96 . 1 1 11 11 GLU CA C 13 54.010 . . . . . . A 11 GLU CA . 19489 1 97 . 1 1 11 11 GLU CB C 13 27.950 . . . . . . A 11 GLU CB . 19489 1 98 . 1 1 11 11 GLU N N 15 119.398 . . . . . . A 11 GLU N . 19489 1 99 . 1 1 12 12 PRO HA H 1 4.485 . . . . . . A 12 PRO HA . 19489 1 100 . 1 1 12 12 PRO HB2 H 1 2.377 . . . . . . A 12 PRO HB2 . 19489 1 101 . 1 1 12 12 PRO HG2 H 1 2.063 . . . . . . A 12 PRO HG2 . 19489 1 102 . 1 1 12 12 PRO HG3 H 1 1.999 . . . . . . A 12 PRO HG3 . 19489 1 103 . 1 1 12 12 PRO HD2 H 1 3.911 . . . . . . A 12 PRO HD2 . 19489 1 104 . 1 1 12 12 PRO HD3 H 1 3.802 . . . . . . A 12 PRO HD3 . 19489 1 105 . 1 1 12 12 PRO CA C 13 63.535 . . . . . . A 12 PRO CA . 19489 1 106 . 1 1 12 12 PRO CB C 13 31.332 . . . . . . A 12 PRO CB . 19489 1 107 . 1 1 13 13 GLN H H 1 8.675 . . . . . . A 13 GLN H . 19489 1 108 . 1 1 13 13 GLN HA H 1 4.280 . . . . . . A 13 GLN HA . 19489 1 109 . 1 1 13 13 GLN HB2 H 1 2.141 . . . . . . A 13 GLN HB2 . 19489 1 110 . 1 1 13 13 GLN HB3 H 1 2.051 . . . . . . A 13 GLN HB3 . 19489 1 111 . 1 1 13 13 GLN HG2 H 1 2.455 . . . . . . A 13 GLN HG2 . 19489 1 112 . 1 1 13 13 GLN HG3 H 1 2.375 . . . . . . A 13 GLN HG3 . 19489 1 113 . 1 1 13 13 GLN HE21 H 1 6.881 . . . . . . A 13 GLN HE21 . 19489 1 114 . 1 1 13 13 GLN HE22 H 1 7.591 . . . . . . A 13 GLN HE22 . 19489 1 115 . 1 1 13 13 GLN CA C 13 56.209 . . . . . . A 13 GLN CA . 19489 1 116 . 1 1 13 13 GLN CB C 13 28.230 . . . . . . A 13 GLN CB . 19489 1 117 . 1 1 13 13 GLN N N 15 118.344 . . . . . . A 13 GLN N . 19489 1 118 . 1 1 13 13 GLN NE2 N 15 111.897 . . . . . . A 13 GLN NE2 . 19489 1 119 . 1 1 14 14 HIS H H 1 8.284 . . . . . . A 14 HIS H . 19489 1 120 . 1 1 14 14 HIS HA H 1 4.785 . . . . . . A 14 HIS HA . 19489 1 121 . 1 1 14 14 HIS HB2 H 1 3.408 . . . . . . A 14 HIS HB2 . 19489 1 122 . 1 1 14 14 HIS HB3 H 1 3.303 . . . . . . A 14 HIS HB3 . 19489 1 123 . 1 1 14 14 HIS CA C 13 54.993 . . . . . . A 14 HIS CA . 19489 1 124 . 1 1 14 14 HIS CB C 13 28.608 . . . . . . A 14 HIS CB . 19489 1 125 . 1 1 14 14 HIS N N 15 117.141 . . . . . . A 14 HIS N . 19489 1 126 . 1 1 15 15 GLU H H 1 8.344 . . . . . . A 15 GLU H . 19489 1 127 . 1 1 15 15 GLU HA H 1 4.421 . . . . . . A 15 GLU HA . 19489 1 128 . 1 1 15 15 GLU HB2 H 1 2.169 . . . . . . A 15 GLU HB2 . 19489 1 129 . 1 1 15 15 GLU HB3 H 1 2.068 . . . . . . A 15 GLU HB3 . 19489 1 130 . 1 1 15 15 GLU HG2 H 1 2.455 . . . . . . A 15 GLU HG2 . 19489 1 131 . 1 1 15 15 GLU CA C 13 55.900 . . . . . . A 15 GLU CA . 19489 1 132 . 1 1 15 15 GLU CB C 13 28.797 . . . . . . A 15 GLU CB . 19489 1 133 . 1 1 15 15 GLU N N 15 119.547 . . . . . . A 15 GLU N . 19489 1 134 . 1 1 16 16 LEU H H 1 8.258 . . . . . . A 16 LEU H . 19489 1 135 . 1 1 16 16 LEU HA H 1 4.421 . . . . . . A 16 LEU HA . 19489 1 136 . 1 1 16 16 LEU HB2 H 1 1.734 . . . . . . A 16 LEU HB2 . 19489 1 137 . 1 1 16 16 LEU HG H 1 1.596 . . . . . . A 16 LEU HG . 19489 1 138 . 1 1 16 16 LEU HD11 H 1 1.030 . . . . . . A 16 LEU HD11 . 19489 1 139 . 1 1 16 16 LEU HD12 H 1 1.030 . . . . . . A 16 LEU HD12 . 19489 1 140 . 1 1 16 16 LEU HD13 H 1 1.030 . . . . . . A 16 LEU HD13 . 19489 1 141 . 1 1 16 16 LEU HD21 H 1 0.971 . . . . . . A 16 LEU HD21 . 19489 1 142 . 1 1 16 16 LEU HD22 H 1 0.971 . . . . . . A 16 LEU HD22 . 19489 1 143 . 1 1 16 16 LEU HD23 H 1 0.971 . . . . . . A 16 LEU HD23 . 19489 1 144 . 1 1 16 16 LEU CA C 13 54.720 . . . . . . A 16 LEU CA . 19489 1 145 . 1 1 16 16 LEU CB C 13 41.845 . . . . . . A 16 LEU CB . 19489 1 146 . 1 1 16 16 LEU N N 15 122.211 . . . . . . A 16 LEU N . 19489 1 147 . 1 1 17 17 LYS H H 1 8.092 . . . . . . A 17 LYS H . 19489 1 148 . 1 1 17 17 LYS HA H 1 4.409 . . . . . . A 17 LYS HA . 19489 1 149 . 1 1 17 17 LYS HB2 H 1 1.798 . . . . . . A 17 LYS HB2 . 19489 1 150 . 1 1 17 17 LYS HG2 H 1 1.379 . . . . . . A 17 LYS HG2 . 19489 1 151 . 1 1 17 17 LYS CA C 13 55.570 . . . . . . A 17 LYS CA . 19489 1 152 . 1 1 17 17 LYS CB C 13 32.525 . . . . . . A 17 LYS CB . 19489 1 153 . 1 1 17 17 LYS N N 15 121.008 . . . . . . A 17 LYS N . 19489 1 154 . 1 1 18 18 PHE H H 1 8.183 . . . . . . A 18 PHE H . 19489 1 155 . 1 1 18 18 PHE HA H 1 4.737 . . . . . . A 18 PHE HA . 19489 1 156 . 1 1 18 18 PHE HB2 H 1 3.257 . . . . . . A 18 PHE HB2 . 19489 1 157 . 1 1 18 18 PHE HB3 H 1 3.138 . . . . . . A 18 PHE HB3 . 19489 1 158 . 1 1 18 18 PHE CA C 13 57.265 . . . . . . A 18 PHE CA . 19489 1 159 . 1 1 18 18 PHE CB C 13 39.388 . . . . . . A 18 PHE CB . 19489 1 160 . 1 1 18 18 PHE N N 15 119.805 . . . . . . A 18 PHE N . 19489 1 161 . 1 1 19 19 ARG H H 1 8.283 . . . . . . A 19 ARG H . 19489 1 162 . 1 1 19 19 ARG HA H 1 4.456 . . . . . . A 19 ARG HA . 19489 1 163 . 1 1 19 19 ARG HB2 H 1 1.986 . . . . . . A 19 ARG HB2 . 19489 1 164 . 1 1 19 19 ARG HB3 H 1 1.870 . . . . . . A 19 ARG HB3 . 19489 1 165 . 1 1 19 19 ARG HG2 H 1 1.713 . . . . . . A 19 ARG HG2 . 19489 1 166 . 1 1 19 19 ARG HD2 H 1 3.320 . . . . . . A 19 ARG HD2 . 19489 1 167 . 1 1 19 19 ARG CA C 13 55.810 . . . . . . A 19 ARG CA . 19489 1 168 . 1 1 19 19 ARG CB C 13 30.613 . . . . . . A 19 ARG CB . 19489 1 169 . 1 1 19 19 ARG N N 15 121.010 . . . . . . A 19 ARG N . 19489 1 170 . 1 1 20 20 GLY H H 1 8.204 . . . . . . A 20 GLY H . 19489 1 171 . 1 1 20 20 GLY HA2 H 1 4.184 . . . . . . A 20 GLY HA2 . 19489 1 172 . 1 1 20 20 GLY HA3 H 1 4.101 . . . . . . A 20 GLY HA3 . 19489 1 173 . 1 1 20 20 GLY CA C 13 44.890 . . . . . . A 20 GLY CA . 19489 1 174 . 1 1 20 20 GLY N N 15 109.321 . . . . . . A 20 GLY N . 19489 1 175 . 1 1 21 21 PRO HA H 1 4.544 . . . . . . A 21 PRO HA . 19489 1 176 . 1 1 21 21 PRO HB2 H 1 2.337 . . . . . . A 21 PRO HB2 . 19489 1 177 . 1 1 21 21 PRO HB3 H 1 1.981 . . . . . . A 21 PRO HB3 . 19489 1 178 . 1 1 21 21 PRO HG2 H 1 1.887 . . . . . . A 21 PRO HG2 . 19489 1 179 . 1 1 21 21 PRO HD2 H 1 3.721 . . . . . . A 21 PRO HD2 . 19489 1 180 . 1 1 21 21 PRO CA C 13 63.530 . . . . . . A 21 PRO CA . 19489 1 181 . 1 1 21 21 PRO CB C 13 31.254 . . . . . . A 21 PRO CB . 19489 1 182 . 1 1 22 22 PHE H H 1 8.505 . . . . . . A 22 PHE H . 19489 1 183 . 1 1 22 22 PHE HA H 1 4.538 . . . . . . A 22 PHE HA . 19489 1 184 . 1 1 22 22 PHE HB2 H 1 3.260 . . . . . . A 22 PHE HB2 . 19489 1 185 . 1 1 22 22 PHE CA C 13 58.960 . . . . . . A 22 PHE CA . 19489 1 186 . 1 1 22 22 PHE CB C 13 38.618 . . . . . . A 22 PHE CB . 19489 1 187 . 1 1 22 22 PHE N N 15 118.773 . . . . . . A 22 PHE N . 19489 1 188 . 1 1 23 23 THR H H 1 8.150 . . . . . . A 23 THR H . 19489 1 189 . 1 1 23 23 THR HA H 1 4.338 . . . . . . A 23 THR HA . 19489 1 190 . 1 1 23 23 THR HB H 1 4.054 . . . . . . A 23 THR HB . 19489 1 191 . 1 1 23 23 THR HG21 H 1 1.322 . . . . . . A 23 THR HG21 . 19489 1 192 . 1 1 23 23 THR HG22 H 1 1.322 . . . . . . A 23 THR HG22 . 19489 1 193 . 1 1 23 23 THR HG23 H 1 1.322 . . . . . . A 23 THR HG23 . 19489 1 194 . 1 1 23 23 THR CA C 13 63.953 . . . . . . A 23 THR CA . 19489 1 195 . 1 1 23 23 THR CB C 13 68.510 . . . . . . A 23 THR CB . 19489 1 196 . 1 1 23 23 THR N N 15 112.672 . . . . . . A 23 THR N . 19489 1 197 . 1 1 24 24 ASP H H 1 8.238 . . . . . . A 24 ASP H . 19489 1 198 . 1 1 24 24 ASP HA H 1 4.668 . . . . . . A 24 ASP HA . 19489 1 199 . 1 1 24 24 ASP HB2 H 1 2.892 . . . . . . A 24 ASP HB2 . 19489 1 200 . 1 1 24 24 ASP CA C 13 54.893 . . . . . . A 24 ASP CA . 19489 1 201 . 1 1 24 24 ASP CB C 13 38.880 . . . . . . A 24 ASP CB . 19489 1 202 . 1 1 24 24 ASP N N 15 121.093 . . . . . . A 24 ASP N . 19489 1 203 . 1 1 25 25 VAL H H 1 7.900 . . . . . . A 25 VAL H . 19489 1 204 . 1 1 25 25 VAL HA H 1 4.044 . . . . . . A 25 VAL HA . 19489 1 205 . 1 1 25 25 VAL HB H 1 2.245 . . . . . . A 25 VAL HB . 19489 1 206 . 1 1 25 25 VAL HG11 H 1 1.010 . . . . . . A 25 VAL HG11 . 19489 1 207 . 1 1 25 25 VAL HG12 H 1 1.010 . . . . . . A 25 VAL HG12 . 19489 1 208 . 1 1 25 25 VAL HG13 H 1 1.010 . . . . . . A 25 VAL HG13 . 19489 1 209 . 1 1 25 25 VAL HG21 H 1 1.089 . . . . . . A 25 VAL HG21 . 19489 1 210 . 1 1 25 25 VAL HG22 H 1 1.089 . . . . . . A 25 VAL HG22 . 19489 1 211 . 1 1 25 25 VAL HG23 H 1 1.089 . . . . . . A 25 VAL HG23 . 19489 1 212 . 1 1 25 25 VAL CA C 13 63.830 . . . . . . A 25 VAL CA . 19489 1 213 . 1 1 25 25 VAL CB C 13 31.640 . . . . . . A 25 VAL CB . 19489 1 214 . 1 1 25 25 VAL N N 15 119.289 . . . . . . A 25 VAL N . 19489 1 215 . 1 1 26 26 VAL H H 1 7.903 . . . . . . A 26 VAL H . 19489 1 216 . 1 1 26 26 VAL HA H 1 4.016 . . . . . . A 26 VAL HA . 19489 1 217 . 1 1 26 26 VAL HB H 1 2.219 . . . . . . A 26 VAL HB . 19489 1 218 . 1 1 26 26 VAL HG11 H 1 0.970 . . . . . . A 26 VAL HG11 . 19489 1 219 . 1 1 26 26 VAL HG12 H 1 0.970 . . . . . . A 26 VAL HG12 . 19489 1 220 . 1 1 26 26 VAL HG13 H 1 0.970 . . . . . . A 26 VAL HG13 . 19489 1 221 . 1 1 26 26 VAL HG21 H 1 1.088 . . . . . . A 26 VAL HG21 . 19489 1 222 . 1 1 26 26 VAL HG22 H 1 1.088 . . . . . . A 26 VAL HG22 . 19489 1 223 . 1 1 26 26 VAL HG23 H 1 1.088 . . . . . . A 26 VAL HG23 . 19489 1 224 . 1 1 26 26 VAL CA C 13 63.230 . . . . . . A 26 VAL CA . 19489 1 225 . 1 1 26 26 VAL CB C 13 31.030 . . . . . . A 26 VAL CB . 19489 1 226 . 1 1 26 26 VAL N N 15 119.547 . . . . . . A 26 VAL N . 19489 1 227 . 1 1 27 27 THR H H 1 8.012 . . . . . . A 27 THR H . 19489 1 228 . 1 1 27 27 THR HA H 1 4.409 . . . . . . A 27 THR HA . 19489 1 229 . 1 1 27 27 THR HB H 1 4.292 . . . . . . A 27 THR HB . 19489 1 230 . 1 1 27 27 THR HG21 H 1 1.304 . . . . . . A 27 THR HG21 . 19489 1 231 . 1 1 27 27 THR HG22 H 1 1.304 . . . . . . A 27 THR HG22 . 19489 1 232 . 1 1 27 27 THR HG23 H 1 1.304 . . . . . . A 27 THR HG23 . 19489 1 233 . 1 1 27 27 THR CA C 13 63.564 . . . . . . A 27 THR CA . 19489 1 234 . 1 1 27 27 THR CB C 13 68.770 . . . . . . A 27 THR CB . 19489 1 235 . 1 1 27 27 THR N N 15 115.078 . . . . . . A 27 THR N . 19489 1 236 . 1 1 28 28 THR H H 1 8.191 . . . . . . A 28 THR H . 19489 1 237 . 1 1 28 28 THR HA H 1 4.409 . . . . . . A 28 THR HA . 19489 1 238 . 1 1 28 28 THR HB H 1 4.291 . . . . . . A 28 THR HB . 19489 1 239 . 1 1 28 28 THR HG21 H 1 1.333 . . . . . . A 28 THR HG21 . 19489 1 240 . 1 1 28 28 THR HG22 H 1 1.333 . . . . . . A 28 THR HG22 . 19489 1 241 . 1 1 28 28 THR HG23 H 1 1.333 . . . . . . A 28 THR HG23 . 19489 1 242 . 1 1 28 28 THR CA C 13 63.564 . . . . . . A 28 THR CA . 19489 1 243 . 1 1 28 28 THR CB C 13 68.770 . . . . . . A 28 THR CB . 19489 1 244 . 1 1 28 28 THR N N 15 113.016 . . . . . . A 28 THR N . 19489 1 245 . 1 1 29 29 ASN H H 1 8.335 . . . . . . A 29 ASN H . 19489 1 246 . 1 1 29 29 ASN HA H 1 4.421 . . . . . . A 29 ASN HA . 19489 1 247 . 1 1 29 29 ASN HB2 H 1 2.980 . . . . . . A 29 ASN HB2 . 19489 1 248 . 1 1 29 29 ASN CA C 13 57.770 . . . . . . A 29 ASN CA . 19489 1 249 . 1 1 29 29 ASN CB C 13 27.858 . . . . . . A 29 ASN CB . 19489 1 250 . 1 1 29 29 ASN N N 15 117.740 . . . . . . A 29 ASN N . 19489 1 251 . 1 1 30 30 LEU H H 1 8.140 . . . . . . A 30 LEU H . 19489 1 252 . 1 1 30 30 LEU HA H 1 4.669 . . . . . . A 30 LEU HA . 19489 1 253 . 1 1 30 30 LEU HB2 H 1 1.691 . . . . . . A 30 LEU HB2 . 19489 1 254 . 1 1 30 30 LEU HG H 1 1.454 . . . . . . A 30 LEU HG . 19489 1 255 . 1 1 30 30 LEU HD11 H 1 1.363 . . . . . . A 30 LEU HD11 . 19489 1 256 . 1 1 30 30 LEU HD12 H 1 1.363 . . . . . . A 30 LEU HD12 . 19489 1 257 . 1 1 30 30 LEU HD13 H 1 1.363 . . . . . . A 30 LEU HD13 . 19489 1 258 . 1 1 30 30 LEU CA C 13 54.469 . . . . . . A 30 LEU CA . 19489 1 259 . 1 1 30 30 LEU CB C 13 38.620 . . . . . . A 30 LEU CB . 19489 1 260 . 1 1 30 30 LEU N N 15 118.687 . . . . . . A 30 LEU N . 19489 1 261 . 1 1 31 31 LYS H H 1 8.011 . . . . . . A 31 LYS H . 19489 1 262 . 1 1 31 31 LYS HA H 1 4.411 . . . . . . A 31 LYS HA . 19489 1 263 . 1 1 31 31 LYS HB2 H 1 1.886 . . . . . . A 31 LYS HB2 . 19489 1 264 . 1 1 31 31 LYS HB3 H 1 1.792 . . . . . . A 31 LYS HB3 . 19489 1 265 . 1 1 31 31 LYS HG2 H 1 1.693 . . . . . . A 31 LYS HG2 . 19489 1 266 . 1 1 31 31 LYS CA C 13 55.655 . . . . . . A 31 LYS CA . 19489 1 267 . 1 1 31 31 LYS CB C 13 31.670 . . . . . . A 31 LYS CB . 19489 1 268 . 1 1 31 31 LYS N N 15 119.719 . . . . . . A 31 LYS N . 19489 1 269 . 1 1 32 32 LEU H H 1 8.147 . . . . . . A 32 LEU H . 19489 1 270 . 1 1 32 32 LEU HA H 1 4.414 . . . . . . A 32 LEU HA . 19489 1 271 . 1 1 32 32 LEU HB2 H 1 1.933 . . . . . . A 32 LEU HB2 . 19489 1 272 . 1 1 32 32 LEU HG H 1 1.766 . . . . . . A 32 LEU HG . 19489 1 273 . 1 1 32 32 LEU HD11 H 1 1.674 . . . . . . A 32 LEU HD11 . 19489 1 274 . 1 1 32 32 LEU HD12 H 1 1.674 . . . . . . A 32 LEU HD12 . 19489 1 275 . 1 1 32 32 LEU HD13 H 1 1.674 . . . . . . A 32 LEU HD13 . 19489 1 276 . 1 1 32 32 LEU CA C 13 54.505 . . . . . . A 32 LEU CA . 19489 1 277 . 1 1 32 32 LEU CB C 13 42.180 . . . . . . A 32 LEU CB . 19489 1 278 . 1 1 32 32 LEU N N 15 121.093 . . . . . . A 32 LEU N . 19489 1 279 . 1 1 33 33 GLY H H 1 8.313 . . . . . . A 33 GLY H . 19489 1 280 . 1 1 33 33 GLY HA2 H 1 4.013 . . . . . . A 33 GLY HA2 . 19489 1 281 . 1 1 33 33 GLY CA C 13 44.550 . . . . . . A 33 GLY CA . 19489 1 282 . 1 1 33 33 GLY N N 15 107.946 . . . . . . A 33 GLY N . 19489 1 283 . 1 1 34 34 ASN H H 1 8.354 . . . . . . A 34 ASN H . 19489 1 284 . 1 1 34 34 ASN HA H 1 5.051 . . . . . . A 34 ASN HA . 19489 1 285 . 1 1 34 34 ASN HB2 H 1 2.963 . . . . . . A 34 ASN HB2 . 19489 1 286 . 1 1 34 34 ASN HB3 H 1 2.807 . . . . . . A 34 ASN HB3 . 19489 1 287 . 1 1 34 34 ASN HD21 H 1 7.012 . . . . . . A 34 ASN HD21 . 19489 1 288 . 1 1 34 34 ASN HD22 H 1 7.813 . . . . . . A 34 ASN HD22 . 19489 1 289 . 1 1 34 34 ASN CA C 13 50.780 . . . . . . A 34 ASN CA . 19489 1 290 . 1 1 34 34 ASN CB C 13 38.530 . . . . . . A 34 ASN CB . 19489 1 291 . 1 1 34 34 ASN N N 15 119.031 . . . . . . A 34 ASN N . 19489 1 292 . 1 1 34 34 ASN ND2 N 15 113.871 . . . . . . A 34 ASN ND2 . 19489 1 293 . 1 1 35 35 PRO HA H 1 4.546 . . . . . . A 35 PRO HA . 19489 1 294 . 1 1 35 35 PRO HB2 H 1 2.386 . . . . . . A 35 PRO HB2 . 19489 1 295 . 1 1 35 35 PRO HB3 H 1 2.099 . . . . . . A 35 PRO HB3 . 19489 1 296 . 1 1 35 35 PRO HG2 H 1 1.306 . . . . . . A 35 PRO HG2 . 19489 1 297 . 1 1 35 35 PRO HD2 H 1 3.958 . . . . . . A 35 PRO HD2 . 19489 1 298 . 1 1 35 35 PRO HD3 H 1 3.862 . . . . . . A 35 PRO HD3 . 19489 1 299 . 1 1 35 35 PRO CA C 13 63.530 . . . . . . A 35 PRO CA . 19489 1 300 . 1 1 35 35 PRO CB C 13 31.417 . . . . . . A 35 PRO CB . 19489 1 301 . 1 1 36 36 THR H H 1 8.135 . . . . . . A 36 THR H . 19489 1 302 . 1 1 36 36 THR HA H 1 4.362 . . . . . . A 36 THR HA . 19489 1 303 . 1 1 36 36 THR HG21 H 1 1.304 . . . . . . A 36 THR HG21 . 19489 1 304 . 1 1 36 36 THR HG22 H 1 1.304 . . . . . . A 36 THR HG22 . 19489 1 305 . 1 1 36 36 THR HG23 H 1 1.304 . . . . . . A 36 THR HG23 . 19489 1 306 . 1 1 36 36 THR CA C 13 62.010 . . . . . . A 36 THR CA . 19489 1 307 . 1 1 36 36 THR CB C 13 69.040 . . . . . . A 36 THR CB . 19489 1 308 . 1 1 36 36 THR N N 15 111.899 . . . . . . A 36 THR N . 19489 1 309 . 1 1 37 37 ASP H H 1 8.170 . . . . . . A 37 ASP H . 19489 1 310 . 1 1 37 37 ASP HA H 1 4.738 . . . . . . A 37 ASP HA . 19489 1 311 . 1 1 37 37 ASP HB2 H 1 2.903 . . . . . . A 37 ASP HB2 . 19489 1 312 . 1 1 37 37 ASP HB3 H 1 2.845 . . . . . . A 37 ASP HB3 . 19489 1 313 . 1 1 37 37 ASP CA C 13 53.530 . . . . . . A 37 ASP CA . 19489 1 314 . 1 1 37 37 ASP CB C 13 39.380 . . . . . . A 37 ASP CB . 19489 1 315 . 1 1 37 37 ASP N N 15 121.265 . . . . . . A 37 ASP N . 19489 1 316 . 1 1 38 38 ARG H H 1 8.190 . . . . . . A 38 ARG H . 19489 1 317 . 1 1 38 38 ARG HA H 1 4.350 . . . . . . A 38 ARG HA . 19489 1 318 . 1 1 38 38 ARG HB2 H 1 1.965 . . . . . . A 38 ARG HB2 . 19489 1 319 . 1 1 38 38 ARG HG2 H 1 1.869 . . . . . . A 38 ARG HG2 . 19489 1 320 . 1 1 38 38 ARG HD2 H 1 1.730 . . . . . . A 38 ARG HD2 . 19489 1 321 . 1 1 38 38 ARG CA C 13 55.994 . . . . . . A 38 ARG CA . 19489 1 322 . 1 1 38 38 ARG CB C 13 30.060 . . . . . . A 38 ARG CB . 19489 1 323 . 1 1 38 38 ARG N N 15 120.320 . . . . . . A 38 ARG N . 19489 1 324 . 1 1 39 39 ASN H H 1 8.417 . . . . . . A 39 ASN H . 19489 1 325 . 1 1 39 39 ASN HA H 1 4.785 . . . . . . A 39 ASN HA . 19489 1 326 . 1 1 39 39 ASN HB2 H 1 2.922 . . . . . . A 39 ASN HB2 . 19489 1 327 . 1 1 39 39 ASN HB3 H 1 2.864 . . . . . . A 39 ASN HB3 . 19489 1 328 . 1 1 39 39 ASN CA C 13 53.114 . . . . . . A 39 ASN CA . 19489 1 329 . 1 1 39 39 ASN CB C 13 38.370 . . . . . . A 39 ASN CB . 19489 1 330 . 1 1 39 39 ASN N N 15 118.859 . . . . . . A 39 ASN N . 19489 1 331 . 1 1 40 40 VAL H H 1 8.037 . . . . . . A 40 VAL H . 19489 1 332 . 1 1 40 40 VAL HA H 1 4.177 . . . . . . A 40 VAL HA . 19489 1 333 . 1 1 40 40 VAL HB H 1 2.183 . . . . . . A 40 VAL HB . 19489 1 334 . 1 1 40 40 VAL HG21 H 1 1.009 . . . . . . A 40 VAL HG21 . 19489 1 335 . 1 1 40 40 VAL HG22 H 1 1.009 . . . . . . A 40 VAL HG22 . 19489 1 336 . 1 1 40 40 VAL HG23 H 1 1.009 . . . . . . A 40 VAL HG23 . 19489 1 337 . 1 1 40 40 VAL CA C 13 62.433 . . . . . . A 40 VAL CA . 19489 1 338 . 1 1 40 40 VAL CB C 13 32.100 . . . . . . A 40 VAL CB . 19489 1 339 . 1 1 40 40 VAL N N 15 119.416 . . . . . . A 40 VAL N . 19489 1 340 . 1 1 41 41 CYS H H 1 8.275 . . . . . . A 41 CYS H . 19489 1 341 . 1 1 41 41 CYS HA H 1 4.500 . . . . . . A 41 CYS HA . 19489 1 342 . 1 1 41 41 CYS HB2 H 1 2.945 . . . . . . A 41 CYS HB2 . 19489 1 343 . 1 1 41 41 CYS CA C 13 58.621 . . . . . . A 41 CYS CA . 19489 1 344 . 1 1 41 41 CYS CB C 13 27.181 . . . . . . A 41 CYS CB . 19489 1 345 . 1 1 41 41 CYS N N 15 121.046 . . . . . . A 41 CYS N . 19489 1 346 . 1 1 42 42 PHE H H 1 8.255 . . . . . . A 42 PHE H . 19489 1 347 . 1 1 42 42 PHE HA H 1 4.716 . . . . . . A 42 PHE HA . 19489 1 348 . 1 1 42 42 PHE HB2 H 1 3.257 . . . . . . A 42 PHE HB2 . 19489 1 349 . 1 1 42 42 PHE HB3 H 1 3.127 . . . . . . A 42 PHE HB3 . 19489 1 350 . 1 1 42 42 PHE CA C 13 57.689 . . . . . . A 42 PHE CA . 19489 1 351 . 1 1 42 42 PHE CB C 13 39.134 . . . . . . A 42 PHE CB . 19489 1 352 . 1 1 42 42 PHE N N 15 121.523 . . . . . . A 42 PHE N . 19489 1 353 . 1 1 43 43 LYS H H 1 8.177 . . . . . . A 43 LYS H . 19489 1 354 . 1 1 43 43 LYS HA H 1 4.424 . . . . . . A 43 LYS HA . 19489 1 355 . 1 1 43 43 LYS HB2 H 1 1.850 . . . . . . A 43 LYS HB2 . 19489 1 356 . 1 1 43 43 LYS HB3 H 1 1.754 . . . . . . A 43 LYS HB3 . 19489 1 357 . 1 1 43 43 LYS HG2 H 1 1.479 . . . . . . A 43 LYS HG2 . 19489 1 358 . 1 1 43 43 LYS HD2 H 1 1.780 . . . . . . A 43 LYS HD2 . 19489 1 359 . 1 1 43 43 LYS CA C 13 55.994 . . . . . . A 43 LYS CA . 19489 1 360 . 1 1 43 43 LYS CB C 13 32.779 . . . . . . A 43 LYS CB . 19489 1 361 . 1 1 43 43 LYS N N 15 121.953 . . . . . . A 43 LYS N . 19489 1 362 . 1 1 44 44 VAL H H 1 8.118 . . . . . . A 44 VAL H . 19489 1 363 . 1 1 44 44 VAL HA H 1 4.177 . . . . . . A 44 VAL HA . 19489 1 364 . 1 1 44 44 VAL HB H 1 2.175 . . . . . . A 44 VAL HB . 19489 1 365 . 1 1 44 44 VAL HG21 H 1 1.046 . . . . . . A 44 VAL HG21 . 19489 1 366 . 1 1 44 44 VAL HG22 H 1 1.046 . . . . . . A 44 VAL HG22 . 19489 1 367 . 1 1 44 44 VAL HG23 H 1 1.046 . . . . . . A 44 VAL HG23 . 19489 1 368 . 1 1 44 44 VAL CA C 13 62.264 . . . . . . A 44 VAL CA . 19489 1 369 . 1 1 44 44 VAL CB C 13 32.186 . . . . . . A 44 VAL CB . 19489 1 370 . 1 1 44 44 VAL N N 15 120.578 . . . . . . A 44 VAL N . 19489 1 371 . 1 1 45 45 LYS H H 1 8.404 . . . . . . A 45 LYS H . 19489 1 372 . 1 1 45 45 LYS HA H 1 4.476 . . . . . . A 45 LYS HA . 19489 1 373 . 1 1 45 45 LYS HB2 H 1 1.957 . . . . . . A 45 LYS HB2 . 19489 1 374 . 1 1 45 45 LYS HB3 H 1 1.872 . . . . . . A 45 LYS HB3 . 19489 1 375 . 1 1 45 45 LYS HG2 H 1 1.575 . . . . . . A 45 LYS HG2 . 19489 1 376 . 1 1 45 45 LYS HD2 H 1 1.501 . . . . . . A 45 LYS HD2 . 19489 1 377 . 1 1 45 45 LYS CA C 13 56.164 . . . . . . A 45 LYS CA . 19489 1 378 . 1 1 45 45 LYS CB C 13 32.520 . . . . . . A 45 LYS CB . 19489 1 379 . 1 1 45 45 LYS N N 15 124.187 . . . . . . A 45 LYS N . 19489 1 380 . 1 1 46 46 THR H H 1 8.135 . . . . . . A 46 THR H . 19489 1 381 . 1 1 46 46 THR HA H 1 4.491 . . . . . . A 46 THR HA . 19489 1 382 . 1 1 46 46 THR HB H 1 4.300 . . . . . . A 46 THR HB . 19489 1 383 . 1 1 46 46 THR HG21 H 1 1.265 . . . . . . A 46 THR HG21 . 19489 1 384 . 1 1 46 46 THR HG22 H 1 1.265 . . . . . . A 46 THR HG22 . 19489 1 385 . 1 1 46 46 THR HG23 H 1 1.265 . . . . . . A 46 THR HG23 . 19489 1 386 . 1 1 46 46 THR CA C 13 61.247 . . . . . . A 46 THR CA . 19489 1 387 . 1 1 46 46 THR CB C 13 69.381 . . . . . . A 46 THR CB . 19489 1 388 . 1 1 46 46 THR N N 15 114.649 . . . . . . A 46 THR N . 19489 1 389 . 1 1 47 47 THR H H 1 8.110 . . . . . . A 47 THR H . 19489 1 390 . 1 1 47 47 THR HA H 1 4.436 . . . . . . A 47 THR HA . 19489 1 391 . 1 1 47 47 THR HB H 1 4.300 . . . . . . A 47 THR HB . 19489 1 392 . 1 1 47 47 THR HG21 H 1 1.292 . . . . . . A 47 THR HG21 . 19489 1 393 . 1 1 47 47 THR HG22 H 1 1.292 . . . . . . A 47 THR HG22 . 19489 1 394 . 1 1 47 47 THR HG23 H 1 1.292 . . . . . . A 47 THR HG23 . 19489 1 395 . 1 1 47 47 THR CA C 13 61.240 . . . . . . A 47 THR CA . 19489 1 396 . 1 1 47 47 THR CB C 13 69.384 . . . . . . A 47 THR CB . 19489 1 397 . 1 1 47 47 THR N N 15 116.109 . . . . . . A 47 THR N . 19489 1 398 . 1 1 48 48 ALA H H 1 8.303 . . . . . . A 48 ALA H . 19489 1 399 . 1 1 48 48 ALA HA H 1 4.668 . . . . . . A 48 ALA HA . 19489 1 400 . 1 1 48 48 ALA HB1 H 1 1.469 . . . . . . A 48 ALA HB1 . 19489 1 401 . 1 1 48 48 ALA HB2 H 1 1.469 . . . . . . A 48 ALA HB2 . 19489 1 402 . 1 1 48 48 ALA HB3 H 1 1.469 . . . . . . A 48 ALA HB3 . 19489 1 403 . 1 1 48 48 ALA CA C 13 50.400 . . . . . . A 48 ALA CA . 19489 1 404 . 1 1 48 48 ALA CB C 13 17.610 . . . . . . A 48 ALA CB . 19489 1 405 . 1 1 48 48 ALA N N 15 127.109 . . . . . . A 48 ALA N . 19489 1 406 . 1 1 49 49 PRO HD2 H 1 3.884 . . . . . . A 49 PRO HD2 . 19489 1 407 . 1 1 49 49 PRO HD3 H 1 3.718 . . . . . . A 49 PRO HD3 . 19489 1 408 . 1 1 52 52 TYR HA H 1 4.678 . . . . . . A 52 TYR HA . 19489 1 409 . 1 1 52 52 TYR HB2 H 1 3.138 . . . . . . A 52 TYR HB2 . 19489 1 410 . 1 1 52 52 TYR HB3 H 1 2.982 . . . . . . A 52 TYR HB3 . 19489 1 411 . 1 1 52 52 TYR CA C 13 58.343 . . . . . . A 52 TYR CA . 19489 1 412 . 1 1 52 52 TYR CB C 13 38.710 . . . . . . A 52 TYR CB . 19489 1 413 . 1 1 53 53 CYS H H 1 8.229 . . . . . . A 53 CYS H . 19489 1 414 . 1 1 53 53 CYS HA H 1 4.641 . . . . . . A 53 CYS HA . 19489 1 415 . 1 1 53 53 CYS HB2 H 1 2.990 . . . . . . A 53 CYS HB2 . 19489 1 416 . 1 1 53 53 CYS CA C 13 57.858 . . . . . . A 53 CYS CA . 19489 1 417 . 1 1 53 53 CYS CB C 13 27.696 . . . . . . A 53 CYS CB . 19489 1 418 . 1 1 53 53 CYS N N 15 119.633 . . . . . . A 53 CYS N . 19489 1 419 . 1 1 54 54 VAL H H 1 8.225 . . . . . . A 54 VAL H . 19489 1 420 . 1 1 54 54 VAL HA H 1 4.231 . . . . . . A 54 VAL HA . 19489 1 421 . 1 1 54 54 VAL HB H 1 2.208 . . . . . . A 54 VAL HB . 19489 1 422 . 1 1 54 54 VAL HG21 H 1 1.033 . . . . . . A 54 VAL HG21 . 19489 1 423 . 1 1 54 54 VAL HG22 H 1 1.033 . . . . . . A 54 VAL HG22 . 19489 1 424 . 1 1 54 54 VAL HG23 H 1 1.033 . . . . . . A 54 VAL HG23 . 19489 1 425 . 1 1 54 54 VAL CA C 13 62.179 . . . . . . A 54 VAL CA . 19489 1 426 . 1 1 54 54 VAL CB C 13 32.186 . . . . . . A 54 VAL CB . 19489 1 427 . 1 1 54 54 VAL N N 15 121.265 . . . . . . A 54 VAL N . 19489 1 428 . 1 1 55 55 ARG H H 1 8.430 . . . . . . A 55 ARG H . 19489 1 429 . 1 1 55 55 ARG HA H 1 4.491 . . . . . . A 55 ARG HA . 19489 1 430 . 1 1 55 55 ARG HB2 H 1 1.985 . . . . . . A 55 ARG HB2 . 19489 1 431 . 1 1 55 55 ARG HB3 H 1 1.886 . . . . . . A 55 ARG HB3 . 19489 1 432 . 1 1 55 55 ARG HG2 H 1 1.733 . . . . . . A 55 ARG HG2 . 19489 1 433 . 1 1 55 55 ARG HE H 1 2.201 . . . . . . A 55 ARG HE . 19489 1 434 . 1 1 55 55 ARG CA C 13 55.486 . . . . . . A 55 ARG CA . 19489 1 435 . 1 1 55 55 ARG CB C 13 30.492 . . . . . . A 55 ARG CB . 19489 1 436 . 1 1 55 55 ARG N N 15 123.330 . . . . . . A 55 ARG N . 19489 1 437 . 1 1 56 56 SER H H 1 8.357 . . . . . . A 56 SER H . 19489 1 438 . 1 1 56 56 SER HA H 1 4.518 . . . . . . A 56 SER HA . 19489 1 439 . 1 1 56 56 SER HB2 H 1 3.999 . . . . . . A 56 SER HB2 . 19489 1 440 . 1 1 56 56 SER HB3 H 1 3.919 . . . . . . A 56 SER HB3 . 19489 1 441 . 1 1 56 56 SER CA C 13 57.943 . . . . . . A 56 SER CA . 19489 1 442 . 1 1 56 56 SER CB C 13 63.619 . . . . . . A 56 SER CB . 19489 1 443 . 1 1 56 56 SER N N 15 116.367 . . . . . . A 56 SER N . 19489 1 444 . 1 1 57 57 ASN H H 1 8.547 . . . . . . A 57 ASN H . 19489 1 445 . 1 1 57 57 ASN HA H 1 4.846 . . . . . . A 57 ASN HA . 19489 1 446 . 1 1 57 57 ASN HB2 H 1 2.963 . . . . . . A 57 ASN HB2 . 19489 1 447 . 1 1 57 57 ASN HB3 H 1 2.904 . . . . . . A 57 ASN HB3 . 19489 1 448 . 1 1 57 57 ASN HD21 H 1 6.950 . . . . . . A 57 ASN HD21 . 19489 1 449 . 1 1 57 57 ASN HD22 H 1 7.659 . . . . . . A 57 ASN HD22 . 19489 1 450 . 1 1 57 57 ASN CA C 13 52.760 . . . . . . A 57 ASN CA . 19489 1 451 . 1 1 57 57 ASN CB C 13 38.534 . . . . . . A 57 ASN CB . 19489 1 452 . 1 1 57 57 ASN N N 15 120.578 . . . . . . A 57 ASN N . 19489 1 453 . 1 1 57 57 ASN ND2 N 15 112.543 . . . . . . A 57 ASN ND2 . 19489 1 454 . 1 1 58 58 SER H H 1 8.326 . . . . . . A 58 SER H . 19489 1 455 . 1 1 58 58 SER HA H 1 4.505 . . . . . . A 58 SER HA . 19489 1 456 . 1 1 58 58 SER HB2 H 1 4.001 . . . . . . A 58 SER HB2 . 19489 1 457 . 1 1 58 58 SER HB3 H 1 3.978 . . . . . . A 58 SER HB3 . 19489 1 458 . 1 1 58 58 SER CA C 13 58.620 . . . . . . A 58 SER CA . 19489 1 459 . 1 1 58 58 SER CB C 13 63.365 . . . . . . A 58 SER CB . 19489 1 460 . 1 1 58 58 SER N N 15 115.508 . . . . . . A 58 SER N . 19489 1 461 . 1 1 59 59 GLY H H 1 8.469 . . . . . . A 59 GLY H . 19489 1 462 . 1 1 59 59 GLY HA2 H 1 4.095 . . . . . . A 59 GLY HA2 . 19489 1 463 . 1 1 59 59 GLY CA C 13 45.230 . . . . . . A 59 GLY CA . 19489 1 464 . 1 1 59 59 GLY N N 15 110.610 . . . . . . A 59 GLY N . 19489 1 465 . 1 1 60 60 ILE H H 1 8.198 . . . . . . A 60 ILE H . 19489 1 466 . 1 1 60 60 ILE HA H 1 4.186 . . . . . . A 60 ILE HA . 19489 1 467 . 1 1 60 60 ILE HB H 1 1.962 . . . . . . A 60 ILE HB . 19489 1 468 . 1 1 60 60 ILE HG12 H 1 1.607 . . . . . . A 60 ILE HG12 . 19489 1 469 . 1 1 60 60 ILE HG13 H 1 1.279 . . . . . . A 60 ILE HG13 . 19489 1 470 . 1 1 60 60 ILE HD11 H 1 0.992 . . . . . . A 60 ILE HD11 . 19489 1 471 . 1 1 60 60 ILE HD12 H 1 0.992 . . . . . . A 60 ILE HD12 . 19489 1 472 . 1 1 60 60 ILE HD13 H 1 0.992 . . . . . . A 60 ILE HD13 . 19489 1 473 . 1 1 60 60 ILE CA C 13 62.010 . . . . . . A 60 ILE CA . 19489 1 474 . 1 1 60 60 ILE CB C 13 38.200 . . . . . . A 60 ILE CB . 19489 1 475 . 1 1 60 60 ILE N N 15 120.062 . . . . . . A 60 ILE N . 19489 1 476 . 1 1 61 61 ILE H H 1 8.046 . . . . . . A 61 ILE H . 19489 1 477 . 1 1 61 61 ILE HA H 1 4.177 . . . . . . A 61 ILE HA . 19489 1 478 . 1 1 61 61 ILE HB H 1 1.990 . . . . . . A 61 ILE HB . 19489 1 479 . 1 1 61 61 ILE HG12 H 1 1.607 . . . . . . A 61 ILE HG12 . 19489 1 480 . 1 1 61 61 ILE HG13 H 1 1.292 . . . . . . A 61 ILE HG13 . 19489 1 481 . 1 1 61 61 ILE HG21 H 1 0.978 . . . . . . A 61 ILE HG21 . 19489 1 482 . 1 1 61 61 ILE HG22 H 1 0.978 . . . . . . A 61 ILE HG22 . 19489 1 483 . 1 1 61 61 ILE HG23 H 1 0.978 . . . . . . A 61 ILE HG23 . 19489 1 484 . 1 1 61 61 ILE CA C 13 61.162 . . . . . . A 61 ILE CA . 19489 1 485 . 1 1 61 61 ILE CB C 13 38.117 . . . . . . A 61 ILE CB . 19489 1 486 . 1 1 61 61 ILE N N 15 120.836 . . . . . . A 61 ILE N . 19489 1 487 . 1 1 62 62 ASP H H 1 8.351 . . . . . . A 62 ASP H . 19489 1 488 . 1 1 62 62 ASP HA H 1 4.709 . . . . . . A 62 ASP HA . 19489 1 489 . 1 1 62 62 ASP HB2 H 1 2.919 . . . . . . A 62 ASP HB2 . 19489 1 490 . 1 1 62 62 ASP HB3 H 1 2.810 . . . . . . A 62 ASP HB3 . 19489 1 491 . 1 1 62 62 ASP CA C 13 61.247 . . . . . . A 62 ASP CA . 19489 1 492 . 1 1 62 62 ASP CB C 13 39.049 . . . . . . A 62 ASP CB . 19489 1 493 . 1 1 62 62 ASP N N 15 121.867 . . . . . . A 62 ASP N . 19489 1 494 . 1 1 63 63 ALA H H 1 8.255 . . . . . . A 63 ALA H . 19489 1 495 . 1 1 63 63 ALA HA H 1 4.341 . . . . . . A 63 ALA HA . 19489 1 496 . 1 1 63 63 ALA HB1 H 1 1.511 . . . . . . A 63 ALA HB1 . 19489 1 497 . 1 1 63 63 ALA HB2 H 1 1.511 . . . . . . A 63 ALA HB2 . 19489 1 498 . 1 1 63 63 ALA HB3 H 1 1.511 . . . . . . A 63 ALA HB3 . 19489 1 499 . 1 1 63 63 ALA CA C 13 52.944 . . . . . . A 63 ALA CA . 19489 1 500 . 1 1 63 63 ALA CB C 13 18.460 . . . . . . A 63 ALA CB . 19489 1 501 . 1 1 63 63 ALA N N 15 123.757 . . . . . . A 63 ALA N . 19489 1 502 . 1 1 64 64 GLY H H 1 8.445 . . . . . . A 64 GLY H . 19489 1 503 . 1 1 64 64 GLY HA2 H 1 3.972 . . . . . . A 64 GLY HA2 . 19489 1 504 . 1 1 64 64 GLY CA C 13 45.400 . . . . . . A 64 GLY CA . 19489 1 505 . 1 1 64 64 GLY N N 15 128.656 . . . . . . A 64 GLY N . 19489 1 506 . 1 1 65 65 ALA H H 1 8.028 . . . . . . A 65 ALA H . 19489 1 507 . 1 1 65 65 ALA HA H 1 4.436 . . . . . . A 65 ALA HA . 19489 1 508 . 1 1 65 65 ALA HB1 H 1 1.525 . . . . . . A 65 ALA HB1 . 19489 1 509 . 1 1 65 65 ALA HB2 H 1 1.525 . . . . . . A 65 ALA HB2 . 19489 1 510 . 1 1 65 65 ALA HB3 H 1 1.525 . . . . . . A 65 ALA HB3 . 19489 1 511 . 1 1 65 65 ALA CA C 13 52.350 . . . . . . A 65 ALA CA . 19489 1 512 . 1 1 65 65 ALA CB C 13 18.880 . . . . . . A 65 ALA CB . 19489 1 513 . 1 1 65 65 ALA N N 15 122.297 . . . . . . A 65 ALA N . 19489 1 514 . 1 1 66 66 SER H H 1 8.182 . . . . . . A 66 SER H . 19489 1 515 . 1 1 66 66 SER HA H 1 4.573 . . . . . . A 66 SER HA . 19489 1 516 . 1 1 66 66 SER HB2 H 1 3.972 . . . . . . A 66 SER HB2 . 19489 1 517 . 1 1 66 66 SER CA C 13 58.234 . . . . . . A 66 SER CA . 19489 1 518 . 1 1 66 66 SER CB C 13 63.590 . . . . . . A 66 SER CB . 19489 1 519 . 1 1 66 66 SER N N 15 113.618 . . . . . . A 66 SER N . 19489 1 520 . 1 1 67 67 ILE H H 1 7.965 . . . . . . A 67 ILE H . 19489 1 521 . 1 1 67 67 ILE HA H 1 4.272 . . . . . . A 67 ILE HA . 19489 1 522 . 1 1 67 67 ILE HB H 1 1.976 . . . . . . A 67 ILE HB . 19489 1 523 . 1 1 67 67 ILE HG12 H 1 1.621 . . . . . . A 67 ILE HG12 . 19489 1 524 . 1 1 67 67 ILE HG13 H 1 1.279 . . . . . . A 67 ILE HG13 . 19489 1 525 . 1 1 67 67 ILE HD11 H 1 0.964 . . . . . . A 67 ILE HD11 . 19489 1 526 . 1 1 67 67 ILE HD12 H 1 0.964 . . . . . . A 67 ILE HD12 . 19489 1 527 . 1 1 67 67 ILE HD13 H 1 0.964 . . . . . . A 67 ILE HD13 . 19489 1 528 . 1 1 67 67 ILE CA C 13 60.560 . . . . . . A 67 ILE CA . 19489 1 529 . 1 1 67 67 ILE CB C 13 38.370 . . . . . . A 67 ILE CB . 19489 1 530 . 1 1 67 67 ILE N N 15 120.836 . . . . . . A 67 ILE N . 19489 1 531 . 1 1 68 68 ASN H H 1 8.361 . . . . . . A 68 ASN H . 19489 1 532 . 1 1 68 68 ASN HA H 1 4.942 . . . . . . A 68 ASN HA . 19489 1 533 . 1 1 68 68 ASN HB2 H 1 3.056 . . . . . . A 68 ASN HB2 . 19489 1 534 . 1 1 68 68 ASN HB3 H 1 2.864 . . . . . . A 68 ASN HB3 . 19489 1 535 . 1 1 68 68 ASN HD21 H 1 6.955 . . . . . . A 68 ASN HD21 . 19489 1 536 . 1 1 68 68 ASN HD22 H 1 7.703 . . . . . . A 68 ASN HD22 . 19489 1 537 . 1 1 68 68 ASN CA C 13 52.260 . . . . . . A 68 ASN CA . 19489 1 538 . 1 1 68 68 ASN CB C 13 38.200 . . . . . . A 68 ASN CB . 19489 1 539 . 1 1 68 68 ASN N N 15 122.812 . . . . . . A 68 ASN N . 19489 1 540 . 1 1 68 68 ASN ND2 N 15 112.336 . . . . . . A 68 ASN ND2 . 19489 1 541 . 1 1 69 69 VAL H H 1 8.522 . . . . . . A 69 VAL H . 19489 1 542 . 1 1 69 69 VAL HA H 1 4.013 . . . . . . A 69 VAL HA . 19489 1 543 . 1 1 69 69 VAL HB H 1 2.249 . . . . . . A 69 VAL HB . 19489 1 544 . 1 1 69 69 VAL HG21 H 1 1.087 . . . . . . A 69 VAL HG21 . 19489 1 545 . 1 1 69 69 VAL HG22 H 1 1.087 . . . . . . A 69 VAL HG22 . 19489 1 546 . 1 1 69 69 VAL HG23 H 1 1.087 . . . . . . A 69 VAL HG23 . 19489 1 547 . 1 1 69 69 VAL CA C 13 63.780 . . . . . . A 69 VAL CA . 19489 1 548 . 1 1 69 69 VAL CB C 13 31.586 . . . . . . A 69 VAL CB . 19489 1 549 . 1 1 69 69 VAL N N 15 120.922 . . . . . . A 69 VAL N . 19489 1 550 . 1 1 70 70 SER H H 1 8.426 . . . . . . A 70 SER H . 19489 1 551 . 1 1 70 70 SER HA H 1 4.300 . . . . . . A 70 SER HA . 19489 1 552 . 1 1 70 70 SER HB2 H 1 4.026 . . . . . . A 70 SER HB2 . 19489 1 553 . 1 1 70 70 SER N N 15 116.281 . . . . . . A 70 SER N . 19489 1 554 . 1 1 71 71 VAL H H 1 7.721 . . . . . . A 71 VAL H . 19489 1 555 . 1 1 71 71 VAL HA H 1 4.091 . . . . . . A 71 VAL HA . 19489 1 556 . 1 1 71 71 VAL HB H 1 2.223 . . . . . . A 71 VAL HB . 19489 1 557 . 1 1 71 71 VAL HG21 H 1 1.078 . . . . . . A 71 VAL HG21 . 19489 1 558 . 1 1 71 71 VAL HG22 H 1 1.078 . . . . . . A 71 VAL HG22 . 19489 1 559 . 1 1 71 71 VAL HG23 H 1 1.078 . . . . . . A 71 VAL HG23 . 19489 1 560 . 1 1 71 71 VAL N N 15 119.763 . . . . . . A 71 VAL N . 19489 1 561 . 1 1 74 74 GLN H H 1 8.172 . . . . . . A 74 GLN H . 19489 1 562 . 1 1 74 74 GLN HA H 1 4.723 . . . . . . A 74 GLN HA . 19489 1 563 . 1 1 74 74 GLN N N 15 121.437 . . . . . . A 74 GLN N . 19489 1 564 . 1 1 75 75 PRO HA H 1 4.395 . . . . . . A 75 PRO HA . 19489 1 565 . 1 1 75 75 PRO HB2 H 1 2.212 . . . . . . A 75 PRO HB2 . 19489 1 566 . 1 1 75 75 PRO HG2 H 1 3.612 . . . . . . A 75 PRO HG2 . 19489 1 567 . 1 1 75 75 PRO CA C 13 63.530 . . . . . . A 75 PRO CA . 19489 1 568 . 1 1 75 75 PRO CB C 13 31.593 . . . . . . A 75 PRO CB . 19489 1 569 . 1 1 76 76 PHE H H 1 7.845 . . . . . . A 76 PHE H . 19489 1 570 . 1 1 76 76 PHE HA H 1 4.655 . . . . . . A 76 PHE HA . 19489 1 571 . 1 1 76 76 PHE HB2 H 1 3.316 . . . . . . A 76 PHE HB2 . 19489 1 572 . 1 1 76 76 PHE HB3 H 1 3.069 . . . . . . A 76 PHE HB3 . 19489 1 573 . 1 1 76 76 PHE CA C 13 57.000 . . . . . . A 76 PHE CA . 19489 1 574 . 1 1 76 76 PHE CB C 13 38.788 . . . . . . A 76 PHE CB . 19489 1 575 . 1 1 76 76 PHE N N 15 115.508 . . . . . . A 76 PHE N . 19489 1 576 . 1 1 77 77 ASP H H 1 8.127 . . . . . . A 77 ASP H . 19489 1 577 . 1 1 77 77 ASP HA H 1 4.746 . . . . . . A 77 ASP HA . 19489 1 578 . 1 1 77 77 ASP HB2 H 1 2.941 . . . . . . A 77 ASP HB2 . 19489 1 579 . 1 1 77 77 ASP HB3 H 1 2.785 . . . . . . A 77 ASP HB3 . 19489 1 580 . 1 1 77 77 ASP CA C 13 52.690 . . . . . . A 77 ASP CA . 19489 1 581 . 1 1 77 77 ASP CB C 13 38.449 . . . . . . A 77 ASP CB . 19489 1 582 . 1 1 77 77 ASP N N 15 118.687 . . . . . . A 77 ASP N . 19489 1 583 . 1 1 78 78 TYR H H 1 7.882 . . . . . . A 78 TYR H . 19489 1 584 . 1 1 78 78 TYR HA H 1 4.600 . . . . . . A 78 TYR HA . 19489 1 585 . 1 1 78 78 TYR HB2 H 1 3.028 . . . . . . A 78 TYR HB2 . 19489 1 586 . 1 1 78 78 TYR CA C 13 57.260 . . . . . . A 78 TYR CA . 19489 1 587 . 1 1 78 78 TYR CB C 13 38.710 . . . . . . A 78 TYR CB . 19489 1 588 . 1 1 78 78 TYR N N 15 120.320 . . . . . . A 78 TYR N . 19489 1 589 . 1 1 79 79 ASP H H 1 8.211 . . . . . . A 79 ASP H . 19489 1 590 . 1 1 79 79 ASP HA H 1 4.956 . . . . . . A 79 ASP HA . 19489 1 591 . 1 1 79 79 ASP HB2 H 1 2.905 . . . . . . A 79 ASP HB2 . 19489 1 592 . 1 1 79 79 ASP HB3 H 1 2.646 . . . . . . A 79 ASP HB3 . 19489 1 593 . 1 1 79 79 ASP CA C 13 50.390 . . . . . . A 79 ASP CA . 19489 1 594 . 1 1 79 79 ASP CB C 13 40.250 . . . . . . A 79 ASP CB . 19489 1 595 . 1 1 79 79 ASP N N 15 122.898 . . . . . . A 79 ASP N . 19489 1 596 . 1 1 80 80 PRO HA H 1 4.397 . . . . . . A 80 PRO HA . 19489 1 597 . 1 1 80 80 PRO HB2 H 1 2.468 . . . . . . A 80 PRO HB2 . 19489 1 598 . 1 1 80 80 PRO HB3 H 1 2.386 . . . . . . A 80 PRO HB3 . 19489 1 599 . 1 1 80 80 PRO HG2 H 1 2.058 . . . . . . A 80 PRO HG2 . 19489 1 600 . 1 1 80 80 PRO HD2 H 1 3.876 . . . . . . A 80 PRO HD2 . 19489 1 601 . 1 1 80 80 PRO HD3 H 1 3.671 . . . . . . A 80 PRO HD3 . 19489 1 602 . 1 1 80 80 PRO CA C 13 63.443 . . . . . . A 80 PRO CA . 19489 1 603 . 1 1 80 80 PRO CB C 13 31.500 . . . . . . A 80 PRO CB . 19489 1 604 . 1 1 81 81 ASN H H 1 8.413 . . . . . . A 81 ASN H . 19489 1 605 . 1 1 81 81 ASN HA H 1 4.751 . . . . . . A 81 ASN HA . 19489 1 606 . 1 1 81 81 ASN HB2 H 1 2.933 . . . . . . A 81 ASN HB2 . 19489 1 607 . 1 1 81 81 ASN HB3 H 1 2.864 . . . . . . A 81 ASN HB3 . 19489 1 608 . 1 1 81 81 ASN HD21 H 1 7.011 . . . . . . A 81 ASN HD21 . 19489 1 609 . 1 1 81 81 ASN HD22 H 1 7.810 . . . . . . A 81 ASN HD22 . 19489 1 610 . 1 1 81 81 ASN CA C 13 53.198 . . . . . . A 81 ASN CA . 19489 1 611 . 1 1 81 81 ASN CB C 13 38.280 . . . . . . A 81 ASN CB . 19489 1 612 . 1 1 81 81 ASN N N 15 116.711 . . . . . . A 81 ASN N . 19489 1 613 . 1 1 81 81 ASN ND2 N 15 113.870 . . . . . . A 81 ASN ND2 . 19489 1 614 . 1 1 82 82 GLU H H 1 7.957 . . . . . . A 82 GLU H . 19489 1 615 . 1 1 82 82 GLU HA H 1 4.313 . . . . . . A 82 GLU HA . 19489 1 616 . 1 1 82 82 GLU HB2 H 1 2.468 . . . . . . A 82 GLU HB2 . 19489 1 617 . 1 1 82 82 GLU HG2 H 1 2.202 . . . . . . A 82 GLU HG2 . 19489 1 618 . 1 1 82 82 GLU HG3 H 1 2.104 . . . . . . A 82 GLU HG3 . 19489 1 619 . 1 1 82 82 GLU CA C 13 56.326 . . . . . . A 82 GLU CA . 19489 1 620 . 1 1 82 82 GLU CB C 13 28.450 . . . . . . A 82 GLU CB . 19489 1 621 . 1 1 82 82 GLU N N 15 120.234 . . . . . . A 82 GLU N . 19489 1 622 . 1 1 83 83 LYS H H 1 8.251 . . . . . . A 83 LYS H . 19489 1 623 . 1 1 83 83 LYS HA H 1 4.371 . . . . . . A 83 LYS HA . 19489 1 624 . 1 1 83 83 LYS HB2 H 1 1.862 . . . . . . A 83 LYS HB2 . 19489 1 625 . 1 1 83 83 LYS HB3 H 1 1.788 . . . . . . A 83 LYS HB3 . 19489 1 626 . 1 1 83 83 LYS HG2 H 1 1.701 . . . . . . A 83 LYS HG2 . 19489 1 627 . 1 1 83 83 LYS CA C 13 56.450 . . . . . . A 83 LYS CA . 19489 1 628 . 1 1 83 83 LYS CB C 13 32.010 . . . . . . A 83 LYS CB . 19489 1 629 . 1 1 83 83 LYS N N 15 120.836 . . . . . . A 83 LYS N . 19489 1 630 . 1 1 84 84 SER H H 1 8.143 . . . . . . A 84 SER H . 19489 1 631 . 1 1 84 84 SER HA H 1 4.477 . . . . . . A 84 SER HA . 19489 1 632 . 1 1 84 84 SER HB2 H 1 3.958 . . . . . . A 84 SER HB2 . 19489 1 633 . 1 1 84 84 SER CA C 13 58.256 . . . . . . A 84 SER CA . 19489 1 634 . 1 1 84 84 SER CB C 13 63.230 . . . . . . A 84 SER CB . 19489 1 635 . 1 1 84 84 SER N N 15 115.078 . . . . . . A 84 SER N . 19489 1 636 . 1 1 85 85 LYS H H 1 8.155 . . . . . . A 85 LYS H . 19489 1 637 . 1 1 85 85 LYS HA H 1 4.341 . . . . . . A 85 LYS HA . 19489 1 638 . 1 1 85 85 LYS HB2 H 1 1.853 . . . . . . A 85 LYS HB2 . 19489 1 639 . 1 1 85 85 LYS HB3 H 1 1.785 . . . . . . A 85 LYS HB3 . 19489 1 640 . 1 1 85 85 LYS HG2 H 1 1.511 . . . . . . A 85 LYS HG2 . 19489 1 641 . 1 1 85 85 LYS HG3 H 1 1.429 . . . . . . A 85 LYS HG3 . 19489 1 642 . 1 1 85 85 LYS CA C 13 56.164 . . . . . . A 85 LYS CA . 19489 1 643 . 1 1 85 85 LYS CB C 13 32.270 . . . . . . A 85 LYS CB . 19489 1 644 . 1 1 85 85 LYS N N 15 122.125 . . . . . . A 85 LYS N . 19489 1 645 . 1 1 86 86 HIS H H 1 8.341 . . . . . . A 86 HIS H . 19489 1 646 . 1 1 86 86 HIS HA H 1 4.737 . . . . . . A 86 HIS HA . 19489 1 647 . 1 1 86 86 HIS HB2 H 1 3.257 . . . . . . A 86 HIS HB2 . 19489 1 648 . 1 1 86 86 HIS HB3 H 1 3.196 . . . . . . A 86 HIS HB3 . 19489 1 649 . 1 1 86 86 HIS CA C 13 54.970 . . . . . . A 86 HIS CA . 19489 1 650 . 1 1 86 86 HIS CB C 13 28.530 . . . . . . A 86 HIS CB . 19489 1 651 . 1 1 86 86 HIS N N 15 118.172 . . . . . . A 86 HIS N . 19489 1 652 . 1 1 87 87 LYS H H 1 8.334 . . . . . . A 87 LYS H . 19489 1 653 . 1 1 87 87 LYS HA H 1 4.338 . . . . . . A 87 LYS HA . 19489 1 654 . 1 1 87 87 LYS HB2 H 1 1.812 . . . . . . A 87 LYS HB2 . 19489 1 655 . 1 1 87 87 LYS CA C 13 56.503 . . . . . . A 87 LYS CA . 19489 1 656 . 1 1 87 87 LYS CB C 13 32.690 . . . . . . A 87 LYS CB . 19489 1 657 . 1 1 87 87 LYS N N 15 122.125 . . . . . . A 87 LYS N . 19489 1 658 . 1 1 88 88 PHE H H 1 8.411 . . . . . . A 88 PHE H . 19489 1 659 . 1 1 88 88 PHE HA H 1 4.696 . . . . . . A 88 PHE HA . 19489 1 660 . 1 1 88 88 PHE HB2 H 1 3.236 . . . . . . A 88 PHE HB2 . 19489 1 661 . 1 1 88 88 PHE HB3 H 1 3.177 . . . . . . A 88 PHE HB3 . 19489 1 662 . 1 1 88 88 PHE CA C 13 57.682 . . . . . . A 88 PHE CA . 19489 1 663 . 1 1 88 88 PHE CB C 13 39.040 . . . . . . A 88 PHE CB . 19489 1 664 . 1 1 88 88 PHE N N 15 120.578 . . . . . . A 88 PHE N . 19489 1 665 . 1 1 89 89 MET H H 1 8.343 . . . . . . A 89 MET H . 19489 1 666 . 1 1 89 89 MET HA H 1 4.527 . . . . . . A 89 MET HA . 19489 1 667 . 1 1 89 89 MET HB2 H 1 2.140 . . . . . . A 89 MET HB2 . 19489 1 668 . 1 1 89 89 MET HG2 H 1 2.640 . . . . . . A 89 MET HG2 . 19489 1 669 . 1 1 89 89 MET HG3 H 1 2.564 . . . . . . A 89 MET HG3 . 19489 1 670 . 1 1 89 89 MET CA C 13 55.394 . . . . . . A 89 MET CA . 19489 1 671 . 1 1 89 89 MET CB C 13 32.600 . . . . . . A 89 MET CB . 19489 1 672 . 1 1 89 89 MET N N 15 121.867 . . . . . . A 89 MET N . 19489 1 673 . 1 1 90 90 VAL H H 1 8.245 . . . . . . A 90 VAL H . 19489 1 674 . 1 1 90 90 VAL HA H 1 4.026 . . . . . . A 90 VAL HA . 19489 1 675 . 1 1 90 90 VAL HB H 1 2.236 . . . . . . A 90 VAL HB . 19489 1 676 . 1 1 90 90 VAL HG21 H 1 1.087 . . . . . . A 90 VAL HG21 . 19489 1 677 . 1 1 90 90 VAL HG22 H 1 1.087 . . . . . . A 90 VAL HG22 . 19489 1 678 . 1 1 90 90 VAL HG23 H 1 1.087 . . . . . . A 90 VAL HG23 . 19489 1 679 . 1 1 90 90 VAL CA C 13 63.535 . . . . . . A 90 VAL CA . 19489 1 680 . 1 1 90 90 VAL CB C 13 31.840 . . . . . . A 90 VAL CB . 19489 1 681 . 1 1 90 90 VAL N N 15 120.148 . . . . . . A 90 VAL N . 19489 1 682 . 1 1 91 91 GLN H H 1 8.598 . . . . . . A 91 GLN H . 19489 1 683 . 1 1 91 91 GLN HA H 1 4.272 . . . . . . A 91 GLN HA . 19489 1 684 . 1 1 91 91 GLN HB2 H 1 2.240 . . . . . . A 91 GLN HB2 . 19489 1 685 . 1 1 91 91 GLN HB3 H 1 2.181 . . . . . . A 91 GLN HB3 . 19489 1 686 . 1 1 91 91 GLN HG2 H 1 2.492 . . . . . . A 91 GLN HG2 . 19489 1 687 . 1 1 91 91 GLN HE21 H 1 6.905 . . . . . . A 91 GLN HE21 . 19489 1 688 . 1 1 91 91 GLN HE22 H 1 7.636 . . . . . . A 91 GLN HE22 . 19489 1 689 . 1 1 91 91 GLN CA C 13 57.000 . . . . . . A 91 GLN CA . 19489 1 690 . 1 1 91 91 GLN CB C 13 28.450 . . . . . . A 91 GLN CB . 19489 1 691 . 1 1 91 91 GLN N N 15 120.234 . . . . . . A 91 GLN N . 19489 1 692 . 1 1 91 91 GLN NE2 N 15 111.559 . . . . . . A 91 GLN NE2 . 19489 1 693 . 1 1 92 92 SER H H 1 8.051 . . . . . . A 92 SER H . 19489 1 694 . 1 1 92 92 SER HA H 1 4.465 . . . . . . A 92 SER HA . 19489 1 695 . 1 1 92 92 SER HB2 H 1 3.997 . . . . . . A 92 SER HB2 . 19489 1 696 . 1 1 92 92 SER HB3 H 1 3.939 . . . . . . A 92 SER HB3 . 19489 1 697 . 1 1 92 92 SER CA C 13 58.960 . . . . . . A 92 SER CA . 19489 1 698 . 1 1 92 92 SER CB C 13 63.196 . . . . . . A 92 SER CB . 19489 1 699 . 1 1 92 92 SER N N 15 114.305 . . . . . . A 92 SER N . 19489 1 700 . 1 1 93 93 MET H H 1 8.031 . . . . . . A 93 MET H . 19489 1 701 . 1 1 93 93 MET HA H 1 4.341 . . . . . . A 93 MET HA . 19489 1 702 . 1 1 93 93 MET HB2 H 1 1.976 . . . . . . A 93 MET HB2 . 19489 1 703 . 1 1 93 93 MET HB3 H 1 1.880 . . . . . . A 93 MET HB3 . 19489 1 704 . 1 1 93 93 MET HG2 H 1 2.441 . . . . . . A 93 MET HG2 . 19489 1 705 . 1 1 93 93 MET CA C 13 56.157 . . . . . . A 93 MET CA . 19489 1 706 . 1 1 93 93 MET CB C 13 32.680 . . . . . . A 93 MET CB . 19489 1 707 . 1 1 93 93 MET N N 15 120.148 . . . . . . A 93 MET N . 19489 1 708 . 1 1 94 94 PHE H H 1 7.758 . . . . . . A 94 PHE H . 19489 1 709 . 1 1 94 94 PHE HA H 1 4.778 . . . . . . A 94 PHE HA . 19489 1 710 . 1 1 94 94 PHE HB2 H 1 3.316 . . . . . . A 94 PHE HB2 . 19489 1 711 . 1 1 94 94 PHE HB3 H 1 2.998 . . . . . . A 94 PHE HB3 . 19489 1 712 . 1 1 94 94 PHE HE1 H 1 7.374 . . . . . . A 94 PHE HE1 . 19489 1 713 . 1 1 94 94 PHE CA C 13 56.418 . . . . . . A 94 PHE CA . 19489 1 714 . 1 1 94 94 PHE CB C 13 39.550 . . . . . . A 94 PHE CB . 19489 1 715 . 1 1 94 94 PHE N N 15 116.281 . . . . . . A 94 PHE N . 19489 1 716 . 1 1 95 95 ALA H H 1 8.110 . . . . . . A 95 ALA H . 19489 1 717 . 1 1 95 95 ALA HA H 1 4.715 . . . . . . A 95 ALA HA . 19489 1 718 . 1 1 95 95 ALA HB1 H 1 1.493 . . . . . . A 95 ALA HB1 . 19489 1 719 . 1 1 95 95 ALA HB2 H 1 1.493 . . . . . . A 95 ALA HB2 . 19489 1 720 . 1 1 95 95 ALA HB3 H 1 1.493 . . . . . . A 95 ALA HB3 . 19489 1 721 . 1 1 95 95 ALA CA C 13 50.063 . . . . . . A 95 ALA CA . 19489 1 722 . 1 1 95 95 ALA CB C 13 18.030 . . . . . . A 95 ALA CB . 19489 1 723 . 1 1 95 95 ALA N N 15 124.703 . . . . . . A 95 ALA N . 19489 1 724 . 1 1 96 96 PRO HA H 1 4.600 . . . . . . A 96 PRO HA . 19489 1 725 . 1 1 96 96 PRO HB2 H 1 2.416 . . . . . . A 96 PRO HB2 . 19489 1 726 . 1 1 96 96 PRO HB3 H 1 2.178 . . . . . . A 96 PRO HB3 . 19489 1 727 . 1 1 96 96 PRO HG2 H 1 2.102 . . . . . . A 96 PRO HG2 . 19489 1 728 . 1 1 96 96 PRO HD2 H 1 3.782 . . . . . . A 96 PRO HD2 . 19489 1 729 . 1 1 96 96 PRO HD3 H 1 3.837 . . . . . . A 96 PRO HD3 . 19489 1 730 . 1 1 96 96 PRO CA C 13 63.443 . . . . . . A 96 PRO CA . 19489 1 731 . 1 1 96 96 PRO CB C 13 31.330 . . . . . . A 96 PRO CB . 19489 1 732 . 1 1 97 97 THR H H 1 8.033 . . . . . . A 97 THR H . 19489 1 733 . 1 1 97 97 THR HA H 1 4.385 . . . . . . A 97 THR HA . 19489 1 734 . 1 1 97 97 THR HG21 H 1 1.328 . . . . . . A 97 THR HG21 . 19489 1 735 . 1 1 97 97 THR HG22 H 1 1.328 . . . . . . A 97 THR HG22 . 19489 1 736 . 1 1 97 97 THR HG23 H 1 1.328 . . . . . . A 97 THR HG23 . 19489 1 737 . 1 1 97 97 THR CA C 13 62.010 . . . . . . A 97 THR CA . 19489 1 738 . 1 1 97 97 THR CB C 13 68.957 . . . . . . A 97 THR CB . 19489 1 739 . 1 1 97 97 THR N N 15 111.126 . . . . . . A 97 THR N . 19489 1 740 . 1 1 98 98 ASP H H 1 8.306 . . . . . . A 98 ASP H . 19489 1 741 . 1 1 98 98 ASP HA H 1 4.821 . . . . . . A 98 ASP HA . 19489 1 742 . 1 1 98 98 ASP HB2 H 1 2.980 . . . . . . A 98 ASP HB2 . 19489 1 743 . 1 1 98 98 ASP CA C 13 53.790 . . . . . . A 98 ASP CA . 19489 1 744 . 1 1 98 98 ASP CB C 13 38.710 . . . . . . A 98 ASP CB . 19489 1 745 . 1 1 98 98 ASP N N 15 120.836 . . . . . . A 98 ASP N . 19489 1 746 . 1 1 99 99 THR H H 1 8.224 . . . . . . A 99 THR H . 19489 1 747 . 1 1 99 99 THR HA H 1 4.259 . . . . . . A 99 THR HA . 19489 1 748 . 1 1 99 99 THR HG21 H 1 1.316 . . . . . . A 99 THR HG21 . 19489 1 749 . 1 1 99 99 THR HG22 H 1 1.316 . . . . . . A 99 THR HG22 . 19489 1 750 . 1 1 99 99 THR HG23 H 1 1.316 . . . . . . A 99 THR HG23 . 19489 1 751 . 1 1 99 99 THR CA C 13 63.450 . . . . . . A 99 THR CA . 19489 1 752 . 1 1 99 99 THR CB C 13 68.450 . . . . . . A 99 THR CB . 19489 1 753 . 1 1 99 99 THR N N 15 113.703 . . . . . . A 99 THR N . 19489 1 754 . 1 1 100 100 SER H H 1 8.345 . . . . . . A 100 SER H . 19489 1 755 . 1 1 100 100 SER HA H 1 4.444 . . . . . . A 100 SER HA . 19489 1 756 . 1 1 100 100 SER HB2 H 1 4.075 . . . . . . A 100 SER HB2 . 19489 1 757 . 1 1 100 100 SER HB3 H 1 4.032 . . . . . . A 100 SER HB3 . 19489 1 758 . 1 1 100 100 SER CA C 13 59.960 . . . . . . A 100 SER CA . 19489 1 759 . 1 1 100 100 SER CB C 13 62.680 . . . . . . A 100 SER CB . 19489 1 760 . 1 1 100 100 SER N N 15 117.828 . . . . . . A 100 SER N . 19489 1 761 . 1 1 101 101 ASP H H 1 8.395 . . . . . . A 101 ASP H . 19489 1 762 . 1 1 101 101 ASP HA H 1 4.715 . . . . . . A 101 ASP HA . 19489 1 763 . 1 1 101 101 ASP HB2 H 1 3.001 . . . . . . A 101 ASP HB2 . 19489 1 764 . 1 1 101 101 ASP HB3 H 1 2.878 . . . . . . A 101 ASP HB3 . 19489 1 765 . 1 1 101 101 ASP CA C 13 54.880 . . . . . . A 101 ASP CA . 19489 1 766 . 1 1 101 101 ASP CB C 13 38.195 . . . . . . A 101 ASP CB . 19489 1 767 . 1 1 101 101 ASP N N 15 121.609 . . . . . . A 101 ASP N . 19489 1 768 . 1 1 102 102 MET H H 1 8.248 . . . . . . A 102 MET H . 19489 1 769 . 1 1 102 102 MET HA H 1 4.313 . . . . . . A 102 MET HA . 19489 1 770 . 1 1 102 102 MET HB2 H 1 2.245 . . . . . . A 102 MET HB2 . 19489 1 771 . 1 1 102 102 MET HG2 H 1 2.739 . . . . . . A 102 MET HG2 . 19489 1 772 . 1 1 102 102 MET HG3 H 1 2.610 . . . . . . A 102 MET HG3 . 19489 1 773 . 1 1 102 102 MET HE1 H 1 2.140 . . . . . . A 102 MET HE1 . 19489 1 774 . 1 1 102 102 MET HE2 H 1 2.140 . . . . . . A 102 MET HE2 . 19489 1 775 . 1 1 102 102 MET HE3 H 1 2.140 . . . . . . A 102 MET HE3 . 19489 1 776 . 1 1 102 102 MET CA C 13 57.680 . . . . . . A 102 MET CA . 19489 1 777 . 1 1 102 102 MET CB C 13 32.020 . . . . . . A 102 MET CB . 19489 1 778 . 1 1 102 102 MET N N 15 118.859 . . . . . . A 102 MET N . 19489 1 779 . 1 1 103 103 GLU H H 1 8.282 . . . . . . A 103 GLU H . 19489 1 780 . 1 1 103 103 GLU HA H 1 4.150 . . . . . . A 103 GLU HA . 19489 1 781 . 1 1 103 103 GLU HB2 H 1 2.261 . . . . . . A 103 GLU HB2 . 19489 1 782 . 1 1 103 103 GLU CA C 13 58.359 . . . . . . A 103 GLU CA . 19489 1 783 . 1 1 103 103 GLU CB C 13 27.519 . . . . . . A 103 GLU CB . 19489 1 784 . 1 1 103 103 GLU N N 15 118.086 . . . . . . A 103 GLU N . 19489 1 785 . 1 1 104 104 ALA H H 1 7.903 . . . . . . A 104 ALA H . 19489 1 786 . 1 1 104 104 ALA HA H 1 4.231 . . . . . . A 104 ALA HA . 19489 1 787 . 1 1 104 104 ALA HB1 H 1 1.593 . . . . . . A 104 ALA HB1 . 19489 1 788 . 1 1 104 104 ALA HB2 H 1 1.593 . . . . . . A 104 ALA HB2 . 19489 1 789 . 1 1 104 104 ALA HB3 H 1 1.593 . . . . . . A 104 ALA HB3 . 19489 1 790 . 1 1 104 104 ALA CA C 13 54.215 . . . . . . A 104 ALA CA . 19489 1 791 . 1 1 104 104 ALA CB C 13 17.868 . . . . . . A 104 ALA CB . 19489 1 792 . 1 1 104 104 ALA N N 15 121.093 . . . . . . A 104 ALA N . 19489 1 793 . 1 1 105 105 VAL H H 1 7.760 . . . . . . A 105 VAL H . 19489 1 794 . 1 1 105 105 VAL HA H 1 3.880 . . . . . . A 105 VAL HA . 19489 1 795 . 1 1 105 105 VAL HB H 1 2.292 . . . . . . A 105 VAL HB . 19489 1 796 . 1 1 105 105 VAL HG11 H 1 0.990 . . . . . . A 105 VAL HG11 . 19489 1 797 . 1 1 105 105 VAL HG12 H 1 0.990 . . . . . . A 105 VAL HG12 . 19489 1 798 . 1 1 105 105 VAL HG13 H 1 0.990 . . . . . . A 105 VAL HG13 . 19489 1 799 . 1 1 105 105 VAL HG21 H 1 1.146 . . . . . . A 105 VAL HG21 . 19489 1 800 . 1 1 105 105 VAL HG22 H 1 1.146 . . . . . . A 105 VAL HG22 . 19489 1 801 . 1 1 105 105 VAL HG23 H 1 1.146 . . . . . . A 105 VAL HG23 . 19489 1 802 . 1 1 105 105 VAL CA C 13 64.970 . . . . . . A 105 VAL CA . 19489 1 803 . 1 1 105 105 VAL CB C 13 31.085 . . . . . . A 105 VAL CB . 19489 1 804 . 1 1 105 105 VAL N N 15 116.969 . . . . . . A 105 VAL N . 19489 1 805 . 1 1 106 106 TRP H H 1 7.970 . . . . . . A 106 TRP H . 19489 1 806 . 1 1 106 106 TRP HA H 1 4.546 . . . . . . A 106 TRP HA . 19489 1 807 . 1 1 106 106 TRP HB2 H 1 3.507 . . . . . . A 106 TRP HB2 . 19489 1 808 . 1 1 106 106 TRP HB3 H 1 3.384 . . . . . . A 106 TRP HB3 . 19489 1 809 . 1 1 106 106 TRP CA C 13 58.960 . . . . . . A 106 TRP CA . 19489 1 810 . 1 1 106 106 TRP CB C 13 29.306 . . . . . . A 106 TRP CB . 19489 1 811 . 1 1 106 106 TRP N N 15 119.633 . . . . . . A 106 TRP N . 19489 1 812 . 1 1 107 107 LYS H H 1 7.954 . . . . . . A 107 LYS H . 19489 1 813 . 1 1 107 107 LYS HA H 1 4.044 . . . . . . A 107 LYS HA . 19489 1 814 . 1 1 107 107 LYS HB2 H 1 1.988 . . . . . . A 107 LYS HB2 . 19489 1 815 . 1 1 107 107 LYS HG2 H 1 1.674 . . . . . . A 107 LYS HG2 . 19489 1 816 . 1 1 107 107 LYS HD2 H 1 1.555 . . . . . . A 107 LYS HD2 . 19489 1 817 . 1 1 107 107 LYS CA C 13 58.020 . . . . . . A 107 LYS CA . 19489 1 818 . 1 1 107 107 LYS CB C 13 32.179 . . . . . . A 107 LYS CB . 19489 1 819 . 1 1 107 107 LYS N N 15 115.938 . . . . . . A 107 LYS N . 19489 1 820 . 1 1 108 108 GLU H H 1 7.739 . . . . . . A 108 GLU H . 19489 1 821 . 1 1 108 108 GLU HA H 1 4.397 . . . . . . A 108 GLU HA . 19489 1 822 . 1 1 108 108 GLU HB2 H 1 2.257 . . . . . . A 108 GLU HB2 . 19489 1 823 . 1 1 108 108 GLU HB3 H 1 2.181 . . . . . . A 108 GLU HB3 . 19489 1 824 . 1 1 108 108 GLU HG2 H 1 2.591 . . . . . . A 108 GLU HG2 . 19489 1 825 . 1 1 108 108 GLU CA C 13 55.570 . . . . . . A 108 GLU CA . 19489 1 826 . 1 1 108 108 GLU CB C 13 28.459 . . . . . . A 108 GLU CB . 19489 1 827 . 1 1 108 108 GLU N N 15 116.195 . . . . . . A 108 GLU N . 19489 1 828 . 1 1 109 109 ALA H H 1 7.820 . . . . . . A 109 ALA H . 19489 1 829 . 1 1 109 109 ALA HA H 1 4.300 . . . . . . A 109 ALA HA . 19489 1 830 . 1 1 109 109 ALA HB1 H 1 1.402 . . . . . . A 109 ALA HB1 . 19489 1 831 . 1 1 109 109 ALA HB2 H 1 1.402 . . . . . . A 109 ALA HB2 . 19489 1 832 . 1 1 109 109 ALA HB3 H 1 1.402 . . . . . . A 109 ALA HB3 . 19489 1 833 . 1 1 109 109 ALA CA C 13 52.259 . . . . . . A 109 ALA CA . 19489 1 834 . 1 1 109 109 ALA CB C 13 18.751 . . . . . . A 109 ALA CB . 19489 1 835 . 1 1 109 109 ALA N N 15 122.554 . . . . . . A 109 ALA N . 19489 1 836 . 1 1 110 110 LYS H H 1 7.953 . . . . . . A 110 LYS H . 19489 1 837 . 1 1 110 110 LYS HA H 1 4.559 . . . . . . A 110 LYS HA . 19489 1 838 . 1 1 110 110 LYS HB2 H 1 1.839 . . . . . . A 110 LYS HB2 . 19489 1 839 . 1 1 110 110 LYS HG2 H 1 1.470 . . . . . . A 110 LYS HG2 . 19489 1 840 . 1 1 110 110 LYS HD2 H 1 1.716 . . . . . . A 110 LYS HD2 . 19489 1 841 . 1 1 110 110 LYS CA C 13 53.876 . . . . . . A 110 LYS CA . 19489 1 842 . 1 1 110 110 LYS CB C 13 31.678 . . . . . . A 110 LYS CB . 19489 1 843 . 1 1 110 110 LYS N N 15 118.430 . . . . . . A 110 LYS N . 19489 1 844 . 1 1 111 111 PRO HA H 1 4.292 . . . . . . A 111 PRO HA . 19489 1 845 . 1 1 111 111 PRO HB2 H 1 2.507 . . . . . . A 111 PRO HB2 . 19489 1 846 . 1 1 111 111 PRO HB3 H 1 2.258 . . . . . . A 111 PRO HB3 . 19489 1 847 . 1 1 111 111 PRO HD2 H 1 3.835 . . . . . . A 111 PRO HD2 . 19489 1 848 . 1 1 111 111 PRO HD3 H 1 3.746 . . . . . . A 111 PRO HD3 . 19489 1 849 . 1 1 111 111 PRO CA C 13 64.121 . . . . . . A 111 PRO CA . 19489 1 850 . 1 1 111 111 PRO CB C 13 31.332 . . . . . . A 111 PRO CB . 19489 1 851 . 1 1 112 112 GLU H H 1 8.883 . . . . . . A 112 GLU H . 19489 1 852 . 1 1 112 112 GLU HA H 1 4.177 . . . . . . A 112 GLU HA . 19489 1 853 . 1 1 112 112 GLU HB2 H 1 2.004 . . . . . . A 112 GLU HB2 . 19489 1 854 . 1 1 112 112 GLU HG2 H 1 2.157 . . . . . . A 112 GLU HG2 . 19489 1 855 . 1 1 112 112 GLU HG3 H 1 2.113 . . . . . . A 112 GLU HG3 . 19489 1 856 . 1 1 112 112 GLU CA C 13 57.597 . . . . . . A 112 GLU CA . 19489 1 857 . 1 1 112 112 GLU CB C 13 27.950 . . . . . . A 112 GLU CB . 19489 1 858 . 1 1 112 112 GLU N N 15 117.313 . . . . . . A 112 GLU N . 19489 1 859 . 1 1 113 113 ASP H H 1 8.136 . . . . . . A 113 ASP H . 19489 1 860 . 1 1 113 113 ASP HA H 1 4.668 . . . . . . A 113 ASP HA . 19489 1 861 . 1 1 113 113 ASP HB2 H 1 2.951 . . . . . . A 113 ASP HB2 . 19489 1 862 . 1 1 113 113 ASP CA C 13 53.950 . . . . . . A 113 ASP CA . 19489 1 863 . 1 1 113 113 ASP CB C 13 38.957 . . . . . . A 113 ASP CB . 19489 1 864 . 1 1 113 113 ASP N N 15 118.516 . . . . . . A 113 ASP N . 19489 1 865 . 1 1 114 114 LEU H H 1 8.006 . . . . . . A 114 LEU H . 19489 1 866 . 1 1 114 114 LEU HA H 1 4.288 . . . . . . A 114 LEU HA . 19489 1 867 . 1 1 114 114 LEU HB2 H 1 1.867 . . . . . . A 114 LEU HB2 . 19489 1 868 . 1 1 114 114 LEU HB3 H 1 1.792 . . . . . . A 114 LEU HB3 . 19489 1 869 . 1 1 114 114 LEU HG H 1 1.687 . . . . . . A 114 LEU HG . 19489 1 870 . 1 1 114 114 LEU HD21 H 1 0.971 . . . . . . A 114 LEU HD21 . 19489 1 871 . 1 1 114 114 LEU HD22 H 1 0.971 . . . . . . A 114 LEU HD22 . 19489 1 872 . 1 1 114 114 LEU HD23 H 1 0.971 . . . . . . A 114 LEU HD23 . 19489 1 873 . 1 1 114 114 LEU CA C 13 56.079 . . . . . . A 114 LEU CA . 19489 1 874 . 1 1 114 114 LEU CB C 13 41.591 . . . . . . A 114 LEU CB . 19489 1 875 . 1 1 114 114 LEU N N 15 119.719 . . . . . . A 114 LEU N . 19489 1 876 . 1 1 115 115 MET H H 1 8.063 . . . . . . A 115 MET H . 19489 1 877 . 1 1 115 115 MET HA H 1 4.385 . . . . . . A 115 MET HA . 19489 1 878 . 1 1 115 115 MET HB2 H 1 2.195 . . . . . . A 115 MET HB2 . 19489 1 879 . 1 1 115 115 MET HG2 H 1 2.728 . . . . . . A 115 MET HG2 . 19489 1 880 . 1 1 115 115 MET HG3 H 1 2.591 . . . . . . A 115 MET HG3 . 19489 1 881 . 1 1 115 115 MET CA C 13 56.410 . . . . . . A 115 MET CA . 19489 1 882 . 1 1 115 115 MET CB C 13 31.848 . . . . . . A 115 MET CB . 19489 1 883 . 1 1 115 115 MET N N 15 116.625 . . . . . . A 115 MET N . 19489 1 884 . 1 1 116 116 ASP H H 1 8.063 . . . . . . A 116 ASP H . 19489 1 885 . 1 1 116 116 ASP HA H 1 4.762 . . . . . . A 116 ASP HA . 19489 1 886 . 1 1 116 116 ASP HB2 H 1 2.974 . . . . . . A 116 ASP HB2 . 19489 1 887 . 1 1 116 116 ASP CA C 13 58.450 . . . . . . A 116 ASP CA . 19489 1 888 . 1 1 116 116 ASP CB C 13 38.880 . . . . . . A 116 ASP CB . 19489 1 889 . 1 1 116 116 ASP N N 15 118.258 . . . . . . A 116 ASP N . 19489 1 890 . 1 1 117 117 SER H H 1 8.225 . . . . . . A 117 SER H . 19489 1 891 . 1 1 117 117 SER HA H 1 4.218 . . . . . . A 117 SER HA . 19489 1 892 . 1 1 117 117 SER HB2 H 1 4.095 . . . . . . A 117 SER HB2 . 19489 1 893 . 1 1 117 117 SER CA C 13 63.110 . . . . . . A 117 SER CA . 19489 1 894 . 1 1 117 117 SER CB C 13 68.788 . . . . . . A 117 SER CB . 19489 1 895 . 1 1 117 117 SER N N 15 112.500 . . . . . . A 117 SER N . 19489 1 896 . 1 1 118 118 LYS H H 1 8.738 . . . . . . A 118 LYS H . 19489 1 897 . 1 1 118 118 LYS HA H 1 4.350 . . . . . . A 118 LYS HA . 19489 1 898 . 1 1 118 118 LYS HB2 H 1 2.044 . . . . . . A 118 LYS HB2 . 19489 1 899 . 1 1 118 118 LYS HB3 H 1 1.946 . . . . . . A 118 LYS HB3 . 19489 1 900 . 1 1 118 118 LYS HG2 H 1 1.830 . . . . . . A 118 LYS HG2 . 19489 1 901 . 1 1 118 118 LYS HD2 H 1 1.716 . . . . . . A 118 LYS HD2 . 19489 1 902 . 1 1 118 118 LYS CA C 13 58.197 . . . . . . A 118 LYS CA . 19489 1 903 . 1 1 118 118 LYS CB C 13 31.840 . . . . . . A 118 LYS CB . 19489 1 904 . 1 1 118 118 LYS N N 15 122.382 . . . . . . A 118 LYS N . 19489 1 905 . 1 1 119 119 LEU H H 1 8.223 . . . . . . A 119 LEU H . 19489 1 906 . 1 1 119 119 LEU HA H 1 4.186 . . . . . . A 119 LEU HA . 19489 1 907 . 1 1 119 119 LEU HB2 H 1 1.901 . . . . . . A 119 LEU HB2 . 19489 1 908 . 1 1 119 119 LEU HB3 H 1 1.848 . . . . . . A 119 LEU HB3 . 19489 1 909 . 1 1 119 119 LEU HG H 1 1.670 . . . . . . A 119 LEU HG . 19489 1 910 . 1 1 119 119 LEU HD11 H 1 1.045 . . . . . . A 119 LEU HD11 . 19489 1 911 . 1 1 119 119 LEU HD12 H 1 1.045 . . . . . . A 119 LEU HD12 . 19489 1 912 . 1 1 119 119 LEU HD13 H 1 1.045 . . . . . . A 119 LEU HD13 . 19489 1 913 . 1 1 119 119 LEU HD21 H 1 0.971 . . . . . . A 119 LEU HD21 . 19489 1 914 . 1 1 119 119 LEU HD22 H 1 0.971 . . . . . . A 119 LEU HD22 . 19489 1 915 . 1 1 119 119 LEU HD23 H 1 0.971 . . . . . . A 119 LEU HD23 . 19489 1 916 . 1 1 119 119 LEU CA C 13 56.834 . . . . . . A 119 LEU CA . 19489 1 917 . 1 1 119 119 LEU CB C 13 41.070 . . . . . . A 119 LEU CB . 19489 1 918 . 1 1 119 119 LEU N N 15 117.828 . . . . . . A 119 LEU N . 19489 1 919 . 1 1 120 120 ARG H H 1 8.099 . . . . . . A 120 ARG H . 19489 1 920 . 1 1 120 120 ARG HA H 1 4.091 . . . . . . A 120 ARG HA . 19489 1 921 . 1 1 120 120 ARG CA C 13 59.546 . . . . . . A 120 ARG CA . 19489 1 922 . 1 1 120 120 ARG CB C 13 29.120 . . . . . . A 120 ARG CB . 19489 1 923 . 1 1 120 120 ARG N N 15 119.031 . . . . . . A 120 ARG N . 19489 1 924 . 1 1 121 121 CYS H H 1 7.970 . . . . . . A 121 CYS H . 19489 1 925 . 1 1 121 121 CYS HA H 1 4.395 . . . . . . A 121 CYS HA . 19489 1 926 . 1 1 121 121 CYS HB2 H 1 3.206 . . . . . . A 121 CYS HB2 . 19489 1 927 . 1 1 121 121 CYS CA C 13 61.417 . . . . . . A 121 CYS CA . 19489 1 928 . 1 1 121 121 CYS CB C 13 26.250 . . . . . . A 121 CYS CB . 19489 1 929 . 1 1 121 121 CYS N N 15 116.539 . . . . . . A 121 CYS N . 19489 1 930 . 1 1 122 122 VAL H H 1 7.809 . . . . . . A 122 VAL H . 19489 1 931 . 1 1 122 122 VAL HA H 1 3.762 . . . . . . A 122 VAL HA . 19489 1 932 . 1 1 122 122 VAL HB H 1 2.318 . . . . . . A 122 VAL HB . 19489 1 933 . 1 1 122 122 VAL HG11 H 1 0.989 . . . . . . A 122 VAL HG11 . 19489 1 934 . 1 1 122 122 VAL HG12 H 1 0.989 . . . . . . A 122 VAL HG12 . 19489 1 935 . 1 1 122 122 VAL HG13 H 1 0.989 . . . . . . A 122 VAL HG13 . 19489 1 936 . 1 1 122 122 VAL HG21 H 1 1.147 . . . . . . A 122 VAL HG21 . 19489 1 937 . 1 1 122 122 VAL HG22 H 1 1.147 . . . . . . A 122 VAL HG22 . 19489 1 938 . 1 1 122 122 VAL HG23 H 1 1.147 . . . . . . A 122 VAL HG23 . 19489 1 939 . 1 1 122 122 VAL CA C 13 65.900 . . . . . . A 122 VAL CA . 19489 1 940 . 1 1 122 122 VAL CB C 13 30.910 . . . . . . A 122 VAL CB . 19489 1 941 . 1 1 122 122 VAL N N 15 119.891 . . . . . . A 122 VAL N . 19489 1 942 . 1 1 123 123 PHE H H 1 8.104 . . . . . . A 123 PHE H . 19489 1 943 . 1 1 123 123 PHE HA H 1 4.293 . . . . . . A 123 PHE HA . 19489 1 944 . 1 1 123 123 PHE HB2 H 1 3.369 . . . . . . A 123 PHE HB2 . 19489 1 945 . 1 1 123 123 PHE HB3 H 1 3.240 . . . . . . A 123 PHE HB3 . 19489 1 946 . 1 1 123 123 PHE CA C 13 60.993 . . . . . . A 123 PHE CA . 19489 1 947 . 1 1 123 123 PHE CB C 13 38.202 . . . . . . A 123 PHE CB . 19489 1 948 . 1 1 123 123 PHE N N 15 119.203 . . . . . . A 123 PHE N . 19489 1 949 . 1 1 124 124 GLU H H 1 8.394 . . . . . . A 124 GLU H . 19489 1 950 . 1 1 124 124 GLU HA H 1 4.054 . . . . . . A 124 GLU HA . 19489 1 951 . 1 1 124 124 GLU HB2 H 1 2.304 . . . . . . A 124 GLU HB2 . 19489 1 952 . 1 1 124 124 GLU HG2 H 1 2.195 . . . . . . A 124 GLU HG2 . 19489 1 953 . 1 1 124 124 GLU CA C 13 58.620 . . . . . . A 124 GLU CA . 19489 1 954 . 1 1 124 124 GLU CB C 13 27.950 . . . . . . A 124 GLU CB . 19489 1 955 . 1 1 124 124 GLU N N 15 117.570 . . . . . . A 124 GLU N . 19489 1 956 . 1 1 125 125 LEU H H 1 7.872 . . . . . . A 125 LEU H . 19489 1 957 . 1 1 125 125 LEU HA H 1 4.233 . . . . . . A 125 LEU HA . 19489 1 958 . 1 1 125 125 LEU HB2 H 1 2.072 . . . . . . A 125 LEU HB2 . 19489 1 959 . 1 1 125 125 LEU HG H 1 1.798 . . . . . . A 125 LEU HG . 19489 1 960 . 1 1 125 125 LEU HD11 H 1 1.046 . . . . . . A 125 LEU HD11 . 19489 1 961 . 1 1 125 125 LEU HD12 H 1 1.046 . . . . . . A 125 LEU HD12 . 19489 1 962 . 1 1 125 125 LEU HD13 H 1 1.046 . . . . . . A 125 LEU HD13 . 19489 1 963 . 1 1 125 125 LEU HD21 H 1 0.971 . . . . . . A 125 LEU HD21 . 19489 1 964 . 1 1 125 125 LEU HD22 H 1 0.971 . . . . . . A 125 LEU HD22 . 19489 1 965 . 1 1 125 125 LEU HD23 H 1 0.971 . . . . . . A 125 LEU HD23 . 19489 1 966 . 1 1 125 125 LEU CA C 13 57.604 . . . . . . A 125 LEU CA . 19489 1 967 . 1 1 125 125 LEU CB C 13 41.500 . . . . . . A 125 LEU CB . 19489 1 968 . 1 1 125 125 LEU N N 15 120.062 . . . . . . A 125 LEU N . 19489 1 stop_ save_