data_30155 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 30155 _Entry.Title ; NMR solution structure of the RRM1 domain of the post-transcriptional regulator HuR ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-08-15 _Entry.Accession_date 2016-08-15 _Entry.Last_release_date 2017-05-12 _Entry.Original_release_date 2017-05-12 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _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.ORCID _Entry_author.Entry_ID 1 C. Lixa C. . . . 30155 2 A. Mujo A. . . . 30155 3 K. Jendiroba K. A. . . 30155 4 F. Almeida F. C.L. . . 30155 5 L. Lima L. M.T.R. . . 30155 6 A. Pinheiro A. S. . . 30155 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'RNA BINDING PROTEIN' . 30155 'RNA-binding protein Post-trasncriptional regulation RNA recognition motif' . 30155 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 30155 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 412 30155 '15N chemical shifts' 106 30155 '1H chemical shifts' 666 30155 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2017-08-04 . original BMRB . 30155 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 5SZW 'BMRB Entry Tracking System' 30155 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 30155 _Citation.ID 1 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1007/s12104-014-9592-9 _Citation.PubMed_ID 25487676 _Citation.Full_citation . _Citation.Title ; (1)H, (15)N and (13)C resonance assignments of the RRM1 domain of the key post-transcriptional regulator HuR. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assign.' _Citation.Journal_name_full . _Citation.Journal_volume 9 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1874-270X _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 281 _Citation.Page_last 284 _Citation.Year 2015 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 A. Mujo A. . . . 30155 1 2 C. Lixa C. . . . 30155 1 3 L. Carneiro L. A. . . 30155 1 4 C. Anobom C. D. . . 30155 1 5 F. Almeida F. C. . . 30155 1 6 A. Pinheiro A. S. . . 30155 1 stop_ save_ save_citation_2 _Citation.Sf_category citations _Citation.Sf_framecode citation_2 _Citation.Entry_ID 30155 _Citation.ID 2 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Insights into HuR RRM1 domain self-association and mRNA recognition from solution NMR studies ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD 0353 _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 . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 C. Lixa C. . . . 30155 2 2 A. Mujo A. . . . 30155 2 3 K. Jendiroba K. A. . . 30155 2 4 F. Almeida F. C.L. . . 30155 2 5 L. Lima L. M.T.R. . . 30155 2 6 A. Pinheiro A. S. . . 30155 2 7 A. Mujo A. . . . 30155 2 8 C. Lixa C. . . . 30155 2 9 L. Carneiro L. A. . . 30155 2 10 C. Anobom C. D. . . 30155 2 11 F. Almeida F. C. . . 30155 2 12 A. Pinheiro A. S. . . 30155 2 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 30155 _Assembly.ID 1 _Assembly.Name 'ELAV-like protein 1' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity_1 1 $entity_1 A A yes . . . . . . 30155 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 30155 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _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 ; GHMSNGYEDHMAEDCRGDIG RTNLIVNYLPQNMTQDELRS LFSSIGEVESAKLIRDKVAG HSLGYGFVNYVTAKDAERAI NTLNGLRLQSKTIKVSYARP S ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 101 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment 'UNP residues 28-126' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 11220.585 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Hu-antigen R' na 30155 1 HuR na 30155 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 . GLY . 30155 1 2 . HIS . 30155 1 3 . MET . 30155 1 4 . SER . 30155 1 5 . ASN . 30155 1 6 . GLY . 30155 1 7 . TYR . 30155 1 8 . GLU . 30155 1 9 . ASP . 30155 1 10 . HIS . 30155 1 11 . MET . 30155 1 12 . ALA . 30155 1 13 . GLU . 30155 1 14 . ASP . 30155 1 15 . CYS . 30155 1 16 . ARG . 30155 1 17 . GLY . 30155 1 18 . ASP . 30155 1 19 . ILE . 30155 1 20 . GLY . 30155 1 21 . ARG . 30155 1 22 . THR . 30155 1 23 . ASN . 30155 1 24 . LEU . 30155 1 25 . ILE . 30155 1 26 . VAL . 30155 1 27 . ASN . 30155 1 28 . TYR . 30155 1 29 . LEU . 30155 1 30 . PRO . 30155 1 31 . GLN . 30155 1 32 . ASN . 30155 1 33 . MET . 30155 1 34 . THR . 30155 1 35 . GLN . 30155 1 36 . ASP . 30155 1 37 . GLU . 30155 1 38 . LEU . 30155 1 39 . ARG . 30155 1 40 . SER . 30155 1 41 . LEU . 30155 1 42 . PHE . 30155 1 43 . SER . 30155 1 44 . SER . 30155 1 45 . ILE . 30155 1 46 . GLY . 30155 1 47 . GLU . 30155 1 48 . VAL . 30155 1 49 . GLU . 30155 1 50 . SER . 30155 1 51 . ALA . 30155 1 52 . LYS . 30155 1 53 . LEU . 30155 1 54 . ILE . 30155 1 55 . ARG . 30155 1 56 . ASP . 30155 1 57 . LYS . 30155 1 58 . VAL . 30155 1 59 . ALA . 30155 1 60 . GLY . 30155 1 61 . HIS . 30155 1 62 . SER . 30155 1 63 . LEU . 30155 1 64 . GLY . 30155 1 65 . TYR . 30155 1 66 . GLY . 30155 1 67 . PHE . 30155 1 68 . VAL . 30155 1 69 . ASN . 30155 1 70 . TYR . 30155 1 71 . VAL . 30155 1 72 . THR . 30155 1 73 . ALA . 30155 1 74 . LYS . 30155 1 75 . ASP . 30155 1 76 . ALA . 30155 1 77 . GLU . 30155 1 78 . ARG . 30155 1 79 . ALA . 30155 1 80 . ILE . 30155 1 81 . ASN . 30155 1 82 . THR . 30155 1 83 . LEU . 30155 1 84 . ASN . 30155 1 85 . GLY . 30155 1 86 . LEU . 30155 1 87 . ARG . 30155 1 88 . LEU . 30155 1 89 . GLN . 30155 1 90 . SER . 30155 1 91 . LYS . 30155 1 92 . THR . 30155 1 93 . ILE . 30155 1 94 . LYS . 30155 1 95 . VAL . 30155 1 96 . SER . 30155 1 97 . TYR . 30155 1 98 . ALA . 30155 1 99 . ARG . 30155 1 100 . PRO . 30155 1 101 . SER . 30155 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 . GLY 1 1 30155 1 . HIS 2 2 30155 1 . MET 3 3 30155 1 . SER 4 4 30155 1 . ASN 5 5 30155 1 . GLY 6 6 30155 1 . TYR 7 7 30155 1 . GLU 8 8 30155 1 . ASP 9 9 30155 1 . HIS 10 10 30155 1 . MET 11 11 30155 1 . ALA 12 12 30155 1 . GLU 13 13 30155 1 . ASP 14 14 30155 1 . CYS 15 15 30155 1 . ARG 16 16 30155 1 . GLY 17 17 30155 1 . ASP 18 18 30155 1 . ILE 19 19 30155 1 . GLY 20 20 30155 1 . ARG 21 21 30155 1 . THR 22 22 30155 1 . ASN 23 23 30155 1 . LEU 24 24 30155 1 . ILE 25 25 30155 1 . VAL 26 26 30155 1 . ASN 27 27 30155 1 . TYR 28 28 30155 1 . LEU 29 29 30155 1 . PRO 30 30 30155 1 . GLN 31 31 30155 1 . ASN 32 32 30155 1 . MET 33 33 30155 1 . THR 34 34 30155 1 . GLN 35 35 30155 1 . ASP 36 36 30155 1 . GLU 37 37 30155 1 . LEU 38 38 30155 1 . ARG 39 39 30155 1 . SER 40 40 30155 1 . LEU 41 41 30155 1 . PHE 42 42 30155 1 . SER 43 43 30155 1 . SER 44 44 30155 1 . ILE 45 45 30155 1 . GLY 46 46 30155 1 . GLU 47 47 30155 1 . VAL 48 48 30155 1 . GLU 49 49 30155 1 . SER 50 50 30155 1 . ALA 51 51 30155 1 . LYS 52 52 30155 1 . LEU 53 53 30155 1 . ILE 54 54 30155 1 . ARG 55 55 30155 1 . ASP 56 56 30155 1 . LYS 57 57 30155 1 . VAL 58 58 30155 1 . ALA 59 59 30155 1 . GLY 60 60 30155 1 . HIS 61 61 30155 1 . SER 62 62 30155 1 . LEU 63 63 30155 1 . GLY 64 64 30155 1 . TYR 65 65 30155 1 . GLY 66 66 30155 1 . PHE 67 67 30155 1 . VAL 68 68 30155 1 . ASN 69 69 30155 1 . TYR 70 70 30155 1 . VAL 71 71 30155 1 . THR 72 72 30155 1 . ALA 73 73 30155 1 . LYS 74 74 30155 1 . ASP 75 75 30155 1 . ALA 76 76 30155 1 . GLU 77 77 30155 1 . ARG 78 78 30155 1 . ALA 79 79 30155 1 . ILE 80 80 30155 1 . ASN 81 81 30155 1 . THR 82 82 30155 1 . LEU 83 83 30155 1 . ASN 84 84 30155 1 . GLY 85 85 30155 1 . LEU 86 86 30155 1 . ARG 87 87 30155 1 . LEU 88 88 30155 1 . GLN 89 89 30155 1 . SER 90 90 30155 1 . LYS 91 91 30155 1 . THR 92 92 30155 1 . ILE 93 93 30155 1 . LYS 94 94 30155 1 . VAL 95 95 30155 1 . SER 96 96 30155 1 . TYR 97 97 30155 1 . ALA 98 98 30155 1 . ARG 99 99 30155 1 . PRO 100 100 30155 1 . SER 101 101 30155 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 30155 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . 'ELAVL1, HUR' . 30155 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 30155 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . 'Recombinant protein expressed in fusion with a Thio6His6 expression/purification tag, followed by a TEV protease cleavage site' 469008 Escherichia coli BL21(DE3) . . . . . RP1B . . . 30155 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 30155 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.5 mM [U-15N] HuR_RRM1, 30 mM sodium phosphate, 100 mM sodium chloride, 10 mM DTT, 90% H2O/10% D2O. ; _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 DTT 'natural abundance' . . . . . . 10 . . mM . . . . 30155 1 2 HuR_RRM1 [U-15N] . . 1 $entity_1 . . 1.5 . . mM . . . . 30155 1 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 30155 1 4 'sodium phosphate' 'natural abundance' . . . . . . 30 . . mM . . . . 30155 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 30155 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.5 mM [U-100% 13C; U-100% 15N] HuR_RRM1, 30 mM sodium phosphate, 100 mM sodium chloride, 10 mM DTT, 90% H2O/10% D2O. ; _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 DTT 'natural abundance' . . . . . . 10 . . mM . . . . 30155 2 2 HuR_RRM1 '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 1.5 . . mM . . . . 30155 2 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 30155 2 4 'sodium phosphate' 'natural abundance' . . . . . . 30 . . mM . . . . 30155 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 30155 _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 'ionic strength' 100 . mM 30155 1 pH 6.0 . pH 30155 1 pressure 1 . atm 30155 1 temperature 298 . K 30155 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 30155 _Software.ID 1 _Software.Name CARA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 30155 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 30155 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 30155 _Software.ID 2 _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' . . 30155 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 30155 2 'structure calculation' 30155 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 30155 _Software.ID 3 _Software.Name CcpNMR _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 30155 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 30155 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 30155 _Software.ID 4 _Software.Name TOPSPIN _Software.Version 3.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 30155 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 30155 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 30155 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 30155 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AvanceIII _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 30155 _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 NMR_spectrometer_1 Bruker DRX . 600 . . . 30155 1 2 NMR_spectrometer_2 Bruker AvanceIII . 800 . . . 30155 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 30155 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30155 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30155 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30155 1 4 '3D HNCACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30155 1 5 '3D CBCA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30155 1 6 '3D (H)CC(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30155 1 7 '3D HBHA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30155 1 8 '3D HN(CA)CO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30155 1 9 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30155 1 10 '3D HC(C)H-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30155 1 11 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30155 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 30155 _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0 na indirect 0.251449530 . . . . . 30155 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1.000000000 . . . . . 30155 1 N 15 DSS 'methyl protons' . . . . ppm 0 na indirect 0.101329118 . . . . . 30155 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 30155 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 30155 1 2 '2D 1H-13C HSQC aliphatic' . . . 30155 1 3 '2D 1H-13C HSQC aromatic' . . . 30155 1 4 '3D HNCACB' . . . 30155 1 5 '3D CBCA(CO)NH' . . . 30155 1 6 '3D (H)CC(CO)NH' . . . 30155 1 7 '3D HBHA(CO)NH' . . . 30155 1 8 '3D HN(CA)CO' . . . 30155 1 9 '3D HNCO' . . . 30155 1 10 '3D HC(C)H-TOCSY' . . . 30155 1 11 '3D 1H-13C NOESY aromatic' . . . 30155 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 2 2 HIS C C 13 174.613 0.000 . 1 . . . A 2 HIS C . 30155 1 2 . 1 1 3 3 MET H H 1 8.516 0.002 . 1 . . . A 3 MET H . 30155 1 3 . 1 1 3 3 MET HA H 1 4.427 0.004 . 1 . . . A 3 MET HA . 30155 1 4 . 1 1 3 3 MET HB2 H 1 1.910 0.000 . 2 . . . A 3 MET HB2 . 30155 1 5 . 1 1 3 3 MET HB3 H 1 1.980 0.000 . 2 . . . A 3 MET HB3 . 30155 1 6 . 1 1 3 3 MET HG2 H 1 2.462 0.006 . 2 . . . A 3 MET HG2 . 30155 1 7 . 1 1 3 3 MET HG3 H 1 2.387 0.000 . 2 . . . A 3 MET HG3 . 30155 1 8 . 1 1 3 3 MET C C 13 176.070 0.000 . 1 . . . A 3 MET C . 30155 1 9 . 1 1 3 3 MET CA C 13 55.439 0.000 . 1 . . . A 3 MET CA . 30155 1 10 . 1 1 3 3 MET CB C 13 32.783 0.001 . 1 . . . A 3 MET CB . 30155 1 11 . 1 1 3 3 MET CG C 13 32.065 0.063 . 1 . . . A 3 MET CG . 30155 1 12 . 1 1 3 3 MET N N 15 122.481 0.038 . 1 . . . A 3 MET N . 30155 1 13 . 1 1 4 4 SER H H 1 8.379 0.003 . 1 . . . A 4 SER H . 30155 1 14 . 1 1 4 4 SER HA H 1 4.386 0.002 . 1 . . . A 4 SER HA . 30155 1 15 . 1 1 4 4 SER HB2 H 1 3.769 0.000 . 1 . . . A 4 SER HB2 . 30155 1 16 . 1 1 4 4 SER HB3 H 1 3.769 0.000 . 1 . . . A 4 SER HB3 . 30155 1 17 . 1 1 4 4 SER C C 13 174.322 0.000 . 1 . . . A 4 SER C . 30155 1 18 . 1 1 4 4 SER CA C 13 58.378 0.000 . 1 . . . A 4 SER CA . 30155 1 19 . 1 1 4 4 SER CB C 13 63.744 0.000 . 1 . . . A 4 SER CB . 30155 1 20 . 1 1 4 4 SER N N 15 117.445 0.031 . 1 . . . A 4 SER N . 30155 1 21 . 1 1 5 5 ASN H H 1 8.505 0.012 . 1 . . . A 5 ASN H . 30155 1 22 . 1 1 5 5 ASN HA H 1 4.626 0.004 . 1 . . . A 5 ASN HA . 30155 1 23 . 1 1 5 5 ASN HB2 H 1 2.732 0.019 . 1 . . . A 5 ASN HB2 . 30155 1 24 . 1 1 5 5 ASN HB3 H 1 2.732 0.019 . 1 . . . A 5 ASN HB3 . 30155 1 25 . 1 1 5 5 ASN HD21 H 1 6.819 0.002 . 1 . . . A 5 ASN HD21 . 30155 1 26 . 1 1 5 5 ASN HD22 H 1 7.524 0.003 . 1 . . . A 5 ASN HD22 . 30155 1 27 . 1 1 5 5 ASN C C 13 175.502 0.000 . 1 . . . A 5 ASN C . 30155 1 28 . 1 1 5 5 ASN CA C 13 53.436 0.000 . 1 . . . A 5 ASN CA . 30155 1 29 . 1 1 5 5 ASN CB C 13 38.635 0.187 . 1 . . . A 5 ASN CB . 30155 1 30 . 1 1 5 5 ASN N N 15 120.765 0.045 . 1 . . . A 5 ASN N . 30155 1 31 . 1 1 5 5 ASN ND2 N 15 112.647 0.069 . 1 . . . A 5 ASN ND2 . 30155 1 32 . 1 1 6 6 GLY H H 1 8.323 0.012 . 1 . . . A 6 GLY H . 30155 1 33 . 1 1 6 6 GLY HA2 H 1 3.820 0.016 . 1 . . . A 6 GLY HA2 . 30155 1 34 . 1 1 6 6 GLY HA3 H 1 3.820 0.016 . 1 . . . A 6 GLY HA3 . 30155 1 35 . 1 1 6 6 GLY C C 13 173.927 0.000 . 1 . . . A 6 GLY C . 30155 1 36 . 1 1 6 6 GLY CA C 13 45.454 0.000 . 1 . . . A 6 GLY CA . 30155 1 37 . 1 1 6 6 GLY N N 15 108.808 0.051 . 1 . . . A 6 GLY N . 30155 1 38 . 1 1 7 7 TYR H H 1 7.949 0.009 . 1 . . . A 7 TYR H . 30155 1 39 . 1 1 7 7 TYR HA H 1 4.431 0.009 . 1 . . . A 7 TYR HA . 30155 1 40 . 1 1 7 7 TYR HB2 H 1 2.927 0.014 . 2 . . . A 7 TYR HB2 . 30155 1 41 . 1 1 7 7 TYR HB3 H 1 2.853 0.012 . 2 . . . A 7 TYR HB3 . 30155 1 42 . 1 1 7 7 TYR HD1 H 1 6.987 0.008 . 3 . . . A 7 TYR HD1 . 30155 1 43 . 1 1 7 7 TYR HD2 H 1 6.987 0.008 . 3 . . . A 7 TYR HD2 . 30155 1 44 . 1 1 7 7 TYR C C 13 175.829 0.000 . 1 . . . A 7 TYR C . 30155 1 45 . 1 1 7 7 TYR CA C 13 58.251 0.113 . 1 . . . A 7 TYR CA . 30155 1 46 . 1 1 7 7 TYR CB C 13 38.700 0.052 . 1 . . . A 7 TYR CB . 30155 1 47 . 1 1 7 7 TYR CD1 C 13 133.139 0.014 . 3 . . . A 7 TYR CD1 . 30155 1 48 . 1 1 7 7 TYR CD2 C 13 133.139 0.014 . 3 . . . A 7 TYR CD2 . 30155 1 49 . 1 1 7 7 TYR N N 15 120.011 0.030 . 1 . . . A 7 TYR N . 30155 1 50 . 1 1 8 8 GLU H H 1 8.294 0.012 . 1 . . . A 8 GLU H . 30155 1 51 . 1 1 8 8 GLU HA H 1 4.119 0.014 . 1 . . . A 8 GLU HA . 30155 1 52 . 1 1 8 8 GLU HB2 H 1 1.808 0.021 . 1 . . . A 8 GLU HB2 . 30155 1 53 . 1 1 8 8 GLU HB3 H 1 1.808 0.021 . 1 . . . A 8 GLU HB3 . 30155 1 54 . 1 1 8 8 GLU HG2 H 1 2.037 0.017 . 2 . . . A 8 GLU HG2 . 30155 1 55 . 1 1 8 8 GLU HG3 H 1 2.093 0.013 . 2 . . . A 8 GLU HG3 . 30155 1 56 . 1 1 8 8 GLU C C 13 175.803 0.000 . 1 . . . A 8 GLU C . 30155 1 57 . 1 1 8 8 GLU CA C 13 56.604 0.093 . 1 . . . A 8 GLU CA . 30155 1 58 . 1 1 8 8 GLU CB C 13 30.359 0.000 . 1 . . . A 8 GLU CB . 30155 1 59 . 1 1 8 8 GLU CG C 13 36.005 0.041 . 1 . . . A 8 GLU CG . 30155 1 60 . 1 1 8 8 GLU N N 15 122.147 0.033 . 1 . . . A 8 GLU N . 30155 1 61 . 1 1 9 9 ASP H H 1 8.152 0.017 . 1 . . . A 9 ASP H . 30155 1 62 . 1 1 9 9 ASP HA H 1 4.430 0.003 . 1 . . . A 9 ASP HA . 30155 1 63 . 1 1 9 9 ASP HB2 H 1 2.536 0.000 . 1 . . . A 9 ASP HB2 . 30155 1 64 . 1 1 9 9 ASP HB3 H 1 2.536 0.000 . 1 . . . A 9 ASP HB3 . 30155 1 65 . 1 1 9 9 ASP C C 13 176.146 0.000 . 1 . . . A 9 ASP C . 30155 1 66 . 1 1 9 9 ASP CA C 13 54.384 0.084 . 1 . . . A 9 ASP CA . 30155 1 67 . 1 1 9 9 ASP CB C 13 41.479 0.000 . 1 . . . A 9 ASP CB . 30155 1 68 . 1 1 9 9 ASP N N 15 120.902 0.018 . 1 . . . A 9 ASP N . 30155 1 69 . 1 1 10 10 HIS H H 1 8.293 0.017 . 1 . . . A 10 HIS H . 30155 1 70 . 1 1 10 10 HIS HA H 1 4.562 0.016 . 1 . . . A 10 HIS HA . 30155 1 71 . 1 1 10 10 HIS HB2 H 1 3.071 0.003 . 2 . . . A 10 HIS HB2 . 30155 1 72 . 1 1 10 10 HIS HB3 H 1 3.197 0.002 . 2 . . . A 10 HIS HB3 . 30155 1 73 . 1 1 10 10 HIS HD2 H 1 7.114 0.009 . 1 . . . A 10 HIS HD2 . 30155 1 74 . 1 1 10 10 HIS HE1 H 1 8.060 0.011 . 1 . . . A 10 HIS HE1 . 30155 1 75 . 1 1 10 10 HIS C C 13 174.638 0.000 . 1 . . . A 10 HIS C . 30155 1 76 . 1 1 10 10 HIS CA C 13 55.619 0.072 . 1 . . . A 10 HIS CA . 30155 1 77 . 1 1 10 10 HIS CB C 13 28.955 0.021 . 1 . . . A 10 HIS CB . 30155 1 78 . 1 1 10 10 HIS CD2 C 13 120.049 0.101 . 1 . . . A 10 HIS CD2 . 30155 1 79 . 1 1 10 10 HIS CE1 C 13 137.752 0.041 . 1 . . . A 10 HIS CE1 . 30155 1 80 . 1 1 10 10 HIS N N 15 118.531 0.031 . 1 . . . A 10 HIS N . 30155 1 81 . 1 1 11 11 MET H H 1 8.261 0.007 . 1 . . . A 11 MET H . 30155 1 82 . 1 1 11 11 MET HA H 1 4.318 0.006 . 1 . . . A 11 MET HA . 30155 1 83 . 1 1 11 11 MET HB2 H 1 1.929 0.018 . 2 . . . A 11 MET HB2 . 30155 1 84 . 1 1 11 11 MET HB3 H 1 1.958 0.017 . 2 . . . A 11 MET HB3 . 30155 1 85 . 1 1 11 11 MET HG2 H 1 2.400 0.014 . 2 . . . A 11 MET HG2 . 30155 1 86 . 1 1 11 11 MET HG3 H 1 2.475 0.011 . 2 . . . A 11 MET HG3 . 30155 1 87 . 1 1 11 11 MET HE1 H 1 1.976 0.010 . 1 . . . A 11 MET HE1 . 30155 1 88 . 1 1 11 11 MET HE2 H 1 1.976 0.010 . 1 . . . A 11 MET HE2 . 30155 1 89 . 1 1 11 11 MET HE3 H 1 1.976 0.010 . 1 . . . A 11 MET HE3 . 30155 1 90 . 1 1 11 11 MET C C 13 176.068 0.000 . 1 . . . A 11 MET C . 30155 1 91 . 1 1 11 11 MET CA C 13 55.823 0.025 . 1 . . . A 11 MET CA . 30155 1 92 . 1 1 11 11 MET CB C 13 32.721 0.101 . 1 . . . A 11 MET CB . 30155 1 93 . 1 1 11 11 MET CG C 13 32.046 0.026 . 1 . . . A 11 MET CG . 30155 1 94 . 1 1 11 11 MET CE C 13 17.024 0.151 . 1 . . . A 11 MET CE . 30155 1 95 . 1 1 11 11 MET N N 15 120.928 0.081 . 1 . . . A 11 MET N . 30155 1 96 . 1 1 12 12 ALA H H 1 8.216 0.008 . 1 . . . A 12 ALA H . 30155 1 97 . 1 1 12 12 ALA HA H 1 4.215 0.011 . 1 . . . A 12 ALA HA . 30155 1 98 . 1 1 12 12 ALA HB1 H 1 1.319 0.011 . 1 . . . A 12 ALA HB1 . 30155 1 99 . 1 1 12 12 ALA HB2 H 1 1.319 0.011 . 1 . . . A 12 ALA HB2 . 30155 1 100 . 1 1 12 12 ALA HB3 H 1 1.319 0.011 . 1 . . . A 12 ALA HB3 . 30155 1 101 . 1 1 12 12 ALA C C 13 177.854 0.000 . 1 . . . A 12 ALA C . 30155 1 102 . 1 1 12 12 ALA CA C 13 52.618 0.069 . 1 . . . A 12 ALA CA . 30155 1 103 . 1 1 12 12 ALA CB C 13 19.315 0.144 . 1 . . . A 12 ALA CB . 30155 1 104 . 1 1 12 12 ALA N N 15 124.756 0.038 . 1 . . . A 12 ALA N . 30155 1 105 . 1 1 13 13 GLU H H 1 8.279 0.006 . 1 . . . A 13 GLU H . 30155 1 106 . 1 1 13 13 GLU HA H 1 4.132 0.016 . 1 . . . A 13 GLU HA . 30155 1 107 . 1 1 13 13 GLU HB2 H 1 1.970 0.000 . 2 . . . A 13 GLU HB2 . 30155 1 108 . 1 1 13 13 GLU HB3 H 1 1.874 0.016 . 2 . . . A 13 GLU HB3 . 30155 1 109 . 1 1 13 13 GLU HG2 H 1 2.186 0.018 . 2 . . . A 13 GLU HG2 . 30155 1 110 . 1 1 13 13 GLU HG3 H 1 2.104 0.018 . 2 . . . A 13 GLU HG3 . 30155 1 111 . 1 1 13 13 GLU CA C 13 56.808 0.069 . 1 . . . A 13 GLU CA . 30155 1 112 . 1 1 13 13 GLU CB C 13 30.024 0.001 . 1 . . . A 13 GLU CB . 30155 1 113 . 1 1 13 13 GLU CG C 13 36.077 0.066 . 1 . . . A 13 GLU CG . 30155 1 114 . 1 1 13 13 GLU N N 15 119.683 0.034 . 1 . . . A 13 GLU N . 30155 1 115 . 1 1 14 14 ASP H H 1 8.266 0.007 . 1 . . . A 14 ASP H . 30155 1 116 . 1 1 14 14 ASP HA H 1 4.528 0.013 . 1 . . . A 14 ASP HA . 30155 1 117 . 1 1 14 14 ASP HB2 H 1 2.603 0.017 . 1 . . . A 14 ASP HB2 . 30155 1 118 . 1 1 14 14 ASP HB3 H 1 2.603 0.017 . 1 . . . A 14 ASP HB3 . 30155 1 119 . 1 1 14 14 ASP C C 13 176.392 0.002 . 1 . . . A 14 ASP C . 30155 1 120 . 1 1 14 14 ASP CA C 13 54.310 0.039 . 1 . . . A 14 ASP CA . 30155 1 121 . 1 1 14 14 ASP CB C 13 41.028 0.002 . 1 . . . A 14 ASP CB . 30155 1 122 . 1 1 14 14 ASP N N 15 120.665 0.053 . 1 . . . A 14 ASP N . 30155 1 123 . 1 1 15 15 CYS H H 1 8.210 0.008 . 1 . . . A 15 CYS H . 30155 1 124 . 1 1 15 15 CYS HA H 1 4.437 0.005 . 1 . . . A 15 CYS HA . 30155 1 125 . 1 1 15 15 CYS HB2 H 1 2.870 0.013 . 1 . . . A 15 CYS HB2 . 30155 1 126 . 1 1 15 15 CYS HB3 H 1 2.870 0.013 . 1 . . . A 15 CYS HB3 . 30155 1 127 . 1 1 15 15 CYS C C 13 174.874 0.000 . 1 . . . A 15 CYS C . 30155 1 128 . 1 1 15 15 CYS CA C 13 58.537 0.049 . 1 . . . A 15 CYS CA . 30155 1 129 . 1 1 15 15 CYS CB C 13 27.700 0.073 . 1 . . . A 15 CYS CB . 30155 1 130 . 1 1 15 15 CYS N N 15 119.450 0.040 . 1 . . . A 15 CYS N . 30155 1 131 . 1 1 16 16 ARG H H 1 8.246 0.012 . 1 . . . A 16 ARG H . 30155 1 132 . 1 1 16 16 ARG HA H 1 4.219 0.013 . 1 . . . A 16 ARG HA . 30155 1 133 . 1 1 16 16 ARG HB2 H 1 1.806 0.014 . 2 . . . A 16 ARG HB2 . 30155 1 134 . 1 1 16 16 ARG HB3 H 1 1.748 0.020 . 2 . . . A 16 ARG HB3 . 30155 1 135 . 1 1 16 16 ARG HG2 H 1 1.561 0.021 . 2 . . . A 16 ARG HG2 . 30155 1 136 . 1 1 16 16 ARG HG3 H 1 1.611 0.009 . 2 . . . A 16 ARG HG3 . 30155 1 137 . 1 1 16 16 ARG HD2 H 1 3.119 0.016 . 1 . . . A 16 ARG HD2 . 30155 1 138 . 1 1 16 16 ARG HD3 H 1 3.119 0.016 . 1 . . . A 16 ARG HD3 . 30155 1 139 . 1 1 16 16 ARG C C 13 176.890 0.000 . 1 . . . A 16 ARG C . 30155 1 140 . 1 1 16 16 ARG CA C 13 56.710 0.035 . 1 . . . A 16 ARG CA . 30155 1 141 . 1 1 16 16 ARG CB C 13 30.176 0.155 . 1 . . . A 16 ARG CB . 30155 1 142 . 1 1 16 16 ARG CG C 13 26.953 0.106 . 1 . . . A 16 ARG CG . 30155 1 143 . 1 1 16 16 ARG CD C 13 43.340 0.061 . 1 . . . A 16 ARG CD . 30155 1 144 . 1 1 16 16 ARG N N 15 122.548 0.042 . 1 . . . A 16 ARG N . 30155 1 145 . 1 1 17 17 GLY H H 1 8.273 0.011 . 1 . . . A 17 GLY H . 30155 1 146 . 1 1 17 17 GLY HA2 H 1 3.840 0.008 . 1 . . . A 17 GLY HA2 . 30155 1 147 . 1 1 17 17 GLY HA3 H 1 3.840 0.008 . 1 . . . A 17 GLY HA3 . 30155 1 148 . 1 1 17 17 GLY C C 13 173.825 0.000 . 1 . . . A 17 GLY C . 30155 1 149 . 1 1 17 17 GLY CA C 13 45.365 0.000 . 1 . . . A 17 GLY CA . 30155 1 150 . 1 1 17 17 GLY N N 15 108.957 0.062 . 1 . . . A 17 GLY N . 30155 1 151 . 1 1 18 18 ASP H H 1 8.204 0.010 . 1 . . . A 18 ASP H . 30155 1 152 . 1 1 18 18 ASP HA H 1 4.518 0.019 . 1 . . . A 18 ASP HA . 30155 1 153 . 1 1 18 18 ASP HB2 H 1 2.527 0.011 . 1 . . . A 18 ASP HB2 . 30155 1 154 . 1 1 18 18 ASP HB3 H 1 2.527 0.011 . 1 . . . A 18 ASP HB3 . 30155 1 155 . 1 1 18 18 ASP C C 13 176.451 0.000 . 1 . . . A 18 ASP C . 30155 1 156 . 1 1 18 18 ASP CA C 13 54.317 0.057 . 1 . . . A 18 ASP CA . 30155 1 157 . 1 1 18 18 ASP CB C 13 41.051 0.031 . 1 . . . A 18 ASP CB . 30155 1 158 . 1 1 18 18 ASP N N 15 120.426 0.058 . 1 . . . A 18 ASP N . 30155 1 159 . 1 1 19 19 ILE H H 1 7.867 0.006 . 1 . . . A 19 ILE H . 30155 1 160 . 1 1 19 19 ILE HA H 1 4.150 0.003 . 1 . . . A 19 ILE HA . 30155 1 161 . 1 1 19 19 ILE HB H 1 1.859 0.010 . 1 . . . A 19 ILE HB . 30155 1 162 . 1 1 19 19 ILE HG12 H 1 1.347 0.018 . 2 . . . A 19 ILE HG12 . 30155 1 163 . 1 1 19 19 ILE HG13 H 1 1.098 0.011 . 2 . . . A 19 ILE HG13 . 30155 1 164 . 1 1 19 19 ILE HG21 H 1 0.808 0.005 . 1 . . . A 19 ILE HG21 . 30155 1 165 . 1 1 19 19 ILE HG22 H 1 0.808 0.005 . 1 . . . A 19 ILE HG22 . 30155 1 166 . 1 1 19 19 ILE HG23 H 1 0.808 0.005 . 1 . . . A 19 ILE HG23 . 30155 1 167 . 1 1 19 19 ILE HD11 H 1 0.752 0.002 . 1 . . . A 19 ILE HD11 . 30155 1 168 . 1 1 19 19 ILE HD12 H 1 0.752 0.002 . 1 . . . A 19 ILE HD12 . 30155 1 169 . 1 1 19 19 ILE HD13 H 1 0.752 0.002 . 1 . . . A 19 ILE HD13 . 30155 1 170 . 1 1 19 19 ILE C C 13 176.776 0.000 . 1 . . . A 19 ILE C . 30155 1 171 . 1 1 19 19 ILE CA C 13 61.424 0.023 . 1 . . . A 19 ILE CA . 30155 1 172 . 1 1 19 19 ILE CB C 13 38.470 0.017 . 1 . . . A 19 ILE CB . 30155 1 173 . 1 1 19 19 ILE CG1 C 13 26.981 0.115 . 1 . . . A 19 ILE CG1 . 30155 1 174 . 1 1 19 19 ILE CG2 C 13 17.613 0.036 . 1 . . . A 19 ILE CG2 . 30155 1 175 . 1 1 19 19 ILE CD1 C 13 13.210 0.087 . 1 . . . A 19 ILE CD1 . 30155 1 176 . 1 1 19 19 ILE N N 15 119.858 0.024 . 1 . . . A 19 ILE N . 30155 1 177 . 1 1 20 20 GLY H H 1 8.419 0.005 . 1 . . . A 20 GLY H . 30155 1 178 . 1 1 20 20 GLY HA2 H 1 3.834 0.009 . 1 . . . A 20 GLY HA2 . 30155 1 179 . 1 1 20 20 GLY HA3 H 1 3.834 0.008 . 1 . . . A 20 GLY HA3 . 30155 1 180 . 1 1 20 20 GLY C C 13 174.335 0.000 . 1 . . . A 20 GLY C . 30155 1 181 . 1 1 20 20 GLY CA C 13 45.579 0.039 . 1 . . . A 20 GLY CA . 30155 1 182 . 1 1 20 20 GLY N N 15 111.356 0.023 . 1 . . . A 20 GLY N . 30155 1 183 . 1 1 21 21 ARG H H 1 8.031 0.008 . 1 . . . A 21 ARG H . 30155 1 184 . 1 1 21 21 ARG HA H 1 4.297 0.013 . 1 . . . A 21 ARG HA . 30155 1 185 . 1 1 21 21 ARG HB2 H 1 1.488 0.012 . 2 . . . A 21 ARG HB2 . 30155 1 186 . 1 1 21 21 ARG HB3 H 1 1.843 0.012 . 2 . . . A 21 ARG HB3 . 30155 1 187 . 1 1 21 21 ARG HG2 H 1 1.480 0.013 . 1 . . . A 21 ARG HG2 . 30155 1 188 . 1 1 21 21 ARG HG3 H 1 1.480 0.012 . 1 . . . A 21 ARG HG3 . 30155 1 189 . 1 1 21 21 ARG HD2 H 1 2.749 0.010 . 2 . . . A 21 ARG HD2 . 30155 1 190 . 1 1 21 21 ARG HD3 H 1 2.885 0.009 . 2 . . . A 21 ARG HD3 . 30155 1 191 . 1 1 21 21 ARG C C 13 176.315 0.000 . 1 . . . A 21 ARG C . 30155 1 192 . 1 1 21 21 ARG CA C 13 57.028 0.000 . 1 . . . A 21 ARG CA . 30155 1 193 . 1 1 21 21 ARG CB C 13 31.372 0.115 . 1 . . . A 21 ARG CB . 30155 1 194 . 1 1 21 21 ARG CG C 13 26.994 0.116 . 1 . . . A 21 ARG CG . 30155 1 195 . 1 1 21 21 ARG CD C 13 43.209 0.111 . 1 . . . A 21 ARG CD . 30155 1 196 . 1 1 21 21 ARG N N 15 119.992 0.035 . 1 . . . A 21 ARG N . 30155 1 197 . 1 1 22 22 THR H H 1 8.082 0.006 . 1 . . . A 22 THR H . 30155 1 198 . 1 1 22 22 THR HA H 1 4.405 0.002 . 1 . . . A 22 THR HA . 30155 1 199 . 1 1 22 22 THR HB H 1 4.818 0.008 . 1 . . . A 22 THR HB . 30155 1 200 . 1 1 22 22 THR HG21 H 1 0.803 0.003 . 1 . . . A 22 THR HG21 . 30155 1 201 . 1 1 22 22 THR HG22 H 1 0.803 0.003 . 1 . . . A 22 THR HG22 . 30155 1 202 . 1 1 22 22 THR HG23 H 1 0.803 0.003 . 1 . . . A 22 THR HG23 . 30155 1 203 . 1 1 22 22 THR C C 13 174.114 0.000 . 1 . . . A 22 THR C . 30155 1 204 . 1 1 22 22 THR CA C 13 61.880 0.139 . 1 . . . A 22 THR CA . 30155 1 205 . 1 1 22 22 THR CB C 13 69.869 0.068 . 1 . . . A 22 THR CB . 30155 1 206 . 1 1 22 22 THR CG2 C 13 20.900 0.068 . 1 . . . A 22 THR CG2 . 30155 1 207 . 1 1 22 22 THR N N 15 108.685 0.057 . 1 . . . A 22 THR N . 30155 1 208 . 1 1 23 23 ASN H H 1 7.791 0.003 . 1 . . . A 23 ASN H . 30155 1 209 . 1 1 23 23 ASN HA H 1 5.469 0.005 . 1 . . . A 23 ASN HA . 30155 1 210 . 1 1 23 23 ASN HB2 H 1 2.858 0.012 . 2 . . . A 23 ASN HB2 . 30155 1 211 . 1 1 23 23 ASN HB3 H 1 2.789 0.013 . 2 . . . A 23 ASN HB3 . 30155 1 212 . 1 1 23 23 ASN HD21 H 1 7.267 0.003 . 1 . . . A 23 ASN HD21 . 30155 1 213 . 1 1 23 23 ASN HD22 H 1 6.262 0.008 . 1 . . . A 23 ASN HD22 . 30155 1 214 . 1 1 23 23 ASN C C 13 174.999 0.000 . 1 . . . A 23 ASN C . 30155 1 215 . 1 1 23 23 ASN CA C 13 53.691 0.052 . 1 . . . A 23 ASN CA . 30155 1 216 . 1 1 23 23 ASN CB C 13 40.020 0.113 . 1 . . . A 23 ASN CB . 30155 1 217 . 1 1 23 23 ASN N N 15 120.362 0.026 . 1 . . . A 23 ASN N . 30155 1 218 . 1 1 23 23 ASN ND2 N 15 110.102 0.028 . 1 . . . A 23 ASN ND2 . 30155 1 219 . 1 1 24 24 LEU H H 1 9.658 0.004 . 1 . . . A 24 LEU H . 30155 1 220 . 1 1 24 24 LEU HA H 1 5.202 0.009 . 1 . . . A 24 LEU HA . 30155 1 221 . 1 1 24 24 LEU HB2 H 1 1.821 0.014 . 2 . . . A 24 LEU HB2 . 30155 1 222 . 1 1 24 24 LEU HB3 H 1 1.215 0.012 . 2 . . . A 24 LEU HB3 . 30155 1 223 . 1 1 24 24 LEU HG H 1 1.890 0.012 . 1 . . . A 24 LEU HG . 30155 1 224 . 1 1 24 24 LEU HD11 H 1 1.001 0.007 . 2 . . . A 24 LEU HD11 . 30155 1 225 . 1 1 24 24 LEU HD12 H 1 1.001 0.007 . 2 . . . A 24 LEU HD12 . 30155 1 226 . 1 1 24 24 LEU HD13 H 1 1.001 0.007 . 2 . . . A 24 LEU HD13 . 30155 1 227 . 1 1 24 24 LEU HD21 H 1 0.479 0.008 . 2 . . . A 24 LEU HD21 . 30155 1 228 . 1 1 24 24 LEU HD22 H 1 0.479 0.008 . 2 . . . A 24 LEU HD22 . 30155 1 229 . 1 1 24 24 LEU HD23 H 1 0.479 0.008 . 2 . . . A 24 LEU HD23 . 30155 1 230 . 1 1 24 24 LEU C C 13 176.299 0.000 . 1 . . . A 24 LEU C . 30155 1 231 . 1 1 24 24 LEU CA C 13 53.628 0.101 . 1 . . . A 24 LEU CA . 30155 1 232 . 1 1 24 24 LEU CB C 13 44.341 0.100 . 1 . . . A 24 LEU CB . 30155 1 233 . 1 1 24 24 LEU CG C 13 26.832 0.127 . 1 . . . A 24 LEU CG . 30155 1 234 . 1 1 24 24 LEU CD1 C 13 27.512 0.115 . 2 . . . A 24 LEU CD1 . 30155 1 235 . 1 1 24 24 LEU CD2 C 13 24.259 0.070 . 2 . . . A 24 LEU CD2 . 30155 1 236 . 1 1 24 24 LEU N N 15 127.068 0.031 . 1 . . . A 24 LEU N . 30155 1 237 . 1 1 25 25 ILE H H 1 9.150 0.008 . 1 . . . A 25 ILE H . 30155 1 238 . 1 1 25 25 ILE HA H 1 4.820 0.007 . 1 . . . A 25 ILE HA . 30155 1 239 . 1 1 25 25 ILE HB H 1 1.497 0.005 . 1 . . . A 25 ILE HB . 30155 1 240 . 1 1 25 25 ILE HG12 H 1 0.678 0.019 . 2 . . . A 25 ILE HG12 . 30155 1 241 . 1 1 25 25 ILE HG13 H 1 1.047 0.013 . 2 . . . A 25 ILE HG13 . 30155 1 242 . 1 1 25 25 ILE HG21 H 1 0.702 0.006 . 1 . . . A 25 ILE HG21 . 30155 1 243 . 1 1 25 25 ILE HG22 H 1 0.702 0.006 . 1 . . . A 25 ILE HG22 . 30155 1 244 . 1 1 25 25 ILE HG23 H 1 0.702 0.006 . 1 . . . A 25 ILE HG23 . 30155 1 245 . 1 1 25 25 ILE HD11 H 1 0.628 0.011 . 1 . . . A 25 ILE HD11 . 30155 1 246 . 1 1 25 25 ILE HD12 H 1 0.628 0.011 . 1 . . . A 25 ILE HD12 . 30155 1 247 . 1 1 25 25 ILE HD13 H 1 0.628 0.011 . 1 . . . A 25 ILE HD13 . 30155 1 248 . 1 1 25 25 ILE C C 13 173.284 0.000 . 1 . . . A 25 ILE C . 30155 1 249 . 1 1 25 25 ILE CA C 13 58.872 0.066 . 1 . . . A 25 ILE CA . 30155 1 250 . 1 1 25 25 ILE CB C 13 41.037 0.042 . 1 . . . A 25 ILE CB . 30155 1 251 . 1 1 25 25 ILE CG1 C 13 28.139 0.094 . 1 . . . A 25 ILE CG1 . 30155 1 252 . 1 1 25 25 ILE CG2 C 13 15.340 0.056 . 1 . . . A 25 ILE CG2 . 30155 1 253 . 1 1 25 25 ILE CD1 C 13 13.790 0.030 . 1 . . . A 25 ILE CD1 . 30155 1 254 . 1 1 25 25 ILE N N 15 121.121 0.032 . 1 . . . A 25 ILE N . 30155 1 255 . 1 1 26 26 VAL H H 1 8.647 0.011 . 1 . . . A 26 VAL H . 30155 1 256 . 1 1 26 26 VAL HA H 1 5.059 0.007 . 1 . . . A 26 VAL HA . 30155 1 257 . 1 1 26 26 VAL HB H 1 1.576 0.016 . 1 . . . A 26 VAL HB . 30155 1 258 . 1 1 26 26 VAL HG11 H 1 0.805 0.011 . 2 . . . A 26 VAL HG11 . 30155 1 259 . 1 1 26 26 VAL HG12 H 1 0.805 0.011 . 2 . . . A 26 VAL HG12 . 30155 1 260 . 1 1 26 26 VAL HG13 H 1 0.805 0.011 . 2 . . . A 26 VAL HG13 . 30155 1 261 . 1 1 26 26 VAL HG21 H 1 0.523 0.009 . 2 . . . A 26 VAL HG21 . 30155 1 262 . 1 1 26 26 VAL HG22 H 1 0.523 0.009 . 2 . . . A 26 VAL HG22 . 30155 1 263 . 1 1 26 26 VAL HG23 H 1 0.523 0.009 . 2 . . . A 26 VAL HG23 . 30155 1 264 . 1 1 26 26 VAL C C 13 173.899 0.000 . 1 . . . A 26 VAL C . 30155 1 265 . 1 1 26 26 VAL CA C 13 59.110 0.083 . 1 . . . A 26 VAL CA . 30155 1 266 . 1 1 26 26 VAL CB C 13 33.561 0.067 . 1 . . . A 26 VAL CB . 30155 1 267 . 1 1 26 26 VAL CG1 C 13 21.643 0.062 . 2 . . . A 26 VAL CG1 . 30155 1 268 . 1 1 26 26 VAL CG2 C 13 21.667 0.086 . 2 . . . A 26 VAL CG2 . 30155 1 269 . 1 1 26 26 VAL N N 15 128.017 0.031 . 1 . . . A 26 VAL N . 30155 1 270 . 1 1 27 27 ASN H H 1 9.120 0.005 . 1 . . . A 27 ASN H . 30155 1 271 . 1 1 27 27 ASN HA H 1 5.022 0.010 . 1 . . . A 27 ASN HA . 30155 1 272 . 1 1 27 27 ASN HB2 H 1 1.803 0.015 . 2 . . . A 27 ASN HB2 . 30155 1 273 . 1 1 27 27 ASN HB3 H 1 1.692 0.006 . 2 . . . A 27 ASN HB3 . 30155 1 274 . 1 1 27 27 ASN HD21 H 1 7.142 0.004 . 1 . . . A 27 ASN HD21 . 30155 1 275 . 1 1 27 27 ASN HD22 H 1 6.124 0.004 . 1 . . . A 27 ASN HD22 . 30155 1 276 . 1 1 27 27 ASN C C 13 173.355 0.000 . 1 . . . A 27 ASN C . 30155 1 277 . 1 1 27 27 ASN CA C 13 51.531 0.124 . 1 . . . A 27 ASN CA . 30155 1 278 . 1 1 27 27 ASN CB C 13 42.887 0.057 . 1 . . . A 27 ASN CB . 30155 1 279 . 1 1 27 27 ASN N N 15 123.723 0.031 . 1 . . . A 27 ASN N . 30155 1 280 . 1 1 27 27 ASN ND2 N 15 109.361 0.061 . 1 . . . A 27 ASN ND2 . 30155 1 281 . 1 1 28 28 TYR H H 1 8.328 0.008 . 1 . . . A 28 TYR H . 30155 1 282 . 1 1 28 28 TYR HA H 1 4.328 0.012 . 1 . . . A 28 TYR HA . 30155 1 283 . 1 1 28 28 TYR HB2 H 1 3.656 0.013 . 2 . . . A 28 TYR HB2 . 30155 1 284 . 1 1 28 28 TYR HB3 H 1 2.995 0.008 . 2 . . . A 28 TYR HB3 . 30155 1 285 . 1 1 28 28 TYR HD1 H 1 7.129 0.015 . 3 . . . A 28 TYR HD1 . 30155 1 286 . 1 1 28 28 TYR HD2 H 1 7.129 0.015 . 3 . . . A 28 TYR HD2 . 30155 1 287 . 1 1 28 28 TYR C C 13 173.934 0.000 . 1 . . . A 28 TYR C . 30155 1 288 . 1 1 28 28 TYR CA C 13 57.079 0.133 . 1 . . . A 28 TYR CA . 30155 1 289 . 1 1 28 28 TYR CB C 13 34.427 0.099 . 1 . . . A 28 TYR CB . 30155 1 290 . 1 1 28 28 TYR CD1 C 13 133.202 0.093 . 3 . . . A 28 TYR CD1 . 30155 1 291 . 1 1 28 28 TYR CD2 C 13 133.202 0.093 . 3 . . . A 28 TYR CD2 . 30155 1 292 . 1 1 28 28 TYR N N 15 114.478 0.023 . 1 . . . A 28 TYR N . 30155 1 293 . 1 1 29 29 LEU H H 1 7.828 0.006 . 1 . . . A 29 LEU H . 30155 1 294 . 1 1 29 29 LEU HA H 1 4.236 0.012 . 1 . . . A 29 LEU HA . 30155 1 295 . 1 1 29 29 LEU HB2 H 1 1.035 0.011 . 2 . . . A 29 LEU HB2 . 30155 1 296 . 1 1 29 29 LEU HB3 H 1 1.284 0.015 . 2 . . . A 29 LEU HB3 . 30155 1 297 . 1 1 29 29 LEU HD11 H 1 0.737 0.011 . 2 . . . A 29 LEU HD11 . 30155 1 298 . 1 1 29 29 LEU HD12 H 1 0.737 0.011 . 2 . . . A 29 LEU HD12 . 30155 1 299 . 1 1 29 29 LEU HD13 H 1 0.737 0.011 . 2 . . . A 29 LEU HD13 . 30155 1 300 . 1 1 29 29 LEU HD21 H 1 0.458 0.014 . 2 . . . A 29 LEU HD21 . 30155 1 301 . 1 1 29 29 LEU HD22 H 1 0.458 0.014 . 2 . . . A 29 LEU HD22 . 30155 1 302 . 1 1 29 29 LEU HD23 H 1 0.458 0.014 . 2 . . . A 29 LEU HD23 . 30155 1 303 . 1 1 29 29 LEU CA C 13 52.588 0.063 . 1 . . . A 29 LEU CA . 30155 1 304 . 1 1 29 29 LEU CB C 13 41.517 0.056 . 1 . . . A 29 LEU CB . 30155 1 305 . 1 1 29 29 LEU CD1 C 13 22.163 0.074 . 2 . . . A 29 LEU CD1 . 30155 1 306 . 1 1 29 29 LEU CD2 C 13 26.196 0.105 . 2 . . . A 29 LEU CD2 . 30155 1 307 . 1 1 29 29 LEU N N 15 114.273 0.045 . 1 . . . A 29 LEU N . 30155 1 308 . 1 1 30 30 PRO HA H 1 4.331 0.006 . 1 . . . A 30 PRO HA . 30155 1 309 . 1 1 30 30 PRO HB2 H 1 1.853 0.018 . 2 . . . A 30 PRO HB2 . 30155 1 310 . 1 1 30 30 PRO HB3 H 1 2.333 0.014 . 2 . . . A 30 PRO HB3 . 30155 1 311 . 1 1 30 30 PRO HG2 H 1 2.010 0.004 . 1 . . . A 30 PRO HG2 . 30155 1 312 . 1 1 30 30 PRO HG3 H 1 2.010 0.004 . 1 . . . A 30 PRO HG3 . 30155 1 313 . 1 1 30 30 PRO HD2 H 1 3.689 0.010 . 2 . . . A 30 PRO HD2 . 30155 1 314 . 1 1 30 30 PRO HD3 H 1 3.554 0.017 . 2 . . . A 30 PRO HD3 . 30155 1 315 . 1 1 30 30 PRO C C 13 178.554 0.000 . 1 . . . A 30 PRO C . 30155 1 316 . 1 1 30 30 PRO CA C 13 63.011 0.115 . 1 . . . A 30 PRO CA . 30155 1 317 . 1 1 30 30 PRO CB C 13 32.235 0.083 . 1 . . . A 30 PRO CB . 30155 1 318 . 1 1 30 30 PRO CG C 13 28.222 0.171 . 1 . . . A 30 PRO CG . 30155 1 319 . 1 1 30 30 PRO CD C 13 50.045 0.078 . 1 . . . A 30 PRO CD . 30155 1 320 . 1 1 31 31 GLN H H 1 9.025 0.003 . 1 . . . A 31 GLN H . 30155 1 321 . 1 1 31 31 GLN HA H 1 3.813 0.005 . 1 . . . A 31 GLN HA . 30155 1 322 . 1 1 31 31 GLN HB2 H 1 2.050 0.015 . 1 . . . A 31 GLN HB2 . 30155 1 323 . 1 1 31 31 GLN HB3 H 1 2.055 0.009 . 1 . . . A 31 GLN HB3 . 30155 1 324 . 1 1 31 31 GLN HG2 H 1 2.351 0.009 . 1 . . . A 31 GLN HG2 . 30155 1 325 . 1 1 31 31 GLN HG3 H 1 2.351 0.009 . 1 . . . A 31 GLN HG3 . 30155 1 326 . 1 1 31 31 GLN HE21 H 1 6.910 0.004 . 1 . . . A 31 GLN HE21 . 30155 1 327 . 1 1 31 31 GLN HE22 H 1 7.525 0.001 . 1 . . . A 31 GLN HE22 . 30155 1 328 . 1 1 31 31 GLN C C 13 175.553 0.000 . 1 . . . A 31 GLN C . 30155 1 329 . 1 1 31 31 GLN CA C 13 58.958 0.094 . 1 . . . A 31 GLN CA . 30155 1 330 . 1 1 31 31 GLN CB C 13 28.943 0.081 . 1 . . . A 31 GLN CB . 30155 1 331 . 1 1 31 31 GLN CG C 13 34.300 0.143 . 1 . . . A 31 GLN CG . 30155 1 332 . 1 1 31 31 GLN N N 15 124.798 0.042 . 1 . . . A 31 GLN N . 30155 1 333 . 1 1 31 31 GLN NE2 N 15 112.008 0.082 . 1 . . . A 31 GLN NE2 . 30155 1 334 . 1 1 32 32 ASN H H 1 8.205 0.004 . 1 . . . A 32 ASN H . 30155 1 335 . 1 1 32 32 ASN HA H 1 4.619 0.004 . 1 . . . A 32 ASN HA . 30155 1 336 . 1 1 32 32 ASN HB2 H 1 2.931 0.006 . 2 . . . A 32 ASN HB2 . 30155 1 337 . 1 1 32 32 ASN HB3 H 1 2.729 0.010 . 2 . . . A 32 ASN HB3 . 30155 1 338 . 1 1 32 32 ASN HD21 H 1 7.514 0.001 . 1 . . . A 32 ASN HD21 . 30155 1 339 . 1 1 32 32 ASN HD22 H 1 6.881 0.007 . 1 . . . A 32 ASN HD22 . 30155 1 340 . 1 1 32 32 ASN C C 13 175.527 0.000 . 1 . . . A 32 ASN C . 30155 1 341 . 1 1 32 32 ASN CA C 13 52.355 0.112 . 1 . . . A 32 ASN CA . 30155 1 342 . 1 1 32 32 ASN CB C 13 37.765 0.066 . 1 . . . A 32 ASN CB . 30155 1 343 . 1 1 32 32 ASN N N 15 112.513 0.024 . 1 . . . A 32 ASN N . 30155 1 344 . 1 1 32 32 ASN ND2 N 15 112.004 0.033 . 1 . . . A 32 ASN ND2 . 30155 1 345 . 1 1 33 33 MET H H 1 7.205 0.007 . 1 . . . A 33 MET H . 30155 1 346 . 1 1 33 33 MET HA H 1 4.469 0.006 . 1 . . . A 33 MET HA . 30155 1 347 . 1 1 33 33 MET HB2 H 1 1.858 0.009 . 1 . . . A 33 MET HB2 . 30155 1 348 . 1 1 33 33 MET HB3 H 1 1.855 0.008 . 1 . . . A 33 MET HB3 . 30155 1 349 . 1 1 33 33 MET HG2 H 1 2.720 0.005 . 2 . . . A 33 MET HG2 . 30155 1 350 . 1 1 33 33 MET HG3 H 1 2.516 0.006 . 2 . . . A 33 MET HG3 . 30155 1 351 . 1 1 33 33 MET HE1 H 1 1.901 0.010 . 1 . . . A 33 MET HE1 . 30155 1 352 . 1 1 33 33 MET HE2 H 1 1.901 0.010 . 1 . . . A 33 MET HE2 . 30155 1 353 . 1 1 33 33 MET HE3 H 1 1.901 0.010 . 1 . . . A 33 MET HE3 . 30155 1 354 . 1 1 33 33 MET C C 13 176.508 0.000 . 1 . . . A 33 MET C . 30155 1 355 . 1 1 33 33 MET CA C 13 56.608 0.061 . 1 . . . A 33 MET CA . 30155 1 356 . 1 1 33 33 MET CB C 13 33.875 0.039 . 1 . . . A 33 MET CB . 30155 1 357 . 1 1 33 33 MET CG C 13 32.603 0.046 . 1 . . . A 33 MET CG . 30155 1 358 . 1 1 33 33 MET CE C 13 17.618 0.059 . 1 . . . A 33 MET CE . 30155 1 359 . 1 1 33 33 MET N N 15 121.623 0.114 . 1 . . . A 33 MET N . 30155 1 360 . 1 1 34 34 THR H H 1 8.523 0.005 . 1 . . . A 34 THR H . 30155 1 361 . 1 1 34 34 THR HA H 1 4.428 0.013 . 1 . . . A 34 THR HA . 30155 1 362 . 1 1 34 34 THR HB H 1 4.692 0.011 . 1 . . . A 34 THR HB . 30155 1 363 . 1 1 34 34 THR HG21 H 1 1.236 0.004 . 1 . . . A 34 THR HG21 . 30155 1 364 . 1 1 34 34 THR HG22 H 1 1.236 0.004 . 1 . . . A 34 THR HG22 . 30155 1 365 . 1 1 34 34 THR HG23 H 1 1.236 0.004 . 1 . . . A 34 THR HG23 . 30155 1 366 . 1 1 34 34 THR C C 13 175.370 0.000 . 1 . . . A 34 THR C . 30155 1 367 . 1 1 34 34 THR CA C 13 60.375 0.024 . 1 . . . A 34 THR CA . 30155 1 368 . 1 1 34 34 THR CB C 13 71.510 0.000 . 1 . . . A 34 THR CB . 30155 1 369 . 1 1 34 34 THR CG2 C 13 21.759 0.137 . 1 . . . A 34 THR CG2 . 30155 1 370 . 1 1 34 34 THR N N 15 118.468 0.018 . 1 . . . A 34 THR N . 30155 1 371 . 1 1 35 35 GLN H H 1 9.163 0.003 . 1 . . . A 35 GLN H . 30155 1 372 . 1 1 35 35 GLN HA H 1 3.667 0.007 . 1 . . . A 35 GLN HA . 30155 1 373 . 1 1 35 35 GLN HB2 H 1 2.123 0.010 . 1 . . . A 35 GLN HB2 . 30155 1 374 . 1 1 35 35 GLN HB3 H 1 2.123 0.010 . 1 . . . A 35 GLN HB3 . 30155 1 375 . 1 1 35 35 GLN HG2 H 1 2.363 0.011 . 2 . . . A 35 GLN HG2 . 30155 1 376 . 1 1 35 35 GLN HG3 H 1 1.951 0.009 . 2 . . . A 35 GLN HG3 . 30155 1 377 . 1 1 35 35 GLN HE21 H 1 6.950 0.009 . 1 . . . A 35 GLN HE21 . 30155 1 378 . 1 1 35 35 GLN HE22 H 1 7.678 0.008 . 1 . . . A 35 GLN HE22 . 30155 1 379 . 1 1 35 35 GLN C C 13 177.286 0.000 . 1 . . . A 35 GLN C . 30155 1 380 . 1 1 35 35 GLN CA C 13 60.174 0.079 . 1 . . . A 35 GLN CA . 30155 1 381 . 1 1 35 35 GLN CB C 13 29.712 0.079 . 1 . . . A 35 GLN CB . 30155 1 382 . 1 1 35 35 GLN CG C 13 35.082 0.117 . 1 . . . A 35 GLN CG . 30155 1 383 . 1 1 35 35 GLN N N 15 121.485 0.108 . 1 . . . A 35 GLN N . 30155 1 384 . 1 1 35 35 GLN NE2 N 15 112.432 0.065 . 1 . . . A 35 GLN NE2 . 30155 1 385 . 1 1 36 36 ASP H H 1 8.329 0.011 . 1 . . . A 36 ASP H . 30155 1 386 . 1 1 36 36 ASP HA H 1 4.362 0.009 . 1 . . . A 36 ASP HA . 30155 1 387 . 1 1 36 36 ASP HB2 H 1 2.565 0.016 . 2 . . . A 36 ASP HB2 . 30155 1 388 . 1 1 36 36 ASP HB3 H 1 2.516 0.011 . 2 . . . A 36 ASP HB3 . 30155 1 389 . 1 1 36 36 ASP C C 13 178.970 0.000 . 1 . . . A 36 ASP C . 30155 1 390 . 1 1 36 36 ASP CA C 13 57.239 0.079 . 1 . . . A 36 ASP CA . 30155 1 391 . 1 1 36 36 ASP CB C 13 40.596 0.074 . 1 . . . A 36 ASP CB . 30155 1 392 . 1 1 36 36 ASP N N 15 118.062 0.032 . 1 . . . A 36 ASP N . 30155 1 393 . 1 1 37 37 GLU H H 1 7.624 0.009 . 1 . . . A 37 GLU H . 30155 1 394 . 1 1 37 37 GLU HA H 1 3.950 0.003 . 1 . . . A 37 GLU HA . 30155 1 395 . 1 1 37 37 GLU HB2 H 1 2.281 0.011 . 2 . . . A 37 GLU HB2 . 30155 1 396 . 1 1 37 37 GLU HB3 H 1 1.836 0.017 . 2 . . . A 37 GLU HB3 . 30155 1 397 . 1 1 37 37 GLU HG2 H 1 2.210 0.004 . 2 . . . A 37 GLU HG2 . 30155 1 398 . 1 1 37 37 GLU HG3 H 1 2.275 0.008 . 2 . . . A 37 GLU HG3 . 30155 1 399 . 1 1 37 37 GLU C C 13 179.487 0.000 . 1 . . . A 37 GLU C . 30155 1 400 . 1 1 37 37 GLU CA C 13 58.991 0.082 . 1 . . . A 37 GLU CA . 30155 1 401 . 1 1 37 37 GLU CB C 13 30.326 0.180 . 1 . . . A 37 GLU CB . 30155 1 402 . 1 1 37 37 GLU CG C 13 37.147 0.042 . 1 . . . A 37 GLU CG . 30155 1 403 . 1 1 37 37 GLU N N 15 121.439 0.023 . 1 . . . A 37 GLU N . 30155 1 404 . 1 1 38 38 LEU H H 1 8.142 0.014 . 1 . . . A 38 LEU H . 30155 1 405 . 1 1 38 38 LEU HA H 1 4.036 0.015 . 1 . . . A 38 LEU HA . 30155 1 406 . 1 1 38 38 LEU HB2 H 1 1.319 0.022 . 2 . . . A 38 LEU HB2 . 30155 1 407 . 1 1 38 38 LEU HB3 H 1 2.059 0.012 . 2 . . . A 38 LEU HB3 . 30155 1 408 . 1 1 38 38 LEU HG H 1 1.140 0.019 . 1 . . . A 38 LEU HG . 30155 1 409 . 1 1 38 38 LEU HD11 H 1 0.746 0.010 . 2 . . . A 38 LEU HD11 . 30155 1 410 . 1 1 38 38 LEU HD12 H 1 0.746 0.010 . 2 . . . A 38 LEU HD12 . 30155 1 411 . 1 1 38 38 LEU HD13 H 1 0.746 0.010 . 2 . . . A 38 LEU HD13 . 30155 1 412 . 1 1 38 38 LEU HD21 H 1 0.434 0.010 . 2 . . . A 38 LEU HD21 . 30155 1 413 . 1 1 38 38 LEU HD22 H 1 0.434 0.010 . 2 . . . A 38 LEU HD22 . 30155 1 414 . 1 1 38 38 LEU HD23 H 1 0.434 0.010 . 2 . . . A 38 LEU HD23 . 30155 1 415 . 1 1 38 38 LEU C C 13 177.637 0.000 . 1 . . . A 38 LEU C . 30155 1 416 . 1 1 38 38 LEU CA C 13 58.497 0.145 . 1 . . . A 38 LEU CA . 30155 1 417 . 1 1 38 38 LEU CB C 13 41.671 0.027 . 1 . . . A 38 LEU CB . 30155 1 418 . 1 1 38 38 LEU CG C 13 27.094 0.143 . 1 . . . A 38 LEU CG . 30155 1 419 . 1 1 38 38 LEU CD1 C 13 24.225 0.104 . 2 . . . A 38 LEU CD1 . 30155 1 420 . 1 1 38 38 LEU CD2 C 13 25.941 0.103 . 2 . . . A 38 LEU CD2 . 30155 1 421 . 1 1 38 38 LEU N N 15 122.938 0.047 . 1 . . . A 38 LEU N . 30155 1 422 . 1 1 39 39 ARG H H 1 8.267 0.008 . 1 . . . A 39 ARG H . 30155 1 423 . 1 1 39 39 ARG HA H 1 3.485 0.005 . 1 . . . A 39 ARG HA . 30155 1 424 . 1 1 39 39 ARG HB2 H 1 1.770 0.018 . 2 . . . A 39 ARG HB2 . 30155 1 425 . 1 1 39 39 ARG HB3 H 1 2.006 0.012 . 2 . . . A 39 ARG HB3 . 30155 1 426 . 1 1 39 39 ARG HG2 H 1 1.262 0.007 . 2 . . . A 39 ARG HG2 . 30155 1 427 . 1 1 39 39 ARG HG3 H 1 1.507 0.013 . 2 . . . A 39 ARG HG3 . 30155 1 428 . 1 1 39 39 ARG HD2 H 1 3.174 0.011 . 1 . . . A 39 ARG HD2 . 30155 1 429 . 1 1 39 39 ARG HD3 H 1 3.174 0.011 . 1 . . . A 39 ARG HD3 . 30155 1 430 . 1 1 39 39 ARG C C 13 179.224 0.000 . 1 . . . A 39 ARG C . 30155 1 431 . 1 1 39 39 ARG CA C 13 60.560 0.030 . 1 . . . A 39 ARG CA . 30155 1 432 . 1 1 39 39 ARG CB C 13 29.871 0.176 . 1 . . . A 39 ARG CB . 30155 1 433 . 1 1 39 39 ARG CG C 13 27.604 0.279 . 1 . . . A 39 ARG CG . 30155 1 434 . 1 1 39 39 ARG CD C 13 42.898 0.090 . 1 . . . A 39 ARG CD . 30155 1 435 . 1 1 39 39 ARG N N 15 118.144 0.032 . 1 . . . A 39 ARG N . 30155 1 436 . 1 1 40 40 SER H H 1 8.485 0.002 . 1 . . . A 40 SER H . 30155 1 437 . 1 1 40 40 SER C C 13 176.942 0.000 . 1 . . . A 40 SER C . 30155 1 438 . 1 1 40 40 SER N N 15 116.148 0.068 . 1 . . . A 40 SER N . 30155 1 439 . 1 1 41 41 LEU H H 1 8.019 0.003 . 1 . . . A 41 LEU H . 30155 1 440 . 1 1 41 41 LEU HA H 1 4.106 0.008 . 1 . . . A 41 LEU HA . 30155 1 441 . 1 1 41 41 LEU HB2 H 1 1.604 0.011 . 2 . . . A 41 LEU HB2 . 30155 1 442 . 1 1 41 41 LEU HB3 H 1 1.972 0.013 . 2 . . . A 41 LEU HB3 . 30155 1 443 . 1 1 41 41 LEU HG H 1 0.982 0.014 . 1 . . . A 41 LEU HG . 30155 1 444 . 1 1 41 41 LEU HD11 H 1 0.675 0.013 . 2 . . . A 41 LEU HD11 . 30155 1 445 . 1 1 41 41 LEU HD12 H 1 0.675 0.013 . 2 . . . A 41 LEU HD12 . 30155 1 446 . 1 1 41 41 LEU HD13 H 1 0.675 0.013 . 2 . . . A 41 LEU HD13 . 30155 1 447 . 1 1 41 41 LEU HD21 H 1 0.683 0.007 . 2 . . . A 41 LEU HD21 . 30155 1 448 . 1 1 41 41 LEU HD22 H 1 0.683 0.007 . 2 . . . A 41 LEU HD22 . 30155 1 449 . 1 1 41 41 LEU HD23 H 1 0.683 0.007 . 2 . . . A 41 LEU HD23 . 30155 1 450 . 1 1 41 41 LEU C C 13 179.144 0.000 . 1 . . . A 41 LEU C . 30155 1 451 . 1 1 41 41 LEU CA C 13 58.142 0.078 . 1 . . . A 41 LEU CA . 30155 1 452 . 1 1 41 41 LEU CB C 13 41.646 0.027 . 1 . . . A 41 LEU CB . 30155 1 453 . 1 1 41 41 LEU CG C 13 26.152 0.199 . 1 . . . A 41 LEU CG . 30155 1 454 . 1 1 41 41 LEU CD1 C 13 25.682 0.000 . 2 . . . A 41 LEU CD1 . 30155 1 455 . 1 1 41 41 LEU CD2 C 13 22.021 0.069 . 2 . . . A 41 LEU CD2 . 30155 1 456 . 1 1 41 41 LEU N N 15 122.746 0.036 . 1 . . . A 41 LEU N . 30155 1 457 . 1 1 42 42 PHE H H 1 7.852 0.012 . 1 . . . A 42 PHE H . 30155 1 458 . 1 1 42 42 PHE HA H 1 3.950 0.013 . 1 . . . A 42 PHE HA . 30155 1 459 . 1 1 42 42 PHE HB2 H 1 2.640 0.010 . 2 . . . A 42 PHE HB2 . 30155 1 460 . 1 1 42 42 PHE HB3 H 1 3.023 0.010 . 2 . . . A 42 PHE HB3 . 30155 1 461 . 1 1 42 42 PHE HD1 H 1 7.811 0.013 . 3 . . . A 42 PHE HD1 . 30155 1 462 . 1 1 42 42 PHE HD2 H 1 7.811 0.013 . 3 . . . A 42 PHE HD2 . 30155 1 463 . 1 1 42 42 PHE HE1 H 1 6.538 0.013 . 3 . . . A 42 PHE HE1 . 30155 1 464 . 1 1 42 42 PHE HE2 H 1 6.538 0.013 . 3 . . . A 42 PHE HE2 . 30155 1 465 . 1 1 42 42 PHE HZ H 1 6.920 0.010 . 1 . . . A 42 PHE HZ . 30155 1 466 . 1 1 42 42 PHE C C 13 179.877 0.000 . 1 . . . A 42 PHE C . 30155 1 467 . 1 1 42 42 PHE CA C 13 61.703 0.097 . 1 . . . A 42 PHE CA . 30155 1 468 . 1 1 42 42 PHE CB C 13 37.840 0.092 . 1 . . . A 42 PHE CB . 30155 1 469 . 1 1 42 42 PHE CD1 C 13 132.370 0.077 . 3 . . . A 42 PHE CD1 . 30155 1 470 . 1 1 42 42 PHE CD2 C 13 132.370 0.077 . 3 . . . A 42 PHE CD2 . 30155 1 471 . 1 1 42 42 PHE CE1 C 13 133.259 0.155 . 3 . . . A 42 PHE CE1 . 30155 1 472 . 1 1 42 42 PHE CE2 C 13 133.259 0.155 . 3 . . . A 42 PHE CE2 . 30155 1 473 . 1 1 42 42 PHE CZ C 13 129.968 0.172 . 1 . . . A 42 PHE CZ . 30155 1 474 . 1 1 42 42 PHE N N 15 116.763 0.032 . 1 . . . A 42 PHE N . 30155 1 475 . 1 1 43 43 SER H H 1 8.924 0.004 . 1 . . . A 43 SER H . 30155 1 476 . 1 1 43 43 SER HA H 1 5.200 0.002 . 1 . . . A 43 SER HA . 30155 1 477 . 1 1 43 43 SER HB2 H 1 3.919 0.006 . 2 . . . A 43 SER HB2 . 30155 1 478 . 1 1 43 43 SER HB3 H 1 4.101 0.013 . 2 . . . A 43 SER HB3 . 30155 1 479 . 1 1 43 43 SER C C 13 174.410 0.000 . 1 . . . A 43 SER C . 30155 1 480 . 1 1 43 43 SER CA C 13 60.790 0.119 . 1 . . . A 43 SER CA . 30155 1 481 . 1 1 43 43 SER CB C 13 62.911 0.151 . 1 . . . A 43 SER CB . 30155 1 482 . 1 1 43 43 SER N N 15 121.383 0.063 . 1 . . . A 43 SER N . 30155 1 483 . 1 1 44 44 SER H H 1 7.282 0.005 . 1 . . . A 44 SER H . 30155 1 484 . 1 1 44 44 SER HA H 1 4.141 0.009 . 1 . . . A 44 SER HA . 30155 1 485 . 1 1 44 44 SER HB2 H 1 3.912 0.013 . 2 . . . A 44 SER HB2 . 30155 1 486 . 1 1 44 44 SER HB3 H 1 3.859 0.012 . 2 . . . A 44 SER HB3 . 30155 1 487 . 1 1 44 44 SER C C 13 174.898 0.000 . 1 . . . A 44 SER C . 30155 1 488 . 1 1 44 44 SER CA C 13 60.810 0.046 . 1 . . . A 44 SER CA . 30155 1 489 . 1 1 44 44 SER CB C 13 62.873 0.142 . 1 . . . A 44 SER CB . 30155 1 490 . 1 1 44 44 SER N N 15 115.753 0.072 . 1 . . . A 44 SER N . 30155 1 491 . 1 1 45 45 ILE H H 1 7.064 0.007 . 1 . . . A 45 ILE H . 30155 1 492 . 1 1 45 45 ILE HA H 1 3.961 0.012 . 1 . . . A 45 ILE HA . 30155 1 493 . 1 1 45 45 ILE HB H 1 2.055 0.008 . 1 . . . A 45 ILE HB . 30155 1 494 . 1 1 45 45 ILE HG12 H 1 1.443 0.015 . 2 . . . A 45 ILE HG12 . 30155 1 495 . 1 1 45 45 ILE HG13 H 1 1.177 0.013 . 2 . . . A 45 ILE HG13 . 30155 1 496 . 1 1 45 45 ILE HG21 H 1 0.639 0.008 . 1 . . . A 45 ILE HG21 . 30155 1 497 . 1 1 45 45 ILE HG22 H 1 0.639 0.008 . 1 . . . A 45 ILE HG22 . 30155 1 498 . 1 1 45 45 ILE HG23 H 1 0.639 0.008 . 1 . . . A 45 ILE HG23 . 30155 1 499 . 1 1 45 45 ILE HD11 H 1 0.529 0.013 . 1 . . . A 45 ILE HD11 . 30155 1 500 . 1 1 45 45 ILE HD12 H 1 0.529 0.013 . 1 . . . A 45 ILE HD12 . 30155 1 501 . 1 1 45 45 ILE HD13 H 1 0.529 0.013 . 1 . . . A 45 ILE HD13 . 30155 1 502 . 1 1 45 45 ILE C C 13 175.540 0.000 . 1 . . . A 45 ILE C . 30155 1 503 . 1 1 45 45 ILE CA C 13 60.217 0.044 . 1 . . . A 45 ILE CA . 30155 1 504 . 1 1 45 45 ILE CB C 13 37.609 0.039 . 1 . . . A 45 ILE CB . 30155 1 505 . 1 1 45 45 ILE CG1 C 13 27.336 0.113 . 1 . . . A 45 ILE CG1 . 30155 1 506 . 1 1 45 45 ILE CG2 C 13 17.696 0.034 . 1 . . . A 45 ILE CG2 . 30155 1 507 . 1 1 45 45 ILE CD1 C 13 9.463 0.042 . 1 . . . A 45 ILE CD1 . 30155 1 508 . 1 1 45 45 ILE N N 15 120.016 0.035 . 1 . . . A 45 ILE N . 30155 1 509 . 1 1 46 46 GLY H H 1 7.102 0.012 . 1 . . . A 46 GLY H . 30155 1 510 . 1 1 46 46 GLY HA2 H 1 3.956 0.004 . 1 . . . A 46 GLY HA2 . 30155 1 511 . 1 1 46 46 GLY HA3 H 1 3.952 0.009 . 1 . . . A 46 GLY HA3 . 30155 1 512 . 1 1 46 46 GLY C C 13 171.011 0.000 . 1 . . . A 46 GLY C . 30155 1 513 . 1 1 46 46 GLY CA C 13 44.592 0.031 . 1 . . . A 46 GLY CA . 30155 1 514 . 1 1 46 46 GLY N N 15 104.593 0.059 . 1 . . . A 46 GLY N . 30155 1 515 . 1 1 47 47 GLU H H 1 8.182 0.005 . 1 . . . A 47 GLU H . 30155 1 516 . 1 1 47 47 GLU HA H 1 4.182 0.005 . 1 . . . A 47 GLU HA . 30155 1 517 . 1 1 47 47 GLU HB2 H 1 1.968 0.012 . 1 . . . A 47 GLU HB2 . 30155 1 518 . 1 1 47 47 GLU HB3 H 1 1.971 0.010 . 1 . . . A 47 GLU HB3 . 30155 1 519 . 1 1 47 47 GLU HG2 H 1 2.100 0.001 . 2 . . . A 47 GLU HG2 . 30155 1 520 . 1 1 47 47 GLU HG3 H 1 2.274 0.009 . 2 . . . A 47 GLU HG3 . 30155 1 521 . 1 1 47 47 GLU C C 13 176.616 0.000 . 1 . . . A 47 GLU C . 30155 1 522 . 1 1 47 47 GLU CA C 13 57.950 0.058 . 1 . . . A 47 GLU CA . 30155 1 523 . 1 1 47 47 GLU CB C 13 29.860 0.070 . 1 . . . A 47 GLU CB . 30155 1 524 . 1 1 47 47 GLU CG C 13 36.085 0.037 . 1 . . . A 47 GLU CG . 30155 1 525 . 1 1 47 47 GLU N N 15 117.160 0.039 . 1 . . . A 47 GLU N . 30155 1 526 . 1 1 48 48 VAL H H 1 8.905 0.006 . 1 . . . A 48 VAL H . 30155 1 527 . 1 1 48 48 VAL HA H 1 3.669 0.008 . 1 . . . A 48 VAL HA . 30155 1 528 . 1 1 48 48 VAL HB H 1 1.739 0.009 . 1 . . . A 48 VAL HB . 30155 1 529 . 1 1 48 48 VAL HG11 H 1 0.532 0.009 . 2 . . . A 48 VAL HG11 . 30155 1 530 . 1 1 48 48 VAL HG12 H 1 0.532 0.009 . 2 . . . A 48 VAL HG12 . 30155 1 531 . 1 1 48 48 VAL HG13 H 1 0.532 0.009 . 2 . . . A 48 VAL HG13 . 30155 1 532 . 1 1 48 48 VAL HG21 H 1 0.432 0.007 . 2 . . . A 48 VAL HG21 . 30155 1 533 . 1 1 48 48 VAL HG22 H 1 0.432 0.007 . 2 . . . A 48 VAL HG22 . 30155 1 534 . 1 1 48 48 VAL HG23 H 1 0.432 0.007 . 2 . . . A 48 VAL HG23 . 30155 1 535 . 1 1 48 48 VAL C C 13 175.651 0.000 . 1 . . . A 48 VAL C . 30155 1 536 . 1 1 48 48 VAL CA C 13 62.071 0.109 . 1 . . . A 48 VAL CA . 30155 1 537 . 1 1 48 48 VAL CB C 13 33.855 0.058 . 1 . . . A 48 VAL CB . 30155 1 538 . 1 1 48 48 VAL CG1 C 13 22.254 0.115 . 2 . . . A 48 VAL CG1 . 30155 1 539 . 1 1 48 48 VAL CG2 C 13 22.576 0.062 . 2 . . . A 48 VAL CG2 . 30155 1 540 . 1 1 48 48 VAL N N 15 129.092 0.036 . 1 . . . A 48 VAL N . 30155 1 541 . 1 1 49 49 GLU H H 1 9.164 0.005 . 1 . . . A 49 GLU H . 30155 1 542 . 1 1 49 49 GLU HA H 1 4.051 0.013 . 1 . . . A 49 GLU HA . 30155 1 543 . 1 1 49 49 GLU HB2 H 1 1.592 0.006 . 2 . . . A 49 GLU HB2 . 30155 1 544 . 1 1 49 49 GLU HB3 H 1 1.920 0.009 . 2 . . . A 49 GLU HB3 . 30155 1 545 . 1 1 49 49 GLU HG2 H 1 2.277 0.006 . 2 . . . A 49 GLU HG2 . 30155 1 546 . 1 1 49 49 GLU HG3 H 1 2.075 0.012 . 2 . . . A 49 GLU HG3 . 30155 1 547 . 1 1 49 49 GLU C C 13 176.281 0.000 . 1 . . . A 49 GLU C . 30155 1 548 . 1 1 49 49 GLU CA C 13 58.564 0.093 . 1 . . . A 49 GLU CA . 30155 1 549 . 1 1 49 49 GLU CB C 13 29.787 0.080 . 1 . . . A 49 GLU CB . 30155 1 550 . 1 1 49 49 GLU CG C 13 35.871 0.100 . 1 . . . A 49 GLU CG . 30155 1 551 . 1 1 49 49 GLU N N 15 130.869 0.056 . 1 . . . A 49 GLU N . 30155 1 552 . 1 1 50 50 SER H H 1 7.576 0.002 . 1 . . . A 50 SER H . 30155 1 553 . 1 1 50 50 SER HA H 1 4.344 0.007 . 1 . . . A 50 SER HA . 30155 1 554 . 1 1 50 50 SER HB2 H 1 3.558 0.003 . 2 . . . A 50 SER HB2 . 30155 1 555 . 1 1 50 50 SER HB3 H 1 3.799 0.002 . 2 . . . A 50 SER HB3 . 30155 1 556 . 1 1 50 50 SER C C 13 171.673 0.000 . 1 . . . A 50 SER C . 30155 1 557 . 1 1 50 50 SER CA C 13 57.593 0.147 . 1 . . . A 50 SER CA . 30155 1 558 . 1 1 50 50 SER CB C 13 64.890 0.087 . 1 . . . A 50 SER CB . 30155 1 559 . 1 1 50 50 SER N N 15 109.231 0.031 . 1 . . . A 50 SER N . 30155 1 560 . 1 1 51 51 ALA H H 1 8.086 0.010 . 1 . . . A 51 ALA H . 30155 1 561 . 1 1 51 51 ALA HA H 1 5.018 0.005 . 1 . . . A 51 ALA HA . 30155 1 562 . 1 1 51 51 ALA HB1 H 1 1.005 0.007 . 1 . . . A 51 ALA HB1 . 30155 1 563 . 1 1 51 51 ALA HB2 H 1 1.005 0.007 . 1 . . . A 51 ALA HB2 . 30155 1 564 . 1 1 51 51 ALA HB3 H 1 1.005 0.007 . 1 . . . A 51 ALA HB3 . 30155 1 565 . 1 1 51 51 ALA C C 13 174.823 0.000 . 1 . . . A 51 ALA C . 30155 1 566 . 1 1 51 51 ALA CA C 13 50.914 0.134 . 1 . . . A 51 ALA CA . 30155 1 567 . 1 1 51 51 ALA CB C 13 20.806 0.083 . 1 . . . A 51 ALA CB . 30155 1 568 . 1 1 51 51 ALA N N 15 123.120 0.044 . 1 . . . A 51 ALA N . 30155 1 569 . 1 1 52 52 LYS H H 1 8.904 0.009 . 1 . . . A 52 LYS H . 30155 1 570 . 1 1 52 52 LYS HA H 1 4.563 0.008 . 1 . . . A 52 LYS HA . 30155 1 571 . 1 1 52 52 LYS HB2 H 1 1.588 0.016 . 2 . . . A 52 LYS HB2 . 30155 1 572 . 1 1 52 52 LYS HB3 H 1 1.685 0.005 . 2 . . . A 52 LYS HB3 . 30155 1 573 . 1 1 52 52 LYS HG2 H 1 1.556 0.005 . 1 . . . A 52 LYS HG2 . 30155 1 574 . 1 1 52 52 LYS HG3 H 1 1.556 0.005 . 1 . . . A 52 LYS HG3 . 30155 1 575 . 1 1 52 52 LYS HD2 H 1 1.239 0.016 . 2 . . . A 52 LYS HD2 . 30155 1 576 . 1 1 52 52 LYS HD3 H 1 1.236 0.014 . 2 . . . A 52 LYS HD3 . 30155 1 577 . 1 1 52 52 LYS HE2 H 1 2.815 0.005 . 1 . . . A 52 LYS HE2 . 30155 1 578 . 1 1 52 52 LYS HE3 H 1 2.815 0.005 . 1 . . . A 52 LYS HE3 . 30155 1 579 . 1 1 52 52 LYS C C 13 173.842 0.000 . 1 . . . A 52 LYS C . 30155 1 580 . 1 1 52 52 LYS CA C 13 54.345 0.018 . 1 . . . A 52 LYS CA . 30155 1 581 . 1 1 52 52 LYS CB C 13 36.260 0.138 . 1 . . . A 52 LYS CB . 30155 1 582 . 1 1 52 52 LYS CG C 13 29.273 0.024 . 1 . . . A 52 LYS CG . 30155 1 583 . 1 1 52 52 LYS CD C 13 24.445 0.090 . 1 . . . A 52 LYS CD . 30155 1 584 . 1 1 52 52 LYS CE C 13 42.087 0.120 . 1 . . . A 52 LYS CE . 30155 1 585 . 1 1 52 52 LYS N N 15 122.469 0.029 . 1 . . . A 52 LYS N . 30155 1 586 . 1 1 53 53 LEU H H 1 8.671 0.009 . 1 . . . A 53 LEU H . 30155 1 587 . 1 1 53 53 LEU HA H 1 4.341 0.009 . 1 . . . A 53 LEU HA . 30155 1 588 . 1 1 53 53 LEU HB2 H 1 0.990 0.008 . 2 . . . A 53 LEU HB2 . 30155 1 589 . 1 1 53 53 LEU HB3 H 1 1.649 0.009 . 2 . . . A 53 LEU HB3 . 30155 1 590 . 1 1 53 53 LEU HG H 1 1.259 0.017 . 1 . . . A 53 LEU HG . 30155 1 591 . 1 1 53 53 LEU HD11 H 1 0.615 0.011 . 2 . . . A 53 LEU HD11 . 30155 1 592 . 1 1 53 53 LEU HD12 H 1 0.615 0.011 . 2 . . . A 53 LEU HD12 . 30155 1 593 . 1 1 53 53 LEU HD13 H 1 0.615 0.011 . 2 . . . A 53 LEU HD13 . 30155 1 594 . 1 1 53 53 LEU HD21 H 1 0.660 0.020 . 2 . . . A 53 LEU HD21 . 30155 1 595 . 1 1 53 53 LEU HD22 H 1 0.660 0.020 . 2 . . . A 53 LEU HD22 . 30155 1 596 . 1 1 53 53 LEU HD23 H 1 0.660 0.020 . 2 . . . A 53 LEU HD23 . 30155 1 597 . 1 1 53 53 LEU C C 13 175.592 0.000 . 1 . . . A 53 LEU C . 30155 1 598 . 1 1 53 53 LEU CA C 13 53.870 0.034 . 1 . . . A 53 LEU CA . 30155 1 599 . 1 1 53 53 LEU CB C 13 44.816 0.059 . 1 . . . A 53 LEU CB . 30155 1 600 . 1 1 53 53 LEU CG C 13 27.293 0.061 . 1 . . . A 53 LEU CG . 30155 1 601 . 1 1 53 53 LEU CD1 C 13 24.347 0.021 . 2 . . . A 53 LEU CD1 . 30155 1 602 . 1 1 53 53 LEU CD2 C 13 25.682 0.000 . 2 . . . A 53 LEU CD2 . 30155 1 603 . 1 1 53 53 LEU N N 15 126.565 0.043 . 1 . . . A 53 LEU N . 30155 1 604 . 1 1 54 54 ILE H H 1 8.225 0.009 . 1 . . . A 54 ILE H . 30155 1 605 . 1 1 54 54 ILE HA H 1 4.006 0.013 . 1 . . . A 54 ILE HA . 30155 1 606 . 1 1 54 54 ILE HB H 1 0.985 0.016 . 1 . . . A 54 ILE HB . 30155 1 607 . 1 1 54 54 ILE HG12 H 1 1.077 0.016 . 1 . . . A 54 ILE HG12 . 30155 1 608 . 1 1 54 54 ILE HG13 H 1 1.070 0.002 . 1 . . . A 54 ILE HG13 . 30155 1 609 . 1 1 54 54 ILE HG21 H 1 0.690 0.004 . 1 . . . A 54 ILE HG21 . 30155 1 610 . 1 1 54 54 ILE HG22 H 1 0.690 0.004 . 1 . . . A 54 ILE HG22 . 30155 1 611 . 1 1 54 54 ILE HG23 H 1 0.690 0.004 . 1 . . . A 54 ILE HG23 . 30155 1 612 . 1 1 54 54 ILE HD11 H 1 0.605 0.013 . 1 . . . A 54 ILE HD11 . 30155 1 613 . 1 1 54 54 ILE HD12 H 1 0.605 0.013 . 1 . . . A 54 ILE HD12 . 30155 1 614 . 1 1 54 54 ILE HD13 H 1 0.605 0.013 . 1 . . . A 54 ILE HD13 . 30155 1 615 . 1 1 54 54 ILE C C 13 174.321 0.000 . 1 . . . A 54 ILE C . 30155 1 616 . 1 1 54 54 ILE CA C 13 59.565 0.101 . 1 . . . A 54 ILE CA . 30155 1 617 . 1 1 54 54 ILE CB C 13 34.295 0.073 . 1 . . . A 54 ILE CB . 30155 1 618 . 1 1 54 54 ILE CG1 C 13 26.953 0.093 . 1 . . . A 54 ILE CG1 . 30155 1 619 . 1 1 54 54 ILE CG2 C 13 17.630 0.057 . 1 . . . A 54 ILE CG2 . 30155 1 620 . 1 1 54 54 ILE CD1 C 13 8.973 0.030 . 1 . . . A 54 ILE CD1 . 30155 1 621 . 1 1 54 54 ILE N N 15 127.501 0.037 . 1 . . . A 54 ILE N . 30155 1 622 . 1 1 55 55 ARG H H 1 8.077 0.002 . 1 . . . A 55 ARG H . 30155 1 623 . 1 1 55 55 ARG HA H 1 4.794 0.012 . 1 . . . A 55 ARG HA . 30155 1 624 . 1 1 55 55 ARG HB2 H 1 1.396 0.011 . 1 . . . A 55 ARG HB2 . 30155 1 625 . 1 1 55 55 ARG HB3 H 1 1.392 0.013 . 1 . . . A 55 ARG HB3 . 30155 1 626 . 1 1 55 55 ARG HG2 H 1 1.223 0.018 . 1 . . . A 55 ARG HG2 . 30155 1 627 . 1 1 55 55 ARG HG3 H 1 1.228 0.012 . 1 . . . A 55 ARG HG3 . 30155 1 628 . 1 1 55 55 ARG HD2 H 1 3.099 0.005 . 1 . . . A 55 ARG HD2 . 30155 1 629 . 1 1 55 55 ARG HD3 H 1 3.097 0.006 . 1 . . . A 55 ARG HD3 . 30155 1 630 . 1 1 55 55 ARG C C 13 175.777 0.000 . 1 . . . A 55 ARG C . 30155 1 631 . 1 1 55 55 ARG CA C 13 53.894 0.012 . 1 . . . A 55 ARG CA . 30155 1 632 . 1 1 55 55 ARG CB C 13 33.540 0.063 . 1 . . . A 55 ARG CB . 30155 1 633 . 1 1 55 55 ARG CG C 13 27.493 0.091 . 1 . . . A 55 ARG CG . 30155 1 634 . 1 1 55 55 ARG CD C 13 43.067 0.141 . 1 . . . A 55 ARG CD . 30155 1 635 . 1 1 55 55 ARG N N 15 125.006 0.019 . 1 . . . A 55 ARG N . 30155 1 636 . 1 1 56 56 ASP H H 1 8.540 0.006 . 1 . . . A 56 ASP H . 30155 1 637 . 1 1 56 56 ASP HA H 1 4.451 0.004 . 1 . . . A 56 ASP HA . 30155 1 638 . 1 1 56 56 ASP HB2 H 1 2.422 0.013 . 2 . . . A 56 ASP HB2 . 30155 1 639 . 1 1 56 56 ASP HB3 H 1 2.345 0.015 . 2 . . . A 56 ASP HB3 . 30155 1 640 . 1 1 56 56 ASP C C 13 176.991 0.000 . 1 . . . A 56 ASP C . 30155 1 641 . 1 1 56 56 ASP CA C 13 54.193 0.067 . 1 . . . A 56 ASP CA . 30155 1 642 . 1 1 56 56 ASP CB C 13 42.735 0.029 . 1 . . . A 56 ASP CB . 30155 1 643 . 1 1 56 56 ASP N N 15 121.881 0.073 . 1 . . . A 56 ASP N . 30155 1 644 . 1 1 57 57 LYS H H 1 8.632 0.008 . 1 . . . A 57 LYS H . 30155 1 645 . 1 1 57 57 LYS HA H 1 4.052 0.014 . 1 . . . A 57 LYS HA . 30155 1 646 . 1 1 57 57 LYS HB2 H 1 1.774 0.010 . 2 . . . A 57 LYS HB2 . 30155 1 647 . 1 1 57 57 LYS HB3 H 1 1.823 0.013 . 2 . . . A 57 LYS HB3 . 30155 1 648 . 1 1 57 57 LYS HG2 H 1 1.397 0.020 . 1 . . . A 57 LYS HG2 . 30155 1 649 . 1 1 57 57 LYS HG3 H 1 1.396 0.022 . 1 . . . A 57 LYS HG3 . 30155 1 650 . 1 1 57 57 LYS HD2 H 1 1.619 0.011 . 1 . . . A 57 LYS HD2 . 30155 1 651 . 1 1 57 57 LYS HD3 H 1 1.618 0.011 . 1 . . . A 57 LYS HD3 . 30155 1 652 . 1 1 57 57 LYS HE2 H 1 2.920 0.015 . 1 . . . A 57 LYS HE2 . 30155 1 653 . 1 1 57 57 LYS HE3 H 1 2.920 0.015 . 1 . . . A 57 LYS HE3 . 30155 1 654 . 1 1 57 57 LYS C C 13 176.755 0.000 . 1 . . . A 57 LYS C . 30155 1 655 . 1 1 57 57 LYS CA C 13 58.019 0.118 . 1 . . . A 57 LYS CA . 30155 1 656 . 1 1 57 57 LYS CB C 13 32.752 0.121 . 1 . . . A 57 LYS CB . 30155 1 657 . 1 1 57 57 LYS CG C 13 24.723 0.184 . 1 . . . A 57 LYS CG . 30155 1 658 . 1 1 57 57 LYS CD C 13 28.933 0.119 . 1 . . . A 57 LYS CD . 30155 1 659 . 1 1 57 57 LYS CE C 13 40.907 0.000 . 1 . . . A 57 LYS CE . 30155 1 660 . 1 1 57 57 LYS N N 15 124.141 0.039 . 1 . . . A 57 LYS N . 30155 1 661 . 1 1 58 58 VAL H H 1 8.084 0.004 . 1 . . . A 58 VAL H . 30155 1 662 . 1 1 58 58 VAL HA H 1 3.860 0.003 . 1 . . . A 58 VAL HA . 30155 1 663 . 1 1 58 58 VAL HB H 1 2.012 0.010 . 1 . . . A 58 VAL HB . 30155 1 664 . 1 1 58 58 VAL HG11 H 1 0.853 0.010 . 2 . . . A 58 VAL HG11 . 30155 1 665 . 1 1 58 58 VAL HG12 H 1 0.853 0.010 . 2 . . . A 58 VAL HG12 . 30155 1 666 . 1 1 58 58 VAL HG13 H 1 0.853 0.010 . 2 . . . A 58 VAL HG13 . 30155 1 667 . 1 1 58 58 VAL HG21 H 1 0.891 0.010 . 2 . . . A 58 VAL HG21 . 30155 1 668 . 1 1 58 58 VAL HG22 H 1 0.891 0.010 . 2 . . . A 58 VAL HG22 . 30155 1 669 . 1 1 58 58 VAL HG23 H 1 0.891 0.010 . 2 . . . A 58 VAL HG23 . 30155 1 670 . 1 1 58 58 VAL C C 13 176.856 0.000 . 1 . . . A 58 VAL C . 30155 1 671 . 1 1 58 58 VAL CA C 13 64.405 0.050 . 1 . . . A 58 VAL CA . 30155 1 672 . 1 1 58 58 VAL CB C 13 32.451 0.118 . 1 . . . A 58 VAL CB . 30155 1 673 . 1 1 58 58 VAL CG1 C 13 20.824 0.029 . 2 . . . A 58 VAL CG1 . 30155 1 674 . 1 1 58 58 VAL CG2 C 13 21.642 0.043 . 2 . . . A 58 VAL CG2 . 30155 1 675 . 1 1 58 58 VAL N N 15 119.864 0.019 . 1 . . . A 58 VAL N . 30155 1 676 . 1 1 59 59 ALA H H 1 8.779 0.007 . 1 . . . A 59 ALA H . 30155 1 677 . 1 1 59 59 ALA HA H 1 4.301 0.012 . 1 . . . A 59 ALA HA . 30155 1 678 . 1 1 59 59 ALA HB1 H 1 1.322 0.008 . 1 . . . A 59 ALA HB1 . 30155 1 679 . 1 1 59 59 ALA HB2 H 1 1.322 0.008 . 1 . . . A 59 ALA HB2 . 30155 1 680 . 1 1 59 59 ALA HB3 H 1 1.322 0.008 . 1 . . . A 59 ALA HB3 . 30155 1 681 . 1 1 59 59 ALA C C 13 178.827 0.000 . 1 . . . A 59 ALA C . 30155 1 682 . 1 1 59 59 ALA CA C 13 52.386 0.043 . 1 . . . A 59 ALA CA . 30155 1 683 . 1 1 59 59 ALA CB C 13 19.684 0.113 . 1 . . . A 59 ALA CB . 30155 1 684 . 1 1 59 59 ALA N N 15 122.914 0.060 . 1 . . . A 59 ALA N . 30155 1 685 . 1 1 60 60 GLY H H 1 7.764 0.010 . 1 . . . A 60 GLY H . 30155 1 686 . 1 1 60 60 GLY HA2 H 1 3.989 0.016 . 2 . . . A 60 GLY HA2 . 30155 1 687 . 1 1 60 60 GLY HA3 H 1 3.772 0.013 . 2 . . . A 60 GLY HA3 . 30155 1 688 . 1 1 60 60 GLY C C 13 174.316 0.000 . 1 . . . A 60 GLY C . 30155 1 689 . 1 1 60 60 GLY CA C 13 45.949 0.175 . 1 . . . A 60 GLY CA . 30155 1 690 . 1 1 60 60 GLY N N 15 105.850 0.018 . 1 . . . A 60 GLY N . 30155 1 691 . 1 1 61 61 HIS H H 1 7.708 0.013 . 1 . . . A 61 HIS H . 30155 1 692 . 1 1 61 61 HIS HA H 1 4.703 0.012 . 1 . . . A 61 HIS HA . 30155 1 693 . 1 1 61 61 HIS HB2 H 1 3.145 0.010 . 1 . . . A 61 HIS HB2 . 30155 1 694 . 1 1 61 61 HIS HB3 H 1 3.145 0.010 . 1 . . . A 61 HIS HB3 . 30155 1 695 . 1 1 61 61 HIS HD2 H 1 6.991 0.013 . 1 . . . A 61 HIS HD2 . 30155 1 696 . 1 1 61 61 HIS HE1 H 1 8.198 0.002 . 1 . . . A 61 HIS HE1 . 30155 1 697 . 1 1 61 61 HIS C C 13 174.724 0.000 . 1 . . . A 61 HIS C . 30155 1 698 . 1 1 61 61 HIS CA C 13 54.806 0.000 . 1 . . . A 61 HIS CA . 30155 1 699 . 1 1 61 61 HIS CB C 13 30.416 0.056 . 1 . . . A 61 HIS CB . 30155 1 700 . 1 1 61 61 HIS CD2 C 13 119.726 0.044 . 1 . . . A 61 HIS CD2 . 30155 1 701 . 1 1 61 61 HIS CE1 C 13 137.076 0.036 . 1 . . . A 61 HIS CE1 . 30155 1 702 . 1 1 61 61 HIS N N 15 117.545 0.046 . 1 . . . A 61 HIS N . 30155 1 703 . 1 1 62 62 SER H H 1 8.836 0.003 . 1 . . . A 62 SER H . 30155 1 704 . 1 1 62 62 SER HA H 1 4.284 0.014 . 1 . . . A 62 SER HA . 30155 1 705 . 1 1 62 62 SER HB2 H 1 3.974 0.009 . 1 . . . A 62 SER HB2 . 30155 1 706 . 1 1 62 62 SER HB3 H 1 3.974 0.009 . 1 . . . A 62 SER HB3 . 30155 1 707 . 1 1 62 62 SER C C 13 176.203 0.000 . 1 . . . A 62 SER C . 30155 1 708 . 1 1 62 62 SER CA C 13 58.359 0.061 . 1 . . . A 62 SER CA . 30155 1 709 . 1 1 62 62 SER CB C 13 64.180 0.058 . 1 . . . A 62 SER CB . 30155 1 710 . 1 1 62 62 SER N N 15 115.275 0.051 . 1 . . . A 62 SER N . 30155 1 711 . 1 1 63 63 LEU H H 1 8.976 0.005 . 1 . . . A 63 LEU H . 30155 1 712 . 1 1 63 63 LEU HA H 1 4.603 0.005 . 1 . . . A 63 LEU HA . 30155 1 713 . 1 1 63 63 LEU HB2 H 1 1.782 0.008 . 2 . . . A 63 LEU HB2 . 30155 1 714 . 1 1 63 63 LEU HB3 H 1 1.415 0.019 . 2 . . . A 63 LEU HB3 . 30155 1 715 . 1 1 63 63 LEU HG H 1 1.472 0.014 . 1 . . . A 63 LEU HG . 30155 1 716 . 1 1 63 63 LEU HD11 H 1 0.897 0.006 . 2 . . . A 63 LEU HD11 . 30155 1 717 . 1 1 63 63 LEU HD12 H 1 0.897 0.006 . 2 . . . A 63 LEU HD12 . 30155 1 718 . 1 1 63 63 LEU HD13 H 1 0.897 0.006 . 2 . . . A 63 LEU HD13 . 30155 1 719 . 1 1 63 63 LEU HD21 H 1 0.869 0.015 . 2 . . . A 63 LEU HD21 . 30155 1 720 . 1 1 63 63 LEU HD22 H 1 0.869 0.015 . 2 . . . A 63 LEU HD22 . 30155 1 721 . 1 1 63 63 LEU HD23 H 1 0.869 0.015 . 2 . . . A 63 LEU HD23 . 30155 1 722 . 1 1 63 63 LEU C C 13 178.274 0.000 . 1 . . . A 63 LEU C . 30155 1 723 . 1 1 63 63 LEU CA C 13 54.663 0.067 . 1 . . . A 63 LEU CA . 30155 1 724 . 1 1 63 63 LEU CB C 13 41.704 0.071 . 1 . . . A 63 LEU CB . 30155 1 725 . 1 1 63 63 LEU CG C 13 26.460 0.000 . 1 . . . A 63 LEU CG . 30155 1 726 . 1 1 63 63 LEU CD1 C 13 23.026 0.059 . 2 . . . A 63 LEU CD1 . 30155 1 727 . 1 1 63 63 LEU CD2 C 13 25.902 0.113 . 2 . . . A 63 LEU CD2 . 30155 1 728 . 1 1 63 63 LEU N N 15 125.759 0.031 . 1 . . . A 63 LEU N . 30155 1 729 . 1 1 64 64 GLY H H 1 9.109 0.008 . 1 . . . A 64 GLY H . 30155 1 730 . 1 1 64 64 GLY HA2 H 1 3.521 0.005 . 2 . . . A 64 GLY HA2 . 30155 1 731 . 1 1 64 64 GLY HA3 H 1 4.036 0.007 . 2 . . . A 64 GLY HA3 . 30155 1 732 . 1 1 64 64 GLY C C 13 171.979 0.000 . 1 . . . A 64 GLY C . 30155 1 733 . 1 1 64 64 GLY CA C 13 46.067 0.088 . 1 . . . A 64 GLY CA . 30155 1 734 . 1 1 64 64 GLY N N 15 108.121 0.047 . 1 . . . A 64 GLY N . 30155 1 735 . 1 1 65 65 TYR H H 1 7.361 0.007 . 1 . . . A 65 TYR H . 30155 1 736 . 1 1 65 65 TYR HA H 1 5.193 0.008 . 1 . . . A 65 TYR HA . 30155 1 737 . 1 1 65 65 TYR HB2 H 1 3.025 0.020 . 2 . . . A 65 TYR HB2 . 30155 1 738 . 1 1 65 65 TYR HB3 H 1 2.966 0.020 . 2 . . . A 65 TYR HB3 . 30155 1 739 . 1 1 65 65 TYR HD1 H 1 6.525 0.004 . 3 . . . A 65 TYR HD1 . 30155 1 740 . 1 1 65 65 TYR HD2 H 1 6.525 0.004 . 3 . . . A 65 TYR HD2 . 30155 1 741 . 1 1 65 65 TYR C C 13 172.274 0.000 . 1 . . . A 65 TYR C . 30155 1 742 . 1 1 65 65 TYR CA C 13 54.975 0.072 . 1 . . . A 65 TYR CA . 30155 1 743 . 1 1 65 65 TYR CB C 13 40.708 0.055 . 1 . . . A 65 TYR CB . 30155 1 744 . 1 1 65 65 TYR CD1 C 13 133.228 0.043 . 3 . . . A 65 TYR CD1 . 30155 1 745 . 1 1 65 65 TYR CD2 C 13 133.228 0.043 . 3 . . . A 65 TYR CD2 . 30155 1 746 . 1 1 65 65 TYR N N 15 113.628 0.079 . 1 . . . A 65 TYR N . 30155 1 747 . 1 1 66 66 GLY H H 1 8.596 0.015 . 1 . . . A 66 GLY H . 30155 1 748 . 1 1 66 66 GLY HA2 H 1 3.640 0.012 . 2 . . . A 66 GLY HA2 . 30155 1 749 . 1 1 66 66 GLY HA3 H 1 4.258 0.015 . 2 . . . A 66 GLY HA3 . 30155 1 750 . 1 1 66 66 GLY C C 13 169.920 0.000 . 1 . . . A 66 GLY C . 30155 1 751 . 1 1 66 66 GLY CA C 13 44.986 0.100 . 1 . . . A 66 GLY CA . 30155 1 752 . 1 1 66 66 GLY N N 15 104.947 0.030 . 1 . . . A 66 GLY N . 30155 1 753 . 1 1 67 67 PHE H H 1 8.713 0.010 . 1 . . . A 67 PHE H . 30155 1 754 . 1 1 67 67 PHE HA H 1 5.542 0.004 . 1 . . . A 67 PHE HA . 30155 1 755 . 1 1 67 67 PHE HB2 H 1 3.203 0.013 . 2 . . . A 67 PHE HB2 . 30155 1 756 . 1 1 67 67 PHE HB3 H 1 2.469 0.007 . 2 . . . A 67 PHE HB3 . 30155 1 757 . 1 1 67 67 PHE HD1 H 1 7.017 0.011 . 3 . . . A 67 PHE HD1 . 30155 1 758 . 1 1 67 67 PHE HD2 H 1 7.017 0.011 . 3 . . . A 67 PHE HD2 . 30155 1 759 . 1 1 67 67 PHE HE1 H 1 7.276 0.010 . 3 . . . A 67 PHE HE1 . 30155 1 760 . 1 1 67 67 PHE HE2 H 1 7.276 0.010 . 3 . . . A 67 PHE HE2 . 30155 1 761 . 1 1 67 67 PHE C C 13 175.686 0.000 . 1 . . . A 67 PHE C . 30155 1 762 . 1 1 67 67 PHE CA C 13 56.035 0.055 . 1 . . . A 67 PHE CA . 30155 1 763 . 1 1 67 67 PHE CB C 13 42.663 0.068 . 1 . . . A 67 PHE CB . 30155 1 764 . 1 1 67 67 PHE CD1 C 13 131.265 0.109 . 3 . . . A 67 PHE CD1 . 30155 1 765 . 1 1 67 67 PHE CD2 C 13 131.265 0.109 . 3 . . . A 67 PHE CD2 . 30155 1 766 . 1 1 67 67 PHE CE1 C 13 131.461 0.033 . 3 . . . A 67 PHE CE1 . 30155 1 767 . 1 1 67 67 PHE CE2 C 13 131.461 0.033 . 3 . . . A 67 PHE CE2 . 30155 1 768 . 1 1 67 67 PHE N N 15 116.557 0.058 . 1 . . . A 67 PHE N . 30155 1 769 . 1 1 68 68 VAL H H 1 8.575 0.008 . 1 . . . A 68 VAL H . 30155 1 770 . 1 1 68 68 VAL HA H 1 4.259 0.010 . 1 . . . A 68 VAL HA . 30155 1 771 . 1 1 68 68 VAL HB H 1 1.152 0.011 . 1 . . . A 68 VAL HB . 30155 1 772 . 1 1 68 68 VAL HG11 H 1 -0.167 0.005 . 2 . . . A 68 VAL HG11 . 30155 1 773 . 1 1 68 68 VAL HG12 H 1 -0.167 0.005 . 2 . . . A 68 VAL HG12 . 30155 1 774 . 1 1 68 68 VAL HG13 H 1 -0.167 0.005 . 2 . . . A 68 VAL HG13 . 30155 1 775 . 1 1 68 68 VAL HG21 H 1 0.264 0.008 . 2 . . . A 68 VAL HG21 . 30155 1 776 . 1 1 68 68 VAL HG22 H 1 0.264 0.008 . 2 . . . A 68 VAL HG22 . 30155 1 777 . 1 1 68 68 VAL HG23 H 1 0.264 0.008 . 2 . . . A 68 VAL HG23 . 30155 1 778 . 1 1 68 68 VAL C C 13 172.431 0.000 . 1 . . . A 68 VAL C . 30155 1 779 . 1 1 68 68 VAL CA C 13 61.356 0.120 . 1 . . . A 68 VAL CA . 30155 1 780 . 1 1 68 68 VAL CB C 13 35.632 0.097 . 1 . . . A 68 VAL CB . 30155 1 781 . 1 1 68 68 VAL CG1 C 13 19.686 0.065 . 2 . . . A 68 VAL CG1 . 30155 1 782 . 1 1 68 68 VAL CG2 C 13 21.146 0.084 . 2 . . . A 68 VAL CG2 . 30155 1 783 . 1 1 68 68 VAL N N 15 122.931 0.090 . 1 . . . A 68 VAL N . 30155 1 784 . 1 1 69 69 ASN H H 1 8.747 0.009 . 1 . . . A 69 ASN H . 30155 1 785 . 1 1 69 69 ASN HA H 1 5.783 0.007 . 1 . . . A 69 ASN HA . 30155 1 786 . 1 1 69 69 ASN HB2 H 1 2.567 0.011 . 2 . . . A 69 ASN HB2 . 30155 1 787 . 1 1 69 69 ASN HB3 H 1 2.759 0.010 . 2 . . . A 69 ASN HB3 . 30155 1 788 . 1 1 69 69 ASN HD21 H 1 7.680 0.013 . 1 . . . A 69 ASN HD21 . 30155 1 789 . 1 1 69 69 ASN HD22 H 1 6.457 0.009 . 1 . . . A 69 ASN HD22 . 30155 1 790 . 1 1 69 69 ASN C C 13 175.839 0.000 . 1 . . . A 69 ASN C . 30155 1 791 . 1 1 69 69 ASN CA C 13 51.238 0.020 . 1 . . . A 69 ASN CA . 30155 1 792 . 1 1 69 69 ASN CB C 13 40.368 0.096 . 1 . . . A 69 ASN CB . 30155 1 793 . 1 1 69 69 ASN N N 15 125.329 0.056 . 1 . . . A 69 ASN N . 30155 1 794 . 1 1 69 69 ASN ND2 N 15 112.601 0.039 . 1 . . . A 69 ASN ND2 . 30155 1 795 . 1 1 70 70 TYR H H 1 8.564 0.007 . 1 . . . A 70 TYR H . 30155 1 796 . 1 1 70 70 TYR HA H 1 4.503 0.006 . 1 . . . A 70 TYR HA . 30155 1 797 . 1 1 70 70 TYR HB2 H 1 3.641 0.017 . 2 . . . A 70 TYR HB2 . 30155 1 798 . 1 1 70 70 TYR HB3 H 1 2.653 0.011 . 2 . . . A 70 TYR HB3 . 30155 1 799 . 1 1 70 70 TYR HD1 H 1 7.078 0.012 . 3 . . . A 70 TYR HD1 . 30155 1 800 . 1 1 70 70 TYR HD2 H 1 7.078 0.012 . 3 . . . A 70 TYR HD2 . 30155 1 801 . 1 1 70 70 TYR C C 13 174.582 0.000 . 1 . . . A 70 TYR C . 30155 1 802 . 1 1 70 70 TYR CA C 13 60.627 0.127 . 1 . . . A 70 TYR CA . 30155 1 803 . 1 1 70 70 TYR CB C 13 40.686 0.071 . 1 . . . A 70 TYR CB . 30155 1 804 . 1 1 70 70 TYR CD1 C 13 132.948 0.262 . 3 . . . A 70 TYR CD1 . 30155 1 805 . 1 1 70 70 TYR CD2 C 13 132.948 0.262 . 3 . . . A 70 TYR CD2 . 30155 1 806 . 1 1 70 70 TYR N N 15 125.899 0.022 . 1 . . . A 70 TYR N . 30155 1 807 . 1 1 71 71 VAL H H 1 7.752 0.003 . 1 . . . A 71 VAL H . 30155 1 808 . 1 1 71 71 VAL HA H 1 3.711 0.014 . 1 . . . A 71 VAL HA . 30155 1 809 . 1 1 71 71 VAL HB H 1 2.203 0.005 . 1 . . . A 71 VAL HB . 30155 1 810 . 1 1 71 71 VAL HG11 H 1 0.928 0.002 . 2 . . . A 71 VAL HG11 . 30155 1 811 . 1 1 71 71 VAL HG12 H 1 0.928 0.002 . 2 . . . A 71 VAL HG12 . 30155 1 812 . 1 1 71 71 VAL HG13 H 1 0.928 0.002 . 2 . . . A 71 VAL HG13 . 30155 1 813 . 1 1 71 71 VAL HG21 H 1 0.838 0.008 . 2 . . . A 71 VAL HG21 . 30155 1 814 . 1 1 71 71 VAL HG22 H 1 0.838 0.008 . 2 . . . A 71 VAL HG22 . 30155 1 815 . 1 1 71 71 VAL HG23 H 1 0.838 0.008 . 2 . . . A 71 VAL HG23 . 30155 1 816 . 1 1 71 71 VAL C C 13 176.917 0.000 . 1 . . . A 71 VAL C . 30155 1 817 . 1 1 71 71 VAL CA C 13 66.447 0.097 . 1 . . . A 71 VAL CA . 30155 1 818 . 1 1 71 71 VAL CB C 13 31.764 0.039 . 1 . . . A 71 VAL CB . 30155 1 819 . 1 1 71 71 VAL CG1 C 13 21.367 0.035 . 2 . . . A 71 VAL CG1 . 30155 1 820 . 1 1 71 71 VAL CG2 C 13 22.910 0.095 . 2 . . . A 71 VAL CG2 . 30155 1 821 . 1 1 71 71 VAL N N 15 118.397 0.039 . 1 . . . A 71 VAL N . 30155 1 822 . 1 1 72 72 THR H H 1 8.943 0.013 . 1 . . . A 72 THR H . 30155 1 823 . 1 1 72 72 THR HA H 1 4.764 0.014 . 1 . . . A 72 THR HA . 30155 1 824 . 1 1 72 72 THR HB H 1 4.349 0.009 . 1 . . . A 72 THR HB . 30155 1 825 . 1 1 72 72 THR HG21 H 1 1.239 0.009 . 1 . . . A 72 THR HG21 . 30155 1 826 . 1 1 72 72 THR HG22 H 1 1.239 0.009 . 1 . . . A 72 THR HG22 . 30155 1 827 . 1 1 72 72 THR HG23 H 1 1.239 0.009 . 1 . . . A 72 THR HG23 . 30155 1 828 . 1 1 72 72 THR C C 13 174.684 0.000 . 1 . . . A 72 THR C . 30155 1 829 . 1 1 72 72 THR CA C 13 59.428 0.054 . 1 . . . A 72 THR CA . 30155 1 830 . 1 1 72 72 THR CB C 13 71.491 0.094 . 1 . . . A 72 THR CB . 30155 1 831 . 1 1 72 72 THR CG2 C 13 21.880 0.148 . 1 . . . A 72 THR CG2 . 30155 1 832 . 1 1 72 72 THR N N 15 109.760 0.041 . 1 . . . A 72 THR N . 30155 1 833 . 1 1 73 73 ALA H H 1 8.755 0.003 . 1 . . . A 73 ALA H . 30155 1 834 . 1 1 73 73 ALA HA H 1 4.014 0.018 . 1 . . . A 73 ALA HA . 30155 1 835 . 1 1 73 73 ALA HB1 H 1 1.313 0.013 . 1 . . . A 73 ALA HB1 . 30155 1 836 . 1 1 73 73 ALA HB2 H 1 1.313 0.013 . 1 . . . A 73 ALA HB2 . 30155 1 837 . 1 1 73 73 ALA HB3 H 1 1.313 0.013 . 1 . . . A 73 ALA HB3 . 30155 1 838 . 1 1 73 73 ALA C C 13 180.562 0.000 . 1 . . . A 73 ALA C . 30155 1 839 . 1 1 73 73 ALA CA C 13 54.649 0.059 . 1 . . . A 73 ALA CA . 30155 1 840 . 1 1 73 73 ALA CB C 13 18.194 0.106 . 1 . . . A 73 ALA CB . 30155 1 841 . 1 1 73 73 ALA N N 15 126.860 0.018 . 1 . . . A 73 ALA N . 30155 1 842 . 1 1 74 74 LYS H H 1 8.354 0.005 . 1 . . . A 74 LYS H . 30155 1 843 . 1 1 74 74 LYS HA H 1 4.050 0.008 . 1 . . . A 74 LYS HA . 30155 1 844 . 1 1 74 74 LYS HB2 H 1 1.782 0.018 . 2 . . . A 74 LYS HB2 . 30155 1 845 . 1 1 74 74 LYS HB3 H 1 1.688 0.003 . 2 . . . A 74 LYS HB3 . 30155 1 846 . 1 1 74 74 LYS HG2 H 1 1.384 0.019 . 1 . . . A 74 LYS HG2 . 30155 1 847 . 1 1 74 74 LYS HG3 H 1 1.383 0.019 . 1 . . . A 74 LYS HG3 . 30155 1 848 . 1 1 74 74 LYS HD2 H 1 1.623 0.013 . 1 . . . A 74 LYS HD2 . 30155 1 849 . 1 1 74 74 LYS HD3 H 1 1.626 0.013 . 1 . . . A 74 LYS HD3 . 30155 1 850 . 1 1 74 74 LYS HE2 H 1 2.907 0.005 . 1 . . . A 74 LYS HE2 . 30155 1 851 . 1 1 74 74 LYS HE3 H 1 2.907 0.005 . 1 . . . A 74 LYS HE3 . 30155 1 852 . 1 1 74 74 LYS C C 13 178.825 0.000 . 1 . . . A 74 LYS C . 30155 1 853 . 1 1 74 74 LYS CA C 13 58.659 0.130 . 1 . . . A 74 LYS CA . 30155 1 854 . 1 1 74 74 LYS CB C 13 31.806 0.073 . 1 . . . A 74 LYS CB . 30155 1 855 . 1 1 74 74 LYS CG C 13 24.587 0.161 . 1 . . . A 74 LYS CG . 30155 1 856 . 1 1 74 74 LYS CD C 13 28.922 0.138 . 1 . . . A 74 LYS CD . 30155 1 857 . 1 1 74 74 LYS CE C 13 42.059 0.034 . 1 . . . A 74 LYS CE . 30155 1 858 . 1 1 74 74 LYS N N 15 118.741 0.037 . 1 . . . A 74 LYS N . 30155 1 859 . 1 1 75 75 ASP H H 1 7.298 0.004 . 1 . . . A 75 ASP H . 30155 1 860 . 1 1 75 75 ASP HA H 1 4.126 0.004 . 1 . . . A 75 ASP HA . 30155 1 861 . 1 1 75 75 ASP HB2 H 1 1.776 0.011 . 2 . . . A 75 ASP HB2 . 30155 1 862 . 1 1 75 75 ASP HB3 H 1 2.579 0.012 . 2 . . . A 75 ASP HB3 . 30155 1 863 . 1 1 75 75 ASP C C 13 176.438 0.000 . 1 . . . A 75 ASP C . 30155 1 864 . 1 1 75 75 ASP CA C 13 56.839 0.054 . 1 . . . A 75 ASP CA . 30155 1 865 . 1 1 75 75 ASP CB C 13 39.662 0.076 . 1 . . . A 75 ASP CB . 30155 1 866 . 1 1 75 75 ASP N N 15 119.922 0.028 . 1 . . . A 75 ASP N . 30155 1 867 . 1 1 76 76 ALA H H 1 6.977 0.009 . 1 . . . A 76 ALA H . 30155 1 868 . 1 1 76 76 ALA HA H 1 3.676 0.007 . 1 . . . A 76 ALA HA . 30155 1 869 . 1 1 76 76 ALA HB1 H 1 1.671 0.008 . 1 . . . A 76 ALA HB1 . 30155 1 870 . 1 1 76 76 ALA HB2 H 1 1.671 0.008 . 1 . . . A 76 ALA HB2 . 30155 1 871 . 1 1 76 76 ALA HB3 H 1 1.671 0.008 . 1 . . . A 76 ALA HB3 . 30155 1 872 . 1 1 76 76 ALA C C 13 178.455 0.000 . 1 . . . A 76 ALA C . 30155 1 873 . 1 1 76 76 ALA CA C 13 55.410 0.032 . 1 . . . A 76 ALA CA . 30155 1 874 . 1 1 76 76 ALA CB C 13 18.061 0.030 . 1 . . . A 76 ALA CB . 30155 1 875 . 1 1 76 76 ALA N N 15 122.214 0.051 . 1 . . . A 76 ALA N . 30155 1 876 . 1 1 77 77 GLU H H 1 7.674 0.003 . 1 . . . A 77 GLU H . 30155 1 877 . 1 1 77 77 GLU HA H 1 3.823 0.009 . 1 . . . A 77 GLU HA . 30155 1 878 . 1 1 77 77 GLU HB2 H 1 2.066 0.009 . 1 . . . A 77 GLU HB2 . 30155 1 879 . 1 1 77 77 GLU HB3 H 1 2.065 0.008 . 1 . . . A 77 GLU HB3 . 30155 1 880 . 1 1 77 77 GLU HG2 H 1 2.126 0.014 . 2 . . . A 77 GLU HG2 . 30155 1 881 . 1 1 77 77 GLU HG3 H 1 2.310 0.011 . 2 . . . A 77 GLU HG3 . 30155 1 882 . 1 1 77 77 GLU C C 13 178.660 0.000 . 1 . . . A 77 GLU C . 30155 1 883 . 1 1 77 77 GLU CA C 13 59.252 0.128 . 1 . . . A 77 GLU CA . 30155 1 884 . 1 1 77 77 GLU CB C 13 29.787 0.051 . 1 . . . A 77 GLU CB . 30155 1 885 . 1 1 77 77 GLU CG C 13 36.050 0.038 . 1 . . . A 77 GLU CG . 30155 1 886 . 1 1 77 77 GLU N N 15 116.819 0.029 . 1 . . . A 77 GLU N . 30155 1 887 . 1 1 78 78 ARG H H 1 7.668 0.002 . 1 . . . A 78 ARG H . 30155 1 888 . 1 1 78 78 ARG HA H 1 3.995 0.005 . 1 . . . A 78 ARG HA . 30155 1 889 . 1 1 78 78 ARG HB2 H 1 1.744 0.015 . 1 . . . A 78 ARG HB2 . 30155 1 890 . 1 1 78 78 ARG HB3 H 1 1.748 0.014 . 1 . . . A 78 ARG HB3 . 30155 1 891 . 1 1 78 78 ARG HG2 H 1 1.514 0.012 . 1 . . . A 78 ARG HG2 . 30155 1 892 . 1 1 78 78 ARG HG3 H 1 1.514 0.012 . 1 . . . A 78 ARG HG3 . 30155 1 893 . 1 1 78 78 ARG HD2 H 1 3.128 0.015 . 2 . . . A 78 ARG HD2 . 30155 1 894 . 1 1 78 78 ARG HD3 H 1 3.204 0.019 . 2 . . . A 78 ARG HD3 . 30155 1 895 . 1 1 78 78 ARG C C 13 179.436 0.000 . 1 . . . A 78 ARG C . 30155 1 896 . 1 1 78 78 ARG CA C 13 59.250 0.082 . 1 . . . A 78 ARG CA . 30155 1 897 . 1 1 78 78 ARG CB C 13 29.942 0.117 . 1 . . . A 78 ARG CB . 30155 1 898 . 1 1 78 78 ARG CG C 13 28.200 0.080 . 1 . . . A 78 ARG CG . 30155 1 899 . 1 1 78 78 ARG CD C 13 43.391 0.063 . 1 . . . A 78 ARG CD . 30155 1 900 . 1 1 78 78 ARG N N 15 119.226 0.043 . 1 . . . A 78 ARG N . 30155 1 901 . 1 1 79 79 ALA H H 1 8.486 0.006 . 1 . . . A 79 ALA H . 30155 1 902 . 1 1 79 79 ALA HA H 1 3.742 0.006 . 1 . . . A 79 ALA HA . 30155 1 903 . 1 1 79 79 ALA HB1 H 1 1.609 0.009 . 1 . . . A 79 ALA HB1 . 30155 1 904 . 1 1 79 79 ALA HB2 H 1 1.609 0.009 . 1 . . . A 79 ALA HB2 . 30155 1 905 . 1 1 79 79 ALA HB3 H 1 1.609 0.009 . 1 . . . A 79 ALA HB3 . 30155 1 906 . 1 1 79 79 ALA C C 13 179.968 0.000 . 1 . . . A 79 ALA C . 30155 1 907 . 1 1 79 79 ALA CA C 13 56.021 0.027 . 1 . . . A 79 ALA CA . 30155 1 908 . 1 1 79 79 ALA CB C 13 19.167 0.033 . 1 . . . A 79 ALA CB . 30155 1 909 . 1 1 79 79 ALA N N 15 124.900 0.048 . 1 . . . A 79 ALA N . 30155 1 910 . 1 1 80 80 ILE H H 1 7.787 0.007 . 1 . . . A 80 ILE H . 30155 1 911 . 1 1 80 80 ILE HA H 1 3.236 0.004 . 1 . . . A 80 ILE HA . 30155 1 912 . 1 1 80 80 ILE HB H 1 1.712 0.012 . 1 . . . A 80 ILE HB . 30155 1 913 . 1 1 80 80 ILE HG12 H 1 0.368 0.009 . 2 . . . A 80 ILE HG12 . 30155 1 914 . 1 1 80 80 ILE HG13 H 1 1.442 0.009 . 2 . . . A 80 ILE HG13 . 30155 1 915 . 1 1 80 80 ILE HG21 H 1 0.766 0.006 . 1 . . . A 80 ILE HG21 . 30155 1 916 . 1 1 80 80 ILE HG22 H 1 0.766 0.006 . 1 . . . A 80 ILE HG22 . 30155 1 917 . 1 1 80 80 ILE HG23 H 1 0.766 0.006 . 1 . . . A 80 ILE HG23 . 30155 1 918 . 1 1 80 80 ILE HD11 H 1 -0.058 0.007 . 1 . . . A 80 ILE HD11 . 30155 1 919 . 1 1 80 80 ILE HD12 H 1 -0.058 0.007 . 1 . . . A 80 ILE HD12 . 30155 1 920 . 1 1 80 80 ILE HD13 H 1 -0.058 0.007 . 1 . . . A 80 ILE HD13 . 30155 1 921 . 1 1 80 80 ILE C C 13 177.962 0.000 . 1 . . . A 80 ILE C . 30155 1 922 . 1 1 80 80 ILE CA C 13 66.334 0.021 . 1 . . . A 80 ILE CA . 30155 1 923 . 1 1 80 80 ILE CB C 13 38.063 0.046 . 1 . . . A 80 ILE CB . 30155 1 924 . 1 1 80 80 ILE CG1 C 13 29.642 0.053 . 1 . . . A 80 ILE CG1 . 30155 1 925 . 1 1 80 80 ILE CG2 C 13 16.959 0.066 . 1 . . . A 80 ILE CG2 . 30155 1 926 . 1 1 80 80 ILE CD1 C 13 12.845 0.039 . 1 . . . A 80 ILE CD1 . 30155 1 927 . 1 1 80 80 ILE N N 15 119.216 0.046 . 1 . . . A 80 ILE N . 30155 1 928 . 1 1 81 81 ASN H H 1 7.650 0.010 . 1 . . . A 81 ASN H . 30155 1 929 . 1 1 81 81 ASN HA H 1 4.382 0.002 . 1 . . . A 81 ASN HA . 30155 1 930 . 1 1 81 81 ASN HB2 H 1 2.774 0.008 . 1 . . . A 81 ASN HB2 . 30155 1 931 . 1 1 81 81 ASN HB3 H 1 2.774 0.008 . 1 . . . A 81 ASN HB3 . 30155 1 932 . 1 1 81 81 ASN HD21 H 1 7.036 0.004 . 1 . . . A 81 ASN HD21 . 30155 1 933 . 1 1 81 81 ASN HD22 H 1 7.495 0.010 . 1 . . . A 81 ASN HD22 . 30155 1 934 . 1 1 81 81 ASN C C 13 176.895 0.000 . 1 . . . A 81 ASN C . 30155 1 935 . 1 1 81 81 ASN CA C 13 55.849 0.109 . 1 . . . A 81 ASN CA . 30155 1 936 . 1 1 81 81 ASN CB C 13 38.783 0.124 . 1 . . . A 81 ASN CB . 30155 1 937 . 1 1 81 81 ASN N N 15 114.706 0.043 . 1 . . . A 81 ASN N . 30155 1 938 . 1 1 81 81 ASN ND2 N 15 112.869 0.096 . 1 . . . A 81 ASN ND2 . 30155 1 939 . 1 1 82 82 THR H H 1 8.098 0.005 . 1 . . . A 82 THR H . 30155 1 940 . 1 1 82 82 THR HA H 1 4.214 0.002 . 1 . . . A 82 THR HA . 30155 1 941 . 1 1 82 82 THR HB H 1 3.833 0.008 . 1 . . . A 82 THR HB . 30155 1 942 . 1 1 82 82 THR HG21 H 1 1.079 0.004 . 1 . . . A 82 THR HG21 . 30155 1 943 . 1 1 82 82 THR HG22 H 1 1.079 0.004 . 1 . . . A 82 THR HG22 . 30155 1 944 . 1 1 82 82 THR HG23 H 1 1.079 0.004 . 1 . . . A 82 THR HG23 . 30155 1 945 . 1 1 82 82 THR C C 13 175.036 0.000 . 1 . . . A 82 THR C . 30155 1 946 . 1 1 82 82 THR CA C 13 64.869 0.100 . 1 . . . A 82 THR CA . 30155 1 947 . 1 1 82 82 THR CB C 13 70.355 0.120 . 1 . . . A 82 THR CB . 30155 1 948 . 1 1 82 82 THR CG2 C 13 21.211 0.053 . 1 . . . A 82 THR CG2 . 30155 1 949 . 1 1 82 82 THR N N 15 112.108 0.027 . 1 . . . A 82 THR N . 30155 1 950 . 1 1 83 83 LEU H H 1 8.589 0.008 . 1 . . . A 83 LEU H . 30155 1 951 . 1 1 83 83 LEU HA H 1 4.344 0.010 . 1 . . . A 83 LEU HA . 30155 1 952 . 1 1 83 83 LEU HB2 H 1 1.060 0.015 . 2 . . . A 83 LEU HB2 . 30155 1 953 . 1 1 83 83 LEU HB3 H 1 1.739 0.013 . 2 . . . A 83 LEU HB3 . 30155 1 954 . 1 1 83 83 LEU HG H 1 1.282 0.012 . 1 . . . A 83 LEU HG . 30155 1 955 . 1 1 83 83 LEU HD11 H 1 0.486 0.007 . 2 . . . A 83 LEU HD11 . 30155 1 956 . 1 1 83 83 LEU HD12 H 1 0.486 0.007 . 2 . . . A 83 LEU HD12 . 30155 1 957 . 1 1 83 83 LEU HD13 H 1 0.486 0.007 . 2 . . . A 83 LEU HD13 . 30155 1 958 . 1 1 83 83 LEU HD21 H 1 -0.093 0.005 . 2 . . . A 83 LEU HD21 . 30155 1 959 . 1 1 83 83 LEU HD22 H 1 -0.093 0.005 . 2 . . . A 83 LEU HD22 . 30155 1 960 . 1 1 83 83 LEU HD23 H 1 -0.093 0.005 . 2 . . . A 83 LEU HD23 . 30155 1 961 . 1 1 83 83 LEU C C 13 177.023 0.000 . 1 . . . A 83 LEU C . 30155 1 962 . 1 1 83 83 LEU CA C 13 55.075 0.087 . 1 . . . A 83 LEU CA . 30155 1 963 . 1 1 83 83 LEU CB C 13 42.510 0.054 . 1 . . . A 83 LEU CB . 30155 1 964 . 1 1 83 83 LEU CG C 13 27.201 0.070 . 1 . . . A 83 LEU CG . 30155 1 965 . 1 1 83 83 LEU CD1 C 13 22.909 0.053 . 2 . . . A 83 LEU CD1 . 30155 1 966 . 1 1 83 83 LEU CD2 C 13 25.377 0.054 . 2 . . . A 83 LEU CD2 . 30155 1 967 . 1 1 83 83 LEU N N 15 119.286 0.035 . 1 . . . A 83 LEU N . 30155 1 968 . 1 1 84 84 ASN H H 1 7.380 0.002 . 1 . . . A 84 ASN H . 30155 1 969 . 1 1 84 84 ASN HA H 1 4.312 0.009 . 1 . . . A 84 ASN HA . 30155 1 970 . 1 1 84 84 ASN HB2 H 1 3.057 0.018 . 2 . . . A 84 ASN HB2 . 30155 1 971 . 1 1 84 84 ASN HB3 H 1 2.989 0.011 . 2 . . . A 84 ASN HB3 . 30155 1 972 . 1 1 84 84 ASN HD21 H 1 7.781 0.007 . 1 . . . A 84 ASN HD21 . 30155 1 973 . 1 1 84 84 ASN HD22 H 1 6.995 0.006 . 1 . . . A 84 ASN HD22 . 30155 1 974 . 1 1 84 84 ASN C C 13 176.894 0.000 . 1 . . . A 84 ASN C . 30155 1 975 . 1 1 84 84 ASN CA C 13 56.577 0.131 . 1 . . . A 84 ASN CA . 30155 1 976 . 1 1 84 84 ASN CB C 13 39.341 0.042 . 1 . . . A 84 ASN CB . 30155 1 977 . 1 1 84 84 ASN N N 15 114.928 0.043 . 1 . . . A 84 ASN N . 30155 1 978 . 1 1 84 84 ASN ND2 N 15 114.749 0.123 . 1 . . . A 84 ASN ND2 . 30155 1 979 . 1 1 85 85 GLY H H 1 8.452 0.003 . 1 . . . A 85 GLY H . 30155 1 980 . 1 1 85 85 GLY HA2 H 1 4.123 0.005 . 2 . . . A 85 GLY HA2 . 30155 1 981 . 1 1 85 85 GLY HA3 H 1 3.525 0.005 . 2 . . . A 85 GLY HA3 . 30155 1 982 . 1 1 85 85 GLY C C 13 173.289 0.000 . 1 . . . A 85 GLY C . 30155 1 983 . 1 1 85 85 GLY CA C 13 45.676 0.081 . 1 . . . A 85 GLY CA . 30155 1 984 . 1 1 85 85 GLY N N 15 116.511 0.035 . 1 . . . A 85 GLY N . 30155 1 985 . 1 1 86 86 LEU H H 1 7.404 0.008 . 1 . . . A 86 LEU H . 30155 1 986 . 1 1 86 86 LEU HA H 1 3.959 0.005 . 1 . . . A 86 LEU HA . 30155 1 987 . 1 1 86 86 LEU HB2 H 1 1.533 0.012 . 2 . . . A 86 LEU HB2 . 30155 1 988 . 1 1 86 86 LEU HB3 H 1 1.611 0.015 . 2 . . . A 86 LEU HB3 . 30155 1 989 . 1 1 86 86 LEU HG H 1 1.403 0.015 . 1 . . . A 86 LEU HG . 30155 1 990 . 1 1 86 86 LEU HD11 H 1 0.869 0.013 . 2 . . . A 86 LEU HD11 . 30155 1 991 . 1 1 86 86 LEU HD12 H 1 0.869 0.013 . 2 . . . A 86 LEU HD12 . 30155 1 992 . 1 1 86 86 LEU HD13 H 1 0.869 0.013 . 2 . . . A 86 LEU HD13 . 30155 1 993 . 1 1 86 86 LEU HD21 H 1 0.764 0.014 . 2 . . . A 86 LEU HD21 . 30155 1 994 . 1 1 86 86 LEU HD22 H 1 0.764 0.014 . 2 . . . A 86 LEU HD22 . 30155 1 995 . 1 1 86 86 LEU HD23 H 1 0.764 0.014 . 2 . . . A 86 LEU HD23 . 30155 1 996 . 1 1 86 86 LEU C C 13 175.453 0.000 . 1 . . . A 86 LEU C . 30155 1 997 . 1 1 86 86 LEU CA C 13 55.900 0.131 . 1 . . . A 86 LEU CA . 30155 1 998 . 1 1 86 86 LEU CB C 13 43.221 0.071 . 1 . . . A 86 LEU CB . 30155 1 999 . 1 1 86 86 LEU CG C 13 26.260 0.000 . 1 . . . A 86 LEU CG . 30155 1 1000 . 1 1 86 86 LEU CD1 C 13 23.701 0.027 . 2 . . . A 86 LEU CD1 . 30155 1 1001 . 1 1 86 86 LEU CD2 C 13 26.788 0.041 . 2 . . . A 86 LEU CD2 . 30155 1 1002 . 1 1 86 86 LEU N N 15 123.551 0.031 . 1 . . . A 86 LEU N . 30155 1 1003 . 1 1 87 87 ARG H H 1 8.169 0.010 . 1 . . . A 87 ARG H . 30155 1 1004 . 1 1 87 87 ARG HA H 1 4.900 0.007 . 1 . . . A 87 ARG HA . 30155 1 1005 . 1 1 87 87 ARG HB2 H 1 1.628 0.013 . 2 . . . A 87 ARG HB2 . 30155 1 1006 . 1 1 87 87 ARG HB3 H 1 1.698 0.017 . 2 . . . A 87 ARG HB3 . 30155 1 1007 . 1 1 87 87 ARG HG2 H 1 1.421 0.011 . 1 . . . A 87 ARG HG2 . 30155 1 1008 . 1 1 87 87 ARG HG3 H 1 1.421 0.011 . 1 . . . A 87 ARG HG3 . 30155 1 1009 . 1 1 87 87 ARG HD2 H 1 3.053 0.010 . 1 . . . A 87 ARG HD2 . 30155 1 1010 . 1 1 87 87 ARG HD3 H 1 3.052 0.010 . 1 . . . A 87 ARG HD3 . 30155 1 1011 . 1 1 87 87 ARG C C 13 175.638 0.000 . 1 . . . A 87 ARG C . 30155 1 1012 . 1 1 87 87 ARG CA C 13 54.879 0.098 . 1 . . . A 87 ARG CA . 30155 1 1013 . 1 1 87 87 ARG CB C 13 30.018 0.080 . 1 . . . A 87 ARG CB . 30155 1 1014 . 1 1 87 87 ARG CG C 13 26.986 0.053 . 1 . . . A 87 ARG CG . 30155 1 1015 . 1 1 87 87 ARG CD C 13 43.247 0.037 . 1 . . . A 87 ARG CD . 30155 1 1016 . 1 1 87 87 ARG N N 15 125.939 0.039 . 1 . . . A 87 ARG N . 30155 1 1017 . 1 1 88 88 LEU H H 1 8.586 0.006 . 1 . . . A 88 LEU H . 30155 1 1018 . 1 1 88 88 LEU HA H 1 4.534 0.014 . 1 . . . A 88 LEU HA . 30155 1 1019 . 1 1 88 88 LEU HB2 H 1 1.400 0.009 . 1 . . . A 88 LEU HB2 . 30155 1 1020 . 1 1 88 88 LEU HB3 H 1 1.401 0.005 . 1 . . . A 88 LEU HB3 . 30155 1 1021 . 1 1 88 88 LEU HG H 1 1.397 0.013 . 1 . . . A 88 LEU HG . 30155 1 1022 . 1 1 88 88 LEU HD11 H 1 0.817 0.008 . 2 . . . A 88 LEU HD11 . 30155 1 1023 . 1 1 88 88 LEU HD12 H 1 0.817 0.008 . 2 . . . A 88 LEU HD12 . 30155 1 1024 . 1 1 88 88 LEU HD13 H 1 0.817 0.008 . 2 . . . A 88 LEU HD13 . 30155 1 1025 . 1 1 88 88 LEU HD21 H 1 0.795 0.018 . 2 . . . A 88 LEU HD21 . 30155 1 1026 . 1 1 88 88 LEU HD22 H 1 0.795 0.018 . 2 . . . A 88 LEU HD22 . 30155 1 1027 . 1 1 88 88 LEU HD23 H 1 0.795 0.018 . 2 . . . A 88 LEU HD23 . 30155 1 1028 . 1 1 88 88 LEU C C 13 175.142 0.000 . 1 . . . A 88 LEU C . 30155 1 1029 . 1 1 88 88 LEU CA C 13 53.567 0.030 . 1 . . . A 88 LEU CA . 30155 1 1030 . 1 1 88 88 LEU CB C 13 44.659 0.021 . 1 . . . A 88 LEU CB . 30155 1 1031 . 1 1 88 88 LEU CG C 13 26.262 0.000 . 1 . . . A 88 LEU CG . 30155 1 1032 . 1 1 88 88 LEU CD1 C 13 23.895 0.065 . 2 . . . A 88 LEU CD1 . 30155 1 1033 . 1 1 88 88 LEU CD2 C 13 25.193 0.248 . 2 . . . A 88 LEU CD2 . 30155 1 1034 . 1 1 88 88 LEU N N 15 128.568 0.030 . 1 . . . A 88 LEU N . 30155 1 1035 . 1 1 89 89 GLN H H 1 9.035 0.004 . 1 . . . A 89 GLN H . 30155 1 1036 . 1 1 89 89 GLN HA H 1 3.728 0.007 . 1 . . . A 89 GLN HA . 30155 1 1037 . 1 1 89 89 GLN HB2 H 1 2.211 0.006 . 2 . . . A 89 GLN HB2 . 30155 1 1038 . 1 1 89 89 GLN HB3 H 1 2.105 0.012 . 2 . . . A 89 GLN HB3 . 30155 1 1039 . 1 1 89 89 GLN HG2 H 1 2.391 0.005 . 2 . . . A 89 GLN HG2 . 30155 1 1040 . 1 1 89 89 GLN HG3 H 1 2.307 0.011 . 2 . . . A 89 GLN HG3 . 30155 1 1041 . 1 1 89 89 GLN HE21 H 1 7.536 0.011 . 1 . . . A 89 GLN HE21 . 30155 1 1042 . 1 1 89 89 GLN HE22 H 1 7.155 0.014 . 1 . . . A 89 GLN HE22 . 30155 1 1043 . 1 1 89 89 GLN C C 13 175.897 0.000 . 1 . . . A 89 GLN C . 30155 1 1044 . 1 1 89 89 GLN CA C 13 57.655 0.045 . 1 . . . A 89 GLN CA . 30155 1 1045 . 1 1 89 89 GLN CB C 13 26.634 0.095 . 1 . . . A 89 GLN CB . 30155 1 1046 . 1 1 89 89 GLN CG C 13 34.282 0.113 . 1 . . . A 89 GLN CG . 30155 1 1047 . 1 1 89 89 GLN N N 15 121.032 0.033 . 1 . . . A 89 GLN N . 30155 1 1048 . 1 1 89 89 GLN NE2 N 15 112.957 0.054 . 1 . . . A 89 GLN NE2 . 30155 1 1049 . 1 1 90 90 SER H H 1 8.241 0.007 . 1 . . . A 90 SER H . 30155 1 1050 . 1 1 90 90 SER HA H 1 4.214 0.003 . 1 . . . A 90 SER HA . 30155 1 1051 . 1 1 90 90 SER HB2 H 1 3.913 0.003 . 2 . . . A 90 SER HB2 . 30155 1 1052 . 1 1 90 90 SER HB3 H 1 4.095 0.020 . 2 . . . A 90 SER HB3 . 30155 1 1053 . 1 1 90 90 SER C C 13 173.566 0.000 . 1 . . . A 90 SER C . 30155 1 1054 . 1 1 90 90 SER CA C 13 59.479 0.091 . 1 . . . A 90 SER CA . 30155 1 1055 . 1 1 90 90 SER CB C 13 63.150 0.142 . 1 . . . A 90 SER CB . 30155 1 1056 . 1 1 90 90 SER N N 15 112.679 0.078 . 1 . . . A 90 SER N . 30155 1 1057 . 1 1 91 91 LYS H H 1 8.090 0.010 . 1 . . . A 91 LYS H . 30155 1 1058 . 1 1 91 91 LYS HA H 1 4.555 0.004 . 1 . . . A 91 LYS HA . 30155 1 1059 . 1 1 91 91 LYS HB2 H 1 1.890 0.008 . 2 . . . A 91 LYS HB2 . 30155 1 1060 . 1 1 91 91 LYS HB3 H 1 2.102 0.010 . 2 . . . A 91 LYS HB3 . 30155 1 1061 . 1 1 91 91 LYS HG2 H 1 1.241 0.006 . 2 . . . A 91 LYS HG2 . 30155 1 1062 . 1 1 91 91 LYS HG3 H 1 1.381 0.016 . 2 . . . A 91 LYS HG3 . 30155 1 1063 . 1 1 91 91 LYS HD2 H 1 1.543 0.020 . 2 . . . A 91 LYS HD2 . 30155 1 1064 . 1 1 91 91 LYS HD3 H 1 1.475 0.013 . 2 . . . A 91 LYS HD3 . 30155 1 1065 . 1 1 91 91 LYS HE2 H 1 2.882 0.009 . 2 . . . A 91 LYS HE2 . 30155 1 1066 . 1 1 91 91 LYS HE3 H 1 2.816 0.003 . 2 . . . A 91 LYS HE3 . 30155 1 1067 . 1 1 91 91 LYS C C 13 175.519 0.000 . 1 . . . A 91 LYS C . 30155 1 1068 . 1 1 91 91 LYS CA C 13 54.176 0.089 . 1 . . . A 91 LYS CA . 30155 1 1069 . 1 1 91 91 LYS CB C 13 34.337 0.030 . 1 . . . A 91 LYS CB . 30155 1 1070 . 1 1 91 91 LYS CG C 13 24.306 0.114 . 1 . . . A 91 LYS CG . 30155 1 1071 . 1 1 91 91 LYS CD C 13 28.038 0.112 . 1 . . . A 91 LYS CD . 30155 1 1072 . 1 1 91 91 LYS CE C 13 42.147 0.065 . 1 . . . A 91 LYS CE . 30155 1 1073 . 1 1 91 91 LYS N N 15 122.316 0.064 . 1 . . . A 91 LYS N . 30155 1 1074 . 1 1 92 92 THR H H 1 8.047 0.011 . 1 . . . A 92 THR H . 30155 1 1075 . 1 1 92 92 THR HA H 1 4.640 0.009 . 1 . . . A 92 THR HA . 30155 1 1076 . 1 1 92 92 THR HB H 1 3.815 0.004 . 1 . . . A 92 THR HB . 30155 1 1077 . 1 1 92 92 THR HG21 H 1 1.001 0.009 . 1 . . . A 92 THR HG21 . 30155 1 1078 . 1 1 92 92 THR HG22 H 1 1.001 0.009 . 1 . . . A 92 THR HG22 . 30155 1 1079 . 1 1 92 92 THR HG23 H 1 1.001 0.009 . 1 . . . A 92 THR HG23 . 30155 1 1080 . 1 1 92 92 THR C C 13 175.076 0.000 . 1 . . . A 92 THR C . 30155 1 1081 . 1 1 92 92 THR CA C 13 61.402 0.000 . 1 . . . A 92 THR CA . 30155 1 1082 . 1 1 92 92 THR CB C 13 69.447 0.051 . 1 . . . A 92 THR CB . 30155 1 1083 . 1 1 92 92 THR CG2 C 13 21.406 0.046 . 1 . . . A 92 THR CG2 . 30155 1 1084 . 1 1 92 92 THR N N 15 117.462 0.017 . 1 . . . A 92 THR N . 30155 1 1085 . 1 1 93 93 ILE H H 1 8.505 0.004 . 1 . . . A 93 ILE H . 30155 1 1086 . 1 1 93 93 ILE HA H 1 4.754 0.005 . 1 . . . A 93 ILE HA . 30155 1 1087 . 1 1 93 93 ILE HB H 1 1.936 0.007 . 1 . . . A 93 ILE HB . 30155 1 1088 . 1 1 93 93 ILE HG12 H 1 1.598 0.008 . 2 . . . A 93 ILE HG12 . 30155 1 1089 . 1 1 93 93 ILE HG13 H 1 1.419 0.016 . 2 . . . A 93 ILE HG13 . 30155 1 1090 . 1 1 93 93 ILE HG21 H 1 0.909 0.008 . 1 . . . A 93 ILE HG21 . 30155 1 1091 . 1 1 93 93 ILE HG22 H 1 0.909 0.008 . 1 . . . A 93 ILE HG22 . 30155 1 1092 . 1 1 93 93 ILE HG23 H 1 0.909 0.008 . 1 . . . A 93 ILE HG23 . 30155 1 1093 . 1 1 93 93 ILE HD11 H 1 0.696 0.012 . 1 . . . A 93 ILE HD11 . 30155 1 1094 . 1 1 93 93 ILE HD12 H 1 0.696 0.012 . 1 . . . A 93 ILE HD12 . 30155 1 1095 . 1 1 93 93 ILE HD13 H 1 0.696 0.012 . 1 . . . A 93 ILE HD13 . 30155 1 1096 . 1 1 93 93 ILE C C 13 175.473 0.000 . 1 . . . A 93 ILE C . 30155 1 1097 . 1 1 93 93 ILE CA C 13 61.777 0.000 . 1 . . . A 93 ILE CA . 30155 1 1098 . 1 1 93 93 ILE CB C 13 39.068 0.028 . 1 . . . A 93 ILE CB . 30155 1 1099 . 1 1 93 93 ILE CG1 C 13 26.057 0.079 . 1 . . . A 93 ILE CG1 . 30155 1 1100 . 1 1 93 93 ILE CG2 C 13 17.596 0.021 . 1 . . . A 93 ILE CG2 . 30155 1 1101 . 1 1 93 93 ILE CD1 C 13 13.488 0.055 . 1 . . . A 93 ILE CD1 . 30155 1 1102 . 1 1 93 93 ILE N N 15 121.250 0.062 . 1 . . . A 93 ILE N . 30155 1 1103 . 1 1 94 94 LYS H H 1 8.283 0.007 . 1 . . . A 94 LYS H . 30155 1 1104 . 1 1 94 94 LYS HA H 1 5.234 0.004 . 1 . . . A 94 LYS HA . 30155 1 1105 . 1 1 94 94 LYS HB2 H 1 1.588 0.007 . 2 . . . A 94 LYS HB2 . 30155 1 1106 . 1 1 94 94 LYS HB3 H 1 1.820 0.018 . 2 . . . A 94 LYS HB3 . 30155 1 1107 . 1 1 94 94 LYS HG2 H 1 1.586 0.007 . 2 . . . A 94 LYS HG2 . 30155 1 1108 . 1 1 94 94 LYS HG3 H 1 1.358 0.010 . 2 . . . A 94 LYS HG3 . 30155 1 1109 . 1 1 94 94 LYS HD2 H 1 1.781 0.011 . 2 . . . A 94 LYS HD2 . 30155 1 1110 . 1 1 94 94 LYS HD3 H 1 1.593 0.008 . 2 . . . A 94 LYS HD3 . 30155 1 1111 . 1 1 94 94 LYS C C 13 174.918 0.000 . 1 . . . A 94 LYS C . 30155 1 1112 . 1 1 94 94 LYS CA C 13 53.987 0.022 . 1 . . . A 94 LYS CA . 30155 1 1113 . 1 1 94 94 LYS CB C 13 36.815 0.087 . 1 . . . A 94 LYS CB . 30155 1 1114 . 1 1 94 94 LYS CG C 13 24.903 0.099 . 1 . . . A 94 LYS CG . 30155 1 1115 . 1 1 94 94 LYS CD C 13 29.600 0.139 . 1 . . . A 94 LYS CD . 30155 1 1116 . 1 1 94 94 LYS N N 15 123.518 0.060 . 1 . . . A 94 LYS N . 30155 1 1117 . 1 1 95 95 VAL H H 1 8.741 0.013 . 1 . . . A 95 VAL H . 30155 1 1118 . 1 1 95 95 VAL HA H 1 4.720 0.019 . 1 . . . A 95 VAL HA . 30155 1 1119 . 1 1 95 95 VAL HB H 1 1.766 0.014 . 1 . . . A 95 VAL HB . 30155 1 1120 . 1 1 95 95 VAL HG11 H 1 0.958 0.015 . 2 . . . A 95 VAL HG11 . 30155 1 1121 . 1 1 95 95 VAL HG12 H 1 0.958 0.015 . 2 . . . A 95 VAL HG12 . 30155 1 1122 . 1 1 95 95 VAL HG13 H 1 0.958 0.015 . 2 . . . A 95 VAL HG13 . 30155 1 1123 . 1 1 95 95 VAL HG21 H 1 0.904 0.010 . 2 . . . A 95 VAL HG21 . 30155 1 1124 . 1 1 95 95 VAL HG22 H 1 0.904 0.010 . 2 . . . A 95 VAL HG22 . 30155 1 1125 . 1 1 95 95 VAL HG23 H 1 0.904 0.010 . 2 . . . A 95 VAL HG23 . 30155 1 1126 . 1 1 95 95 VAL C C 13 173.732 0.000 . 1 . . . A 95 VAL C . 30155 1 1127 . 1 1 95 95 VAL CA C 13 61.177 0.000 . 1 . . . A 95 VAL CA . 30155 1 1128 . 1 1 95 95 VAL CB C 13 34.651 0.047 . 1 . . . A 95 VAL CB . 30155 1 1129 . 1 1 95 95 VAL CG1 C 13 21.990 0.074 . 2 . . . A 95 VAL CG1 . 30155 1 1130 . 1 1 95 95 VAL CG2 C 13 23.873 0.130 . 2 . . . A 95 VAL CG2 . 30155 1 1131 . 1 1 95 95 VAL N N 15 126.852 0.025 . 1 . . . A 95 VAL N . 30155 1 1132 . 1 1 96 96 SER H H 1 8.544 0.013 . 1 . . . A 96 SER H . 30155 1 1133 . 1 1 96 96 SER HA H 1 4.562 0.003 . 1 . . . A 96 SER HA . 30155 1 1134 . 1 1 96 96 SER HB2 H 1 3.747 0.004 . 1 . . . A 96 SER HB2 . 30155 1 1135 . 1 1 96 96 SER HB3 H 1 3.747 0.004 . 1 . . . A 96 SER HB3 . 30155 1 1136 . 1 1 96 96 SER C C 13 172.921 0.000 . 1 . . . A 96 SER C . 30155 1 1137 . 1 1 96 96 SER CA C 13 56.451 0.126 . 1 . . . A 96 SER CA . 30155 1 1138 . 1 1 96 96 SER CB C 13 65.758 0.046 . 1 . . . A 96 SER CB . 30155 1 1139 . 1 1 96 96 SER N N 15 118.989 0.043 . 1 . . . A 96 SER N . 30155 1 1140 . 1 1 97 97 TYR H H 1 8.389 0.006 . 1 . . . A 97 TYR H . 30155 1 1141 . 1 1 97 97 TYR HA H 1 4.662 0.014 . 1 . . . A 97 TYR HA . 30155 1 1142 . 1 1 97 97 TYR HB2 H 1 2.634 0.006 . 2 . . . A 97 TYR HB2 . 30155 1 1143 . 1 1 97 97 TYR HB3 H 1 3.190 0.014 . 2 . . . A 97 TYR HB3 . 30155 1 1144 . 1 1 97 97 TYR HD1 H 1 7.072 0.009 . 3 . . . A 97 TYR HD1 . 30155 1 1145 . 1 1 97 97 TYR HD2 H 1 7.072 0.009 . 3 . . . A 97 TYR HD2 . 30155 1 1146 . 1 1 97 97 TYR HE1 H 1 6.616 0.007 . 3 . . . A 97 TYR HE1 . 30155 1 1147 . 1 1 97 97 TYR HE2 H 1 6.616 0.007 . 3 . . . A 97 TYR HE2 . 30155 1 1148 . 1 1 97 97 TYR C C 13 176.921 0.000 . 1 . . . A 97 TYR C . 30155 1 1149 . 1 1 97 97 TYR CA C 13 60.940 0.000 . 1 . . . A 97 TYR CA . 30155 1 1150 . 1 1 97 97 TYR CB C 13 38.414 0.066 . 1 . . . A 97 TYR CB . 30155 1 1151 . 1 1 97 97 TYR CD1 C 13 133.105 0.149 . 3 . . . A 97 TYR CD1 . 30155 1 1152 . 1 1 97 97 TYR CD2 C 13 133.105 0.149 . 3 . . . A 97 TYR CD2 . 30155 1 1153 . 1 1 97 97 TYR CE1 C 13 118.373 0.171 . 3 . . . A 97 TYR CE1 . 30155 1 1154 . 1 1 97 97 TYR CE2 C 13 118.373 0.171 . 3 . . . A 97 TYR CE2 . 30155 1 1155 . 1 1 97 97 TYR N N 15 119.734 0.041 . 1 . . . A 97 TYR N . 30155 1 1156 . 1 1 98 98 ALA H H 1 8.714 0.011 . 1 . . . A 98 ALA H . 30155 1 1157 . 1 1 98 98 ALA HA H 1 4.234 0.014 . 1 . . . A 98 ALA HA . 30155 1 1158 . 1 1 98 98 ALA HB1 H 1 1.326 0.008 . 1 . . . A 98 ALA HB1 . 30155 1 1159 . 1 1 98 98 ALA HB2 H 1 1.326 0.008 . 1 . . . A 98 ALA HB2 . 30155 1 1160 . 1 1 98 98 ALA HB3 H 1 1.326 0.008 . 1 . . . A 98 ALA HB3 . 30155 1 1161 . 1 1 98 98 ALA C C 13 177.381 0.000 . 1 . . . A 98 ALA C . 30155 1 1162 . 1 1 98 98 ALA CA C 13 52.736 0.069 . 1 . . . A 98 ALA CA . 30155 1 1163 . 1 1 98 98 ALA CB C 13 19.443 0.078 . 1 . . . A 98 ALA CB . 30155 1 1164 . 1 1 98 98 ALA N N 15 125.207 0.055 . 1 . . . A 98 ALA N . 30155 1 1165 . 1 1 99 99 ARG H H 1 8.702 0.004 . 1 . . . A 99 ARG H . 30155 1 1166 . 1 1 99 99 ARG N N 15 120.920 0.049 . 1 . . . A 99 ARG N . 30155 1 1167 . 1 1 100 100 PRO HA H 1 4.331 0.005 . 1 . . . A 100 PRO HA . 30155 1 1168 . 1 1 100 100 PRO HB2 H 1 2.209 0.003 . 2 . . . A 100 PRO HB2 . 30155 1 1169 . 1 1 100 100 PRO HB3 H 1 1.828 0.016 . 2 . . . A 100 PRO HB3 . 30155 1 1170 . 1 1 100 100 PRO HG2 H 1 1.923 0.008 . 1 . . . A 100 PRO HG2 . 30155 1 1171 . 1 1 100 100 PRO HG3 H 1 1.917 0.012 . 1 . . . A 100 PRO HG3 . 30155 1 1172 . 1 1 100 100 PRO HD2 H 1 3.602 0.006 . 2 . . . A 100 PRO HD2 . 30155 1 1173 . 1 1 100 100 PRO HD3 H 1 3.714 0.004 . 2 . . . A 100 PRO HD3 . 30155 1 1174 . 1 1 100 100 PRO C C 13 176.740 0.000 . 1 . . . A 100 PRO C . 30155 1 1175 . 1 1 100 100 PRO CA C 13 63.131 0.067 . 1 . . . A 100 PRO CA . 30155 1 1176 . 1 1 100 100 PRO CB C 13 32.082 0.099 . 1 . . . A 100 PRO CB . 30155 1 1177 . 1 1 100 100 PRO CG C 13 28.187 0.030 . 1 . . . A 100 PRO CG . 30155 1 1178 . 1 1 100 100 PRO CD C 13 50.528 0.082 . 1 . . . A 100 PRO CD . 30155 1 1179 . 1 1 101 101 SER H H 1 8.262 0.004 . 1 . . . A 101 SER H . 30155 1 1180 . 1 1 101 101 SER HA H 1 4.283 0.002 . 1 . . . A 101 SER HA . 30155 1 1181 . 1 1 101 101 SER HB2 H 1 3.752 0.015 . 2 . . . A 101 SER HB2 . 30155 1 1182 . 1 1 101 101 SER HB3 H 1 3.718 0.011 . 2 . . . A 101 SER HB3 . 30155 1 1183 . 1 1 101 101 SER CA C 13 58.291 0.113 . 1 . . . A 101 SER CA . 30155 1 1184 . 1 1 101 101 SER CB C 13 63.609 0.033 . 1 . . . A 101 SER CB . 30155 1 stop_ save_