data_31026 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 31026 _Entry.Title ; Intramembrane recognition between transmembrane domains of IL-7R and common gamma chain ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2022-06-17 _Entry.Accession_date 2022-06-17 _Entry.Last_release_date 2022-07-18 _Entry.Original_release_date 2022-07-18 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'SOLUTION NMR' _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 T. Cai T. . . . 31026 2 R. 'Lenoir Capello' R. . . . 31026 3 J. Chou J. J. . . 31026 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'MEMBRANE PROTEIN' . 31026 'common gamma-chain cytokine receptor' . 31026 'receptor sharing' . 31026 'transmembrane domain' . 31026 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 31026 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 153 31026 '15N chemical shifts' 50 31026 '1H chemical shifts' 345 31026 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 . . 2023-06-27 . original BMRB . 31026 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 8DDC 'BMRB Entry Tracking System' 31026 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 31026 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 37205582 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Structural basis of gamma-chain family receptor sharing at the membrane level ; _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 T. Cai T. . . . 31026 1 2 R. 'Lenoir Capello' R. . . . 31026 1 3 X. Pi X. . . . 31026 1 4 H. Wu H. . . . 31026 1 5 J. Chou J. J. . . 31026 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 31026 _Assembly.ID 1 _Assembly.Name 'Cytokine receptor common subunit gamma, Interleukin-7 receptor subunit alpha' _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 unit_1 1 $entity_1 A A yes . . . . . . 31026 1 2 unit_2 2 $entity_2 B B yes . . . . . . 31026 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 31026 _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 ; EENPSLFALEAVLIPVGTVG LIITLIFVYFWLER ; _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 34 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment 'Transmembrane domain, residues 253-286' _Entity.Mutation 'M271V, C282F' _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 3864.547 _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 'IL-2 receptor subunit gamma' common 31026 1 'IL-2R subunit gamma' common 31026 1 IL-2RG common 31026 1 'Interleukin-2 receptor subunit gamma' common 31026 1 gammaC common 31026 1 p64 common 31026 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 1 253 GLU . 31026 1 2 254 GLU . 31026 1 3 255 ASN . 31026 1 4 256 PRO . 31026 1 5 257 SER . 31026 1 6 258 LEU . 31026 1 7 259 PHE . 31026 1 8 260 ALA . 31026 1 9 261 LEU . 31026 1 10 262 GLU . 31026 1 11 263 ALA . 31026 1 12 264 VAL . 31026 1 13 265 LEU . 31026 1 14 266 ILE . 31026 1 15 267 PRO . 31026 1 16 268 VAL . 31026 1 17 269 GLY . 31026 1 18 270 THR . 31026 1 19 271 VAL . 31026 1 20 272 GLY . 31026 1 21 273 LEU . 31026 1 22 274 ILE . 31026 1 23 275 ILE . 31026 1 24 276 THR . 31026 1 25 277 LEU . 31026 1 26 278 ILE . 31026 1 27 279 PHE . 31026 1 28 280 VAL . 31026 1 29 281 TYR . 31026 1 30 282 PHE . 31026 1 31 283 TRP . 31026 1 32 284 LEU . 31026 1 33 285 GLU . 31026 1 34 286 ARG . 31026 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 . GLU 1 1 31026 1 . GLU 2 2 31026 1 . ASN 3 3 31026 1 . PRO 4 4 31026 1 . SER 5 5 31026 1 . LEU 6 6 31026 1 . PHE 7 7 31026 1 . ALA 8 8 31026 1 . LEU 9 9 31026 1 . GLU 10 10 31026 1 . ALA 11 11 31026 1 . VAL 12 12 31026 1 . LEU 13 13 31026 1 . ILE 14 14 31026 1 . PRO 15 15 31026 1 . VAL 16 16 31026 1 . GLY 17 17 31026 1 . THR 18 18 31026 1 . VAL 19 19 31026 1 . GLY 20 20 31026 1 . LEU 21 21 31026 1 . ILE 22 22 31026 1 . ILE 23 23 31026 1 . THR 24 24 31026 1 . LEU 25 25 31026 1 . ILE 26 26 31026 1 . PHE 27 27 31026 1 . VAL 28 28 31026 1 . TYR 29 29 31026 1 . PHE 30 30 31026 1 . TRP 31 31 31026 1 . LEU 32 32 31026 1 . GLU 33 33 31026 1 . ARG 34 34 31026 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 31026 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GGWDPVLPSVTILSLFSVFL LVILAHVLWKK ; _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 31 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID 2 _Entity.Fragment 'Transmembrane domain, residues 236-266' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 3452.199 _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 'IL-7 receptor subunit alpha' common 31026 2 'IL-7R subunit alpha' common 31026 2 IL-7R-alpha common 31026 2 IL-7RA common 31026 2 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 1 236 GLY . 31026 2 2 237 GLY . 31026 2 3 238 TRP . 31026 2 4 239 ASP . 31026 2 5 240 PRO . 31026 2 6 241 VAL . 31026 2 7 242 LEU . 31026 2 8 243 PRO . 31026 2 9 244 SER . 31026 2 10 245 VAL . 31026 2 11 246 THR . 31026 2 12 247 ILE . 31026 2 13 248 LEU . 31026 2 14 249 SER . 31026 2 15 250 LEU . 31026 2 16 251 PHE . 31026 2 17 252 SER . 31026 2 18 253 VAL . 31026 2 19 254 PHE . 31026 2 20 255 LEU . 31026 2 21 256 LEU . 31026 2 22 257 VAL . 31026 2 23 258 ILE . 31026 2 24 259 LEU . 31026 2 25 260 ALA . 31026 2 26 261 HIS . 31026 2 27 262 VAL . 31026 2 28 263 LEU . 31026 2 29 264 TRP . 31026 2 30 265 LYS . 31026 2 31 266 LYS . 31026 2 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 31026 2 . GLY 2 2 31026 2 . TRP 3 3 31026 2 . ASP 4 4 31026 2 . PRO 5 5 31026 2 . VAL 6 6 31026 2 . LEU 7 7 31026 2 . PRO 8 8 31026 2 . SER 9 9 31026 2 . VAL 10 10 31026 2 . THR 11 11 31026 2 . ILE 12 12 31026 2 . LEU 13 13 31026 2 . SER 14 14 31026 2 . LEU 15 15 31026 2 . PHE 16 16 31026 2 . SER 17 17 31026 2 . VAL 18 18 31026 2 . PHE 19 19 31026 2 . LEU 20 20 31026 2 . LEU 21 21 31026 2 . VAL 22 22 31026 2 . ILE 23 23 31026 2 . LEU 24 24 31026 2 . ALA 25 25 31026 2 . HIS 26 26 31026 2 . VAL 27 27 31026 2 . LEU 28 28 31026 2 . TRP 29 29 31026 2 . LYS 30 30 31026 2 . LYS 31 31 31026 2 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 31026 _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 . 10090 organism . 'Mus musculus' 'house mouse' . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . Il2rg . 31026 1 2 2 $entity_2 . 10090 organism . 'Mus musculus' 'house mouse' . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . Il7r . 31026 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 31026 _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 BL21(DE3)' . . 469008 . . BL21(DE3) . . . . . . . . . 31026 1 2 2 $entity_2 . 'recombinant technology' 'Escherichia coli BL21(DE3)' . . 469008 . . BL21(DE3) . . . . . . . . . 31026 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 31026 _Sample.ID 1 _Sample.Name . _Sample.Type bicelle _Sample.Sub_type . _Sample.Details ; 0.4 mM 15N, 13C, 85%2H Transmembrane domain of the common gamma-chain receptor, 40 mM DMPC, 100 mM DH6PC, 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 'Transmembrane domain of the common gamma-chain receptor' '[U-15N; U-13C; U-85% 2H]' . . 1 $entity_1 . . 0.4 . . mM 0.02 . . . 31026 1 2 DMPC 'natural abundance' . . . . . . 40 . . mM 0.2 . . . 31026 1 3 DH6PC 'natural abundance' . . . . . . 100 . . mM 0.2 . . . 31026 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 31026 _Sample.ID 2 _Sample.Name . _Sample.Type bicelle _Sample.Sub_type . _Sample.Details ; 0.4 mM 15N, 13C, 85%2H Transmembrane domain of the Interleukin-7 receptor alpha subunit, 40 mM DMPC, 100 mM DH6PC, 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 DMPC 'natural abundance' . . . . . . 40 . . mM 0.2 . . . 31026 2 2 DH6PC 'natural abundance' . . . . . . 100 . . mM 0.2 . . . 31026 2 3 'Transmembrane domain of the Interleukin-7 receptor alpha subunit' '[U-15N; U-13C; U-85% 2H]' . . 2 $entity_2 . . 0.4 . . mM 0.02 . . . 31026 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 31026 _Sample.ID 3 _Sample.Name . _Sample.Type bicelle _Sample.Sub_type . _Sample.Details ; 0.4 mM 15N, 2H Transmembrane domain of the common gamma-chain receptor, 0.4 mM 13C Transmembrane domain of the Interleukin-7 receptor alpha subunit, 40 mM deuterated DMPC (deuterated), 100 mM deuterated DH6PC (deuterated), 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 'Transmembrane domain of the common gamma-chain receptor' '[U-15N; U-2H]' . . 1 $entity_1 . . 0.4 . . mM 0.02 . . . 31026 3 2 'Transmembrane domain of the Interleukin-7 receptor alpha subunit' [U-13C] . . 2 $entity_2 . . 0.4 . . mM 0.02 . . . 31026 3 3 'DMPC (deuterated)' deuterated . . . . . . 40 . . mM 0.2 . . . 31026 3 4 'DH6PC (deuterated)' deuterated . . . . . . 100 . . mM 0.2 . . . 31026 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 31026 _Sample.ID 4 _Sample.Name . _Sample.Type bicelle _Sample.Sub_type . _Sample.Details ; 0.4 mM 15N, 2H Transmembrane domain of the Interleukin-7 receptor alpha subunit, 0.4 mM 13C Transmembrane domain of the common gamma-chain receptor, 40 mM deuterated DMPC (deuterated), 100 mM deuterated DH6PC (deuterated), 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 'Transmembrane domain of the common gamma-chain receptor' [U-13C] . . 1 $entity_1 . . 0.4 . . mM 0.02 . . . 31026 4 2 'Transmembrane domain of the Interleukin-7 receptor alpha subunit' '[U-15N; U-2H]' . . 2 $entity_2 . . 0.4 . . mM 0.02 . . . 31026 4 3 'DMPC (deuterated)' deuterated . . . . . . 40 . . mM 0.2 . . . 31026 4 4 'DH6PC (deuterated)' deuterated . . . . . . 100 . . mM 0.2 . . . 31026 4 stop_ save_ save_sample_5 _Sample.Sf_category sample _Sample.Sf_framecode sample_5 _Sample.Entry_ID 31026 _Sample.ID 5 _Sample.Name . _Sample.Type bicelle _Sample.Sub_type . _Sample.Details ; 0.4 mM 15N, 13C Transmembrane domain of the common gamma-chain receptor, 0.4 mM 15N, 13C Transmembrane domain of the Interleukin-7 receptor alpha subunit, 40 mM deuterated DMPC (deuterated), 100 mM deuterated DH6PC (deuterated), 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 'Transmembrane domain of the common gamma-chain receptor' '[U-15N; U-13C]' . . 1 $entity_1 . . 0.4 . . mM 0.02 . . . 31026 5 2 'Transmembrane domain of the Interleukin-7 receptor alpha subunit' '[U-15N; U-13C]' . . 2 $entity_2 . . 0.4 . . mM 0.02 . . . 31026 5 3 'DMPC (deuterated)' deuterated . . . . . . 40 . . mM 0.2 . . . 31026 5 4 'DH6PC (deuterated)' deuterated . . . . . . 100 . . mM 0.2 . . . 31026 5 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 31026 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.15 . M 31026 1 pH 6.7 . pH 31026 1 pressure 1 0.01 atm 31026 1 temperature 303 0.1 K 31026 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 31026 _Software.ID 1 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 31026 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 31026 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 31026 _Software.ID 2 _Software.Type . _Software.Name XEASY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bartels et al.' . . 31026 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 31026 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 31026 _Software.ID 3 _Software.Type . _Software.Name TALOS+ _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Shen, Delaglio, Cornilescu, Bax' . . 31026 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift calculation' . 31026 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 31026 _Software.ID 4 _Software.Type . _Software.Name 'X-PLOR NIH' _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 31026 4 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID refinement . 31026 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 31026 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _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 31026 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE NEO' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_3 _NMR_spectrometer.Entry_ID 31026 _NMR_spectrometer.ID 3 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_4 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_4 _NMR_spectrometer.Entry_ID 31026 _NMR_spectrometer.ID 4 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 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 31026 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker 'AVANCE III' . 600 . . . 31026 1 2 NMR_spectrometer_2 Bruker 'AVANCE NEO' . 700 . . . 31026 1 3 NMR_spectrometer_3 Bruker 'AVANCE III' . 800 . . . 31026 1 4 NMR_spectrometer_4 Bruker 'AVANCE III' . 900 . . . 31026 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 31026 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_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.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N TROSY-HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31026 1 2 '2D 1H-15N TROSY-HSQC' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31026 1 3 '2D 1H-15N TROSY-HSQC' no . . . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 4 $NMR_spectrometer_4 . . . . . . . . . . . . . . . . . 31026 1 4 '2D 1H-15N TROSY-HSQC' no . . . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 4 $NMR_spectrometer_4 . . . . . . . . . . . . . . . . . 31026 1 5 '2D 1H-13C HSQC' no . . . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 31026 1 6 '2D 1H-13C HSQC' no . . . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 31026 1 7 '3D TROSY HNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31026 1 8 '3D TROSY HNCA' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31026 1 9 '3D TROSY HN(CO)CA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31026 1 10 '3D TROSY HN(CO)CA' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31026 1 11 '3D TROSY HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31026 1 12 '3D TROSY HNCO' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31026 1 13 '3D TROSY HNCACO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31026 1 14 '3D TROSY HNCACO' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 31026 1 15 '3D 1H-15N NOESY-TROSY' no . . . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 4 $NMR_spectrometer_4 . . . . . . . . . . . . . . . . . 31026 1 16 '3D 1H-15N NOESY-TROSY' no . . . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 4 $NMR_spectrometer_4 . . . . . . . . . . . . . . . . . 31026 1 17 '3D 1H-15N NOESY-TROSY' no . . . . . . . . . . . . 5 $sample_5 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 31026 1 18 '3D 1H-13C NOESY' no . . . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 31026 1 19 '3D 1H-13C NOESY' no . . . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 31026 1 20 '2D Methyl-Amide Intermolecular NOESY' no . . . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 31026 1 21 '3D 1H-13C NOESY' no . . . . . . . . . . . . 5 $sample_5 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 31026 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 31026 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.251449530 . . . . . 31026 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 31026 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.101329118 . . . . . 31026 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 31026 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $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 TROSY-HSQC' . . . 31026 1 2 '2D 1H-15N TROSY-HSQC' . . . 31026 1 3 '2D 1H-15N TROSY-HSQC' . . . 31026 1 4 '2D 1H-15N TROSY-HSQC' . . . 31026 1 5 '2D 1H-13C HSQC' . . . 31026 1 6 '2D 1H-13C HSQC' . . . 31026 1 7 '3D TROSY HNCA' . . . 31026 1 8 '3D TROSY HNCA' . . . 31026 1 9 '3D TROSY HN(CO)CA' . . . 31026 1 10 '3D TROSY HN(CO)CA' . . . 31026 1 11 '3D TROSY HNCO' . . . 31026 1 12 '3D TROSY HNCO' . . . 31026 1 13 '3D TROSY HNCACO' . . . 31026 1 14 '3D TROSY HNCACO' . . . 31026 1 15 '3D 1H-15N NOESY-TROSY' . . . 31026 1 16 '3D 1H-15N NOESY-TROSY' . . . 31026 1 17 '3D 1H-15N NOESY-TROSY' . . . 31026 1 18 '3D 1H-13C NOESY' . . . 31026 1 19 '3D 1H-13C NOESY' . . . 31026 1 20 '2D Methyl-Amide Intermolecular NOESY' . . . 31026 1 21 '3D 1H-13C NOESY' . . . 31026 1 stop_ loop_ _Systematic_chem_shift_offset.Type _Systematic_chem_shift_offset.Atom_type _Systematic_chem_shift_offset.Atom_isotope_number _Systematic_chem_shift_offset.Val _Systematic_chem_shift_offset.Val_err _Systematic_chem_shift_offset.Entry_ID _Systematic_chem_shift_offset.Assigned_chem_shift_list_ID 'TROSY offset' 'amide nitrogens' 15 0.575 0.05 31026 1 'TROSY offset' 'amide protons' 1 0.057 0.005 31026 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 4 4 PRO C C 13 177.3 0.030 . 1 . . . . A 256 PRO C . 31026 1 2 . 1 . 1 4 4 PRO CA C 13 62.89 0.050 . 1 . . . . A 256 PRO CA . 31026 1 3 . 1 . 1 5 5 SER H H 1 8.32 0.002 . 1 . . . . A 257 SER H . 31026 1 4 . 1 . 1 5 5 SER HA H 1 4.37 0.010 . 1 . . . . A 257 SER HA . 31026 1 5 . 1 . 1 5 5 SER C C 13 175.01 0.030 . 1 . . . . A 257 SER C . 31026 1 6 . 1 . 1 5 5 SER CA C 13 58.66 0.050 . 1 . . . . A 257 SER CA . 31026 1 7 . 1 . 1 5 5 SER N N 15 115.81 0.020 . 1 . . . . A 257 SER N . 31026 1 8 . 1 . 1 6 6 LEU H H 1 8.12 0.002 . 1 . . . . A 258 LEU H . 31026 1 9 . 1 . 1 6 6 LEU HA H 1 4.18 0.010 . 1 . . . . A 258 LEU HA . 31026 1 10 . 1 . 1 6 6 LEU HB2 H 1 1.56 0.010 . . . . . . A 258 LEU HB2 . 31026 1 11 . 1 . 1 6 6 LEU HB3 H 1 1.56 0.010 . . . . . . A 258 LEU HB3 . 31026 1 12 . 1 . 1 6 6 LEU HD11 H 1 0.91 0.010 . . . . . . A 258 LEU HD11 . 31026 1 13 . 1 . 1 6 6 LEU HD12 H 1 0.91 0.010 . . . . . . A 258 LEU HD12 . 31026 1 14 . 1 . 1 6 6 LEU HD13 H 1 0.91 0.010 . . . . . . A 258 LEU HD13 . 31026 1 15 . 1 . 1 6 6 LEU HD21 H 1 0.84 0.010 . . . . . . A 258 LEU HD21 . 31026 1 16 . 1 . 1 6 6 LEU HD22 H 1 0.84 0.010 . . . . . . A 258 LEU HD22 . 31026 1 17 . 1 . 1 6 6 LEU HD23 H 1 0.84 0.010 . . . . . . A 258 LEU HD23 . 31026 1 18 . 1 . 1 6 6 LEU C C 13 177.4 0.030 . 1 . . . . A 258 LEU C . 31026 1 19 . 1 . 1 6 6 LEU CA C 13 55.57 0.050 . 1 . . . . A 258 LEU CA . 31026 1 20 . 1 . 1 6 6 LEU CD1 C 13 24.54 0.020 . . . . . . A 258 LEU CD1 . 31026 1 21 . 1 . 1 6 6 LEU CD2 C 13 24.02 0.020 . . . . . . A 258 LEU CD2 . 31026 1 22 . 1 . 1 6 6 LEU N N 15 123.54 0.020 . 1 . . . . A 258 LEU N . 31026 1 23 . 1 . 1 7 7 PHE H H 1 7.96 0.002 . 1 . . . . A 259 PHE H . 31026 1 24 . 1 . 1 7 7 PHE HA H 1 4.41 0.010 . 1 . . . . A 259 PHE HA . 31026 1 25 . 1 . 1 7 7 PHE HB2 H 1 3.1 0.010 . . . . . . A 259 PHE HB2 . 31026 1 26 . 1 . 1 7 7 PHE HB3 H 1 3.1 0.010 . . . . . . A 259 PHE HB3 . 31026 1 27 . 1 . 1 7 7 PHE HD1 H 1 7.15 0.020 . . . . . . A 259 PHE HD1 . 31026 1 28 . 1 . 1 7 7 PHE HD2 H 1 7.15 0.020 . . . . . . A 259 PHE HD2 . 31026 1 29 . 1 . 1 7 7 PHE HE1 H 1 7.27 0.020 . . . . . . A 259 PHE HE1 . 31026 1 30 . 1 . 1 7 7 PHE HE2 H 1 7.27 0.020 . . . . . . A 259 PHE HE2 . 31026 1 31 . 1 . 1 7 7 PHE CA C 13 58.27 0.050 . 1 . . . . A 259 PHE CA . 31026 1 32 . 1 . 1 7 7 PHE N N 15 118.56 0.020 . 1 . . . . A 259 PHE N . 31026 1 33 . 1 . 1 8 8 ALA H H 1 8.34 0.002 . 1 . . . . A 260 ALA H . 31026 1 34 . 1 . 1 8 8 ALA HA H 1 3.89 0.010 . 1 . . . . A 260 ALA HA . 31026 1 35 . 1 . 1 8 8 ALA HB1 H 1 1.42 0.010 . 1 . . . . A 260 ALA HB1 . 31026 1 36 . 1 . 1 8 8 ALA HB2 H 1 1.42 0.010 . 1 . . . . A 260 ALA HB2 . 31026 1 37 . 1 . 1 8 8 ALA HB3 H 1 1.42 0.010 . 1 . . . . A 260 ALA HB3 . 31026 1 38 . 1 . 1 8 8 ALA C C 13 178.49 0.030 . 1 . . . . A 260 ALA C . 31026 1 39 . 1 . 1 8 8 ALA CA C 13 54.36 0.050 . 1 . . . . A 260 ALA CA . 31026 1 40 . 1 . 1 8 8 ALA CB C 13 17.95 0.020 . 1 . . . . A 260 ALA CB . 31026 1 41 . 1 . 1 8 8 ALA N N 15 120.11 0.020 . 1 . . . . A 260 ALA N . 31026 1 42 . 1 . 1 9 9 LEU C C 13 178.65 0.030 . 1 . . . . A 261 LEU C . 31026 1 43 . 1 . 1 9 9 LEU CA C 13 56.54 0.050 . 1 . . . . A 261 LEU CA . 31026 1 44 . 1 . 1 10 10 GLU H H 1 8.89 0.002 . 1 . . . . A 262 GLU H . 31026 1 45 . 1 . 1 10 10 GLU C C 13 177.04 0.030 . 1 . . . . A 262 GLU C . 31026 1 46 . 1 . 1 10 10 GLU CA C 13 59.05 0.050 . 1 . . . . A 262 GLU CA . 31026 1 47 . 1 . 1 10 10 GLU N N 15 118.8 0.020 . 1 . . . . A 262 GLU N . 31026 1 48 . 1 . 1 11 11 ALA H H 1 7.96 0.002 . 1 . . . . A 263 ALA H . 31026 1 49 . 1 . 1 11 11 ALA HA H 1 4.06 0.010 . 1 . . . . A 263 ALA HA . 31026 1 50 . 1 . 1 11 11 ALA HB1 H 1 1.35 0.010 . 1 . . . . A 263 ALA HB1 . 31026 1 51 . 1 . 1 11 11 ALA HB2 H 1 1.35 0.010 . 1 . . . . A 263 ALA HB2 . 31026 1 52 . 1 . 1 11 11 ALA HB3 H 1 1.35 0.010 . 1 . . . . A 263 ALA HB3 . 31026 1 53 . 1 . 1 11 11 ALA C C 13 177.21 0.030 . 1 . . . . A 263 ALA C . 31026 1 54 . 1 . 1 11 11 ALA N N 15 119.13 0.020 . 1 . . . . A 263 ALA N . 31026 1 55 . 1 . 1 12 12 VAL H H 1 7.32 0.002 . 1 . . . . A 264 VAL H . 31026 1 56 . 1 . 1 12 12 VAL HA H 1 4.04 0.040 . 1 . . . . A 264 VAL HA . 31026 1 57 . 1 . 1 12 12 VAL HG11 H 1 0.99 0.010 . . . . . . A 264 VAL HG11 . 31026 1 58 . 1 . 1 12 12 VAL HG12 H 1 0.99 0.010 . . . . . . A 264 VAL HG12 . 31026 1 59 . 1 . 1 12 12 VAL HG13 H 1 0.99 0.010 . . . . . . A 264 VAL HG13 . 31026 1 60 . 1 . 1 12 12 VAL HG21 H 1 0.89 0.002 . . . . . . A 264 VAL HG21 . 31026 1 61 . 1 . 1 12 12 VAL HG22 H 1 0.89 0.002 . . . . . . A 264 VAL HG22 . 31026 1 62 . 1 . 1 12 12 VAL HG23 H 1 0.89 0.002 . . . . . . A 264 VAL HG23 . 31026 1 63 . 1 . 1 12 12 VAL CA C 13 62.44 0.050 . 1 . . . . A 264 VAL CA . 31026 1 64 . 1 . 1 12 12 VAL CG2 C 13 21.4 0.020 . . . . . . A 264 VAL CG2 . 31026 1 65 . 1 . 1 12 12 VAL N N 15 110.85 0.020 . 1 . . . . A 264 VAL N . 31026 1 66 . 1 . 1 13 13 LEU C C 13 178.71 0.030 . 1 . . . . A 265 LEU C . 31026 1 67 . 1 . 1 13 13 LEU CA C 13 57.15 0.050 . 1 . . . . A 265 LEU CA . 31026 1 68 . 1 . 1 14 14 ILE H H 1 8.37 0.002 . 1 . . . . A 266 ILE H . 31026 1 69 . 1 . 1 14 14 ILE HA H 1 3.95 0.010 . 1 . . . . A 266 ILE HA . 31026 1 70 . 1 . 1 14 14 ILE HB H 1 1.78 0.010 . 1 . . . . A 266 ILE HB . 31026 1 71 . 1 . 1 14 14 ILE HG21 H 1 0.8 0.002 . 1 . . . . A 266 ILE HG21 . 31026 1 72 . 1 . 1 14 14 ILE HG22 H 1 0.8 0.002 . 1 . . . . A 266 ILE HG22 . 31026 1 73 . 1 . 1 14 14 ILE HG23 H 1 0.8 0.002 . 1 . . . . A 266 ILE HG23 . 31026 1 74 . 1 . 1 14 14 ILE HD11 H 1 0.86 0.020 . 1 . . . . A 266 ILE HD11 . 31026 1 75 . 1 . 1 14 14 ILE HD12 H 1 0.86 0.020 . 1 . . . . A 266 ILE HD12 . 31026 1 76 . 1 . 1 14 14 ILE HD13 H 1 0.86 0.020 . 1 . . . . A 266 ILE HD13 . 31026 1 77 . 1 . 1 14 14 ILE CA C 13 65.72 0.050 . 1 . . . . A 266 ILE CA . 31026 1 78 . 1 . 1 14 14 ILE CG2 C 13 17.22 0.020 . 1 . . . . A 266 ILE CG2 . 31026 1 79 . 1 . 1 14 14 ILE CD1 C 13 12.77 0.002 . 1 . . . . A 266 ILE CD1 . 31026 1 80 . 1 . 1 14 14 ILE N N 15 116.57 0.020 . 1 . . . . A 266 ILE N . 31026 1 81 . 1 . 1 15 15 PRO HB2 H 1 2.17 0.010 . . . . . . A 267 PRO HB2 . 31026 1 82 . 1 . 1 15 15 PRO HB3 H 1 2.17 0.010 . . . . . . A 267 PRO HB3 . 31026 1 83 . 1 . 1 15 15 PRO HD2 H 1 3.74 0.010 . . . . . . A 267 PRO HD2 . 31026 1 84 . 1 . 1 15 15 PRO HD3 H 1 3.74 0.010 . . . . . . A 267 PRO HD3 . 31026 1 85 . 1 . 1 15 15 PRO C C 13 177.61 0.030 . 1 . . . . A 267 PRO C . 31026 1 86 . 1 . 1 16 16 VAL H H 1 7.48 0.002 . 1 . . . . A 268 VAL H . 31026 1 87 . 1 . 1 16 16 VAL HG11 H 1 1.02 0.005 . . . . . . A 268 VAL HG11 . 31026 1 88 . 1 . 1 16 16 VAL HG12 H 1 1.02 0.005 . . . . . . A 268 VAL HG12 . 31026 1 89 . 1 . 1 16 16 VAL HG13 H 1 1.02 0.005 . . . . . . A 268 VAL HG13 . 31026 1 90 . 1 . 1 16 16 VAL C C 13 177.7 0.030 . 1 . . . . A 268 VAL C . 31026 1 91 . 1 . 1 16 16 VAL CA C 13 66.13 0.050 . 1 . . . . A 268 VAL CA . 31026 1 92 . 1 . 1 16 16 VAL CG1 C 13 23.58 0.040 . . . . . . A 268 VAL CG1 . 31026 1 93 . 1 . 1 16 16 VAL N N 15 115.57 0.020 . 1 . . . . A 268 VAL N . 31026 1 94 . 1 . 1 17 17 GLY H H 1 8.75 0.002 . 1 . . . . A 269 GLY H . 31026 1 95 . 1 . 1 17 17 GLY HA2 H 1 3.61 0.010 . . . . . . A 269 GLY HA2 . 31026 1 96 . 1 . 1 17 17 GLY HA3 H 1 3.61 0.010 . . . . . . A 269 GLY HA3 . 31026 1 97 . 1 . 1 17 17 GLY C C 13 174.76 0.030 . 1 . . . . A 269 GLY C . 31026 1 98 . 1 . 1 17 17 GLY CA C 13 46.3 0.050 . 1 . . . . A 269 GLY CA . 31026 1 99 . 1 . 1 17 17 GLY N N 15 107.6 0.020 . 1 . . . . A 269 GLY N . 31026 1 100 . 1 . 1 18 18 THR H H 1 8.25 0.002 . 1 . . . . A 270 THR H . 31026 1 101 . 1 . 1 18 18 THR HA H 1 3.73 0.010 . 1 . . . . A 270 THR HA . 31026 1 102 . 1 . 1 18 18 THR HB H 1 4.2 0.010 . 1 . . . . A 270 THR HB . 31026 1 103 . 1 . 1 18 18 THR HG21 H 1 1.08 0.002 . 1 . . . . A 270 THR HG21 . 31026 1 104 . 1 . 1 18 18 THR HG22 H 1 1.08 0.002 . 1 . . . . A 270 THR HG22 . 31026 1 105 . 1 . 1 18 18 THR HG23 H 1 1.08 0.002 . 1 . . . . A 270 THR HG23 . 31026 1 106 . 1 . 1 18 18 THR C C 13 176.13 0.030 . 1 . . . . A 270 THR C . 31026 1 107 . 1 . 1 18 18 THR CA C 13 67.4 0.050 . 1 . . . . A 270 THR CA . 31026 1 108 . 1 . 1 18 18 THR CG2 C 13 21.09 0.020 . 1 . . . . A 270 THR CG2 . 31026 1 109 . 1 . 1 18 18 THR N N 15 118.03 0.020 . 1 . . . . A 270 THR N . 31026 1 110 . 1 . 1 19 19 VAL H H 1 7.98 0.002 . 1 . . . . A 271 VAL H . 31026 1 111 . 1 . 1 19 19 VAL HA H 1 3.5 0.010 . 1 . . . . A 271 VAL HA . 31026 1 112 . 1 . 1 19 19 VAL HB H 1 2.2 0.010 . 1 . . . . A 271 VAL HB . 31026 1 113 . 1 . 1 19 19 VAL HG11 H 1 1.01 0.002 . . . . . . A 271 VAL HG11 . 31026 1 114 . 1 . 1 19 19 VAL HG12 H 1 1.01 0.002 . . . . . . A 271 VAL HG12 . 31026 1 115 . 1 . 1 19 19 VAL HG13 H 1 1.01 0.002 . . . . . . A 271 VAL HG13 . 31026 1 116 . 1 . 1 19 19 VAL HG21 H 1 0.87 0.002 . . . . . . A 271 VAL HG21 . 31026 1 117 . 1 . 1 19 19 VAL HG22 H 1 0.87 0.002 . . . . . . A 271 VAL HG22 . 31026 1 118 . 1 . 1 19 19 VAL HG23 H 1 0.87 0.002 . . . . . . A 271 VAL HG23 . 31026 1 119 . 1 . 1 19 19 VAL C C 13 177.73 0.030 . 1 . . . . A 271 VAL C . 31026 1 120 . 1 . 1 19 19 VAL CA C 13 66.33 0.050 . 1 . . . . A 271 VAL CA . 31026 1 121 . 1 . 1 19 19 VAL CG1 C 13 23.33 0.020 . . . . . . A 271 VAL CG1 . 31026 1 122 . 1 . 1 19 19 VAL CG2 C 13 21.57 0.020 . . . . . . A 271 VAL CG2 . 31026 1 123 . 1 . 1 19 19 VAL N N 15 120.63 0.020 . 1 . . . . A 271 VAL N . 31026 1 124 . 1 . 1 20 20 GLY H H 1 8.54 0.002 . 1 . . . . A 272 GLY H . 31026 1 125 . 1 . 1 20 20 GLY HA2 H 1 3.59 0.010 . . . . . . A 272 GLY HA2 . 31026 1 126 . 1 . 1 20 20 GLY HA3 H 1 3.59 0.010 . . . . . . A 272 GLY HA3 . 31026 1 127 . 1 . 1 20 20 GLY C C 13 175.73 0.030 . 1 . . . . A 272 GLY C . 31026 1 128 . 1 . 1 20 20 GLY CA C 13 46.66 0.050 . 1 . . . . A 272 GLY CA . 31026 1 129 . 1 . 1 20 20 GLY N N 15 106.62 0.020 . 1 . . . . A 272 GLY N . 31026 1 130 . 1 . 1 21 21 LEU H H 1 8.47 0.002 . 1 . . . . A 273 LEU H . 31026 1 131 . 1 . 1 21 21 LEU HA H 1 4.02 0.010 . 1 . . . . A 273 LEU HA . 31026 1 132 . 1 . 1 21 21 LEU HD11 H 1 0.84 0.002 . . . . . . A 273 LEU HD11 . 31026 1 133 . 1 . 1 21 21 LEU HD12 H 1 0.84 0.002 . . . . . . A 273 LEU HD12 . 31026 1 134 . 1 . 1 21 21 LEU HD13 H 1 0.84 0.002 . . . . . . A 273 LEU HD13 . 31026 1 135 . 1 . 1 21 21 LEU HD21 H 1 0.84 0.002 . . . . . . A 273 LEU HD21 . 31026 1 136 . 1 . 1 21 21 LEU HD22 H 1 0.84 0.002 . . . . . . A 273 LEU HD22 . 31026 1 137 . 1 . 1 21 21 LEU HD23 H 1 0.84 0.002 . . . . . . A 273 LEU HD23 . 31026 1 138 . 1 . 1 21 21 LEU C C 13 177.67 0.030 . 1 . . . . A 273 LEU C . 31026 1 139 . 1 . 1 21 21 LEU CA C 13 57.47 0.050 . 1 . . . . A 273 LEU CA . 31026 1 140 . 1 . 1 21 21 LEU CD1 C 13 24.83 0.020 . . . . . . A 273 LEU CD1 . 31026 1 141 . 1 . 1 21 21 LEU CD2 C 13 24.05 0.020 . . . . . . A 273 LEU CD2 . 31026 1 142 . 1 . 1 21 21 LEU N N 15 124.72 0.020 . 1 . . . . A 273 LEU N . 31026 1 143 . 1 . 1 22 22 ILE H H 1 8.06 0.002 . 1 . . . . A 274 ILE H . 31026 1 144 . 1 . 1 22 22 ILE HA H 1 3.53 0.010 . 1 . . . . A 274 ILE HA . 31026 1 145 . 1 . 1 22 22 ILE HB H 1 1.99 0.010 . 1 . . . . A 274 ILE HB . 31026 1 146 . 1 . 1 22 22 ILE HG21 H 1 0.85 0.002 . 1 . . . . A 274 ILE HG21 . 31026 1 147 . 1 . 1 22 22 ILE HG22 H 1 0.85 0.002 . 1 . . . . A 274 ILE HG22 . 31026 1 148 . 1 . 1 22 22 ILE HG23 H 1 0.85 0.002 . 1 . . . . A 274 ILE HG23 . 31026 1 149 . 1 . 1 22 22 ILE HD11 H 1 0.76 0.002 . 1 . . . . A 274 ILE HD11 . 31026 1 150 . 1 . 1 22 22 ILE HD12 H 1 0.76 0.002 . 1 . . . . A 274 ILE HD12 . 31026 1 151 . 1 . 1 22 22 ILE HD13 H 1 0.76 0.002 . 1 . . . . A 274 ILE HD13 . 31026 1 152 . 1 . 1 22 22 ILE C C 13 177.3 0.030 . 1 . . . . A 274 ILE C . 31026 1 153 . 1 . 1 22 22 ILE CA C 13 65 0.050 . 1 . . . . A 274 ILE CA . 31026 1 154 . 1 . 1 22 22 ILE CG2 C 13 17.14 0.020 . 1 . . . . A 274 ILE CG2 . 31026 1 155 . 1 . 1 22 22 ILE CD1 C 13 13.17 0.020 . 1 . . . . A 274 ILE CD1 . 31026 1 156 . 1 . 1 22 22 ILE N N 15 119.26 0.020 . 1 . . . . A 274 ILE N . 31026 1 157 . 1 . 1 23 23 ILE H H 1 8.4 0.002 . 1 . . . . A 275 ILE H . 31026 1 158 . 1 . 1 23 23 ILE HA H 1 3.59 0.010 . 1 . . . . A 275 ILE HA . 31026 1 159 . 1 . 1 23 23 ILE HB H 1 1.91 0.010 . 1 . . . . A 275 ILE HB . 31026 1 160 . 1 . 1 23 23 ILE HG21 H 1 0.85 0.002 . 1 . . . . A 275 ILE HG21 . 31026 1 161 . 1 . 1 23 23 ILE HG22 H 1 0.85 0.002 . 1 . . . . A 275 ILE HG22 . 31026 1 162 . 1 . 1 23 23 ILE HG23 H 1 0.85 0.002 . 1 . . . . A 275 ILE HG23 . 31026 1 163 . 1 . 1 23 23 ILE HD11 H 1 0.75 0.002 . 1 . . . . A 275 ILE HD11 . 31026 1 164 . 1 . 1 23 23 ILE HD12 H 1 0.75 0.002 . 1 . . . . A 275 ILE HD12 . 31026 1 165 . 1 . 1 23 23 ILE HD13 H 1 0.75 0.002 . 1 . . . . A 275 ILE HD13 . 31026 1 166 . 1 . 1 23 23 ILE C C 13 177.15 0.030 . 1 . . . . A 275 ILE C . 31026 1 167 . 1 . 1 23 23 ILE CA C 13 64.64 0.050 . 1 . . . . A 275 ILE CA . 31026 1 168 . 1 . 1 23 23 ILE CG2 C 13 17.48 0.020 . 1 . . . . A 275 ILE CG2 . 31026 1 169 . 1 . 1 23 23 ILE CD1 C 13 13.18 0.020 . 1 . . . . A 275 ILE CD1 . 31026 1 170 . 1 . 1 23 23 ILE N N 15 117.54 0.020 . 1 . . . . A 275 ILE N . 31026 1 171 . 1 . 1 24 24 THR H H 1 7.95 0.002 . 1 . . . . A 276 THR H . 31026 1 172 . 1 . 1 24 24 THR HA H 1 3.72 0.010 . 1 . . . . A 276 THR HA . 31026 1 173 . 1 . 1 24 24 THR HB H 1 4.33 0.010 . 1 . . . . A 276 THR HB . 31026 1 174 . 1 . 1 24 24 THR C C 13 175.92 0.030 . 1 . . . . A 276 THR C . 31026 1 175 . 1 . 1 24 24 THR CA C 13 67.7 0.050 . 1 . . . . A 276 THR CA . 31026 1 176 . 1 . 1 24 24 THR N N 15 116.43 0.020 . 1 . . . . A 276 THR N . 31026 1 177 . 1 . 1 25 25 LEU H H 1 8.25 0.002 . 1 . . . . A 277 LEU H . 31026 1 178 . 1 . 1 25 25 LEU HA H 1 3.99 0.010 . 1 . . . . A 277 LEU HA . 31026 1 179 . 1 . 1 25 25 LEU HB2 H 1 1.97 0.010 . . . . . . A 277 LEU HB2 . 31026 1 180 . 1 . 1 25 25 LEU HB3 H 1 1.97 0.010 . . . . . . A 277 LEU HB3 . 31026 1 181 . 1 . 1 25 25 LEU HD11 H 1 0.81 0.002 . . . . . . A 277 LEU HD11 . 31026 1 182 . 1 . 1 25 25 LEU HD12 H 1 0.81 0.002 . . . . . . A 277 LEU HD12 . 31026 1 183 . 1 . 1 25 25 LEU HD13 H 1 0.81 0.002 . . . . . . A 277 LEU HD13 . 31026 1 184 . 1 . 1 25 25 LEU HD21 H 1 0.81 0.002 . . . . . . A 277 LEU HD21 . 31026 1 185 . 1 . 1 25 25 LEU HD22 H 1 0.81 0.002 . . . . . . A 277 LEU HD22 . 31026 1 186 . 1 . 1 25 25 LEU HD23 H 1 0.81 0.002 . . . . . . A 277 LEU HD23 . 31026 1 187 . 1 . 1 25 25 LEU C C 13 178.22 0.030 . 1 . . . . A 277 LEU C . 31026 1 188 . 1 . 1 25 25 LEU CA C 13 57.44 0.050 . 1 . . . . A 277 LEU CA . 31026 1 189 . 1 . 1 25 25 LEU CD1 C 13 25.39 0.020 . . . . . . A 277 LEU CD1 . 31026 1 190 . 1 . 1 25 25 LEU CD2 C 13 22.86 0.020 . . . . . . A 277 LEU CD2 . 31026 1 191 . 1 . 1 25 25 LEU N N 15 120.23 0.020 . 1 . . . . A 277 LEU N . 31026 1 192 . 1 . 1 26 26 ILE H H 1 8.09 0.002 . 1 . . . . A 278 ILE H . 31026 1 193 . 1 . 1 26 26 ILE HA H 1 3.65 0.010 . 1 . . . . A 278 ILE HA . 31026 1 194 . 1 . 1 26 26 ILE HB H 1 2.04 0.010 . 1 . . . . A 278 ILE HB . 31026 1 195 . 1 . 1 26 26 ILE HG21 H 1 0.94 0.002 . 1 . . . . A 278 ILE HG21 . 31026 1 196 . 1 . 1 26 26 ILE HG22 H 1 0.94 0.002 . 1 . . . . A 278 ILE HG22 . 31026 1 197 . 1 . 1 26 26 ILE HG23 H 1 0.94 0.002 . 1 . . . . A 278 ILE HG23 . 31026 1 198 . 1 . 1 26 26 ILE HD11 H 1 0.78 0.002 . 1 . . . . A 278 ILE HD11 . 31026 1 199 . 1 . 1 26 26 ILE HD12 H 1 0.78 0.002 . 1 . . . . A 278 ILE HD12 . 31026 1 200 . 1 . 1 26 26 ILE HD13 H 1 0.78 0.002 . 1 . . . . A 278 ILE HD13 . 31026 1 201 . 1 . 1 26 26 ILE C C 13 177.37 0.030 . 1 . . . . A 278 ILE C . 31026 1 202 . 1 . 1 26 26 ILE CA C 13 64.96 0.050 . 1 . . . . A 278 ILE CA . 31026 1 203 . 1 . 1 26 26 ILE CG2 C 13 17.72 0.020 . 1 . . . . A 278 ILE CG2 . 31026 1 204 . 1 . 1 26 26 ILE CD1 C 13 13.96 0.020 . 1 . . . . A 278 ILE CD1 . 31026 1 205 . 1 . 1 26 26 ILE N N 15 118.84 0.020 . 1 . . . . A 278 ILE N . 31026 1 206 . 1 . 1 27 27 PHE H H 1 8.67 0.002 . 1 . . . . A 279 PHE H . 31026 1 207 . 1 . 1 27 27 PHE HB2 H 1 3.21 0.010 . . . . . . A 279 PHE HB2 . 31026 1 208 . 1 . 1 27 27 PHE HB3 H 1 3.21 0.010 . . . . . . A 279 PHE HB3 . 31026 1 209 . 1 . 1 27 27 PHE C C 13 177.67 0.030 . 1 . . . . A 279 PHE C . 31026 1 210 . 1 . 1 27 27 PHE CA C 13 61.51 0.050 . 1 . . . . A 279 PHE CA . 31026 1 211 . 1 . 1 27 27 PHE N N 15 118.83 0.020 . 1 . . . . A 279 PHE N . 31026 1 212 . 1 . 1 28 28 VAL H H 1 8.68 0.002 . 1 . . . . A 280 VAL H . 31026 1 213 . 1 . 1 28 28 VAL HA H 1 3.64 0.010 . 1 . . . . A 280 VAL HA . 31026 1 214 . 1 . 1 28 28 VAL HB H 1 2.32 0.010 . 1 . . . . A 280 VAL HB . 31026 1 215 . 1 . 1 28 28 VAL HG11 H 1 1.16 0.002 . . . . . . A 280 VAL HG11 . 31026 1 216 . 1 . 1 28 28 VAL HG12 H 1 1.16 0.002 . . . . . . A 280 VAL HG12 . 31026 1 217 . 1 . 1 28 28 VAL HG13 H 1 1.16 0.002 . . . . . . A 280 VAL HG13 . 31026 1 218 . 1 . 1 28 28 VAL HG21 H 1 1.01 0.002 . . . . . . A 280 VAL HG21 . 31026 1 219 . 1 . 1 28 28 VAL HG22 H 1 1.01 0.002 . . . . . . A 280 VAL HG22 . 31026 1 220 . 1 . 1 28 28 VAL HG23 H 1 1.01 0.002 . . . . . . A 280 VAL HG23 . 31026 1 221 . 1 . 1 28 28 VAL C C 13 176.91 0.030 . 1 . . . . A 280 VAL C . 31026 1 222 . 1 . 1 28 28 VAL CA C 13 66.25 0.050 . 1 . . . . A 280 VAL CA . 31026 1 223 . 1 . 1 28 28 VAL CG1 C 13 23.38 0.020 . . . . . . A 280 VAL CG1 . 31026 1 224 . 1 . 1 28 28 VAL CG2 C 13 21.95 0.020 . . . . . . A 280 VAL CG2 . 31026 1 225 . 1 . 1 28 28 VAL N N 15 118.38 0.020 . 1 . . . . A 280 VAL N . 31026 1 226 . 1 . 1 29 29 TYR H H 1 8.37 0.002 . 1 . . . . A 281 TYR H . 31026 1 227 . 1 . 1 29 29 TYR HA H 1 3.95 0.010 . 1 . . . . A 281 TYR HA . 31026 1 228 . 1 . 1 29 29 TYR HB2 H 1 2.94 0.010 . . . . . . A 281 TYR HB2 . 31026 1 229 . 1 . 1 29 29 TYR HB3 H 1 3.12 0.010 . . . . . . A 281 TYR HB3 . 31026 1 230 . 1 . 1 29 29 TYR HD1 H 1 6.44 0.010 . . . . . . A 281 TYR HD1 . 31026 1 231 . 1 . 1 29 29 TYR HD2 H 1 6.44 0.010 . . . . . . A 281 TYR HD2 . 31026 1 232 . 1 . 1 29 29 TYR C C 13 176.9 0.030 . 1 . . . . A 281 TYR C . 31026 1 233 . 1 . 1 29 29 TYR CA C 13 61.51 0.050 . 1 . . . . A 281 TYR CA . 31026 1 234 . 1 . 1 29 29 TYR N N 15 119.26 0.020 . 1 . . . . A 281 TYR N . 31026 1 235 . 1 . 1 30 30 PHE H H 1 8.06 0.002 . 1 . . . . A 282 PHE H . 31026 1 236 . 1 . 1 30 30 PHE HA H 1 4.14 0.010 . 1 . . . . A 282 PHE HA . 31026 1 237 . 1 . 1 30 30 PHE HB2 H 1 2.97 0.010 . . . . . . A 282 PHE HB2 . 31026 1 238 . 1 . 1 30 30 PHE HB3 H 1 3.1 0.010 . . . . . . A 282 PHE HB3 . 31026 1 239 . 1 . 1 30 30 PHE C C 13 177.33 0.030 . 1 . . . . A 282 PHE C . 31026 1 240 . 1 . 1 30 30 PHE CA C 13 60.38 0.050 . 1 . . . . A 282 PHE CA . 31026 1 241 . 1 . 1 30 30 PHE N N 15 115.03 0.020 . 1 . . . . A 282 PHE N . 31026 1 242 . 1 . 1 31 31 TRP H H 1 8.5 0.002 . 1 . . . . A 283 TRP H . 31026 1 243 . 1 . 1 31 31 TRP HA H 1 4.29 0.010 . 1 . . . . A 283 TRP HA . 31026 1 244 . 1 . 1 31 31 TRP HB2 H 1 3.07 0.010 . . . . . . A 283 TRP HB2 . 31026 1 245 . 1 . 1 31 31 TRP HB3 H 1 3.35 0.010 . . . . . . A 283 TRP HB3 . 31026 1 246 . 1 . 1 31 31 TRP HE1 H 1 10.25 0.010 . 1 . . . . A 283 TRP HE1 . 31026 1 247 . 1 . 1 31 31 TRP C C 13 177.21 0.030 . 1 . . . . A 283 TRP C . 31026 1 248 . 1 . 1 31 31 TRP CA C 13 59.05 0.050 . 1 . . . . A 283 TRP CA . 31026 1 249 . 1 . 1 31 31 TRP N N 15 120.78 0.020 . 1 . . . . A 283 TRP N . 31026 1 250 . 1 . 1 32 32 LEU H H 1 7.93 0.002 . 1 . . . . A 284 LEU H . 31026 1 251 . 1 . 1 32 32 LEU HA H 1 3.96 0.010 . 1 . . . . A 284 LEU HA . 31026 1 252 . 1 . 1 32 32 LEU HB2 H 1 1.77 0.010 . . . . . . A 284 LEU HB2 . 31026 1 253 . 1 . 1 32 32 LEU HB3 H 1 1.93 0.010 . . . . . . A 284 LEU HB3 . 31026 1 254 . 1 . 1 32 32 LEU HG H 1 1.48 0.010 . 1 . . . . A 284 LEU HG . 31026 1 255 . 1 . 1 32 32 LEU HD11 H 1 0.87 0.002 . . . . . . A 284 LEU HD11 . 31026 1 256 . 1 . 1 32 32 LEU HD12 H 1 0.87 0.002 . . . . . . A 284 LEU HD12 . 31026 1 257 . 1 . 1 32 32 LEU HD13 H 1 0.87 0.002 . . . . . . A 284 LEU HD13 . 31026 1 258 . 1 . 1 32 32 LEU HD21 H 1 0.81 0.002 . . . . . . A 284 LEU HD21 . 31026 1 259 . 1 . 1 32 32 LEU HD22 H 1 0.81 0.002 . . . . . . A 284 LEU HD22 . 31026 1 260 . 1 . 1 32 32 LEU HD23 H 1 0.81 0.002 . . . . . . A 284 LEU HD23 . 31026 1 261 . 1 . 1 32 32 LEU C C 13 177.51 0.030 . 1 . . . . A 284 LEU C . 31026 1 262 . 1 . 1 32 32 LEU CD1 C 13 25.76 0.020 . . . . . . A 284 LEU CD1 . 31026 1 263 . 1 . 1 32 32 LEU CD2 C 13 23.29 0.020 . . . . . . A 284 LEU CD2 . 31026 1 264 . 1 . 1 32 32 LEU N N 15 117.62 0.020 . 1 . . . . A 284 LEU N . 31026 1 265 . 1 . 1 33 33 GLU H H 1 7.72 0.002 . 1 . . . . A 285 GLU H . 31026 1 266 . 1 . 1 33 33 GLU HA H 1 4.14 0.010 . 1 . . . . A 285 GLU HA . 31026 1 267 . 1 . 1 33 33 GLU HB2 H 1 1.66 0.010 . . . . . . A 285 GLU HB2 . 31026 1 268 . 1 . 1 33 33 GLU HB3 H 1 1.66 0.010 . . . . . . A 285 GLU HB3 . 31026 1 269 . 1 . 1 33 33 GLU HG2 H 1 1.98 0.010 . . . . . . A 285 GLU HG2 . 31026 1 270 . 1 . 1 33 33 GLU HG3 H 1 1.98 0.010 . . . . . . A 285 GLU HG3 . 31026 1 271 . 1 . 1 33 33 GLU C C 13 175.3 0.030 . 1 . . . . A 285 GLU C . 31026 1 272 . 1 . 1 33 33 GLU CA C 13 55.3 0.050 . 1 . . . . A 285 GLU CA . 31026 1 273 . 1 . 1 33 33 GLU N N 15 119.74 0.020 . 1 . . . . A 285 GLU N . 31026 1 274 . 1 . 1 34 34 ARG H H 1 7.44 0.002 . 1 . . . . A 286 ARG H . 31026 1 275 . 1 . 1 34 34 ARG HA H 1 4 0.010 . 1 . . . . A 286 ARG HA . 31026 1 276 . 1 . 1 34 34 ARG HB2 H 1 1.73 0.010 . . . . . . A 286 ARG HB2 . 31026 1 277 . 1 . 1 34 34 ARG HB3 H 1 1.73 0.010 . . . . . . A 286 ARG HB3 . 31026 1 278 . 1 . 1 34 34 ARG HG2 H 1 1.61 0.010 . . . . . . A 286 ARG HG2 . 31026 1 279 . 1 . 1 34 34 ARG HG3 H 1 1.61 0.010 . . . . . . A 286 ARG HG3 . 31026 1 280 . 1 . 1 34 34 ARG HD2 H 1 2.96 0.010 . . . . . . A 286 ARG HD2 . 31026 1 281 . 1 . 1 34 34 ARG HD3 H 1 2.96 0.010 . . . . . . A 286 ARG HD3 . 31026 1 282 . 1 . 1 34 34 ARG CA C 13 56.53 0.050 . 1 . . . . A 286 ARG CA . 31026 1 283 . 1 . 1 34 34 ARG N N 15 126.66 0.020 . 1 . . . . A 286 ARG N . 31026 1 284 . 2 . 2 2 2 GLY C C 13 173.62 0.030 . 1 . . . . B 237 GLY C . 31026 1 285 . 2 . 2 2 2 GLY CA C 13 44.42 0.050 . 1 . . . . B 237 GLY CA . 31026 1 286 . 2 . 2 3 3 TRP H H 1 8.27 0.002 . 1 . . . . B 238 TRP H . 31026 1 287 . 2 . 2 3 3 TRP HA H 1 3.94 0.010 . 1 . . . . B 238 TRP HA . 31026 1 288 . 2 . 2 3 3 TRP HB2 H 1 3.14 0.010 . . . . . . B 238 TRP HB2 . 31026 1 289 . 2 . 2 3 3 TRP HB3 H 1 3.27 0.010 . . . . . . B 238 TRP HB3 . 31026 1 290 . 2 . 2 3 3 TRP HE1 H 1 10.34 0.010 . 1 . . . . B 238 TRP HE1 . 31026 1 291 . 2 . 2 3 3 TRP C C 13 175.54 0.030 . 1 . . . . B 238 TRP C . 31026 1 292 . 2 . 2 3 3 TRP CA C 13 56.01 0.050 . 1 . . . . B 238 TRP CA . 31026 1 293 . 2 . 2 3 3 TRP N N 15 121.11 0.020 . 1 . . . . B 238 TRP N . 31026 1 294 . 2 . 2 4 4 ASP H H 1 8.16 0.002 . 1 . . . . B 239 ASP H . 31026 1 295 . 2 . 2 4 4 ASP HA H 1 3.66 0.010 . 1 . . . . B 239 ASP HA . 31026 1 296 . 2 . 2 4 4 ASP CA C 13 52.67 0.050 . 1 . . . . B 239 ASP CA . 31026 1 297 . 2 . 2 4 4 ASP N N 15 124.28 0.020 . 1 . . . . B 239 ASP N . 31026 1 298 . 2 . 2 7 7 LEU HD11 H 1 0.92 0.010 . . . . . . B 242 LEU HD11 . 31026 1 299 . 2 . 2 7 7 LEU HD12 H 1 0.92 0.010 . . . . . . B 242 LEU HD12 . 31026 1 300 . 2 . 2 7 7 LEU HD13 H 1 0.92 0.010 . . . . . . B 242 LEU HD13 . 31026 1 301 . 2 . 2 7 7 LEU HD21 H 1 0.87 0.010 . . . . . . B 242 LEU HD21 . 31026 1 302 . 2 . 2 7 7 LEU HD22 H 1 0.87 0.010 . . . . . . B 242 LEU HD22 . 31026 1 303 . 2 . 2 7 7 LEU HD23 H 1 0.87 0.010 . . . . . . B 242 LEU HD23 . 31026 1 304 . 2 . 2 7 7 LEU CD1 C 13 24.66 0.020 . . . . . . B 242 LEU CD1 . 31026 1 305 . 2 . 2 7 7 LEU CD2 C 13 23.98 0.020 . . . . . . B 242 LEU CD2 . 31026 1 306 . 2 . 2 9 9 SER C C 13 175.9 0.030 . 1 . . . . B 244 SER C . 31026 1 307 . 2 . 2 9 9 SER CA C 13 61.64 0.050 . 1 . . . . B 244 SER CA . 31026 1 308 . 2 . 2 10 10 VAL H H 1 8.48 0.002 . 1 . . . . B 245 VAL H . 31026 1 309 . 2 . 2 10 10 VAL HG11 H 1 0.91 0.010 . . . . . . B 245 VAL HG11 . 31026 1 310 . 2 . 2 10 10 VAL HG12 H 1 0.91 0.010 . . . . . . B 245 VAL HG12 . 31026 1 311 . 2 . 2 10 10 VAL HG13 H 1 0.91 0.010 . . . . . . B 245 VAL HG13 . 31026 1 312 . 2 . 2 10 10 VAL HG21 H 1 1.04 0.010 . . . . . . B 245 VAL HG21 . 31026 1 313 . 2 . 2 10 10 VAL HG22 H 1 1.04 0.010 . . . . . . B 245 VAL HG22 . 31026 1 314 . 2 . 2 10 10 VAL HG23 H 1 1.04 0.010 . . . . . . B 245 VAL HG23 . 31026 1 315 . 2 . 2 10 10 VAL C C 13 178.65 0.030 . 1 . . . . B 245 VAL C . 31026 1 316 . 2 . 2 10 10 VAL CA C 13 65.32 0.050 . 1 . . . . B 245 VAL CA . 31026 1 317 . 2 . 2 10 10 VAL CG1 C 13 21.28 0.020 . . . . . . B 245 VAL CG1 . 31026 1 318 . 2 . 2 10 10 VAL CG2 C 13 22.93 0.020 . . . . . . B 245 VAL CG2 . 31026 1 319 . 2 . 2 10 10 VAL N N 15 121.05 0.020 . 1 . . . . B 245 VAL N . 31026 1 320 . 2 . 2 11 11 THR H H 1 8.22 0.002 . 1 . . . . B 246 THR H . 31026 1 321 . 2 . 2 11 11 THR HA H 1 4.29 0.010 . 1 . . . . B 246 THR HA . 31026 1 322 . 2 . 2 11 11 THR HG21 H 1 1.11 0.010 . 1 . . . . B 246 THR HG21 . 31026 1 323 . 2 . 2 11 11 THR HG22 H 1 1.11 0.010 . 1 . . . . B 246 THR HG22 . 31026 1 324 . 2 . 2 11 11 THR HG23 H 1 1.11 0.010 . 1 . . . . B 246 THR HG23 . 31026 1 325 . 2 . 2 11 11 THR C C 13 175.92 0.030 . 1 . . . . B 246 THR C . 31026 1 326 . 2 . 2 11 11 THR CA C 13 67.03 0.050 . 1 . . . . B 246 THR CA . 31026 1 327 . 2 . 2 11 11 THR CG2 C 13 21.4 0.020 . 1 . . . . B 246 THR CG2 . 31026 1 328 . 2 . 2 11 11 THR N N 15 120.23 0.020 . 1 . . . . B 246 THR N . 31026 1 329 . 2 . 2 12 12 ILE H H 1 8.08 0.002 . 1 . . . . B 247 ILE H . 31026 1 330 . 2 . 2 12 12 ILE HA H 1 3.65 0.010 . 1 . . . . B 247 ILE HA . 31026 1 331 . 2 . 2 12 12 ILE HG21 H 1 0.82 0.010 . 1 . . . . B 247 ILE HG21 . 31026 1 332 . 2 . 2 12 12 ILE HG22 H 1 0.82 0.010 . 1 . . . . B 247 ILE HG22 . 31026 1 333 . 2 . 2 12 12 ILE HG23 H 1 0.82 0.010 . 1 . . . . B 247 ILE HG23 . 31026 1 334 . 2 . 2 12 12 ILE HD11 H 1 0.8 0.010 . 1 . . . . B 247 ILE HD11 . 31026 1 335 . 2 . 2 12 12 ILE HD12 H 1 0.8 0.010 . 1 . . . . B 247 ILE HD12 . 31026 1 336 . 2 . 2 12 12 ILE HD13 H 1 0.8 0.010 . 1 . . . . B 247 ILE HD13 . 31026 1 337 . 2 . 2 12 12 ILE C C 13 177.54 0.030 . 1 . . . . B 247 ILE C . 31026 1 338 . 2 . 2 12 12 ILE CA C 13 64.18 0.050 . 1 . . . . B 247 ILE CA . 31026 1 339 . 2 . 2 12 12 ILE CG2 C 13 17.6 0.020 . 1 . . . . B 247 ILE CG2 . 31026 1 340 . 2 . 2 12 12 ILE CD1 C 13 12.62 0.020 . 1 . . . . B 247 ILE CD1 . 31026 1 341 . 2 . 2 12 12 ILE N N 15 121.29 0.020 . 1 . . . . B 247 ILE N . 31026 1 342 . 2 . 2 13 13 LEU H H 1 8.34 0.002 . 1 . . . . B 248 LEU H . 31026 1 343 . 2 . 2 13 13 LEU HA H 1 4.09 0.010 . 1 . . . . B 248 LEU HA . 31026 1 344 . 2 . 2 13 13 LEU HD11 H 1 0.88 0.020 . . . . . . B 248 LEU HD11 . 31026 1 345 . 2 . 2 13 13 LEU HD12 H 1 0.88 0.020 . . . . . . B 248 LEU HD12 . 31026 1 346 . 2 . 2 13 13 LEU HD13 H 1 0.88 0.020 . . . . . . B 248 LEU HD13 . 31026 1 347 . 2 . 2 13 13 LEU HD21 H 1 0.83 0.010 . . . . . . B 248 LEU HD21 . 31026 1 348 . 2 . 2 13 13 LEU HD22 H 1 0.83 0.010 . . . . . . B 248 LEU HD22 . 31026 1 349 . 2 . 2 13 13 LEU HD23 H 1 0.83 0.010 . . . . . . B 248 LEU HD23 . 31026 1 350 . 2 . 2 13 13 LEU C C 13 180.06 0.030 . 1 . . . . B 248 LEU C . 31026 1 351 . 2 . 2 13 13 LEU CA C 13 57.34 0.050 . 1 . . . . B 248 LEU CA . 31026 1 352 . 2 . 2 13 13 LEU CD1 C 13 24.67 0.020 . . . . . . B 248 LEU CD1 . 31026 1 353 . 2 . 2 13 13 LEU CD2 C 13 23.98 0.020 . . . . . . B 248 LEU CD2 . 31026 1 354 . 2 . 2 13 13 LEU N N 15 119.29 0.020 . 1 . . . . B 248 LEU N . 31026 1 355 . 2 . 2 14 14 SER H H 1 8.37 0.002 . 1 . . . . B 249 SER H . 31026 1 356 . 2 . 2 14 14 SER HA H 1 3.67 0.010 . 1 . . . . B 249 SER HA . 31026 1 357 . 2 . 2 14 14 SER HB2 H 1 4.1 0.010 . . . . . . B 249 SER HB2 . 31026 1 358 . 2 . 2 14 14 SER HB3 H 1 4.1 0.010 . . . . . . B 249 SER HB3 . 31026 1 359 . 2 . 2 14 14 SER C C 13 175.46 0.030 . 1 . . . . B 249 SER C . 31026 1 360 . 2 . 2 14 14 SER CA C 13 62.73 0.050 . 1 . . . . B 249 SER CA . 31026 1 361 . 2 . 2 14 14 SER N N 15 118.47 0.020 . 1 . . . . B 249 SER N . 31026 1 362 . 2 . 2 15 15 LEU H H 1 8.03 0.002 . 1 . . . . B 250 LEU H . 31026 1 363 . 2 . 2 15 15 LEU HA H 1 3.94 0.010 . 1 . . . . B 250 LEU HA . 31026 1 364 . 2 . 2 15 15 LEU HB2 H 1 1.83 0.010 . . . . . . B 250 LEU HB2 . 31026 1 365 . 2 . 2 15 15 LEU HB3 H 1 1.83 0.010 . . . . . . B 250 LEU HB3 . 31026 1 366 . 2 . 2 15 15 LEU HG H 1 1.43 0.010 . 1 . . . . B 250 LEU HG . 31026 1 367 . 2 . 2 15 15 LEU HD11 H 1 0.78 0.010 . . . . . . B 250 LEU HD11 . 31026 1 368 . 2 . 2 15 15 LEU HD12 H 1 0.78 0.010 . . . . . . B 250 LEU HD12 . 31026 1 369 . 2 . 2 15 15 LEU HD13 H 1 0.78 0.010 . . . . . . B 250 LEU HD13 . 31026 1 370 . 2 . 2 15 15 LEU HD21 H 1 0.76 0.010 . . . . . . B 250 LEU HD21 . 31026 1 371 . 2 . 2 15 15 LEU HD22 H 1 0.76 0.010 . . . . . . B 250 LEU HD22 . 31026 1 372 . 2 . 2 15 15 LEU HD23 H 1 0.76 0.010 . . . . . . B 250 LEU HD23 . 31026 1 373 . 2 . 2 15 15 LEU C C 13 178.35 0.030 . 1 . . . . B 250 LEU C . 31026 1 374 . 2 . 2 15 15 LEU CA C 13 57.22 0.050 . 1 . . . . B 250 LEU CA . 31026 1 375 . 2 . 2 15 15 LEU CD1 C 13 25.14 0.020 . . . . . . B 250 LEU CD1 . 31026 1 376 . 2 . 2 15 15 LEU CD2 C 13 23.52 0.020 . . . . . . B 250 LEU CD2 . 31026 1 377 . 2 . 2 15 15 LEU N N 15 122.34 0.020 . 1 . . . . B 250 LEU N . 31026 1 378 . 2 . 2 16 16 PHE H H 1 8.55 0.002 . 1 . . . . B 251 PHE H . 31026 1 379 . 2 . 2 16 16 PHE HA H 1 4.19 0.010 . 1 . . . . B 251 PHE HA . 31026 1 380 . 2 . 2 16 16 PHE HB2 H 1 3.16 0.010 . . . . . . B 251 PHE HB2 . 31026 1 381 . 2 . 2 16 16 PHE HB3 H 1 3.16 0.010 . . . . . . B 251 PHE HB3 . 31026 1 382 . 2 . 2 16 16 PHE HD1 H 1 7.06 0.020 . . . . . . B 251 PHE HD1 . 31026 1 383 . 2 . 2 16 16 PHE HD2 H 1 7.06 0.020 . . . . . . B 251 PHE HD2 . 31026 1 384 . 2 . 2 16 16 PHE C C 13 177.01 0.030 . 1 . . . . B 251 PHE C . 31026 1 385 . 2 . 2 16 16 PHE CA C 13 60.44 0.050 . 1 . . . . B 251 PHE CA . 31026 1 386 . 2 . 2 16 16 PHE N N 15 117.71 0.020 . 1 . . . . B 251 PHE N . 31026 1 387 . 2 . 2 17 17 SER H H 1 8.09 0.002 . 1 . . . . B 252 SER H . 31026 1 388 . 2 . 2 17 17 SER HA H 1 3.97 0.010 . 1 . . . . B 252 SER HA . 31026 1 389 . 2 . 2 17 17 SER HB2 H 1 4.12 0.010 . . . . . . B 252 SER HB2 . 31026 1 390 . 2 . 2 17 17 SER HB3 H 1 4.12 0.010 . . . . . . B 252 SER HB3 . 31026 1 391 . 2 . 2 17 17 SER C C 13 175.26 0.030 . 1 . . . . B 252 SER C . 31026 1 392 . 2 . 2 17 17 SER CA C 13 62.97 0.050 . 1 . . . . B 252 SER CA . 31026 1 393 . 2 . 2 17 17 SER N N 15 115.25 0.020 . 1 . . . . B 252 SER N . 31026 1 394 . 2 . 2 18 18 VAL H H 1 7.83 0.002 . 1 . . . . B 253 VAL H . 31026 1 395 . 2 . 2 18 18 VAL HA H 1 3.53 0.010 . 1 . . . . B 253 VAL HA . 31026 1 396 . 2 . 2 18 18 VAL HB H 1 2.16 0.010 . 1 . . . . B 253 VAL HB . 31026 1 397 . 2 . 2 18 18 VAL HG11 H 1 0.83 0.010 . . . . . . B 253 VAL HG11 . 31026 1 398 . 2 . 2 18 18 VAL HG12 H 1 0.83 0.010 . . . . . . B 253 VAL HG12 . 31026 1 399 . 2 . 2 18 18 VAL HG13 H 1 0.83 0.010 . . . . . . B 253 VAL HG13 . 31026 1 400 . 2 . 2 18 18 VAL HG21 H 1 1.01 0.010 . . . . . . B 253 VAL HG21 . 31026 1 401 . 2 . 2 18 18 VAL HG22 H 1 1.01 0.010 . . . . . . B 253 VAL HG22 . 31026 1 402 . 2 . 2 18 18 VAL HG23 H 1 1.01 0.010 . . . . . . B 253 VAL HG23 . 31026 1 403 . 2 . 2 18 18 VAL C C 13 177.04 0.030 . 1 . . . . B 253 VAL C . 31026 1 404 . 2 . 2 18 18 VAL CA C 13 66.03 0.050 . 1 . . . . B 253 VAL CA . 31026 1 405 . 2 . 2 18 18 VAL CG1 C 13 21.43 0.020 . . . . . . B 253 VAL CG1 . 31026 1 406 . 2 . 2 18 18 VAL CG2 C 13 23.08 0.020 . . . . . . B 253 VAL CG2 . 31026 1 407 . 2 . 2 18 18 VAL N N 15 120.64 0.020 . 1 . . . . B 253 VAL N . 31026 1 408 . 2 . 2 19 19 PHE H H 1 7.98 0.002 . 1 . . . . B 254 PHE H . 31026 1 409 . 2 . 2 19 19 PHE HA H 1 4.09 0.010 . 1 . . . . B 254 PHE HA . 31026 1 410 . 2 . 2 19 19 PHE HB2 H 1 3.14 0.010 . . . . . . B 254 PHE HB2 . 31026 1 411 . 2 . 2 19 19 PHE HB3 H 1 3.14 0.010 . . . . . . B 254 PHE HB3 . 31026 1 412 . 2 . 2 19 19 PHE HD1 H 1 7.02 0.020 . . . . . . B 254 PHE HD1 . 31026 1 413 . 2 . 2 19 19 PHE HD2 H 1 7.02 0.020 . . . . . . B 254 PHE HD2 . 31026 1 414 . 2 . 2 19 19 PHE C C 13 176.71 0.030 . 1 . . . . B 254 PHE C . 31026 1 415 . 2 . 2 19 19 PHE CA C 13 60.08 0.050 . 1 . . . . B 254 PHE CA . 31026 1 416 . 2 . 2 19 19 PHE N N 15 118.94 0.020 . 1 . . . . B 254 PHE N . 31026 1 417 . 2 . 2 20 20 LEU H H 1 8.11 0.002 . 1 . . . . B 255 LEU H . 31026 1 418 . 2 . 2 20 20 LEU HA H 1 3.73 0.010 . 1 . . . . B 255 LEU HA . 31026 1 419 . 2 . 2 20 20 LEU HB2 H 1 1.6 0.020 . . . . . . B 255 LEU HB2 . 31026 1 420 . 2 . 2 20 20 LEU HB3 H 1 1.6 0.020 . . . . . . B 255 LEU HB3 . 31026 1 421 . 2 . 2 20 20 LEU HG H 1 1.46 0.020 . 1 . . . . B 255 LEU HG . 31026 1 422 . 2 . 2 20 20 LEU HD11 H 1 0.72 0.020 . . . . . . B 255 LEU HD11 . 31026 1 423 . 2 . 2 20 20 LEU HD12 H 1 0.72 0.020 . . . . . . B 255 LEU HD12 . 31026 1 424 . 2 . 2 20 20 LEU HD13 H 1 0.72 0.020 . . . . . . B 255 LEU HD13 . 31026 1 425 . 2 . 2 20 20 LEU HD21 H 1 0.8 0.020 . . . . . . B 255 LEU HD21 . 31026 1 426 . 2 . 2 20 20 LEU HD22 H 1 0.8 0.020 . . . . . . B 255 LEU HD22 . 31026 1 427 . 2 . 2 20 20 LEU HD23 H 1 0.8 0.020 . . . . . . B 255 LEU HD23 . 31026 1 428 . 2 . 2 20 20 LEU C C 13 178.2 0.030 . 1 . . . . B 255 LEU C . 31026 1 429 . 2 . 2 20 20 LEU CA C 13 57.03 0.050 . 1 . . . . B 255 LEU CA . 31026 1 430 . 2 . 2 20 20 LEU CD1 C 13 23.84 0.020 . . . . . . B 255 LEU CD1 . 31026 1 431 . 2 . 2 20 20 LEU CD2 C 13 23.5 0.020 . . . . . . B 255 LEU CD2 . 31026 1 432 . 2 . 2 20 20 LEU N N 15 117.71 0.020 . 1 . . . . B 255 LEU N . 31026 1 433 . 2 . 2 21 21 LEU H H 1 7.88 0.002 . 1 . . . . B 256 LEU H . 31026 1 434 . 2 . 2 21 21 LEU HA H 1 3.92 0.010 . 1 . . . . B 256 LEU HA . 31026 1 435 . 2 . 2 21 21 LEU HD11 H 1 0.82 0.020 . . . . . . B 256 LEU HD11 . 31026 1 436 . 2 . 2 21 21 LEU HD12 H 1 0.82 0.020 . . . . . . B 256 LEU HD12 . 31026 1 437 . 2 . 2 21 21 LEU HD13 H 1 0.82 0.020 . . . . . . B 256 LEU HD13 . 31026 1 438 . 2 . 2 21 21 LEU HD21 H 1 0.82 0.020 . . . . . . B 256 LEU HD21 . 31026 1 439 . 2 . 2 21 21 LEU HD22 H 1 0.82 0.020 . . . . . . B 256 LEU HD22 . 31026 1 440 . 2 . 2 21 21 LEU HD23 H 1 0.82 0.020 . . . . . . B 256 LEU HD23 . 31026 1 441 . 2 . 2 21 21 LEU C C 13 178.2 0.030 . 1 . . . . B 256 LEU C . 31026 1 442 . 2 . 2 21 21 LEU CA C 13 57.34 0.050 . 1 . . . . B 256 LEU CA . 31026 1 443 . 2 . 2 21 21 LEU CD1 C 13 25.04 0.020 . . . . . . B 256 LEU CD1 . 31026 1 444 . 2 . 2 21 21 LEU CD2 C 13 24.98 0.020 . . . . . . B 256 LEU CD2 . 31026 1 445 . 2 . 2 21 21 LEU N N 15 118.47 0.020 . 1 . . . . B 256 LEU N . 31026 1 446 . 2 . 2 22 22 VAL H H 1 8.04 0.002 . 1 . . . . B 257 VAL H . 31026 1 447 . 2 . 2 22 22 VAL HA H 1 3.55 0.010 . 1 . . . . B 257 VAL HA . 31026 1 448 . 2 . 2 22 22 VAL HB H 1 2.24 0.010 . 1 . . . . B 257 VAL HB . 31026 1 449 . 2 . 2 22 22 VAL HG11 H 1 0.88 0.010 . . . . . . B 257 VAL HG11 . 31026 1 450 . 2 . 2 22 22 VAL HG12 H 1 0.88 0.010 . . . . . . B 257 VAL HG12 . 31026 1 451 . 2 . 2 22 22 VAL HG13 H 1 0.88 0.010 . . . . . . B 257 VAL HG13 . 31026 1 452 . 2 . 2 22 22 VAL HG21 H 1 1.01 0.010 . . . . . . B 257 VAL HG21 . 31026 1 453 . 2 . 2 22 22 VAL HG22 H 1 1.01 0.010 . . . . . . B 257 VAL HG22 . 31026 1 454 . 2 . 2 22 22 VAL HG23 H 1 1.01 0.010 . . . . . . B 257 VAL HG23 . 31026 1 455 . 2 . 2 22 22 VAL C C 13 177.91 0.030 . 1 . . . . B 257 VAL C . 31026 1 456 . 2 . 2 22 22 VAL CA C 13 65.99 0.050 . 1 . . . . B 257 VAL CA . 31026 1 457 . 2 . 2 22 22 VAL CG1 C 13 21.67 0.020 . . . . . . B 257 VAL CG1 . 31026 1 458 . 2 . 2 22 22 VAL CG2 C 13 23.11 0.020 . . . . . . B 257 VAL CG2 . 31026 1 459 . 2 . 2 22 22 VAL N N 15 118.3 0.020 . 1 . . . . B 257 VAL N . 31026 1 460 . 2 . 2 23 23 ILE H H 1 7.84 0.002 . 1 . . . . B 258 ILE H . 31026 1 461 . 2 . 2 23 23 ILE HA H 1 3.61 0.010 . 1 . . . . B 258 ILE HA . 31026 1 462 . 2 . 2 23 23 ILE HB H 1 1.88 0.010 . 1 . . . . B 258 ILE HB . 31026 1 463 . 2 . 2 23 23 ILE HG21 H 1 0.78 0.010 . 1 . . . . B 258 ILE HG21 . 31026 1 464 . 2 . 2 23 23 ILE HG22 H 1 0.78 0.010 . 1 . . . . B 258 ILE HG22 . 31026 1 465 . 2 . 2 23 23 ILE HG23 H 1 0.78 0.010 . 1 . . . . B 258 ILE HG23 . 31026 1 466 . 2 . 2 23 23 ILE HD11 H 1 0.51 0.010 . 1 . . . . B 258 ILE HD11 . 31026 1 467 . 2 . 2 23 23 ILE HD12 H 1 0.51 0.010 . 1 . . . . B 258 ILE HD12 . 31026 1 468 . 2 . 2 23 23 ILE HD13 H 1 0.51 0.010 . 1 . . . . B 258 ILE HD13 . 31026 1 469 . 2 . 2 23 23 ILE C C 13 177.79 0.030 . 1 . . . . B 258 ILE C . 31026 1 470 . 2 . 2 23 23 ILE CA C 13 64.1 0.050 . 1 . . . . B 258 ILE CA . 31026 1 471 . 2 . 2 23 23 ILE CG2 C 13 17.39 0.020 . 1 . . . . B 258 ILE CG2 . 31026 1 472 . 2 . 2 23 23 ILE CD1 C 13 12.55 0.020 . 1 . . . . B 258 ILE CD1 . 31026 1 473 . 2 . 2 23 23 ILE N N 15 119.47 0.020 . 1 . . . . B 258 ILE N . 31026 1 474 . 2 . 2 24 24 LEU H H 1 8.38 0.002 . 1 . . . . B 259 LEU H . 31026 1 475 . 2 . 2 24 24 LEU HA H 1 3.92 0.010 . 1 . . . . B 259 LEU HA . 31026 1 476 . 2 . 2 24 24 LEU HB2 H 1 1.77 0.020 . . . . . . B 259 LEU HB2 . 31026 1 477 . 2 . 2 24 24 LEU HB3 H 1 1.77 0.020 . . . . . . B 259 LEU HB3 . 31026 1 478 . 2 . 2 24 24 LEU HG H 1 1.52 0.010 . 1 . . . . B 259 LEU HG . 31026 1 479 . 2 . 2 24 24 LEU HD11 H 1 0.8 0.010 . . . . . . B 259 LEU HD11 . 31026 1 480 . 2 . 2 24 24 LEU HD12 H 1 0.8 0.010 . . . . . . B 259 LEU HD12 . 31026 1 481 . 2 . 2 24 24 LEU HD13 H 1 0.8 0.010 . . . . . . B 259 LEU HD13 . 31026 1 482 . 2 . 2 24 24 LEU HD21 H 1 0.78 0.020 . . . . . . B 259 LEU HD21 . 31026 1 483 . 2 . 2 24 24 LEU HD22 H 1 0.78 0.020 . . . . . . B 259 LEU HD22 . 31026 1 484 . 2 . 2 24 24 LEU HD23 H 1 0.78 0.020 . . . . . . B 259 LEU HD23 . 31026 1 485 . 2 . 2 24 24 LEU C C 13 178.04 0.030 . 1 . . . . B 259 LEU C . 31026 1 486 . 2 . 2 24 24 LEU CA C 13 57.1 0.050 . 1 . . . . B 259 LEU CA . 31026 1 487 . 2 . 2 24 24 LEU CD1 C 13 24.7 0.020 . . . . . . B 259 LEU CD1 . 31026 1 488 . 2 . 2 24 24 LEU CD2 C 13 23.87 0.020 . . . . . . B 259 LEU CD2 . 31026 1 489 . 2 . 2 24 24 LEU N N 15 119.59 0.020 . 1 . . . . B 259 LEU N . 31026 1 490 . 2 . 2 26 26 HIS H H 1 7.92 0.002 . 1 . . . . B 261 HIS H . 31026 1 491 . 2 . 2 26 26 HIS HA H 1 4.25 0.010 . 1 . . . . B 261 HIS HA . 31026 1 492 . 2 . 2 26 26 HIS HB2 H 1 3.12 0.010 . . . . . . B 261 HIS HB2 . 31026 1 493 . 2 . 2 26 26 HIS HB3 H 1 3.37 0.010 . . . . . . B 261 HIS HB3 . 31026 1 494 . 2 . 2 26 26 HIS C C 13 177.21 0.030 . 1 . . . . B 261 HIS C . 31026 1 495 . 2 . 2 26 26 HIS CA C 13 59.35 0.050 . 1 . . . . B 261 HIS CA . 31026 1 496 . 2 . 2 26 26 HIS N N 15 115.72 0.020 . 1 . . . . B 261 HIS N . 31026 1 497 . 2 . 2 27 27 VAL H H 1 8.05 0.002 . 1 . . . . B 262 VAL H . 31026 1 498 . 2 . 2 27 27 VAL HA H 1 3.75 0.010 . 1 . . . . B 262 VAL HA . 31026 1 499 . 2 . 2 27 27 VAL HB H 1 2.21 0.010 . 1 . . . . B 262 VAL HB . 31026 1 500 . 2 . 2 27 27 VAL HG11 H 1 0.95 0.010 . . . . . . B 262 VAL HG11 . 31026 1 501 . 2 . 2 27 27 VAL HG12 H 1 0.95 0.010 . . . . . . B 262 VAL HG12 . 31026 1 502 . 2 . 2 27 27 VAL HG13 H 1 0.95 0.010 . . . . . . B 262 VAL HG13 . 31026 1 503 . 2 . 2 27 27 VAL HG21 H 1 1.09 0.010 . . . . . . B 262 VAL HG21 . 31026 1 504 . 2 . 2 27 27 VAL HG22 H 1 1.09 0.010 . . . . . . B 262 VAL HG22 . 31026 1 505 . 2 . 2 27 27 VAL HG23 H 1 1.09 0.010 . . . . . . B 262 VAL HG23 . 31026 1 506 . 2 . 2 27 27 VAL C C 13 177.63 0.030 . 1 . . . . B 262 VAL C . 31026 1 507 . 2 . 2 27 27 VAL CA C 13 64.26 0.050 . 1 . . . . B 262 VAL CA . 31026 1 508 . 2 . 2 27 27 VAL CG1 C 13 21.51 0.020 . . . . . . B 262 VAL CG1 . 31026 1 509 . 2 . 2 27 27 VAL CG2 C 13 22.12 0.020 . . . . . . B 262 VAL CG2 . 31026 1 510 . 2 . 2 27 27 VAL N N 15 115.84 0.020 . 1 . . . . B 262 VAL N . 31026 1 511 . 2 . 2 28 28 LEU H H 1 8.02 0.002 . 1 . . . . B 263 LEU H . 31026 1 512 . 2 . 2 28 28 LEU HA H 1 4.15 0.010 . 1 . . . . B 263 LEU HA . 31026 1 513 . 2 . 2 28 28 LEU HB2 H 1 1.59 0.010 . . . . . . B 263 LEU HB2 . 31026 1 514 . 2 . 2 28 28 LEU HB3 H 1 1.7 0.010 . . . . . . B 263 LEU HB3 . 31026 1 515 . 2 . 2 28 28 LEU HG H 1 1.18 0.020 . 1 . . . . B 263 LEU HG . 31026 1 516 . 2 . 2 28 28 LEU HD11 H 1 0.72 0.010 . . . . . . B 263 LEU HD11 . 31026 1 517 . 2 . 2 28 28 LEU HD12 H 1 0.72 0.010 . . . . . . B 263 LEU HD12 . 31026 1 518 . 2 . 2 28 28 LEU HD13 H 1 0.72 0.010 . . . . . . B 263 LEU HD13 . 31026 1 519 . 2 . 2 28 28 LEU HD21 H 1 0.76 0.010 . . . . . . B 263 LEU HD21 . 31026 1 520 . 2 . 2 28 28 LEU HD22 H 1 0.76 0.010 . . . . . . B 263 LEU HD22 . 31026 1 521 . 2 . 2 28 28 LEU HD23 H 1 0.76 0.010 . . . . . . B 263 LEU HD23 . 31026 1 522 . 2 . 2 28 28 LEU C C 13 177.67 0.030 . 1 . . . . B 263 LEU C . 31026 1 523 . 2 . 2 28 28 LEU CA C 13 55.53 0.050 . 1 . . . . B 263 LEU CA . 31026 1 524 . 2 . 2 28 28 LEU CD1 C 13 25.57 0.020 . . . . . . B 263 LEU CD1 . 31026 1 525 . 2 . 2 28 28 LEU CD2 C 13 22.83 0.020 . . . . . . B 263 LEU CD2 . 31026 1 526 . 2 . 2 28 28 LEU N N 15 117.65 0.020 . 1 . . . . B 263 LEU N . 31026 1 527 . 2 . 2 29 29 TRP H H 1 7.8 0.002 . 1 . . . . B 264 TRP H . 31026 1 528 . 2 . 2 29 29 TRP HA H 1 4.61 0.010 . 1 . . . . B 264 TRP HA . 31026 1 529 . 2 . 2 29 29 TRP HB2 H 1 3.26 0.020 . . . . . . B 264 TRP HB2 . 31026 1 530 . 2 . 2 29 29 TRP HB3 H 1 3.33 0.020 . . . . . . B 264 TRP HB3 . 31026 1 531 . 2 . 2 29 29 TRP HE1 H 1 10.24 0.010 . 1 . . . . B 264 TRP HE1 . 31026 1 532 . 2 . 2 29 29 TRP C C 13 175.85 0.030 . 1 . . . . B 264 TRP C . 31026 1 533 . 2 . 2 29 29 TRP N N 15 119.18 0.020 . 1 . . . . B 264 TRP N . 31026 1 534 . 2 . 2 30 30 LYS H H 1 7.54 0.002 . 1 . . . . B 265 LYS H . 31026 1 535 . 2 . 2 30 30 LYS HA H 1 4.19 0.010 . 1 . . . . B 265 LYS HA . 31026 1 536 . 2 . 2 30 30 LYS HB2 H 1 1.77 0.010 . . . . . . B 265 LYS HB2 . 31026 1 537 . 2 . 2 30 30 LYS HB3 H 1 1.77 0.010 . . . . . . B 265 LYS HB3 . 31026 1 538 . 2 . 2 30 30 LYS HG2 H 1 1.35 0.010 . . . . . . B 265 LYS HG2 . 31026 1 539 . 2 . 2 30 30 LYS HG3 H 1 1.35 0.010 . . . . . . B 265 LYS HG3 . 31026 1 540 . 2 . 2 30 30 LYS HD2 H 1 1.69 0.010 . . . . . . B 265 LYS HD2 . 31026 1 541 . 2 . 2 30 30 LYS HD3 H 1 1.69 0.010 . . . . . . B 265 LYS HD3 . 31026 1 542 . 2 . 2 30 30 LYS C C 13 175.39 0.030 . 1 . . . . B 265 LYS C . 31026 1 543 . 2 . 2 30 30 LYS CA C 13 55.49 0.050 . 1 . . . . B 265 LYS CA . 31026 1 544 . 2 . 2 30 30 LYS N N 15 121.87 0.020 . 1 . . . . B 265 LYS N . 31026 1 545 . 2 . 2 31 31 LYS H H 1 7.68 0.002 . 1 . . . . B 266 LYS H . 31026 1 546 . 2 . 2 31 31 LYS HA H 1 4.07 0.010 . 1 . . . . B 266 LYS HA . 31026 1 547 . 2 . 2 31 31 LYS CA C 13 56.94 0.050 . 1 . . . . B 266 LYS CA . 31026 1 548 . 2 . 2 31 31 LYS N N 15 113.08 0.020 . 1 . . . . B 266 LYS N . 31026 1 stop_ save_