data_34673 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 34673 _Entry.Title ; Solution structure of RBM39 RRM2 bound to 5'-AGCUUUG-3 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2021-10-26 _Entry.Accession_date 2021-10-26 _Entry.Last_release_date 2021-11-08 _Entry.Original_release_date 2021-11-08 _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 S. Campagne S. . . . 34673 2 F. Allain F. H. . . 34673 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'RNA BINDING PROTEIN' . 34673 'RNA binding' . 34673 RRM . 34673 'extended RNA binding surface' . 34673 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 34673 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 360 34673 '15N chemical shifts' 87 34673 '1H chemical shifts' 638 34673 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2023-09-08 2021-10-26 update BMRB 'update entry citation' 34673 1 . . 2023-01-31 2021-10-26 original author 'original release' 34673 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 7Q33 'BMRB Entry Tracking System' 34673 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 34673 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 37666821 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Molecular basis of RNA-binding and autoregulation by the cancer-associated splicing factor RBM39 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Commun.' _Citation.Journal_name_full 'Nature communications' _Citation.Journal_volume 14 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2041-1723 _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 5366 _Citation.Page_last 5366 _Citation.Year 2023 _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 Sebastien Campagne S. . . . 34673 1 2 Daniel Jutzi D. . . . 34673 1 3 Florian Malard F. . . . 34673 1 4 Maja Matoga M. . . . 34673 1 5 Ksenija Romane K. . . . 34673 1 6 Miki Feldmuller M. . . . 34673 1 7 Martino Colombo M. . . . 34673 1 8 Marc-David Ruepp M. D. . . 34673 1 9 'Frederic H-T' Allain F. H. . . 34673 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 34673 _Assembly.ID 1 _Assembly.Name 'RNA-binding protein 39/RNA Complex' _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 . . . . . . 34673 1 2 unit_2 2 $entity_2 B B yes . . . . . . 34673 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 34673 _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 ; MAGPMRLYVGSLHFNITEDM LRGIFEPFGRIESIQLMMDS ETGRSKGYGFITFSDSECAK KALEQLNGFELAGRPMKVGH VTERTDALELVPR ; _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 93 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 10441.014 _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 'CAPER alpha' common 34673 1 CAPERalpha common 34673 1 'Hepatocellular carcinoma protein 1' common 34673 1 'RNA-binding motif protein 39' common 34673 1 'RNA-binding region-containing protein 2' common 34673 1 'Splicing factor HCC1' common 34673 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 1 246 MET . 34673 1 2 247 ALA . 34673 1 3 248 GLY . 34673 1 4 249 PRO . 34673 1 5 250 MET . 34673 1 6 251 ARG . 34673 1 7 252 LEU . 34673 1 8 253 TYR . 34673 1 9 254 VAL . 34673 1 10 255 GLY . 34673 1 11 256 SER . 34673 1 12 257 LEU . 34673 1 13 258 HIS . 34673 1 14 259 PHE . 34673 1 15 260 ASN . 34673 1 16 261 ILE . 34673 1 17 262 THR . 34673 1 18 263 GLU . 34673 1 19 264 ASP . 34673 1 20 265 MET . 34673 1 21 266 LEU . 34673 1 22 267 ARG . 34673 1 23 268 GLY . 34673 1 24 269 ILE . 34673 1 25 270 PHE . 34673 1 26 271 GLU . 34673 1 27 272 PRO . 34673 1 28 273 PHE . 34673 1 29 274 GLY . 34673 1 30 275 ARG . 34673 1 31 276 ILE . 34673 1 32 277 GLU . 34673 1 33 278 SER . 34673 1 34 279 ILE . 34673 1 35 280 GLN . 34673 1 36 281 LEU . 34673 1 37 282 MET . 34673 1 38 283 MET . 34673 1 39 284 ASP . 34673 1 40 285 SER . 34673 1 41 286 GLU . 34673 1 42 287 THR . 34673 1 43 288 GLY . 34673 1 44 289 ARG . 34673 1 45 290 SER . 34673 1 46 291 LYS . 34673 1 47 292 GLY . 34673 1 48 293 TYR . 34673 1 49 294 GLY . 34673 1 50 295 PHE . 34673 1 51 296 ILE . 34673 1 52 297 THR . 34673 1 53 298 PHE . 34673 1 54 299 SER . 34673 1 55 300 ASP . 34673 1 56 301 SER . 34673 1 57 302 GLU . 34673 1 58 303 CYS . 34673 1 59 304 ALA . 34673 1 60 305 LYS . 34673 1 61 306 LYS . 34673 1 62 307 ALA . 34673 1 63 308 LEU . 34673 1 64 309 GLU . 34673 1 65 310 GLN . 34673 1 66 311 LEU . 34673 1 67 312 ASN . 34673 1 68 313 GLY . 34673 1 69 314 PHE . 34673 1 70 315 GLU . 34673 1 71 316 LEU . 34673 1 72 317 ALA . 34673 1 73 318 GLY . 34673 1 74 319 ARG . 34673 1 75 320 PRO . 34673 1 76 321 MET . 34673 1 77 322 LYS . 34673 1 78 323 VAL . 34673 1 79 324 GLY . 34673 1 80 325 HIS . 34673 1 81 326 VAL . 34673 1 82 327 THR . 34673 1 83 328 GLU . 34673 1 84 329 ARG . 34673 1 85 330 THR . 34673 1 86 331 ASP . 34673 1 87 332 ALA . 34673 1 88 333 LEU . 34673 1 89 334 GLU . 34673 1 90 335 LEU . 34673 1 91 336 VAL . 34673 1 92 337 PRO . 34673 1 93 338 ARG . 34673 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 34673 1 . ALA 2 2 34673 1 . GLY 3 3 34673 1 . PRO 4 4 34673 1 . MET 5 5 34673 1 . ARG 6 6 34673 1 . LEU 7 7 34673 1 . TYR 8 8 34673 1 . VAL 9 9 34673 1 . GLY 10 10 34673 1 . SER 11 11 34673 1 . LEU 12 12 34673 1 . HIS 13 13 34673 1 . PHE 14 14 34673 1 . ASN 15 15 34673 1 . ILE 16 16 34673 1 . THR 17 17 34673 1 . GLU 18 18 34673 1 . ASP 19 19 34673 1 . MET 20 20 34673 1 . LEU 21 21 34673 1 . ARG 22 22 34673 1 . GLY 23 23 34673 1 . ILE 24 24 34673 1 . PHE 25 25 34673 1 . GLU 26 26 34673 1 . PRO 27 27 34673 1 . PHE 28 28 34673 1 . GLY 29 29 34673 1 . ARG 30 30 34673 1 . ILE 31 31 34673 1 . GLU 32 32 34673 1 . SER 33 33 34673 1 . ILE 34 34 34673 1 . GLN 35 35 34673 1 . LEU 36 36 34673 1 . MET 37 37 34673 1 . MET 38 38 34673 1 . ASP 39 39 34673 1 . SER 40 40 34673 1 . GLU 41 41 34673 1 . THR 42 42 34673 1 . GLY 43 43 34673 1 . ARG 44 44 34673 1 . SER 45 45 34673 1 . LYS 46 46 34673 1 . GLY 47 47 34673 1 . TYR 48 48 34673 1 . GLY 49 49 34673 1 . PHE 50 50 34673 1 . ILE 51 51 34673 1 . THR 52 52 34673 1 . PHE 53 53 34673 1 . SER 54 54 34673 1 . ASP 55 55 34673 1 . SER 56 56 34673 1 . GLU 57 57 34673 1 . CYS 58 58 34673 1 . ALA 59 59 34673 1 . LYS 60 60 34673 1 . LYS 61 61 34673 1 . ALA 62 62 34673 1 . LEU 63 63 34673 1 . GLU 64 64 34673 1 . GLN 65 65 34673 1 . LEU 66 66 34673 1 . ASN 67 67 34673 1 . GLY 68 68 34673 1 . PHE 69 69 34673 1 . GLU 70 70 34673 1 . LEU 71 71 34673 1 . ALA 72 72 34673 1 . GLY 73 73 34673 1 . ARG 74 74 34673 1 . PRO 75 75 34673 1 . MET 76 76 34673 1 . LYS 77 77 34673 1 . VAL 78 78 34673 1 . GLY 79 79 34673 1 . HIS 80 80 34673 1 . VAL 81 81 34673 1 . THR 82 82 34673 1 . GLU 83 83 34673 1 . ARG 84 84 34673 1 . THR 85 85 34673 1 . ASP 86 86 34673 1 . ALA 87 87 34673 1 . LEU 88 88 34673 1 . GLU 89 89 34673 1 . LEU 90 90 34673 1 . VAL 91 91 34673 1 . PRO 92 92 34673 1 . ARG 93 93 34673 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 34673 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; AGCUUUG ; _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 7 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 2198.339 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 1 701 A . 34673 2 2 702 G . 34673 2 3 703 C . 34673 2 4 704 U . 34673 2 5 705 U . 34673 2 6 706 U . 34673 2 7 707 G . 34673 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 . A 1 1 34673 2 . G 2 2 34673 2 . C 3 3 34673 2 . U 4 4 34673 2 . U 5 5 34673 2 . U 6 6 34673 2 . G 7 7 34673 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 34673 _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 . . . . . . . . . . . 'RBM39, HCC1, RNPC2' . 34673 1 2 2 $entity_2 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 34673 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 34673 _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-Gold(DE3)pLysS AG'" . . 866768 . . . . . . . . . . . . 34673 1 2 2 $entity_2 . 'recombinant technology' 'synthetic construct' . . 32630 synthetic construct . . . . . . . . . . 34673 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 34673 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '10 mM NaPO4, 50 mM sodium chloride, 2 mM DTT, 1.2 mM 13C; 15N RBM39 RRM2, 1.2 mM AGCUUUG, 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 NaPO4 'natural abundance' . . . . . . 10 . . mM . . . . 34673 1 2 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 34673 1 3 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 34673 1 4 'RBM39 RRM2' '[U-13C; U-15N]' . . 1 $entity_1 . . 1.2 . . mM . . . . 34673 1 5 AGCUUUG 'natural abundance' . . 2 $entity_2 . . 1.2 . . mM . . . . 34673 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 34673 _Sample.ID 2 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '10 mM NaPO4, 50 mM sodium chloride, 2 mM DTT, 1.2 mM 13C; 15N RBM39 RRM2, 1.2 mM AGCUUUG, 100% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 NaPO4 'natural abundance' . . . . . . 10 . . mM . . . . 34673 2 2 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 34673 2 3 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 34673 2 4 'RBM39 RRM2' '[U-13C; U-15N]' . . 1 $entity_1 . . 1.2 . . mM . . . . 34673 2 5 AGCUUUG 'natural abundance' . . 2 $entity_2 . . 1.2 . . mM . . . . 34673 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 34673 _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' 60 . mM 34673 1 pH 6.5 . pH 34673 1 pressure 1 . atm 34673 1 temperature 308 . K 34673 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 34673 _Software.ID 1 _Software.Type . _Software.Name CARA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 34673 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 34673 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 34673 _Software.ID 2 _Software.Type . _Software.Name CYANA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 34673 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'structure calculation' . 34673 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 34673 _Software.ID 3 _Software.Type . _Software.Name Amber _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham III, Simmerling, Wang, Duke, Luo, ... and Kollman' . . 34673 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID refinement . 34673 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 34673 _Software.ID 4 _Software.Type . _Software.Name ATNOS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Thorsten . . 34673 4 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'peak picking' . 34673 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 34673 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE NEO' _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 34673 _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 34673 _NMR_spectrometer.ID 3 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III HD' _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 34673 _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 NEO' . 600 . . . 34673 1 2 NMR_spectrometer_2 Bruker 'AVANCE NEO' . 700 . . . 34673 1 3 NMR_spectrometer_3 Bruker 'AVANCE III HD' . 900 . . . 34673 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 34673 _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 HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34673 1 2 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34673 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34673 1 4 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34673 1 5 '3D H(CCO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34673 1 6 '3D C(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34673 1 7 '3D 1H-15N NOESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 34673 1 8 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 34673 1 9 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 34673 1 10 '2D F1FF2F NOESY' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 34673 1 11 '2D F2F NOESY' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 34673 1 12 '2D F2f TOCSY' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 34673 1 13 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 34673 1 14 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 34673 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 34673 _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 . . . . . 34673 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 34673 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.101329118 . . . . . 34673 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 34673 _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 HSQC' . . . 34673 1 2 '3D HNCACB' . . . 34673 1 3 '3D CBCA(CO)NH' . . . 34673 1 4 '3D HNCO' . . . 34673 1 5 '3D H(CCO)NH' . . . 34673 1 6 '3D C(CO)NH' . . . 34673 1 7 '3D 1H-15N NOESY' . . . 34673 1 8 '3D 1H-13C NOESY aliphatic' . . . 34673 1 9 '3D 1H-13C NOESY aromatic' . . . 34673 1 10 '2D F1FF2F NOESY' . . . 34673 1 11 '2D F2F NOESY' . . . 34673 1 12 '2D F2f TOCSY' . . . 34673 1 13 '3D 1H-13C NOESY aliphatic' . . . 34673 1 14 '3D 1H-13C NOESY aromatic' . . . 34673 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 34673 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 2 2 ALA H H 1 8.622 0.020 . 1 . . . . A 247 ALA H . 34673 1 2 . 1 . 1 2 2 ALA HB1 H 1 1.671 0.020 . 1 . . . . A 247 ALA HB1 . 34673 1 3 . 1 . 1 2 2 ALA HB2 H 1 1.671 0.020 . 1 . . . . A 247 ALA HB2 . 34673 1 4 . 1 . 1 2 2 ALA HB3 H 1 1.671 0.020 . 1 . . . . A 247 ALA HB3 . 34673 1 5 . 1 . 1 2 2 ALA C C 13 177.178 0.3 . 1 . . . . A 247 ALA C . 34673 1 6 . 1 . 1 2 2 ALA CB C 13 19.766 0.3 . 1 . . . . A 247 ALA CB . 34673 1 7 . 1 . 1 2 2 ALA N N 15 126.133 0.3 . 1 . . . . A 247 ALA N . 34673 1 8 . 1 . 1 3 3 GLY H H 1 8.331 0.020 . 1 . . . . A 248 GLY H . 34673 1 9 . 1 . 1 3 3 GLY HA2 H 1 3.542 0.020 . 2 . . . . A 248 GLY HA2 . 34673 1 10 . 1 . 1 3 3 GLY HA3 H 1 3.557 0.020 . 2 . . . . A 248 GLY HA3 . 34673 1 11 . 1 . 1 3 3 GLY CA C 13 43.848 0.3 . 1 . . . . A 248 GLY CA . 34673 1 12 . 1 . 1 3 3 GLY N N 15 110.888 0.3 . 1 . . . . A 248 GLY N . 34673 1 13 . 1 . 1 4 4 PRO HA H 1 4.666 0.020 . 1 . . . . A 249 PRO HA . 34673 1 14 . 1 . 1 4 4 PRO HB2 H 1 1.777 0.020 . 2 . . . . A 249 PRO HB2 . 34673 1 15 . 1 . 1 4 4 PRO HB3 H 1 2.285 0.020 . 2 . . . . A 249 PRO HB3 . 34673 1 16 . 1 . 1 4 4 PRO C C 13 176.848 0.3 . 1 . . . . A 249 PRO C . 34673 1 17 . 1 . 1 4 4 PRO CA C 13 63.286 0.3 . 1 . . . . A 249 PRO CA . 34673 1 18 . 1 . 1 4 4 PRO CB C 13 33.248 0.3 . 1 . . . . A 249 PRO CB . 34673 1 19 . 1 . 1 4 4 PRO CG C 13 26.328 0.3 . 1 . . . . A 249 PRO CG . 34673 1 20 . 1 . 1 4 4 PRO CD C 13 49.465 0.3 . 1 . . . . A 249 PRO CD . 34673 1 21 . 1 . 1 5 5 MET H H 1 8.183 0.020 . 1 . . . . A 250 MET H . 34673 1 22 . 1 . 1 5 5 MET HA H 1 4.669 0.020 . 1 . . . . A 250 MET HA . 34673 1 23 . 1 . 1 5 5 MET HB2 H 1 2.054 0.020 . 2 . . . . A 250 MET HB2 . 34673 1 24 . 1 . 1 5 5 MET HB3 H 1 1.703 0.020 . 2 . . . . A 250 MET HB3 . 34673 1 25 . 1 . 1 5 5 MET HG2 H 1 2.670 0.020 . 2 . . . . A 250 MET HG2 . 34673 1 26 . 1 . 1 5 5 MET HG3 H 1 2.376 0.020 . 2 . . . . A 250 MET HG3 . 34673 1 27 . 1 . 1 5 5 MET HE1 H 1 2.100 0.020 . 1 . . . . A 250 MET HE1 . 34673 1 28 . 1 . 1 5 5 MET HE2 H 1 2.100 0.020 . 1 . . . . A 250 MET HE2 . 34673 1 29 . 1 . 1 5 5 MET HE3 H 1 2.100 0.020 . 1 . . . . A 250 MET HE3 . 34673 1 30 . 1 . 1 5 5 MET C C 13 172.909 0.3 . 1 . . . . A 250 MET C . 34673 1 31 . 1 . 1 5 5 MET CA C 13 55.739 0.3 . 1 . . . . A 250 MET CA . 34673 1 32 . 1 . 1 5 5 MET CB C 13 37.363 0.3 . 1 . . . . A 250 MET CB . 34673 1 33 . 1 . 1 5 5 MET CG C 13 32.487 0.3 . 1 . . . . A 250 MET CG . 34673 1 34 . 1 . 1 5 5 MET CE C 13 17.793 0.3 . 1 . . . . A 250 MET CE . 34673 1 35 . 1 . 1 5 5 MET N N 15 118.500 0.3 . 1 . . . . A 250 MET N . 34673 1 36 . 1 . 1 6 6 ARG H H 1 8.849 0.020 . 1 . . . . A 251 ARG H . 34673 1 37 . 1 . 1 6 6 ARG HA H 1 5.297 0.020 . 1 . . . . A 251 ARG HA . 34673 1 38 . 1 . 1 6 6 ARG HB2 H 1 1.863 0.020 . 2 . . . . A 251 ARG HB2 . 34673 1 39 . 1 . 1 6 6 ARG HB3 H 1 1.749 0.020 . 2 . . . . A 251 ARG HB3 . 34673 1 40 . 1 . 1 6 6 ARG HG2 H 1 1.664 0.020 . 2 . . . . A 251 ARG HG2 . 34673 1 41 . 1 . 1 6 6 ARG HG3 H 1 1.656 0.020 . 2 . . . . A 251 ARG HG3 . 34673 1 42 . 1 . 1 6 6 ARG HD2 H 1 3.035 0.020 . 1 . . . . A 251 ARG HD2 . 34673 1 43 . 1 . 1 6 6 ARG HD3 H 1 3.035 0.020 . 1 . . . . A 251 ARG HD3 . 34673 1 44 . 1 . 1 6 6 ARG C C 13 174.206 0.3 . 1 . . . . A 251 ARG C . 34673 1 45 . 1 . 1 6 6 ARG CA C 13 55.037 0.3 . 1 . . . . A 251 ARG CA . 34673 1 46 . 1 . 1 6 6 ARG CB C 13 33.087 0.3 . 1 . . . . A 251 ARG CB . 34673 1 47 . 1 . 1 6 6 ARG CG C 13 27.611 0.3 . 1 . . . . A 251 ARG CG . 34673 1 48 . 1 . 1 6 6 ARG CD C 13 43.713 0.3 . 1 . . . . A 251 ARG CD . 34673 1 49 . 1 . 1 6 6 ARG N N 15 129.826 0.3 . 1 . . . . A 251 ARG N . 34673 1 50 . 1 . 1 7 7 LEU H H 1 9.340 0.020 . 1 . . . . A 252 LEU H . 34673 1 51 . 1 . 1 7 7 LEU HA H 1 5.168 0.020 . 1 . . . . A 252 LEU HA . 34673 1 52 . 1 . 1 7 7 LEU HB2 H 1 1.701 0.020 . 2 . . . . A 252 LEU HB2 . 34673 1 53 . 1 . 1 7 7 LEU HB3 H 1 1.587 0.020 . 2 . . . . A 252 LEU HB3 . 34673 1 54 . 1 . 1 7 7 LEU HG H 1 1.556 0.020 . 1 . . . . A 252 LEU HG . 34673 1 55 . 1 . 1 7 7 LEU HD11 H 1 1.114 0.020 . 2 . . . . A 252 LEU HD11 . 34673 1 56 . 1 . 1 7 7 LEU HD12 H 1 1.114 0.020 . 2 . . . . A 252 LEU HD12 . 34673 1 57 . 1 . 1 7 7 LEU HD13 H 1 1.114 0.020 . 2 . . . . A 252 LEU HD13 . 34673 1 58 . 1 . 1 7 7 LEU HD21 H 1 0.801 0.020 . 2 . . . . A 252 LEU HD21 . 34673 1 59 . 1 . 1 7 7 LEU HD22 H 1 0.801 0.020 . 2 . . . . A 252 LEU HD22 . 34673 1 60 . 1 . 1 7 7 LEU HD23 H 1 0.801 0.020 . 2 . . . . A 252 LEU HD23 . 34673 1 61 . 1 . 1 7 7 LEU C C 13 176.337 0.3 . 1 . . . . A 252 LEU C . 34673 1 62 . 1 . 1 7 7 LEU CA C 13 53.152 0.3 . 1 . . . . A 252 LEU CA . 34673 1 63 . 1 . 1 7 7 LEU CB C 13 44.945 0.3 . 1 . . . . A 252 LEU CB . 34673 1 64 . 1 . 1 7 7 LEU CG C 13 27.567 0.3 . 1 . . . . A 252 LEU CG . 34673 1 65 . 1 . 1 7 7 LEU CD1 C 13 24.131 0.3 . 1 . . . . A 252 LEU CD1 . 34673 1 66 . 1 . 1 7 7 LEU CD2 C 13 22.951 0.3 . 1 . . . . A 252 LEU CD2 . 34673 1 67 . 1 . 1 7 7 LEU N N 15 122.547 0.3 . 1 . . . . A 252 LEU N . 34673 1 68 . 1 . 1 8 8 TYR H H 1 8.703 0.020 . 1 . . . . A 253 TYR H . 34673 1 69 . 1 . 1 8 8 TYR HA H 1 4.760 0.020 . 1 . . . . A 253 TYR HA . 34673 1 70 . 1 . 1 8 8 TYR HB2 H 1 2.913 0.020 . 2 . . . . A 253 TYR HB2 . 34673 1 71 . 1 . 1 8 8 TYR HB3 H 1 2.436 0.020 . 2 . . . . A 253 TYR HB3 . 34673 1 72 . 1 . 1 8 8 TYR HD1 H 1 6.596 0.020 . 1 . . . . A 253 TYR HD1 . 34673 1 73 . 1 . 1 8 8 TYR HD2 H 1 6.596 0.020 . 1 . . . . A 253 TYR HD2 . 34673 1 74 . 1 . 1 8 8 TYR HE1 H 1 6.302 0.020 . 1 . . . . A 253 TYR HE1 . 34673 1 75 . 1 . 1 8 8 TYR HE2 H 1 6.302 0.020 . 1 . . . . A 253 TYR HE2 . 34673 1 76 . 1 . 1 8 8 TYR C C 13 173.478 0.3 . 1 . . . . A 253 TYR C . 34673 1 77 . 1 . 1 8 8 TYR CA C 13 56.905 0.3 . 1 . . . . A 253 TYR CA . 34673 1 78 . 1 . 1 8 8 TYR CB C 13 40.382 0.3 . 1 . . . . A 253 TYR CB . 34673 1 79 . 1 . 1 8 8 TYR CD1 C 13 133.293 0.3 . 1 . . . . A 253 TYR CD1 . 34673 1 80 . 1 . 1 8 8 TYR CE1 C 13 118.263 0.3 . 1 . . . . A 253 TYR CE1 . 34673 1 81 . 1 . 1 8 8 TYR N N 15 122.825 0.3 . 1 . . . . A 253 TYR N . 34673 1 82 . 1 . 1 9 9 VAL H H 1 7.677 0.020 . 1 . . . . A 254 VAL H . 34673 1 83 . 1 . 1 9 9 VAL HA H 1 4.893 0.020 . 1 . . . . A 254 VAL HA . 34673 1 84 . 1 . 1 9 9 VAL HB H 1 1.560 0.020 . 1 . . . . A 254 VAL HB . 34673 1 85 . 1 . 1 9 9 VAL HG11 H 1 0.795 0.020 . 2 . . . . A 254 VAL HG11 . 34673 1 86 . 1 . 1 9 9 VAL HG12 H 1 0.795 0.020 . 2 . . . . A 254 VAL HG12 . 34673 1 87 . 1 . 1 9 9 VAL HG13 H 1 0.795 0.020 . 2 . . . . A 254 VAL HG13 . 34673 1 88 . 1 . 1 9 9 VAL HG21 H 1 0.717 0.020 . 2 . . . . A 254 VAL HG21 . 34673 1 89 . 1 . 1 9 9 VAL HG22 H 1 0.717 0.020 . 2 . . . . A 254 VAL HG22 . 34673 1 90 . 1 . 1 9 9 VAL HG23 H 1 0.717 0.020 . 2 . . . . A 254 VAL HG23 . 34673 1 91 . 1 . 1 9 9 VAL C C 13 173.566 0.3 . 1 . . . . A 254 VAL C . 34673 1 92 . 1 . 1 9 9 VAL CA C 13 58.848 0.3 . 1 . . . . A 254 VAL CA . 34673 1 93 . 1 . 1 9 9 VAL CB C 13 34.026 0.3 . 1 . . . . A 254 VAL CB . 34673 1 94 . 1 . 1 9 9 VAL CG1 C 13 21.926 0.3 . 1 . . . . A 254 VAL CG1 . 34673 1 95 . 1 . 1 9 9 VAL CG2 C 13 21.478 0.3 . 1 . . . . A 254 VAL CG2 . 34673 1 96 . 1 . 1 9 9 VAL N N 15 125.807 0.3 . 1 . . . . A 254 VAL N . 34673 1 97 . 1 . 1 10 10 GLY H H 1 8.898 0.020 . 1 . . . . A 255 GLY H . 34673 1 98 . 1 . 1 10 10 GLY HA2 H 1 4.936 0.020 . 2 . . . . A 255 GLY HA2 . 34673 1 99 . 1 . 1 10 10 GLY HA3 H 1 3.770 0.020 . 2 . . . . A 255 GLY HA3 . 34673 1 100 . 1 . 1 10 10 GLY C C 13 173.282 0.3 . 1 . . . . A 255 GLY C . 34673 1 101 . 1 . 1 10 10 GLY CA C 13 44.017 0.3 . 1 . . . . A 255 GLY CA . 34673 1 102 . 1 . 1 10 10 GLY N N 15 110.965 0.3 . 1 . . . . A 255 GLY N . 34673 1 103 . 1 . 1 11 11 SER H H 1 8.620 0.020 . 1 . . . . A 256 SER H . 34673 1 104 . 1 . 1 11 11 SER HA H 1 3.947 0.020 . 1 . . . . A 256 SER HA . 34673 1 105 . 1 . 1 11 11 SER HB2 H 1 4.726 0.020 . 2 . . . . A 256 SER HB2 . 34673 1 106 . 1 . 1 11 11 SER HB3 H 1 3.807 0.020 . 2 . . . . A 256 SER HB3 . 34673 1 107 . 1 . 1 11 11 SER C C 13 175.106 0.3 . 1 . . . . A 256 SER C . 34673 1 108 . 1 . 1 11 11 SER CA C 13 58.478 0.3 . 1 . . . . A 256 SER CA . 34673 1 109 . 1 . 1 11 11 SER CB C 13 64.095 0.3 . 1 . . . . A 256 SER CB . 34673 1 110 . 1 . 1 11 11 SER N N 15 114.760 0.3 . 1 . . . . A 256 SER N . 34673 1 111 . 1 . 1 12 12 LEU H H 1 8.590 0.020 . 1 . . . . A 257 LEU H . 34673 1 112 . 1 . 1 12 12 LEU HA H 1 4.287 0.020 . 1 . . . . A 257 LEU HA . 34673 1 113 . 1 . 1 12 12 LEU HB2 H 1 1.380 0.020 . 2 . . . . A 257 LEU HB2 . 34673 1 114 . 1 . 1 12 12 LEU HB3 H 1 1.268 0.020 . 2 . . . . A 257 LEU HB3 . 34673 1 115 . 1 . 1 12 12 LEU HG H 1 1.318 0.020 . 1 . . . . A 257 LEU HG . 34673 1 116 . 1 . 1 12 12 LEU HD11 H 1 0.825 0.020 . 2 . . . . A 257 LEU HD11 . 34673 1 117 . 1 . 1 12 12 LEU HD12 H 1 0.825 0.020 . 2 . . . . A 257 LEU HD12 . 34673 1 118 . 1 . 1 12 12 LEU HD13 H 1 0.825 0.020 . 2 . . . . A 257 LEU HD13 . 34673 1 119 . 1 . 1 12 12 LEU HD21 H 1 0.517 0.020 . 2 . . . . A 257 LEU HD21 . 34673 1 120 . 1 . 1 12 12 LEU HD22 H 1 0.517 0.020 . 2 . . . . A 257 LEU HD22 . 34673 1 121 . 1 . 1 12 12 LEU HD23 H 1 0.517 0.020 . 2 . . . . A 257 LEU HD23 . 34673 1 122 . 1 . 1 12 12 LEU C C 13 177.936 0.3 . 1 . . . . A 257 LEU C . 34673 1 123 . 1 . 1 12 12 LEU CA C 13 52.726 0.3 . 1 . . . . A 257 LEU CA . 34673 1 124 . 1 . 1 12 12 LEU CB C 13 43.374 0.3 . 1 . . . . A 257 LEU CB . 34673 1 125 . 1 . 1 12 12 LEU CG C 13 26.401 0.3 . 1 . . . . A 257 LEU CG . 34673 1 126 . 1 . 1 12 12 LEU CD1 C 13 23.152 0.3 . 1 . . . . A 257 LEU CD1 . 34673 1 127 . 1 . 1 12 12 LEU CD2 C 13 26.381 0.3 . 1 . . . . A 257 LEU CD2 . 34673 1 128 . 1 . 1 12 12 LEU N N 15 119.788 0.3 . 1 . . . . A 257 LEU N . 34673 1 129 . 1 . 1 13 13 HIS H H 1 9.259 0.020 . 1 . . . . A 258 HIS H . 34673 1 130 . 1 . 1 13 13 HIS HA H 1 4.433 0.020 . 1 . . . . A 258 HIS HA . 34673 1 131 . 1 . 1 13 13 HIS HB2 H 1 2.981 0.020 . 2 . . . . A 258 HIS HB2 . 34673 1 132 . 1 . 1 13 13 HIS HB3 H 1 2.995 0.020 . 2 . . . . A 258 HIS HB3 . 34673 1 133 . 1 . 1 13 13 HIS HD2 H 1 7.136 0.020 . 1 . . . . A 258 HIS HD2 . 34673 1 134 . 1 . 1 13 13 HIS HE1 H 1 7.573 0.020 . 1 . . . . A 258 HIS HE1 . 34673 1 135 . 1 . 1 13 13 HIS C C 13 177.936 0.3 . 1 . . . . A 258 HIS C . 34673 1 136 . 1 . 1 13 13 HIS CA C 13 57.781 0.3 . 1 . . . . A 258 HIS CA . 34673 1 137 . 1 . 1 13 13 HIS CB C 13 31.465 0.3 . 1 . . . . A 258 HIS CB . 34673 1 138 . 1 . 1 13 13 HIS CD2 C 13 118.058 0.3 . 1 . . . . A 258 HIS CD2 . 34673 1 139 . 1 . 1 13 13 HIS CE1 C 13 138.892 0.3 . 1 . . . . A 258 HIS CE1 . 34673 1 140 . 1 . 1 13 13 HIS N N 15 122.966 0.3 . 1 . . . . A 258 HIS N . 34673 1 141 . 1 . 1 14 14 PHE H H 1 7.228 0.020 . 1 . . . . A 259 PHE H . 34673 1 142 . 1 . 1 14 14 PHE HA H 1 4.383 0.020 . 1 . . . . A 259 PHE HA . 34673 1 143 . 1 . 1 14 14 PHE HB2 H 1 3.288 0.020 . 2 . . . . A 259 PHE HB2 . 34673 1 144 . 1 . 1 14 14 PHE HB3 H 1 2.989 0.020 . 2 . . . . A 259 PHE HB3 . 34673 1 145 . 1 . 1 14 14 PHE HD1 H 1 7.016 0.020 . 1 . . . . A 259 PHE HD1 . 34673 1 146 . 1 . 1 14 14 PHE HD2 H 1 7.016 0.020 . 1 . . . . A 259 PHE HD2 . 34673 1 147 . 1 . 1 14 14 PHE HE1 H 1 7.095 0.020 . 1 . . . . A 259 PHE HE1 . 34673 1 148 . 1 . 1 14 14 PHE HE2 H 1 7.095 0.020 . 1 . . . . A 259 PHE HE2 . 34673 1 149 . 1 . 1 14 14 PHE HZ H 1 6.854 0.020 . 1 . . . . A 259 PHE HZ . 34673 1 150 . 1 . 1 14 14 PHE C C 13 175.343 0.3 . 1 . . . . A 259 PHE C . 34673 1 151 . 1 . 1 14 14 PHE CA C 13 59.326 0.3 . 1 . . . . A 259 PHE CA . 34673 1 152 . 1 . 1 14 14 PHE CB C 13 37.941 0.3 . 1 . . . . A 259 PHE CB . 34673 1 153 . 1 . 1 14 14 PHE CD1 C 13 131.226 0.3 . 1 . . . . A 259 PHE CD1 . 34673 1 154 . 1 . 1 14 14 PHE CE1 C 13 131.282 0.3 . 1 . . . . A 259 PHE CE1 . 34673 1 155 . 1 . 1 14 14 PHE CZ C 13 127.891 0.3 . 1 . . . . A 259 PHE CZ . 34673 1 156 . 1 . 1 14 14 PHE N N 15 124.388 0.3 . 1 . . . . A 259 PHE N . 34673 1 157 . 1 . 1 15 15 ASN H H 1 9.600 0.020 . 1 . . . . A 260 ASN H . 34673 1 158 . 1 . 1 15 15 ASN HA H 1 4.880 0.020 . 1 . . . . A 260 ASN HA . 34673 1 159 . 1 . 1 15 15 ASN HB2 H 1 2.907 0.020 . 2 . . . . A 260 ASN HB2 . 34673 1 160 . 1 . 1 15 15 ASN HB3 H 1 2.835 0.020 . 2 . . . . A 260 ASN HB3 . 34673 1 161 . 1 . 1 15 15 ASN HD21 H 1 7.407 0.020 . 1 . . . . A 260 ASN HD21 . 34673 1 162 . 1 . 1 15 15 ASN HD22 H 1 6.638 0.020 . 1 . . . . A 260 ASN HD22 . 34673 1 163 . 1 . 1 15 15 ASN C C 13 175.467 0.3 . 1 . . . . A 260 ASN C . 34673 1 164 . 1 . 1 15 15 ASN CA C 13 52.812 0.3 . 1 . . . . A 260 ASN CA . 34673 1 165 . 1 . 1 15 15 ASN CB C 13 37.833 0.3 . 1 . . . . A 260 ASN CB . 34673 1 166 . 1 . 1 15 15 ASN N N 15 117.786 0.3 . 1 . . . . A 260 ASN N . 34673 1 167 . 1 . 1 15 15 ASN ND2 N 15 110.144 0.3 . 1 . . . . A 260 ASN ND2 . 34673 1 168 . 1 . 1 16 16 ILE H H 1 7.448 0.020 . 1 . . . . A 261 ILE H . 34673 1 169 . 1 . 1 16 16 ILE HA H 1 4.423 0.020 . 1 . . . . A 261 ILE HA . 34673 1 170 . 1 . 1 16 16 ILE HB H 1 2.298 0.020 . 1 . . . . A 261 ILE HB . 34673 1 171 . 1 . 1 16 16 ILE HG12 H 1 1.865 0.020 . 2 . . . . A 261 ILE HG12 . 34673 1 172 . 1 . 1 16 16 ILE HG13 H 1 1.654 0.020 . 2 . . . . A 261 ILE HG13 . 34673 1 173 . 1 . 1 16 16 ILE HG21 H 1 1.006 0.020 . 1 . . . . A 261 ILE HG21 . 34673 1 174 . 1 . 1 16 16 ILE HG22 H 1 1.006 0.020 . 1 . . . . A 261 ILE HG22 . 34673 1 175 . 1 . 1 16 16 ILE HG23 H 1 1.006 0.020 . 1 . . . . A 261 ILE HG23 . 34673 1 176 . 1 . 1 16 16 ILE HD11 H 1 0.861 0.020 . 1 . . . . A 261 ILE HD11 . 34673 1 177 . 1 . 1 16 16 ILE HD12 H 1 0.861 0.020 . 1 . . . . A 261 ILE HD12 . 34673 1 178 . 1 . 1 16 16 ILE HD13 H 1 0.861 0.020 . 1 . . . . A 261 ILE HD13 . 34673 1 179 . 1 . 1 16 16 ILE C C 13 176.693 0.3 . 1 . . . . A 261 ILE C . 34673 1 180 . 1 . 1 16 16 ILE CA C 13 59.739 0.3 . 1 . . . . A 261 ILE CA . 34673 1 181 . 1 . 1 16 16 ILE CB C 13 35.399 0.3 . 1 . . . . A 261 ILE CB . 34673 1 182 . 1 . 1 16 16 ILE CG1 C 13 27.271 0.3 . 1 . . . . A 261 ILE CG1 . 34673 1 183 . 1 . 1 16 16 ILE CG2 C 13 18.329 0.3 . 1 . . . . A 261 ILE CG2 . 34673 1 184 . 1 . 1 16 16 ILE CD1 C 13 10.528 0.3 . 1 . . . . A 261 ILE CD1 . 34673 1 185 . 1 . 1 16 16 ILE N N 15 119.776 0.3 . 1 . . . . A 261 ILE N . 34673 1 186 . 1 . 1 17 17 THR H H 1 7.389 0.020 . 1 . . . . A 262 THR H . 34673 1 187 . 1 . 1 17 17 THR HA H 1 4.631 0.020 . 1 . . . . A 262 THR HA . 34673 1 188 . 1 . 1 17 17 THR HB H 1 4.779 0.020 . 1 . . . . A 262 THR HB . 34673 1 189 . 1 . 1 17 17 THR HG21 H 1 1.377 0.020 . 1 . . . . A 262 THR HG21 . 34673 1 190 . 1 . 1 17 17 THR HG22 H 1 1.377 0.020 . 1 . . . . A 262 THR HG22 . 34673 1 191 . 1 . 1 17 17 THR HG23 H 1 1.377 0.020 . 1 . . . . A 262 THR HG23 . 34673 1 192 . 1 . 1 17 17 THR C C 13 175.574 0.3 . 1 . . . . A 262 THR C . 34673 1 193 . 1 . 1 17 17 THR CA C 13 59.728 0.3 . 1 . . . . A 262 THR CA . 34673 1 194 . 1 . 1 17 17 THR CB C 13 71.959 0.3 . 1 . . . . A 262 THR CB . 34673 1 195 . 1 . 1 17 17 THR CG2 C 13 21.920 0.3 . 1 . . . . A 262 THR CG2 . 34673 1 196 . 1 . 1 17 17 THR N N 15 117.661 0.3 . 1 . . . . A 262 THR N . 34673 1 197 . 1 . 1 18 18 GLU H H 1 9.310 0.020 . 1 . . . . A 263 GLU H . 34673 1 198 . 1 . 1 18 18 GLU HA H 1 3.705 0.020 . 1 . . . . A 263 GLU HA . 34673 1 199 . 1 . 1 18 18 GLU HB2 H 1 2.154 0.020 . 2 . . . . A 263 GLU HB2 . 34673 1 200 . 1 . 1 18 18 GLU HB3 H 1 1.987 0.020 . 2 . . . . A 263 GLU HB3 . 34673 1 201 . 1 . 1 18 18 GLU HG2 H 1 2.241 0.020 . 2 . . . . A 263 GLU HG2 . 34673 1 202 . 1 . 1 18 18 GLU HG3 H 1 2.247 0.020 . 2 . . . . A 263 GLU HG3 . 34673 1 203 . 1 . 1 18 18 GLU C C 13 178.156 0.3 . 1 . . . . A 263 GLU C . 34673 1 204 . 1 . 1 18 18 GLU CA C 13 60.860 0.3 . 1 . . . . A 263 GLU CA . 34673 1 205 . 1 . 1 18 18 GLU CB C 13 29.328 0.3 . 1 . . . . A 263 GLU CB . 34673 1 206 . 1 . 1 18 18 GLU CG C 13 37.525 0.3 . 1 . . . . A 263 GLU CG . 34673 1 207 . 1 . 1 18 18 GLU N N 15 120.470 0.3 . 1 . . . . A 263 GLU N . 34673 1 208 . 1 . 1 19 19 ASP H H 1 8.292 0.020 . 1 . . . . A 264 ASP H . 34673 1 209 . 1 . 1 19 19 ASP HA H 1 4.416 0.020 . 1 . . . . A 264 ASP HA . 34673 1 210 . 1 . 1 19 19 ASP HB2 H 1 2.656 0.020 . 2 . . . . A 264 ASP HB2 . 34673 1 211 . 1 . 1 19 19 ASP HB3 H 1 2.602 0.020 . 2 . . . . A 264 ASP HB3 . 34673 1 212 . 1 . 1 19 19 ASP C C 13 179.329 0.3 . 1 . . . . A 264 ASP C . 34673 1 213 . 1 . 1 19 19 ASP CA C 13 57.198 0.3 . 1 . . . . A 264 ASP CA . 34673 1 214 . 1 . 1 19 19 ASP CB C 13 40.563 0.3 . 1 . . . . A 264 ASP CB . 34673 1 215 . 1 . 1 19 19 ASP N N 15 116.577 0.3 . 1 . . . . A 264 ASP N . 34673 1 216 . 1 . 1 20 20 MET H H 1 7.556 0.020 . 1 . . . . A 265 MET H . 34673 1 217 . 1 . 1 20 20 MET HA H 1 4.164 0.020 . 1 . . . . A 265 MET HA . 34673 1 218 . 1 . 1 20 20 MET HB2 H 1 2.307 0.020 . 2 . . . . A 265 MET HB2 . 34673 1 219 . 1 . 1 20 20 MET HB3 H 1 2.173 0.020 . 2 . . . . A 265 MET HB3 . 34673 1 220 . 1 . 1 20 20 MET HG2 H 1 2.764 0.020 . 2 . . . . A 265 MET HG2 . 34673 1 221 . 1 . 1 20 20 MET HG3 H 1 2.702 0.020 . 2 . . . . A 265 MET HG3 . 34673 1 222 . 1 . 1 20 20 MET HE1 H 1 2.251 0.020 . 1 . . . . A 265 MET HE1 . 34673 1 223 . 1 . 1 20 20 MET HE2 H 1 2.251 0.020 . 1 . . . . A 265 MET HE2 . 34673 1 224 . 1 . 1 20 20 MET HE3 H 1 2.251 0.020 . 1 . . . . A 265 MET HE3 . 34673 1 225 . 1 . 1 20 20 MET C C 13 179.393 0.3 . 1 . . . . A 265 MET C . 34673 1 226 . 1 . 1 20 20 MET CA C 13 58.949 0.3 . 1 . . . . A 265 MET CA . 34673 1 227 . 1 . 1 20 20 MET CB C 13 33.255 0.3 . 1 . . . . A 265 MET CB . 34673 1 228 . 1 . 1 20 20 MET CG C 13 32.648 0.3 . 1 . . . . A 265 MET CG . 34673 1 229 . 1 . 1 20 20 MET CE C 13 17.664 0.3 . 1 . . . . A 265 MET CE . 34673 1 230 . 1 . 1 20 20 MET N N 15 119.979 0.3 . 1 . . . . A 265 MET N . 34673 1 231 . 1 . 1 21 21 LEU H H 1 7.681 0.020 . 1 . . . . A 266 LEU H . 34673 1 232 . 1 . 1 21 21 LEU HA H 1 4.203 0.020 . 1 . . . . A 266 LEU HA . 34673 1 233 . 1 . 1 21 21 LEU HB2 H 1 1.984 0.020 . 2 . . . . A 266 LEU HB2 . 34673 1 234 . 1 . 1 21 21 LEU HB3 H 1 1.380 0.020 . 2 . . . . A 266 LEU HB3 . 34673 1 235 . 1 . 1 21 21 LEU HG H 1 1.745 0.020 . 1 . . . . A 266 LEU HG . 34673 1 236 . 1 . 1 21 21 LEU HD11 H 1 0.850 0.020 . 2 . . . . A 266 LEU HD11 . 34673 1 237 . 1 . 1 21 21 LEU HD12 H 1 0.850 0.020 . 2 . . . . A 266 LEU HD12 . 34673 1 238 . 1 . 1 21 21 LEU HD13 H 1 0.850 0.020 . 2 . . . . A 266 LEU HD13 . 34673 1 239 . 1 . 1 21 21 LEU HD21 H 1 0.706 0.020 . 2 . . . . A 266 LEU HD21 . 34673 1 240 . 1 . 1 21 21 LEU HD22 H 1 0.706 0.020 . 2 . . . . A 266 LEU HD22 . 34673 1 241 . 1 . 1 21 21 LEU HD23 H 1 0.706 0.020 . 2 . . . . A 266 LEU HD23 . 34673 1 242 . 1 . 1 21 21 LEU C C 13 179.055 0.3 . 1 . . . . A 266 LEU C . 34673 1 243 . 1 . 1 21 21 LEU CA C 13 57.344 0.3 . 1 . . . . A 266 LEU CA . 34673 1 244 . 1 . 1 21 21 LEU CB C 13 42.277 0.3 . 1 . . . . A 266 LEU CB . 34673 1 245 . 1 . 1 21 21 LEU CG C 13 26.289 0.3 . 1 . . . . A 266 LEU CG . 34673 1 246 . 1 . 1 21 21 LEU CD1 C 13 23.380 0.3 . 1 . . . . A 266 LEU CD1 . 34673 1 247 . 1 . 1 21 21 LEU CD2 C 13 25.564 0.3 . 1 . . . . A 266 LEU CD2 . 34673 1 248 . 1 . 1 21 21 LEU N N 15 118.291 0.3 . 1 . . . . A 266 LEU N . 34673 1 249 . 1 . 1 22 22 ARG H H 1 8.606 0.020 . 1 . . . . A 267 ARG H . 34673 1 250 . 1 . 1 22 22 ARG HA H 1 3.673 0.020 . 1 . . . . A 267 ARG HA . 34673 1 251 . 1 . 1 22 22 ARG HB2 H 1 1.884 0.020 . 2 . . . . A 267 ARG HB2 . 34673 1 252 . 1 . 1 22 22 ARG HB3 H 1 1.830 0.020 . 2 . . . . A 267 ARG HB3 . 34673 1 253 . 1 . 1 22 22 ARG HG2 H 1 1.526 0.020 . 2 . . . . A 267 ARG HG2 . 34673 1 254 . 1 . 1 22 22 ARG HG3 H 1 0.770 0.020 . 2 . . . . A 267 ARG HG3 . 34673 1 255 . 1 . 1 22 22 ARG HD2 H 1 3.277 0.020 . 2 . . . . A 267 ARG HD2 . 34673 1 256 . 1 . 1 22 22 ARG HD3 H 1 3.124 0.020 . 2 . . . . A 267 ARG HD3 . 34673 1 257 . 1 . 1 22 22 ARG C C 13 177.830 0.3 . 1 . . . . A 267 ARG C . 34673 1 258 . 1 . 1 22 22 ARG CA C 13 61.039 0.3 . 1 . . . . A 267 ARG CA . 34673 1 259 . 1 . 1 22 22 ARG CB C 13 29.361 0.3 . 1 . . . . A 267 ARG CB . 34673 1 260 . 1 . 1 22 22 ARG CG C 13 28.119 0.3 . 1 . . . . A 267 ARG CG . 34673 1 261 . 1 . 1 22 22 ARG CD C 13 43.169 0.3 . 1 . . . . A 267 ARG CD . 34673 1 262 . 1 . 1 22 22 ARG N N 15 120.632 0.3 . 1 . . . . A 267 ARG N . 34673 1 263 . 1 . 1 23 23 GLY H H 1 7.490 0.020 . 1 . . . . A 268 GLY H . 34673 1 264 . 1 . 1 23 23 GLY HA2 H 1 3.977 0.020 . 2 . . . . A 268 GLY HA2 . 34673 1 265 . 1 . 1 23 23 GLY HA3 H 1 3.959 0.020 . 2 . . . . A 268 GLY HA3 . 34673 1 266 . 1 . 1 23 23 GLY C C 13 175.307 0.3 . 1 . . . . A 268 GLY C . 34673 1 267 . 1 . 1 23 23 GLY CA C 13 46.837 0.3 . 1 . . . . A 268 GLY CA . 34673 1 268 . 1 . 1 23 23 GLY N N 15 101.928 0.3 . 1 . . . . A 268 GLY N . 34673 1 269 . 1 . 1 24 24 ILE H H 1 7.163 0.020 . 1 . . . . A 269 ILE H . 34673 1 270 . 1 . 1 24 24 ILE HA H 1 4.051 0.020 . 1 . . . . A 269 ILE HA . 34673 1 271 . 1 . 1 24 24 ILE HB H 1 1.910 0.020 . 1 . . . . A 269 ILE HB . 34673 1 272 . 1 . 1 24 24 ILE HG12 H 1 1.611 0.020 . 2 . . . . A 269 ILE HG12 . 34673 1 273 . 1 . 1 24 24 ILE HG13 H 1 1.396 0.020 . 2 . . . . A 269 ILE HG13 . 34673 1 274 . 1 . 1 24 24 ILE HG21 H 1 0.517 0.020 . 1 . . . . A 269 ILE HG21 . 34673 1 275 . 1 . 1 24 24 ILE HG22 H 1 0.517 0.020 . 1 . . . . A 269 ILE HG22 . 34673 1 276 . 1 . 1 24 24 ILE HG23 H 1 0.517 0.020 . 1 . . . . A 269 ILE HG23 . 34673 1 277 . 1 . 1 24 24 ILE HD11 H 1 0.875 0.020 . 1 . . . . A 269 ILE HD11 . 34673 1 278 . 1 . 1 24 24 ILE HD12 H 1 0.875 0.020 . 1 . . . . A 269 ILE HD12 . 34673 1 279 . 1 . 1 24 24 ILE HD13 H 1 0.875 0.020 . 1 . . . . A 269 ILE HD13 . 34673 1 280 . 1 . 1 24 24 ILE CA C 13 62.229 0.3 . 1 . . . . A 269 ILE CA . 34673 1 281 . 1 . 1 24 24 ILE CB C 13 38.705 0.3 . 1 . . . . A 269 ILE CB . 34673 1 282 . 1 . 1 24 24 ILE CG1 C 13 27.848 0.3 . 1 . . . . A 269 ILE CG1 . 34673 1 283 . 1 . 1 24 24 ILE CG2 C 13 18.065 0.3 . 1 . . . . A 269 ILE CG2 . 34673 1 284 . 1 . 1 24 24 ILE CD1 C 13 13.637 0.3 . 1 . . . . A 269 ILE CD1 . 34673 1 285 . 1 . 1 24 24 ILE N N 15 117.004 0.3 . 1 . . . . A 269 ILE N . 34673 1 286 . 1 . 1 25 25 PHE H H 1 7.973 0.020 . 1 . . . . A 270 PHE H . 34673 1 287 . 1 . 1 25 25 PHE HA H 1 3.662 0.020 . 1 . . . . A 270 PHE HA . 34673 1 288 . 1 . 1 25 25 PHE HB2 H 1 3.159 0.020 . 2 . . . . A 270 PHE HB2 . 34673 1 289 . 1 . 1 25 25 PHE HB3 H 1 2.824 0.020 . 2 . . . . A 270 PHE HB3 . 34673 1 290 . 1 . 1 25 25 PHE HD1 H 1 7.537 0.020 . 1 . . . . A 270 PHE HD1 . 34673 1 291 . 1 . 1 25 25 PHE HD2 H 1 7.537 0.020 . 1 . . . . A 270 PHE HD2 . 34673 1 292 . 1 . 1 25 25 PHE HE1 H 1 7.468 0.020 . 1 . . . . A 270 PHE HE1 . 34673 1 293 . 1 . 1 25 25 PHE HE2 H 1 7.468 0.020 . 1 . . . . A 270 PHE HE2 . 34673 1 294 . 1 . 1 25 25 PHE HZ H 1 7.017 0.020 . 1 . . . . A 270 PHE HZ . 34673 1 295 . 1 . 1 25 25 PHE CA C 13 61.020 0.3 . 1 . . . . A 270 PHE CA . 34673 1 296 . 1 . 1 25 25 PHE CB C 13 40.722 0.3 . 1 . . . . A 270 PHE CB . 34673 1 297 . 1 . 1 25 25 PHE CD1 C 13 131.988 0.3 . 1 . . . . A 270 PHE CD1 . 34673 1 298 . 1 . 1 25 25 PHE CD2 C 13 131.988 0.3 . 1 . . . . A 270 PHE CD2 . 34673 1 299 . 1 . 1 25 25 PHE CE1 C 13 129.437 0.3 . 1 . . . . A 270 PHE CE1 . 34673 1 300 . 1 . 1 25 25 PHE CE2 C 13 129.437 0.3 . 1 . . . . A 270 PHE CE2 . 34673 1 301 . 1 . 1 25 25 PHE CZ C 13 130.658 0.3 . 1 . . . . A 270 PHE CZ . 34673 1 302 . 1 . 1 25 25 PHE N N 15 116.214 0.3 . 1 . . . . A 270 PHE N . 34673 1 303 . 1 . 1 26 26 GLU H H 1 8.821 0.020 . 1 . . . . A 271 GLU H . 34673 1 304 . 1 . 1 26 26 GLU HA H 1 4.675 0.020 . 1 . . . . A 271 GLU HA . 34673 1 305 . 1 . 1 26 26 GLU HB2 H 1 2.307 0.020 . 2 . . . . A 271 GLU HB2 . 34673 1 306 . 1 . 1 26 26 GLU HB3 H 1 2.170 0.020 . 2 . . . . A 271 GLU HB3 . 34673 1 307 . 1 . 1 26 26 GLU HG2 H 1 2.471 0.020 . 2 . . . . A 271 GLU HG2 . 34673 1 308 . 1 . 1 26 26 GLU HG3 H 1 2.461 0.020 . 2 . . . . A 271 GLU HG3 . 34673 1 309 . 1 . 1 26 26 GLU CA C 13 60.216 0.3 . 1 . . . . A 271 GLU CA . 34673 1 310 . 1 . 1 26 26 GLU CB C 13 28.767 0.3 . 1 . . . . A 271 GLU CB . 34673 1 311 . 1 . 1 26 26 GLU CG C 13 37.586 0.3 . 1 . . . . A 271 GLU CG . 34673 1 312 . 1 . 1 26 26 GLU N N 15 121.296 0.3 . 1 . . . . A 271 GLU N . 34673 1 313 . 1 . 1 27 27 PRO HA H 1 4.279 0.020 . 1 . . . . A 272 PRO HA . 34673 1 314 . 1 . 1 27 27 PRO HB2 H 1 2.161 0.020 . 2 . . . . A 272 PRO HB2 . 34673 1 315 . 1 . 1 27 27 PRO HB3 H 1 1.057 0.020 . 2 . . . . A 272 PRO HB3 . 34673 1 316 . 1 . 1 27 27 PRO HG2 H 1 1.960 0.020 . 2 . . . . A 272 PRO HG2 . 34673 1 317 . 1 . 1 27 27 PRO HG3 H 1 1.865 0.020 . 2 . . . . A 272 PRO HG3 . 34673 1 318 . 1 . 1 27 27 PRO HD2 H 1 3.710 0.020 . 2 . . . . A 272 PRO HD2 . 34673 1 319 . 1 . 1 27 27 PRO HD3 H 1 3.332 0.020 . 2 . . . . A 272 PRO HD3 . 34673 1 320 . 1 . 1 27 27 PRO C C 13 177.581 0.3 . 1 . . . . A 272 PRO C . 34673 1 321 . 1 . 1 27 27 PRO CA C 13 65.770 0.3 . 1 . . . . A 272 PRO CA . 34673 1 322 . 1 . 1 27 27 PRO CB C 13 31.271 0.3 . 1 . . . . A 272 PRO CB . 34673 1 323 . 1 . 1 27 27 PRO CG C 13 28.496 0.3 . 1 . . . . A 272 PRO CG . 34673 1 324 . 1 . 1 27 27 PRO CD C 13 51.787 0.3 . 1 . . . . A 272 PRO CD . 34673 1 325 . 1 . 1 28 28 PHE H H 1 7.942 0.020 . 1 . . . . A 273 PHE H . 34673 1 326 . 1 . 1 28 28 PHE HA H 1 4.152 0.020 . 1 . . . . A 273 PHE HA . 34673 1 327 . 1 . 1 28 28 PHE HB2 H 1 3.364 0.020 . 2 . . . . A 273 PHE HB2 . 34673 1 328 . 1 . 1 28 28 PHE HB3 H 1 3.161 0.020 . 2 . . . . A 273 PHE HB3 . 34673 1 329 . 1 . 1 28 28 PHE HD1 H 1 7.402 0.020 . 1 . . . . A 273 PHE HD1 . 34673 1 330 . 1 . 1 28 28 PHE HD2 H 1 7.402 0.020 . 1 . . . . A 273 PHE HD2 . 34673 1 331 . 1 . 1 28 28 PHE HE1 H 1 7.221 0.020 . 1 . . . . A 273 PHE HE1 . 34673 1 332 . 1 . 1 28 28 PHE HE2 H 1 7.221 0.020 . 1 . . . . A 273 PHE HE2 . 34673 1 333 . 1 . 1 28 28 PHE HZ H 1 7.087 0.020 . 1 . . . . A 273 PHE HZ . 34673 1 334 . 1 . 1 28 28 PHE C C 13 176.178 0.3 . 1 . . . . A 273 PHE C . 34673 1 335 . 1 . 1 28 28 PHE CA C 13 60.390 0.3 . 1 . . . . A 273 PHE CA . 34673 1 336 . 1 . 1 28 28 PHE CB C 13 39.415 0.3 . 1 . . . . A 273 PHE CB . 34673 1 337 . 1 . 1 28 28 PHE CD1 C 13 131.428 0.3 . 1 . . . . A 273 PHE CD1 . 34673 1 338 . 1 . 1 28 28 PHE CE1 C 13 131.498 0.3 . 1 . . . . A 273 PHE CE1 . 34673 1 339 . 1 . 1 28 28 PHE CZ C 13 129.421 0.3 . 1 . . . . A 273 PHE CZ . 34673 1 340 . 1 . 1 28 28 PHE N N 15 111.939 0.3 . 1 . . . . A 273 PHE N . 34673 1 341 . 1 . 1 29 29 GLY H H 1 7.857 0.020 . 1 . . . . A 274 GLY H . 34673 1 342 . 1 . 1 29 29 GLY HA2 H 1 4.737 0.020 . 2 . . . . A 274 GLY HA2 . 34673 1 343 . 1 . 1 29 29 GLY HA3 H 1 4.028 0.020 . 2 . . . . A 274 GLY HA3 . 34673 1 344 . 1 . 1 29 29 GLY C C 13 170.227 0.3 . 1 . . . . A 274 GLY C . 34673 1 345 . 1 . 1 29 29 GLY CA C 13 45.157 0.3 . 1 . . . . A 274 GLY CA . 34673 1 346 . 1 . 1 29 29 GLY N N 15 106.999 0.3 . 1 . . . . A 274 GLY N . 34673 1 347 . 1 . 1 30 30 ARG H H 1 7.826 0.020 . 1 . . . . A 275 ARG H . 34673 1 348 . 1 . 1 30 30 ARG HA H 1 4.253 0.020 . 1 . . . . A 275 ARG HA . 34673 1 349 . 1 . 1 30 30 ARG HB2 H 1 1.874 0.020 . 1 . . . . A 275 ARG HB2 . 34673 1 350 . 1 . 1 30 30 ARG HB3 H 1 1.874 0.020 . 1 . . . . A 275 ARG HB3 . 34673 1 351 . 1 . 1 30 30 ARG HG2 H 1 1.654 0.020 . 2 . . . . A 275 ARG HG2 . 34673 1 352 . 1 . 1 30 30 ARG HG3 H 1 1.573 0.020 . 2 . . . . A 275 ARG HG3 . 34673 1 353 . 1 . 1 30 30 ARG HD2 H 1 3.280 0.020 . 2 . . . . A 275 ARG HD2 . 34673 1 354 . 1 . 1 30 30 ARG HD3 H 1 3.221 0.020 . 2 . . . . A 275 ARG HD3 . 34673 1 355 . 1 . 1 30 30 ARG C C 13 176.941 0.3 . 1 . . . . A 275 ARG C . 34673 1 356 . 1 . 1 30 30 ARG CA C 13 57.477 0.3 . 1 . . . . A 275 ARG CA . 34673 1 357 . 1 . 1 30 30 ARG CB C 13 30.553 0.3 . 1 . . . . A 275 ARG CB . 34673 1 358 . 1 . 1 30 30 ARG CG C 13 27.468 0.3 . 1 . . . . A 275 ARG CG . 34673 1 359 . 1 . 1 30 30 ARG CD C 13 43.456 0.3 . 1 . . . . A 275 ARG CD . 34673 1 360 . 1 . 1 30 30 ARG N N 15 116.002 0.3 . 1 . . . . A 275 ARG N . 34673 1 361 . 1 . 1 31 31 ILE H H 1 8.789 0.020 . 1 . . . . A 276 ILE H . 34673 1 362 . 1 . 1 31 31 ILE HA H 1 4.040 0.020 . 1 . . . . A 276 ILE HA . 34673 1 363 . 1 . 1 31 31 ILE HB H 1 1.676 0.020 . 1 . . . . A 276 ILE HB . 34673 1 364 . 1 . 1 31 31 ILE HG12 H 1 1.583 0.020 . 2 . . . . A 276 ILE HG12 . 34673 1 365 . 1 . 1 31 31 ILE HG13 H 1 1.436 0.020 . 2 . . . . A 276 ILE HG13 . 34673 1 366 . 1 . 1 31 31 ILE HG21 H 1 0.506 0.020 . 1 . . . . A 276 ILE HG21 . 34673 1 367 . 1 . 1 31 31 ILE HG22 H 1 0.506 0.020 . 1 . . . . A 276 ILE HG22 . 34673 1 368 . 1 . 1 31 31 ILE HG23 H 1 0.506 0.020 . 1 . . . . A 276 ILE HG23 . 34673 1 369 . 1 . 1 31 31 ILE HD11 H 1 0.458 0.020 . 1 . . . . A 276 ILE HD11 . 34673 1 370 . 1 . 1 31 31 ILE HD12 H 1 0.458 0.020 . 1 . . . . A 276 ILE HD12 . 34673 1 371 . 1 . 1 31 31 ILE HD13 H 1 0.458 0.020 . 1 . . . . A 276 ILE HD13 . 34673 1 372 . 1 . 1 31 31 ILE C C 13 176.426 0.3 . 1 . . . . A 276 ILE C . 34673 1 373 . 1 . 1 31 31 ILE CA C 13 59.986 0.3 . 1 . . . . A 276 ILE CA . 34673 1 374 . 1 . 1 31 31 ILE CB C 13 39.935 0.3 . 1 . . . . A 276 ILE CB . 34673 1 375 . 1 . 1 31 31 ILE CG1 C 13 27.332 0.3 . 1 . . . . A 276 ILE CG1 . 34673 1 376 . 1 . 1 31 31 ILE CG2 C 13 17.735 0.3 . 1 . . . . A 276 ILE CG2 . 34673 1 377 . 1 . 1 31 31 ILE CD1 C 13 13.506 0.3 . 1 . . . . A 276 ILE CD1 . 34673 1 378 . 1 . 1 31 31 ILE N N 15 128.270 0.3 . 1 . . . . A 276 ILE N . 34673 1 379 . 1 . 1 32 32 GLU H H 1 8.807 0.020 . 1 . . . . A 277 GLU H . 34673 1 380 . 1 . 1 32 32 GLU HA H 1 4.260 0.020 . 1 . . . . A 277 GLU HA . 34673 1 381 . 1 . 1 32 32 GLU HB2 H 1 1.946 0.020 . 2 . . . . A 277 GLU HB2 . 34673 1 382 . 1 . 1 32 32 GLU HB3 H 1 1.664 0.020 . 2 . . . . A 277 GLU HB3 . 34673 1 383 . 1 . 1 32 32 GLU HG2 H 1 2.129 0.020 . 2 . . . . A 277 GLU HG2 . 34673 1 384 . 1 . 1 32 32 GLU HG3 H 1 2.072 0.020 . 2 . . . . A 277 GLU HG3 . 34673 1 385 . 1 . 1 32 32 GLU C C 13 176.497 0.3 . 1 . . . . A 277 GLU C . 34673 1 386 . 1 . 1 32 32 GLU CA C 13 57.295 0.3 . 1 . . . . A 277 GLU CA . 34673 1 387 . 1 . 1 32 32 GLU CB C 13 31.371 0.3 . 1 . . . . A 277 GLU CB . 34673 1 388 . 1 . 1 32 32 GLU CG C 13 35.563 0.3 . 1 . . . . A 277 GLU CG . 34673 1 389 . 1 . 1 32 32 GLU N N 15 127.191 0.3 . 1 . . . . A 277 GLU N . 34673 1 390 . 1 . 1 33 33 SER H H 1 7.139 0.020 . 1 . . . . A 278 SER H . 34673 1 391 . 1 . 1 33 33 SER HA H 1 4.532 0.020 . 1 . . . . A 278 SER HA . 34673 1 392 . 1 . 1 33 33 SER HB2 H 1 3.789 0.020 . 1 . . . . A 278 SER HB2 . 34673 1 393 . 1 . 1 33 33 SER HB3 H 1 3.789 0.020 . 1 . . . . A 278 SER HB3 . 34673 1 394 . 1 . 1 33 33 SER C C 13 171.932 0.3 . 1 . . . . A 278 SER C . 34673 1 395 . 1 . 1 33 33 SER CA C 13 57.623 0.3 . 1 . . . . A 278 SER CA . 34673 1 396 . 1 . 1 33 33 SER CB C 13 64.775 0.3 . 1 . . . . A 278 SER CB . 34673 1 397 . 1 . 1 33 33 SER N N 15 109.715 0.3 . 1 . . . . A 278 SER N . 34673 1 398 . 1 . 1 34 34 ILE H H 1 8.370 0.020 . 1 . . . . A 279 ILE H . 34673 1 399 . 1 . 1 34 34 ILE HA H 1 4.481 0.020 . 1 . . . . A 279 ILE HA . 34673 1 400 . 1 . 1 34 34 ILE HB H 1 1.635 0.020 . 1 . . . . A 279 ILE HB . 34673 1 401 . 1 . 1 34 34 ILE HG12 H 1 0.808 0.020 . 2 . . . . A 279 ILE HG12 . 34673 1 402 . 1 . 1 34 34 ILE HG13 H 1 1.513 0.020 . 2 . . . . A 279 ILE HG13 . 34673 1 403 . 1 . 1 34 34 ILE HG21 H 1 0.716 0.020 . 1 . . . . A 279 ILE HG21 . 34673 1 404 . 1 . 1 34 34 ILE HG22 H 1 0.716 0.020 . 1 . . . . A 279 ILE HG22 . 34673 1 405 . 1 . 1 34 34 ILE HG23 H 1 0.716 0.020 . 1 . . . . A 279 ILE HG23 . 34673 1 406 . 1 . 1 34 34 ILE HD11 H 1 0.765 0.020 . 1 . . . . A 279 ILE HD11 . 34673 1 407 . 1 . 1 34 34 ILE HD12 H 1 0.765 0.020 . 1 . . . . A 279 ILE HD12 . 34673 1 408 . 1 . 1 34 34 ILE HD13 H 1 0.765 0.020 . 1 . . . . A 279 ILE HD13 . 34673 1 409 . 1 . 1 34 34 ILE C C 13 173.566 0.3 . 1 . . . . A 279 ILE C . 34673 1 410 . 1 . 1 34 34 ILE CA C 13 61.343 0.3 . 1 . . . . A 279 ILE CA . 34673 1 411 . 1 . 1 34 34 ILE CB C 13 40.894 0.3 . 1 . . . . A 279 ILE CB . 34673 1 412 . 1 . 1 34 34 ILE CG1 C 13 28.165 0.3 . 1 . . . . A 279 ILE CG1 . 34673 1 413 . 1 . 1 34 34 ILE CG2 C 13 16.233 0.3 . 1 . . . . A 279 ILE CG2 . 34673 1 414 . 1 . 1 34 34 ILE CD1 C 13 13.914 0.3 . 1 . . . . A 279 ILE CD1 . 34673 1 415 . 1 . 1 34 34 ILE N N 15 122.448 0.3 . 1 . . . . A 279 ILE N . 34673 1 416 . 1 . 1 35 35 GLN H H 1 8.625 0.020 . 1 . . . . A 280 GLN H . 34673 1 417 . 1 . 1 35 35 GLN HA H 1 4.740 0.020 . 1 . . . . A 280 GLN HA . 34673 1 418 . 1 . 1 35 35 GLN HB2 H 1 2.087 0.020 . 2 . . . . A 280 GLN HB2 . 34673 1 419 . 1 . 1 35 35 GLN HB3 H 1 1.963 0.020 . 2 . . . . A 280 GLN HB3 . 34673 1 420 . 1 . 1 35 35 GLN HG2 H 1 2.306 0.020 . 2 . . . . A 280 GLN HG2 . 34673 1 421 . 1 . 1 35 35 GLN HG3 H 1 2.286 0.020 . 2 . . . . A 280 GLN HG3 . 34673 1 422 . 1 . 1 35 35 GLN HE21 H 1 7.403 0.020 . 1 . . . . A 280 GLN HE21 . 34673 1 423 . 1 . 1 35 35 GLN HE22 H 1 6.744 0.020 . 1 . . . . A 280 GLN HE22 . 34673 1 424 . 1 . 1 35 35 GLN C C 13 174.259 0.3 . 1 . . . . A 280 GLN C . 34673 1 425 . 1 . 1 35 35 GLN CA C 13 54.160 0.3 . 1 . . . . A 280 GLN CA . 34673 1 426 . 1 . 1 35 35 GLN CB C 13 31.522 0.3 . 1 . . . . A 280 GLN CB . 34673 1 427 . 1 . 1 35 35 GLN CG C 13 33.521 0.3 . 1 . . . . A 280 GLN CG . 34673 1 428 . 1 . 1 35 35 GLN N N 15 126.210 0.3 . 1 . . . . A 280 GLN N . 34673 1 429 . 1 . 1 35 35 GLN NE2 N 15 111.188 0.3 . 1 . . . . A 280 GLN NE2 . 34673 1 430 . 1 . 1 36 36 LEU H H 1 9.021 0.020 . 1 . . . . A 281 LEU H . 34673 1 431 . 1 . 1 36 36 LEU HA H 1 4.420 0.020 . 1 . . . . A 281 LEU HA . 34673 1 432 . 1 . 1 36 36 LEU HB2 H 1 1.613 0.020 . 2 . . . . A 281 LEU HB2 . 34673 1 433 . 1 . 1 36 36 LEU HB3 H 1 1.276 0.020 . 2 . . . . A 281 LEU HB3 . 34673 1 434 . 1 . 1 36 36 LEU HG H 1 1.406 0.020 . 1 . . . . A 281 LEU HG . 34673 1 435 . 1 . 1 36 36 LEU HD11 H 1 0.660 0.020 . 2 . . . . A 281 LEU HD11 . 34673 1 436 . 1 . 1 36 36 LEU HD12 H 1 0.660 0.020 . 2 . . . . A 281 LEU HD12 . 34673 1 437 . 1 . 1 36 36 LEU HD13 H 1 0.660 0.020 . 2 . . . . A 281 LEU HD13 . 34673 1 438 . 1 . 1 36 36 LEU HD21 H 1 0.667 0.020 . 2 . . . . A 281 LEU HD21 . 34673 1 439 . 1 . 1 36 36 LEU HD22 H 1 0.667 0.020 . 2 . . . . A 281 LEU HD22 . 34673 1 440 . 1 . 1 36 36 LEU HD23 H 1 0.667 0.020 . 2 . . . . A 281 LEU HD23 . 34673 1 441 . 1 . 1 36 36 LEU CA C 13 54.195 0.3 . 1 . . . . A 281 LEU CA . 34673 1 442 . 1 . 1 36 36 LEU CB C 13 43.650 0.3 . 1 . . . . A 281 LEU CB . 34673 1 443 . 1 . 1 36 36 LEU CG C 13 27.014 0.3 . 1 . . . . A 281 LEU CG . 34673 1 444 . 1 . 1 36 36 LEU CD1 C 13 24.447 0.3 . 1 . . . . A 281 LEU CD1 . 34673 1 445 . 1 . 1 36 36 LEU CD2 C 13 23.929 0.3 . 1 . . . . A 281 LEU CD2 . 34673 1 446 . 1 . 1 36 36 LEU N N 15 127.637 0.3 . 1 . . . . A 281 LEU N . 34673 1 447 . 1 . 1 37 37 MET H H 1 8.260 0.020 . 1 . . . . A 282 MET H . 34673 1 448 . 1 . 1 37 37 MET HA H 1 4.594 0.020 . 1 . . . . A 282 MET HA . 34673 1 449 . 1 . 1 37 37 MET HB2 H 1 1.532 0.020 . 2 . . . . A 282 MET HB2 . 34673 1 450 . 1 . 1 37 37 MET HB3 H 1 1.256 0.020 . 2 . . . . A 282 MET HB3 . 34673 1 451 . 1 . 1 37 37 MET HG2 H 1 2.560 0.020 . 2 . . . . A 282 MET HG2 . 34673 1 452 . 1 . 1 37 37 MET HG3 H 1 2.192 0.020 . 2 . . . . A 282 MET HG3 . 34673 1 453 . 1 . 1 37 37 MET HE1 H 1 2.209 0.020 . 1 . . . . A 282 MET HE1 . 34673 1 454 . 1 . 1 37 37 MET HE2 H 1 2.209 0.020 . 1 . . . . A 282 MET HE2 . 34673 1 455 . 1 . 1 37 37 MET HE3 H 1 2.209 0.020 . 1 . . . . A 282 MET HE3 . 34673 1 456 . 1 . 1 37 37 MET CA C 13 54.292 0.3 . 1 . . . . A 282 MET CA . 34673 1 457 . 1 . 1 37 37 MET CB C 13 30.490 0.3 . 1 . . . . A 282 MET CB . 34673 1 458 . 1 . 1 37 37 MET CG C 13 33.423 0.3 . 1 . . . . A 282 MET CG . 34673 1 459 . 1 . 1 37 37 MET CE C 13 17.792 0.3 . 1 . . . . A 282 MET CE . 34673 1 460 . 1 . 1 37 37 MET N N 15 123.947 0.3 . 1 . . . . A 282 MET N . 34673 1 461 . 1 . 1 38 38 MET H H 1 8.312 0.020 . 1 . . . . A 283 MET H . 34673 1 462 . 1 . 1 38 38 MET HA H 1 4.983 0.020 . 1 . . . . A 283 MET HA . 34673 1 463 . 1 . 1 38 38 MET HB2 H 1 1.839 0.020 . 2 . . . . A 283 MET HB2 . 34673 1 464 . 1 . 1 38 38 MET HB3 H 1 1.715 0.020 . 2 . . . . A 283 MET HB3 . 34673 1 465 . 1 . 1 38 38 MET HG2 H 1 2.580 0.020 . 2 . . . . A 283 MET HG2 . 34673 1 466 . 1 . 1 38 38 MET HG3 H 1 2.494 0.020 . 2 . . . . A 283 MET HG3 . 34673 1 467 . 1 . 1 38 38 MET HE1 H 1 2.212 0.020 . 1 . . . . A 283 MET HE1 . 34673 1 468 . 1 . 1 38 38 MET HE2 H 1 2.212 0.020 . 1 . . . . A 283 MET HE2 . 34673 1 469 . 1 . 1 38 38 MET HE3 H 1 2.212 0.020 . 1 . . . . A 283 MET HE3 . 34673 1 470 . 1 . 1 38 38 MET CA C 13 52.897 0.3 . 1 . . . . A 283 MET CA . 34673 1 471 . 1 . 1 38 38 MET CB C 13 33.908 0.3 . 1 . . . . A 283 MET CB . 34673 1 472 . 1 . 1 38 38 MET CG C 13 31.928 0.3 . 1 . . . . A 283 MET CG . 34673 1 473 . 1 . 1 38 38 MET CE C 13 17.801 0.3 . 1 . . . . A 283 MET CE . 34673 1 474 . 1 . 1 38 38 MET N N 15 120.611 0.3 . 1 . . . . A 283 MET N . 34673 1 475 . 1 . 1 39 39 ASP H H 1 8.876 0.020 . 1 . . . . A 284 ASP H . 34673 1 476 . 1 . 1 39 39 ASP HA H 1 4.708 0.020 . 1 . . . . A 284 ASP HA . 34673 1 477 . 1 . 1 39 39 ASP HB2 H 1 3.376 0.020 . 2 . . . . A 284 ASP HB2 . 34673 1 478 . 1 . 1 39 39 ASP HB3 H 1 2.440 0.020 . 2 . . . . A 284 ASP HB3 . 34673 1 479 . 1 . 1 39 39 ASP C C 13 177.510 0.3 . 1 . . . . A 284 ASP C . 34673 1 480 . 1 . 1 39 39 ASP CA C 13 53.820 0.3 . 1 . . . . A 284 ASP CA . 34673 1 481 . 1 . 1 39 39 ASP CB C 13 42.970 0.3 . 1 . . . . A 284 ASP CB . 34673 1 482 . 1 . 1 39 39 ASP N N 15 123.049 0.3 . 1 . . . . A 284 ASP N . 34673 1 483 . 1 . 1 40 40 SER H H 1 8.890 0.020 . 1 . . . . A 285 SER H . 34673 1 484 . 1 . 1 40 40 SER HA H 1 4.175 0.020 . 1 . . . . A 285 SER HA . 34673 1 485 . 1 . 1 40 40 SER HB2 H 1 4.031 0.020 . 2 . . . . A 285 SER HB2 . 34673 1 486 . 1 . 1 40 40 SER HB3 H 1 3.995 0.020 . 2 . . . . A 285 SER HB3 . 34673 1 487 . 1 . 1 40 40 SER C C 13 175.325 0.3 . 1 . . . . A 285 SER C . 34673 1 488 . 1 . 1 40 40 SER CA C 13 61.049 0.3 . 1 . . . . A 285 SER CA . 34673 1 489 . 1 . 1 40 40 SER CB C 13 63.060 0.3 . 1 . . . . A 285 SER CB . 34673 1 490 . 1 . 1 40 40 SER N N 15 123.280 0.3 . 1 . . . . A 285 SER N . 34673 1 491 . 1 . 1 41 41 GLU H H 1 8.503 0.020 . 1 . . . . A 286 GLU H . 34673 1 492 . 1 . 1 41 41 GLU HA H 1 4.334 0.020 . 1 . . . . A 286 GLU HA . 34673 1 493 . 1 . 1 41 41 GLU HB2 H 1 2.204 0.020 . 2 . . . . A 286 GLU HB2 . 34673 1 494 . 1 . 1 41 41 GLU HB3 H 1 2.161 0.020 . 2 . . . . A 286 GLU HB3 . 34673 1 495 . 1 . 1 41 41 GLU HG2 H 1 2.362 0.020 . 2 . . . . A 286 GLU HG2 . 34673 1 496 . 1 . 1 41 41 GLU HG3 H 1 2.240 0.020 . 2 . . . . A 286 GLU HG3 . 34673 1 497 . 1 . 1 41 41 GLU C C 13 178.220 0.3 . 1 . . . . A 286 GLU C . 34673 1 498 . 1 . 1 41 41 GLU CA C 13 58.389 0.3 . 1 . . . . A 286 GLU CA . 34673 1 499 . 1 . 1 41 41 GLU CB C 13 30.199 0.3 . 1 . . . . A 286 GLU CB . 34673 1 500 . 1 . 1 41 41 GLU CG C 13 36.374 0.3 . 1 . . . . A 286 GLU CG . 34673 1 501 . 1 . 1 41 41 GLU N N 15 120.534 0.3 . 1 . . . . A 286 GLU N . 34673 1 502 . 1 . 1 42 42 THR H H 1 7.906 0.020 . 1 . . . . A 287 THR H . 34673 1 503 . 1 . 1 42 42 THR HA H 1 4.419 0.020 . 1 . . . . A 287 THR HA . 34673 1 504 . 1 . 1 42 42 THR HB H 1 4.285 0.020 . 1 . . . . A 287 THR HB . 34673 1 505 . 1 . 1 42 42 THR HG21 H 1 1.209 0.020 . 1 . . . . A 287 THR HG21 . 34673 1 506 . 1 . 1 42 42 THR HG22 H 1 1.209 0.020 . 1 . . . . A 287 THR HG22 . 34673 1 507 . 1 . 1 42 42 THR HG23 H 1 1.209 0.020 . 1 . . . . A 287 THR HG23 . 34673 1 508 . 1 . 1 42 42 THR C C 13 176.639 0.3 . 1 . . . . A 287 THR C . 34673 1 509 . 1 . 1 42 42 THR CA C 13 61.720 0.3 . 1 . . . . A 287 THR CA . 34673 1 510 . 1 . 1 42 42 THR CB C 13 71.013 0.3 . 1 . . . . A 287 THR CB . 34673 1 511 . 1 . 1 42 42 THR CG2 C 13 21.046 0.3 . 1 . . . . A 287 THR CG2 . 34673 1 512 . 1 . 1 42 42 THR N N 15 106.555 0.3 . 1 . . . . A 287 THR N . 34673 1 513 . 1 . 1 43 43 GLY H H 1 8.174 0.020 . 1 . . . . A 288 GLY H . 34673 1 514 . 1 . 1 43 43 GLY HA2 H 1 4.135 0.020 . 2 . . . . A 288 GLY HA2 . 34673 1 515 . 1 . 1 43 43 GLY HA3 H 1 3.816 0.020 . 2 . . . . A 288 GLY HA3 . 34673 1 516 . 1 . 1 43 43 GLY C C 13 173.478 0.3 . 1 . . . . A 288 GLY C . 34673 1 517 . 1 . 1 43 43 GLY CA C 13 45.662 0.3 . 1 . . . . A 288 GLY CA . 34673 1 518 . 1 . 1 43 43 GLY N N 15 110.896 0.3 . 1 . . . . A 288 GLY N . 34673 1 519 . 1 . 1 44 44 ARG H H 1 7.547 0.020 . 1 . . . . A 289 ARG H . 34673 1 520 . 1 . 1 44 44 ARG HA H 1 4.360 0.020 . 1 . . . . A 289 ARG HA . 34673 1 521 . 1 . 1 44 44 ARG HB2 H 1 1.819 0.020 . 2 . . . . A 289 ARG HB2 . 34673 1 522 . 1 . 1 44 44 ARG HB3 H 1 1.624 0.020 . 2 . . . . A 289 ARG HB3 . 34673 1 523 . 1 . 1 44 44 ARG HG2 H 1 1.585 0.020 . 2 . . . . A 289 ARG HG2 . 34673 1 524 . 1 . 1 44 44 ARG HG3 H 1 1.547 0.020 . 2 . . . . A 289 ARG HG3 . 34673 1 525 . 1 . 1 44 44 ARG HD2 H 1 2.935 0.020 . 1 . . . . A 289 ARG HD2 . 34673 1 526 . 1 . 1 44 44 ARG HD3 H 1 2.935 0.020 . 1 . . . . A 289 ARG HD3 . 34673 1 527 . 1 . 1 44 44 ARG C C 13 175.680 0.3 . 1 . . . . A 289 ARG C . 34673 1 528 . 1 . 1 44 44 ARG CA C 13 55.082 0.3 . 1 . . . . A 289 ARG CA . 34673 1 529 . 1 . 1 44 44 ARG CB C 13 32.268 0.3 . 1 . . . . A 289 ARG CB . 34673 1 530 . 1 . 1 44 44 ARG CG C 13 26.968 0.3 . 1 . . . . A 289 ARG CG . 34673 1 531 . 1 . 1 44 44 ARG CD C 13 43.300 0.3 . 1 . . . . A 289 ARG CD . 34673 1 532 . 1 . 1 44 44 ARG N N 15 118.850 0.3 . 1 . . . . A 289 ARG N . 34673 1 533 . 1 . 1 45 45 SER H H 1 8.583 0.020 . 1 . . . . A 290 SER H . 34673 1 534 . 1 . 1 45 45 SER HA H 1 4.840 0.020 . 1 . . . . A 290 SER HA . 34673 1 535 . 1 . 1 45 45 SER HB2 H 1 4.162 0.020 . 2 . . . . A 290 SER HB2 . 34673 1 536 . 1 . 1 45 45 SER HB3 H 1 4.091 0.020 . 2 . . . . A 290 SER HB3 . 34673 1 537 . 1 . 1 45 45 SER C C 13 175.325 0.3 . 1 . . . . A 290 SER C . 34673 1 538 . 1 . 1 45 45 SER CA C 13 58.071 0.3 . 1 . . . . A 290 SER CA . 34673 1 539 . 1 . 1 45 45 SER CB C 13 64.650 0.3 . 1 . . . . A 290 SER CB . 34673 1 540 . 1 . 1 45 45 SER N N 15 117.046 0.3 . 1 . . . . A 290 SER N . 34673 1 541 . 1 . 1 46 46 LYS H H 1 8.837 0.020 . 1 . . . . A 291 LYS H . 34673 1 542 . 1 . 1 46 46 LYS HA H 1 4.346 0.020 . 1 . . . . A 291 LYS HA . 34673 1 543 . 1 . 1 46 46 LYS HB2 H 1 2.166 0.020 . 2 . . . . A 291 LYS HB2 . 34673 1 544 . 1 . 1 46 46 LYS HB3 H 1 2.173 0.020 . 2 . . . . A 291 LYS HB3 . 34673 1 545 . 1 . 1 46 46 LYS HG2 H 1 1.290 0.020 . 1 . . . . A 291 LYS HG2 . 34673 1 546 . 1 . 1 46 46 LYS HG3 H 1 1.290 0.020 . 1 . . . . A 291 LYS HG3 . 34673 1 547 . 1 . 1 46 46 LYS HD2 H 1 1.432 0.020 . 2 . . . . A 291 LYS HD2 . 34673 1 548 . 1 . 1 46 46 LYS HD3 H 1 1.335 0.020 . 2 . . . . A 291 LYS HD3 . 34673 1 549 . 1 . 1 46 46 LYS HE2 H 1 3.058 0.020 . 1 . . . . A 291 LYS HE2 . 34673 1 550 . 1 . 1 46 46 LYS HE3 H 1 3.058 0.020 . 1 . . . . A 291 LYS HE3 . 34673 1 551 . 1 . 1 46 46 LYS C C 13 177.954 0.3 . 1 . . . . A 291 LYS C . 34673 1 552 . 1 . 1 46 46 LYS CA C 13 56.736 0.3 . 1 . . . . A 291 LYS CA . 34673 1 553 . 1 . 1 46 46 LYS CB C 13 33.490 0.3 . 1 . . . . A 291 LYS CB . 34673 1 554 . 1 . 1 46 46 LYS CG C 13 33.536 0.3 . 1 . . . . A 291 LYS CG . 34673 1 555 . 1 . 1 46 46 LYS CD C 13 26.419 0.3 . 1 . . . . A 291 LYS CD . 34673 1 556 . 1 . 1 46 46 LYS CE C 13 42.046 0.3 . 1 . . . . A 291 LYS CE . 34673 1 557 . 1 . 1 46 46 LYS N N 15 122.366 0.3 . 1 . . . . A 291 LYS N . 34673 1 558 . 1 . 1 47 47 GLY H H 1 9.213 0.020 . 1 . . . . A 292 GLY H . 34673 1 559 . 1 . 1 47 47 GLY HA2 H 1 4.312 0.020 . 2 . . . . A 292 GLY HA2 . 34673 1 560 . 1 . 1 47 47 GLY HA3 H 1 3.507 0.020 . 2 . . . . A 292 GLY HA3 . 34673 1 561 . 1 . 1 47 47 GLY C C 13 171.719 0.3 . 1 . . . . A 292 GLY C . 34673 1 562 . 1 . 1 47 47 GLY CA C 13 45.557 0.3 . 1 . . . . A 292 GLY CA . 34673 1 563 . 1 . 1 47 47 GLY N N 15 106.476 0.3 . 1 . . . . A 292 GLY N . 34673 1 564 . 1 . 1 48 48 TYR H H 1 6.937 0.020 . 1 . . . . A 293 TYR H . 34673 1 565 . 1 . 1 48 48 TYR HA H 1 5.272 0.020 . 1 . . . . A 293 TYR HA . 34673 1 566 . 1 . 1 48 48 TYR HB2 H 1 3.145 0.020 . 2 . . . . A 293 TYR HB2 . 34673 1 567 . 1 . 1 48 48 TYR HB3 H 1 3.028 0.020 . 2 . . . . A 293 TYR HB3 . 34673 1 568 . 1 . 1 48 48 TYR HD1 H 1 6.731 0.020 . 1 . . . . A 293 TYR HD1 . 34673 1 569 . 1 . 1 48 48 TYR HD2 H 1 6.731 0.020 . 1 . . . . A 293 TYR HD2 . 34673 1 570 . 1 . 1 48 48 TYR HE1 H 1 6.823 0.020 . 1 . . . . A 293 TYR HE1 . 34673 1 571 . 1 . 1 48 48 TYR HE2 H 1 6.823 0.020 . 1 . . . . A 293 TYR HE2 . 34673 1 572 . 1 . 1 48 48 TYR C C 13 172.323 0.3 . 1 . . . . A 293 TYR C . 34673 1 573 . 1 . 1 48 48 TYR CA C 13 55.037 0.3 . 1 . . . . A 293 TYR CA . 34673 1 574 . 1 . 1 48 48 TYR CB C 13 40.636 0.3 . 1 . . . . A 293 TYR CB . 34673 1 575 . 1 . 1 48 48 TYR CD1 C 13 133.970 0.3 . 1 . . . . A 293 TYR CD1 . 34673 1 576 . 1 . 1 48 48 TYR CE1 C 13 118.245 0.3 . 1 . . . . A 293 TYR CE1 . 34673 1 577 . 1 . 1 48 48 TYR N N 15 110.831 0.3 . 1 . . . . A 293 TYR N . 34673 1 578 . 1 . 1 49 49 GLY H H 1 8.802 0.020 . 1 . . . . A 294 GLY H . 34673 1 579 . 1 . 1 49 49 GLY HA2 H 1 4.043 0.020 . 2 . . . . A 294 GLY HA2 . 34673 1 580 . 1 . 1 49 49 GLY HA3 H 1 3.772 0.020 . 2 . . . . A 294 GLY HA3 . 34673 1 581 . 1 . 1 49 49 GLY C C 13 169.658 0.3 . 1 . . . . A 294 GLY C . 34673 1 582 . 1 . 1 49 49 GLY CA C 13 45.339 0.3 . 1 . . . . A 294 GLY CA . 34673 1 583 . 1 . 1 49 49 GLY N N 15 106.160 0.3 . 1 . . . . A 294 GLY N . 34673 1 584 . 1 . 1 50 50 PHE H H 1 8.331 0.020 . 1 . . . . A 295 PHE H . 34673 1 585 . 1 . 1 50 50 PHE HA H 1 5.810 0.020 . 1 . . . . A 295 PHE HA . 34673 1 586 . 1 . 1 50 50 PHE HB2 H 1 2.693 0.020 . 2 . . . . A 295 PHE HB2 . 34673 1 587 . 1 . 1 50 50 PHE HB3 H 1 2.926 0.020 . 2 . . . . A 295 PHE HB3 . 34673 1 588 . 1 . 1 50 50 PHE HD1 H 1 7.147 0.020 . 1 . . . . A 295 PHE HD1 . 34673 1 589 . 1 . 1 50 50 PHE HD2 H 1 7.147 0.020 . 1 . . . . A 295 PHE HD2 . 34673 1 590 . 1 . 1 50 50 PHE HE1 H 1 7.475 0.020 . 1 . . . . A 295 PHE HE1 . 34673 1 591 . 1 . 1 50 50 PHE HE2 H 1 7.475 0.020 . 1 . . . . A 295 PHE HE2 . 34673 1 592 . 1 . 1 50 50 PHE HZ H 1 7.129 0.020 . 1 . . . . A 295 PHE HZ . 34673 1 593 . 1 . 1 50 50 PHE C C 13 176.409 0.3 . 1 . . . . A 295 PHE C . 34673 1 594 . 1 . 1 50 50 PHE CA C 13 55.967 0.3 . 1 . . . . A 295 PHE CA . 34673 1 595 . 1 . 1 50 50 PHE CB C 13 43.815 0.3 . 1 . . . . A 295 PHE CB . 34673 1 596 . 1 . 1 50 50 PHE CD1 C 13 132.415 0.3 . 1 . . . . A 295 PHE CD1 . 34673 1 597 . 1 . 1 50 50 PHE CE1 C 13 130.995 0.3 . 1 . . . . A 295 PHE CE1 . 34673 1 598 . 1 . 1 50 50 PHE CZ C 13 130.425 0.3 . 1 . . . . A 295 PHE CZ . 34673 1 599 . 1 . 1 50 50 PHE N N 15 113.897 0.3 . 1 . . . . A 295 PHE N . 34673 1 600 . 1 . 1 51 51 ILE H H 1 9.001 0.020 . 1 . . . . A 296 ILE H . 34673 1 601 . 1 . 1 51 51 ILE HA H 1 4.601 0.020 . 1 . . . . A 296 ILE HA . 34673 1 602 . 1 . 1 51 51 ILE HB H 1 1.246 0.020 . 1 . . . . A 296 ILE HB . 34673 1 603 . 1 . 1 51 51 ILE HG12 H 1 0.921 0.020 . 2 . . . . A 296 ILE HG12 . 34673 1 604 . 1 . 1 51 51 ILE HG13 H 1 0.575 0.020 . 2 . . . . A 296 ILE HG13 . 34673 1 605 . 1 . 1 51 51 ILE HG21 H 1 0.286 0.020 . 1 . . . . A 296 ILE HG21 . 34673 1 606 . 1 . 1 51 51 ILE HG22 H 1 0.286 0.020 . 1 . . . . A 296 ILE HG22 . 34673 1 607 . 1 . 1 51 51 ILE HG23 H 1 0.286 0.020 . 1 . . . . A 296 ILE HG23 . 34673 1 608 . 1 . 1 51 51 ILE HD11 H 1 -0.144 0.020 . 1 . . . . A 296 ILE HD11 . 34673 1 609 . 1 . 1 51 51 ILE HD12 H 1 -0.144 0.020 . 1 . . . . A 296 ILE HD12 . 34673 1 610 . 1 . 1 51 51 ILE HD13 H 1 -0.144 0.020 . 1 . . . . A 296 ILE HD13 . 34673 1 611 . 1 . 1 51 51 ILE C C 13 175.218 0.3 . 1 . . . . A 296 ILE C . 34673 1 612 . 1 . 1 51 51 ILE CA C 13 59.751 0.3 . 1 . . . . A 296 ILE CA . 34673 1 613 . 1 . 1 51 51 ILE CB C 13 41.309 0.3 . 1 . . . . A 296 ILE CB . 34673 1 614 . 1 . 1 51 51 ILE CG1 C 13 27.256 0.3 . 1 . . . . A 296 ILE CG1 . 34673 1 615 . 1 . 1 51 51 ILE CG2 C 13 16.964 0.3 . 1 . . . . A 296 ILE CG2 . 34673 1 616 . 1 . 1 51 51 ILE CD1 C 13 13.369 0.3 . 1 . . . . A 296 ILE CD1 . 34673 1 617 . 1 . 1 51 51 ILE N N 15 123.158 0.3 . 1 . . . . A 296 ILE N . 34673 1 618 . 1 . 1 52 52 THR H H 1 8.775 0.020 . 1 . . . . A 297 THR H . 34673 1 619 . 1 . 1 52 52 THR HA H 1 5.115 0.020 . 1 . . . . A 297 THR HA . 34673 1 620 . 1 . 1 52 52 THR HB H 1 4.019 0.020 . 1 . . . . A 297 THR HB . 34673 1 621 . 1 . 1 52 52 THR HG21 H 1 1.052 0.020 . 1 . . . . A 297 THR HG21 . 34673 1 622 . 1 . 1 52 52 THR HG22 H 1 1.052 0.020 . 1 . . . . A 297 THR HG22 . 34673 1 623 . 1 . 1 52 52 THR HG23 H 1 1.052 0.020 . 1 . . . . A 297 THR HG23 . 34673 1 624 . 1 . 1 52 52 THR C C 13 174.637 0.3 . 1 . . . . A 297 THR C . 34673 1 625 . 1 . 1 52 52 THR CA C 13 61.890 0.3 . 1 . . . . A 297 THR CA . 34673 1 626 . 1 . 1 52 52 THR CB C 13 69.520 0.3 . 1 . . . . A 297 THR CB . 34673 1 627 . 1 . 1 52 52 THR CG2 C 13 21.442 0.3 . 1 . . . . A 297 THR CG2 . 34673 1 628 . 1 . 1 52 52 THR N N 15 122.899 0.3 . 1 . . . . A 297 THR N . 34673 1 629 . 1 . 1 53 53 PHE H H 1 8.966 0.020 . 1 . . . . A 298 PHE H . 34673 1 630 . 1 . 1 53 53 PHE HA H 1 4.893 0.020 . 1 . . . . A 298 PHE HA . 34673 1 631 . 1 . 1 53 53 PHE HB2 H 1 3.468 0.020 . 2 . . . . A 298 PHE HB2 . 34673 1 632 . 1 . 1 53 53 PHE HB3 H 1 2.882 0.020 . 2 . . . . A 298 PHE HB3 . 34673 1 633 . 1 . 1 53 53 PHE HD1 H 1 7.217 0.020 . 1 . . . . A 298 PHE HD1 . 34673 1 634 . 1 . 1 53 53 PHE HD2 H 1 7.217 0.020 . 1 . . . . A 298 PHE HD2 . 34673 1 635 . 1 . 1 53 53 PHE HE1 H 1 7.182 0.020 . 1 . . . . A 298 PHE HE1 . 34673 1 636 . 1 . 1 53 53 PHE HE2 H 1 7.182 0.020 . 1 . . . . A 298 PHE HE2 . 34673 1 637 . 1 . 1 53 53 PHE HZ H 1 7.039 0.020 . 1 . . . . A 298 PHE HZ . 34673 1 638 . 1 . 1 53 53 PHE C C 13 176.396 0.3 . 1 . . . . A 298 PHE C . 34673 1 639 . 1 . 1 53 53 PHE CA C 13 58.022 0.3 . 1 . . . . A 298 PHE CA . 34673 1 640 . 1 . 1 53 53 PHE CB C 13 41.940 0.3 . 1 . . . . A 298 PHE CB . 34673 1 641 . 1 . 1 53 53 PHE CD1 C 13 131.369 0.3 . 1 . . . . A 298 PHE CD1 . 34673 1 642 . 1 . 1 53 53 PHE CE1 C 13 131.579 0.3 . 1 . . . . A 298 PHE CE1 . 34673 1 643 . 1 . 1 53 53 PHE CE2 C 13 131.579 0.3 . 1 . . . . A 298 PHE CE2 . 34673 1 644 . 1 . 1 53 53 PHE CZ C 13 126.731 0.3 . 1 . . . . A 298 PHE CZ . 34673 1 645 . 1 . 1 53 53 PHE N N 15 128.468 0.3 . 1 . . . . A 298 PHE N . 34673 1 646 . 1 . 1 54 54 SER H H 1 8.145 0.020 . 1 . . . . A 299 SER H . 34673 1 647 . 1 . 1 54 54 SER HA H 1 4.238 0.020 . 1 . . . . A 299 SER HA . 34673 1 648 . 1 . 1 54 54 SER HB2 H 1 3.810 0.020 . 2 . . . . A 299 SER HB2 . 34673 1 649 . 1 . 1 54 54 SER HB3 H 1 4.012 0.020 . 2 . . . . A 299 SER HB3 . 34673 1 650 . 1 . 1 54 54 SER C C 13 173.051 0.3 . 1 . . . . A 299 SER C . 34673 1 651 . 1 . 1 54 54 SER CA C 13 61.615 0.3 . 1 . . . . A 299 SER CA . 34673 1 652 . 1 . 1 54 54 SER CB C 13 63.480 0.3 . 1 . . . . A 299 SER CB . 34673 1 653 . 1 . 1 54 54 SER N N 15 115.877 0.3 . 1 . . . . A 299 SER N . 34673 1 654 . 1 . 1 55 55 ASP H H 1 8.802 0.020 . 1 . . . . A 300 ASP H . 34673 1 655 . 1 . 1 55 55 ASP HA H 1 5.025 0.020 . 1 . . . . A 300 ASP HA . 34673 1 656 . 1 . 1 55 55 ASP HB2 H 1 3.071 0.020 . 2 . . . . A 300 ASP HB2 . 34673 1 657 . 1 . 1 55 55 ASP HB3 H 1 2.647 0.020 . 2 . . . . A 300 ASP HB3 . 34673 1 658 . 1 . 1 55 55 ASP C C 13 177.190 0.3 . 1 . . . . A 300 ASP C . 34673 1 659 . 1 . 1 55 55 ASP CA C 13 52.666 0.3 . 1 . . . . A 300 ASP CA . 34673 1 660 . 1 . 1 55 55 ASP CB C 13 44.781 0.3 . 1 . . . . A 300 ASP CB . 34673 1 661 . 1 . 1 55 55 ASP N N 15 118.805 0.3 . 1 . . . . A 300 ASP N . 34673 1 662 . 1 . 1 56 56 SER H H 1 8.888 0.020 . 1 . . . . A 301 SER H . 34673 1 663 . 1 . 1 56 56 SER HA H 1 4.140 0.020 . 1 . . . . A 301 SER HA . 34673 1 664 . 1 . 1 56 56 SER HB2 H 1 4.051 0.020 . 1 . . . . A 301 SER HB2 . 34673 1 665 . 1 . 1 56 56 SER HB3 H 1 4.051 0.020 . 1 . . . . A 301 SER HB3 . 34673 1 666 . 1 . 1 56 56 SER C C 13 175.964 0.3 . 1 . . . . A 301 SER C . 34673 1 667 . 1 . 1 56 56 SER CA C 13 61.601 0.3 . 1 . . . . A 301 SER CA . 34673 1 668 . 1 . 1 56 56 SER CB C 13 63.370 0.3 . 1 . . . . A 301 SER CB . 34673 1 669 . 1 . 1 56 56 SER N N 15 123.371 0.3 . 1 . . . . A 301 SER N . 34673 1 670 . 1 . 1 57 57 GLU H H 1 8.718 0.020 . 1 . . . . A 302 GLU H . 34673 1 671 . 1 . 1 57 57 GLU HA H 1 4.137 0.020 . 1 . . . . A 302 GLU HA . 34673 1 672 . 1 . 1 57 57 GLU HB2 H 1 2.235 0.020 . 2 . . . . A 302 GLU HB2 . 34673 1 673 . 1 . 1 57 57 GLU HB3 H 1 2.157 0.020 . 2 . . . . A 302 GLU HB3 . 34673 1 674 . 1 . 1 57 57 GLU HG2 H 1 2.487 0.020 . 2 . . . . A 302 GLU HG2 . 34673 1 675 . 1 . 1 57 57 GLU HG3 H 1 2.356 0.020 . 2 . . . . A 302 GLU HG3 . 34673 1 676 . 1 . 1 57 57 GLU C C 13 179.955 0.3 . 1 . . . . A 302 GLU C . 34673 1 677 . 1 . 1 57 57 GLU CA C 13 59.178 0.3 . 1 . . . . A 302 GLU CA . 34673 1 678 . 1 . 1 57 57 GLU CB C 13 28.847 0.3 . 1 . . . . A 302 GLU CB . 34673 1 679 . 1 . 1 57 57 GLU CG C 13 36.598 0.3 . 1 . . . . A 302 GLU CG . 34673 1 680 . 1 . 1 57 57 GLU N N 15 122.889 0.3 . 1 . . . . A 302 GLU N . 34673 1 681 . 1 . 1 58 58 CYS H H 1 7.496 0.020 . 1 . . . . A 303 CYS H . 34673 1 682 . 1 . 1 58 58 CYS HA H 1 4.164 0.020 . 1 . . . . A 303 CYS HA . 34673 1 683 . 1 . 1 58 58 CYS HB2 H 1 3.041 0.020 . 2 . . . . A 303 CYS HB2 . 34673 1 684 . 1 . 1 58 58 CYS HB3 H 1 3.286 0.020 . 2 . . . . A 303 CYS HB3 . 34673 1 685 . 1 . 1 58 58 CYS C C 13 175.929 0.3 . 1 . . . . A 303 CYS C . 34673 1 686 . 1 . 1 58 58 CYS CA C 13 62.167 0.3 . 1 . . . . A 303 CYS CA . 34673 1 687 . 1 . 1 58 58 CYS CB C 13 27.775 0.3 . 1 . . . . A 303 CYS CB . 34673 1 688 . 1 . 1 58 58 CYS N N 15 119.679 0.3 . 1 . . . . A 303 CYS N . 34673 1 689 . 1 . 1 59 59 ALA H H 1 6.977 0.020 . 1 . . . . A 304 ALA H . 34673 1 690 . 1 . 1 59 59 ALA HA H 1 2.907 0.020 . 1 . . . . A 304 ALA HA . 34673 1 691 . 1 . 1 59 59 ALA HB1 H 1 1.441 0.020 . 1 . . . . A 304 ALA HB1 . 34673 1 692 . 1 . 1 59 59 ALA HB2 H 1 1.441 0.020 . 1 . . . . A 304 ALA HB2 . 34673 1 693 . 1 . 1 59 59 ALA HB3 H 1 1.441 0.020 . 1 . . . . A 304 ALA HB3 . 34673 1 694 . 1 . 1 59 59 ALA C C 13 178.558 0.3 . 1 . . . . A 304 ALA C . 34673 1 695 . 1 . 1 59 59 ALA CA C 13 54.233 0.3 . 1 . . . . A 304 ALA CA . 34673 1 696 . 1 . 1 59 59 ALA CB C 13 19.040 0.3 . 1 . . . . A 304 ALA CB . 34673 1 697 . 1 . 1 59 59 ALA N N 15 120.242 0.3 . 1 . . . . A 304 ALA N . 34673 1 698 . 1 . 1 60 60 LYS H H 1 7.859 0.020 . 1 . . . . A 305 LYS H . 34673 1 699 . 1 . 1 60 60 LYS HA H 1 3.780 0.020 . 1 . . . . A 305 LYS HA . 34673 1 700 . 1 . 1 60 60 LYS HB2 H 1 1.968 0.020 . 2 . . . . A 305 LYS HB2 . 34673 1 701 . 1 . 1 60 60 LYS HB3 H 1 1.859 0.020 . 2 . . . . A 305 LYS HB3 . 34673 1 702 . 1 . 1 60 60 LYS HG2 H 1 1.741 0.020 . 2 . . . . A 305 LYS HG2 . 34673 1 703 . 1 . 1 60 60 LYS HG3 H 1 1.441 0.020 . 2 . . . . A 305 LYS HG3 . 34673 1 704 . 1 . 1 60 60 LYS HE2 H 1 3.061 0.020 . 2 . . . . A 305 LYS HE2 . 34673 1 705 . 1 . 1 60 60 LYS HE3 H 1 2.956 0.020 . 2 . . . . A 305 LYS HE3 . 34673 1 706 . 1 . 1 60 60 LYS C C 13 178.736 0.3 . 1 . . . . A 305 LYS C . 34673 1 707 . 1 . 1 60 60 LYS CA C 13 60.094 0.3 . 1 . . . . A 305 LYS CA . 34673 1 708 . 1 . 1 60 60 LYS CB C 13 32.033 0.3 . 1 . . . . A 305 LYS CB . 34673 1 709 . 1 . 1 60 60 LYS CG C 13 25.972 0.3 . 1 . . . . A 305 LYS CG . 34673 1 710 . 1 . 1 60 60 LYS CD C 13 29.525 0.3 . 1 . . . . A 305 LYS CD . 34673 1 711 . 1 . 1 60 60 LYS CE C 13 41.878 0.3 . 1 . . . . A 305 LYS CE . 34673 1 712 . 1 . 1 60 60 LYS N N 15 115.886 0.3 . 1 . . . . A 305 LYS N . 34673 1 713 . 1 . 1 61 61 LYS H H 1 7.063 0.020 . 1 . . . . A 306 LYS H . 34673 1 714 . 1 . 1 61 61 LYS HA H 1 4.123 0.020 . 1 . . . . A 306 LYS HA . 34673 1 715 . 1 . 1 61 61 LYS HB2 H 1 2.088 0.020 . 2 . . . . A 306 LYS HB2 . 34673 1 716 . 1 . 1 61 61 LYS HB3 H 1 2.072 0.020 . 2 . . . . A 306 LYS HB3 . 34673 1 717 . 1 . 1 61 61 LYS HG2 H 1 1.735 0.020 . 2 . . . . A 306 LYS HG2 . 34673 1 718 . 1 . 1 61 61 LYS HG3 H 1 1.644 0.020 . 2 . . . . A 306 LYS HG3 . 34673 1 719 . 1 . 1 61 61 LYS HD2 H 1 1.866 0.020 . 1 . . . . A 306 LYS HD2 . 34673 1 720 . 1 . 1 61 61 LYS HD3 H 1 1.866 0.020 . 1 . . . . A 306 LYS HD3 . 34673 1 721 . 1 . 1 61 61 LYS HE2 H 1 3.070 0.020 . 2 . . . . A 306 LYS HE2 . 34673 1 722 . 1 . 1 61 61 LYS HE3 H 1 2.957 0.020 . 2 . . . . A 306 LYS HE3 . 34673 1 723 . 1 . 1 61 61 LYS C C 13 177.830 0.3 . 1 . . . . A 306 LYS C . 34673 1 724 . 1 . 1 61 61 LYS CA C 13 58.963 0.3 . 1 . . . . A 306 LYS CA . 34673 1 725 . 1 . 1 61 61 LYS CB C 13 32.103 0.3 . 1 . . . . A 306 LYS CB . 34673 1 726 . 1 . 1 61 61 LYS CG C 13 25.328 0.3 . 1 . . . . A 306 LYS CG . 34673 1 727 . 1 . 1 61 61 LYS CD C 13 28.790 0.3 . 1 . . . . A 306 LYS CD . 34673 1 728 . 1 . 1 61 61 LYS CE C 13 41.913 0.3 . 1 . . . . A 306 LYS CE . 34673 1 729 . 1 . 1 61 61 LYS N N 15 119.163 0.3 . 1 . . . . A 306 LYS N . 34673 1 730 . 1 . 1 62 62 ALA H H 1 7.404 0.020 . 1 . . . . A 307 ALA H . 34673 1 731 . 1 . 1 62 62 ALA HA H 1 2.459 0.020 . 1 . . . . A 307 ALA HA . 34673 1 732 . 1 . 1 62 62 ALA HB1 H 1 0.988 0.020 . 1 . . . . A 307 ALA HB1 . 34673 1 733 . 1 . 1 62 62 ALA HB2 H 1 0.988 0.020 . 1 . . . . A 307 ALA HB2 . 34673 1 734 . 1 . 1 62 62 ALA HB3 H 1 0.988 0.020 . 1 . . . . A 307 ALA HB3 . 34673 1 735 . 1 . 1 62 62 ALA C C 13 178.558 0.3 . 1 . . . . A 307 ALA C . 34673 1 736 . 1 . 1 62 62 ALA CA C 13 54.713 0.3 . 1 . . . . A 307 ALA CA . 34673 1 737 . 1 . 1 62 62 ALA CB C 13 18.311 0.3 . 1 . . . . A 307 ALA CB . 34673 1 738 . 1 . 1 62 62 ALA N N 15 121.392 0.3 . 1 . . . . A 307 ALA N . 34673 1 739 . 1 . 1 63 63 LEU H H 1 7.968 0.020 . 1 . . . . A 308 LEU H . 34673 1 740 . 1 . 1 63 63 LEU HA H 1 3.681 0.020 . 1 . . . . A 308 LEU HA . 34673 1 741 . 1 . 1 63 63 LEU HB2 H 1 1.800 0.020 . 2 . . . . A 308 LEU HB2 . 34673 1 742 . 1 . 1 63 63 LEU HB3 H 1 1.580 0.020 . 2 . . . . A 308 LEU HB3 . 34673 1 743 . 1 . 1 63 63 LEU HG H 1 1.476 0.020 . 1 . . . . A 308 LEU HG . 34673 1 744 . 1 . 1 63 63 LEU HD11 H 1 0.762 0.020 . 2 . . . . A 308 LEU HD11 . 34673 1 745 . 1 . 1 63 63 LEU HD12 H 1 0.762 0.020 . 2 . . . . A 308 LEU HD12 . 34673 1 746 . 1 . 1 63 63 LEU HD13 H 1 0.762 0.020 . 2 . . . . A 308 LEU HD13 . 34673 1 747 . 1 . 1 63 63 LEU HD21 H 1 0.645 0.020 . 2 . . . . A 308 LEU HD21 . 34673 1 748 . 1 . 1 63 63 LEU HD22 H 1 0.645 0.020 . 2 . . . . A 308 LEU HD22 . 34673 1 749 . 1 . 1 63 63 LEU HD23 H 1 0.645 0.020 . 2 . . . . A 308 LEU HD23 . 34673 1 750 . 1 . 1 63 63 LEU C C 13 178.410 0.3 . 1 . . . . A 308 LEU C . 34673 1 751 . 1 . 1 63 63 LEU CA C 13 59.086 0.3 . 1 . . . . A 308 LEU CA . 34673 1 752 . 1 . 1 63 63 LEU CB C 13 42.247 0.3 . 1 . . . . A 308 LEU CB . 34673 1 753 . 1 . 1 63 63 LEU CG C 13 27.134 0.3 . 1 . . . . A 308 LEU CG . 34673 1 754 . 1 . 1 63 63 LEU CD1 C 13 25.230 0.3 . 1 . . . . A 308 LEU CD1 . 34673 1 755 . 1 . 1 63 63 LEU CD2 C 13 25.702 0.3 . 1 . . . . A 308 LEU CD2 . 34673 1 756 . 1 . 1 63 63 LEU N N 15 118.181 0.3 . 1 . . . . A 308 LEU N . 34673 1 757 . 1 . 1 64 64 GLU H H 1 7.501 0.020 . 1 . . . . A 309 GLU H . 34673 1 758 . 1 . 1 64 64 GLU HA H 1 3.981 0.020 . 1 . . . . A 309 GLU HA . 34673 1 759 . 1 . 1 64 64 GLU HB2 H 1 2.086 0.020 . 2 . . . . A 309 GLU HB2 . 34673 1 760 . 1 . 1 64 64 GLU HB3 H 1 2.015 0.020 . 2 . . . . A 309 GLU HB3 . 34673 1 761 . 1 . 1 64 64 GLU HG2 H 1 2.485 0.020 . 2 . . . . A 309 GLU HG2 . 34673 1 762 . 1 . 1 64 64 GLU HG3 H 1 2.264 0.020 . 2 . . . . A 309 GLU HG3 . 34673 1 763 . 1 . 1 64 64 GLU C C 13 178.771 0.3 . 1 . . . . A 309 GLU C . 34673 1 764 . 1 . 1 64 64 GLU CA C 13 58.788 0.3 . 1 . . . . A 309 GLU CA . 34673 1 765 . 1 . 1 64 64 GLU CB C 13 29.926 0.3 . 1 . . . . A 309 GLU CB . 34673 1 766 . 1 . 1 64 64 GLU CG C 13 36.259 0.3 . 1 . . . . A 309 GLU CG . 34673 1 767 . 1 . 1 64 64 GLU N N 15 116.255 0.3 . 1 . . . . A 309 GLU N . 34673 1 768 . 1 . 1 65 65 GLN H H 1 7.780 0.020 . 1 . . . . A 310 GLN H . 34673 1 769 . 1 . 1 65 65 GLN HA H 1 4.309 0.020 . 1 . . . . A 310 GLN HA . 34673 1 770 . 1 . 1 65 65 GLN HB2 H 1 2.149 0.020 . 2 . . . . A 310 GLN HB2 . 34673 1 771 . 1 . 1 65 65 GLN HB3 H 1 1.939 0.020 . 2 . . . . A 310 GLN HB3 . 34673 1 772 . 1 . 1 65 65 GLN HG2 H 1 2.606 0.020 . 2 . . . . A 310 GLN HG2 . 34673 1 773 . 1 . 1 65 65 GLN HG3 H 1 2.521 0.020 . 2 . . . . A 310 GLN HG3 . 34673 1 774 . 1 . 1 65 65 GLN HE21 H 1 7.631 0.020 . 1 . . . . A 310 GLN HE21 . 34673 1 775 . 1 . 1 65 65 GLN HE22 H 1 6.849 0.020 . 1 . . . . A 310 GLN HE22 . 34673 1 776 . 1 . 1 65 65 GLN C C 13 177.883 0.3 . 1 . . . . A 310 GLN C . 34673 1 777 . 1 . 1 65 65 GLN CA C 13 57.378 0.3 . 1 . . . . A 310 GLN CA . 34673 1 778 . 1 . 1 65 65 GLN CB C 13 30.014 0.3 . 1 . . . . A 310 GLN CB . 34673 1 779 . 1 . 1 65 65 GLN CG C 13 34.606 0.3 . 1 . . . . A 310 GLN CG . 34673 1 780 . 1 . 1 65 65 GLN N N 15 114.402 0.3 . 1 . . . . A 310 GLN N . 34673 1 781 . 1 . 1 65 65 GLN NE2 N 15 112.312 0.3 . 1 . . . . A 310 GLN NE2 . 34673 1 782 . 1 . 1 66 66 LEU H H 1 8.314 0.020 . 1 . . . . A 311 LEU H . 34673 1 783 . 1 . 1 66 66 LEU HA H 1 4.468 0.020 . 1 . . . . A 311 LEU HA . 34673 1 784 . 1 . 1 66 66 LEU HB2 H 1 1.658 0.020 . 2 . . . . A 311 LEU HB2 . 34673 1 785 . 1 . 1 66 66 LEU HB3 H 1 1.159 0.020 . 2 . . . . A 311 LEU HB3 . 34673 1 786 . 1 . 1 66 66 LEU HG H 1 0.963 0.020 . 1 . . . . A 311 LEU HG . 34673 1 787 . 1 . 1 66 66 LEU HD11 H 1 0.226 0.020 . 2 . . . . A 311 LEU HD11 . 34673 1 788 . 1 . 1 66 66 LEU HD12 H 1 0.226 0.020 . 2 . . . . A 311 LEU HD12 . 34673 1 789 . 1 . 1 66 66 LEU HD13 H 1 0.226 0.020 . 2 . . . . A 311 LEU HD13 . 34673 1 790 . 1 . 1 66 66 LEU HD21 H 1 -0.234 0.020 . 2 . . . . A 311 LEU HD21 . 34673 1 791 . 1 . 1 66 66 LEU HD22 H 1 -0.234 0.020 . 2 . . . . A 311 LEU HD22 . 34673 1 792 . 1 . 1 66 66 LEU HD23 H 1 -0.234 0.020 . 2 . . . . A 311 LEU HD23 . 34673 1 793 . 1 . 1 66 66 LEU C C 13 177.812 0.3 . 1 . . . . A 311 LEU C . 34673 1 794 . 1 . 1 66 66 LEU CA C 13 54.924 0.3 . 1 . . . . A 311 LEU CA . 34673 1 795 . 1 . 1 66 66 LEU CB C 13 42.247 0.3 . 1 . . . . A 311 LEU CB . 34673 1 796 . 1 . 1 66 66 LEU CG C 13 26.381 0.3 . 1 . . . . A 311 LEU CG . 34673 1 797 . 1 . 1 66 66 LEU CD1 C 13 21.927 0.3 . 1 . . . . A 311 LEU CD1 . 34673 1 798 . 1 . 1 66 66 LEU CD2 C 13 25.836 0.3 . 1 . . . . A 311 LEU CD2 . 34673 1 799 . 1 . 1 66 66 LEU N N 15 115.744 0.3 . 1 . . . . A 311 LEU N . 34673 1 800 . 1 . 1 67 67 ASN H H 1 7.151 0.020 . 1 . . . . A 312 ASN H . 34673 1 801 . 1 . 1 67 67 ASN HA H 1 4.592 0.020 . 1 . . . . A 312 ASN HA . 34673 1 802 . 1 . 1 67 67 ASN HB2 H 1 3.098 0.020 . 2 . . . . A 312 ASN HB2 . 34673 1 803 . 1 . 1 67 67 ASN HB3 H 1 3.004 0.020 . 2 . . . . A 312 ASN HB3 . 34673 1 804 . 1 . 1 67 67 ASN HD21 H 1 7.632 0.020 . 1 . . . . A 312 ASN HD21 . 34673 1 805 . 1 . 1 67 67 ASN HD22 H 1 6.837 0.020 . 1 . . . . A 312 ASN HD22 . 34673 1 806 . 1 . 1 67 67 ASN C C 13 176.551 0.3 . 1 . . . . A 312 ASN C . 34673 1 807 . 1 . 1 67 67 ASN CA C 13 56.262 0.3 . 1 . . . . A 312 ASN CA . 34673 1 808 . 1 . 1 67 67 ASN CB C 13 38.060 0.3 . 1 . . . . A 312 ASN CB . 34673 1 809 . 1 . 1 67 67 ASN N N 15 116.722 0.3 . 1 . . . . A 312 ASN N . 34673 1 810 . 1 . 1 67 67 ASN ND2 N 15 113.371 0.3 . 1 . . . . A 312 ASN ND2 . 34673 1 811 . 1 . 1 68 68 GLY H H 1 9.047 0.020 . 1 . . . . A 313 GLY H . 34673 1 812 . 1 . 1 68 68 GLY HA2 H 1 4.374 0.020 . 2 . . . . A 313 GLY HA2 . 34673 1 813 . 1 . 1 68 68 GLY HA3 H 1 3.614 0.020 . 2 . . . . A 313 GLY HA3 . 34673 1 814 . 1 . 1 68 68 GLY C C 13 173.229 0.3 . 1 . . . . A 313 GLY C . 34673 1 815 . 1 . 1 68 68 GLY CA C 13 45.380 0.3 . 1 . . . . A 313 GLY CA . 34673 1 816 . 1 . 1 68 68 GLY N N 15 118.684 0.3 . 1 . . . . A 313 GLY N . 34673 1 817 . 1 . 1 69 69 PHE H H 1 8.115 0.020 . 1 . . . . A 314 PHE H . 34673 1 818 . 1 . 1 69 69 PHE HA H 1 4.273 0.020 . 1 . . . . A 314 PHE HA . 34673 1 819 . 1 . 1 69 69 PHE HB2 H 1 3.210 0.020 . 2 . . . . A 314 PHE HB2 . 34673 1 820 . 1 . 1 69 69 PHE HB3 H 1 3.141 0.020 . 2 . . . . A 314 PHE HB3 . 34673 1 821 . 1 . 1 69 69 PHE HD1 H 1 7.179 0.020 . 1 . . . . A 314 PHE HD1 . 34673 1 822 . 1 . 1 69 69 PHE HD2 H 1 7.179 0.020 . 1 . . . . A 314 PHE HD2 . 34673 1 823 . 1 . 1 69 69 PHE HE1 H 1 7.325 0.020 . 1 . . . . A 314 PHE HE1 . 34673 1 824 . 1 . 1 69 69 PHE HE2 H 1 7.325 0.020 . 1 . . . . A 314 PHE HE2 . 34673 1 825 . 1 . 1 69 69 PHE HZ H 1 7.329 0.020 . 1 . . . . A 314 PHE HZ . 34673 1 826 . 1 . 1 69 69 PHE C C 13 175.432 0.3 . 1 . . . . A 314 PHE C . 34673 1 827 . 1 . 1 69 69 PHE CA C 13 58.669 0.3 . 1 . . . . A 314 PHE CA . 34673 1 828 . 1 . 1 69 69 PHE CB C 13 40.603 0.3 . 1 . . . . A 314 PHE CB . 34673 1 829 . 1 . 1 69 69 PHE CD1 C 13 132.112 0.3 . 1 . . . . A 314 PHE CD1 . 34673 1 830 . 1 . 1 69 69 PHE CE1 C 13 131.381 0.3 . 1 . . . . A 314 PHE CE1 . 34673 1 831 . 1 . 1 69 69 PHE CZ C 13 129.717 0.3 . 1 . . . . A 314 PHE CZ . 34673 1 832 . 1 . 1 69 69 PHE N N 15 123.785 0.3 . 1 . . . . A 314 PHE N . 34673 1 833 . 1 . 1 70 70 GLU H H 1 7.849 0.020 . 1 . . . . A 315 GLU H . 34673 1 834 . 1 . 1 70 70 GLU HA H 1 3.917 0.020 . 1 . . . . A 315 GLU HA . 34673 1 835 . 1 . 1 70 70 GLU HB2 H 1 1.739 0.020 . 2 . . . . A 315 GLU HB2 . 34673 1 836 . 1 . 1 70 70 GLU HB3 H 1 1.507 0.020 . 2 . . . . A 315 GLU HB3 . 34673 1 837 . 1 . 1 70 70 GLU HG2 H 1 2.020 0.020 . 2 . . . . A 315 GLU HG2 . 34673 1 838 . 1 . 1 70 70 GLU HG3 H 1 1.637 0.020 . 2 . . . . A 315 GLU HG3 . 34673 1 839 . 1 . 1 70 70 GLU C C 13 173.691 0.3 . 1 . . . . A 315 GLU C . 34673 1 840 . 1 . 1 70 70 GLU CA C 13 56.809 0.3 . 1 . . . . A 315 GLU CA . 34673 1 841 . 1 . 1 70 70 GLU CB C 13 29.564 0.3 . 1 . . . . A 315 GLU CB . 34673 1 842 . 1 . 1 70 70 GLU CG C 13 37.010 0.3 . 1 . . . . A 315 GLU CG . 34673 1 843 . 1 . 1 70 70 GLU N N 15 127.871 0.3 . 1 . . . . A 315 GLU N . 34673 1 844 . 1 . 1 71 71 LEU H H 1 7.875 0.020 . 1 . . . . A 316 LEU H . 34673 1 845 . 1 . 1 71 71 LEU HA H 1 4.548 0.020 . 1 . . . . A 316 LEU HA . 34673 1 846 . 1 . 1 71 71 LEU HB2 H 1 1.970 0.020 . 2 . . . . A 316 LEU HB2 . 34673 1 847 . 1 . 1 71 71 LEU HB3 H 1 1.516 0.020 . 2 . . . . A 316 LEU HB3 . 34673 1 848 . 1 . 1 71 71 LEU HG H 1 1.515 0.020 . 1 . . . . A 316 LEU HG . 34673 1 849 . 1 . 1 71 71 LEU HD11 H 1 1.048 0.020 . 2 . . . . A 316 LEU HD11 . 34673 1 850 . 1 . 1 71 71 LEU HD12 H 1 1.048 0.020 . 2 . . . . A 316 LEU HD12 . 34673 1 851 . 1 . 1 71 71 LEU HD13 H 1 1.048 0.020 . 2 . . . . A 316 LEU HD13 . 34673 1 852 . 1 . 1 71 71 LEU HD21 H 1 1.080 0.020 . 2 . . . . A 316 LEU HD21 . 34673 1 853 . 1 . 1 71 71 LEU HD22 H 1 1.080 0.020 . 2 . . . . A 316 LEU HD22 . 34673 1 854 . 1 . 1 71 71 LEU HD23 H 1 1.080 0.020 . 2 . . . . A 316 LEU HD23 . 34673 1 855 . 1 . 1 71 71 LEU C C 13 175.876 0.3 . 1 . . . . A 316 LEU C . 34673 1 856 . 1 . 1 71 71 LEU CA C 13 53.696 0.3 . 1 . . . . A 316 LEU CA . 34673 1 857 . 1 . 1 71 71 LEU CB C 13 44.095 0.3 . 1 . . . . A 316 LEU CB . 34673 1 858 . 1 . 1 71 71 LEU CG C 13 28.942 0.3 . 1 . . . . A 316 LEU CG . 34673 1 859 . 1 . 1 71 71 LEU CD1 C 13 26.473 0.3 . 1 . . . . A 316 LEU CD1 . 34673 1 860 . 1 . 1 71 71 LEU CD2 C 13 22.580 0.3 . 1 . . . . A 316 LEU CD2 . 34673 1 861 . 1 . 1 71 71 LEU N N 15 128.423 0.3 . 1 . . . . A 316 LEU N . 34673 1 862 . 1 . 1 72 72 ALA H H 1 9.356 0.020 . 1 . . . . A 317 ALA H . 34673 1 863 . 1 . 1 72 72 ALA HA H 1 3.931 0.020 . 1 . . . . A 317 ALA HA . 34673 1 864 . 1 . 1 72 72 ALA HB1 H 1 1.315 0.020 . 1 . . . . A 317 ALA HB1 . 34673 1 865 . 1 . 1 72 72 ALA HB2 H 1 1.315 0.020 . 1 . . . . A 317 ALA HB2 . 34673 1 866 . 1 . 1 72 72 ALA HB3 H 1 1.315 0.020 . 1 . . . . A 317 ALA HB3 . 34673 1 867 . 1 . 1 72 72 ALA C C 13 177.421 0.3 . 1 . . . . A 317 ALA C . 34673 1 868 . 1 . 1 72 72 ALA CA C 13 52.795 0.3 . 1 . . . . A 317 ALA CA . 34673 1 869 . 1 . 1 72 72 ALA CB C 13 17.053 0.3 . 1 . . . . A 317 ALA CB . 34673 1 870 . 1 . 1 72 72 ALA N N 15 131.839 0.3 . 1 . . . . A 317 ALA N . 34673 1 871 . 1 . 1 73 73 GLY H H 1 8.285 0.020 . 1 . . . . A 318 GLY H . 34673 1 872 . 1 . 1 73 73 GLY HA2 H 1 4.137 0.020 . 2 . . . . A 318 GLY HA2 . 34673 1 873 . 1 . 1 73 73 GLY HA3 H 1 3.623 0.020 . 2 . . . . A 318 GLY HA3 . 34673 1 874 . 1 . 1 73 73 GLY C C 13 173.957 0.3 . 1 . . . . A 318 GLY C . 34673 1 875 . 1 . 1 73 73 GLY CA C 13 45.196 0.3 . 1 . . . . A 318 GLY CA . 34673 1 876 . 1 . 1 73 73 GLY N N 15 101.639 0.3 . 1 . . . . A 318 GLY N . 34673 1 877 . 1 . 1 74 74 ARG H H 1 7.538 0.020 . 1 . . . . A 319 ARG H . 34673 1 878 . 1 . 1 74 74 ARG HA H 1 4.999 0.020 . 1 . . . . A 319 ARG HA . 34673 1 879 . 1 . 1 74 74 ARG HB2 H 1 1.911 0.020 . 2 . . . . A 319 ARG HB2 . 34673 1 880 . 1 . 1 74 74 ARG HB3 H 1 1.728 0.020 . 2 . . . . A 319 ARG HB3 . 34673 1 881 . 1 . 1 74 74 ARG HG2 H 1 1.489 0.020 . 1 . . . . A 319 ARG HG2 . 34673 1 882 . 1 . 1 74 74 ARG HD2 H 1 3.059 0.020 . 2 . . . . A 319 ARG HD2 . 34673 1 883 . 1 . 1 74 74 ARG HD3 H 1 2.957 0.020 . 2 . . . . A 319 ARG HD3 . 34673 1 884 . 1 . 1 74 74 ARG CA C 13 52.787 0.3 . 1 . . . . A 319 ARG CA . 34673 1 885 . 1 . 1 74 74 ARG CB C 13 32.971 0.3 . 1 . . . . A 319 ARG CB . 34673 1 886 . 1 . 1 74 74 ARG CG C 13 27.010 0.3 . 1 . . . . A 319 ARG CG . 34673 1 887 . 1 . 1 74 74 ARG CD C 13 41.814 0.3 . 1 . . . . A 319 ARG CD . 34673 1 888 . 1 . 1 74 74 ARG N N 15 119.956 0.3 . 1 . . . . A 319 ARG N . 34673 1 889 . 1 . 1 75 75 PRO HA H 1 4.305 0.020 . 1 . . . . A 320 PRO HA . 34673 1 890 . 1 . 1 75 75 PRO HB2 H 1 2.167 0.020 . 2 . . . . A 320 PRO HB2 . 34673 1 891 . 1 . 1 75 75 PRO HB3 H 1 1.879 0.020 . 2 . . . . A 320 PRO HB3 . 34673 1 892 . 1 . 1 75 75 PRO HG2 H 1 1.997 0.020 . 2 . . . . A 320 PRO HG2 . 34673 1 893 . 1 . 1 75 75 PRO HG3 H 1 2.216 0.020 . 2 . . . . A 320 PRO HG3 . 34673 1 894 . 1 . 1 75 75 PRO HD2 H 1 3.913 0.020 . 2 . . . . A 320 PRO HD2 . 34673 1 895 . 1 . 1 75 75 PRO HD3 H 1 3.731 0.020 . 2 . . . . A 320 PRO HD3 . 34673 1 896 . 1 . 1 75 75 PRO C C 13 176.178 0.3 . 1 . . . . A 320 PRO C . 34673 1 897 . 1 . 1 75 75 PRO CA C 13 62.786 0.3 . 1 . . . . A 320 PRO CA . 34673 1 898 . 1 . 1 75 75 PRO CB C 13 31.562 0.3 . 1 . . . . A 320 PRO CB . 34673 1 899 . 1 . 1 75 75 PRO CG C 13 27.835 0.3 . 1 . . . . A 320 PRO CG . 34673 1 900 . 1 . 1 75 75 PRO CD C 13 51.364 0.3 . 1 . . . . A 320 PRO CD . 34673 1 901 . 1 . 1 76 76 MET H H 1 8.938 0.020 . 1 . . . . A 321 MET H . 34673 1 902 . 1 . 1 76 76 MET HA H 1 4.585 0.020 . 1 . . . . A 321 MET HA . 34673 1 903 . 1 . 1 76 76 MET HB2 H 1 2.378 0.020 . 2 . . . . A 321 MET HB2 . 34673 1 904 . 1 . 1 76 76 MET HB3 H 1 2.239 0.020 . 2 . . . . A 321 MET HB3 . 34673 1 905 . 1 . 1 76 76 MET HG2 H 1 2.761 0.020 . 2 . . . . A 321 MET HG2 . 34673 1 906 . 1 . 1 76 76 MET HG3 H 1 2.754 0.020 . 2 . . . . A 321 MET HG3 . 34673 1 907 . 1 . 1 76 76 MET HE1 H 1 2.044 0.020 . 1 . . . . A 321 MET HE1 . 34673 1 908 . 1 . 1 76 76 MET HE2 H 1 2.044 0.020 . 1 . . . . A 321 MET HE2 . 34673 1 909 . 1 . 1 76 76 MET HE3 H 1 2.044 0.020 . 1 . . . . A 321 MET HE3 . 34673 1 910 . 1 . 1 76 76 MET C C 13 176.089 0.3 . 1 . . . . A 321 MET C . 34673 1 911 . 1 . 1 76 76 MET CA C 13 56.189 0.3 . 1 . . . . A 321 MET CA . 34673 1 912 . 1 . 1 76 76 MET CB C 13 35.574 0.3 . 1 . . . . A 321 MET CB . 34673 1 913 . 1 . 1 76 76 MET CG C 13 31.282 0.3 . 1 . . . . A 321 MET CG . 34673 1 914 . 1 . 1 76 76 MET CE C 13 17.218 0.3 . 1 . . . . A 321 MET CE . 34673 1 915 . 1 . 1 76 76 MET N N 15 127.167 0.3 . 1 . . . . A 321 MET N . 34673 1 916 . 1 . 1 77 77 LYS H H 1 8.057 0.020 . 1 . . . . A 322 LYS H . 34673 1 917 . 1 . 1 77 77 LYS HA H 1 4.944 0.020 . 1 . . . . A 322 LYS HA . 34673 1 918 . 1 . 1 77 77 LYS HB2 H 1 1.858 0.020 . 2 . . . . A 322 LYS HB2 . 34673 1 919 . 1 . 1 77 77 LYS HB3 H 1 1.638 0.020 . 2 . . . . A 322 LYS HB3 . 34673 1 920 . 1 . 1 77 77 LYS HG2 H 1 1.088 0.020 . 1 . . . . A 322 LYS HG2 . 34673 1 921 . 1 . 1 77 77 LYS HG3 H 1 1.088 0.020 . 1 . . . . A 322 LYS HG3 . 34673 1 922 . 1 . 1 77 77 LYS HD2 H 1 1.513 0.020 . 2 . . . . A 322 LYS HD2 . 34673 1 923 . 1 . 1 77 77 LYS HD3 H 1 1.483 0.020 . 2 . . . . A 322 LYS HD3 . 34673 1 924 . 1 . 1 77 77 LYS HE2 H 1 3.056 0.020 . 1 . . . . A 322 LYS HE2 . 34673 1 925 . 1 . 1 77 77 LYS HE3 H 1 3.056 0.020 . 1 . . . . A 322 LYS HE3 . 34673 1 926 . 1 . 1 77 77 LYS C C 13 174.828 0.3 . 1 . . . . A 322 LYS C . 34673 1 927 . 1 . 1 77 77 LYS CA C 13 54.864 0.3 . 1 . . . . A 322 LYS CA . 34673 1 928 . 1 . 1 77 77 LYS CB C 13 34.259 0.3 . 1 . . . . A 322 LYS CB . 34673 1 929 . 1 . 1 77 77 LYS CG C 13 22.790 0.3 . 1 . . . . A 322 LYS CG . 34673 1 930 . 1 . 1 77 77 LYS CD C 13 25.137 0.3 . 1 . . . . A 322 LYS CD . 34673 1 931 . 1 . 1 77 77 LYS CE C 13 41.908 0.3 . 1 . . . . A 322 LYS CE . 34673 1 932 . 1 . 1 77 77 LYS N N 15 124.318 0.3 . 1 . . . . A 322 LYS N . 34673 1 933 . 1 . 1 78 78 VAL H H 1 8.380 0.020 . 1 . . . . A 323 VAL H . 34673 1 934 . 1 . 1 78 78 VAL HA H 1 5.373 0.020 . 1 . . . . A 323 VAL HA . 34673 1 935 . 1 . 1 78 78 VAL HB H 1 1.804 0.020 . 1 . . . . A 323 VAL HB . 34673 1 936 . 1 . 1 78 78 VAL HG11 H 1 1.130 0.020 . 2 . . . . A 323 VAL HG11 . 34673 1 937 . 1 . 1 78 78 VAL HG12 H 1 1.130 0.020 . 2 . . . . A 323 VAL HG12 . 34673 1 938 . 1 . 1 78 78 VAL HG13 H 1 1.130 0.020 . 2 . . . . A 323 VAL HG13 . 34673 1 939 . 1 . 1 78 78 VAL HG21 H 1 1.072 0.020 . 2 . . . . A 323 VAL HG21 . 34673 1 940 . 1 . 1 78 78 VAL HG22 H 1 1.072 0.020 . 2 . . . . A 323 VAL HG22 . 34673 1 941 . 1 . 1 78 78 VAL HG23 H 1 1.072 0.020 . 2 . . . . A 323 VAL HG23 . 34673 1 942 . 1 . 1 78 78 VAL C C 13 175.201 0.3 . 1 . . . . A 323 VAL C . 34673 1 943 . 1 . 1 78 78 VAL CA C 13 60.262 0.3 . 1 . . . . A 323 VAL CA . 34673 1 944 . 1 . 1 78 78 VAL CB C 13 34.363 0.3 . 1 . . . . A 323 VAL CB . 34673 1 945 . 1 . 1 78 78 VAL CG1 C 13 23.600 0.3 . 1 . . . . A 323 VAL CG1 . 34673 1 946 . 1 . 1 78 78 VAL CG2 C 13 22.588 0.3 . 1 . . . . A 323 VAL CG2 . 34673 1 947 . 1 . 1 78 78 VAL N N 15 123.545 0.3 . 1 . . . . A 323 VAL N . 34673 1 948 . 1 . 1 79 79 GLY H H 1 9.160 0.020 . 1 . . . . A 324 GLY H . 34673 1 949 . 1 . 1 79 79 GLY HA2 H 1 4.603 0.020 . 2 . . . . A 324 GLY HA2 . 34673 1 950 . 1 . 1 79 79 GLY HA3 H 1 3.939 0.020 . 2 . . . . A 324 GLY HA3 . 34673 1 951 . 1 . 1 79 79 GLY C C 13 171.978 0.3 . 1 . . . . A 324 GLY C . 34673 1 952 . 1 . 1 79 79 GLY CA C 13 44.926 0.3 . 1 . . . . A 324 GLY CA . 34673 1 953 . 1 . 1 79 79 GLY N N 15 111.884 0.3 . 1 . . . . A 324 GLY N . 34673 1 954 . 1 . 1 80 80 HIS H H 1 8.496 0.020 . 1 . . . . A 325 HIS H . 34673 1 955 . 1 . 1 80 80 HIS HA H 1 4.992 0.020 . 1 . . . . A 325 HIS HA . 34673 1 956 . 1 . 1 80 80 HIS HB2 H 1 3.243 0.020 . 2 . . . . A 325 HIS HB2 . 34673 1 957 . 1 . 1 80 80 HIS HB3 H 1 2.993 0.020 . 2 . . . . A 325 HIS HB3 . 34673 1 958 . 1 . 1 80 80 HIS HD2 H 1 7.087 0.020 . 1 . . . . A 325 HIS HD2 . 34673 1 959 . 1 . 1 80 80 HIS HE1 H 1 7.728 0.020 . 1 . . . . A 325 HIS HE1 . 34673 1 960 . 1 . 1 80 80 HIS C C 13 176.107 0.3 . 1 . . . . A 325 HIS C . 34673 1 961 . 1 . 1 80 80 HIS CA C 13 56.905 0.3 . 1 . . . . A 325 HIS CA . 34673 1 962 . 1 . 1 80 80 HIS CB C 13 31.796 0.3 . 1 . . . . A 325 HIS CB . 34673 1 963 . 1 . 1 80 80 HIS CD2 C 13 120.703 0.3 . 1 . . . . A 325 HIS CD2 . 34673 1 964 . 1 . 1 80 80 HIS CE1 C 13 138.117 0.3 . 1 . . . . A 325 HIS CE1 . 34673 1 965 . 1 . 1 80 80 HIS N N 15 117.437 0.3 . 1 . . . . A 325 HIS N . 34673 1 966 . 1 . 1 81 81 VAL H H 1 8.730 0.020 . 1 . . . . A 326 VAL H . 34673 1 967 . 1 . 1 81 81 VAL HA H 1 4.670 0.020 . 1 . . . . A 326 VAL HA . 34673 1 968 . 1 . 1 81 81 VAL HB H 1 2.285 0.020 . 1 . . . . A 326 VAL HB . 34673 1 969 . 1 . 1 81 81 VAL HG11 H 1 1.130 0.020 . 2 . . . . A 326 VAL HG11 . 34673 1 970 . 1 . 1 81 81 VAL HG12 H 1 1.130 0.020 . 2 . . . . A 326 VAL HG12 . 34673 1 971 . 1 . 1 81 81 VAL HG13 H 1 1.130 0.020 . 2 . . . . A 326 VAL HG13 . 34673 1 972 . 1 . 1 81 81 VAL HG21 H 1 1.088 0.020 . 2 . . . . A 326 VAL HG21 . 34673 1 973 . 1 . 1 81 81 VAL HG22 H 1 1.088 0.020 . 2 . . . . A 326 VAL HG22 . 34673 1 974 . 1 . 1 81 81 VAL HG23 H 1 1.088 0.020 . 2 . . . . A 326 VAL HG23 . 34673 1 975 . 1 . 1 81 81 VAL C C 13 175.964 0.3 . 1 . . . . A 326 VAL C . 34673 1 976 . 1 . 1 81 81 VAL CA C 13 61.751 0.3 . 1 . . . . A 326 VAL CA . 34673 1 977 . 1 . 1 81 81 VAL CB C 13 32.081 0.3 . 1 . . . . A 326 VAL CB . 34673 1 978 . 1 . 1 81 81 VAL CG1 C 13 21.554 0.3 . 1 . . . . A 326 VAL CG1 . 34673 1 979 . 1 . 1 81 81 VAL CG2 C 13 22.302 0.3 . 1 . . . . A 326 VAL CG2 . 34673 1 980 . 1 . 1 81 81 VAL N N 15 119.443 0.3 . 1 . . . . A 326 VAL N . 34673 1 981 . 1 . 1 82 82 THR H H 1 8.188 0.020 . 1 . . . . A 327 THR H . 34673 1 982 . 1 . 1 82 82 THR HA H 1 4.342 0.020 . 1 . . . . A 327 THR HA . 34673 1 983 . 1 . 1 82 82 THR HB H 1 4.176 0.020 . 1 . . . . A 327 THR HB . 34673 1 984 . 1 . 1 82 82 THR HG21 H 1 1.124 0.020 . 1 . . . . A 327 THR HG21 . 34673 1 985 . 1 . 1 82 82 THR HG22 H 1 1.124 0.020 . 1 . . . . A 327 THR HG22 . 34673 1 986 . 1 . 1 82 82 THR HG23 H 1 1.124 0.020 . 1 . . . . A 327 THR HG23 . 34673 1 987 . 1 . 1 82 82 THR CA C 13 61.477 0.3 . 1 . . . . A 327 THR CA . 34673 1 988 . 1 . 1 82 82 THR CB C 13 69.744 0.3 . 1 . . . . A 327 THR CB . 34673 1 989 . 1 . 1 82 82 THR CG2 C 13 21.715 0.3 . 1 . . . . A 327 THR CG2 . 34673 1 990 . 1 . 1 82 82 THR N N 15 119.005 0.3 . 1 . . . . A 327 THR N . 34673 1 991 . 1 . 1 83 83 GLU H H 1 8.498 0.020 . 1 . . . . A 328 GLU H . 34673 1 992 . 1 . 1 83 83 GLU HA H 1 4.394 0.020 . 1 . . . . A 328 GLU HA . 34673 1 993 . 1 . 1 83 83 GLU HB2 H 1 2.048 0.020 . 2 . . . . A 328 GLU HB2 . 34673 1 994 . 1 . 1 83 83 GLU HB3 H 1 1.947 0.020 . 2 . . . . A 328 GLU HB3 . 34673 1 995 . 1 . 1 83 83 GLU HG2 H 1 2.250 0.020 . 1 . . . . A 328 GLU HG2 . 34673 1 996 . 1 . 1 83 83 GLU HG3 H 1 2.250 0.020 . 1 . . . . A 328 GLU HG3 . 34673 1 997 . 1 . 1 83 83 GLU CA C 13 56.018 0.3 . 1 . . . . A 328 GLU CA . 34673 1 998 . 1 . 1 83 83 GLU CB C 13 30.234 0.3 . 1 . . . . A 328 GLU CB . 34673 1 999 . 1 . 1 83 83 GLU CG C 13 36.115 0.3 . 1 . . . . A 328 GLU CG . 34673 1 1000 . 1 . 1 83 83 GLU N N 15 124.250 0.3 . 1 . . . . A 328 GLU N . 34673 1 1001 . 1 . 1 84 84 ARG H H 1 8.415 0.020 . 1 . . . . A 329 ARG H . 34673 1 1002 . 1 . 1 84 84 ARG HA H 1 4.347 0.020 . 1 . . . . A 329 ARG HA . 34673 1 1003 . 1 . 1 84 84 ARG HB2 H 1 1.740 0.020 . 2 . . . . A 329 ARG HB2 . 34673 1 1004 . 1 . 1 84 84 ARG HB3 H 1 1.874 0.020 . 2 . . . . A 329 ARG HB3 . 34673 1 1005 . 1 . 1 84 84 ARG HG2 H 1 1.486 0.020 . 1 . . . . A 329 ARG HG2 . 34673 1 1006 . 1 . 1 84 84 ARG HG3 H 1 1.486 0.020 . 1 . . . . A 329 ARG HG3 . 34673 1 1007 . 1 . 1 84 84 ARG HD2 H 1 3.037 0.020 . 1 . . . . A 329 ARG HD2 . 34673 1 1008 . 1 . 1 84 84 ARG HD3 H 1 3.037 0.020 . 1 . . . . A 329 ARG HD3 . 34673 1 1009 . 1 . 1 84 84 ARG C C 13 176.693 0.3 . 1 . . . . A 329 ARG C . 34673 1 1010 . 1 . 1 84 84 ARG CA C 13 56.468 0.3 . 1 . . . . A 329 ARG CA . 34673 1 1011 . 1 . 1 84 84 ARG CB C 13 31.280 0.3 . 1 . . . . A 329 ARG CB . 34673 1 1012 . 1 . 1 84 84 ARG CG C 13 26.909 0.3 . 1 . . . . A 329 ARG CG . 34673 1 1013 . 1 . 1 84 84 ARG CD C 13 43.346 0.3 . 1 . . . . A 329 ARG CD . 34673 1 1014 . 1 . 1 84 84 ARG N N 15 122.806 0.3 . 1 . . . . A 329 ARG N . 34673 1 1015 . 1 . 1 85 85 THR H H 1 8.315 0.020 . 1 . . . . A 330 THR H . 34673 1 1016 . 1 . 1 85 85 THR HA H 1 4.324 0.020 . 1 . . . . A 330 THR HA . 34673 1 1017 . 1 . 1 85 85 THR HB H 1 4.265 0.020 . 1 . . . . A 330 THR HB . 34673 1 1018 . 1 . 1 85 85 THR HG21 H 1 1.198 0.020 . 1 . . . . A 330 THR HG21 . 34673 1 1019 . 1 . 1 85 85 THR HG22 H 1 1.198 0.020 . 1 . . . . A 330 THR HG22 . 34673 1 1020 . 1 . 1 85 85 THR HG23 H 1 1.198 0.020 . 1 . . . . A 330 THR HG23 . 34673 1 1021 . 1 . 1 85 85 THR CA C 13 62.019 0.3 . 1 . . . . A 330 THR CA . 34673 1 1022 . 1 . 1 85 85 THR CB C 13 69.547 0.3 . 1 . . . . A 330 THR CB . 34673 1 1023 . 1 . 1 85 85 THR CG2 C 13 21.490 0.3 . 1 . . . . A 330 THR CG2 . 34673 1 1024 . 1 . 1 85 85 THR N N 15 115.308 0.3 . 1 . . . . A 330 THR N . 34673 1 1025 . 1 . 1 86 86 ASP H H 1 8.246 0.020 . 1 . . . . A 331 ASP H . 34673 1 1026 . 1 . 1 86 86 ASP HA H 1 4.584 0.020 . 1 . . . . A 331 ASP HA . 34673 1 1027 . 1 . 1 86 86 ASP HB2 H 1 2.682 0.020 . 1 . . . . A 331 ASP HB2 . 34673 1 1028 . 1 . 1 86 86 ASP HB3 H 1 2.682 0.020 . 1 . . . . A 331 ASP HB3 . 34673 1 1029 . 1 . 1 86 86 ASP CA C 13 54.082 0.3 . 1 . . . . A 331 ASP CA . 34673 1 1030 . 1 . 1 86 86 ASP CB C 13 41.040 0.3 . 1 . . . . A 331 ASP CB . 34673 1 1031 . 1 . 1 86 86 ASP N N 15 122.214 0.3 . 1 . . . . A 331 ASP N . 34673 1 1032 . 1 . 1 87 87 ALA H H 1 8.001 0.020 . 1 . . . . A 332 ALA H . 34673 1 1033 . 1 . 1 87 87 ALA HA H 1 4.255 0.020 . 1 . . . . A 332 ALA HA . 34673 1 1034 . 1 . 1 87 87 ALA HB1 H 1 1.389 0.020 . 1 . . . . A 332 ALA HB1 . 34673 1 1035 . 1 . 1 87 87 ALA HB2 H 1 1.389 0.020 . 1 . . . . A 332 ALA HB2 . 34673 1 1036 . 1 . 1 87 87 ALA HB3 H 1 1.389 0.020 . 1 . . . . A 332 ALA HB3 . 34673 1 1037 . 1 . 1 87 87 ALA CA C 13 52.073 0.3 . 1 . . . . A 332 ALA CA . 34673 1 1038 . 1 . 1 87 87 ALA CB C 13 19.121 0.3 . 1 . . . . A 332 ALA CB . 34673 1 1039 . 1 . 1 87 87 ALA N N 15 123.552 0.3 . 1 . . . . A 332 ALA N . 34673 1 1040 . 2 . 2 1 1 A H1' H 1 6.024 0.020 . 1 . . . . B 701 A H1' . 34673 1 1041 . 2 . 2 1 1 A H2 H 1 8.165 0.020 . 1 . . . . B 701 A H2 . 34673 1 1042 . 2 . 2 1 1 A H2' H 1 4.839 0.020 . 1 . . . . B 701 A H2' . 34673 1 1043 . 2 . 2 1 1 A H3' H 1 4.763 0.020 . 1 . . . . B 701 A H3' . 34673 1 1044 . 2 . 2 1 1 A H4' H 1 4.441 0.020 . 1 . . . . B 701 A H4' . 34673 1 1045 . 2 . 2 1 1 A H5' H 1 3.882 0.020 . 1 . . . . B 701 A H5' . 34673 1 1046 . 2 . 2 1 1 A H5'' H 1 3.882 0.020 . 1 . . . . B 701 A H5'' . 34673 1 1047 . 2 . 2 1 1 A H8 H 1 8.297 0.020 . 1 . . . . B 701 A H8 . 34673 1 1048 . 2 . 2 2 2 G H1' H 1 5.870 0.020 . 1 . . . . B 702 G H1' . 34673 1 1049 . 2 . 2 2 2 G H2' H 1 4.833 0.020 . 1 . . . . B 702 G H2' . 34673 1 1050 . 2 . 2 2 2 G H3' H 1 4.588 0.020 . 1 . . . . B 702 G H3' . 34673 1 1051 . 2 . 2 2 2 G H4' H 1 4.442 0.020 . 1 . . . . B 702 G H4' . 34673 1 1052 . 2 . 2 2 2 G H5' H 1 4.338 0.020 . 2 . . . . B 702 G H5' . 34673 1 1053 . 2 . 2 2 2 G H5'' H 1 4.232 0.020 . 2 . . . . B 702 G H5'' . 34673 1 1054 . 2 . 2 2 2 G H8 H 1 8.032 0.020 . 1 . . . . B 702 G H8 . 34673 1 1055 . 2 . 2 3 3 C H1' H 1 5.988 0.020 . 1 . . . . B 703 C H1' . 34673 1 1056 . 2 . 2 3 3 C H2' H 1 4.654 0.020 . 1 . . . . B 703 C H2' . 34673 1 1057 . 2 . 2 3 3 C H3' H 1 4.402 0.020 . 1 . . . . B 703 C H3' . 34673 1 1058 . 2 . 2 3 3 C H4' H 1 4.474 0.020 . 1 . . . . B 703 C H4' . 34673 1 1059 . 2 . 2 3 3 C H5 H 1 5.896 0.020 . 1 . . . . B 703 C H5 . 34673 1 1060 . 2 . 2 3 3 C H5' H 1 4.224 0.020 . 2 . . . . B 703 C H5' . 34673 1 1061 . 2 . 2 3 3 C H5'' H 1 4.116 0.020 . 2 . . . . B 703 C H5'' . 34673 1 1062 . 2 . 2 3 3 C H6 H 1 7.828 0.020 . 1 . . . . B 703 C H6 . 34673 1 1063 . 2 . 2 4 4 U H1' H 1 6.050 0.020 . 1 . . . . B 704 U H1' . 34673 1 1064 . 2 . 2 4 4 U H2' H 1 4.730 0.020 . 1 . . . . B 704 U H2' . 34673 1 1065 . 2 . 2 4 4 U H3' H 1 4.418 0.020 . 1 . . . . B 704 U H3' . 34673 1 1066 . 2 . 2 4 4 U H4' H 1 4.232 0.020 . 1 . . . . B 704 U H4' . 34673 1 1067 . 2 . 2 4 4 U H5 H 1 5.744 0.020 . 1 . . . . B 704 U H5 . 34673 1 1068 . 2 . 2 4 4 U H5' H 1 4.108 0.020 . 2 . . . . B 704 U H5' . 34673 1 1069 . 2 . 2 4 4 U H5'' H 1 3.946 0.020 . 2 . . . . B 704 U H5'' . 34673 1 1070 . 2 . 2 4 4 U H6 H 1 7.774 0.020 . 1 . . . . B 704 U H6 . 34673 1 1071 . 2 . 2 5 5 U H1' H 1 6.022 0.020 . 1 . . . . B 705 U H1' . 34673 1 1072 . 2 . 2 5 5 U H5 H 1 5.784 0.020 . 1 . . . . B 705 U H5 . 34673 1 1073 . 2 . 2 5 5 U H6 H 1 7.760 0.020 . 1 . . . . B 705 U H6 . 34673 1 1074 . 2 . 2 6 6 U H1' H 1 6.034 0.020 . 1 . . . . B 706 U H1' . 34673 1 1075 . 2 . 2 6 6 U H2' H 1 4.685 0.020 . 1 . . . . B 706 U H2' . 34673 1 1076 . 2 . 2 6 6 U H3' H 1 4.344 0.020 . 1 . . . . B 706 U H3' . 34673 1 1077 . 2 . 2 6 6 U H5 H 1 5.628 0.020 . 1 . . . . B 706 U H5 . 34673 1 1078 . 2 . 2 6 6 U H6 H 1 7.621 0.020 . 1 . . . . B 706 U H6 . 34673 1 1079 . 2 . 2 7 7 G H1' H 1 5.910 0.020 . 1 . . . . B 707 G H1' . 34673 1 1080 . 2 . 2 7 7 G H2' H 1 4.873 0.020 . 1 . . . . B 707 G H2' . 34673 1 1081 . 2 . 2 7 7 G H3' H 1 4.544 0.020 . 1 . . . . B 707 G H3' . 34673 1 1082 . 2 . 2 7 7 G H4' H 1 4.431 0.020 . 1 . . . . B 707 G H4' . 34673 1 1083 . 2 . 2 7 7 G H5' H 1 4.362 0.020 . 2 . . . . B 707 G H5' . 34673 1 1084 . 2 . 2 7 7 G H5'' H 1 4.197 0.020 . 2 . . . . B 707 G H5'' . 34673 1 1085 . 2 . 2 7 7 G H8 H 1 7.962 0.020 . 1 . . . . B 707 G H8 . 34673 1 stop_ save_