data_51485 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 51485 _Entry.Title ; Chemical shift assignments of the C-terminal domain of AKAP5 (AKAP79), residues 300-427 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2022-06-09 _Entry.Accession_date 2022-06-09 _Entry.Last_release_date 2022-06-09 _Entry.Original_release_date 2022-06-09 _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 _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 Matthew Watson . . . . 51485 2 Teresa Almeida . B. . . 51485 3 Arundhati Ray . . . . 51485 4 Christina Hanack . . . . 51485 5 Rory Elston . . . . 51485 6 Joan Btesh . . . . 51485 7 Peter McNaughton . A. . . 51485 8 Katherine Stott . . . . 51485 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 51485 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '15N chemical shifts' 125 51485 '1H chemical shifts' 125 51485 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 . . 2022-10-10 2022-03-01 update BMRB 'update entry citation' 51485 1 . . 2022-06-14 2022-03-01 original author 'original release' 51485 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 51485 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 35697294 _Citation.DOI 10.1016/j.jmb.2022.167682 _Citation.Full_citation . _Citation.Title ; Hidden Multivalency in Phosphatase Recruitment by a Disordered AKAP Scaffold ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full 'Journal of molecular biology' _Citation.Journal_volume 434 _Citation.Journal_issue 16 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1089-8638 _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 167682 _Citation.Page_last 167682 _Citation.Year 2022 _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 Matthew Watson . . . . 51485 1 2 Teresa Almeida . B. . . 51485 1 3 Arundhati Ray . . . . 51485 1 4 Christina Hanack . . . . 51485 1 5 Rory Elston . . . . 51485 1 6 Joan Btesh . . . . 51485 1 7 Peter McNaughton . A. . . 51485 1 8 Katherine Stott . . . . 51485 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'A-kinase anchoring protein (AKAP)' 51485 1 Calcineurin 51485 1 allovalency 51485 1 'intrinsically disordered protein' 51485 1 multivalency 51485 1 'short linear motif (SLiM)' 51485 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 51485 _Assembly.ID 1 _Assembly.Name 'AKAP5 (AKAP79)' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _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 'AKAP5 (AKAP79)' 1 $entity_1 . . yes native no no . . . 51485 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 51485 _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 . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSVAEETKPKDTELSQESDF KENGITEEKSKSEESKRMEP IAIIITDTEISEFDVTKSKN VPKQFLISAENEQVGVFAND NGFEDRTSEQYETLLIETAS SLVKNAIQLSIEQLVNEMAS DDNKINNLLQ ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq ; 298, G 299, S 300, V etc ; _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 130 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_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 1 298 GLY . 51485 1 2 299 SER . 51485 1 3 300 VAL . 51485 1 4 301 ALA . 51485 1 5 302 GLU . 51485 1 6 303 GLU . 51485 1 7 304 THR . 51485 1 8 305 LYS . 51485 1 9 306 PRO . 51485 1 10 307 LYS . 51485 1 11 308 ASP . 51485 1 12 309 THR . 51485 1 13 310 GLU . 51485 1 14 311 LEU . 51485 1 15 312 SER . 51485 1 16 313 GLN . 51485 1 17 314 GLU . 51485 1 18 315 SER . 51485 1 19 316 ASP . 51485 1 20 317 PHE . 51485 1 21 318 LYS . 51485 1 22 319 GLU . 51485 1 23 320 ASN . 51485 1 24 321 GLY . 51485 1 25 322 ILE . 51485 1 26 323 THR . 51485 1 27 324 GLU . 51485 1 28 325 GLU . 51485 1 29 326 LYS . 51485 1 30 327 SER . 51485 1 31 328 LYS . 51485 1 32 329 SER . 51485 1 33 330 GLU . 51485 1 34 331 GLU . 51485 1 35 332 SER . 51485 1 36 333 LYS . 51485 1 37 334 ARG . 51485 1 38 335 MET . 51485 1 39 336 GLU . 51485 1 40 337 PRO . 51485 1 41 338 ILE . 51485 1 42 339 ALA . 51485 1 43 340 ILE . 51485 1 44 341 ILE . 51485 1 45 342 ILE . 51485 1 46 343 THR . 51485 1 47 344 ASP . 51485 1 48 345 THR . 51485 1 49 346 GLU . 51485 1 50 347 ILE . 51485 1 51 348 SER . 51485 1 52 349 GLU . 51485 1 53 350 PHE . 51485 1 54 351 ASP . 51485 1 55 352 VAL . 51485 1 56 353 THR . 51485 1 57 354 LYS . 51485 1 58 355 SER . 51485 1 59 356 LYS . 51485 1 60 357 ASN . 51485 1 61 358 VAL . 51485 1 62 359 PRO . 51485 1 63 360 LYS . 51485 1 64 361 GLN . 51485 1 65 362 PHE . 51485 1 66 363 LEU . 51485 1 67 364 ILE . 51485 1 68 365 SER . 51485 1 69 366 ALA . 51485 1 70 367 GLU . 51485 1 71 368 ASN . 51485 1 72 369 GLU . 51485 1 73 370 GLN . 51485 1 74 371 VAL . 51485 1 75 372 GLY . 51485 1 76 373 VAL . 51485 1 77 374 PHE . 51485 1 78 375 ALA . 51485 1 79 376 ASN . 51485 1 80 377 ASP . 51485 1 81 378 ASN . 51485 1 82 379 GLY . 51485 1 83 380 PHE . 51485 1 84 381 GLU . 51485 1 85 382 ASP . 51485 1 86 383 ARG . 51485 1 87 384 THR . 51485 1 88 385 SER . 51485 1 89 386 GLU . 51485 1 90 387 GLN . 51485 1 91 388 TYR . 51485 1 92 389 GLU . 51485 1 93 390 THR . 51485 1 94 391 LEU . 51485 1 95 392 LEU . 51485 1 96 393 ILE . 51485 1 97 394 GLU . 51485 1 98 395 THR . 51485 1 99 396 ALA . 51485 1 100 397 SER . 51485 1 101 398 SER . 51485 1 102 399 LEU . 51485 1 103 400 VAL . 51485 1 104 401 LYS . 51485 1 105 402 ASN . 51485 1 106 403 ALA . 51485 1 107 404 ILE . 51485 1 108 405 GLN . 51485 1 109 406 LEU . 51485 1 110 407 SER . 51485 1 111 408 ILE . 51485 1 112 409 GLU . 51485 1 113 410 GLN . 51485 1 114 411 LEU . 51485 1 115 412 VAL . 51485 1 116 413 ASN . 51485 1 117 414 GLU . 51485 1 118 415 MET . 51485 1 119 416 ALA . 51485 1 120 417 SER . 51485 1 121 418 ASP . 51485 1 122 419 ASP . 51485 1 123 420 ASN . 51485 1 124 421 LYS . 51485 1 125 422 ILE . 51485 1 126 423 ASN . 51485 1 127 424 ASN . 51485 1 128 425 LEU . 51485 1 129 426 LEU . 51485 1 130 427 GLN . 51485 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 51485 1 . SER 2 2 51485 1 . VAL 3 3 51485 1 . ALA 4 4 51485 1 . GLU 5 5 51485 1 . GLU 6 6 51485 1 . THR 7 7 51485 1 . LYS 8 8 51485 1 . PRO 9 9 51485 1 . LYS 10 10 51485 1 . ASP 11 11 51485 1 . THR 12 12 51485 1 . GLU 13 13 51485 1 . LEU 14 14 51485 1 . SER 15 15 51485 1 . GLN 16 16 51485 1 . GLU 17 17 51485 1 . SER 18 18 51485 1 . ASP 19 19 51485 1 . PHE 20 20 51485 1 . LYS 21 21 51485 1 . GLU 22 22 51485 1 . ASN 23 23 51485 1 . GLY 24 24 51485 1 . ILE 25 25 51485 1 . THR 26 26 51485 1 . GLU 27 27 51485 1 . GLU 28 28 51485 1 . LYS 29 29 51485 1 . SER 30 30 51485 1 . LYS 31 31 51485 1 . SER 32 32 51485 1 . GLU 33 33 51485 1 . GLU 34 34 51485 1 . SER 35 35 51485 1 . LYS 36 36 51485 1 . ARG 37 37 51485 1 . MET 38 38 51485 1 . GLU 39 39 51485 1 . PRO 40 40 51485 1 . ILE 41 41 51485 1 . ALA 42 42 51485 1 . ILE 43 43 51485 1 . ILE 44 44 51485 1 . ILE 45 45 51485 1 . THR 46 46 51485 1 . ASP 47 47 51485 1 . THR 48 48 51485 1 . GLU 49 49 51485 1 . ILE 50 50 51485 1 . SER 51 51 51485 1 . GLU 52 52 51485 1 . PHE 53 53 51485 1 . ASP 54 54 51485 1 . VAL 55 55 51485 1 . THR 56 56 51485 1 . LYS 57 57 51485 1 . SER 58 58 51485 1 . LYS 59 59 51485 1 . ASN 60 60 51485 1 . VAL 61 61 51485 1 . PRO 62 62 51485 1 . LYS 63 63 51485 1 . GLN 64 64 51485 1 . PHE 65 65 51485 1 . LEU 66 66 51485 1 . ILE 67 67 51485 1 . SER 68 68 51485 1 . ALA 69 69 51485 1 . GLU 70 70 51485 1 . ASN 71 71 51485 1 . GLU 72 72 51485 1 . GLN 73 73 51485 1 . VAL 74 74 51485 1 . GLY 75 75 51485 1 . VAL 76 76 51485 1 . PHE 77 77 51485 1 . ALA 78 78 51485 1 . ASN 79 79 51485 1 . ASP 80 80 51485 1 . ASN 81 81 51485 1 . GLY 82 82 51485 1 . PHE 83 83 51485 1 . GLU 84 84 51485 1 . ASP 85 85 51485 1 . ARG 86 86 51485 1 . THR 87 87 51485 1 . SER 88 88 51485 1 . GLU 89 89 51485 1 . GLN 90 90 51485 1 . TYR 91 91 51485 1 . GLU 92 92 51485 1 . THR 93 93 51485 1 . LEU 94 94 51485 1 . LEU 95 95 51485 1 . ILE 96 96 51485 1 . GLU 97 97 51485 1 . THR 98 98 51485 1 . ALA 99 99 51485 1 . SER 100 100 51485 1 . SER 101 101 51485 1 . LEU 102 102 51485 1 . VAL 103 103 51485 1 . LYS 104 104 51485 1 . ASN 105 105 51485 1 . ALA 106 106 51485 1 . ILE 107 107 51485 1 . GLN 108 108 51485 1 . LEU 109 109 51485 1 . SER 110 110 51485 1 . ILE 111 111 51485 1 . GLU 112 112 51485 1 . GLN 113 113 51485 1 . LEU 114 114 51485 1 . VAL 115 115 51485 1 . ASN 116 116 51485 1 . GLU 117 117 51485 1 . MET 118 118 51485 1 . ALA 119 119 51485 1 . SER 120 120 51485 1 . ASP 121 121 51485 1 . ASP 122 122 51485 1 . ASN 123 123 51485 1 . LYS 124 124 51485 1 . ILE 125 125 51485 1 . ASN 126 126 51485 1 . ASN 127 127 51485 1 . LEU 128 128 51485 1 . LEU 129 129 51485 1 . GLN 130 130 51485 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 51485 _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 . . . . . . . . . . . . . 51485 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 51485 _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' . . . Escherichia coli . . . plasmid . . 'pHAT3 AKAP5c' . . . 51485 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 51485 _Sample.ID 1 _Sample.Name 15N-AKAP5 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _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 'AKAP5 (AKAP79)' '[U-98% 15N]' . . 1 $entity_1 . . 50-100 . . uM . . . . 51485 1 2 PIPES 'natural abundance' . . . . . . 10 . . mM . . . . 51485 1 3 NaCl 'natural abundance' . . . . . . 150 . . mM . . . . 51485 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 51485 _Sample_condition_list.ID 1 _Sample_condition_list.Name Standard _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.16 . M 51485 1 pH 6.5 . pH 51485 1 pressure 1 . atm 51485 1 temperature 298 . K 51485 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 51485 _Software.ID 1 _Software.Type . _Software.Name AZARA _Software.Version 2.7 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 51485 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 51485 _Software.ID 2 _Software.Type . _Software.Name ANALYSIS _Software.Version 2.4 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 51485 2 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 51485 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name DRX800 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 51485 _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 no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51485 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 51485 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name 15N-AKAP5 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 51485 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 51485 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 51485 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 15N-AKAP5 _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' . . . 51485 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 2 $software_2 . . 51485 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 3 3 VAL H H 1 8.326 0.000 . 1 . . . . . 300 V HN . 51485 1 2 . 1 . 1 3 3 VAL N N 15 121.559 0.000 . 1 . . . . . 300 V N . 51485 1 3 . 1 . 1 4 4 ALA H H 1 8.421 0.000 . 1 . . . . . 301 A HN . 51485 1 4 . 1 . 1 4 4 ALA N N 15 127.190 0.000 . 1 . . . . . 301 A N . 51485 1 5 . 1 . 1 5 5 GLU H H 1 8.317 0.000 . 1 . . . . . 302 E HN . 51485 1 6 . 1 . 1 5 5 GLU N N 15 119.911 0.000 . 1 . . . . . 302 E N . 51485 1 7 . 1 . 1 6 6 GLU H H 1 8.454 0.000 . 1 . . . . . 303 E HN . 51485 1 8 . 1 . 1 6 6 GLU N N 15 121.650 0.000 . 1 . . . . . 303 E N . 51485 1 9 . 1 . 1 7 7 THR H H 1 8.223 0.000 . 1 . . . . . 304 T HN . 51485 1 10 . 1 . 1 7 7 THR N N 15 115.553 0.000 . 1 . . . . . 304 T N . 51485 1 11 . 1 . 1 8 8 LYS H H 1 8.310 0.000 . 1 . . . . . 305 K HN . 51485 1 12 . 1 . 1 8 8 LYS N N 15 125.276 0.000 . 1 . . . . . 305 K N . 51485 1 13 . 1 . 1 10 10 LYS H H 1 8.504 0.000 . 1 . . . . . 307 K HN . 51485 1 14 . 1 . 1 10 10 LYS N N 15 121.588 0.000 . 1 . . . . . 307 K N . 51485 1 15 . 1 . 1 11 11 ASP H H 1 8.449 0.000 . 1 . . . . . 308 D HN . 51485 1 16 . 1 . 1 11 11 ASP N N 15 121.280 0.000 . 1 . . . . . 308 D N . 51485 1 17 . 1 . 1 12 12 THR H H 1 8.084 0.000 . 1 . . . . . 309 T HN . 51485 1 18 . 1 . 1 12 12 THR N N 15 113.403 0.000 . 1 . . . . . 309 T N . 51485 1 19 . 1 . 1 13 13 GLU H H 1 8.422 0.000 . 1 . . . . . 310 E HN . 51485 1 20 . 1 . 1 13 13 GLU N N 15 122.806 0.000 . 1 . . . . . 310 E N . 51485 1 21 . 1 . 1 14 14 LEU H H 1 8.228 0.000 . 1 . . . . . 311 L HN . 51485 1 22 . 1 . 1 14 14 LEU N N 15 122.609 0.000 . 1 . . . . . 311 L N . 51485 1 23 . 1 . 1 15 15 SER H H 1 8.333 0.000 . 1 . . . . . 312 S HN . 51485 1 24 . 1 . 1 15 15 SER N N 15 116.461 0.000 . 1 . . . . . 312 S N . 51485 1 25 . 1 . 1 16 16 GLN H H 1 8.473 0.000 . 1 . . . . . 313 Q HN . 51485 1 26 . 1 . 1 16 16 GLN N N 15 122.016 0.000 . 1 . . . . . 313 Q N . 51485 1 27 . 1 . 1 17 17 GLU H H 1 8.485 0.000 . 1 . . . . . 314 E HN . 51485 1 28 . 1 . 1 17 17 GLU N N 15 121.651 0.000 . 1 . . . . . 314 E N . 51485 1 29 . 1 . 1 18 18 SER H H 1 8.340 0.000 . 1 . . . . . 315 S HN . 51485 1 30 . 1 . 1 18 18 SER N N 15 115.983 0.000 . 1 . . . . . 315 S N . 51485 1 31 . 1 . 1 19 19 ASP H H 1 8.322 0.000 . 1 . . . . . 316 D HN . 51485 1 32 . 1 . 1 19 19 ASP N N 15 122.006 0.000 . 1 . . . . . 316 D N . 51485 1 33 . 1 . 1 20 20 PHE H H 1 8.133 0.000 . 1 . . . . . 317 F HN . 51485 1 34 . 1 . 1 20 20 PHE N N 15 120.263 0.000 . 1 . . . . . 317 F N . 51485 1 35 . 1 . 1 21 21 LYS H H 1 8.095 0.000 . 1 . . . . . 318 K HN . 51485 1 36 . 1 . 1 21 21 LYS N N 15 123.163 0.000 . 1 . . . . . 318 K N . 51485 1 37 . 1 . 1 22 22 GLU H H 1 8.372 0.000 . 1 . . . . . 319 E HN . 51485 1 38 . 1 . 1 22 22 GLU N N 15 121.575 0.000 . 1 . . . . . 319 E N . 51485 1 39 . 1 . 1 23 23 ASN H H 1 8.481 0.000 . 1 . . . . . 320 N HN . 51485 1 40 . 1 . 1 23 23 ASN N N 15 119.256 0.000 . 1 . . . . . 320 N N . 51485 1 41 . 1 . 1 24 24 GLY H H 1 8.389 0.000 . 1 . . . . . 321 G HN . 51485 1 42 . 1 . 1 24 24 GLY N N 15 108.959 0.000 . 1 . . . . . 321 G N . 51485 1 43 . 1 . 1 25 25 ILE H H 1 8.043 0.000 . 1 . . . . . 322 I HN . 51485 1 44 . 1 . 1 25 25 ILE N N 15 119.962 0.000 . 1 . . . . . 322 I N . 51485 1 45 . 1 . 1 26 26 THR H H 1 8.274 0.000 . 1 . . . . . 323 T HN . 51485 1 46 . 1 . 1 26 26 THR N N 15 118.441 0.000 . 1 . . . . . 323 T N . 51485 1 47 . 1 . 1 27 27 GLU H H 1 8.480 0.000 . 1 . . . . . 324 E HN . 51485 1 48 . 1 . 1 27 27 GLU N N 15 123.541 0.000 . 1 . . . . . 324 E N . 51485 1 49 . 1 . 1 28 28 GLU H H 1 8.522 0.000 . 1 . . . . . 325 E HN . 51485 1 50 . 1 . 1 28 28 GLU N N 15 122.549 0.000 . 1 . . . . . 325 E N . 51485 1 51 . 1 . 1 29 29 LYS H H 1 8.406 0.000 . 1 . . . . . 326 K HN . 51485 1 52 . 1 . 1 29 29 LYS N N 15 122.440 0.000 . 1 . . . . . 326 K N . 51485 1 53 . 1 . 1 30 30 SER H H 1 8.387 0.000 . 1 . . . . . 327 S HN . 51485 1 54 . 1 . 1 30 30 SER N N 15 116.454 0.000 . 1 . . . . . 327 S N . 51485 1 55 . 1 . 1 31 31 LYS H H 1 8.364 0.000 . 1 . . . . . 328 K HN . 51485 1 56 . 1 . 1 31 31 LYS N N 15 122.982 0.000 . 1 . . . . . 328 K N . 51485 1 57 . 1 . 1 32 32 SER H H 1 8.345 0.000 . 1 . . . . . 329 S HN . 51485 1 58 . 1 . 1 32 32 SER N N 15 116.635 0.000 . 1 . . . . . 329 S N . 51485 1 59 . 1 . 1 33 33 GLU H H 1 8.500 0.000 . 1 . . . . . 330 E HN . 51485 1 60 . 1 . 1 33 33 GLU N N 15 122.505 0.000 . 1 . . . . . 330 E N . 51485 1 61 . 1 . 1 34 34 GLU H H 1 8.427 0.000 . 1 . . . . . 331 E HN . 51485 1 62 . 1 . 1 34 34 GLU N N 15 121.238 0.000 . 1 . . . . . 331 E N . 51485 1 63 . 1 . 1 35 35 SER H H 1 8.289 0.000 . 1 . . . . . 332 S HN . 51485 1 64 . 1 . 1 35 35 SER N N 15 116.188 0.000 . 1 . . . . . 332 S N . 51485 1 65 . 1 . 1 36 36 LYS H H 1 8.179 0.000 . 1 . . . . . 333 K HN . 51485 1 66 . 1 . 1 36 36 LYS N N 15 122.670 0.000 . 1 . . . . . 333 K N . 51485 1 67 . 1 . 1 37 37 ARG H H 1 8.218 0.000 . 1 . . . . . 334 R HN . 51485 1 68 . 1 . 1 37 37 ARG N N 15 121.699 0.000 . 1 . . . . . 334 R N . 51485 1 69 . 1 . 1 38 38 MET H H 1 8.388 0.000 . 1 . . . . . 335 M HN . 51485 1 70 . 1 . 1 38 38 MET N N 15 121.690 0.000 . 1 . . . . . 335 M N . 51485 1 71 . 1 . 1 39 39 GLU H H 1 8.340 0.000 . 1 . . . . . 336 E HN . 51485 1 72 . 1 . 1 39 39 GLU N N 15 123.527 0.000 . 1 . . . . . 336 E N . 51485 1 73 . 1 . 1 41 41 ILE H H 1 8.189 0.000 . 1 . . . . . 338 I HN . 51485 1 74 . 1 . 1 41 41 ILE N N 15 120.868 0.000 . 1 . . . . . 338 I N . 51485 1 75 . 1 . 1 42 42 ALA H H 1 8.330 0.000 . 1 . . . . . 339 A HN . 51485 1 76 . 1 . 1 42 42 ALA N N 15 128.204 0.000 . 1 . . . . . 339 A N . 51485 1 77 . 1 . 1 43 43 ILE H H 1 8.140 0.000 . 1 . . . . . 340 I HN . 51485 1 78 . 1 . 1 43 43 ILE N N 15 120.942 0.000 . 1 . . . . . 340 I N . 51485 1 79 . 1 . 1 44 44 ILE H H 1 8.299 0.000 . 1 . . . . . 341 I HN . 51485 1 80 . 1 . 1 44 44 ILE N N 15 126.141 0.000 . 1 . . . . . 341 I N . 51485 1 81 . 1 . 1 45 45 ILE H H 1 8.436 0.000 . 1 . . . . . 342 I HN . 51485 1 82 . 1 . 1 45 45 ILE N N 15 126.775 0.000 . 1 . . . . . 342 I N . 51485 1 83 . 1 . 1 46 46 THR H H 1 8.316 0.000 . 1 . . . . . 343 T HN . 51485 1 84 . 1 . 1 46 46 THR N N 15 118.614 0.000 . 1 . . . . . 343 T N . 51485 1 85 . 1 . 1 47 47 ASP H H 1 8.384 0.000 . 1 . . . . . 344 D HN . 51485 1 86 . 1 . 1 47 47 ASP N N 15 122.699 0.000 . 1 . . . . . 344 D N . 51485 1 87 . 1 . 1 48 48 THR H H 1 8.123 0.000 . 1 . . . . . 345 T HN . 51485 1 88 . 1 . 1 48 48 THR N N 15 113.888 0.000 . 1 . . . . . 345 T N . 51485 1 89 . 1 . 1 49 49 GLU H H 1 8.416 0.000 . 1 . . . . . 346 E HN . 51485 1 90 . 1 . 1 49 49 GLU N N 15 123.105 0.000 . 1 . . . . . 346 E N . 51485 1 91 . 1 . 1 50 50 ILE H H 1 8.171 0.000 . 1 . . . . . 347 I HN . 51485 1 92 . 1 . 1 50 50 ILE N N 15 121.754 0.000 . 1 . . . . . 347 I N . 51485 1 93 . 1 . 1 51 51 SER H H 1 8.461 0.000 . 1 . . . . . 348 S HN . 51485 1 94 . 1 . 1 51 51 SER N N 15 119.911 0.000 . 1 . . . . . 348 S N . 51485 1 95 . 1 . 1 52 52 GLU H H 1 8.480 0.000 . 1 . . . . . 349 E HN . 51485 1 96 . 1 . 1 52 52 GLU N N 15 122.894 0.000 . 1 . . . . . 349 E N . 51485 1 97 . 1 . 1 53 53 PHE H H 1 8.141 0.000 . 1 . . . . . 350 F HN . 51485 1 98 . 1 . 1 53 53 PHE N N 15 119.957 0.000 . 1 . . . . . 350 F N . 51485 1 99 . 1 . 1 54 54 ASP H H 1 8.139 0.000 . 1 . . . . . 351 D HN . 51485 1 100 . 1 . 1 54 54 ASP N N 15 121.940 0.000 . 1 . . . . . 351 D N . 51485 1 101 . 1 . 1 55 55 VAL H H 1 8.227 0.000 . 1 . . . . . 352 V HN . 51485 1 102 . 1 . 1 55 55 VAL N N 15 120.895 0.000 . 1 . . . . . 352 V N . 51485 1 103 . 1 . 1 56 56 THR H H 1 8.309 0.000 . 1 . . . . . 353 T HN . 51485 1 104 . 1 . 1 56 56 THR N N 15 114.959 0.000 . 1 . . . . . 353 T N . 51485 1 105 . 1 . 1 57 57 LYS H H 1 7.955 0.000 . 1 . . . . . 354 K HN . 51485 1 106 . 1 . 1 57 57 LYS N N 15 122.044 0.000 . 1 . . . . . 354 K N . 51485 1 107 . 1 . 1 58 58 SER H H 1 8.109 0.000 . 1 . . . . . 355 S HN . 51485 1 108 . 1 . 1 58 58 SER N N 15 115.594 0.000 . 1 . . . . . 355 S N . 51485 1 109 . 1 . 1 59 59 LYS H H 1 8.286 0.000 . 1 . . . . . 356 K HN . 51485 1 110 . 1 . 1 59 59 LYS N N 15 122.243 0.000 . 1 . . . . . 356 K N . 51485 1 111 . 1 . 1 60 60 ASN H H 1 8.386 0.000 . 1 . . . . . 357 N HN . 51485 1 112 . 1 . 1 60 60 ASN N N 15 119.328 0.000 . 1 . . . . . 357 N N . 51485 1 113 . 1 . 1 61 61 VAL H H 1 8.068 0.000 . 1 . . . . . 358 V HN . 51485 1 114 . 1 . 1 61 61 VAL N N 15 121.818 0.000 . 1 . . . . . 358 V N . 51485 1 115 . 1 . 1 63 63 LYS H H 1 8.385 0.000 . 1 . . . . . 360 K HN . 51485 1 116 . 1 . 1 63 63 LYS N N 15 121.377 0.000 . 1 . . . . . 360 K N . 51485 1 117 . 1 . 1 64 64 GLN H H 1 8.390 0.000 . 1 . . . . . 361 Q HN . 51485 1 118 . 1 . 1 64 64 GLN N N 15 120.238 0.000 . 1 . . . . . 361 Q N . 51485 1 119 . 1 . 1 65 65 PHE H H 1 8.227 0.000 . 1 . . . . . 362 F HN . 51485 1 120 . 1 . 1 65 65 PHE N N 15 120.572 0.000 . 1 . . . . . 362 F N . 51485 1 121 . 1 . 1 66 66 LEU H H 1 8.114 0.000 . 1 . . . . . 363 L HN . 51485 1 122 . 1 . 1 66 66 LEU N N 15 123.331 0.000 . 1 . . . . . 363 L N . 51485 1 123 . 1 . 1 67 67 ILE H H 1 8.145 0.000 . 1 . . . . . 364 I HN . 51485 1 124 . 1 . 1 67 67 ILE N N 15 121.744 0.000 . 1 . . . . . 364 I N . 51485 1 125 . 1 . 1 68 68 SER H H 1 8.379 0.000 . 1 . . . . . 365 S HN . 51485 1 126 . 1 . 1 68 68 SER N N 15 119.719 0.000 . 1 . . . . . 365 S N . 51485 1 127 . 1 . 1 69 69 ALA H H 1 8.441 0.000 . 1 . . . . . 366 A HN . 51485 1 128 . 1 . 1 69 69 ALA N N 15 126.076 0.000 . 1 . . . . . 366 A N . 51485 1 129 . 1 . 1 70 70 GLU H H 1 8.412 0.000 . 1 . . . . . 367 E HN . 51485 1 130 . 1 . 1 70 70 GLU N N 15 119.020 0.000 . 1 . . . . . 367 E N . 51485 1 131 . 1 . 1 71 71 ASN H H 1 8.325 0.000 . 1 . . . . . 368 N HN . 51485 1 132 . 1 . 1 71 71 ASN N N 15 118.224 0.000 . 1 . . . . . 368 N N . 51485 1 133 . 1 . 1 72 72 GLU H H 1 8.309 0.000 . 1 . . . . . 369 E HN . 51485 1 134 . 1 . 1 72 72 GLU N N 15 120.685 0.000 . 1 . . . . . 369 E N . 51485 1 135 . 1 . 1 73 73 GLN H H 1 8.398 0.000 . 1 . . . . . 370 Q HN . 51485 1 136 . 1 . 1 73 73 GLN N N 15 120.814 0.000 . 1 . . . . . 370 Q N . 51485 1 137 . 1 . 1 74 74 VAL H H 1 8.154 0.000 . 1 . . . . . 371 V HN . 51485 1 138 . 1 . 1 74 74 VAL N N 15 120.855 0.000 . 1 . . . . . 371 V N . 51485 1 139 . 1 . 1 75 75 GLY H H 1 8.470 0.000 . 1 . . . . . 372 G HN . 51485 1 140 . 1 . 1 75 75 GLY N N 15 112.047 0.000 . 1 . . . . . 372 G N . 51485 1 141 . 1 . 1 76 76 VAL H H 1 7.850 0.000 . 1 . . . . . 373 V HN . 51485 1 142 . 1 . 1 76 76 VAL N N 15 119.013 0.000 . 1 . . . . . 373 V N . 51485 1 143 . 1 . 1 77 77 PHE H H 1 8.345 0.000 . 1 . . . . . 374 F HN . 51485 1 144 . 1 . 1 77 77 PHE N N 15 123.410 0.000 . 1 . . . . . 374 F N . 51485 1 145 . 1 . 1 78 78 ALA H H 1 8.246 0.000 . 1 . . . . . 375 A HN . 51485 1 146 . 1 . 1 78 78 ALA N N 15 125.249 0.000 . 1 . . . . . 375 A N . 51485 1 147 . 1 . 1 79 79 ASN H H 1 8.318 0.000 . 1 . . . . . 376 N HN . 51485 1 148 . 1 . 1 79 79 ASN N N 15 117.656 0.000 . 1 . . . . . 376 N N . 51485 1 149 . 1 . 1 80 80 ASP H H 1 8.317 0.000 . 1 . . . . . 377 D HN . 51485 1 150 . 1 . 1 80 80 ASP N N 15 120.393 0.000 . 1 . . . . . 377 D N . 51485 1 151 . 1 . 1 81 81 ASN H H 1 8.422 0.000 . 1 . . . . . 378 N HN . 51485 1 152 . 1 . 1 81 81 ASN N N 15 118.717 0.000 . 1 . . . . . 378 N N . 51485 1 153 . 1 . 1 82 82 GLY H H 1 8.423 0.000 . 1 . . . . . 379 G HN . 51485 1 154 . 1 . 1 82 82 GLY N N 15 108.661 0.000 . 1 . . . . . 379 G N . 51485 1 155 . 1 . 1 83 83 PHE H H 1 8.088 0.000 . 1 . . . . . 380 F HN . 51485 1 156 . 1 . 1 83 83 PHE N N 15 119.517 0.000 . 1 . . . . . 380 F N . 51485 1 157 . 1 . 1 84 84 GLU H H 1 8.394 0.000 . 1 . . . . . 381 E HN . 51485 1 158 . 1 . 1 84 84 GLU N N 15 122.043 0.000 . 1 . . . . . 381 E N . 51485 1 159 . 1 . 1 85 85 ASP H H 1 8.363 0.000 . 1 . . . . . 382 D HN . 51485 1 160 . 1 . 1 85 85 ASP N N 15 121.293 0.000 . 1 . . . . . 382 D N . 51485 1 161 . 1 . 1 86 86 ARG H H 1 8.363 0.000 . 1 . . . . . 383 R HN . 51485 1 162 . 1 . 1 86 86 ARG N N 15 121.917 0.000 . 1 . . . . . 383 R N . 51485 1 163 . 1 . 1 87 87 THR H H 1 8.321 0.000 . 1 . . . . . 384 T HN . 51485 1 164 . 1 . 1 87 87 THR N N 15 114.280 0.000 . 1 . . . . . 384 T N . 51485 1 165 . 1 . 1 88 88 SER H H 1 8.336 0.000 . 1 . . . . . 385 S HN . 51485 1 166 . 1 . 1 88 88 SER N N 15 117.237 0.000 . 1 . . . . . 385 S N . 51485 1 167 . 1 . 1 89 89 GLU H H 1 8.434 0.000 . 1 . . . . . 386 E HN . 51485 1 168 . 1 . 1 89 89 GLU N N 15 122.274 0.000 . 1 . . . . . 386 E N . 51485 1 169 . 1 . 1 90 90 GLN H H 1 8.237 0.000 . 1 . . . . . 387 Q HN . 51485 1 170 . 1 . 1 90 90 GLN N N 15 119.810 0.000 . 1 . . . . . 387 Q N . 51485 1 171 . 1 . 1 91 91 TYR H H 1 8.092 0.000 . 1 . . . . . 388 Y HN . 51485 1 172 . 1 . 1 91 91 TYR N N 15 120.548 0.000 . 1 . . . . . 388 Y N . 51485 1 173 . 1 . 1 92 92 GLU H H 1 8.353 0.000 . 1 . . . . . 389 E HN . 51485 1 174 . 1 . 1 92 92 GLU N N 15 121.188 0.000 . 1 . . . . . 389 E N . 51485 1 175 . 1 . 1 93 93 THR H H 1 8.141 0.000 . 1 . . . . . 390 T HN . 51485 1 176 . 1 . 1 93 93 THR N N 15 115.206 0.000 . 1 . . . . . 390 T N . 51485 1 177 . 1 . 1 94 94 LEU H H 1 8.171 0.000 . 1 . . . . . 391 L HN . 51485 1 178 . 1 . 1 94 94 LEU N N 15 124.365 0.000 . 1 . . . . . 391 L N . 51485 1 179 . 1 . 1 95 95 LEU H H 1 8.175 0.000 . 1 . . . . . 392 L HN . 51485 1 180 . 1 . 1 95 95 LEU N N 15 122.878 0.000 . 1 . . . . . 392 L N . 51485 1 181 . 1 . 1 96 96 ILE H H 1 8.011 0.000 . 1 . . . . . 393 I HN . 51485 1 182 . 1 . 1 96 96 ILE N N 15 121.437 0.000 . 1 . . . . . 393 I N . 51485 1 183 . 1 . 1 97 97 GLU H H 1 8.504 0.000 . 1 . . . . . 394 E HN . 51485 1 184 . 1 . 1 97 97 GLU N N 15 124.274 0.000 . 1 . . . . . 394 E N . 51485 1 185 . 1 . 1 98 98 THR H H 1 8.211 0.000 . 1 . . . . . 395 T HN . 51485 1 186 . 1 . 1 98 98 THR N N 15 114.904 0.000 . 1 . . . . . 395 T N . 51485 1 187 . 1 . 1 99 99 ALA H H 1 8.358 0.000 . 1 . . . . . 396 A HN . 51485 1 188 . 1 . 1 99 99 ALA N N 15 125.883 0.000 . 1 . . . . . 396 A N . 51485 1 189 . 1 . 1 100 100 SER H H 1 8.309 0.000 . 1 . . . . . 397 S HN . 51485 1 190 . 1 . 1 100 100 SER N N 15 114.267 0.000 . 1 . . . . . 397 S N . 51485 1 191 . 1 . 1 101 101 SER H H 1 8.269 0.000 . 1 . . . . . 398 S HN . 51485 1 192 . 1 . 1 101 101 SER N N 15 117.398 0.000 . 1 . . . . . 398 S N . 51485 1 193 . 1 . 1 102 102 LEU H H 1 8.101 0.000 . 1 . . . . . 399 L HN . 51485 1 194 . 1 . 1 102 102 LEU N N 15 123.068 0.000 . 1 . . . . . 399 L N . 51485 1 195 . 1 . 1 103 103 VAL H H 1 7.931 0.000 . 1 . . . . . 400 V HN . 51485 1 196 . 1 . 1 103 103 VAL N N 15 120.312 0.000 . 1 . . . . . 400 V N . 51485 1 197 . 1 . 1 104 104 LYS H H 1 8.322 0.000 . 1 . . . . . 401 K HN . 51485 1 198 . 1 . 1 104 104 LYS N N 15 124.360 0.000 . 1 . . . . . 401 K N . 51485 1 199 . 1 . 1 105 105 ASN H H 1 8.385 0.000 . 1 . . . . . 402 N HN . 51485 1 200 . 1 . 1 105 105 ASN N N 15 119.195 0.000 . 1 . . . . . 402 N N . 51485 1 201 . 1 . 1 106 106 ALA H H 1 8.215 0.000 . 1 . . . . . 403 A HN . 51485 1 202 . 1 . 1 106 106 ALA N N 15 123.577 0.000 . 1 . . . . . 403 A N . 51485 1 203 . 1 . 1 107 107 ILE H H 1 8.084 0.000 . 1 . . . . . 404 I HN . 51485 1 204 . 1 . 1 107 107 ILE N N 15 119.590 0.000 . 1 . . . . . 404 I N . 51485 1 205 . 1 . 1 108 108 GLN H H 1 8.373 0.000 . 1 . . . . . 405 Q HN . 51485 1 206 . 1 . 1 108 108 GLN N N 15 123.756 0.000 . 1 . . . . . 405 Q N . 51485 1 207 . 1 . 1 109 109 LEU H H 1 8.301 0.000 . 1 . . . . . 406 L HN . 51485 1 208 . 1 . 1 109 109 LEU N N 15 123.258 0.000 . 1 . . . . . 406 L N . 51485 1 209 . 1 . 1 110 110 SER H H 1 8.314 0.000 . 1 . . . . . 407 S HN . 51485 1 210 . 1 . 1 110 110 SER N N 15 116.395 0.000 . 1 . . . . . 407 S N . 51485 1 211 . 1 . 1 111 111 ILE H H 1 8.181 0.000 . 1 . . . . . 408 I HN . 51485 1 212 . 1 . 1 111 111 ILE N N 15 121.904 0.000 . 1 . . . . . 408 I N . 51485 1 213 . 1 . 1 112 112 GLU H H 1 8.409 0.000 . 1 . . . . . 409 E HN . 51485 1 214 . 1 . 1 112 112 GLU N N 15 122.617 0.000 . 1 . . . . . 409 E N . 51485 1 215 . 1 . 1 113 113 GLN H H 1 8.197 0.000 . 1 . . . . . 410 Q HN . 51485 1 216 . 1 . 1 113 113 GLN N N 15 119.918 0.000 . 1 . . . . . 410 Q N . 51485 1 217 . 1 . 1 114 114 LEU H H 1 8.158 0.000 . 1 . . . . . 411 L HN . 51485 1 218 . 1 . 1 114 114 LEU N N 15 122.673 0.000 . 1 . . . . . 411 L N . 51485 1 219 . 1 . 1 115 115 VAL H H 1 8.108 0.000 . 1 . . . . . 412 V HN . 51485 1 220 . 1 . 1 115 115 VAL N N 15 119.962 0.000 . 1 . . . . . 412 V N . 51485 1 221 . 1 . 1 116 116 ASN H H 1 8.385 0.000 . 1 . . . . . 413 N HN . 51485 1 222 . 1 . 1 116 116 ASN N N 15 121.377 0.000 . 1 . . . . . 413 N N . 51485 1 223 . 1 . 1 117 117 GLU H H 1 8.410 0.000 . 1 . . . . . 414 E HN . 51485 1 224 . 1 . 1 117 117 GLU N N 15 121.277 0.000 . 1 . . . . . 414 E N . 51485 1 225 . 1 . 1 118 118 MET H H 1 8.291 0.000 . 1 . . . . . 415 M HN . 51485 1 226 . 1 . 1 118 118 MET N N 15 120.223 0.000 . 1 . . . . . 415 M N . 51485 1 227 . 1 . 1 119 119 ALA H H 1 8.235 0.000 . 1 . . . . . 416 A HN . 51485 1 228 . 1 . 1 119 119 ALA N N 15 124.803 0.000 . 1 . . . . . 416 A N . 51485 1 229 . 1 . 1 120 120 SER H H 1 8.284 0.000 . 1 . . . . . 417 S HN . 51485 1 230 . 1 . 1 120 120 SER N N 15 114.947 0.000 . 1 . . . . . 417 S N . 51485 1 231 . 1 . 1 121 121 ASP H H 1 8.415 0.000 . 1 . . . . . 418 D HN . 51485 1 232 . 1 . 1 121 121 ASP N N 15 122.262 0.000 . 1 . . . . . 418 D N . 51485 1 233 . 1 . 1 122 122 ASP H H 1 8.298 0.000 . 1 . . . . . 419 D HN . 51485 1 234 . 1 . 1 122 122 ASP N N 15 120.377 0.000 . 1 . . . . . 419 D N . 51485 1 235 . 1 . 1 123 123 ASN H H 1 8.356 0.000 . 1 . . . . . 420 N HN . 51485 1 236 . 1 . 1 123 123 ASN N N 15 118.368 0.000 . 1 . . . . . 420 N N . 51485 1 237 . 1 . 1 124 124 LYS H H 1 8.135 0.000 . 1 . . . . . 421 K HN . 51485 1 238 . 1 . 1 124 124 LYS N N 15 120.625 0.000 . 1 . . . . . 421 K N . 51485 1 239 . 1 . 1 125 125 ILE H H 1 8.057 0.000 . 1 . . . . . 422 I HN . 51485 1 240 . 1 . 1 125 125 ILE N N 15 120.474 0.000 . 1 . . . . . 422 I N . 51485 1 241 . 1 . 1 126 126 ASN H H 1 8.421 0.000 . 1 . . . . . 423 N HN . 51485 1 242 . 1 . 1 126 126 ASN N N 15 121.731 0.000 . 1 . . . . . 423 N N . 51485 1 243 . 1 . 1 127 127 ASN H H 1 8.375 0.000 . 1 . . . . . 424 N HN . 51485 1 244 . 1 . 1 127 127 ASN N N 15 119.302 0.000 . 1 . . . . . 424 N N . 51485 1 245 . 1 . 1 128 128 LEU H H 1 8.172 0.000 . 1 . . . . . 425 L HN . 51485 1 246 . 1 . 1 128 128 LEU N N 15 121.434 0.000 . 1 . . . . . 425 L N . 51485 1 247 . 1 . 1 129 129 LEU H H 1 8.118 0.000 . 1 . . . . . 426 L HN . 51485 1 248 . 1 . 1 129 129 LEU N N 15 122.388 0.000 . 1 . . . . . 426 L N . 51485 1 249 . 1 . 1 130 130 GLN H H 1 7.823 0.000 . 1 . . . . . 427 Q HN . 51485 1 250 . 1 . 1 130 130 GLN N N 15 125.511 0.000 . 1 . . . . . 427 Q N . 51485 1 stop_ save_