data_19362 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 19362 _Entry.Title ; Solution Structure of the STIM1 CC1-CC2 homodimer. ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2013-07-12 _Entry.Accession_date 2013-07-12 _Entry.Last_release_date 2014-01-13 _Entry.Original_release_date 2014-01-13 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Peter Stathopulos . B. . 19362 2 Mitsuhiko Ikura . . . 19362 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 19362 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID CC1-CC2 . 19362 coiled-coil . 19362 STIM1 . 19362 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 2 19362 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 693 19362 '15N chemical shifts' 156 19362 '1H chemical shifts' 1076 19362 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2014-01-13 2013-07-12 original author . 19362 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 19363 '-CC2 homodimer in complex with two Orai1 C-terminal domains' 19362 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 19362 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 24351972 _Citation.Full_citation . _Citation.Title 'STIM1/Orai1 coiled-coil interplay in the regulation of store-operated calcium entry' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Commun.' _Citation.Journal_name_full . _Citation.Journal_volume 4 _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 2963 _Citation.Page_last 2963 _Citation.Year 2013 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Peter Stathopulos . B. . 19362 1 2 Rainer Schindl . . . 19362 1 3 Marc Fahrner . . . 19362 1 4 Le Zheng . . . 19362 1 5 Genevieve Gasmi-Seabrook . . . 19362 1 6 Martin Muik . . . 19362 1 7 Christoph Romanin . . . 19362 1 8 Mitsuhiko Ikura . . . 19362 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 19362 _Assembly.ID 1 _Assembly.Name 'STIM1 CC1-CC2 homodimer' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _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 STIM1_CC1-CC2 1 $STIM1_CC1-CC2 A . yes native no no . . . 19362 1 2 STIM1_CC1-CC2 1 $STIM1_CC1-CC2 B . yes native no no . . . 19362 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_STIM1_CC1-CC2 _Entity.Sf_category entity _Entity.Sf_framecode STIM1_CC1-CC2 _Entity.Entry_ID 19362 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name STIM1_CC1-CC2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A,B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSHMASSRQKYAEEELEQVR EALRKAEKELESHSSWYAPE ALQKWLQLTHEVEVQYYNIK KQNAEKQLLVAKEGAEKIKK KR ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Residues -5-0 (i.e. GSHMAS) are a cloning artifact.' _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 82 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment CC1-CC2 _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 9703.089 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes REF NP_003147.2 . "stromal interaction molecule 1" . . . . . . . . . . . . . . 19362 1 2 no BMRB 19363 . STIM1_CC1-CC2 . . . . . 100.00 82 100.00 100.00 4.71e-48 . . . . 19362 1 3 no PDB 2MAJ . "Solution Structure Of The Stim1 Cc1-cc2 Homodimer." . . . . . 100.00 82 100.00 100.00 4.71e-48 . . . . 19362 1 4 no PDB 2MAK . "Solution Structure Of The Stim1 Cc1-cc2 Homodimer In Complex With Two Orai1 C-terminal Domains" . . . . . 100.00 82 100.00 100.00 4.71e-48 . . . . 19362 1 5 no PDB 3TEQ . "Crystal Structure Of Soar Domain" . . . . . 53.66 101 97.73 100.00 6.05e-20 . . . . 19362 1 6 no GB ADO20317 . "STIM1L [Homo sapiens]" . . . . . 92.68 791 100.00 100.00 6.74e-40 . . . . 19362 1 7 no REF NP_001264890 . "stromal interaction molecule 1 isoform 1 precursor [Homo sapiens]" . . . . . 92.68 791 100.00 100.00 6.74e-40 . . . . 19362 1 8 no REF XP_003910388 . "PREDICTED: stromal interaction molecule 1 isoform X1 [Papio anubis]" . . . . . 92.68 790 100.00 100.00 6.57e-40 . . . . 19362 1 9 no REF XP_003923449 . "PREDICTED: stromal interaction molecule 1 isoform X1 [Saimiri boliviensis boliviensis]" . . . . . 92.68 792 100.00 100.00 6.58e-40 . . . . 19362 1 10 no REF XP_003951854 . "PREDICTED: stromal interaction molecule 1 isoform X1 [Pan troglodytes]" . . . . . 92.68 791 100.00 100.00 6.74e-40 . . . . 19362 1 11 no REF XP_004016320 . "PREDICTED: stromal interaction molecule 1 isoform X1 [Ovis aries]" . . . . . 92.68 785 100.00 100.00 1.56e-39 . . . . 19362 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 -5 GLY . 19362 1 2 -4 SER . 19362 1 3 -3 HIS . 19362 1 4 -2 MET . 19362 1 5 -1 ALA . 19362 1 6 0 SER . 19362 1 7 312 SER . 19362 1 8 313 ARG . 19362 1 9 314 GLN . 19362 1 10 315 LYS . 19362 1 11 316 TYR . 19362 1 12 317 ALA . 19362 1 13 318 GLU . 19362 1 14 319 GLU . 19362 1 15 320 GLU . 19362 1 16 321 LEU . 19362 1 17 322 GLU . 19362 1 18 323 GLN . 19362 1 19 324 VAL . 19362 1 20 325 ARG . 19362 1 21 326 GLU . 19362 1 22 327 ALA . 19362 1 23 328 LEU . 19362 1 24 329 ARG . 19362 1 25 330 LYS . 19362 1 26 331 ALA . 19362 1 27 332 GLU . 19362 1 28 333 LYS . 19362 1 29 334 GLU . 19362 1 30 335 LEU . 19362 1 31 336 GLU . 19362 1 32 337 SER . 19362 1 33 338 HIS . 19362 1 34 339 SER . 19362 1 35 340 SER . 19362 1 36 341 TRP . 19362 1 37 342 TYR . 19362 1 38 343 ALA . 19362 1 39 344 PRO . 19362 1 40 345 GLU . 19362 1 41 346 ALA . 19362 1 42 347 LEU . 19362 1 43 348 GLN . 19362 1 44 349 LYS . 19362 1 45 350 TRP . 19362 1 46 351 LEU . 19362 1 47 352 GLN . 19362 1 48 353 LEU . 19362 1 49 354 THR . 19362 1 50 355 HIS . 19362 1 51 356 GLU . 19362 1 52 357 VAL . 19362 1 53 358 GLU . 19362 1 54 359 VAL . 19362 1 55 360 GLN . 19362 1 56 361 TYR . 19362 1 57 362 TYR . 19362 1 58 363 ASN . 19362 1 59 364 ILE . 19362 1 60 365 LYS . 19362 1 61 366 LYS . 19362 1 62 367 GLN . 19362 1 63 368 ASN . 19362 1 64 369 ALA . 19362 1 65 370 GLU . 19362 1 66 371 LYS . 19362 1 67 372 GLN . 19362 1 68 373 LEU . 19362 1 69 374 LEU . 19362 1 70 375 VAL . 19362 1 71 376 ALA . 19362 1 72 377 LYS . 19362 1 73 378 GLU . 19362 1 74 379 GLY . 19362 1 75 380 ALA . 19362 1 76 381 GLU . 19362 1 77 382 LYS . 19362 1 78 383 ILE . 19362 1 79 384 LYS . 19362 1 80 385 LYS . 19362 1 81 386 LYS . 19362 1 82 387 ARG . 19362 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 19362 1 . SER 2 2 19362 1 . HIS 3 3 19362 1 . MET 4 4 19362 1 . ALA 5 5 19362 1 . SER 6 6 19362 1 . SER 7 7 19362 1 . ARG 8 8 19362 1 . GLN 9 9 19362 1 . LYS 10 10 19362 1 . TYR 11 11 19362 1 . ALA 12 12 19362 1 . GLU 13 13 19362 1 . GLU 14 14 19362 1 . GLU 15 15 19362 1 . LEU 16 16 19362 1 . GLU 17 17 19362 1 . GLN 18 18 19362 1 . VAL 19 19 19362 1 . ARG 20 20 19362 1 . GLU 21 21 19362 1 . ALA 22 22 19362 1 . LEU 23 23 19362 1 . ARG 24 24 19362 1 . LYS 25 25 19362 1 . ALA 26 26 19362 1 . GLU 27 27 19362 1 . LYS 28 28 19362 1 . GLU 29 29 19362 1 . LEU 30 30 19362 1 . GLU 31 31 19362 1 . SER 32 32 19362 1 . HIS 33 33 19362 1 . SER 34 34 19362 1 . SER 35 35 19362 1 . TRP 36 36 19362 1 . TYR 37 37 19362 1 . ALA 38 38 19362 1 . PRO 39 39 19362 1 . GLU 40 40 19362 1 . ALA 41 41 19362 1 . LEU 42 42 19362 1 . GLN 43 43 19362 1 . LYS 44 44 19362 1 . TRP 45 45 19362 1 . LEU 46 46 19362 1 . GLN 47 47 19362 1 . LEU 48 48 19362 1 . THR 49 49 19362 1 . HIS 50 50 19362 1 . GLU 51 51 19362 1 . VAL 52 52 19362 1 . GLU 53 53 19362 1 . VAL 54 54 19362 1 . GLN 55 55 19362 1 . TYR 56 56 19362 1 . TYR 57 57 19362 1 . ASN 58 58 19362 1 . ILE 59 59 19362 1 . LYS 60 60 19362 1 . LYS 61 61 19362 1 . GLN 62 62 19362 1 . ASN 63 63 19362 1 . ALA 64 64 19362 1 . GLU 65 65 19362 1 . LYS 66 66 19362 1 . GLN 67 67 19362 1 . LEU 68 68 19362 1 . LEU 69 69 19362 1 . VAL 70 70 19362 1 . ALA 71 71 19362 1 . LYS 72 72 19362 1 . GLU 73 73 19362 1 . GLY 74 74 19362 1 . ALA 75 75 19362 1 . GLU 76 76 19362 1 . LYS 77 77 19362 1 . ILE 78 78 19362 1 . LYS 79 79 19362 1 . LYS 80 80 19362 1 . LYS 81 81 19362 1 . ARG 82 82 19362 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 19362 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $STIM1_CC1-CC2 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 19362 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 19362 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $STIM1_CC1-CC2 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET-28a . . . . . . 19362 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 19362 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 STIM1_CC1-CC2 '[U-99% 15N]' . . 1 $STIM1_CC1-CC2 . . 0.5 . . mM . . . . 19362 1 2 bis-TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 19362 1 3 TFE '[U-99% 2H]' . . . . . . 0.175 . . v/v . . . . 19362 1 4 H2O 'natural abundance' . . . . . . 90 . . % . . . . 19362 1 5 D2O 'natural abundance' . . . . . . 10 . . % . . . . 19362 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 19362 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 STIM1_CC1-CC2 '[U-99% 13C; U-99% 15N]' . . 1 $STIM1_CC1-CC2 . . 0.5 . . mM . . . . 19362 2 2 bis-TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 19362 2 3 TFE '[U-99% 2H]' . . . . . . 0.175 . . v/v . . . . 19362 2 4 H2O 'natural abundance' . . . . . . 90 . . % . . . . 19362 2 5 D2O 'natural abundance' . . . . . . 10 . . % . . . . 19362 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 19362 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _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 STIM1_CC1-CC2 '[U-99% 13C; U-99% 15N]' . . 1 $STIM1_CC1-CC2 . . 0.5 . . mM . . . . 19362 3 2 bis-TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 19362 3 3 TFE '[U-99% 2H]' . . . . . . 0.175 . . v/v . . . . 19362 3 4 D2O 'natural abundance' . . . . . . 100 . . % . . . . 19362 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 19362 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _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 STIM1_CC1-CC2 '[U-99% 13C; U-99% 15N]' . . 1 $STIM1_CC1-CC2 . . 0.5 . . mM . . . . 19362 4 2 STIM1_CC1-CC2 'natural abundance' . . 1 $STIM1_CC1-CC2 . . 0.5 . . mM . . . . 19362 4 3 bis-TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 19362 4 4 TFE '[U-99% 2H]' . . . . . . 0.175 . . v/v . . . . 19362 4 5 D2O 'natural abundance' . . . . . . 100 . . % . . . . 19362 4 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 19362 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.02 . M 19362 1 pH 5.5 . pH 19362 1 pressure 1 . atm 19362 1 temperature 308 . K 19362 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 19362 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 19362 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 19362 1 stop_ save_ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID 19362 _Software.ID 2 _Software.Name XEASY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bartels et al.' . . 19362 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 19362 2 'peak picking' 19362 2 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 19362 _Software.ID 3 _Software.Name TALOS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 19362 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 19362 3 'geometry optimization' 19362 3 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 19362 _Software.ID 4 _Software.Name CYANA _Software.Version 3.0 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 19362 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 19362 4 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 19362 _Software.ID 5 _Software.Name CNS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 19362 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' 19362 5 refinement 19362 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 19362 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 19362 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 19362 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 800 . . . 19362 1 2 spectrometer_2 Bruker Avance . 600 . . . 19362 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 19362 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19362 1 2 '3D HNCACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19362 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19362 1 4 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19362 1 5 '3D C(CO)NH TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19362 1 6 '3D H(CCO)NH TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19362 1 7 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19362 1 8 '2D 1H-13C HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19362 1 9 '3D 1H-13C NOESY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19362 1 10 '3D 1H-13C-1H-12C/14N xfilt NOESY' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19362 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 19362 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 19362 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 19362 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 19362 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 19362 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 19362 1 2 '3D HNCACB' . . . 19362 1 3 '3D CBCA(CO)NH' . . . 19362 1 4 '3D HNCO' . . . 19362 1 5 '3D C(CO)NH TOCSY' . . . 19362 1 6 '3D H(CCO)NH TOCSY' . . . 19362 1 7 '3D 1H-15N NOESY' . . . 19362 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 3 3 HIS HA H 1 4.631 0.040 . 1 . . . A -3 HIS HA . 19362 1 2 . 1 1 3 3 HIS HB2 H 1 3.17 0.040 . 2 . . . A -3 HIS HB2 . 19362 1 3 . 1 1 3 3 HIS HB3 H 1 3.082 0.040 . 2 . . . A -3 HIS HB3 . 19362 1 4 . 1 1 3 3 HIS C C 13 174.845 0.400 . 1 . . . A -3 HIS C . 19362 1 5 . 1 1 3 3 HIS CA C 13 56.103 0.400 . 1 . . . A -3 HIS CA . 19362 1 6 . 1 1 3 3 HIS CB C 13 29.948 0.400 . 1 . . . A -3 HIS CB . 19362 1 7 . 1 1 4 4 MET H H 1 8.297 0.040 . 1 . . . A -2 MET H . 19362 1 8 . 1 1 4 4 MET HA H 1 4.386 0.040 . 1 . . . A -2 MET HA . 19362 1 9 . 1 1 4 4 MET HB2 H 1 2.015 0.040 . 2 . . . A -2 MET HB2 . 19362 1 10 . 1 1 4 4 MET HB3 H 1 1.927 0.040 . 2 . . . A -2 MET HB3 . 19362 1 11 . 1 1 4 4 MET HG2 H 1 2.477 0.040 . 2 . . . A -2 MET HG2 . 19362 1 12 . 1 1 4 4 MET HG3 H 1 2.43 0.040 . 2 . . . A -2 MET HG3 . 19362 1 13 . 1 1 4 4 MET C C 13 175.874 0.400 . 1 . . . A -2 MET C . 19362 1 14 . 1 1 4 4 MET CA C 13 55.898 0.003 . 1 . . . A -2 MET CA . 19362 1 15 . 1 1 4 4 MET CB C 13 33.203 0.032 . 1 . . . A -2 MET CB . 19362 1 16 . 1 1 4 4 MET CG C 13 32.207 0.400 . 1 . . . A -2 MET CG . 19362 1 17 . 1 1 4 4 MET N N 15 121.3 0.400 . 1 . . . A -2 MET N . 19362 1 18 . 1 1 5 5 ALA H H 1 8.311 0.040 . 1 . . . A -1 ALA H . 19362 1 19 . 1 1 5 5 ALA HA H 1 4.285 0.040 . 1 . . . A -1 ALA HA . 19362 1 20 . 1 1 5 5 ALA HB1 H 1 1.37 0.040 . 1 . . . A -1 ALA HB1 . 19362 1 21 . 1 1 5 5 ALA HB2 H 1 1.37 0.040 . 1 . . . A -1 ALA HB2 . 19362 1 22 . 1 1 5 5 ALA HB3 H 1 1.37 0.040 . 1 . . . A -1 ALA HB3 . 19362 1 23 . 1 1 5 5 ALA C C 13 177.793 0.400 . 1 . . . A -1 ALA C . 19362 1 24 . 1 1 5 5 ALA CA C 13 53.001 0.07 . 1 . . . A -1 ALA CA . 19362 1 25 . 1 1 5 5 ALA CB C 13 19.357 0.042 . 1 . . . A -1 ALA CB . 19362 1 26 . 1 1 5 5 ALA N N 15 124.904 0.400 . 1 . . . A -1 ALA N . 19362 1 27 . 1 1 6 6 SER H H 1 8.175 0.040 . 1 . . . A 0 SER H . 19362 1 28 . 1 1 6 6 SER HA H 1 4.414 0.040 . 1 . . . A 0 SER HA . 19362 1 29 . 1 1 6 6 SER HB2 H 1 3.904 0.040 . 2 . . . A 0 SER HB2 . 19362 1 30 . 1 1 6 6 SER HB3 H 1 3.829 0.040 . 2 . . . A 0 SER HB3 . 19362 1 31 . 1 1 6 6 SER C C 13 174.845 0.400 . 1 . . . A 0 SER C . 19362 1 32 . 1 1 6 6 SER CA C 13 58.784 0.158 . 1 . . . A 0 SER CA . 19362 1 33 . 1 1 6 6 SER CB C 13 64.033 0.134 . 1 . . . A 0 SER CB . 19362 1 34 . 1 1 6 6 SER N N 15 114.122 0.400 . 1 . . . A 0 SER N . 19362 1 35 . 1 1 7 7 SER H H 1 8.204 0.040 . 1 . . . A 312 SER H . 19362 1 36 . 1 1 7 7 SER HA H 1 4.4 0.040 . 1 . . . A 312 SER HA . 19362 1 37 . 1 1 7 7 SER HB2 H 1 3.924 0.040 . 2 . . . A 312 SER HB2 . 19362 1 38 . 1 1 7 7 SER HB3 H 1 3.856 0.040 . 2 . . . A 312 SER HB3 . 19362 1 39 . 1 1 7 7 SER C C 13 174.757 0.400 . 1 . . . A 312 SER C . 19362 1 40 . 1 1 7 7 SER CA C 13 58.882 0.11 . 1 . . . A 312 SER CA . 19362 1 41 . 1 1 7 7 SER CB C 13 63.922 0.058 . 1 . . . A 312 SER CB . 19362 1 42 . 1 1 7 7 SER N N 15 117.154 0.400 . 1 . . . A 312 SER N . 19362 1 43 . 1 1 8 8 ARG H H 1 8.234 0.040 . 1 . . . A 313 ARG H . 19362 1 44 . 1 1 8 8 ARG HA H 1 4.244 0.040 . 1 . . . A 313 ARG HA . 19362 1 45 . 1 1 8 8 ARG HB2 H 1 1.866 0.040 . 2 . . . A 313 ARG HB2 . 19362 1 46 . 1 1 8 8 ARG HB3 H 1 1.757 0.040 . 2 . . . A 313 ARG HB3 . 19362 1 47 . 1 1 8 8 ARG HG2 H 1 1.628 0.040 . 2 . . . A 313 ARG HG2 . 19362 1 48 . 1 1 8 8 ARG HG3 H 1 1.608 0.040 . 2 . . . A 313 ARG HG3 . 19362 1 49 . 1 1 8 8 ARG HD2 H 1 3.129 0.040 . 2 . . . A 313 ARG HD2 . 19362 1 50 . 1 1 8 8 ARG HD3 H 1 3.129 0.040 . 2 . . . A 313 ARG HD3 . 19362 1 51 . 1 1 8 8 ARG C C 13 176.677 0.400 . 1 . . . A 313 ARG C . 19362 1 52 . 1 1 8 8 ARG CA C 13 57.25 0.181 . 1 . . . A 313 ARG CA . 19362 1 53 . 1 1 8 8 ARG CB C 13 30.578 0.025 . 1 . . . A 313 ARG CB . 19362 1 54 . 1 1 8 8 ARG CG C 13 27.6 0.400 . 1 . . . A 313 ARG CG . 19362 1 55 . 1 1 8 8 ARG CD C 13 43.578 0.400 . 1 . . . A 313 ARG CD . 19362 1 56 . 1 1 8 8 ARG N N 15 121.93 0.400 . 1 . . . A 313 ARG N . 19362 1 57 . 1 1 9 9 GLN H H 1 8.194 0.040 . 1 . . . A 314 GLN H . 19362 1 58 . 1 1 9 9 GLN HA H 1 4.149 0.040 . 1 . . . A 314 GLN HA . 19362 1 59 . 1 1 9 9 GLN HB2 H 1 1.988 0.040 . 2 . . . A 314 GLN HB2 . 19362 1 60 . 1 1 9 9 GLN HB3 H 1 1.988 0.040 . 2 . . . A 314 GLN HB3 . 19362 1 61 . 1 1 9 9 GLN HG2 H 1 2.28 0.040 . 2 . . . A 314 GLN HG2 . 19362 1 62 . 1 1 9 9 GLN HG3 H 1 2.28 0.040 . 2 . . . A 314 GLN HG3 . 19362 1 63 . 1 1 9 9 GLN C C 13 176.188 0.400 . 1 . . . A 314 GLN C . 19362 1 64 . 1 1 9 9 GLN CA C 13 57.285 0.157 . 1 . . . A 314 GLN CA . 19362 1 65 . 1 1 9 9 GLN CB C 13 29.197 0.014 . 1 . . . A 314 GLN CB . 19362 1 66 . 1 1 9 9 GLN CG C 13 34.15 0.400 . 1 . . . A 314 GLN CG . 19362 1 67 . 1 1 9 9 GLN N N 15 120.172 0.400 . 1 . . . A 314 GLN N . 19362 1 68 . 1 1 10 10 LYS H H 1 8.041 0.040 . 1 . . . A 315 LYS H . 19362 1 69 . 1 1 10 10 LYS HA H 1 4.176 0.040 . 1 . . . A 315 LYS HA . 19362 1 70 . 1 1 10 10 LYS HB2 H 1 1.689 0.040 . 2 . . . A 315 LYS HB2 . 19362 1 71 . 1 1 10 10 LYS HB3 H 1 1.689 0.040 . 2 . . . A 315 LYS HB3 . 19362 1 72 . 1 1 10 10 LYS HG2 H 1 1.336 0.040 . 2 . . . A 315 LYS HG2 . 19362 1 73 . 1 1 10 10 LYS HG3 H 1 1.254 0.040 . 2 . . . A 315 LYS HG3 . 19362 1 74 . 1 1 10 10 LYS HD2 H 1 1.574 0.040 . 2 . . . A 315 LYS HD2 . 19362 1 75 . 1 1 10 10 LYS HD3 H 1 1.574 0.040 . 2 . . . A 315 LYS HD3 . 19362 1 76 . 1 1 10 10 LYS HE2 H 1 2.898 0.040 . 2 . . . A 315 LYS HE2 . 19362 1 77 . 1 1 10 10 LYS HE3 H 1 2.898 0.040 . 2 . . . A 315 LYS HE3 . 19362 1 78 . 1 1 10 10 LYS C C 13 176.868 0.400 . 1 . . . A 315 LYS C . 19362 1 79 . 1 1 10 10 LYS CA C 13 57.175 0.048 . 1 . . . A 315 LYS CA . 19362 1 80 . 1 1 10 10 LYS CB C 13 32.98 0.042 . 1 . . . A 315 LYS CB . 19362 1 81 . 1 1 10 10 LYS CG C 13 25.009 0.400 . 1 . . . A 315 LYS CG . 19362 1 82 . 1 1 10 10 LYS CD C 13 29.4 0.400 . 1 . . . A 315 LYS CD . 19362 1 83 . 1 1 10 10 LYS CE C 13 42.427 0.400 . 1 . . . A 315 LYS CE . 19362 1 84 . 1 1 10 10 LYS N N 15 120.875 0.400 . 1 . . . A 315 LYS N . 19362 1 85 . 1 1 11 11 TYR H H 1 8.051 0.040 . 1 . . . A 316 TYR H . 19362 1 86 . 1 1 11 11 TYR HA H 1 4.488 0.040 . 1 . . . A 316 TYR HA . 19362 1 87 . 1 1 11 11 TYR HB2 H 1 3.129 0.040 . 2 . . . A 316 TYR HB2 . 19362 1 88 . 1 1 11 11 TYR HB3 H 1 2.905 0.040 . 2 . . . A 316 TYR HB3 . 19362 1 89 . 1 1 11 11 TYR C C 13 176.607 0.400 . 1 . . . A 316 TYR C . 19362 1 90 . 1 1 11 11 TYR CA C 13 58.849 0.002 . 1 . . . A 316 TYR CA . 19362 1 91 . 1 1 11 11 TYR CB C 13 38.701 0.039 . 1 . . . A 316 TYR CB . 19362 1 92 . 1 1 11 11 TYR N N 15 119.63 0.400 . 1 . . . A 316 TYR N . 19362 1 93 . 1 1 12 12 ALA H H 1 8.319 0.040 . 1 . . . A 317 ALA H . 19362 1 94 . 1 1 12 12 ALA HA H 1 4.196 0.040 . 1 . . . A 317 ALA HA . 19362 1 95 . 1 1 12 12 ALA HB1 H 1 1.438 0.040 . 1 . . . A 317 ALA HB1 . 19362 1 96 . 1 1 12 12 ALA HB2 H 1 1.438 0.040 . 1 . . . A 317 ALA HB2 . 19362 1 97 . 1 1 12 12 ALA HB3 H 1 1.438 0.040 . 1 . . . A 317 ALA HB3 . 19362 1 98 . 1 1 12 12 ALA C C 13 179.032 0.400 . 1 . . . A 317 ALA C . 19362 1 99 . 1 1 12 12 ALA CA C 13 54.309 0.022 . 1 . . . A 317 ALA CA . 19362 1 100 . 1 1 12 12 ALA CB C 13 18.668 0.02 . 1 . . . A 317 ALA CB . 19362 1 101 . 1 1 12 12 ALA N N 15 123.747 0.400 . 1 . . . A 317 ALA N . 19362 1 102 . 1 1 13 13 GLU H H 1 8.581 0.040 . 1 . . . A 318 GLU H . 19362 1 103 . 1 1 13 13 GLU HA H 1 3.965 0.040 . 1 . . . A 318 GLU HA . 19362 1 104 . 1 1 13 13 GLU HB2 H 1 2.063 0.040 . 2 . . . A 318 GLU HB2 . 19362 1 105 . 1 1 13 13 GLU HB3 H 1 2.063 0.040 . 2 . . . A 318 GLU HB3 . 19362 1 106 . 1 1 13 13 GLU HG2 H 1 2.314 0.040 . 2 . . . A 318 GLU HG2 . 19362 1 107 . 1 1 13 13 GLU HG3 H 1 2.314 0.040 . 2 . . . A 318 GLU HG3 . 19362 1 108 . 1 1 13 13 GLU C C 13 178.247 0.400 . 1 . . . A 318 GLU C . 19362 1 109 . 1 1 13 13 GLU CA C 13 59.706 0.005 . 1 . . . A 318 GLU CA . 19362 1 110 . 1 1 13 13 GLU CB C 13 29.592 0.095 . 1 . . . A 318 GLU CB . 19362 1 111 . 1 1 13 13 GLU CG C 13 36.741 0.400 . 1 . . . A 318 GLU CG . 19362 1 112 . 1 1 13 13 GLU N N 15 118.341 0.400 . 1 . . . A 318 GLU N . 19362 1 113 . 1 1 14 14 GLU H H 1 8.301 0.040 . 1 . . . A 319 GLU H . 19362 1 114 . 1 1 14 14 GLU HA H 1 4.06 0.040 . 1 . . . A 319 GLU HA . 19362 1 115 . 1 1 14 14 GLU HB2 H 1 2.104 0.040 . 2 . . . A 319 GLU HB2 . 19362 1 116 . 1 1 14 14 GLU HB3 H 1 2.029 0.040 . 2 . . . A 319 GLU HB3 . 19362 1 117 . 1 1 14 14 GLU HG2 H 1 2.369 0.040 . 2 . . . A 319 GLU HG2 . 19362 1 118 . 1 1 14 14 GLU HG3 H 1 2.287 0.040 . 2 . . . A 319 GLU HG3 . 19362 1 119 . 1 1 14 14 GLU C C 13 178.875 0.400 . 1 . . . A 319 GLU C . 19362 1 120 . 1 1 14 14 GLU CA C 13 59.681 0.091 . 1 . . . A 319 GLU CA . 19362 1 121 . 1 1 14 14 GLU CB C 13 29.673 0.087 . 1 . . . A 319 GLU CB . 19362 1 122 . 1 1 14 14 GLU CG C 13 36.669 0.400 . 1 . . . A 319 GLU CG . 19362 1 123 . 1 1 14 14 GLU N N 15 118.808 0.400 . 1 . . . A 319 GLU N . 19362 1 124 . 1 1 15 15 GLU H H 1 8.144 0.040 . 1 . . . A 320 GLU H . 19362 1 125 . 1 1 15 15 GLU HA H 1 4.04 0.040 . 1 . . . A 320 GLU HA . 19362 1 126 . 1 1 15 15 GLU HB2 H 1 2.158 0.040 . 2 . . . A 320 GLU HB2 . 19362 1 127 . 1 1 15 15 GLU HB3 H 1 2.063 0.040 . 2 . . . A 320 GLU HB3 . 19362 1 128 . 1 1 15 15 GLU HG2 H 1 2.273 0.040 . 2 . . . A 320 GLU HG2 . 19362 1 129 . 1 1 15 15 GLU HG3 H 1 2.273 0.040 . 2 . . . A 320 GLU HG3 . 19362 1 130 . 1 1 15 15 GLU C C 13 178.509 0.400 . 1 . . . A 320 GLU C . 19362 1 131 . 1 1 15 15 GLU CA C 13 59.528 0.023 . 1 . . . A 320 GLU CA . 19362 1 132 . 1 1 15 15 GLU CB C 13 29.564 0.088 . 1 . . . A 320 GLU CB . 19362 1 133 . 1 1 15 15 GLU CG C 13 36.381 0.400 . 1 . . . A 320 GLU CG . 19362 1 134 . 1 1 15 15 GLU N N 15 119.996 0.400 . 1 . . . A 320 GLU N . 19362 1 135 . 1 1 16 16 LEU H H 1 8.018 0.040 . 1 . . . A 321 LEU H . 19362 1 136 . 1 1 16 16 LEU HA H 1 4.115 0.040 . 1 . . . A 321 LEU HA . 19362 1 137 . 1 1 16 16 LEU HB2 H 1 1.934 0.040 . 2 . . . A 321 LEU HB2 . 19362 1 138 . 1 1 16 16 LEU HB3 H 1 1.934 0.040 . 2 . . . A 321 LEU HB3 . 19362 1 139 . 1 1 16 16 LEU HG H 1 1.444 0.040 . 1 . . . A 321 LEU HG . 19362 1 140 . 1 1 16 16 LEU HD11 H 1 0.874 0.040 . 2 . . . A 321 LEU HD11 . 19362 1 141 . 1 1 16 16 LEU HD12 H 1 0.874 0.040 . 2 . . . A 321 LEU HD12 . 19362 1 142 . 1 1 16 16 LEU HD13 H 1 0.874 0.040 . 2 . . . A 321 LEU HD13 . 19362 1 143 . 1 1 16 16 LEU HD21 H 1 0.887 0.040 . 2 . . . A 321 LEU HD21 . 19362 1 144 . 1 1 16 16 LEU HD22 H 1 0.887 0.040 . 2 . . . A 321 LEU HD22 . 19362 1 145 . 1 1 16 16 LEU HD23 H 1 0.887 0.040 . 2 . . . A 321 LEU HD23 . 19362 1 146 . 1 1 16 16 LEU C C 13 178.683 0.400 . 1 . . . A 321 LEU C . 19362 1 147 . 1 1 16 16 LEU CA C 13 57.986 0.02 . 1 . . . A 321 LEU CA . 19362 1 148 . 1 1 16 16 LEU CB C 13 41.942 0.103 . 1 . . . A 321 LEU CB . 19362 1 149 . 1 1 16 16 LEU CG C 13 28.104 0.400 . 1 . . . A 321 LEU CG . 19362 1 150 . 1 1 16 16 LEU CD1 C 13 25.153 0.400 . 2 . . . A 321 LEU CD1 . 19362 1 151 . 1 1 16 16 LEU CD2 C 13 24.937 0.400 . 2 . . . A 321 LEU CD2 . 19362 1 152 . 1 1 16 16 LEU N N 15 119.147 0.400 . 1 . . . A 321 LEU N . 19362 1 153 . 1 1 17 17 GLU H H 1 8.082 0.040 . 1 . . . A 322 GLU H . 19362 1 154 . 1 1 17 17 GLU HA H 1 4.04 0.040 . 1 . . . A 322 GLU HA . 19362 1 155 . 1 1 17 17 GLU HB2 H 1 2.165 0.040 . 2 . . . A 322 GLU HB2 . 19362 1 156 . 1 1 17 17 GLU HB3 H 1 2.104 0.040 . 2 . . . A 322 GLU HB3 . 19362 1 157 . 1 1 17 17 GLU HG2 H 1 2.369 0.040 . 2 . . . A 322 GLU HG2 . 19362 1 158 . 1 1 17 17 GLU HG3 H 1 2.369 0.040 . 2 . . . A 322 GLU HG3 . 19362 1 159 . 1 1 17 17 GLU C C 13 179.032 0.400 . 1 . . . A 322 GLU C . 19362 1 160 . 1 1 17 17 GLU CA C 13 59.595 0.005 . 1 . . . A 322 GLU CA . 19362 1 161 . 1 1 17 17 GLU CB C 13 29.122 0.017 . 1 . . . A 322 GLU CB . 19362 1 162 . 1 1 17 17 GLU CG C 13 35.733 0.400 . 1 . . . A 322 GLU CG . 19362 1 163 . 1 1 17 17 GLU N N 15 119.055 0.400 . 1 . . . A 322 GLU N . 19362 1 164 . 1 1 18 18 GLN H H 1 7.841 0.040 . 1 . . . A 323 GLN H . 19362 1 165 . 1 1 18 18 GLN HA H 1 4.047 0.040 . 1 . . . A 323 GLN HA . 19362 1 166 . 1 1 18 18 GLN HB2 H 1 2.267 0.040 . 2 . . . A 323 GLN HB2 . 19362 1 167 . 1 1 18 18 GLN HB3 H 1 2.144 0.040 . 2 . . . A 323 GLN HB3 . 19362 1 168 . 1 1 18 18 GLN HG2 H 1 2.518 0.040 . 2 . . . A 323 GLN HG2 . 19362 1 169 . 1 1 18 18 GLN HG3 H 1 2.389 0.040 . 2 . . . A 323 GLN HG3 . 19362 1 170 . 1 1 18 18 GLN C C 13 179.154 0.400 . 1 . . . A 323 GLN C . 19362 1 171 . 1 1 18 18 GLN CA C 13 59.318 0.091 . 1 . . . A 323 GLN CA . 19362 1 172 . 1 1 18 18 GLN CB C 13 28.449 0.122 . 1 . . . A 323 GLN CB . 19362 1 173 . 1 1 18 18 GLN CG C 13 34.51 0.400 . 1 . . . A 323 GLN CG . 19362 1 174 . 1 1 18 18 GLN N N 15 118.092 0.400 . 1 . . . A 323 GLN N . 19362 1 175 . 1 1 19 19 VAL H H 1 7.997 0.040 . 1 . . . A 324 VAL H . 19362 1 176 . 1 1 19 19 VAL HA H 1 3.625 0.040 . 1 . . . A 324 VAL HA . 19362 1 177 . 1 1 19 19 VAL HB H 1 2.175 0.040 . 1 . . . A 324 VAL HB . 19362 1 178 . 1 1 19 19 VAL HG11 H 1 0.845 0.040 . 2 . . . A 324 VAL HG11 . 19362 1 179 . 1 1 19 19 VAL HG12 H 1 0.845 0.040 . 2 . . . A 324 VAL HG12 . 19362 1 180 . 1 1 19 19 VAL HG13 H 1 0.845 0.040 . 2 . . . A 324 VAL HG13 . 19362 1 181 . 1 1 19 19 VAL HG21 H 1 0.975 0.040 . 2 . . . A 324 VAL HG21 . 19362 1 182 . 1 1 19 19 VAL HG22 H 1 0.975 0.040 . 2 . . . A 324 VAL HG22 . 19362 1 183 . 1 1 19 19 VAL HG23 H 1 0.975 0.040 . 2 . . . A 324 VAL HG23 . 19362 1 184 . 1 1 19 19 VAL C C 13 177.497 0.400 . 1 . . . A 324 VAL C . 19362 1 185 . 1 1 19 19 VAL CA C 13 66.727 0.042 . 1 . . . A 324 VAL CA . 19362 1 186 . 1 1 19 19 VAL CB C 13 31.67 0.042 . 1 . . . A 324 VAL CB . 19362 1 187 . 1 1 19 19 VAL CG1 C 13 22.562 0.400 . 2 . . . A 324 VAL CG1 . 19362 1 188 . 1 1 19 19 VAL CG2 C 13 21.626 0.400 . 2 . . . A 324 VAL CG2 . 19362 1 189 . 1 1 19 19 VAL N N 15 121.608 0.400 . 1 . . . A 324 VAL N . 19362 1 190 . 1 1 20 20 ARG H H 1 8.372 0.040 . 1 . . . A 325 ARG H . 19362 1 191 . 1 1 20 20 ARG HA H 1 3.904 0.040 . 1 . . . A 325 ARG HA . 19362 1 192 . 1 1 20 20 ARG HB2 H 1 1.771 0.040 . 2 . . . A 325 ARG HB2 . 19362 1 193 . 1 1 20 20 ARG HB3 H 1 1.771 0.040 . 2 . . . A 325 ARG HB3 . 19362 1 194 . 1 1 20 20 ARG HG2 H 1 1.635 0.040 . 2 . . . A 325 ARG HG2 . 19362 1 195 . 1 1 20 20 ARG HG3 H 1 1.635 0.040 . 2 . . . A 325 ARG HG3 . 19362 1 196 . 1 1 20 20 ARG HD2 H 1 2.917 0.040 . 2 . . . A 325 ARG HD2 . 19362 1 197 . 1 1 20 20 ARG HD3 H 1 2.917 0.040 . 2 . . . A 325 ARG HD3 . 19362 1 198 . 1 1 20 20 ARG C C 13 178.317 0.400 . 1 . . . A 325 ARG C . 19362 1 199 . 1 1 20 20 ARG CA C 13 60.599 0.063 . 1 . . . A 325 ARG CA . 19362 1 200 . 1 1 20 20 ARG CB C 13 30.212 0.021 . 1 . . . A 325 ARG CB . 19362 1 201 . 1 1 20 20 ARG CG C 13 28.176 0.400 . 1 . . . A 325 ARG CG . 19362 1 202 . 1 1 20 20 ARG CD C 13 41.851 0.400 . 1 . . . A 325 ARG CD . 19362 1 203 . 1 1 20 20 ARG N N 15 119.044 0.400 . 1 . . . A 325 ARG N . 19362 1 204 . 1 1 21 21 GLU H H 1 8.076 0.040 . 1 . . . A 326 GLU H . 19362 1 205 . 1 1 21 21 GLU HA H 1 4.094 0.040 . 1 . . . A 326 GLU HA . 19362 1 206 . 1 1 21 21 GLU HB2 H 1 2.099 0.040 . 2 . . . A 326 GLU HB2 . 19362 1 207 . 1 1 21 21 GLU HB3 H 1 2.099 0.040 . 2 . . . A 326 GLU HB3 . 19362 1 208 . 1 1 21 21 GLU HG2 H 1 2.339 0.040 . 2 . . . A 326 GLU HG2 . 19362 1 209 . 1 1 21 21 GLU HG3 H 1 2.339 0.040 . 2 . . . A 326 GLU HG3 . 19362 1 210 . 1 1 21 21 GLU C C 13 178.613 0.400 . 1 . . . A 326 GLU C . 19362 1 211 . 1 1 21 21 GLU CA C 13 59.313 0.155 . 1 . . . A 326 GLU CA . 19362 1 212 . 1 1 21 21 GLU CB C 13 29.274 0.169 . 1 . . . A 326 GLU CB . 19362 1 213 . 1 1 21 21 GLU CG C 13 35.877 0.400 . 1 . . . A 326 GLU CG . 19362 1 214 . 1 1 21 21 GLU N N 15 118.063 0.400 . 1 . . . A 326 GLU N . 19362 1 215 . 1 1 22 22 ALA H H 1 8.004 0.040 . 1 . . . A 327 ALA H . 19362 1 216 . 1 1 22 22 ALA HA H 1 4.09 0.040 . 1 . . . A 327 ALA HA . 19362 1 217 . 1 1 22 22 ALA HB1 H 1 1.539 0.040 . 1 . . . A 327 ALA HB1 . 19362 1 218 . 1 1 22 22 ALA HB2 H 1 1.539 0.040 . 1 . . . A 327 ALA HB2 . 19362 1 219 . 1 1 22 22 ALA HB3 H 1 1.539 0.040 . 1 . . . A 327 ALA HB3 . 19362 1 220 . 1 1 22 22 ALA C C 13 180.969 0.400 . 1 . . . A 327 ALA C . 19362 1 221 . 1 1 22 22 ALA CA C 13 55.584 0.026 . 1 . . . A 327 ALA CA . 19362 1 222 . 1 1 22 22 ALA CB C 13 17.696 0.019 . 1 . . . A 327 ALA CB . 19362 1 223 . 1 1 22 22 ALA N N 15 123.324 0.064 . 1 . . . A 327 ALA N . 19362 1 224 . 1 1 23 23 LEU H H 1 8.553 0.040 . 1 . . . A 328 LEU H . 19362 1 225 . 1 1 23 23 LEU HA H 1 4.135 0.040 . 1 . . . A 328 LEU HA . 19362 1 226 . 1 1 23 23 LEU HB2 H 1 1.92 0.040 . 2 . . . A 328 LEU HB2 . 19362 1 227 . 1 1 23 23 LEU HB3 H 1 1.92 0.040 . 2 . . . A 328 LEU HB3 . 19362 1 228 . 1 1 23 23 LEU HG H 1 1.478 0.040 . 1 . . . A 328 LEU HG . 19362 1 229 . 1 1 23 23 LEU HD11 H 1 0.725 0.040 . 2 . . . A 328 LEU HD11 . 19362 1 230 . 1 1 23 23 LEU HD12 H 1 0.725 0.040 . 2 . . . A 328 LEU HD12 . 19362 1 231 . 1 1 23 23 LEU HD13 H 1 0.725 0.040 . 2 . . . A 328 LEU HD13 . 19362 1 232 . 1 1 23 23 LEU HD21 H 1 0.735 0.040 . 2 . . . A 328 LEU HD21 . 19362 1 233 . 1 1 23 23 LEU HD22 H 1 0.735 0.040 . 2 . . . A 328 LEU HD22 . 19362 1 234 . 1 1 23 23 LEU HD23 H 1 0.735 0.040 . 2 . . . A 328 LEU HD23 . 19362 1 235 . 1 1 23 23 LEU C C 13 179.643 0.400 . 1 . . . A 328 LEU C . 19362 1 236 . 1 1 23 23 LEU CA C 13 58.193 0.037 . 1 . . . A 328 LEU CA . 19362 1 237 . 1 1 23 23 LEU CB C 13 41.725 0.008 . 1 . . . A 328 LEU CB . 19362 1 238 . 1 1 23 23 LEU CG C 13 26.809 0.400 . 1 . . . A 328 LEU CG . 19362 1 239 . 1 1 23 23 LEU CD1 C 13 25.441 0.400 . 2 . . . A 328 LEU CD1 . 19362 1 240 . 1 1 23 23 LEU CD2 C 13 22.994 0.400 . 2 . . . A 328 LEU CD2 . 19362 1 241 . 1 1 23 23 LEU N N 15 119.249 0.400 . 1 . . . A 328 LEU N . 19362 1 242 . 1 1 24 24 ARG H H 1 8.279 0.040 . 1 . . . A 329 ARG H . 19362 1 243 . 1 1 24 24 ARG HA H 1 4.121 0.040 . 1 . . . A 329 ARG HA . 19362 1 244 . 1 1 24 24 ARG HB2 H 1 1.946 0.040 . 2 . . . A 329 ARG HB2 . 19362 1 245 . 1 1 24 24 ARG HB3 H 1 1.946 0.040 . 2 . . . A 329 ARG HB3 . 19362 1 246 . 1 1 24 24 ARG HG2 H 1 1.635 0.040 . 2 . . . A 329 ARG HG2 . 19362 1 247 . 1 1 24 24 ARG HG3 H 1 1.635 0.040 . 2 . . . A 329 ARG HG3 . 19362 1 248 . 1 1 24 24 ARG HD2 H 1 3.197 0.040 . 2 . . . A 329 ARG HD2 . 19362 1 249 . 1 1 24 24 ARG HD3 H 1 3.197 0.040 . 2 . . . A 329 ARG HD3 . 19362 1 250 . 1 1 24 24 ARG C C 13 179.503 0.400 . 1 . . . A 329 ARG C . 19362 1 251 . 1 1 24 24 ARG CA C 13 59.723 0.133 . 1 . . . A 329 ARG CA . 19362 1 252 . 1 1 24 24 ARG CB C 13 30.282 0.074 . 1 . . . A 329 ARG CB . 19362 1 253 . 1 1 24 24 ARG CG C 13 28.104 0.400 . 1 . . . A 329 ARG CG . 19362 1 254 . 1 1 24 24 ARG CD C 13 43.722 0.400 . 1 . . . A 329 ARG CD . 19362 1 255 . 1 1 24 24 ARG N N 15 120.249 0.400 . 1 . . . A 329 ARG N . 19362 1 256 . 1 1 25 25 LYS H H 1 8.084 0.040 . 1 . . . A 330 LYS H . 19362 1 257 . 1 1 25 25 LYS HA H 1 3.953 0.040 . 1 . . . A 330 LYS HA . 19362 1 258 . 1 1 25 25 LYS HB2 H 1 1.924 0.040 . 2 . . . A 330 LYS HB2 . 19362 1 259 . 1 1 25 25 LYS HB3 H 1 1.924 0.040 . 2 . . . A 330 LYS HB3 . 19362 1 260 . 1 1 25 25 LYS HG2 H 1 1.368 0.040 . 2 . . . A 330 LYS HG2 . 19362 1 261 . 1 1 25 25 LYS HG3 H 1 1.368 0.040 . 2 . . . A 330 LYS HG3 . 19362 1 262 . 1 1 25 25 LYS HD2 H 1 1.652 0.040 . 2 . . . A 330 LYS HD2 . 19362 1 263 . 1 1 25 25 LYS HD3 H 1 1.652 0.040 . 2 . . . A 330 LYS HD3 . 19362 1 264 . 1 1 25 25 LYS C C 13 179.032 0.400 . 1 . . . A 330 LYS C . 19362 1 265 . 1 1 25 25 LYS CA C 13 59.822 0.031 . 1 . . . A 330 LYS CA . 19362 1 266 . 1 1 25 25 LYS CB C 13 32.437 0.035 . 1 . . . A 330 LYS CB . 19362 1 267 . 1 1 25 25 LYS CG C 13 26.089 0.400 . 1 . . . A 330 LYS CG . 19362 1 268 . 1 1 25 25 LYS CD C 13 29.975 0.400 . 1 . . . A 330 LYS CD . 19362 1 269 . 1 1 25 25 LYS CE C 13 42.427 0.400 . 1 . . . A 330 LYS CE . 19362 1 270 . 1 1 25 25 LYS N N 15 119.85 0.400 . 1 . . . A 330 LYS N . 19362 1 271 . 1 1 26 26 ALA H H 1 8.156 0.040 . 1 . . . A 331 ALA H . 19362 1 272 . 1 1 26 26 ALA HA H 1 4.072 0.040 . 1 . . . A 331 ALA HA . 19362 1 273 . 1 1 26 26 ALA HB1 H 1 1.488 0.040 . 1 . . . A 331 ALA HB1 . 19362 1 274 . 1 1 26 26 ALA HB2 H 1 1.488 0.040 . 1 . . . A 331 ALA HB2 . 19362 1 275 . 1 1 26 26 ALA HB3 H 1 1.488 0.040 . 1 . . . A 331 ALA HB3 . 19362 1 276 . 1 1 26 26 ALA C C 13 179.276 0.400 . 1 . . . A 331 ALA C . 19362 1 277 . 1 1 26 26 ALA CA C 13 55.218 0.01 . 1 . . . A 331 ALA CA . 19362 1 278 . 1 1 26 26 ALA CB C 13 17.969 0.017 . 1 . . . A 331 ALA CB . 19362 1 279 . 1 1 26 26 ALA N N 15 122.296 0.400 . 1 . . . A 331 ALA N . 19362 1 280 . 1 1 27 27 GLU H H 1 8.311 0.040 . 1 . . . A 332 GLU H . 19362 1 281 . 1 1 27 27 GLU HA H 1 3.527 0.040 . 1 . . . A 332 GLU HA . 19362 1 282 . 1 1 27 27 GLU HB2 H 1 2.088 0.040 . 2 . . . A 332 GLU HB2 . 19362 1 283 . 1 1 27 27 GLU HB3 H 1 2.088 0.040 . 2 . . . A 332 GLU HB3 . 19362 1 284 . 1 1 27 27 GLU HG2 H 1 2.153 0.040 . 2 . . . A 332 GLU HG2 . 19362 1 285 . 1 1 27 27 GLU HG3 H 1 2.153 0.040 . 2 . . . A 332 GLU HG3 . 19362 1 286 . 1 1 27 27 GLU C C 13 178.142 0.400 . 1 . . . A 332 GLU C . 19362 1 287 . 1 1 27 27 GLU CA C 13 59.75 0.078 . 1 . . . A 332 GLU CA . 19362 1 288 . 1 1 27 27 GLU CB C 13 29.014 0.042 . 1 . . . A 332 GLU CB . 19362 1 289 . 1 1 27 27 GLU CG C 13 35.23 0.400 . 1 . . . A 332 GLU CG . 19362 1 290 . 1 1 27 27 GLU N N 15 118.063 0.400 . 1 . . . A 332 GLU N . 19362 1 291 . 1 1 28 28 LYS H H 1 7.694 0.040 . 1 . . . A 333 LYS H . 19362 1 292 . 1 1 28 28 LYS HA H 1 4.006 0.040 . 1 . . . A 333 LYS HA . 19362 1 293 . 1 1 28 28 LYS HB2 H 1 1.908 0.040 . 2 . . . A 333 LYS HB2 . 19362 1 294 . 1 1 28 28 LYS HB3 H 1 1.908 0.040 . 2 . . . A 333 LYS HB3 . 19362 1 295 . 1 1 28 28 LYS HG2 H 1 1.506 0.040 . 2 . . . A 333 LYS HG2 . 19362 1 296 . 1 1 28 28 LYS HG3 H 1 1.506 0.040 . 2 . . . A 333 LYS HG3 . 19362 1 297 . 1 1 28 28 LYS HD2 H 1 1.642 0.040 . 2 . . . A 333 LYS HD2 . 19362 1 298 . 1 1 28 28 LYS HD3 H 1 1.642 0.040 . 2 . . . A 333 LYS HD3 . 19362 1 299 . 1 1 28 28 LYS C C 13 179.66 0.400 . 1 . . . A 333 LYS C . 19362 1 300 . 1 1 28 28 LYS CA C 13 58.48 0.031 . 1 . . . A 333 LYS CA . 19362 1 301 . 1 1 28 28 LYS CB C 13 31.946 0.015 . 1 . . . A 333 LYS CB . 19362 1 302 . 1 1 28 28 LYS CG C 13 26.737 0.400 . 1 . . . A 333 LYS CG . 19362 1 303 . 1 1 28 28 LYS CD C 13 29.256 0.400 . 1 . . . A 333 LYS CD . 19362 1 304 . 1 1 28 28 LYS CE C 13 42.427 0.400 . 1 . . . A 333 LYS CE . 19362 1 305 . 1 1 28 28 LYS N N 15 117.403 0.400 . 1 . . . A 333 LYS N . 19362 1 306 . 1 1 29 29 GLU H H 1 7.911 0.040 . 1 . . . A 334 GLU H . 19362 1 307 . 1 1 29 29 GLU HA H 1 4.05 0.040 . 1 . . . A 334 GLU HA . 19362 1 308 . 1 1 29 29 GLU HB2 H 1 2.104 0.040 . 2 . . . A 334 GLU HB2 . 19362 1 309 . 1 1 29 29 GLU HB3 H 1 2.05 0.040 . 2 . . . A 334 GLU HB3 . 19362 1 310 . 1 1 29 29 GLU HG2 H 1 2.27 0.040 . 2 . . . A 334 GLU HG2 . 19362 1 311 . 1 1 29 29 GLU HG3 H 1 2.27 0.040 . 2 . . . A 334 GLU HG3 . 19362 1 312 . 1 1 29 29 GLU C C 13 179.102 0.400 . 1 . . . A 334 GLU C . 19362 1 313 . 1 1 29 29 GLU CA C 13 59.175 0.017 . 1 . . . A 334 GLU CA . 19362 1 314 . 1 1 29 29 GLU CB C 13 29.152 0.003 . 1 . . . A 334 GLU CB . 19362 1 315 . 1 1 29 29 GLU CG C 13 35.877 0.400 . 1 . . . A 334 GLU CG . 19362 1 316 . 1 1 29 29 GLU N N 15 120.483 0.400 . 1 . . . A 334 GLU N . 19362 1 317 . 1 1 30 30 LEU H H 1 8.179 0.040 . 1 . . . A 335 LEU H . 19362 1 318 . 1 1 30 30 LEU HA H 1 3.902 0.040 . 1 . . . A 335 LEU HA . 19362 1 319 . 1 1 30 30 LEU HB2 H 1 1.623 0.040 . 2 . . . A 335 LEU HB2 . 19362 1 320 . 1 1 30 30 LEU HB3 H 1 1.623 0.040 . 2 . . . A 335 LEU HB3 . 19362 1 321 . 1 1 30 30 LEU HG H 1 1.303 0.040 . 1 . . . A 335 LEU HG . 19362 1 322 . 1 1 30 30 LEU HD11 H 1 0.485 0.040 . 2 . . . A 335 LEU HD11 . 19362 1 323 . 1 1 30 30 LEU HD12 H 1 0.485 0.040 . 2 . . . A 335 LEU HD12 . 19362 1 324 . 1 1 30 30 LEU HD13 H 1 0.485 0.040 . 2 . . . A 335 LEU HD13 . 19362 1 325 . 1 1 30 30 LEU HD21 H 1 0.496 0.040 . 2 . . . A 335 LEU HD21 . 19362 1 326 . 1 1 30 30 LEU HD22 H 1 0.496 0.040 . 2 . . . A 335 LEU HD22 . 19362 1 327 . 1 1 30 30 LEU HD23 H 1 0.496 0.040 . 2 . . . A 335 LEU HD23 . 19362 1 328 . 1 1 30 30 LEU C C 13 179.311 0.400 . 1 . . . A 335 LEU C . 19362 1 329 . 1 1 30 30 LEU CA C 13 58.231 0.008 . 1 . . . A 335 LEU CA . 19362 1 330 . 1 1 30 30 LEU CB C 13 41.68 0.083 . 1 . . . A 335 LEU CB . 19362 1 331 . 1 1 30 30 LEU CG C 13 27.096 0.400 . 1 . . . A 335 LEU CG . 19362 1 332 . 1 1 30 30 LEU CD1 C 13 24.865 0.400 . 2 . . . A 335 LEU CD1 . 19362 1 333 . 1 1 30 30 LEU CD2 C 13 23.426 0.400 . 2 . . . A 335 LEU CD2 . 19362 1 334 . 1 1 30 30 LEU N N 15 120.905 0.400 . 1 . . . A 335 LEU N . 19362 1 335 . 1 1 31 31 GLU H H 1 8.133 0.040 . 1 . . . A 336 GLU H . 19362 1 336 . 1 1 31 31 GLU HA H 1 3.909 0.040 . 1 . . . A 336 GLU HA . 19362 1 337 . 1 1 31 31 GLU HB2 H 1 2.033 0.040 . 2 . . . A 336 GLU HB2 . 19362 1 338 . 1 1 31 31 GLU HB3 H 1 2.033 0.040 . 2 . . . A 336 GLU HB3 . 19362 1 339 . 1 1 31 31 GLU HG2 H 1 2.393 0.040 . 2 . . . A 336 GLU HG2 . 19362 1 340 . 1 1 31 31 GLU HG3 H 1 2.197 0.040 . 2 . . . A 336 GLU HG3 . 19362 1 341 . 1 1 31 31 GLU C C 13 178.369 0.400 . 1 . . . A 336 GLU C . 19362 1 342 . 1 1 31 31 GLU CA C 13 58.703 0.118 . 1 . . . A 336 GLU CA . 19362 1 343 . 1 1 31 31 GLU CB C 13 29.667 0.097 . 1 . . . A 336 GLU CB . 19362 1 344 . 1 1 31 31 GLU CG C 13 36.021 0.400 . 1 . . . A 336 GLU CG . 19362 1 345 . 1 1 31 31 GLU N N 15 117.321 0.400 . 1 . . . A 336 GLU N . 19362 1 346 . 1 1 32 32 SER H H 1 7.784 0.040 . 1 . . . A 337 SER H . 19362 1 347 . 1 1 32 32 SER HA H 1 4.247 0.040 . 1 . . . A 337 SER HA . 19362 1 348 . 1 1 32 32 SER HB2 H 1 3.756 0.040 . 2 . . . A 337 SER HB2 . 19362 1 349 . 1 1 32 32 SER HB3 H 1 3.756 0.040 . 2 . . . A 337 SER HB3 . 19362 1 350 . 1 1 32 32 SER C C 13 174.792 0.400 . 1 . . . A 337 SER C . 19362 1 351 . 1 1 32 32 SER CA C 13 59.939 0.039 . 1 . . . A 337 SER CA . 19362 1 352 . 1 1 32 32 SER CB C 13 63.686 0.017 . 1 . . . A 337 SER CB . 19362 1 353 . 1 1 32 32 SER N N 15 112.613 0.400 . 1 . . . A 337 SER N . 19362 1 354 . 1 1 33 33 HIS H H 1 7.827 0.040 . 1 . . . A 338 HIS H . 19362 1 355 . 1 1 33 33 HIS HA H 1 4.672 0.040 . 1 . . . A 338 HIS HA . 19362 1 356 . 1 1 33 33 HIS HB2 H 1 2.971 0.040 . 2 . . . A 338 HIS HB2 . 19362 1 357 . 1 1 33 33 HIS HB3 H 1 2.971 0.040 . 2 . . . A 338 HIS HB3 . 19362 1 358 . 1 1 33 33 HIS C C 13 174.827 0.400 . 1 . . . A 338 HIS C . 19362 1 359 . 1 1 33 33 HIS CA C 13 55.514 0.033 . 1 . . . A 338 HIS CA . 19362 1 360 . 1 1 33 33 HIS CB C 13 28.796 0.05 . 1 . . . A 338 HIS CB . 19362 1 361 . 1 1 33 33 HIS N N 15 118.649 0.400 . 1 . . . A 338 HIS N . 19362 1 362 . 1 1 34 34 SER H H 1 7.95 0.040 . 1 . . . A 339 SER H . 19362 1 363 . 1 1 34 34 SER HA H 1 4.269 0.040 . 1 . . . A 339 SER HA . 19362 1 364 . 1 1 34 34 SER HB2 H 1 3.876 0.040 . 2 . . . A 339 SER HB2 . 19362 1 365 . 1 1 34 34 SER HB3 H 1 3.876 0.040 . 2 . . . A 339 SER HB3 . 19362 1 366 . 1 1 34 34 SER C C 13 175.159 0.400 . 1 . . . A 339 SER C . 19362 1 367 . 1 1 34 34 SER CA C 13 60.454 0.082 . 1 . . . A 339 SER CA . 19362 1 368 . 1 1 34 34 SER CB C 13 63.508 0.038 . 1 . . . A 339 SER CB . 19362 1 369 . 1 1 34 34 SER N N 15 115.44 0.400 . 1 . . . A 339 SER N . 19362 1 370 . 1 1 35 35 SER H H 1 8.11 0.040 . 1 . . . A 340 SER H . 19362 1 371 . 1 1 35 35 SER HA H 1 4.334 0.040 . 1 . . . A 340 SER HA . 19362 1 372 . 1 1 35 35 SER HB2 H 1 3.778 0.040 . 2 . . . A 340 SER HB2 . 19362 1 373 . 1 1 35 35 SER HB3 H 1 3.778 0.040 . 2 . . . A 340 SER HB3 . 19362 1 374 . 1 1 35 35 SER C C 13 174.531 0.400 . 1 . . . A 340 SER C . 19362 1 375 . 1 1 35 35 SER CA C 13 59.46 0.001 . 1 . . . A 340 SER CA . 19362 1 376 . 1 1 35 35 SER CB C 13 63.644 0.067 . 1 . . . A 340 SER CB . 19362 1 377 . 1 1 35 35 SER N N 15 115.411 0.400 . 1 . . . A 340 SER N . 19362 1 378 . 1 1 36 36 TRP H H 1 7.937 0.040 . 1 . . . A 341 TRP H . 19362 1 379 . 1 1 36 36 TRP HA H 1 4.52 0.040 . 1 . . . A 341 TRP HA . 19362 1 380 . 1 1 36 36 TRP HB2 H 1 3.036 0.040 . 2 . . . A 341 TRP HB2 . 19362 1 381 . 1 1 36 36 TRP HB3 H 1 3.036 0.040 . 2 . . . A 341 TRP HB3 . 19362 1 382 . 1 1 36 36 TRP HE1 H 1 9.891 0.008 . 1 . . . A 341 TRP HE1 . 19362 1 383 . 1 1 36 36 TRP C C 13 175.473 0.400 . 1 . . . A 341 TRP C . 19362 1 384 . 1 1 36 36 TRP CA C 13 57.359 0.069 . 1 . . . A 341 TRP CA . 19362 1 385 . 1 1 36 36 TRP CB C 13 29.552 0.023 . 1 . . . A 341 TRP CB . 19362 1 386 . 1 1 36 36 TRP N N 15 121.124 0.400 . 1 . . . A 341 TRP N . 19362 1 387 . 1 1 36 36 TRP NE1 N 15 127.981 0.400 . 1 . . . A 341 TRP NE1 . 19362 1 388 . 1 1 37 37 TYR H H 1 7.49 0.040 . 1 . . . A 342 TYR H . 19362 1 389 . 1 1 37 37 TYR HA H 1 4.485 0.040 . 1 . . . A 342 TYR HA . 19362 1 390 . 1 1 37 37 TYR HB2 H 1 2.835 0.040 . 2 . . . A 342 TYR HB2 . 19362 1 391 . 1 1 37 37 TYR HB3 H 1 2.703 0.040 . 2 . . . A 342 TYR HB3 . 19362 1 392 . 1 1 37 37 TYR C C 13 174.565 0.400 . 1 . . . A 342 TYR C . 19362 1 393 . 1 1 37 37 TYR CA C 13 57.243 0.189 . 1 . . . A 342 TYR CA . 19362 1 394 . 1 1 37 37 TYR CB C 13 39.528 0.016 . 1 . . . A 342 TYR CB . 19362 1 395 . 1 1 37 37 TYR N N 15 118.854 0.400 . 1 . . . A 342 TYR N . 19362 1 396 . 1 1 38 38 ALA H H 1 7.91 0.040 . 1 . . . A 343 ALA H . 19362 1 397 . 1 1 38 38 ALA CA C 13 51.389 0.400 . 1 . . . A 343 ALA CA . 19362 1 398 . 1 1 38 38 ALA CB C 13 18.275 0.400 . 1 . . . A 343 ALA CB . 19362 1 399 . 1 1 38 38 ALA N N 15 125.05 0.400 . 1 . . . A 343 ALA N . 19362 1 400 . 1 1 39 39 PRO HA H 1 4.225 0.040 . 1 . . . A 344 PRO HA . 19362 1 401 . 1 1 39 39 PRO HB2 H 1 2.317 0.040 . 2 . . . A 344 PRO HB2 . 19362 1 402 . 1 1 39 39 PRO HB3 H 1 2.317 0.040 . 2 . . . A 344 PRO HB3 . 19362 1 403 . 1 1 39 39 PRO HG2 H 1 1.902 0.040 . 2 . . . A 344 PRO HG2 . 19362 1 404 . 1 1 39 39 PRO HG3 H 1 1.902 0.040 . 2 . . . A 344 PRO HG3 . 19362 1 405 . 1 1 39 39 PRO C C 13 178.317 0.400 . 1 . . . A 344 PRO C . 19362 1 406 . 1 1 39 39 PRO CA C 13 65.458 0.400 . 1 . . . A 344 PRO CA . 19362 1 407 . 1 1 39 39 PRO CB C 13 31.514 0.400 . 1 . . . A 344 PRO CB . 19362 1 408 . 1 1 39 39 PRO CG C 13 28.032 0.400 . 1 . . . A 344 PRO CG . 19362 1 409 . 1 1 39 39 PRO CD C 13 50.488 0.400 . 1 . . . A 344 PRO CD . 19362 1 410 . 1 1 40 40 GLU H H 1 8.846 0.040 . 1 . . . A 345 GLU H . 19362 1 411 . 1 1 40 40 GLU HA H 1 4.029 0.040 . 1 . . . A 345 GLU HA . 19362 1 412 . 1 1 40 40 GLU HB2 H 1 2.011 0.040 . 2 . . . A 345 GLU HB2 . 19362 1 413 . 1 1 40 40 GLU HB3 H 1 2.011 0.040 . 2 . . . A 345 GLU HB3 . 19362 1 414 . 1 1 40 40 GLU HG2 H 1 2.295 0.040 . 2 . . . A 345 GLU HG2 . 19362 1 415 . 1 1 40 40 GLU HG3 H 1 2.295 0.040 . 2 . . . A 345 GLU HG3 . 19362 1 416 . 1 1 40 40 GLU C C 13 178.177 0.400 . 1 . . . A 345 GLU C . 19362 1 417 . 1 1 40 40 GLU CA C 13 59.744 0.016 . 1 . . . A 345 GLU CA . 19362 1 418 . 1 1 40 40 GLU CB C 13 29.133 0.009 . 1 . . . A 345 GLU CB . 19362 1 419 . 1 1 40 40 GLU CG C 13 36.741 0.400 . 1 . . . A 345 GLU CG . 19362 1 420 . 1 1 40 40 GLU N N 15 117.213 0.400 . 1 . . . A 345 GLU N . 19362 1 421 . 1 1 41 41 ALA H H 1 7.827 0.040 . 1 . . . A 346 ALA H . 19362 1 422 . 1 1 41 41 ALA HA H 1 4.094 0.040 . 1 . . . A 346 ALA HA . 19362 1 423 . 1 1 41 41 ALA HB1 H 1 1.461 0.040 . 1 . . . A 346 ALA HB1 . 19362 1 424 . 1 1 41 41 ALA HB2 H 1 1.461 0.040 . 1 . . . A 346 ALA HB2 . 19362 1 425 . 1 1 41 41 ALA HB3 H 1 1.461 0.040 . 1 . . . A 346 ALA HB3 . 19362 1 426 . 1 1 41 41 ALA C C 13 179.398 0.400 . 1 . . . A 346 ALA C . 19362 1 427 . 1 1 41 41 ALA CA C 13 55.146 0.007 . 1 . . . A 346 ALA CA . 19362 1 428 . 1 1 41 41 ALA CB C 13 18.576 0.151 . 1 . . . A 346 ALA CB . 19362 1 429 . 1 1 41 41 ALA N N 15 121.754 0.400 . 1 . . . A 346 ALA N . 19362 1 430 . 1 1 42 42 LEU H H 1 7.712 0.040 . 1 . . . A 347 LEU H . 19362 1 431 . 1 1 42 42 LEU HA H 1 3.782 0.040 . 1 . . . A 347 LEU HA . 19362 1 432 . 1 1 42 42 LEU HB2 H 1 1.89 0.040 . 2 . . . A 347 LEU HB2 . 19362 1 433 . 1 1 42 42 LEU HB3 H 1 1.89 0.040 . 2 . . . A 347 LEU HB3 . 19362 1 434 . 1 1 42 42 LEU HG H 1 1.302 0.040 . 1 . . . A 347 LEU HG . 19362 1 435 . 1 1 42 42 LEU HD11 H 1 0.794 0.040 . 2 . . . A 347 LEU HD11 . 19362 1 436 . 1 1 42 42 LEU HD12 H 1 0.794 0.040 . 2 . . . A 347 LEU HD12 . 19362 1 437 . 1 1 42 42 LEU HD13 H 1 0.794 0.040 . 2 . . . A 347 LEU HD13 . 19362 1 438 . 1 1 42 42 LEU HD21 H 1 0.849 0.040 . 2 . . . A 347 LEU HD21 . 19362 1 439 . 1 1 42 42 LEU HD22 H 1 0.849 0.040 . 2 . . . A 347 LEU HD22 . 19362 1 440 . 1 1 42 42 LEU HD23 H 1 0.849 0.040 . 2 . . . A 347 LEU HD23 . 19362 1 441 . 1 1 42 42 LEU C C 13 179.468 0.400 . 1 . . . A 347 LEU C . 19362 1 442 . 1 1 42 42 LEU CA C 13 58.163 0.059 . 1 . . . A 347 LEU CA . 19362 1 443 . 1 1 42 42 LEU CB C 13 41.915 0.119 . 1 . . . A 347 LEU CB . 19362 1 444 . 1 1 42 42 LEU CG C 13 27.888 0.400 . 1 . . . A 347 LEU CG . 19362 1 445 . 1 1 42 42 LEU CD1 C 13 24.865 0.400 . 2 . . . A 347 LEU CD1 . 19362 1 446 . 1 1 42 42 LEU CD2 C 13 22.994 0.400 . 2 . . . A 347 LEU CD2 . 19362 1 447 . 1 1 42 42 LEU N N 15 118.18 0.400 . 1 . . . A 347 LEU N . 19362 1 448 . 1 1 43 43 GLN H H 1 8.08 0.040 . 1 . . . A 348 GLN H . 19362 1 449 . 1 1 43 43 GLN HA H 1 3.933 0.040 . 1 . . . A 348 GLN HA . 19362 1 450 . 1 1 43 43 GLN HB2 H 1 2.13 0.040 . 2 . . . A 348 GLN HB2 . 19362 1 451 . 1 1 43 43 GLN HB3 H 1 2.13 0.040 . 2 . . . A 348 GLN HB3 . 19362 1 452 . 1 1 43 43 GLN HG2 H 1 2.433 0.040 . 2 . . . A 348 GLN HG2 . 19362 1 453 . 1 1 43 43 GLN HG3 H 1 2.308 0.040 . 2 . . . A 348 GLN HG3 . 19362 1 454 . 1 1 43 43 GLN C C 13 178.596 0.400 . 1 . . . A 348 GLN C . 19362 1 455 . 1 1 43 43 GLN CA C 13 59.698 0.18 . 1 . . . A 348 GLN CA . 19362 1 456 . 1 1 43 43 GLN CB C 13 28.615 0.036 . 1 . . . A 348 GLN CB . 19362 1 457 . 1 1 43 43 GLN CG C 13 34.15 0.400 . 1 . . . A 348 GLN CG . 19362 1 458 . 1 1 43 43 GLN N N 15 118.557 0.400 . 1 . . . A 348 GLN N . 19362 1 459 . 1 1 44 44 LYS H H 1 7.893 0.040 . 1 . . . A 349 LYS H . 19362 1 460 . 1 1 44 44 LYS HA H 1 4.062 0.040 . 1 . . . A 349 LYS HA . 19362 1 461 . 1 1 44 44 LYS HB2 H 1 1.951 0.040 . 2 . . . A 349 LYS HB2 . 19362 1 462 . 1 1 44 44 LYS HB3 H 1 1.951 0.040 . 2 . . . A 349 LYS HB3 . 19362 1 463 . 1 1 44 44 LYS HG2 H 1 1.551 0.040 . 2 . . . A 349 LYS HG2 . 19362 1 464 . 1 1 44 44 LYS HG3 H 1 1.551 0.040 . 2 . . . A 349 LYS HG3 . 19362 1 465 . 1 1 44 44 LYS HD2 H 1 1.873 0.040 . 2 . . . A 349 LYS HD2 . 19362 1 466 . 1 1 44 44 LYS HD3 H 1 1.873 0.040 . 2 . . . A 349 LYS HD3 . 19362 1 467 . 1 1 44 44 LYS HE2 H 1 3.084 0.040 . 2 . . . A 349 LYS HE2 . 19362 1 468 . 1 1 44 44 LYS HE3 H 1 3.084 0.040 . 2 . . . A 349 LYS HE3 . 19362 1 469 . 1 1 44 44 LYS C C 13 178.299 0.400 . 1 . . . A 349 LYS C . 19362 1 470 . 1 1 44 44 LYS CA C 13 59.581 0.094 . 1 . . . A 349 LYS CA . 19362 1 471 . 1 1 44 44 LYS CB C 13 32.1 0.059 . 1 . . . A 349 LYS CB . 19362 1 472 . 1 1 44 44 LYS CG C 13 25.441 0.400 . 1 . . . A 349 LYS CG . 19362 1 473 . 1 1 44 44 LYS CD C 13 29.616 0.400 . 1 . . . A 349 LYS CD . 19362 1 474 . 1 1 44 44 LYS CE C 13 42.283 0.400 . 1 . . . A 349 LYS CE . 19362 1 475 . 1 1 44 44 LYS N N 15 118.707 0.400 . 1 . . . A 349 LYS N . 19362 1 476 . 1 1 45 45 TRP H H 1 8.231 0.040 . 1 . . . A 350 TRP H . 19362 1 477 . 1 1 45 45 TRP HA H 1 4.21 0.040 . 1 . . . A 350 TRP HA . 19362 1 478 . 1 1 45 45 TRP HB2 H 1 3.473 0.040 . 2 . . . A 350 TRP HB2 . 19362 1 479 . 1 1 45 45 TRP HB3 H 1 3.252 0.040 . 2 . . . A 350 TRP HB3 . 19362 1 480 . 1 1 45 45 TRP HE1 H 1 9.75 0.008 . 1 . . . A 350 TRP HE1 . 19362 1 481 . 1 1 45 45 TRP C C 13 179.084 0.400 . 1 . . . A 350 TRP C . 19362 1 482 . 1 1 45 45 TRP CA C 13 61.477 0.049 . 1 . . . A 350 TRP CA . 19362 1 483 . 1 1 45 45 TRP CB C 13 29.157 0.096 . 1 . . . A 350 TRP CB . 19362 1 484 . 1 1 45 45 TRP N N 15 120.963 0.400 . 1 . . . A 350 TRP N . 19362 1 485 . 1 1 45 45 TRP NE1 N 15 126.809 0.400 . 1 . . . A 350 TRP NE1 . 19362 1 486 . 1 1 46 46 LEU H H 1 8.788 0.040 . 1 . . . A 351 LEU H . 19362 1 487 . 1 1 46 46 LEU HA H 1 4.144 0.040 . 1 . . . A 351 LEU HA . 19362 1 488 . 1 1 46 46 LEU HB2 H 1 1.756 0.040 . 2 . . . A 351 LEU HB2 . 19362 1 489 . 1 1 46 46 LEU HB3 H 1 1.614 0.040 . 2 . . . A 351 LEU HB3 . 19362 1 490 . 1 1 46 46 LEU HG H 1 1.446 0.040 . 1 . . . A 351 LEU HG . 19362 1 491 . 1 1 46 46 LEU HD11 H 1 0.846 0.040 . 2 . . . A 351 LEU HD11 . 19362 1 492 . 1 1 46 46 LEU HD12 H 1 0.846 0.040 . 2 . . . A 351 LEU HD12 . 19362 1 493 . 1 1 46 46 LEU HD13 H 1 0.846 0.040 . 2 . . . A 351 LEU HD13 . 19362 1 494 . 1 1 46 46 LEU HD21 H 1 0.856 0.040 . 2 . . . A 351 LEU HD21 . 19362 1 495 . 1 1 46 46 LEU HD22 H 1 0.856 0.040 . 2 . . . A 351 LEU HD22 . 19362 1 496 . 1 1 46 46 LEU HD23 H 1 0.856 0.040 . 2 . . . A 351 LEU HD23 . 19362 1 497 . 1 1 46 46 LEU C C 13 178.509 0.400 . 1 . . . A 351 LEU C . 19362 1 498 . 1 1 46 46 LEU CA C 13 58.257 0.094 . 1 . . . A 351 LEU CA . 19362 1 499 . 1 1 46 46 LEU CB C 13 41.861 0.035 . 1 . . . A 351 LEU CB . 19362 1 500 . 1 1 46 46 LEU CG C 13 27.528 0.400 . 1 . . . A 351 LEU CG . 19362 1 501 . 1 1 46 46 LEU CD1 C 13 24.361 0.400 . 2 . . . A 351 LEU CD1 . 19362 1 502 . 1 1 46 46 LEU CD2 C 13 18.819 0.400 . 2 . . . A 351 LEU CD2 . 19362 1 503 . 1 1 46 46 LEU N N 15 120.875 0.400 . 1 . . . A 351 LEU N . 19362 1 504 . 1 1 47 47 GLN H H 1 8.041 0.040 . 1 . . . A 352 GLN H . 19362 1 505 . 1 1 47 47 GLN HA H 1 3.964 0.040 . 1 . . . A 352 GLN HA . 19362 1 506 . 1 1 47 47 GLN HB2 H 1 2.316 0.040 . 2 . . . A 352 GLN HB2 . 19362 1 507 . 1 1 47 47 GLN HB3 H 1 2.167 0.040 . 2 . . . A 352 GLN HB3 . 19362 1 508 . 1 1 47 47 GLN HG2 H 1 2.52 0.040 . 2 . . . A 352 GLN HG2 . 19362 1 509 . 1 1 47 47 GLN HG3 H 1 2.52 0.040 . 2 . . . A 352 GLN HG3 . 19362 1 510 . 1 1 47 47 GLN C C 13 178.561 0.400 . 1 . . . A 352 GLN C . 19362 1 511 . 1 1 47 47 GLN CA C 13 59.567 0.024 . 1 . . . A 352 GLN CA . 19362 1 512 . 1 1 47 47 GLN CB C 13 28.446 0.035 . 1 . . . A 352 GLN CB . 19362 1 513 . 1 1 47 47 GLN CG C 13 34.15 0.400 . 1 . . . A 352 GLN CG . 19362 1 514 . 1 1 47 47 GLN N N 15 116.803 0.400 . 1 . . . A 352 GLN N . 19362 1 515 . 1 1 48 48 LEU H H 1 8.344 0.040 . 1 . . . A 353 LEU H . 19362 1 516 . 1 1 48 48 LEU HA H 1 4.051 0.040 . 1 . . . A 353 LEU HA . 19362 1 517 . 1 1 48 48 LEU HB2 H 1 1.671 0.040 . 2 . . . A 353 LEU HB2 . 19362 1 518 . 1 1 48 48 LEU HB3 H 1 1.567 0.040 . 2 . . . A 353 LEU HB3 . 19362 1 519 . 1 1 48 48 LEU HG H 1 1.383 0.040 . 1 . . . A 353 LEU HG . 19362 1 520 . 1 1 48 48 LEU HD11 H 1 0.864 0.076 . 2 . . . A 353 LEU HD11 . 19362 1 521 . 1 1 48 48 LEU HD12 H 1 0.864 0.076 . 2 . . . A 353 LEU HD12 . 19362 1 522 . 1 1 48 48 LEU HD13 H 1 0.864 0.076 . 2 . . . A 353 LEU HD13 . 19362 1 523 . 1 1 48 48 LEU C C 13 178.666 0.400 . 1 . . . A 353 LEU C . 19362 1 524 . 1 1 48 48 LEU CA C 13 58.389 0.009 . 1 . . . A 353 LEU CA . 19362 1 525 . 1 1 48 48 LEU CB C 13 42.17 0.13 . 1 . . . A 353 LEU CB . 19362 1 526 . 1 1 48 48 LEU CG C 13 27.025 0.400 . 1 . . . A 353 LEU CG . 19362 1 527 . 1 1 48 48 LEU CD1 C 13 24.433 0.400 . 2 . . . A 353 LEU CD1 . 19362 1 528 . 1 1 48 48 LEU CD2 C 13 19.251 0.400 . 2 . . . A 353 LEU CD2 . 19362 1 529 . 1 1 48 48 LEU N N 15 121.08 0.400 . 1 . . . A 353 LEU N . 19362 1 530 . 1 1 49 49 THR H H 1 8.188 0.040 . 1 . . . A 354 THR H . 19362 1 531 . 1 1 49 49 THR C C 13 175.857 0.400 . 1 . . . A 354 THR C . 19362 1 532 . 1 1 49 49 THR CA C 13 66.706 0.007 . 1 . . . A 354 THR CA . 19362 1 533 . 1 1 49 49 THR CB C 13 68.681 0.119 . 1 . . . A 354 THR CB . 19362 1 534 . 1 1 49 49 THR N N 15 111.749 0.400 . 1 . . . A 354 THR N . 19362 1 535 . 1 1 50 50 HIS H H 1 7.928 0.040 . 1 . . . A 355 HIS H . 19362 1 536 . 1 1 50 50 HIS CA C 13 59.217 0.400 . 1 . . . A 355 HIS CA . 19362 1 537 . 1 1 50 50 HIS CB C 13 33.204 0.400 . 1 . . . A 355 HIS CB . 19362 1 538 . 1 1 50 50 HIS N N 15 119.352 0.400 . 1 . . . A 355 HIS N . 19362 1 539 . 1 1 51 51 GLU HA H 1 3.924 0.040 . 1 . . . A 356 GLU HA . 19362 1 540 . 1 1 51 51 GLU HB2 H 1 2.231 0.040 . 2 . . . A 356 GLU HB2 . 19362 1 541 . 1 1 51 51 GLU HB3 H 1 2.09 0.040 . 2 . . . A 356 GLU HB3 . 19362 1 542 . 1 1 51 51 GLU HG2 H 1 2.361 0.040 . 2 . . . A 356 GLU HG2 . 19362 1 543 . 1 1 51 51 GLU HG3 H 1 2.361 0.040 . 2 . . . A 356 GLU HG3 . 19362 1 544 . 1 1 51 51 GLU C C 13 179.154 0.400 . 1 . . . A 356 GLU C . 19362 1 545 . 1 1 51 51 GLU CA C 13 59.734 0.400 . 1 . . . A 356 GLU CA . 19362 1 546 . 1 1 51 51 GLU CB C 13 29.227 0.400 . 1 . . . A 356 GLU CB . 19362 1 547 . 1 1 51 51 GLU CG C 13 36.165 0.400 . 1 . . . A 356 GLU CG . 19362 1 548 . 1 1 52 52 VAL H H 1 8.201 0.040 . 1 . . . A 357 VAL H . 19362 1 549 . 1 1 52 52 VAL HA H 1 3.516 0.040 . 1 . . . A 357 VAL HA . 19362 1 550 . 1 1 52 52 VAL HB H 1 2.034 0.040 . 1 . . . A 357 VAL HB . 19362 1 551 . 1 1 52 52 VAL HG11 H 1 0.8 0.040 . 2 . . . A 357 VAL HG11 . 19362 1 552 . 1 1 52 52 VAL HG12 H 1 0.8 0.040 . 2 . . . A 357 VAL HG12 . 19362 1 553 . 1 1 52 52 VAL HG13 H 1 0.8 0.040 . 2 . . . A 357 VAL HG13 . 19362 1 554 . 1 1 52 52 VAL HG21 H 1 0.9 0.040 . 2 . . . A 357 VAL HG21 . 19362 1 555 . 1 1 52 52 VAL HG22 H 1 0.9 0.040 . 2 . . . A 357 VAL HG22 . 19362 1 556 . 1 1 52 52 VAL HG23 H 1 0.9 0.040 . 2 . . . A 357 VAL HG23 . 19362 1 557 . 1 1 52 52 VAL C C 13 177.479 0.400 . 1 . . . A 357 VAL C . 19362 1 558 . 1 1 52 52 VAL CA C 13 66.803 0.055 . 1 . . . A 357 VAL CA . 19362 1 559 . 1 1 52 52 VAL CB C 13 31.536 0.137 . 1 . . . A 357 VAL CB . 19362 1 560 . 1 1 52 52 VAL CG1 C 13 22.994 0.400 . 2 . . . A 357 VAL CG1 . 19362 1 561 . 1 1 52 52 VAL CG2 C 13 21.483 0.400 . 2 . . . A 357 VAL CG2 . 19362 1 562 . 1 1 52 52 VAL N N 15 119.311 0.400 . 1 . . . A 357 VAL N . 19362 1 563 . 1 1 53 53 GLU H H 1 7.975 0.040 . 1 . . . A 358 GLU H . 19362 1 564 . 1 1 53 53 GLU HA H 1 4.04 0.040 . 1 . . . A 358 GLU HA . 19362 1 565 . 1 1 53 53 GLU HB2 H 1 2.061 0.040 . 2 . . . A 358 GLU HB2 . 19362 1 566 . 1 1 53 53 GLU HB3 H 1 2.061 0.040 . 2 . . . A 358 GLU HB3 . 19362 1 567 . 1 1 53 53 GLU HG2 H 1 2.382 0.040 . 2 . . . A 358 GLU HG2 . 19362 1 568 . 1 1 53 53 GLU HG3 H 1 2.233 0.040 . 2 . . . A 358 GLU HG3 . 19362 1 569 . 1 1 53 53 GLU C C 13 178.892 0.400 . 1 . . . A 358 GLU C . 19362 1 570 . 1 1 53 53 GLU CA C 13 60.171 0.067 . 1 . . . A 358 GLU CA . 19362 1 571 . 1 1 53 53 GLU CB C 13 29.422 0.092 . 1 . . . A 358 GLU CB . 19362 1 572 . 1 1 53 53 GLU CG C 13 36.381 0.400 . 1 . . . A 358 GLU CG . 19362 1 573 . 1 1 53 53 GLU N N 15 119.674 0.400 . 1 . . . A 358 GLU N . 19362 1 574 . 1 1 54 54 VAL H H 1 8.071 0.040 . 1 . . . A 359 VAL H . 19362 1 575 . 1 1 54 54 VAL HA H 1 3.631 0.040 . 1 . . . A 359 VAL HA . 19362 1 576 . 1 1 54 54 VAL HB H 1 2.06 0.040 . 1 . . . A 359 VAL HB . 19362 1 577 . 1 1 54 54 VAL HG11 H 1 0.8 0.040 . 2 . . . A 359 VAL HG11 . 19362 1 578 . 1 1 54 54 VAL HG12 H 1 0.8 0.040 . 2 . . . A 359 VAL HG12 . 19362 1 579 . 1 1 54 54 VAL HG13 H 1 0.8 0.040 . 2 . . . A 359 VAL HG13 . 19362 1 580 . 1 1 54 54 VAL HG21 H 1 0.862 0.040 . 2 . . . A 359 VAL HG21 . 19362 1 581 . 1 1 54 54 VAL HG22 H 1 0.862 0.040 . 2 . . . A 359 VAL HG22 . 19362 1 582 . 1 1 54 54 VAL HG23 H 1 0.862 0.040 . 2 . . . A 359 VAL HG23 . 19362 1 583 . 1 1 54 54 VAL C C 13 176.031 0.400 . 1 . . . A 359 VAL C . 19362 1 584 . 1 1 54 54 VAL CA C 13 66.749 0.036 . 1 . . . A 359 VAL CA . 19362 1 585 . 1 1 54 54 VAL CB C 13 32.069 0.108 . 1 . . . A 359 VAL CB . 19362 1 586 . 1 1 54 54 VAL CG1 C 13 22.922 0.400 . 2 . . . A 359 VAL CG1 . 19362 1 587 . 1 1 54 54 VAL CG2 C 13 21.698 0.400 . 2 . . . A 359 VAL CG2 . 19362 1 588 . 1 1 54 54 VAL N N 15 118.356 0.400 . 1 . . . A 359 VAL N . 19362 1 589 . 1 1 55 55 GLN H H 1 8.073 0.001 . 1 . . . A 360 GLN H . 19362 1 590 . 1 1 55 55 GLN HA H 1 4.127 0.040 . 1 . . . A 360 GLN HA . 19362 1 591 . 1 1 55 55 GLN HB2 H 1 2.153 0.040 . 2 . . . A 360 GLN HB2 . 19362 1 592 . 1 1 55 55 GLN HB3 H 1 2.153 0.040 . 2 . . . A 360 GLN HB3 . 19362 1 593 . 1 1 55 55 GLN HG2 H 1 2.43 0.040 . 2 . . . A 360 GLN HG2 . 19362 1 594 . 1 1 55 55 GLN HG3 H 1 2.43 0.040 . 2 . . . A 360 GLN HG3 . 19362 1 595 . 1 1 55 55 GLN C C 13 178.369 0.400 . 1 . . . A 360 GLN C . 19362 1 596 . 1 1 55 55 GLN CA C 13 59.037 0.023 . 1 . . . A 360 GLN CA . 19362 1 597 . 1 1 55 55 GLN CB C 13 28.209 0.01 . 1 . . . A 360 GLN CB . 19362 1 598 . 1 1 55 55 GLN CG C 13 33.646 0.400 . 1 . . . A 360 GLN CG . 19362 1 599 . 1 1 55 55 GLN N N 15 119.015 0.400 . 1 . . . A 360 GLN N . 19362 1 600 . 1 1 56 56 TYR H H 1 8.723 0.040 . 1 . . . A 361 TYR H . 19362 1 601 . 1 1 56 56 TYR HA H 1 4.083 0.040 . 1 . . . A 361 TYR HA . 19362 1 602 . 1 1 56 56 TYR HB2 H 1 3.069 0.040 . 2 . . . A 361 TYR HB2 . 19362 1 603 . 1 1 56 56 TYR HB3 H 1 2.993 0.040 . 2 . . . A 361 TYR HB3 . 19362 1 604 . 1 1 56 56 TYR C C 13 177.2 0.400 . 1 . . . A 361 TYR C . 19362 1 605 . 1 1 56 56 TYR CA C 13 61.748 0.072 . 1 . . . A 361 TYR CA . 19362 1 606 . 1 1 56 56 TYR CB C 13 38.352 0.012 . 1 . . . A 361 TYR CB . 19362 1 607 . 1 1 56 56 TYR N N 15 120.172 0.400 . 1 . . . A 361 TYR N . 19362 1 608 . 1 1 57 57 TYR H H 1 8.421 0.040 . 1 . . . A 362 TYR H . 19362 1 609 . 1 1 57 57 TYR HA H 1 3.973 0.040 . 1 . . . A 362 TYR HA . 19362 1 610 . 1 1 57 57 TYR HB2 H 1 3.117 0.040 . 2 . . . A 362 TYR HB2 . 19362 1 611 . 1 1 57 57 TYR HB3 H 1 3.117 0.040 . 2 . . . A 362 TYR HB3 . 19362 1 612 . 1 1 57 57 TYR C C 13 177.723 0.400 . 1 . . . A 362 TYR C . 19362 1 613 . 1 1 57 57 TYR CA C 13 62.004 0.112 . 1 . . . A 362 TYR CA . 19362 1 614 . 1 1 57 57 TYR CB C 13 37.937 0.003 . 1 . . . A 362 TYR CB . 19362 1 615 . 1 1 57 57 TYR N N 15 118.707 0.400 . 1 . . . A 362 TYR N . 19362 1 616 . 1 1 58 58 ASN H H 1 8.305 0.040 . 1 . . . A 363 ASN H . 19362 1 617 . 1 1 58 58 ASN HA H 1 4.353 0.040 . 1 . . . A 363 ASN HA . 19362 1 618 . 1 1 58 58 ASN HB2 H 1 2.944 0.040 . 2 . . . A 363 ASN HB2 . 19362 1 619 . 1 1 58 58 ASN HB3 H 1 2.717 0.040 . 2 . . . A 363 ASN HB3 . 19362 1 620 . 1 1 58 58 ASN C C 13 177.88 0.400 . 1 . . . A 363 ASN C . 19362 1 621 . 1 1 58 58 ASN CA C 13 56.777 0.007 . 1 . . . A 363 ASN CA . 19362 1 622 . 1 1 58 58 ASN CB C 13 38.58 0.400 . 1 . . . A 363 ASN CB . 19362 1 623 . 1 1 58 58 ASN N N 15 117.671 0.400 . 1 . . . A 363 ASN N . 19362 1 624 . 1 1 59 59 ILE H H 1 8.201 0.040 . 1 . . . A 364 ILE H . 19362 1 625 . 1 1 59 59 ILE HA H 1 3.699 0.040 . 1 . . . A 364 ILE HA . 19362 1 626 . 1 1 59 59 ILE HG12 H 1 1.087 0.040 . 2 . . . A 364 ILE HG12 . 19362 1 627 . 1 1 59 59 ILE HG13 H 1 1.087 0.040 . 2 . . . A 364 ILE HG13 . 19362 1 628 . 1 1 59 59 ILE HG21 H 1 0.809 0.040 . 1 . . . A 364 ILE HG21 . 19362 1 629 . 1 1 59 59 ILE HG22 H 1 0.809 0.040 . 1 . . . A 364 ILE HG22 . 19362 1 630 . 1 1 59 59 ILE HG23 H 1 0.809 0.040 . 1 . . . A 364 ILE HG23 . 19362 1 631 . 1 1 59 59 ILE HD11 H 1 0.639 0.040 . 1 . . . A 364 ILE HD11 . 19362 1 632 . 1 1 59 59 ILE HD12 H 1 0.639 0.040 . 1 . . . A 364 ILE HD12 . 19362 1 633 . 1 1 59 59 ILE HD13 H 1 0.639 0.040 . 1 . . . A 364 ILE HD13 . 19362 1 634 . 1 1 59 59 ILE C C 13 178.194 0.400 . 1 . . . A 364 ILE C . 19362 1 635 . 1 1 59 59 ILE CA C 13 65.098 0.065 . 1 . . . A 364 ILE CA . 19362 1 636 . 1 1 59 59 ILE CB C 13 38.1 0.004 . 1 . . . A 364 ILE CB . 19362 1 637 . 1 1 59 59 ILE CG1 C 13 29.472 0.400 . 1 . . . A 364 ILE CG1 . 19362 1 638 . 1 1 59 59 ILE CG2 C 13 17.596 0.400 . 1 . . . A 364 ILE CG2 . 19362 1 639 . 1 1 59 59 ILE CD1 C 13 17.524 0.400 . 1 . . . A 364 ILE CD1 . 19362 1 640 . 1 1 59 59 ILE N N 15 121.461 0.400 . 1 . . . A 364 ILE N . 19362 1 641 . 1 1 60 60 LYS H H 1 8.103 0.040 . 1 . . . A 365 LYS H . 19362 1 642 . 1 1 60 60 LYS HA H 1 4.076 0.040 . 1 . . . A 365 LYS HA . 19362 1 643 . 1 1 60 60 LYS HB2 H 1 1.904 0.040 . 2 . . . A 365 LYS HB2 . 19362 1 644 . 1 1 60 60 LYS HB3 H 1 1.904 0.040 . 2 . . . A 365 LYS HB3 . 19362 1 645 . 1 1 60 60 LYS HG2 H 1 1.525 0.040 . 2 . . . A 365 LYS HG2 . 19362 1 646 . 1 1 60 60 LYS HG3 H 1 1.412 0.040 . 2 . . . A 365 LYS HG3 . 19362 1 647 . 1 1 60 60 LYS HD2 H 1 1.643 0.040 . 2 . . . A 365 LYS HD2 . 19362 1 648 . 1 1 60 60 LYS HD3 H 1 1.643 0.040 . 2 . . . A 365 LYS HD3 . 19362 1 649 . 1 1 60 60 LYS HE2 H 1 2.942 0.040 . 2 . . . A 365 LYS HE2 . 19362 1 650 . 1 1 60 60 LYS HE3 H 1 2.942 0.040 . 2 . . . A 365 LYS HE3 . 19362 1 651 . 1 1 60 60 LYS C C 13 179.433 0.400 . 1 . . . A 365 LYS C . 19362 1 652 . 1 1 60 60 LYS CA C 13 59.315 0.059 . 1 . . . A 365 LYS CA . 19362 1 653 . 1 1 60 60 LYS CB C 13 31.752 0.064 . 1 . . . A 365 LYS CB . 19362 1 654 . 1 1 60 60 LYS CG C 13 25.153 0.400 . 1 . . . A 365 LYS CG . 19362 1 655 . 1 1 60 60 LYS CD C 13 30.119 0.400 . 1 . . . A 365 LYS CD . 19362 1 656 . 1 1 60 60 LYS CE C 13 42.139 0.400 . 1 . . . A 365 LYS CE . 19362 1 657 . 1 1 60 60 LYS N N 15 120.861 0.400 . 1 . . . A 365 LYS N . 19362 1 658 . 1 1 61 61 LYS H H 1 8.297 0.040 . 1 . . . A 366 LYS H . 19362 1 659 . 1 1 61 61 LYS CA C 13 59.63 0.400 . 1 . . . A 366 LYS CA . 19362 1 660 . 1 1 61 61 LYS CB C 13 32.281 0.400 . 1 . . . A 366 LYS CB . 19362 1 661 . 1 1 61 61 LYS N N 15 120.289 0.400 . 1 . . . A 366 LYS N . 19362 1 662 . 1 1 62 62 GLN HA H 1 4.083 0.040 . 1 . . . A 367 GLN HA . 19362 1 663 . 1 1 62 62 GLN HB2 H 1 2.104 0.040 . 2 . . . A 367 GLN HB2 . 19362 1 664 . 1 1 62 62 GLN HB3 H 1 2.104 0.040 . 2 . . . A 367 GLN HB3 . 19362 1 665 . 1 1 62 62 GLN HG2 H 1 2.495 0.040 . 2 . . . A 367 GLN HG2 . 19362 1 666 . 1 1 62 62 GLN HG3 H 1 2.34 0.040 . 2 . . . A 367 GLN HG3 . 19362 1 667 . 1 1 62 62 GLN C C 13 178.509 0.400 . 1 . . . A 367 GLN C . 19362 1 668 . 1 1 62 62 GLN CA C 13 59.022 0.400 . 1 . . . A 367 GLN CA . 19362 1 669 . 1 1 62 62 GLN CB C 13 28.992 0.400 . 1 . . . A 367 GLN CB . 19362 1 670 . 1 1 62 62 GLN CG C 13 34.582 0.400 . 1 . . . A 367 GLN CG . 19362 1 671 . 1 1 63 63 ASN H H 1 8.289 0.040 . 1 . . . A 368 ASN H . 19362 1 672 . 1 1 63 63 ASN HA H 1 4.454 0.040 . 1 . . . A 368 ASN HA . 19362 1 673 . 1 1 63 63 ASN HB2 H 1 2.824 0.040 . 2 . . . A 368 ASN HB2 . 19362 1 674 . 1 1 63 63 ASN HB3 H 1 2.734 0.040 . 2 . . . A 368 ASN HB3 . 19362 1 675 . 1 1 63 63 ASN C C 13 177.078 0.400 . 1 . . . A 368 ASN C . 19362 1 676 . 1 1 63 63 ASN CA C 13 56.001 0.018 . 1 . . . A 368 ASN CA . 19362 1 677 . 1 1 63 63 ASN CB C 13 38.648 0.056 . 1 . . . A 368 ASN CB . 19362 1 678 . 1 1 63 63 ASN N N 15 117.931 0.400 . 1 . . . A 368 ASN N . 19362 1 679 . 1 1 64 64 ALA H H 1 8.132 0.040 . 1 . . . A 369 ALA H . 19362 1 680 . 1 1 64 64 ALA HA H 1 4.105 0.040 . 1 . . . A 369 ALA HA . 19362 1 681 . 1 1 64 64 ALA HB1 H 1 1.466 0.040 . 1 . . . A 369 ALA HB1 . 19362 1 682 . 1 1 64 64 ALA HB2 H 1 1.466 0.040 . 1 . . . A 369 ALA HB2 . 19362 1 683 . 1 1 64 64 ALA HB3 H 1 1.466 0.040 . 1 . . . A 369 ALA HB3 . 19362 1 684 . 1 1 64 64 ALA C C 13 179.8 0.400 . 1 . . . A 369 ALA C . 19362 1 685 . 1 1 64 64 ALA CA C 13 55.326 0.002 . 1 . . . A 369 ALA CA . 19362 1 686 . 1 1 64 64 ALA CB C 13 18.15 0.003 . 1 . . . A 369 ALA CB . 19362 1 687 . 1 1 64 64 ALA N N 15 123.439 0.400 . 1 . . . A 369 ALA N . 19362 1 688 . 1 1 65 65 GLU H H 1 8.262 0.040 . 1 . . . A 370 GLU H . 19362 1 689 . 1 1 65 65 GLU HA H 1 3.942 0.040 . 1 . . . A 370 GLU HA . 19362 1 690 . 1 1 65 65 GLU HB2 H 1 2.195 0.040 . 2 . . . A 370 GLU HB2 . 19362 1 691 . 1 1 65 65 GLU HB3 H 1 2.051 0.040 . 2 . . . A 370 GLU HB3 . 19362 1 692 . 1 1 65 65 GLU HG2 H 1 2.429 0.040 . 2 . . . A 370 GLU HG2 . 19362 1 693 . 1 1 65 65 GLU HG3 H 1 2.429 0.040 . 2 . . . A 370 GLU HG3 . 19362 1 694 . 1 1 65 65 GLU C C 13 178.561 0.400 . 1 . . . A 370 GLU C . 19362 1 695 . 1 1 65 65 GLU CA C 13 59.533 0.025 . 1 . . . A 370 GLU CA . 19362 1 696 . 1 1 65 65 GLU CB C 13 29.5 0.028 . 1 . . . A 370 GLU CB . 19362 1 697 . 1 1 65 65 GLU CG C 13 36.813 0.400 . 1 . . . A 370 GLU CG . 19362 1 698 . 1 1 65 65 GLU N N 15 117.931 0.400 . 1 . . . A 370 GLU N . 19362 1 699 . 1 1 66 66 LYS H H 1 7.974 0.040 . 1 . . . A 371 LYS H . 19362 1 700 . 1 1 66 66 LYS HA H 1 4.013 0.040 . 1 . . . A 371 LYS HA . 19362 1 701 . 1 1 66 66 LYS HB2 H 1 1.918 0.040 . 2 . . . A 371 LYS HB2 . 19362 1 702 . 1 1 66 66 LYS HB3 H 1 1.918 0.040 . 2 . . . A 371 LYS HB3 . 19362 1 703 . 1 1 66 66 LYS HG2 H 1 1.435 0.040 . 2 . . . A 371 LYS HG2 . 19362 1 704 . 1 1 66 66 LYS HG3 H 1 1.435 0.040 . 2 . . . A 371 LYS HG3 . 19362 1 705 . 1 1 66 66 LYS HD2 H 1 1.668 0.040 . 2 . . . A 371 LYS HD2 . 19362 1 706 . 1 1 66 66 LYS HD3 H 1 1.561 0.040 . 2 . . . A 371 LYS HD3 . 19362 1 707 . 1 1 66 66 LYS HE2 H 1 2.902 0.040 . 2 . . . A 371 LYS HE2 . 19362 1 708 . 1 1 66 66 LYS HE3 H 1 2.902 0.040 . 2 . . . A 371 LYS HE3 . 19362 1 709 . 1 1 66 66 LYS C C 13 178.215 0.400 . 1 . . . A 371 LYS C . 19362 1 710 . 1 1 66 66 LYS CA C 13 59.569 0.051 . 1 . . . A 371 LYS CA . 19362 1 711 . 1 1 66 66 LYS CB C 13 32.353 0.083 . 1 . . . A 371 LYS CB . 19362 1 712 . 1 1 66 66 LYS CG C 13 25.441 0.400 . 1 . . . A 371 LYS CG . 19362 1 713 . 1 1 66 66 LYS CD C 13 29.616 0.400 . 1 . . . A 371 LYS CD . 19362 1 714 . 1 1 66 66 LYS CE C 13 42.355 0.400 . 1 . . . A 371 LYS CE . 19362 1 715 . 1 1 66 66 LYS N N 15 118.722 0.400 . 1 . . . A 371 LYS N . 19362 1 716 . 1 1 67 67 GLN H H 1 7.924 0.040 . 1 . . . A 372 GLN H . 19362 1 717 . 1 1 67 67 GLN HA H 1 4.007 0.040 . 1 . . . A 372 GLN HA . 19362 1 718 . 1 1 67 67 GLN HB2 H 1 2.113 0.040 . 2 . . . A 372 GLN HB2 . 19362 1 719 . 1 1 67 67 GLN HB3 H 1 2.113 0.040 . 2 . . . A 372 GLN HB3 . 19362 1 720 . 1 1 67 67 GLN HG2 H 1 2.451 0.040 . 2 . . . A 372 GLN HG2 . 19362 1 721 . 1 1 67 67 GLN HG3 H 1 2.346 0.040 . 2 . . . A 372 GLN HG3 . 19362 1 722 . 1 1 67 67 GLN C C 13 178.317 0.400 . 1 . . . A 372 GLN C . 19362 1 723 . 1 1 67 67 GLN CA C 13 58.653 0.144 . 1 . . . A 372 GLN CA . 19362 1 724 . 1 1 67 67 GLN CB C 13 28.578 0.001 . 1 . . . A 372 GLN CB . 19362 1 725 . 1 1 67 67 GLN CG C 13 34.294 0.400 . 1 . . . A 372 GLN CG . 19362 1 726 . 1 1 67 67 GLN N N 15 117.052 0.400 . 1 . . . A 372 GLN N . 19362 1 727 . 1 1 68 68 LEU H H 1 7.897 0.040 . 1 . . . A 373 LEU H . 19362 1 728 . 1 1 68 68 LEU HA H 1 4.124 0.040 . 1 . . . A 373 LEU HA . 19362 1 729 . 1 1 68 68 LEU HB2 H 1 1.791 0.040 . 2 . . . A 373 LEU HB2 . 19362 1 730 . 1 1 68 68 LEU HB3 H 1 1.791 0.040 . 2 . . . A 373 LEU HB3 . 19362 1 731 . 1 1 68 68 LEU HG H 1 1.642 0.040 . 1 . . . A 373 LEU HG . 19362 1 732 . 1 1 68 68 LEU HD11 H 1 0.862 0.040 . 2 . . . A 373 LEU HD11 . 19362 1 733 . 1 1 68 68 LEU HD12 H 1 0.862 0.040 . 2 . . . A 373 LEU HD12 . 19362 1 734 . 1 1 68 68 LEU HD13 H 1 0.862 0.040 . 2 . . . A 373 LEU HD13 . 19362 1 735 . 1 1 68 68 LEU HD21 H 1 0.858 0.040 . 2 . . . A 373 LEU HD21 . 19362 1 736 . 1 1 68 68 LEU HD22 H 1 0.858 0.040 . 2 . . . A 373 LEU HD22 . 19362 1 737 . 1 1 68 68 LEU HD23 H 1 0.858 0.040 . 2 . . . A 373 LEU HD23 . 19362 1 738 . 1 1 68 68 LEU C C 13 178.578 0.400 . 1 . . . A 373 LEU C . 19362 1 739 . 1 1 68 68 LEU CA C 13 57.866 0.142 . 1 . . . A 373 LEU CA . 19362 1 740 . 1 1 68 68 LEU CB C 13 41.984 0.05 . 1 . . . A 373 LEU CB . 19362 1 741 . 1 1 68 68 LEU CG C 13 27.168 0.400 . 1 . . . A 373 LEU CG . 19362 1 742 . 1 1 68 68 LEU CD1 C 13 24.505 0.400 . 2 . . . A 373 LEU CD1 . 19362 1 743 . 1 1 68 68 LEU CD2 C 13 24.218 0.400 . 2 . . . A 373 LEU CD2 . 19362 1 744 . 1 1 68 68 LEU N N 15 120.216 0.400 . 1 . . . A 373 LEU N . 19362 1 745 . 1 1 69 69 LEU H H 1 7.9 0.040 . 1 . . . A 374 LEU H . 19362 1 746 . 1 1 69 69 LEU HA H 1 4.098 0.040 . 1 . . . A 374 LEU HA . 19362 1 747 . 1 1 69 69 LEU HB2 H 1 1.815 0.040 . 2 . . . A 374 LEU HB2 . 19362 1 748 . 1 1 69 69 LEU HB3 H 1 1.815 0.040 . 2 . . . A 374 LEU HB3 . 19362 1 749 . 1 1 69 69 LEU HG H 1 1.64 0.040 . 1 . . . A 374 LEU HG . 19362 1 750 . 1 1 69 69 LEU HD11 H 1 0.863 0.040 . 2 . . . A 374 LEU HD11 . 19362 1 751 . 1 1 69 69 LEU HD12 H 1 0.863 0.040 . 2 . . . A 374 LEU HD12 . 19362 1 752 . 1 1 69 69 LEU HD13 H 1 0.863 0.040 . 2 . . . A 374 LEU HD13 . 19362 1 753 . 1 1 69 69 LEU HD21 H 1 0.873 0.040 . 2 . . . A 374 LEU HD21 . 19362 1 754 . 1 1 69 69 LEU HD22 H 1 0.873 0.040 . 2 . . . A 374 LEU HD22 . 19362 1 755 . 1 1 69 69 LEU HD23 H 1 0.873 0.040 . 2 . . . A 374 LEU HD23 . 19362 1 756 . 1 1 69 69 LEU C C 13 179.137 0.400 . 1 . . . A 374 LEU C . 19362 1 757 . 1 1 69 69 LEU CA C 13 57.895 0.047 . 1 . . . A 374 LEU CA . 19362 1 758 . 1 1 69 69 LEU CB C 13 41.937 0.009 . 1 . . . A 374 LEU CB . 19362 1 759 . 1 1 69 69 LEU CG C 13 27.096 0.400 . 1 . . . A 374 LEU CG . 19362 1 760 . 1 1 69 69 LEU CD1 C 13 25.009 0.400 . 2 . . . A 374 LEU CD1 . 19362 1 761 . 1 1 69 69 LEU CD2 C 13 24.002 0.400 . 2 . . . A 374 LEU CD2 . 19362 1 762 . 1 1 69 69 LEU N N 15 119.894 0.400 . 1 . . . A 374 LEU N . 19362 1 763 . 1 1 70 70 VAL H H 1 7.959 0.040 . 1 . . . A 375 VAL H . 19362 1 764 . 1 1 70 70 VAL HA H 1 3.77 0.040 . 1 . . . A 375 VAL HA . 19362 1 765 . 1 1 70 70 VAL HB H 1 2.114 0.040 . 1 . . . A 375 VAL HB . 19362 1 766 . 1 1 70 70 VAL HG11 H 1 0.918 0.040 . 2 . . . A 375 VAL HG11 . 19362 1 767 . 1 1 70 70 VAL HG12 H 1 0.918 0.040 . 2 . . . A 375 VAL HG12 . 19362 1 768 . 1 1 70 70 VAL HG13 H 1 0.918 0.040 . 2 . . . A 375 VAL HG13 . 19362 1 769 . 1 1 70 70 VAL HG21 H 1 1.004 0.040 . 2 . . . A 375 VAL HG21 . 19362 1 770 . 1 1 70 70 VAL HG22 H 1 1.004 0.040 . 2 . . . A 375 VAL HG22 . 19362 1 771 . 1 1 70 70 VAL HG23 H 1 1.004 0.040 . 2 . . . A 375 VAL HG23 . 19362 1 772 . 1 1 70 70 VAL C C 13 178.282 0.400 . 1 . . . A 375 VAL C . 19362 1 773 . 1 1 70 70 VAL CA C 13 65.307 0.017 . 1 . . . A 375 VAL CA . 19362 1 774 . 1 1 70 70 VAL CB C 13 32.139 0.019 . 1 . . . A 375 VAL CB . 19362 1 775 . 1 1 70 70 VAL CG1 C 13 21.986 0.400 . 2 . . . A 375 VAL CG1 . 19362 1 776 . 1 1 70 70 VAL CG2 C 13 21.77 0.400 . 2 . . . A 375 VAL CG2 . 19362 1 777 . 1 1 70 70 VAL N N 15 118.561 0.400 . 1 . . . A 375 VAL N . 19362 1 778 . 1 1 71 71 ALA H H 1 7.973 0.040 . 1 . . . A 376 ALA H . 19362 1 779 . 1 1 71 71 ALA HA H 1 4.166 0.040 . 1 . . . A 376 ALA HA . 19362 1 780 . 1 1 71 71 ALA HB1 H 1 1.468 0.040 . 1 . . . A 376 ALA HB1 . 19362 1 781 . 1 1 71 71 ALA HB2 H 1 1.468 0.040 . 1 . . . A 376 ALA HB2 . 19362 1 782 . 1 1 71 71 ALA HB3 H 1 1.468 0.040 . 1 . . . A 376 ALA HB3 . 19362 1 783 . 1 1 71 71 ALA C C 13 179.625 0.400 . 1 . . . A 376 ALA C . 19362 1 784 . 1 1 71 71 ALA CA C 13 54.406 0.024 . 1 . . . A 376 ALA CA . 19362 1 785 . 1 1 71 71 ALA CB C 13 18.263 0.071 . 1 . . . A 376 ALA CB . 19362 1 786 . 1 1 71 71 ALA N N 15 123.776 0.400 . 1 . . . A 376 ALA N . 19362 1 787 . 1 1 72 72 LYS H H 1 8.234 0.040 . 1 . . . A 377 LYS H . 19362 1 788 . 1 1 72 72 LYS HA H 1 4.083 0.040 . 1 . . . A 377 LYS HA . 19362 1 789 . 1 1 72 72 LYS HB2 H 1 1.906 0.040 . 2 . . . A 377 LYS HB2 . 19362 1 790 . 1 1 72 72 LYS HB3 H 1 1.906 0.040 . 2 . . . A 377 LYS HB3 . 19362 1 791 . 1 1 72 72 LYS HG2 H 1 1.52 0.040 . 2 . . . A 377 LYS HG2 . 19362 1 792 . 1 1 72 72 LYS HG3 H 1 1.412 0.040 . 2 . . . A 377 LYS HG3 . 19362 1 793 . 1 1 72 72 LYS HD2 H 1 1.64 0.040 . 2 . . . A 377 LYS HD2 . 19362 1 794 . 1 1 72 72 LYS HD3 H 1 1.64 0.040 . 2 . . . A 377 LYS HD3 . 19362 1 795 . 1 1 72 72 LYS HE2 H 1 2.926 0.040 . 2 . . . A 377 LYS HE2 . 19362 1 796 . 1 1 72 72 LYS HE3 H 1 2.926 0.040 . 2 . . . A 377 LYS HE3 . 19362 1 797 . 1 1 72 72 LYS C C 13 178.212 0.400 . 1 . . . A 377 LYS C . 19362 1 798 . 1 1 72 72 LYS CA C 13 58.831 0.183 . 1 . . . A 377 LYS CA . 19362 1 799 . 1 1 72 72 LYS CB C 13 32.84 0.036 . 1 . . . A 377 LYS CB . 19362 1 800 . 1 1 72 72 LYS CG C 13 25.225 0.400 . 1 . . . A 377 LYS CG . 19362 1 801 . 1 1 72 72 LYS CD C 13 29.688 0.400 . 1 . . . A 377 LYS CD . 19362 1 802 . 1 1 72 72 LYS CE C 13 42.355 0.400 . 1 . . . A 377 LYS CE . 19362 1 803 . 1 1 72 72 LYS N N 15 119.235 0.400 . 1 . . . A 377 LYS N . 19362 1 804 . 1 1 73 73 GLU H H 1 8.307 0.040 . 1 . . . A 378 GLU H . 19362 1 805 . 1 1 73 73 GLU HA H 1 4.127 0.040 . 1 . . . A 378 GLU HA . 19362 1 806 . 1 1 73 73 GLU HB2 H 1 2.067 0.040 . 2 . . . A 378 GLU HB2 . 19362 1 807 . 1 1 73 73 GLU HB3 H 1 2.067 0.040 . 2 . . . A 378 GLU HB3 . 19362 1 808 . 1 1 73 73 GLU HG2 H 1 2.35 0.040 . 2 . . . A 378 GLU HG2 . 19362 1 809 . 1 1 73 73 GLU HG3 H 1 2.24 0.040 . 2 . . . A 378 GLU HG3 . 19362 1 810 . 1 1 73 73 GLU C C 13 178.578 0.400 . 1 . . . A 378 GLU C . 19362 1 811 . 1 1 73 73 GLU CA C 13 58.543 0.123 . 1 . . . A 378 GLU CA . 19362 1 812 . 1 1 73 73 GLU CB C 13 29.736 0.06 . 1 . . . A 378 GLU CB . 19362 1 813 . 1 1 73 73 GLU CG C 13 36.309 0.400 . 1 . . . A 378 GLU CG . 19362 1 814 . 1 1 73 73 GLU N N 15 119.513 0.400 . 1 . . . A 378 GLU N . 19362 1 815 . 1 1 74 74 GLY H H 1 8.275 0.040 . 1 . . . A 379 GLY H . 19362 1 816 . 1 1 74 74 GLY HA2 H 1 3.873 0.040 . 2 . . . A 379 GLY HA2 . 19362 1 817 . 1 1 74 74 GLY HA3 H 1 3.873 0.040 . 2 . . . A 379 GLY HA3 . 19362 1 818 . 1 1 74 74 GLY C C 13 175.176 0.400 . 1 . . . A 379 GLY C . 19362 1 819 . 1 1 74 74 GLY CA C 13 46.613 0.003 . 1 . . . A 379 GLY CA . 19362 1 820 . 1 1 74 74 GLY N N 15 107.427 0.400 . 1 . . . A 379 GLY N . 19362 1 821 . 1 1 75 75 ALA H H 1 8.007 0.040 . 1 . . . A 380 ALA H . 19362 1 822 . 1 1 75 75 ALA HA H 1 4.162 0.040 . 1 . . . A 380 ALA HA . 19362 1 823 . 1 1 75 75 ALA HB1 H 1 1.445 0.040 . 1 . . . A 380 ALA HB1 . 19362 1 824 . 1 1 75 75 ALA HB2 H 1 1.445 0.040 . 1 . . . A 380 ALA HB2 . 19362 1 825 . 1 1 75 75 ALA HB3 H 1 1.445 0.040 . 1 . . . A 380 ALA HB3 . 19362 1 826 . 1 1 75 75 ALA C C 13 179.154 0.400 . 1 . . . A 380 ALA C . 19362 1 827 . 1 1 75 75 ALA CA C 13 54.232 0.017 . 1 . . . A 380 ALA CA . 19362 1 828 . 1 1 75 75 ALA CB C 13 18.668 0.011 . 1 . . . A 380 ALA CB . 19362 1 829 . 1 1 75 75 ALA N N 15 123.205 0.400 . 1 . . . A 380 ALA N . 19362 1 830 . 1 1 76 76 GLU H H 1 8.169 0.040 . 1 . . . A 381 GLU H . 19362 1 831 . 1 1 76 76 GLU HA H 1 4.099 0.040 . 1 . . . A 381 GLU HA . 19362 1 832 . 1 1 76 76 GLU HB2 H 1 2.045 0.040 . 2 . . . A 381 GLU HB2 . 19362 1 833 . 1 1 76 76 GLU HB3 H 1 2.045 0.040 . 2 . . . A 381 GLU HB3 . 19362 1 834 . 1 1 76 76 GLU HG2 H 1 2.345 0.040 . 2 . . . A 381 GLU HG2 . 19362 1 835 . 1 1 76 76 GLU HG3 H 1 2.264 0.040 . 2 . . . A 381 GLU HG3 . 19362 1 836 . 1 1 76 76 GLU C C 13 177.811 0.400 . 1 . . . A 381 GLU C . 19362 1 837 . 1 1 76 76 GLU CA C 13 58.259 0.400 . 1 . . . A 381 GLU CA . 19362 1 838 . 1 1 76 76 GLU CB C 13 29.785 0.045 . 1 . . . A 381 GLU CB . 19362 1 839 . 1 1 76 76 GLU CG C 13 36.453 0.400 . 1 . . . A 381 GLU CG . 19362 1 840 . 1 1 76 76 GLU N N 15 117.36 0.400 . 1 . . . A 381 GLU N . 19362 1 841 . 1 1 77 77 LYS H H 1 7.924 0.040 . 1 . . . A 382 LYS H . 19362 1 842 . 1 1 77 77 LYS HA H 1 4.075 0.049 . 1 . . . A 382 LYS HA . 19362 1 843 . 1 1 77 77 LYS HB2 H 1 1.863 0.040 . 2 . . . A 382 LYS HB2 . 19362 1 844 . 1 1 77 77 LYS HB3 H 1 1.863 0.040 . 2 . . . A 382 LYS HB3 . 19362 1 845 . 1 1 77 77 LYS HG2 H 1 1.526 0.040 . 2 . . . A 382 LYS HG2 . 19362 1 846 . 1 1 77 77 LYS HG3 H 1 1.427 0.040 . 2 . . . A 382 LYS HG3 . 19362 1 847 . 1 1 77 77 LYS HD2 H 1 1.661 0.040 . 2 . . . A 382 LYS HD2 . 19362 1 848 . 1 1 77 77 LYS HD3 H 1 1.661 0.040 . 2 . . . A 382 LYS HD3 . 19362 1 849 . 1 1 77 77 LYS HE2 H 1 2.954 0.040 . 2 . . . A 382 LYS HE2 . 19362 1 850 . 1 1 77 77 LYS HE3 H 1 2.954 0.040 . 2 . . . A 382 LYS HE3 . 19362 1 851 . 1 1 77 77 LYS C C 13 177.619 0.400 . 1 . . . A 382 LYS C . 19362 1 852 . 1 1 77 77 LYS CA C 13 58.343 0.168 . 1 . . . A 382 LYS CA . 19362 1 853 . 1 1 77 77 LYS CB C 13 32.809 0.041 . 1 . . . A 382 LYS CB . 19362 1 854 . 1 1 77 77 LYS CG C 13 25.585 0.400 . 1 . . . A 382 LYS CG . 19362 1 855 . 1 1 77 77 LYS CD C 13 29.616 0.400 . 1 . . . A 382 LYS CD . 19362 1 856 . 1 1 77 77 LYS CE C 13 42.499 0.400 . 1 . . . A 382 LYS CE . 19362 1 857 . 1 1 77 77 LYS N N 15 118.942 0.400 . 1 . . . A 382 LYS N . 19362 1 858 . 1 1 78 78 ILE H H 1 7.614 0.040 . 1 . . . A 383 ILE H . 19362 1 859 . 1 1 78 78 ILE HB H 1 1.9 0.040 . 1 . . . A 383 ILE HB . 19362 1 860 . 1 1 78 78 ILE HG12 H 1 1.47 0.040 . 2 . . . A 383 ILE HG12 . 19362 1 861 . 1 1 78 78 ILE HG13 H 1 1.212 0.040 . 2 . . . A 383 ILE HG13 . 19362 1 862 . 1 1 78 78 ILE HG21 H 1 0.864 0.040 . 1 . . . A 383 ILE HG21 . 19362 1 863 . 1 1 78 78 ILE HG22 H 1 0.864 0.040 . 1 . . . A 383 ILE HG22 . 19362 1 864 . 1 1 78 78 ILE HG23 H 1 0.864 0.040 . 1 . . . A 383 ILE HG23 . 19362 1 865 . 1 1 78 78 ILE HD11 H 1 0.868 0.040 . 1 . . . A 383 ILE HD11 . 19362 1 866 . 1 1 78 78 ILE HD12 H 1 0.868 0.040 . 1 . . . A 383 ILE HD12 . 19362 1 867 . 1 1 78 78 ILE HD13 H 1 0.868 0.040 . 1 . . . A 383 ILE HD13 . 19362 1 868 . 1 1 78 78 ILE C C 13 176.554 0.400 . 1 . . . A 383 ILE C . 19362 1 869 . 1 1 78 78 ILE CA C 13 62.277 0.028 . 1 . . . A 383 ILE CA . 19362 1 870 . 1 1 78 78 ILE CB C 13 38.519 0.03 . 1 . . . A 383 ILE CB . 19362 1 871 . 1 1 78 78 ILE CG1 C 13 28.076 0.400 . 1 . . . A 383 ILE CG1 . 19362 1 872 . 1 1 78 78 ILE CG2 C 13 17.956 0.400 . 1 . . . A 383 ILE CG2 . 19362 1 873 . 1 1 78 78 ILE CD1 C 13 13.493 0.400 . 1 . . . A 383 ILE CD1 . 19362 1 874 . 1 1 78 78 ILE N N 15 117.682 0.400 . 1 . . . A 383 ILE N . 19362 1 875 . 1 1 79 79 LYS H H 1 7.878 0.040 . 1 . . . A 384 LYS H . 19362 1 876 . 1 1 79 79 LYS HA H 1 4.197 0.040 . 1 . . . A 384 LYS HA . 19362 1 877 . 1 1 79 79 LYS HB2 H 1 1.816 0.040 . 2 . . . A 384 LYS HB2 . 19362 1 878 . 1 1 79 79 LYS HB3 H 1 1.785 0.040 . 2 . . . A 384 LYS HB3 . 19362 1 879 . 1 1 79 79 LYS HG2 H 1 1.486 0.040 . 2 . . . A 384 LYS HG2 . 19362 1 880 . 1 1 79 79 LYS HG3 H 1 1.389 0.040 . 2 . . . A 384 LYS HG3 . 19362 1 881 . 1 1 79 79 LYS HD2 H 1 1.641 0.040 . 2 . . . A 384 LYS HD2 . 19362 1 882 . 1 1 79 79 LYS HD3 H 1 1.641 0.040 . 2 . . . A 384 LYS HD3 . 19362 1 883 . 1 1 79 79 LYS HE2 H 1 2.941 0.040 . 2 . . . A 384 LYS HE2 . 19362 1 884 . 1 1 79 79 LYS HE3 H 1 2.941 0.040 . 2 . . . A 384 LYS HE3 . 19362 1 885 . 1 1 79 79 LYS C C 13 176.52 0.400 . 1 . . . A 384 LYS C . 19362 1 886 . 1 1 79 79 LYS CA C 13 57.09 0.104 . 1 . . . A 384 LYS CA . 19362 1 887 . 1 1 79 79 LYS CB C 13 33.078 0.069 . 1 . . . A 384 LYS CB . 19362 1 888 . 1 1 79 79 LYS CG C 13 25.313 0.400 . 1 . . . A 384 LYS CG . 19362 1 889 . 1 1 79 79 LYS CD C 13 29.582 0.400 . 1 . . . A 384 LYS CD . 19362 1 890 . 1 1 79 79 LYS CE C 13 42.43 0.400 . 1 . . . A 384 LYS CE . 19362 1 891 . 1 1 79 79 LYS N N 15 122.252 0.400 . 1 . . . A 384 LYS N . 19362 1 892 . 1 1 80 80 LYS H H 1 7.928 0.040 . 1 . . . A 385 LYS H . 19362 1 893 . 1 1 80 80 LYS HA H 1 4.256 0.040 . 1 . . . A 385 LYS HA . 19362 1 894 . 1 1 80 80 LYS HB2 H 1 1.835 0.040 . 2 . . . A 385 LYS HB2 . 19362 1 895 . 1 1 80 80 LYS HB3 H 1 1.743 0.040 . 2 . . . A 385 LYS HB3 . 19362 1 896 . 1 1 80 80 LYS HG2 H 1 1.415 0.040 . 2 . . . A 385 LYS HG2 . 19362 1 897 . 1 1 80 80 LYS HG3 H 1 1.415 0.040 . 2 . . . A 385 LYS HG3 . 19362 1 898 . 1 1 80 80 LYS HD2 H 1 1.639 0.040 . 2 . . . A 385 LYS HD2 . 19362 1 899 . 1 1 80 80 LYS HD3 H 1 1.639 0.040 . 2 . . . A 385 LYS HD3 . 19362 1 900 . 1 1 80 80 LYS HE2 H 1 2.953 0.040 . 2 . . . A 385 LYS HE2 . 19362 1 901 . 1 1 80 80 LYS HE3 H 1 2.953 0.040 . 2 . . . A 385 LYS HE3 . 19362 1 902 . 1 1 80 80 LYS C C 13 176.066 0.400 . 1 . . . A 385 LYS C . 19362 1 903 . 1 1 80 80 LYS CA C 13 56.639 0.07 . 1 . . . A 385 LYS CA . 19362 1 904 . 1 1 80 80 LYS CB C 13 33.319 0.081 . 1 . . . A 385 LYS CB . 19362 1 905 . 1 1 80 80 LYS CG C 13 25.161 0.400 . 1 . . . A 385 LYS CG . 19362 1 906 . 1 1 80 80 LYS CD C 13 29.488 0.400 . 1 . . . A 385 LYS CD . 19362 1 907 . 1 1 80 80 LYS CE C 13 42.388 0.400 . 1 . . . A 385 LYS CE . 19362 1 908 . 1 1 80 80 LYS N N 15 120.582 0.400 . 1 . . . A 385 LYS N . 19362 1 909 . 1 1 81 81 LYS H H 1 8.082 0.040 . 1 . . . A 386 LYS H . 19362 1 910 . 1 1 81 81 LYS HA H 1 4.248 0.040 . 1 . . . A 386 LYS HA . 19362 1 911 . 1 1 81 81 LYS HB2 H 1 1.841 0.040 . 2 . . . A 386 LYS HB2 . 19362 1 912 . 1 1 81 81 LYS HB3 H 1 1.75 0.040 . 2 . . . A 386 LYS HB3 . 19362 1 913 . 1 1 81 81 LYS HG2 H 1 1.415 0.040 . 2 . . . A 386 LYS HG2 . 19362 1 914 . 1 1 81 81 LYS HG3 H 1 1.415 0.040 . 2 . . . A 386 LYS HG3 . 19362 1 915 . 1 1 81 81 LYS HD2 H 1 1.633 0.040 . 2 . . . A 386 LYS HD2 . 19362 1 916 . 1 1 81 81 LYS HD3 H 1 1.633 0.040 . 2 . . . A 386 LYS HD3 . 19362 1 917 . 1 1 81 81 LYS HE2 H 1 2.966 0.040 . 2 . . . A 386 LYS HE2 . 19362 1 918 . 1 1 81 81 LYS HE3 H 1 2.966 0.040 . 2 . . . A 386 LYS HE3 . 19362 1 919 . 1 1 81 81 LYS C C 13 175.298 0.400 . 1 . . . A 386 LYS C . 19362 1 920 . 1 1 81 81 LYS CA C 13 56.839 0.015 . 1 . . . A 386 LYS CA . 19362 1 921 . 1 1 81 81 LYS CB C 13 33.303 0.016 . 1 . . . A 386 LYS CB . 19362 1 922 . 1 1 81 81 LYS CG C 13 24.966 0.400 . 1 . . . A 386 LYS CG . 19362 1 923 . 1 1 81 81 LYS CD C 13 29.496 0.400 . 1 . . . A 386 LYS CD . 19362 1 924 . 1 1 81 81 LYS CE C 13 42.444 0.400 . 1 . . . A 386 LYS CE . 19362 1 925 . 1 1 81 81 LYS N N 15 122.326 0.400 . 1 . . . A 386 LYS N . 19362 1 926 . 1 1 82 82 ARG H H 1 7.827 0.040 . 1 . . . A 387 ARG H . 19362 1 927 . 1 1 82 82 ARG CA C 13 57.659 0.400 . 1 . . . A 387 ARG CA . 19362 1 928 . 1 1 82 82 ARG CB C 13 31.838 0.400 . 1 . . . A 387 ARG CB . 19362 1 929 . 1 1 82 82 ARG N N 15 126.984 0.400 . 1 . . . A 387 ARG N . 19362 1 stop_ save_ save_assigned_chem_shift_list_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2 _Assigned_chem_shift_list.Entry_ID 19362 _Assigned_chem_shift_list.ID 2 _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 $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 19362 2 2 '3D HNCACB' . . . 19362 2 3 '3D CBCA(CO)NH' . . . 19362 2 5 '3D C(CO)NH TOCSY' . . . 19362 2 7 '3D 1H-15N NOESY' . . . 19362 2 8 '2D 1H-13C HSQC' . . . 19362 2 9 '3D 1H-13C NOESY' . . . 19362 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 GLY HA2 H 1 3.894 0.040 . 2 . . . A -5 GLY HA2 . 19362 2 2 . 1 1 1 1 GLY HA3 H 1 3.894 0.040 . 2 . . . A -5 GLY HA3 . 19362 2 3 . 1 1 1 1 GLY CA C 13 43.357 0.400 . 1 . . . A -5 GLY CA . 19362 2 4 . 1 1 2 2 SER HA H 1 4.546 0.040 . 1 . . . A -4 SER HA . 19362 2 5 . 1 1 2 2 SER HB2 H 1 3.883 0.040 . 2 . . . A -4 SER HB2 . 19362 2 6 . 1 1 2 2 SER HB3 H 1 3.883 0.040 . 2 . . . A -4 SER HB3 . 19362 2 7 . 1 1 2 2 SER CA C 13 58.148 0.400 . 1 . . . A -4 SER CA . 19362 2 8 . 1 1 2 2 SER CB C 13 63.863 0.400 . 1 . . . A -4 SER CB . 19362 2 9 . 1 1 3 3 HIS HA H 1 4.688 0.009 . 1 . . . A -3 HIS HA . 19362 2 10 . 1 1 3 3 HIS HB2 H 1 3.197 0.012 . 2 . . . A -3 HIS HB2 . 19362 2 11 . 1 1 3 3 HIS HB3 H 1 3.143 0.040 . 2 . . . A -3 HIS HB3 . 19362 2 12 . 1 1 3 3 HIS HD2 H 1 7.097 0.001 . 1 . . . A -3 HIS HD2 . 19362 2 13 . 1 1 3 3 HIS C C 13 174.845 0.400 . 1 . . . A -3 HIS C . 19362 2 14 . 1 1 3 3 HIS CA C 13 56.419 0.400 . 1 . . . A -3 HIS CA . 19362 2 15 . 1 1 3 3 HIS CB C 13 30.367 0.006 . 1 . . . A -3 HIS CB . 19362 2 16 . 1 1 3 3 HIS CD2 C 13 119.438 0.400 . 1 . . . A -3 HIS CD2 . 19362 2 17 . 1 1 4 4 MET H H 1 8.437 0.040 . 1 . . . A -2 MET H . 19362 2 18 . 1 1 4 4 MET HA H 1 4.467 0.040 . 1 . . . A -2 MET HA . 19362 2 19 . 1 1 4 4 MET HB2 H 1 2.104 0.040 . 2 . . . A -2 MET HB2 . 19362 2 20 . 1 1 4 4 MET HB3 H 1 1.998 0.040 . 2 . . . A -2 MET HB3 . 19362 2 21 . 1 1 4 4 MET HG2 H 1 2.555 0.040 . 2 . . . A -2 MET HG2 . 19362 2 22 . 1 1 4 4 MET HG3 H 1 2.494 0.040 . 2 . . . A -2 MET HG3 . 19362 2 23 . 1 1 4 4 MET HE1 H 1 2.123 0.040 . 1 . . . A -2 MET HE1 . 19362 2 24 . 1 1 4 4 MET HE2 H 1 2.123 0.040 . 1 . . . A -2 MET HE2 . 19362 2 25 . 1 1 4 4 MET HE3 H 1 2.123 0.040 . 1 . . . A -2 MET HE3 . 19362 2 26 . 1 1 4 4 MET C C 13 175.874 0.400 . 1 . . . A -2 MET C . 19362 2 27 . 1 1 4 4 MET CA C 13 55.6 0.400 . 1 . . . A -2 MET CA . 19362 2 28 . 1 1 4 4 MET CB C 13 32.879 0.002 . 1 . . . A -2 MET CB . 19362 2 29 . 1 1 4 4 MET CG C 13 31.875 0.007 . 1 . . . A -2 MET CG . 19362 2 30 . 1 1 4 4 MET CE C 13 16.736 0.400 . 1 . . . A -2 MET CE . 19362 2 31 . 1 1 4 4 MET N N 15 121.3 0.400 . 1 . . . A -2 MET N . 19362 2 32 . 1 1 5 5 ALA H H 1 8.451 0.040 . 1 . . . A -1 ALA H . 19362 2 33 . 1 1 5 5 ALA HA H 1 4.367 0.040 . 1 . . . A -1 ALA HA . 19362 2 34 . 1 1 5 5 ALA HB1 H 1 1.465 0.040 . 1 . . . A -1 ALA HB1 . 19362 2 35 . 1 1 5 5 ALA HB2 H 1 1.465 0.040 . 1 . . . A -1 ALA HB2 . 19362 2 36 . 1 1 5 5 ALA HB3 H 1 1.465 0.040 . 1 . . . A -1 ALA HB3 . 19362 2 37 . 1 1 5 5 ALA C C 13 177.793 0.400 . 1 . . . A -1 ALA C . 19362 2 38 . 1 1 5 5 ALA CA C 13 52.825 0.400 . 1 . . . A -1 ALA CA . 19362 2 39 . 1 1 5 5 ALA CB C 13 19.032 0.400 . 1 . . . A -1 ALA CB . 19362 2 40 . 1 1 5 5 ALA N N 15 124.904 0.400 . 1 . . . A -1 ALA N . 19362 2 41 . 1 1 6 6 SER H H 1 8.315 0.040 . 1 . . . A 0 SER H . 19362 2 42 . 1 1 6 6 SER HA H 1 4.5 0.040 . 1 . . . A 0 SER HA . 19362 2 43 . 1 1 6 6 SER HB2 H 1 3.999 0.040 . 2 . . . A 0 SER HB2 . 19362 2 44 . 1 1 6 6 SER HB3 H 1 3.921 0.040 . 2 . . . A 0 SER HB3 . 19362 2 45 . 1 1 6 6 SER C C 13 174.845 0.400 . 1 . . . A 0 SER C . 19362 2 46 . 1 1 6 6 SER CA C 13 58.47 0.400 . 1 . . . A 0 SER CA . 19362 2 47 . 1 1 6 6 SER CB C 13 63.712 0.002 . 1 . . . A 0 SER CB . 19362 2 48 . 1 1 6 6 SER N N 15 114.122 0.400 . 1 . . . A 0 SER N . 19362 2 49 . 1 1 7 7 SER H H 1 8.344 0.040 . 1 . . . A 312 SER H . 19362 2 50 . 1 1 7 7 SER HA H 1 4.5 0.040 . 1 . . . A 312 SER HA . 19362 2 51 . 1 1 7 7 SER HB2 H 1 3.994 0.040 . 2 . . . A 312 SER HB2 . 19362 2 52 . 1 1 7 7 SER HB3 H 1 3.934 0.040 . 2 . . . A 312 SER HB3 . 19362 2 53 . 1 1 7 7 SER C C 13 174.757 0.400 . 1 . . . A 312 SER C . 19362 2 54 . 1 1 7 7 SER CA C 13 58.651 0.400 . 1 . . . A 312 SER CA . 19362 2 55 . 1 1 7 7 SER CB C 13 63.604 0.001 . 1 . . . A 312 SER CB . 19362 2 56 . 1 1 7 7 SER N N 15 117.154 0.400 . 1 . . . A 312 SER N . 19362 2 57 . 1 1 8 8 ARG H H 1 8.374 0.040 . 1 . . . A 313 ARG H . 19362 2 58 . 1 1 8 8 ARG HA H 1 4.345 0.040 . 1 . . . A 313 ARG HA . 19362 2 59 . 1 1 8 8 ARG HB2 H 1 1.939 0.040 . 2 . . . A 313 ARG HB2 . 19362 2 60 . 1 1 8 8 ARG HB3 H 1 1.835 0.040 . 2 . . . A 313 ARG HB3 . 19362 2 61 . 1 1 8 8 ARG HG2 H 1 1.711 0.040 . 2 . . . A 313 ARG HG2 . 19362 2 62 . 1 1 8 8 ARG HG3 H 1 1.661 0.040 . 2 . . . A 313 ARG HG3 . 19362 2 63 . 1 1 8 8 ARG HD2 H 1 3.222 0.040 . 2 . . . A 313 ARG HD2 . 19362 2 64 . 1 1 8 8 ARG HD3 H 1 3.222 0.040 . 2 . . . A 313 ARG HD3 . 19362 2 65 . 1 1 8 8 ARG C C 13 176.677 0.400 . 1 . . . A 313 ARG C . 19362 2 66 . 1 1 8 8 ARG CA C 13 56.816 0.400 . 1 . . . A 313 ARG CA . 19362 2 67 . 1 1 8 8 ARG CB C 13 30.434 0.007 . 1 . . . A 313 ARG CB . 19362 2 68 . 1 1 8 8 ARG CG C 13 27.112 0.005 . 1 . . . A 313 ARG CG . 19362 2 69 . 1 1 8 8 ARG CD C 13 43.102 0.400 . 1 . . . A 313 ARG CD . 19362 2 70 . 1 1 8 8 ARG N N 15 121.93 0.400 . 1 . . . A 313 ARG N . 19362 2 71 . 1 1 9 9 GLN H H 1 8.334 0.040 . 1 . . . A 314 GLN H . 19362 2 72 . 1 1 9 9 GLN HA H 1 4.268 0.040 . 1 . . . A 314 GLN HA . 19362 2 73 . 1 1 9 9 GLN HB2 H 1 2.053 0.040 . 2 . . . A 314 GLN HB2 . 19362 2 74 . 1 1 9 9 GLN HB3 H 1 2.053 0.040 . 2 . . . A 314 GLN HB3 . 19362 2 75 . 1 1 9 9 GLN HG2 H 1 2.373 0.040 . 2 . . . A 314 GLN HG2 . 19362 2 76 . 1 1 9 9 GLN HG3 H 1 2.373 0.040 . 2 . . . A 314 GLN HG3 . 19362 2 77 . 1 1 9 9 GLN C C 13 176.188 0.400 . 1 . . . A 314 GLN C . 19362 2 78 . 1 1 9 9 GLN CA C 13 56.933 0.400 . 1 . . . A 314 GLN CA . 19362 2 79 . 1 1 9 9 GLN CB C 13 29.088 0.400 . 1 . . . A 314 GLN CB . 19362 2 80 . 1 1 9 9 GLN CG C 13 33.702 0.400 . 1 . . . A 314 GLN CG . 19362 2 81 . 1 1 9 9 GLN N N 15 120.172 0.400 . 1 . . . A 314 GLN N . 19362 2 82 . 1 1 10 10 LYS H H 1 8.181 0.040 . 1 . . . A 315 LYS H . 19362 2 83 . 1 1 10 10 LYS HA H 1 4.253 0.040 . 1 . . . A 315 LYS HA . 19362 2 84 . 1 1 10 10 LYS HB2 H 1 1.772 0.040 . 2 . . . A 315 LYS HB2 . 19362 2 85 . 1 1 10 10 LYS HB3 H 1 1.772 0.040 . 2 . . . A 315 LYS HB3 . 19362 2 86 . 1 1 10 10 LYS HG2 H 1 1.411 0.040 . 2 . . . A 315 LYS HG2 . 19362 2 87 . 1 1 10 10 LYS HG3 H 1 1.339 0.040 . 2 . . . A 315 LYS HG3 . 19362 2 88 . 1 1 10 10 LYS HD2 H 1 1.607 0.040 . 2 . . . A 315 LYS HD2 . 19362 2 89 . 1 1 10 10 LYS HD3 H 1 1.607 0.040 . 2 . . . A 315 LYS HD3 . 19362 2 90 . 1 1 10 10 LYS HE2 H 1 2.994 0.040 . 2 . . . A 315 LYS HE2 . 19362 2 91 . 1 1 10 10 LYS HE3 H 1 2.994 0.040 . 2 . . . A 315 LYS HE3 . 19362 2 92 . 1 1 10 10 LYS C C 13 176.868 0.400 . 1 . . . A 315 LYS C . 19362 2 93 . 1 1 10 10 LYS CA C 13 56.844 0.400 . 1 . . . A 315 LYS CA . 19362 2 94 . 1 1 10 10 LYS CB C 13 32.906 0.400 . 1 . . . A 315 LYS CB . 19362 2 95 . 1 1 10 10 LYS CG C 13 24.603 0.004 . 1 . . . A 315 LYS CG . 19362 2 96 . 1 1 10 10 LYS CD C 13 28.352 0.400 . 1 . . . A 315 LYS CD . 19362 2 97 . 1 1 10 10 LYS CE C 13 41.855 0.400 . 1 . . . A 315 LYS CE . 19362 2 98 . 1 1 10 10 LYS N N 15 120.875 0.400 . 1 . . . A 315 LYS N . 19362 2 99 . 1 1 11 11 TYR H H 1 8.191 0.040 . 1 . . . A 316 TYR H . 19362 2 100 . 1 1 11 11 TYR HA H 1 4.605 0.001 . 1 . . . A 316 TYR HA . 19362 2 101 . 1 1 11 11 TYR HB2 H 1 3.215 0.007 . 2 . . . A 316 TYR HB2 . 19362 2 102 . 1 1 11 11 TYR HB3 H 1 2.982 0.003 . 2 . . . A 316 TYR HB3 . 19362 2 103 . 1 1 11 11 TYR HD1 H 1 7.177 0.001 . 3 . . . A 316 TYR HD1 . 19362 2 104 . 1 1 11 11 TYR HE2 H 1 6.852 0.002 . 3 . . . A 316 TYR HE2 . 19362 2 105 . 1 1 11 11 TYR C C 13 176.607 0.400 . 1 . . . A 316 TYR C . 19362 2 106 . 1 1 11 11 TYR CA C 13 58.418 0.400 . 1 . . . A 316 TYR CA . 19362 2 107 . 1 1 11 11 TYR CB C 13 38.679 0.004 . 1 . . . A 316 TYR CB . 19362 2 108 . 1 1 11 11 TYR CD1 C 13 133.244 0.400 . 3 . . . A 316 TYR CD1 . 19362 2 109 . 1 1 11 11 TYR CE2 C 13 118.376 0.400 . 3 . . . A 316 TYR CE2 . 19362 2 110 . 1 1 11 11 TYR N N 15 119.63 0.400 . 1 . . . A 316 TYR N . 19362 2 111 . 1 1 12 12 ALA H H 1 8.459 0.040 . 1 . . . A 317 ALA H . 19362 2 112 . 1 1 12 12 ALA HA H 1 4.309 0.040 . 1 . . . A 317 ALA HA . 19362 2 113 . 1 1 12 12 ALA HB1 H 1 1.524 0.040 . 1 . . . A 317 ALA HB1 . 19362 2 114 . 1 1 12 12 ALA HB2 H 1 1.524 0.040 . 1 . . . A 317 ALA HB2 . 19362 2 115 . 1 1 12 12 ALA HB3 H 1 1.524 0.040 . 1 . . . A 317 ALA HB3 . 19362 2 116 . 1 1 12 12 ALA C C 13 179.032 0.400 . 1 . . . A 317 ALA C . 19362 2 117 . 1 1 12 12 ALA CA C 13 53.93 0.400 . 1 . . . A 317 ALA CA . 19362 2 118 . 1 1 12 12 ALA CB C 13 18.636 0.400 . 1 . . . A 317 ALA CB . 19362 2 119 . 1 1 12 12 ALA N N 15 123.747 0.400 . 1 . . . A 317 ALA N . 19362 2 120 . 1 1 13 13 GLU H H 1 8.721 0.040 . 1 . . . A 318 GLU H . 19362 2 121 . 1 1 13 13 GLU HA H 1 4.07 0.040 . 1 . . . A 318 GLU HA . 19362 2 122 . 1 1 13 13 GLU HB2 H 1 2.159 0.040 . 2 . . . A 318 GLU HB2 . 19362 2 123 . 1 1 13 13 GLU HB3 H 1 2.159 0.040 . 2 . . . A 318 GLU HB3 . 19362 2 124 . 1 1 13 13 GLU HG2 H 1 2.412 0.040 . 2 . . . A 318 GLU HG2 . 19362 2 125 . 1 1 13 13 GLU HG3 H 1 2.412 0.040 . 2 . . . A 318 GLU HG3 . 19362 2 126 . 1 1 13 13 GLU C C 13 178.247 0.400 . 1 . . . A 318 GLU C . 19362 2 127 . 1 1 13 13 GLU CA C 13 59.536 0.400 . 1 . . . A 318 GLU CA . 19362 2 128 . 1 1 13 13 GLU CB C 13 29.603 0.400 . 1 . . . A 318 GLU CB . 19362 2 129 . 1 1 13 13 GLU CG C 13 36.634 0.400 . 1 . . . A 318 GLU CG . 19362 2 130 . 1 1 13 13 GLU N N 15 118.341 0.400 . 1 . . . A 318 GLU N . 19362 2 131 . 1 1 14 14 GLU H H 1 8.441 0.040 . 1 . . . A 319 GLU H . 19362 2 132 . 1 1 14 14 GLU HA H 1 4.162 0.040 . 1 . . . A 319 GLU HA . 19362 2 133 . 1 1 14 14 GLU HB2 H 1 2.196 0.040 . 2 . . . A 319 GLU HB2 . 19362 2 134 . 1 1 14 14 GLU HB3 H 1 2.151 0.040 . 2 . . . A 319 GLU HB3 . 19362 2 135 . 1 1 14 14 GLU HG2 H 1 2.458 0.040 . 2 . . . A 319 GLU HG2 . 19362 2 136 . 1 1 14 14 GLU HG3 H 1 2.381 0.040 . 2 . . . A 319 GLU HG3 . 19362 2 137 . 1 1 14 14 GLU C C 13 178.875 0.400 . 1 . . . A 319 GLU C . 19362 2 138 . 1 1 14 14 GLU CA C 13 59.274 0.400 . 1 . . . A 319 GLU CA . 19362 2 139 . 1 1 14 14 GLU CB C 13 29.432 0.400 . 1 . . . A 319 GLU CB . 19362 2 140 . 1 1 14 14 GLU CG C 13 36.571 0.001 . 1 . . . A 319 GLU CG . 19362 2 141 . 1 1 14 14 GLU N N 15 118.808 0.400 . 1 . . . A 319 GLU N . 19362 2 142 . 1 1 15 15 GLU H H 1 8.284 0.040 . 1 . . . A 320 GLU H . 19362 2 143 . 1 1 15 15 GLU HA H 1 4.139 0.040 . 1 . . . A 320 GLU HA . 19362 2 144 . 1 1 15 15 GLU HB2 H 1 2.268 0.040 . 2 . . . A 320 GLU HB2 . 19362 2 145 . 1 1 15 15 GLU HB3 H 1 2.165 0.040 . 2 . . . A 320 GLU HB3 . 19362 2 146 . 1 1 15 15 GLU HG2 H 1 2.359 0.040 . 2 . . . A 320 GLU HG2 . 19362 2 147 . 1 1 15 15 GLU HG3 H 1 2.359 0.040 . 2 . . . A 320 GLU HG3 . 19362 2 148 . 1 1 15 15 GLU C C 13 178.509 0.400 . 1 . . . A 320 GLU C . 19362 2 149 . 1 1 15 15 GLU CA C 13 59.345 0.400 . 1 . . . A 320 GLU CA . 19362 2 150 . 1 1 15 15 GLU CB C 13 29.389 0.002 . 1 . . . A 320 GLU CB . 19362 2 151 . 1 1 15 15 GLU CG C 13 36.275 0.400 . 1 . . . A 320 GLU CG . 19362 2 152 . 1 1 15 15 GLU N N 15 119.996 0.400 . 1 . . . A 320 GLU N . 19362 2 153 . 1 1 16 16 LEU H H 1 8.158 0.040 . 1 . . . A 321 LEU H . 19362 2 154 . 1 1 16 16 LEU HA H 1 4.192 0.040 . 1 . . . A 321 LEU HA . 19362 2 155 . 1 1 16 16 LEU HB3 H 1 1.85 0.040 . 2 . . . A 321 LEU HB3 . 19362 2 156 . 1 1 16 16 LEU HD11 H 1 0.9 0.040 . 2 . . . A 321 LEU HD11 . 19362 2 157 . 1 1 16 16 LEU HD12 H 1 0.9 0.040 . 2 . . . A 321 LEU HD12 . 19362 2 158 . 1 1 16 16 LEU HD13 H 1 0.9 0.040 . 2 . . . A 321 LEU HD13 . 19362 2 159 . 1 1 16 16 LEU HD21 H 1 0.907 0.040 . 2 . . . A 321 LEU HD21 . 19362 2 160 . 1 1 16 16 LEU HD22 H 1 0.907 0.040 . 2 . . . A 321 LEU HD22 . 19362 2 161 . 1 1 16 16 LEU HD23 H 1 0.907 0.040 . 2 . . . A 321 LEU HD23 . 19362 2 162 . 1 1 16 16 LEU C C 13 178.683 0.400 . 1 . . . A 321 LEU C . 19362 2 163 . 1 1 16 16 LEU CA C 13 57.888 0.400 . 1 . . . A 321 LEU CA . 19362 2 164 . 1 1 16 16 LEU CB C 13 41.633 0.001 . 1 . . . A 321 LEU CB . 19362 2 165 . 1 1 16 16 LEU CD1 C 13 24.433 0.400 . 2 . . . A 321 LEU CD1 . 19362 2 166 . 1 1 16 16 LEU CD2 C 13 24.49 0.400 . 2 . . . A 321 LEU CD2 . 19362 2 167 . 1 1 16 16 LEU N N 15 119.147 0.400 . 1 . . . A 321 LEU N . 19362 2 168 . 1 1 17 17 GLU H H 1 8.222 0.040 . 1 . . . A 322 GLU H . 19362 2 169 . 1 1 17 17 GLU HA H 1 4.143 0.040 . 1 . . . A 322 GLU HA . 19362 2 170 . 1 1 17 17 GLU HB2 H 1 2.258 0.040 . 2 . . . A 322 GLU HB2 . 19362 2 171 . 1 1 17 17 GLU HB3 H 1 2.22 0.040 . 2 . . . A 322 GLU HB3 . 19362 2 172 . 1 1 17 17 GLU HG2 H 1 2.464 0.040 . 2 . . . A 322 GLU HG2 . 19362 2 173 . 1 1 17 17 GLU HG3 H 1 2.464 0.040 . 2 . . . A 322 GLU HG3 . 19362 2 174 . 1 1 17 17 GLU C C 13 179.032 0.400 . 1 . . . A 322 GLU C . 19362 2 175 . 1 1 17 17 GLU CA C 13 59.274 0.400 . 1 . . . A 322 GLU CA . 19362 2 176 . 1 1 17 17 GLU CB C 13 29.13 0.400 . 1 . . . A 322 GLU CB . 19362 2 177 . 1 1 17 17 GLU CG C 13 35.813 0.400 . 1 . . . A 322 GLU CG . 19362 2 178 . 1 1 17 17 GLU N N 15 119.055 0.400 . 1 . . . A 322 GLU N . 19362 2 179 . 1 1 18 18 GLN H H 1 7.981 0.040 . 1 . . . A 323 GLN H . 19362 2 180 . 1 1 18 18 GLN HA H 1 4.145 0.040 . 1 . . . A 323 GLN HA . 19362 2 181 . 1 1 18 18 GLN HB2 H 1 2.327 0.040 . 2 . . . A 323 GLN HB2 . 19362 2 182 . 1 1 18 18 GLN HB3 H 1 2.24 0.040 . 2 . . . A 323 GLN HB3 . 19362 2 183 . 1 1 18 18 GLN HG2 H 1 2.612 0.040 . 2 . . . A 323 GLN HG2 . 19362 2 184 . 1 1 18 18 GLN HG3 H 1 2.492 0.040 . 2 . . . A 323 GLN HG3 . 19362 2 185 . 1 1 18 18 GLN C C 13 179.154 0.400 . 1 . . . A 323 GLN C . 19362 2 186 . 1 1 18 18 GLN CA C 13 58.986 0.400 . 1 . . . A 323 GLN CA . 19362 2 187 . 1 1 18 18 GLN CB C 13 28.24 0.003 . 1 . . . A 323 GLN CB . 19362 2 188 . 1 1 18 18 GLN CG C 13 34.143 0.003 . 1 . . . A 323 GLN CG . 19362 2 189 . 1 1 18 18 GLN N N 15 118.092 0.400 . 1 . . . A 323 GLN N . 19362 2 190 . 1 1 19 19 VAL H H 1 8.137 0.040 . 1 . . . A 324 VAL H . 19362 2 191 . 1 1 19 19 VAL HA H 1 3.721 0.040 . 1 . . . A 324 VAL HA . 19362 2 192 . 1 1 19 19 VAL HB H 1 2.274 0.040 . 1 . . . A 324 VAL HB . 19362 2 193 . 1 1 19 19 VAL HG11 H 1 1.068 0.040 . 2 . . . A 324 VAL HG11 . 19362 2 194 . 1 1 19 19 VAL HG12 H 1 1.068 0.040 . 2 . . . A 324 VAL HG12 . 19362 2 195 . 1 1 19 19 VAL HG13 H 1 1.068 0.040 . 2 . . . A 324 VAL HG13 . 19362 2 196 . 1 1 19 19 VAL HG21 H 1 0.94 0.040 . 2 . . . A 324 VAL HG21 . 19362 2 197 . 1 1 19 19 VAL HG22 H 1 0.94 0.040 . 2 . . . A 324 VAL HG22 . 19362 2 198 . 1 1 19 19 VAL HG23 H 1 0.94 0.040 . 2 . . . A 324 VAL HG23 . 19362 2 199 . 1 1 19 19 VAL C C 13 177.497 0.400 . 1 . . . A 324 VAL C . 19362 2 200 . 1 1 19 19 VAL CA C 13 66.486 0.400 . 1 . . . A 324 VAL CA . 19362 2 201 . 1 1 19 19 VAL CB C 13 31.534 0.400 . 1 . . . A 324 VAL CB . 19362 2 202 . 1 1 19 19 VAL CG1 C 13 22.225 0.400 . 2 . . . A 324 VAL CG1 . 19362 2 203 . 1 1 19 19 VAL CG2 C 13 21.085 0.400 . 2 . . . A 324 VAL CG2 . 19362 2 204 . 1 1 19 19 VAL N N 15 121.608 0.400 . 1 . . . A 324 VAL N . 19362 2 205 . 1 1 20 20 ARG H H 1 8.512 0.040 . 1 . . . A 325 ARG H . 19362 2 206 . 1 1 20 20 ARG HA H 1 3.888 0.040 . 1 . . . A 325 ARG HA . 19362 2 207 . 1 1 20 20 ARG HB2 H 1 1.9 0.040 . 2 . . . A 325 ARG HB2 . 19362 2 208 . 1 1 20 20 ARG HG2 H 1 1.526 0.040 . 2 . . . A 325 ARG HG2 . 19362 2 209 . 1 1 20 20 ARG HG3 H 1 1.758 0.040 . 2 . . . A 325 ARG HG3 . 19362 2 210 . 1 1 20 20 ARG HD2 H 1 2.991 0.040 . 2 . . . A 325 ARG HD2 . 19362 2 211 . 1 1 20 20 ARG HD3 H 1 2.991 0.040 . 2 . . . A 325 ARG HD3 . 19362 2 212 . 1 1 20 20 ARG C C 13 178.317 0.400 . 1 . . . A 325 ARG C . 19362 2 213 . 1 1 20 20 ARG CA C 13 60.304 0.400 . 1 . . . A 325 ARG CA . 19362 2 214 . 1 1 20 20 ARG CB C 13 29.997 0.003 . 1 . . . A 325 ARG CB . 19362 2 215 . 1 1 20 20 ARG CG C 13 27.969 0.400 . 1 . . . A 325 ARG CG . 19362 2 216 . 1 1 20 20 ARG CD C 13 43.39 0.400 . 1 . . . A 325 ARG CD . 19362 2 217 . 1 1 20 20 ARG N N 15 119.044 0.400 . 1 . . . A 325 ARG N . 19362 2 218 . 1 1 21 21 GLU H H 1 8.216 0.040 . 1 . . . A 326 GLU H . 19362 2 219 . 1 1 21 21 GLU HA H 1 4.182 0.040 . 1 . . . A 326 GLU HA . 19362 2 220 . 1 1 21 21 GLU HB2 H 1 2.2 0.040 . 2 . . . A 326 GLU HB2 . 19362 2 221 . 1 1 21 21 GLU HB3 H 1 2.2 0.040 . 2 . . . A 326 GLU HB3 . 19362 2 222 . 1 1 21 21 GLU HG2 H 1 2.42 0.040 . 2 . . . A 326 GLU HG2 . 19362 2 223 . 1 1 21 21 GLU HG3 H 1 2.32 0.040 . 2 . . . A 326 GLU HG3 . 19362 2 224 . 1 1 21 21 GLU C C 13 178.613 0.400 . 1 . . . A 326 GLU C . 19362 2 225 . 1 1 21 21 GLU CA C 13 58.988 0.400 . 1 . . . A 326 GLU CA . 19362 2 226 . 1 1 21 21 GLU CB C 13 29.219 0.400 . 1 . . . A 326 GLU CB . 19362 2 227 . 1 1 21 21 GLU CG C 13 35.786 0.400 . 1 . . . A 326 GLU CG . 19362 2 228 . 1 1 21 21 GLU N N 15 118.063 0.400 . 1 . . . A 326 GLU N . 19362 2 229 . 1 1 22 22 ALA H H 1 8.144 0.040 . 1 . . . A 327 ALA H . 19362 2 230 . 1 1 22 22 ALA HA H 1 4.183 0.040 . 1 . . . A 327 ALA HA . 19362 2 231 . 1 1 22 22 ALA HB1 H 1 1.628 0.040 . 1 . . . A 327 ALA HB1 . 19362 2 232 . 1 1 22 22 ALA HB2 H 1 1.628 0.040 . 1 . . . A 327 ALA HB2 . 19362 2 233 . 1 1 22 22 ALA HB3 H 1 1.628 0.040 . 1 . . . A 327 ALA HB3 . 19362 2 234 . 1 1 22 22 ALA C C 13 180.969 0.400 . 1 . . . A 327 ALA C . 19362 2 235 . 1 1 22 22 ALA CA C 13 55.366 0.400 . 1 . . . A 327 ALA CA . 19362 2 236 . 1 1 22 22 ALA CB C 13 17.548 0.400 . 1 . . . A 327 ALA CB . 19362 2 237 . 1 1 22 22 ALA N N 15 123.324 0.400 . 1 . . . A 327 ALA N . 19362 2 238 . 1 1 23 23 LEU H H 1 8.693 0.040 . 1 . . . A 328 LEU H . 19362 2 239 . 1 1 23 23 LEU HA H 1 4.219 0.040 . 1 . . . A 328 LEU HA . 19362 2 240 . 1 1 23 23 LEU HB2 H 1 1.587 0.040 . 2 . . . A 328 LEU HB2 . 19362 2 241 . 1 1 23 23 LEU HB3 H 1 2.011 0.040 . 2 . . . A 328 LEU HB3 . 19362 2 242 . 1 1 23 23 LEU HG H 1 1.911 0.040 . 1 . . . A 328 LEU HG . 19362 2 243 . 1 1 23 23 LEU HD11 H 1 0.805 0.040 . 2 . . . A 328 LEU HD11 . 19362 2 244 . 1 1 23 23 LEU HD12 H 1 0.805 0.040 . 2 . . . A 328 LEU HD12 . 19362 2 245 . 1 1 23 23 LEU HD13 H 1 0.805 0.040 . 2 . . . A 328 LEU HD13 . 19362 2 246 . 1 1 23 23 LEU HD21 H 1 0.823 0.040 . 2 . . . A 328 LEU HD21 . 19362 2 247 . 1 1 23 23 LEU HD22 H 1 0.823 0.040 . 2 . . . A 328 LEU HD22 . 19362 2 248 . 1 1 23 23 LEU HD23 H 1 0.823 0.040 . 2 . . . A 328 LEU HD23 . 19362 2 249 . 1 1 23 23 LEU C C 13 179.643 0.400 . 1 . . . A 328 LEU C . 19362 2 250 . 1 1 23 23 LEU CA C 13 58.274 0.400 . 1 . . . A 328 LEU CA . 19362 2 251 . 1 1 23 23 LEU CB C 13 41.431 0.400 . 1 . . . A 328 LEU CB . 19362 2 252 . 1 1 23 23 LEU CG C 13 26.806 0.400 . 1 . . . A 328 LEU CG . 19362 2 253 . 1 1 23 23 LEU CD1 C 13 25.583 0.400 . 2 . . . A 328 LEU CD1 . 19362 2 254 . 1 1 23 23 LEU CD2 C 13 22.645 0.400 . 2 . . . A 328 LEU CD2 . 19362 2 255 . 1 1 23 23 LEU N N 15 119.249 0.400 . 1 . . . A 328 LEU N . 19362 2 256 . 1 1 24 24 ARG H H 1 8.419 0.040 . 1 . . . A 329 ARG H . 19362 2 257 . 1 1 24 24 ARG HA H 1 4.235 0.040 . 1 . . . A 329 ARG HA . 19362 2 258 . 1 1 24 24 ARG HB2 H 1 2.009 0.040 . 2 . . . A 329 ARG HB2 . 19362 2 259 . 1 1 24 24 ARG HB3 H 1 2.084 0.040 . 2 . . . A 329 ARG HB3 . 19362 2 260 . 1 1 24 24 ARG HG2 H 1 1.737 0.040 . 2 . . . A 329 ARG HG2 . 19362 2 261 . 1 1 24 24 ARG HG3 H 1 1.922 0.040 . 2 . . . A 329 ARG HG3 . 19362 2 262 . 1 1 24 24 ARG HD2 H 1 3.247 0.040 . 2 . . . A 329 ARG HD2 . 19362 2 263 . 1 1 24 24 ARG HD3 H 1 3.292 0.040 . 2 . . . A 329 ARG HD3 . 19362 2 264 . 1 1 24 24 ARG C C 13 179.503 0.400 . 1 . . . A 329 ARG C . 19362 2 265 . 1 1 24 24 ARG CA C 13 59.335 0.400 . 1 . . . A 329 ARG CA . 19362 2 266 . 1 1 24 24 ARG CB C 13 30.084 0.400 . 1 . . . A 329 ARG CB . 19362 2 267 . 1 1 24 24 ARG CG C 13 27.687 0.400 . 1 . . . A 329 ARG CG . 19362 2 268 . 1 1 24 24 ARG CD C 13 43.34 0.400 . 1 . . . A 329 ARG CD . 19362 2 269 . 1 1 24 24 ARG N N 15 120.249 0.400 . 1 . . . A 329 ARG N . 19362 2 270 . 1 1 25 25 LYS H H 1 8.224 0.040 . 1 . . . A 330 LYS H . 19362 2 271 . 1 1 25 25 LYS HA H 1 4.034 0.040 . 1 . . . A 330 LYS HA . 19362 2 272 . 1 1 25 25 LYS HB2 H 1 2.009 0.040 . 2 . . . A 330 LYS HB2 . 19362 2 273 . 1 1 25 25 LYS HB3 H 1 1.995 0.040 . 2 . . . A 330 LYS HB3 . 19362 2 274 . 1 1 25 25 LYS HG2 H 1 1.723 0.040 . 2 . . . A 330 LYS HG2 . 19362 2 275 . 1 1 25 25 LYS HG3 H 1 1.483 0.040 . 2 . . . A 330 LYS HG3 . 19362 2 276 . 1 1 25 25 LYS HD2 H 1 1.756 0.040 . 2 . . . A 330 LYS HD2 . 19362 2 277 . 1 1 25 25 LYS HD3 H 1 1.756 0.040 . 2 . . . A 330 LYS HD3 . 19362 2 278 . 1 1 25 25 LYS C C 13 179.032 0.400 . 1 . . . A 330 LYS C . 19362 2 279 . 1 1 25 25 LYS CA C 13 59.89 0.400 . 1 . . . A 330 LYS CA . 19362 2 280 . 1 1 25 25 LYS CB C 13 32.224 0.400 . 1 . . . A 330 LYS CB . 19362 2 281 . 1 1 25 25 LYS CG C 13 25.608 0.400 . 1 . . . A 330 LYS CG . 19362 2 282 . 1 1 25 25 LYS CD C 13 29.303 0.400 . 1 . . . A 330 LYS CD . 19362 2 283 . 1 1 25 25 LYS CE C 13 42.421 0.400 . 1 . . . A 330 LYS CE . 19362 2 284 . 1 1 25 25 LYS N N 15 119.85 0.400 . 1 . . . A 330 LYS N . 19362 2 285 . 1 1 26 26 ALA H H 1 8.296 0.040 . 1 . . . A 331 ALA H . 19362 2 286 . 1 1 26 26 ALA HA H 1 4.153 0.040 . 1 . . . A 331 ALA HA . 19362 2 287 . 1 1 26 26 ALA HB1 H 1 1.569 0.040 . 1 . . . A 331 ALA HB1 . 19362 2 288 . 1 1 26 26 ALA HB2 H 1 1.569 0.040 . 1 . . . A 331 ALA HB2 . 19362 2 289 . 1 1 26 26 ALA HB3 H 1 1.569 0.040 . 1 . . . A 331 ALA HB3 . 19362 2 290 . 1 1 26 26 ALA C C 13 179.276 0.400 . 1 . . . A 331 ALA C . 19362 2 291 . 1 1 26 26 ALA CA C 13 54.866 0.400 . 1 . . . A 331 ALA CA . 19362 2 292 . 1 1 26 26 ALA CB C 13 17.854 0.400 . 1 . . . A 331 ALA CB . 19362 2 293 . 1 1 26 26 ALA N N 15 122.296 0.400 . 1 . . . A 331 ALA N . 19362 2 294 . 1 1 27 27 GLU H H 1 8.451 0.040 . 1 . . . A 332 GLU H . 19362 2 295 . 1 1 27 27 GLU HA H 1 3.63 0.040 . 1 . . . A 332 GLU HA . 19362 2 296 . 1 1 27 27 GLU HB2 H 1 2.193 0.040 . 2 . . . A 332 GLU HB2 . 19362 2 297 . 1 1 27 27 GLU HB3 H 1 2.193 0.040 . 2 . . . A 332 GLU HB3 . 19362 2 298 . 1 1 27 27 GLU HG2 H 1 2.292 0.040 . 2 . . . A 332 GLU HG2 . 19362 2 299 . 1 1 27 27 GLU HG3 H 1 2.174 0.040 . 2 . . . A 332 GLU HG3 . 19362 2 300 . 1 1 27 27 GLU C C 13 178.142 0.400 . 1 . . . A 332 GLU C . 19362 2 301 . 1 1 27 27 GLU CA C 13 59.615 0.400 . 1 . . . A 332 GLU CA . 19362 2 302 . 1 1 27 27 GLU CB C 13 29.154 0.400 . 1 . . . A 332 GLU CB . 19362 2 303 . 1 1 27 27 GLU CG C 13 35.457 0.400 . 1 . . . A 332 GLU CG . 19362 2 304 . 1 1 27 27 GLU N N 15 118.063 0.400 . 1 . . . A 332 GLU N . 19362 2 305 . 1 1 28 28 LYS H H 1 7.834 0.040 . 1 . . . A 333 LYS H . 19362 2 306 . 1 1 28 28 LYS HA H 1 4.089 0.040 . 1 . . . A 333 LYS HA . 19362 2 307 . 1 1 28 28 LYS HB2 H 1 1.985 0.040 . 2 . . . A 333 LYS HB2 . 19362 2 308 . 1 1 28 28 LYS HB3 H 1 1.985 0.040 . 2 . . . A 333 LYS HB3 . 19362 2 309 . 1 1 28 28 LYS HG2 H 1 1.607 0.040 . 2 . . . A 333 LYS HG2 . 19362 2 310 . 1 1 28 28 LYS HG3 H 1 1.607 0.040 . 2 . . . A 333 LYS HG3 . 19362 2 311 . 1 1 28 28 LYS HD2 H 1 1.536 0.040 . 2 . . . A 333 LYS HD2 . 19362 2 312 . 1 1 28 28 LYS HD3 H 1 1.536 0.040 . 2 . . . A 333 LYS HD3 . 19362 2 313 . 1 1 28 28 LYS C C 13 179.66 0.400 . 1 . . . A 333 LYS C . 19362 2 314 . 1 1 28 28 LYS CA C 13 58.239 0.400 . 1 . . . A 333 LYS CA . 19362 2 315 . 1 1 28 28 LYS CB C 13 31.681 0.400 . 1 . . . A 333 LYS CB . 19362 2 316 . 1 1 28 28 LYS CG C 13 24.544 0.400 . 1 . . . A 333 LYS CG . 19362 2 317 . 1 1 28 28 LYS CD C 13 28.603 0.400 . 1 . . . A 333 LYS CD . 19362 2 318 . 1 1 28 28 LYS CE C 13 42.38 0.400 . 1 . . . A 333 LYS CE . 19362 2 319 . 1 1 28 28 LYS N N 15 117.403 0.400 . 1 . . . A 333 LYS N . 19362 2 320 . 1 1 29 29 GLU H H 1 8.051 0.040 . 1 . . . A 334 GLU H . 19362 2 321 . 1 1 29 29 GLU HA H 1 4.149 0.040 . 1 . . . A 334 GLU HA . 19362 2 322 . 1 1 29 29 GLU HB2 H 1 2.191 0.040 . 2 . . . A 334 GLU HB2 . 19362 2 323 . 1 1 29 29 GLU HB3 H 1 2.165 0.040 . 2 . . . A 334 GLU HB3 . 19362 2 324 . 1 1 29 29 GLU HG2 H 1 2.36 0.040 . 2 . . . A 334 GLU HG2 . 19362 2 325 . 1 1 29 29 GLU HG3 H 1 2.36 0.040 . 2 . . . A 334 GLU HG3 . 19362 2 326 . 1 1 29 29 GLU C C 13 179.102 0.400 . 1 . . . A 334 GLU C . 19362 2 327 . 1 1 29 29 GLU CA C 13 58.914 0.400 . 1 . . . A 334 GLU CA . 19362 2 328 . 1 1 29 29 GLU CB C 13 29.102 0.400 . 1 . . . A 334 GLU CB . 19362 2 329 . 1 1 29 29 GLU CG C 13 35.757 0.400 . 1 . . . A 334 GLU CG . 19362 2 330 . 1 1 29 29 GLU N N 15 120.483 0.400 . 1 . . . A 334 GLU N . 19362 2 331 . 1 1 30 30 LEU H H 1 8.319 0.040 . 1 . . . A 335 LEU H . 19362 2 332 . 1 1 30 30 LEU HA H 1 3.987 0.040 . 1 . . . A 335 LEU HA . 19362 2 333 . 1 1 30 30 LEU HB2 H 1 1.376 0.040 . 2 . . . A 335 LEU HB2 . 19362 2 334 . 1 1 30 30 LEU HB3 H 1 1.702 0.040 . 2 . . . A 335 LEU HB3 . 19362 2 335 . 1 1 30 30 LEU HG H 1 1.576 0.040 . 1 . . . A 335 LEU HG . 19362 2 336 . 1 1 30 30 LEU HD11 H 1 0.533 0.040 . 2 . . . A 335 LEU HD11 . 19362 2 337 . 1 1 30 30 LEU HD12 H 1 0.533 0.040 . 2 . . . A 335 LEU HD12 . 19362 2 338 . 1 1 30 30 LEU HD13 H 1 0.533 0.040 . 2 . . . A 335 LEU HD13 . 19362 2 339 . 1 1 30 30 LEU HD21 H 1 0.575 0.040 . 2 . . . A 335 LEU HD21 . 19362 2 340 . 1 1 30 30 LEU HD22 H 1 0.575 0.040 . 2 . . . A 335 LEU HD22 . 19362 2 341 . 1 1 30 30 LEU HD23 H 1 0.575 0.040 . 2 . . . A 335 LEU HD23 . 19362 2 342 . 1 1 30 30 LEU C C 13 179.311 0.400 . 1 . . . A 335 LEU C . 19362 2 343 . 1 1 30 30 LEU CA C 13 57.763 0.400 . 1 . . . A 335 LEU CA . 19362 2 344 . 1 1 30 30 LEU CB C 13 41.481 0.400 . 1 . . . A 335 LEU CB . 19362 2 345 . 1 1 30 30 LEU CG C 13 26.742 0.400 . 1 . . . A 335 LEU CG . 19362 2 346 . 1 1 30 30 LEU CD1 C 13 24.551 0.400 . 2 . . . A 335 LEU CD1 . 19362 2 347 . 1 1 30 30 LEU CD2 C 13 22.997 0.400 . 2 . . . A 335 LEU CD2 . 19362 2 348 . 1 1 30 30 LEU N N 15 120.905 0.400 . 1 . . . A 335 LEU N . 19362 2 349 . 1 1 31 31 GLU H H 1 8.273 0.040 . 1 . . . A 336 GLU H . 19362 2 350 . 1 1 31 31 GLU HA H 1 4.015 0.040 . 1 . . . A 336 GLU HA . 19362 2 351 . 1 1 31 31 GLU HB2 H 1 2.129 0.040 . 2 . . . A 336 GLU HB2 . 19362 2 352 . 1 1 31 31 GLU HB3 H 1 2.129 0.040 . 2 . . . A 336 GLU HB3 . 19362 2 353 . 1 1 31 31 GLU HG2 H 1 2.378 0.040 . 2 . . . A 336 GLU HG2 . 19362 2 354 . 1 1 31 31 GLU HG3 H 1 2.28 0.040 . 2 . . . A 336 GLU HG3 . 19362 2 355 . 1 1 31 31 GLU C C 13 178.369 0.400 . 1 . . . A 336 GLU C . 19362 2 356 . 1 1 31 31 GLU CA C 13 58.617 0.400 . 1 . . . A 336 GLU CA . 19362 2 357 . 1 1 31 31 GLU CB C 13 29.3 0.400 . 1 . . . A 336 GLU CB . 19362 2 358 . 1 1 31 31 GLU CG C 13 36.02 0.400 . 1 . . . A 336 GLU CG . 19362 2 359 . 1 1 31 31 GLU N N 15 117.321 0.400 . 1 . . . A 336 GLU N . 19362 2 360 . 1 1 32 32 SER H H 1 7.924 0.040 . 1 . . . A 337 SER H . 19362 2 361 . 1 1 32 32 SER HA H 1 4.354 0.040 . 1 . . . A 337 SER HA . 19362 2 362 . 1 1 32 32 SER HB2 H 1 3.835 0.040 . 2 . . . A 337 SER HB2 . 19362 2 363 . 1 1 32 32 SER HB3 H 1 3.835 0.040 . 2 . . . A 337 SER HB3 . 19362 2 364 . 1 1 32 32 SER C C 13 174.792 0.400 . 1 . . . A 337 SER C . 19362 2 365 . 1 1 32 32 SER CA C 13 59.785 0.400 . 1 . . . A 337 SER CA . 19362 2 366 . 1 1 32 32 SER CB C 13 63.423 0.001 . 1 . . . A 337 SER CB . 19362 2 367 . 1 1 32 32 SER N N 15 112.613 0.400 . 1 . . . A 337 SER N . 19362 2 368 . 1 1 33 33 HIS H H 1 7.967 0.040 . 1 . . . A 338 HIS H . 19362 2 369 . 1 1 33 33 HIS HA H 1 4.734 0.004 . 1 . . . A 338 HIS HA . 19362 2 370 . 1 1 33 33 HIS HB2 H 1 3.075 0.040 . 2 . . . A 338 HIS HB2 . 19362 2 371 . 1 1 33 33 HIS HB3 H 1 3.046 0.040 . 2 . . . A 338 HIS HB3 . 19362 2 372 . 1 1 33 33 HIS HD2 H 1 7.041 0.002 . 1 . . . A 338 HIS HD2 . 19362 2 373 . 1 1 33 33 HIS C C 13 174.827 0.400 . 1 . . . A 338 HIS C . 19362 2 374 . 1 1 33 33 HIS CA C 13 55.285 0.400 . 1 . . . A 338 HIS CA . 19362 2 375 . 1 1 33 33 HIS CB C 13 28.973 0.400 . 1 . . . A 338 HIS CB . 19362 2 376 . 1 1 33 33 HIS CD2 C 13 119.704 0.400 . 1 . . . A 338 HIS CD2 . 19362 2 377 . 1 1 33 33 HIS N N 15 118.649 0.400 . 1 . . . A 338 HIS N . 19362 2 378 . 1 1 34 34 SER H H 1 8.09 0.040 . 1 . . . A 339 SER H . 19362 2 379 . 1 1 34 34 SER HA H 1 4.349 0.040 . 1 . . . A 339 SER HA . 19362 2 380 . 1 1 34 34 SER HB2 H 1 3.935 0.040 . 2 . . . A 339 SER HB2 . 19362 2 381 . 1 1 34 34 SER HB3 H 1 3.935 0.040 . 2 . . . A 339 SER HB3 . 19362 2 382 . 1 1 34 34 SER C C 13 175.159 0.400 . 1 . . . A 339 SER C . 19362 2 383 . 1 1 34 34 SER CA C 13 60.256 0.400 . 1 . . . A 339 SER CA . 19362 2 384 . 1 1 34 34 SER CB C 13 63.229 0.001 . 1 . . . A 339 SER CB . 19362 2 385 . 1 1 34 34 SER N N 15 115.44 0.400 . 1 . . . A 339 SER N . 19362 2 386 . 1 1 35 35 SER H H 1 8.25 0.040 . 1 . . . A 340 SER H . 19362 2 387 . 1 1 35 35 SER HA H 1 4.434 0.040 . 1 . . . A 340 SER HA . 19362 2 388 . 1 1 35 35 SER HB2 H 1 3.861 0.040 . 2 . . . A 340 SER HB2 . 19362 2 389 . 1 1 35 35 SER HB3 H 1 3.861 0.040 . 2 . . . A 340 SER HB3 . 19362 2 390 . 1 1 35 35 SER C C 13 174.531 0.400 . 1 . . . A 340 SER C . 19362 2 391 . 1 1 35 35 SER CA C 13 59.129 0.400 . 1 . . . A 340 SER CA . 19362 2 392 . 1 1 35 35 SER CB C 13 63.726 0.002 . 1 . . . A 340 SER CB . 19362 2 393 . 1 1 35 35 SER N N 15 115.411 0.400 . 1 . . . A 340 SER N . 19362 2 394 . 1 1 36 36 TRP H H 1 8.077 0.040 . 1 . . . A 341 TRP H . 19362 2 395 . 1 1 36 36 TRP HA H 1 4.61 0.002 . 1 . . . A 341 TRP HA . 19362 2 396 . 1 1 36 36 TRP HB2 H 1 3.142 0.01 . 2 . . . A 341 TRP HB2 . 19362 2 397 . 1 1 36 36 TRP HB3 H 1 3.119 0.001 . 2 . . . A 341 TRP HB3 . 19362 2 398 . 1 1 36 36 TRP HD1 H 1 7.09 0.01 . 1 . . . A 341 TRP HD1 . 19362 2 399 . 1 1 36 36 TRP HE1 H 1 9.991 0.008 . 1 . . . A 341 TRP HE1 . 19362 2 400 . 1 1 36 36 TRP HE3 H 1 7.474 0.003 . 1 . . . A 341 TRP HE3 . 19362 2 401 . 1 1 36 36 TRP C C 13 175.473 0.400 . 1 . . . A 341 TRP C . 19362 2 402 . 1 1 36 36 TRP CA C 13 57.122 0.400 . 1 . . . A 341 TRP CA . 19362 2 403 . 1 1 36 36 TRP CB C 13 29.421 0.400 . 1 . . . A 341 TRP CB . 19362 2 404 . 1 1 36 36 TRP CD1 C 13 126.341 0.400 . 1 . . . A 341 TRP CD1 . 19362 2 405 . 1 1 36 36 TRP CE3 C 13 120.235 0.400 . 1 . . . A 341 TRP CE3 . 19362 2 406 . 1 1 36 36 TRP N N 15 121.124 0.400 . 1 . . . A 341 TRP N . 19362 2 407 . 1 1 36 36 TRP NE1 N 15 127.981 0.400 . 1 . . . A 341 TRP NE1 . 19362 2 408 . 1 1 37 37 TYR H H 1 7.63 0.040 . 1 . . . A 342 TYR H . 19362 2 409 . 1 1 37 37 TYR HA H 1 4.576 0.003 . 1 . . . A 342 TYR HA . 19362 2 410 . 1 1 37 37 TYR HB2 H 1 2.939 0.002 . 2 . . . A 342 TYR HB2 . 19362 2 411 . 1 1 37 37 TYR HB3 H 1 2.787 0.005 . 2 . . . A 342 TYR HB3 . 19362 2 412 . 1 1 37 37 TYR HD2 H 1 7.043 0.001 . 3 . . . A 342 TYR HD2 . 19362 2 413 . 1 1 37 37 TYR HE1 H 1 6.805 0.003 . 3 . . . A 342 TYR HE1 . 19362 2 414 . 1 1 37 37 TYR C C 13 174.565 0.400 . 1 . . . A 342 TYR C . 19362 2 415 . 1 1 37 37 TYR CA C 13 57.197 0.400 . 1 . . . A 342 TYR CA . 19362 2 416 . 1 1 37 37 TYR CB C 13 39.357 0.01 . 1 . . . A 342 TYR CB . 19362 2 417 . 1 1 37 37 TYR CD2 C 13 133.244 0.400 . 3 . . . A 342 TYR CD2 . 19362 2 418 . 1 1 37 37 TYR CE1 C 13 118.376 0.400 . 3 . . . A 342 TYR CE1 . 19362 2 419 . 1 1 37 37 TYR N N 15 118.854 0.400 . 1 . . . A 342 TYR N . 19362 2 420 . 1 1 38 38 ALA H H 1 8.05 0.040 . 1 . . . A 343 ALA H . 19362 2 421 . 1 1 38 38 ALA HA H 1 4.57 0.040 . 1 . . . A 343 ALA HA . 19362 2 422 . 1 1 38 38 ALA HB1 H 1 1.491 0.040 . 1 . . . A 343 ALA HB1 . 19362 2 423 . 1 1 38 38 ALA HB2 H 1 1.491 0.040 . 1 . . . A 343 ALA HB2 . 19362 2 424 . 1 1 38 38 ALA HB3 H 1 1.491 0.040 . 1 . . . A 343 ALA HB3 . 19362 2 425 . 1 1 38 38 ALA CA C 13 51.068 0.400 . 1 . . . A 343 ALA CA . 19362 2 426 . 1 1 38 38 ALA CB C 13 17.99 0.400 . 1 . . . A 343 ALA CB . 19362 2 427 . 1 1 38 38 ALA N N 15 125.05 0.400 . 1 . . . A 343 ALA N . 19362 2 428 . 1 1 39 39 PRO HA H 1 4.309 0.040 . 1 . . . A 344 PRO HA . 19362 2 429 . 1 1 39 39 PRO HB2 H 1 2.381 0.040 . 2 . . . A 344 PRO HB2 . 19362 2 430 . 1 1 39 39 PRO HB3 H 1 1.989 0.040 . 2 . . . A 344 PRO HB3 . 19362 2 431 . 1 1 39 39 PRO HG2 H 1 2.186 0.040 . 2 . . . A 344 PRO HG2 . 19362 2 432 . 1 1 39 39 PRO HG3 H 1 2.071 0.040 . 2 . . . A 344 PRO HG3 . 19362 2 433 . 1 1 39 39 PRO HD2 H 1 3.774 0.040 . 2 . . . A 344 PRO HD2 . 19362 2 434 . 1 1 39 39 PRO HD3 H 1 3.742 0.040 . 2 . . . A 344 PRO HD3 . 19362 2 435 . 1 1 39 39 PRO C C 13 178.317 0.400 . 1 . . . A 344 PRO C . 19362 2 436 . 1 1 39 39 PRO CA C 13 65.414 0.400 . 1 . . . A 344 PRO CA . 19362 2 437 . 1 1 39 39 PRO CB C 13 31.182 0.400 . 1 . . . A 344 PRO CB . 19362 2 438 . 1 1 39 39 PRO CG C 13 27.677 0.400 . 1 . . . A 344 PRO CG . 19362 2 439 . 1 1 39 39 PRO CD C 13 50.25 0.001 . 1 . . . A 344 PRO CD . 19362 2 440 . 1 1 40 40 GLU H H 1 8.986 0.040 . 1 . . . A 345 GLU H . 19362 2 441 . 1 1 40 40 GLU HA H 1 4.133 0.040 . 1 . . . A 345 GLU HA . 19362 2 442 . 1 1 40 40 GLU HB2 H 1 2.104 0.040 . 2 . . . A 345 GLU HB2 . 19362 2 443 . 1 1 40 40 GLU HB3 H 1 2.104 0.040 . 2 . . . A 345 GLU HB3 . 19362 2 444 . 1 1 40 40 GLU HG2 H 1 2.388 0.040 . 2 . . . A 345 GLU HG2 . 19362 2 445 . 1 1 40 40 GLU HG3 H 1 2.388 0.040 . 2 . . . A 345 GLU HG3 . 19362 2 446 . 1 1 40 40 GLU C C 13 178.177 0.400 . 1 . . . A 345 GLU C . 19362 2 447 . 1 1 40 40 GLU CA C 13 59.55 0.400 . 1 . . . A 345 GLU CA . 19362 2 448 . 1 1 40 40 GLU CB C 13 29.021 0.400 . 1 . . . A 345 GLU CB . 19362 2 449 . 1 1 40 40 GLU CG C 13 36.518 0.400 . 1 . . . A 345 GLU CG . 19362 2 450 . 1 1 40 40 GLU N N 15 117.213 0.400 . 1 . . . A 345 GLU N . 19362 2 451 . 1 1 41 41 ALA H H 1 7.967 0.040 . 1 . . . A 346 ALA H . 19362 2 452 . 1 1 41 41 ALA HA H 1 4.173 0.040 . 1 . . . A 346 ALA HA . 19362 2 453 . 1 1 41 41 ALA HB1 H 1 1.542 0.040 . 1 . . . A 346 ALA HB1 . 19362 2 454 . 1 1 41 41 ALA HB2 H 1 1.542 0.040 . 1 . . . A 346 ALA HB2 . 19362 2 455 . 1 1 41 41 ALA HB3 H 1 1.542 0.040 . 1 . . . A 346 ALA HB3 . 19362 2 456 . 1 1 41 41 ALA C C 13 179.398 0.400 . 1 . . . A 346 ALA C . 19362 2 457 . 1 1 41 41 ALA CA C 13 54.901 0.400 . 1 . . . A 346 ALA CA . 19362 2 458 . 1 1 41 41 ALA CB C 13 18.534 0.400 . 1 . . . A 346 ALA CB . 19362 2 459 . 1 1 41 41 ALA N N 15 121.754 0.400 . 1 . . . A 346 ALA N . 19362 2 460 . 1 1 42 42 LEU H H 1 7.852 0.040 . 1 . . . A 347 LEU H . 19362 2 461 . 1 1 42 42 LEU HA H 1 3.856 0.040 . 1 . . . A 347 LEU HA . 19362 2 462 . 1 1 42 42 LEU HB2 H 1 1.53 0.040 . 2 . . . A 347 LEU HB2 . 19362 2 463 . 1 1 42 42 LEU HB3 H 1 2.032 0.040 . 2 . . . A 347 LEU HB3 . 19362 2 464 . 1 1 42 42 LEU HG H 1 1.986 0.040 . 1 . . . A 347 LEU HG . 19362 2 465 . 1 1 42 42 LEU HD11 H 1 0.979 0.040 . 2 . . . A 347 LEU HD11 . 19362 2 466 . 1 1 42 42 LEU HD12 H 1 0.979 0.040 . 2 . . . A 347 LEU HD12 . 19362 2 467 . 1 1 42 42 LEU HD13 H 1 0.979 0.040 . 2 . . . A 347 LEU HD13 . 19362 2 468 . 1 1 42 42 LEU HD21 H 1 0.944 0.040 . 2 . . . A 347 LEU HD21 . 19362 2 469 . 1 1 42 42 LEU HD22 H 1 0.944 0.040 . 2 . . . A 347 LEU HD22 . 19362 2 470 . 1 1 42 42 LEU HD23 H 1 0.944 0.040 . 2 . . . A 347 LEU HD23 . 19362 2 471 . 1 1 42 42 LEU C C 13 179.468 0.400 . 1 . . . A 347 LEU C . 19362 2 472 . 1 1 42 42 LEU CA C 13 58.088 0.400 . 1 . . . A 347 LEU CA . 19362 2 473 . 1 1 42 42 LEU CB C 13 41.703 0.002 . 1 . . . A 347 LEU CB . 19362 2 474 . 1 1 42 42 LEU CG C 13 27.025 0.400 . 1 . . . A 347 LEU CG . 19362 2 475 . 1 1 42 42 LEU CD1 C 13 22.975 0.400 . 2 . . . A 347 LEU CD1 . 19362 2 476 . 1 1 42 42 LEU CD2 C 13 25.035 0.400 . 2 . . . A 347 LEU CD2 . 19362 2 477 . 1 1 42 42 LEU N N 15 118.18 0.400 . 1 . . . A 347 LEU N . 19362 2 478 . 1 1 43 43 GLN H H 1 8.22 0.040 . 1 . . . A 348 GLN H . 19362 2 479 . 1 1 43 43 GLN HA H 1 4.034 0.040 . 1 . . . A 348 GLN HA . 19362 2 480 . 1 1 43 43 GLN HB2 H 1 2.203 0.040 . 2 . . . A 348 GLN HB2 . 19362 2 481 . 1 1 43 43 GLN HB3 H 1 2.203 0.040 . 2 . . . A 348 GLN HB3 . 19362 2 482 . 1 1 43 43 GLN HG2 H 1 2.514 0.040 . 2 . . . A 348 GLN HG2 . 19362 2 483 . 1 1 43 43 GLN HG3 H 1 2.414 0.040 . 2 . . . A 348 GLN HG3 . 19362 2 484 . 1 1 43 43 GLN C C 13 178.596 0.400 . 1 . . . A 348 GLN C . 19362 2 485 . 1 1 43 43 GLN CA C 13 59.461 0.400 . 1 . . . A 348 GLN CA . 19362 2 486 . 1 1 43 43 GLN CB C 13 28.534 0.400 . 1 . . . A 348 GLN CB . 19362 2 487 . 1 1 43 43 GLN CG C 13 33.822 0.003 . 1 . . . A 348 GLN CG . 19362 2 488 . 1 1 43 43 GLN N N 15 118.557 0.400 . 1 . . . A 348 GLN N . 19362 2 489 . 1 1 44 44 LYS H H 1 8.033 0.040 . 1 . . . A 349 LYS H . 19362 2 490 . 1 1 44 44 LYS HA H 1 4.149 0.040 . 1 . . . A 349 LYS HA . 19362 2 491 . 1 1 44 44 LYS HB2 H 1 2.016 0.040 . 2 . . . A 349 LYS HB2 . 19362 2 492 . 1 1 44 44 LYS HB3 H 1 2.016 0.040 . 2 . . . A 349 LYS HB3 . 19362 2 493 . 1 1 44 44 LYS HG2 H 1 1.606 0.040 . 2 . . . A 349 LYS HG2 . 19362 2 494 . 1 1 44 44 LYS HG3 H 1 1.606 0.040 . 2 . . . A 349 LYS HG3 . 19362 2 495 . 1 1 44 44 LYS HD2 H 1 1.74 0.040 . 2 . . . A 349 LYS HD2 . 19362 2 496 . 1 1 44 44 LYS HD3 H 1 1.74 0.040 . 2 . . . A 349 LYS HD3 . 19362 2 497 . 1 1 44 44 LYS HE2 H 1 3.084 0.040 . 2 . . . A 349 LYS HE2 . 19362 2 498 . 1 1 44 44 LYS HE3 H 1 3.084 0.040 . 2 . . . A 349 LYS HE3 . 19362 2 499 . 1 1 44 44 LYS C C 13 178.299 0.400 . 1 . . . A 349 LYS C . 19362 2 500 . 1 1 44 44 LYS CA C 13 59.158 0.400 . 1 . . . A 349 LYS CA . 19362 2 501 . 1 1 44 44 LYS CB C 13 31.931 0.400 . 1 . . . A 349 LYS CB . 19362 2 502 . 1 1 44 44 LYS CG C 13 24.912 0.400 . 1 . . . A 349 LYS CG . 19362 2 503 . 1 1 44 44 LYS CD C 13 28.336 0.400 . 1 . . . A 349 LYS CD . 19362 2 504 . 1 1 44 44 LYS CE C 13 42.283 0.400 . 1 . . . A 349 LYS CE . 19362 2 505 . 1 1 44 44 LYS N N 15 118.707 0.400 . 1 . . . A 349 LYS N . 19362 2 506 . 1 1 45 45 TRP H H 1 8.371 0.040 . 1 . . . A 350 TRP H . 19362 2 507 . 1 1 45 45 TRP HA H 1 4.304 0.001 . 1 . . . A 350 TRP HA . 19362 2 508 . 1 1 45 45 TRP HB2 H 1 3.593 0.040 . 2 . . . A 350 TRP HB2 . 19362 2 509 . 1 1 45 45 TRP HB3 H 1 3.342 0.040 . 2 . . . A 350 TRP HB3 . 19362 2 510 . 1 1 45 45 TRP HD1 H 1 6.997 0.001 . 1 . . . A 350 TRP HD1 . 19362 2 511 . 1 1 45 45 TRP HE1 H 1 9.85 0.008 . 1 . . . A 350 TRP HE1 . 19362 2 512 . 1 1 45 45 TRP HZ3 H 1 6.971 0.002 . 1 . . . A 350 TRP HZ3 . 19362 2 513 . 1 1 45 45 TRP HH2 H 1 7.333 0.003 . 1 . . . A 350 TRP HH2 . 19362 2 514 . 1 1 45 45 TRP C C 13 179.084 0.400 . 1 . . . A 350 TRP C . 19362 2 515 . 1 1 45 45 TRP CA C 13 61.406 0.400 . 1 . . . A 350 TRP CA . 19362 2 516 . 1 1 45 45 TRP CB C 13 28.995 0.009 . 1 . . . A 350 TRP CB . 19362 2 517 . 1 1 45 45 TRP CD1 C 13 125.545 0.400 . 1 . . . A 350 TRP CD1 . 19362 2 518 . 1 1 45 45 TRP CZ3 C 13 122.093 0.400 . 1 . . . A 350 TRP CZ3 . 19362 2 519 . 1 1 45 45 TRP N N 15 120.963 0.400 . 1 . . . A 350 TRP N . 19362 2 520 . 1 1 45 45 TRP NE1 N 15 126.809 0.400 . 1 . . . A 350 TRP NE1 . 19362 2 521 . 1 1 46 46 LEU H H 1 8.928 0.040 . 1 . . . A 351 LEU H . 19362 2 522 . 1 1 46 46 LEU HA H 1 4.23 0.040 . 1 . . . A 351 LEU HA . 19362 2 523 . 1 1 46 46 LEU HB2 H 1 1.852 0.040 . 2 . . . A 351 LEU HB2 . 19362 2 524 . 1 1 46 46 LEU HB3 H 1 1.696 0.040 . 2 . . . A 351 LEU HB3 . 19362 2 525 . 1 1 46 46 LEU HD11 H 1 0.951 0.040 . 2 . . . A 351 LEU HD11 . 19362 2 526 . 1 1 46 46 LEU HD12 H 1 0.951 0.040 . 2 . . . A 351 LEU HD12 . 19362 2 527 . 1 1 46 46 LEU HD13 H 1 0.951 0.040 . 2 . . . A 351 LEU HD13 . 19362 2 528 . 1 1 46 46 LEU HD21 H 1 0.898 0.040 . 2 . . . A 351 LEU HD21 . 19362 2 529 . 1 1 46 46 LEU HD22 H 1 0.898 0.040 . 2 . . . A 351 LEU HD22 . 19362 2 530 . 1 1 46 46 LEU HD23 H 1 0.898 0.040 . 2 . . . A 351 LEU HD23 . 19362 2 531 . 1 1 46 46 LEU C C 13 178.509 0.400 . 1 . . . A 351 LEU C . 19362 2 532 . 1 1 46 46 LEU CA C 13 58.31 0.400 . 1 . . . A 351 LEU CA . 19362 2 533 . 1 1 46 46 LEU CB C 13 41.787 0.007 . 1 . . . A 351 LEU CB . 19362 2 534 . 1 1 46 46 LEU CD1 C 13 23.867 0.400 . 2 . . . A 351 LEU CD1 . 19362 2 535 . 1 1 46 46 LEU CD2 C 13 24.023 0.400 . 2 . . . A 351 LEU CD2 . 19362 2 536 . 1 1 46 46 LEU N N 15 120.875 0.400 . 1 . . . A 351 LEU N . 19362 2 537 . 1 1 47 47 GLN H H 1 8.181 0.040 . 1 . . . A 352 GLN H . 19362 2 538 . 1 1 47 47 GLN HA H 1 4.058 0.040 . 1 . . . A 352 GLN HA . 19362 2 539 . 1 1 47 47 GLN HB2 H 1 2.375 0.040 . 2 . . . A 352 GLN HB2 . 19362 2 540 . 1 1 47 47 GLN HB3 H 1 2.259 0.040 . 2 . . . A 352 GLN HB3 . 19362 2 541 . 1 1 47 47 GLN HG2 H 1 2.615 0.040 . 2 . . . A 352 GLN HG2 . 19362 2 542 . 1 1 47 47 GLN HG3 H 1 2.615 0.040 . 2 . . . A 352 GLN HG3 . 19362 2 543 . 1 1 47 47 GLN C C 13 178.561 0.400 . 1 . . . A 352 GLN C . 19362 2 544 . 1 1 47 47 GLN CA C 13 59.42 0.400 . 1 . . . A 352 GLN CA . 19362 2 545 . 1 1 47 47 GLN CB C 13 28.241 0.002 . 1 . . . A 352 GLN CB . 19362 2 546 . 1 1 47 47 GLN CG C 13 33.726 0.400 . 1 . . . A 352 GLN CG . 19362 2 547 . 1 1 47 47 GLN N N 15 116.803 0.400 . 1 . . . A 352 GLN N . 19362 2 548 . 1 1 48 48 LEU H H 1 8.484 0.040 . 1 . . . A 353 LEU H . 19362 2 549 . 1 1 48 48 LEU HA H 1 4.118 0.040 . 1 . . . A 353 LEU HA . 19362 2 550 . 1 1 48 48 LEU HB2 H 1 1.783 0.040 . 2 . . . A 353 LEU HB2 . 19362 2 551 . 1 1 48 48 LEU HB3 H 1 1.651 0.040 . 2 . . . A 353 LEU HB3 . 19362 2 552 . 1 1 48 48 LEU HD11 H 1 0.876 0.040 . 2 . . . A 353 LEU HD11 . 19362 2 553 . 1 1 48 48 LEU HD12 H 1 0.876 0.040 . 2 . . . A 353 LEU HD12 . 19362 2 554 . 1 1 48 48 LEU HD13 H 1 0.876 0.040 . 2 . . . A 353 LEU HD13 . 19362 2 555 . 1 1 48 48 LEU C C 13 178.666 0.400 . 1 . . . A 353 LEU C . 19362 2 556 . 1 1 48 48 LEU CA C 13 57.609 0.400 . 1 . . . A 353 LEU CA . 19362 2 557 . 1 1 48 48 LEU CB C 13 41.865 0.004 . 1 . . . A 353 LEU CB . 19362 2 558 . 1 1 48 48 LEU CD1 C 13 23.86 0.400 . 2 . . . A 353 LEU CD1 . 19362 2 559 . 1 1 48 48 LEU CD2 C 13 24.165 0.400 . 2 . . . A 353 LEU CD2 . 19362 2 560 . 1 1 48 48 LEU N N 15 121.08 0.400 . 1 . . . A 353 LEU N . 19362 2 561 . 1 1 49 49 THR H H 1 8.328 0.040 . 1 . . . A 354 THR H . 19362 2 562 . 1 1 49 49 THR HA H 1 3.643 0.040 . 1 . . . A 354 THR HA . 19362 2 563 . 1 1 49 49 THR HB H 1 3.896 0.040 . 1 . . . A 354 THR HB . 19362 2 564 . 1 1 49 49 THR HG21 H 1 0.719 0.040 . 1 . . . A 354 THR HG21 . 19362 2 565 . 1 1 49 49 THR HG22 H 1 0.719 0.040 . 1 . . . A 354 THR HG22 . 19362 2 566 . 1 1 49 49 THR HG23 H 1 0.719 0.040 . 1 . . . A 354 THR HG23 . 19362 2 567 . 1 1 49 49 THR C C 13 175.857 0.400 . 1 . . . A 354 THR C . 19362 2 568 . 1 1 49 49 THR CA C 13 66.367 0.400 . 1 . . . A 354 THR CA . 19362 2 569 . 1 1 49 49 THR CB C 13 68.36 0.400 . 1 . . . A 354 THR CB . 19362 2 570 . 1 1 49 49 THR CG2 C 13 21.094 0.400 . 1 . . . A 354 THR CG2 . 19362 2 571 . 1 1 49 49 THR N N 15 111.749 0.400 . 1 . . . A 354 THR N . 19362 2 572 . 1 1 50 50 HIS H H 1 8.068 0.040 . 1 . . . A 355 HIS H . 19362 2 573 . 1 1 50 50 HIS HA H 1 4.451 0.040 . 1 . . . A 355 HIS HA . 19362 2 574 . 1 1 50 50 HIS HB2 H 1 3.412 0.001 . 2 . . . A 355 HIS HB2 . 19362 2 575 . 1 1 50 50 HIS HB3 H 1 3.343 0.001 . 2 . . . A 355 HIS HB3 . 19362 2 576 . 1 1 50 50 HIS HD2 H 1 7.264 0.001 . 1 . . . A 355 HIS HD2 . 19362 2 577 . 1 1 50 50 HIS CA C 13 59.056 0.400 . 1 . . . A 355 HIS CA . 19362 2 578 . 1 1 50 50 HIS CB C 13 28.177 0.400 . 1 . . . A 355 HIS CB . 19362 2 579 . 1 1 50 50 HIS CD2 C 13 120.235 0.400 . 1 . . . A 355 HIS CD2 . 19362 2 580 . 1 1 50 50 HIS N N 15 119.352 0.400 . 1 . . . A 355 HIS N . 19362 2 581 . 1 1 51 51 GLU HA H 1 4.001 0.040 . 1 . . . A 356 GLU HA . 19362 2 582 . 1 1 51 51 GLU HB3 H 1 2.186 0.040 . 2 . . . A 356 GLU HB3 . 19362 2 583 . 1 1 51 51 GLU HG2 H 1 2.442 0.040 . 2 . . . A 356 GLU HG2 . 19362 2 584 . 1 1 51 51 GLU HG3 H 1 2.293 0.040 . 2 . . . A 356 GLU HG3 . 19362 2 585 . 1 1 51 51 GLU C C 13 179.154 0.400 . 1 . . . A 356 GLU C . 19362 2 586 . 1 1 51 51 GLU CA C 13 59.265 0.400 . 1 . . . A 356 GLU CA . 19362 2 587 . 1 1 51 51 GLU CB C 13 29.034 0.400 . 1 . . . A 356 GLU CB . 19362 2 588 . 1 1 51 51 GLU CG C 13 36.559 0.400 . 1 . . . A 356 GLU CG . 19362 2 589 . 1 1 52 52 VAL H H 1 8.341 0.040 . 1 . . . A 357 VAL H . 19362 2 590 . 1 1 52 52 VAL HA H 1 3.606 0.040 . 1 . . . A 357 VAL HA . 19362 2 591 . 1 1 52 52 VAL HB H 1 2.145 0.040 . 1 . . . A 357 VAL HB . 19362 2 592 . 1 1 52 52 VAL HG11 H 1 0.988 0.040 . 2 . . . A 357 VAL HG11 . 19362 2 593 . 1 1 52 52 VAL HG12 H 1 0.988 0.040 . 2 . . . A 357 VAL HG12 . 19362 2 594 . 1 1 52 52 VAL HG13 H 1 0.988 0.040 . 2 . . . A 357 VAL HG13 . 19362 2 595 . 1 1 52 52 VAL HG21 H 1 0.881 0.040 . 2 . . . A 357 VAL HG21 . 19362 2 596 . 1 1 52 52 VAL HG22 H 1 0.881 0.040 . 2 . . . A 357 VAL HG22 . 19362 2 597 . 1 1 52 52 VAL HG23 H 1 0.881 0.040 . 2 . . . A 357 VAL HG23 . 19362 2 598 . 1 1 52 52 VAL C C 13 177.479 0.400 . 1 . . . A 357 VAL C . 19362 2 599 . 1 1 52 52 VAL CA C 13 66.696 0.400 . 1 . . . A 357 VAL CA . 19362 2 600 . 1 1 52 52 VAL CB C 13 31.433 0.400 . 1 . . . A 357 VAL CB . 19362 2 601 . 1 1 52 52 VAL CG1 C 13 22.871 0.400 . 2 . . . A 357 VAL CG1 . 19362 2 602 . 1 1 52 52 VAL CG2 C 13 21.232 0.400 . 2 . . . A 357 VAL CG2 . 19362 2 603 . 1 1 52 52 VAL N N 15 119.311 0.400 . 1 . . . A 357 VAL N . 19362 2 604 . 1 1 53 53 GLU H H 1 8.115 0.040 . 1 . . . A 358 GLU H . 19362 2 605 . 1 1 53 53 GLU HA H 1 4.114 0.040 . 1 . . . A 358 GLU HA . 19362 2 606 . 1 1 53 53 GLU HB2 H 1 2.19 0.040 . 2 . . . A 358 GLU HB2 . 19362 2 607 . 1 1 53 53 GLU HB3 H 1 2.19 0.040 . 2 . . . A 358 GLU HB3 . 19362 2 608 . 1 1 53 53 GLU HG2 H 1 2.466 0.040 . 2 . . . A 358 GLU HG2 . 19362 2 609 . 1 1 53 53 GLU HG3 H 1 2.339 0.040 . 2 . . . A 358 GLU HG3 . 19362 2 610 . 1 1 53 53 GLU C C 13 178.892 0.400 . 1 . . . A 358 GLU C . 19362 2 611 . 1 1 53 53 GLU CA C 13 59.519 0.400 . 1 . . . A 358 GLU CA . 19362 2 612 . 1 1 53 53 GLU CB C 13 29.334 0.400 . 1 . . . A 358 GLU CB . 19362 2 613 . 1 1 53 53 GLU CG C 13 36.312 0.400 . 1 . . . A 358 GLU CG . 19362 2 614 . 1 1 53 53 GLU N N 15 119.674 0.400 . 1 . . . A 358 GLU N . 19362 2 615 . 1 1 54 54 VAL H H 1 8.211 0.040 . 1 . . . A 359 VAL H . 19362 2 616 . 1 1 54 54 VAL HA H 1 3.722 0.040 . 1 . . . A 359 VAL HA . 19362 2 617 . 1 1 54 54 VAL HB H 1 2.126 0.040 . 1 . . . A 359 VAL HB . 19362 2 618 . 1 1 54 54 VAL HG11 H 1 0.857 0.040 . 2 . . . A 359 VAL HG11 . 19362 2 619 . 1 1 54 54 VAL HG12 H 1 0.857 0.040 . 2 . . . A 359 VAL HG12 . 19362 2 620 . 1 1 54 54 VAL HG13 H 1 0.857 0.040 . 2 . . . A 359 VAL HG13 . 19362 2 621 . 1 1 54 54 VAL HG21 H 1 0.963 0.040 . 2 . . . A 359 VAL HG21 . 19362 2 622 . 1 1 54 54 VAL HG22 H 1 0.963 0.040 . 2 . . . A 359 VAL HG22 . 19362 2 623 . 1 1 54 54 VAL HG23 H 1 0.963 0.040 . 2 . . . A 359 VAL HG23 . 19362 2 624 . 1 1 54 54 VAL C C 13 176.031 0.400 . 1 . . . A 359 VAL C . 19362 2 625 . 1 1 54 54 VAL CA C 13 66.436 0.400 . 1 . . . A 359 VAL CA . 19362 2 626 . 1 1 54 54 VAL CB C 13 31.72 0.400 . 1 . . . A 359 VAL CB . 19362 2 627 . 1 1 54 54 VAL CG1 C 13 22.347 0.400 . 2 . . . A 359 VAL CG1 . 19362 2 628 . 1 1 54 54 VAL CG2 C 13 21.11 0.400 . 2 . . . A 359 VAL CG2 . 19362 2 629 . 1 1 54 54 VAL N N 15 118.356 0.400 . 1 . . . A 359 VAL N . 19362 2 630 . 1 1 55 55 GLN H H 1 8.213 0.040 . 1 . . . A 360 GLN H . 19362 2 631 . 1 1 55 55 GLN HA H 1 4.218 0.040 . 1 . . . A 360 GLN HA . 19362 2 632 . 1 1 55 55 GLN HB2 H 1 2.237 0.040 . 2 . . . A 360 GLN HB2 . 19362 2 633 . 1 1 55 55 GLN HB3 H 1 2.237 0.040 . 2 . . . A 360 GLN HB3 . 19362 2 634 . 1 1 55 55 GLN HG2 H 1 2.526 0.040 . 2 . . . A 360 GLN HG2 . 19362 2 635 . 1 1 55 55 GLN HG3 H 1 2.526 0.040 . 2 . . . A 360 GLN HG3 . 19362 2 636 . 1 1 55 55 GLN C C 13 178.369 0.400 . 1 . . . A 360 GLN C . 19362 2 637 . 1 1 55 55 GLN CA C 13 58.882 0.400 . 1 . . . A 360 GLN CA . 19362 2 638 . 1 1 55 55 GLN CB C 13 27.908 0.400 . 1 . . . A 360 GLN CB . 19362 2 639 . 1 1 55 55 GLN CG C 13 33.378 0.400 . 1 . . . A 360 GLN CG . 19362 2 640 . 1 1 55 55 GLN N N 15 119.015 0.400 . 1 . . . A 360 GLN N . 19362 2 641 . 1 1 56 56 TYR H H 1 8.863 0.040 . 1 . . . A 361 TYR H . 19362 2 642 . 1 1 56 56 TYR HA H 1 4.16 0.001 . 1 . . . A 361 TYR HA . 19362 2 643 . 1 1 56 56 TYR HB2 H 1 3.173 0.005 . 2 . . . A 361 TYR HB2 . 19362 2 644 . 1 1 56 56 TYR HB3 H 1 3.078 0.013 . 2 . . . A 361 TYR HB3 . 19362 2 645 . 1 1 56 56 TYR HD1 H 1 6.879 0.002 . 3 . . . A 361 TYR HD1 . 19362 2 646 . 1 1 56 56 TYR HE2 H 1 6.702 0.002 . 3 . . . A 361 TYR HE2 . 19362 2 647 . 1 1 56 56 TYR C C 13 177.2 0.400 . 1 . . . A 361 TYR C . 19362 2 648 . 1 1 56 56 TYR CA C 13 61.499 0.400 . 1 . . . A 361 TYR CA . 19362 2 649 . 1 1 56 56 TYR CB C 13 38.183 0.400 . 1 . . . A 361 TYR CB . 19362 2 650 . 1 1 56 56 TYR CD1 C 13 132.182 0.400 . 3 . . . A 361 TYR CD1 . 19362 2 651 . 1 1 56 56 TYR CE2 C 13 118.111 0.400 . 3 . . . A 361 TYR CE2 . 19362 2 652 . 1 1 56 56 TYR N N 15 120.172 0.400 . 1 . . . A 361 TYR N . 19362 2 653 . 1 1 57 57 TYR H H 1 8.561 0.040 . 1 . . . A 362 TYR H . 19362 2 654 . 1 1 57 57 TYR HA H 1 4.05 0.002 . 1 . . . A 362 TYR HA . 19362 2 655 . 1 1 57 57 TYR HB2 H 1 3.205 0.019 . 2 . . . A 362 TYR HB2 . 19362 2 656 . 1 1 57 57 TYR HB3 H 1 3.213 0.023 . 2 . . . A 362 TYR HB3 . 19362 2 657 . 1 1 57 57 TYR HD1 H 1 7.229 0.040 . 3 . . . A 362 TYR HD1 . 19362 2 658 . 1 1 57 57 TYR HE2 H 1 6.887 0.001 . 3 . . . A 362 TYR HE2 . 19362 2 659 . 1 1 57 57 TYR C C 13 177.723 0.400 . 1 . . . A 362 TYR C . 19362 2 660 . 1 1 57 57 TYR CA C 13 61.782 0.400 . 1 . . . A 362 TYR CA . 19362 2 661 . 1 1 57 57 TYR CB C 13 37.69 0.400 . 1 . . . A 362 TYR CB . 19362 2 662 . 1 1 57 57 TYR CD1 C 13 133.244 0.400 . 3 . . . A 362 TYR CD1 . 19362 2 663 . 1 1 57 57 TYR CE2 C 13 118.111 0.400 . 3 . . . A 362 TYR CE2 . 19362 2 664 . 1 1 57 57 TYR N N 15 118.707 0.400 . 1 . . . A 362 TYR N . 19362 2 665 . 1 1 58 58 ASN H H 1 8.445 0.040 . 1 . . . A 363 ASN H . 19362 2 666 . 1 1 58 58 ASN HA H 1 4.423 0.040 . 1 . . . A 363 ASN HA . 19362 2 667 . 1 1 58 58 ASN HB2 H 1 3.046 0.040 . 2 . . . A 363 ASN HB2 . 19362 2 668 . 1 1 58 58 ASN HB3 H 1 2.809 0.040 . 2 . . . A 363 ASN HB3 . 19362 2 669 . 1 1 58 58 ASN C C 13 177.88 0.400 . 1 . . . A 363 ASN C . 19362 2 670 . 1 1 58 58 ASN CA C 13 56.368 0.400 . 1 . . . A 363 ASN CA . 19362 2 671 . 1 1 58 58 ASN CB C 13 38.306 0.004 . 1 . . . A 363 ASN CB . 19362 2 672 . 1 1 58 58 ASN N N 15 117.671 0.400 . 1 . . . A 363 ASN N . 19362 2 673 . 1 1 59 59 ILE H H 1 8.341 0.040 . 1 . . . A 364 ILE H . 19362 2 674 . 1 1 59 59 ILE HA H 1 3.79 0.040 . 1 . . . A 364 ILE HA . 19362 2 675 . 1 1 59 59 ILE HB H 1 1.945 0.040 . 1 . . . A 364 ILE HB . 19362 2 676 . 1 1 59 59 ILE HG12 H 1 1.773 0.040 . 2 . . . A 364 ILE HG12 . 19362 2 677 . 1 1 59 59 ILE HG13 H 1 1.19 0.040 . 2 . . . A 364 ILE HG13 . 19362 2 678 . 1 1 59 59 ILE HG21 H 1 0.896 0.040 . 1 . . . A 364 ILE HG21 . 19362 2 679 . 1 1 59 59 ILE HG22 H 1 0.896 0.040 . 1 . . . A 364 ILE HG22 . 19362 2 680 . 1 1 59 59 ILE HG23 H 1 0.896 0.040 . 1 . . . A 364 ILE HG23 . 19362 2 681 . 1 1 59 59 ILE HD11 H 1 0.857 0.040 . 1 . . . A 364 ILE HD11 . 19362 2 682 . 1 1 59 59 ILE HD12 H 1 0.857 0.040 . 1 . . . A 364 ILE HD12 . 19362 2 683 . 1 1 59 59 ILE HD13 H 1 0.857 0.040 . 1 . . . A 364 ILE HD13 . 19362 2 684 . 1 1 59 59 ILE C C 13 178.194 0.400 . 1 . . . A 364 ILE C . 19362 2 685 . 1 1 59 59 ILE CA C 13 64.714 0.400 . 1 . . . A 364 ILE CA . 19362 2 686 . 1 1 59 59 ILE CB C 13 37.863 0.400 . 1 . . . A 364 ILE CB . 19362 2 687 . 1 1 59 59 ILE CG1 C 13 29.048 0.002 . 1 . . . A 364 ILE CG1 . 19362 2 688 . 1 1 59 59 ILE CG2 C 13 17.289 0.400 . 1 . . . A 364 ILE CG2 . 19362 2 689 . 1 1 59 59 ILE CD1 C 13 13.158 0.400 . 1 . . . A 364 ILE CD1 . 19362 2 690 . 1 1 59 59 ILE N N 15 121.461 0.400 . 1 . . . A 364 ILE N . 19362 2 691 . 1 1 60 60 LYS H H 1 8.243 0.040 . 1 . . . A 365 LYS H . 19362 2 692 . 1 1 60 60 LYS HA H 1 3.927 0.040 . 1 . . . A 365 LYS HA . 19362 2 693 . 1 1 60 60 LYS HB2 H 1 2.025 0.040 . 2 . . . A 365 LYS HB2 . 19362 2 694 . 1 1 60 60 LYS HB3 H 1 2.025 0.040 . 2 . . . A 365 LYS HB3 . 19362 2 695 . 1 1 60 60 LYS HG2 H 1 1.259 0.040 . 2 . . . A 365 LYS HG2 . 19362 2 696 . 1 1 60 60 LYS HG3 H 1 1.215 0.040 . 2 . . . A 365 LYS HG3 . 19362 2 697 . 1 1 60 60 LYS HD2 H 1 1.529 0.040 . 2 . . . A 365 LYS HD2 . 19362 2 698 . 1 1 60 60 LYS HD3 H 1 1.529 0.040 . 2 . . . A 365 LYS HD3 . 19362 2 699 . 1 1 60 60 LYS HE2 H 1 2.906 0.040 . 2 . . . A 365 LYS HE2 . 19362 2 700 . 1 1 60 60 LYS HE3 H 1 2.798 0.040 . 2 . . . A 365 LYS HE3 . 19362 2 701 . 1 1 60 60 LYS C C 13 179.433 0.400 . 1 . . . A 365 LYS C . 19362 2 702 . 1 1 60 60 LYS CA C 13 59.051 0.400 . 1 . . . A 365 LYS CA . 19362 2 703 . 1 1 60 60 LYS CB C 13 31.683 0.400 . 1 . . . A 365 LYS CB . 19362 2 704 . 1 1 60 60 LYS CG C 13 24.444 0.400 . 1 . . . A 365 LYS CG . 19362 2 705 . 1 1 60 60 LYS CD C 13 28.602 0.400 . 1 . . . A 365 LYS CD . 19362 2 706 . 1 1 60 60 LYS CE C 13 41.685 0.400 . 1 . . . A 365 LYS CE . 19362 2 707 . 1 1 60 60 LYS N N 15 120.861 0.400 . 1 . . . A 365 LYS N . 19362 2 708 . 1 1 61 61 LYS H H 1 8.437 0.040 . 1 . . . A 366 LYS H . 19362 2 709 . 1 1 61 61 LYS HB2 H 1 1.862 0.040 . 2 . . . A 366 LYS HB2 . 19362 2 710 . 1 1 61 61 LYS HB3 H 1 1.744 0.040 . 2 . . . A 366 LYS HB3 . 19362 2 711 . 1 1 61 61 LYS HG2 H 1 1.433 0.040 . 2 . . . A 366 LYS HG2 . 19362 2 712 . 1 1 61 61 LYS HG3 H 1 1.375 0.040 . 2 . . . A 366 LYS HG3 . 19362 2 713 . 1 1 61 61 LYS HD2 H 1 1.684 0.040 . 2 . . . A 366 LYS HD2 . 19362 2 714 . 1 1 61 61 LYS HD3 H 1 1.663 0.040 . 2 . . . A 366 LYS HD3 . 19362 2 715 . 1 1 61 61 LYS HE2 H 1 2.99 0.040 . 2 . . . A 366 LYS HE2 . 19362 2 716 . 1 1 61 61 LYS HE3 H 1 2.99 0.040 . 2 . . . A 366 LYS HE3 . 19362 2 717 . 1 1 61 61 LYS CA C 13 59.225 0.400 . 1 . . . A 366 LYS CA . 19362 2 718 . 1 1 61 61 LYS CB C 13 32.281 0.400 . 1 . . . A 366 LYS CB . 19362 2 719 . 1 1 61 61 LYS CG C 13 24.682 0.400 . 1 . . . A 366 LYS CG . 19362 2 720 . 1 1 61 61 LYS CD C 13 29.342 0.400 . 1 . . . A 366 LYS CD . 19362 2 721 . 1 1 61 61 LYS CE C 13 41.929 0.400 . 1 . . . A 366 LYS CE . 19362 2 722 . 1 1 61 61 LYS N N 15 120.289 0.400 . 1 . . . A 366 LYS N . 19362 2 723 . 1 1 62 62 GLN HA H 1 4.156 0.040 . 1 . . . A 367 GLN HA . 19362 2 724 . 1 1 62 62 GLN HB2 H 1 2.202 0.040 . 2 . . . A 367 GLN HB2 . 19362 2 725 . 1 1 62 62 GLN HB3 H 1 2.202 0.040 . 2 . . . A 367 GLN HB3 . 19362 2 726 . 1 1 62 62 GLN HG2 H 1 2.589 0.040 . 2 . . . A 367 GLN HG2 . 19362 2 727 . 1 1 62 62 GLN HG3 H 1 2.432 0.040 . 2 . . . A 367 GLN HG3 . 19362 2 728 . 1 1 62 62 GLN C C 13 178.509 0.400 . 1 . . . A 367 GLN C . 19362 2 729 . 1 1 62 62 GLN CA C 13 58.487 0.400 . 1 . . . A 367 GLN CA . 19362 2 730 . 1 1 62 62 GLN CB C 13 28.652 0.400 . 1 . . . A 367 GLN CB . 19362 2 731 . 1 1 62 62 GLN CG C 13 34.244 0.400 . 1 . . . A 367 GLN CG . 19362 2 732 . 1 1 63 63 ASN H H 1 8.429 0.040 . 1 . . . A 368 ASN H . 19362 2 733 . 1 1 63 63 ASN HA H 1 4.549 0.040 . 1 . . . A 368 ASN HA . 19362 2 734 . 1 1 63 63 ASN HB2 H 1 2.914 0.040 . 2 . . . A 368 ASN HB2 . 19362 2 735 . 1 1 63 63 ASN HB3 H 1 2.821 0.040 . 2 . . . A 368 ASN HB3 . 19362 2 736 . 1 1 63 63 ASN C C 13 177.078 0.400 . 1 . . . A 368 ASN C . 19362 2 737 . 1 1 63 63 ASN CA C 13 55.737 0.400 . 1 . . . A 368 ASN CA . 19362 2 738 . 1 1 63 63 ASN CB C 13 38.388 0.002 . 1 . . . A 368 ASN CB . 19362 2 739 . 1 1 63 63 ASN N N 15 117.931 0.400 . 1 . . . A 368 ASN N . 19362 2 740 . 1 1 64 64 ALA H H 1 8.272 0.040 . 1 . . . A 369 ALA H . 19362 2 741 . 1 1 64 64 ALA HA H 1 4.201 0.040 . 1 . . . A 369 ALA HA . 19362 2 742 . 1 1 64 64 ALA HB1 H 1 1.56 0.040 . 1 . . . A 369 ALA HB1 . 19362 2 743 . 1 1 64 64 ALA HB2 H 1 1.56 0.040 . 1 . . . A 369 ALA HB2 . 19362 2 744 . 1 1 64 64 ALA HB3 H 1 1.56 0.040 . 1 . . . A 369 ALA HB3 . 19362 2 745 . 1 1 64 64 ALA C C 13 179.8 0.400 . 1 . . . A 369 ALA C . 19362 2 746 . 1 1 64 64 ALA CA C 13 54.92 0.400 . 1 . . . A 369 ALA CA . 19362 2 747 . 1 1 64 64 ALA CB C 13 17.954 0.400 . 1 . . . A 369 ALA CB . 19362 2 748 . 1 1 64 64 ALA N N 15 123.439 0.400 . 1 . . . A 369 ALA N . 19362 2 749 . 1 1 65 65 GLU H H 1 8.402 0.040 . 1 . . . A 370 GLU H . 19362 2 750 . 1 1 65 65 GLU HA H 1 4.053 0.040 . 1 . . . A 370 GLU HA . 19362 2 751 . 1 1 65 65 GLU HB2 H 1 2.189 0.040 . 2 . . . A 370 GLU HB2 . 19362 2 752 . 1 1 65 65 GLU HB3 H 1 2.142 0.040 . 2 . . . A 370 GLU HB3 . 19362 2 753 . 1 1 65 65 GLU HG2 H 1 2.514 0.040 . 2 . . . A 370 GLU HG2 . 19362 2 754 . 1 1 65 65 GLU HG3 H 1 2.288 0.040 . 2 . . . A 370 GLU HG3 . 19362 2 755 . 1 1 65 65 GLU C C 13 178.561 0.400 . 1 . . . A 370 GLU C . 19362 2 756 . 1 1 65 65 GLU CA C 13 59.247 0.400 . 1 . . . A 370 GLU CA . 19362 2 757 . 1 1 65 65 GLU CB C 13 29.512 0.400 . 1 . . . A 370 GLU CB . 19362 2 758 . 1 1 65 65 GLU CG C 13 36.633 0.400 . 1 . . . A 370 GLU CG . 19362 2 759 . 1 1 65 65 GLU N N 15 117.931 0.400 . 1 . . . A 370 GLU N . 19362 2 760 . 1 1 66 66 LYS H H 1 8.114 0.040 . 1 . . . A 371 LYS H . 19362 2 761 . 1 1 66 66 LYS HA H 1 4.101 0.040 . 1 . . . A 371 LYS HA . 19362 2 762 . 1 1 66 66 LYS HB2 H 1 1.97 0.040 . 2 . . . A 371 LYS HB2 . 19362 2 763 . 1 1 66 66 LYS HB3 H 1 1.97 0.040 . 2 . . . A 371 LYS HB3 . 19362 2 764 . 1 1 66 66 LYS HG2 H 1 1.64 0.040 . 2 . . . A 371 LYS HG2 . 19362 2 765 . 1 1 66 66 LYS HG3 H 1 1.526 0.040 . 2 . . . A 371 LYS HG3 . 19362 2 766 . 1 1 66 66 LYS HD2 H 1 1.76 0.040 . 2 . . . A 371 LYS HD2 . 19362 2 767 . 1 1 66 66 LYS HD3 H 1 1.633 0.040 . 2 . . . A 371 LYS HD3 . 19362 2 768 . 1 1 66 66 LYS HE2 H 1 2.992 0.040 . 2 . . . A 371 LYS HE2 . 19362 2 769 . 1 1 66 66 LYS HE3 H 1 2.992 0.040 . 2 . . . A 371 LYS HE3 . 19362 2 770 . 1 1 66 66 LYS C C 13 178.215 0.400 . 1 . . . A 371 LYS C . 19362 2 771 . 1 1 66 66 LYS CA C 13 59.389 0.400 . 1 . . . A 371 LYS CA . 19362 2 772 . 1 1 66 66 LYS CB C 13 32.247 0.400 . 1 . . . A 371 LYS CB . 19362 2 773 . 1 1 66 66 LYS CG C 13 25.129 0.400 . 1 . . . A 371 LYS CG . 19362 2 774 . 1 1 66 66 LYS CD C 13 28.913 0.400 . 1 . . . A 371 LYS CD . 19362 2 775 . 1 1 66 66 LYS CE C 13 41.814 0.400 . 1 . . . A 371 LYS CE . 19362 2 776 . 1 1 66 66 LYS N N 15 118.722 0.400 . 1 . . . A 371 LYS N . 19362 2 777 . 1 1 67 67 GLN H H 1 8.064 0.040 . 1 . . . A 372 GLN H . 19362 2 778 . 1 1 67 67 GLN HA H 1 4.114 0.040 . 1 . . . A 372 GLN HA . 19362 2 779 . 1 1 67 67 GLN HB2 H 1 2.199 0.040 . 2 . . . A 372 GLN HB2 . 19362 2 780 . 1 1 67 67 GLN HB3 H 1 2.199 0.040 . 2 . . . A 372 GLN HB3 . 19362 2 781 . 1 1 67 67 GLN HG2 H 1 2.527 0.040 . 2 . . . A 372 GLN HG2 . 19362 2 782 . 1 1 67 67 GLN HG3 H 1 2.441 0.040 . 2 . . . A 372 GLN HG3 . 19362 2 783 . 1 1 67 67 GLN C C 13 178.317 0.400 . 1 . . . A 372 GLN C . 19362 2 784 . 1 1 67 67 GLN CA C 13 58.4 0.400 . 1 . . . A 372 GLN CA . 19362 2 785 . 1 1 67 67 GLN CB C 13 28.421 0.400 . 1 . . . A 372 GLN CB . 19362 2 786 . 1 1 67 67 GLN CG C 13 33.938 0.400 . 1 . . . A 372 GLN CG . 19362 2 787 . 1 1 67 67 GLN N N 15 117.052 0.400 . 1 . . . A 372 GLN N . 19362 2 788 . 1 1 68 68 LEU H H 1 8.037 0.040 . 1 . . . A 373 LEU H . 19362 2 789 . 1 1 68 68 LEU HA H 1 4.214 0.040 . 1 . . . A 373 LEU HA . 19362 2 790 . 1 1 68 68 LEU HB2 H 1 1.89 0.040 . 2 . . . A 373 LEU HB2 . 19362 2 791 . 1 1 68 68 LEU HB3 H 1 1.717 0.040 . 2 . . . A 373 LEU HB3 . 19362 2 792 . 1 1 68 68 LEU HG H 1 1.797 0.040 . 1 . . . A 373 LEU HG . 19362 2 793 . 1 1 68 68 LEU HD11 H 1 0.941 0.040 . 2 . . . A 373 LEU HD11 . 19362 2 794 . 1 1 68 68 LEU HD12 H 1 0.941 0.040 . 2 . . . A 373 LEU HD12 . 19362 2 795 . 1 1 68 68 LEU HD13 H 1 0.941 0.040 . 2 . . . A 373 LEU HD13 . 19362 2 796 . 1 1 68 68 LEU HD21 H 1 0.985 0.040 . 2 . . . A 373 LEU HD21 . 19362 2 797 . 1 1 68 68 LEU HD22 H 1 0.985 0.040 . 2 . . . A 373 LEU HD22 . 19362 2 798 . 1 1 68 68 LEU HD23 H 1 0.985 0.040 . 2 . . . A 373 LEU HD23 . 19362 2 799 . 1 1 68 68 LEU C C 13 178.578 0.400 . 1 . . . A 373 LEU C . 19362 2 800 . 1 1 68 68 LEU CA C 13 57.833 0.400 . 1 . . . A 373 LEU CA . 19362 2 801 . 1 1 68 68 LEU CB C 13 41.822 0.400 . 1 . . . A 373 LEU CB . 19362 2 802 . 1 1 68 68 LEU CG C 13 26.977 0.400 . 1 . . . A 373 LEU CG . 19362 2 803 . 1 1 68 68 LEU CD1 C 13 23.457 0.400 . 2 . . . A 373 LEU CD1 . 19362 2 804 . 1 1 68 68 LEU CD2 C 13 24.64 0.400 . 2 . . . A 373 LEU CD2 . 19362 2 805 . 1 1 68 68 LEU N N 15 120.216 0.400 . 1 . . . A 373 LEU N . 19362 2 806 . 1 1 69 69 LEU H H 1 8.04 0.040 . 1 . . . A 374 LEU H . 19362 2 807 . 1 1 69 69 LEU HA H 1 4.203 0.040 . 1 . . . A 374 LEU HA . 19362 2 808 . 1 1 69 69 LEU HB2 H 1 1.71 0.040 . 2 . . . A 374 LEU HB2 . 19362 2 809 . 1 1 69 69 LEU HB3 H 1 1.907 0.040 . 2 . . . A 374 LEU HB3 . 19362 2 810 . 1 1 69 69 LEU HG H 1 1.815 0.040 . 1 . . . A 374 LEU HG . 19362 2 811 . 1 1 69 69 LEU HD11 H 1 0.972 0.040 . 2 . . . A 374 LEU HD11 . 19362 2 812 . 1 1 69 69 LEU HD12 H 1 0.972 0.040 . 2 . . . A 374 LEU HD12 . 19362 2 813 . 1 1 69 69 LEU HD13 H 1 0.972 0.040 . 2 . . . A 374 LEU HD13 . 19362 2 814 . 1 1 69 69 LEU HD21 H 1 0.934 0.040 . 2 . . . A 374 LEU HD21 . 19362 2 815 . 1 1 69 69 LEU HD22 H 1 0.934 0.040 . 2 . . . A 374 LEU HD22 . 19362 2 816 . 1 1 69 69 LEU HD23 H 1 0.934 0.040 . 2 . . . A 374 LEU HD23 . 19362 2 817 . 1 1 69 69 LEU C C 13 179.137 0.400 . 1 . . . A 374 LEU C . 19362 2 818 . 1 1 69 69 LEU CA C 13 57.79 0.400 . 1 . . . A 374 LEU CA . 19362 2 819 . 1 1 69 69 LEU CB C 13 41.778 0.400 . 1 . . . A 374 LEU CB . 19362 2 820 . 1 1 69 69 LEU CG C 13 26.907 0.400 . 1 . . . A 374 LEU CG . 19362 2 821 . 1 1 69 69 LEU CD1 C 13 24.511 0.400 . 2 . . . A 374 LEU CD1 . 19362 2 822 . 1 1 69 69 LEU CD2 C 13 23.374 0.400 . 2 . . . A 374 LEU CD2 . 19362 2 823 . 1 1 69 69 LEU N N 15 119.894 0.400 . 1 . . . A 374 LEU N . 19362 2 824 . 1 1 70 70 VAL H H 1 8.099 0.040 . 1 . . . A 375 VAL H . 19362 2 825 . 1 1 70 70 VAL HA H 1 3.886 0.040 . 1 . . . A 375 VAL HA . 19362 2 826 . 1 1 70 70 VAL HB H 1 2.214 0.040 . 1 . . . A 375 VAL HB . 19362 2 827 . 1 1 70 70 VAL HG11 H 1 1.098 0.040 . 2 . . . A 375 VAL HG11 . 19362 2 828 . 1 1 70 70 VAL HG12 H 1 1.098 0.040 . 2 . . . A 375 VAL HG12 . 19362 2 829 . 1 1 70 70 VAL HG13 H 1 1.098 0.040 . 2 . . . A 375 VAL HG13 . 19362 2 830 . 1 1 70 70 VAL HG21 H 1 1.016 0.040 . 2 . . . A 375 VAL HG21 . 19362 2 831 . 1 1 70 70 VAL HG22 H 1 1.016 0.040 . 2 . . . A 375 VAL HG22 . 19362 2 832 . 1 1 70 70 VAL HG23 H 1 1.016 0.040 . 2 . . . A 375 VAL HG23 . 19362 2 833 . 1 1 70 70 VAL C C 13 178.282 0.400 . 1 . . . A 375 VAL C . 19362 2 834 . 1 1 70 70 VAL CA C 13 65.02 0.400 . 1 . . . A 375 VAL CA . 19362 2 835 . 1 1 70 70 VAL CB C 13 31.997 0.400 . 1 . . . A 375 VAL CB . 19362 2 836 . 1 1 70 70 VAL CG1 C 13 21.809 0.400 . 2 . . . A 375 VAL CG1 . 19362 2 837 . 1 1 70 70 VAL CG2 C 13 21.021 0.400 . 2 . . . A 375 VAL CG2 . 19362 2 838 . 1 1 70 70 VAL N N 15 118.561 0.400 . 1 . . . A 375 VAL N . 19362 2 839 . 1 1 71 71 ALA H H 1 8.113 0.040 . 1 . . . A 376 ALA H . 19362 2 840 . 1 1 71 71 ALA HA H 1 4.269 0.040 . 1 . . . A 376 ALA HA . 19362 2 841 . 1 1 71 71 ALA HB1 H 1 1.561 0.040 . 1 . . . A 376 ALA HB1 . 19362 2 842 . 1 1 71 71 ALA HB2 H 1 1.561 0.040 . 1 . . . A 376 ALA HB2 . 19362 2 843 . 1 1 71 71 ALA HB3 H 1 1.561 0.040 . 1 . . . A 376 ALA HB3 . 19362 2 844 . 1 1 71 71 ALA C C 13 179.625 0.400 . 1 . . . A 376 ALA C . 19362 2 845 . 1 1 71 71 ALA CA C 13 54.127 0.400 . 1 . . . A 376 ALA CA . 19362 2 846 . 1 1 71 71 ALA CB C 13 18.23 0.400 . 1 . . . A 376 ALA CB . 19362 2 847 . 1 1 71 71 ALA N N 15 123.776 0.400 . 1 . . . A 376 ALA N . 19362 2 848 . 1 1 72 72 LYS H H 1 8.374 0.040 . 1 . . . A 377 LYS H . 19362 2 849 . 1 1 72 72 LYS HA H 1 4.18 0.040 . 1 . . . A 377 LYS HA . 19362 2 850 . 1 1 72 72 LYS HB2 H 1 1.995 0.040 . 2 . . . A 377 LYS HB2 . 19362 2 851 . 1 1 72 72 LYS HB3 H 1 1.995 0.040 . 2 . . . A 377 LYS HB3 . 19362 2 852 . 1 1 72 72 LYS HG2 H 1 1.619 0.040 . 2 . . . A 377 LYS HG2 . 19362 2 853 . 1 1 72 72 LYS HG3 H 1 1.49 0.040 . 2 . . . A 377 LYS HG3 . 19362 2 854 . 1 1 72 72 LYS HD2 H 1 1.744 0.040 . 2 . . . A 377 LYS HD2 . 19362 2 855 . 1 1 72 72 LYS HE2 H 1 2.999 0.040 . 2 . . . A 377 LYS HE2 . 19362 2 856 . 1 1 72 72 LYS HE3 H 1 2.999 0.040 . 2 . . . A 377 LYS HE3 . 19362 2 857 . 1 1 72 72 LYS C C 13 178.212 0.400 . 1 . . . A 377 LYS C . 19362 2 858 . 1 1 72 72 LYS CA C 13 58.491 0.400 . 1 . . . A 377 LYS CA . 19362 2 859 . 1 1 72 72 LYS CB C 13 32.731 0.400 . 1 . . . A 377 LYS CB . 19362 2 860 . 1 1 72 72 LYS CG C 13 24.885 0.400 . 1 . . . A 377 LYS CG . 19362 2 861 . 1 1 72 72 LYS CD C 13 29.036 0.400 . 1 . . . A 377 LYS CD . 19362 2 862 . 1 1 72 72 LYS CE C 13 41.814 0.400 . 1 . . . A 377 LYS CE . 19362 2 863 . 1 1 72 72 LYS N N 15 119.235 0.400 . 1 . . . A 377 LYS N . 19362 2 864 . 1 1 73 73 GLU H H 1 8.447 0.040 . 1 . . . A 378 GLU H . 19362 2 865 . 1 1 73 73 GLU HA H 1 4.177 0.040 . 1 . . . A 378 GLU HA . 19362 2 866 . 1 1 73 73 GLU HB2 H 1 2.168 0.040 . 2 . . . A 378 GLU HB2 . 19362 2 867 . 1 1 73 73 GLU HB3 H 1 2.168 0.040 . 2 . . . A 378 GLU HB3 . 19362 2 868 . 1 1 73 73 GLU HG2 H 1 2.432 0.040 . 2 . . . A 378 GLU HG2 . 19362 2 869 . 1 1 73 73 GLU HG3 H 1 2.33 0.040 . 2 . . . A 378 GLU HG3 . 19362 2 870 . 1 1 73 73 GLU C C 13 178.578 0.400 . 1 . . . A 378 GLU C . 19362 2 871 . 1 1 73 73 GLU CA C 13 58.423 0.400 . 1 . . . A 378 GLU CA . 19362 2 872 . 1 1 73 73 GLU CB C 13 29.513 0.400 . 1 . . . A 378 GLU CB . 19362 2 873 . 1 1 73 73 GLU CG C 13 36.277 0.400 . 1 . . . A 378 GLU CG . 19362 2 874 . 1 1 73 73 GLU N N 15 119.513 0.400 . 1 . . . A 378 GLU N . 19362 2 875 . 1 1 74 74 GLY H H 1 8.415 0.040 . 1 . . . A 379 GLY H . 19362 2 876 . 1 1 74 74 GLY HA2 H 1 3.974 0.040 . 2 . . . A 379 GLY HA2 . 19362 2 877 . 1 1 74 74 GLY HA3 H 1 3.974 0.040 . 2 . . . A 379 GLY HA3 . 19362 2 878 . 1 1 74 74 GLY C C 13 175.176 0.400 . 1 . . . A 379 GLY C . 19362 2 879 . 1 1 74 74 GLY CA C 13 46.242 0.400 . 1 . . . A 379 GLY CA . 19362 2 880 . 1 1 74 74 GLY N N 15 107.427 0.400 . 1 . . . A 379 GLY N . 19362 2 881 . 1 1 75 75 ALA H H 1 8.147 0.040 . 1 . . . A 380 ALA H . 19362 2 882 . 1 1 75 75 ALA HA H 1 4.257 0.040 . 1 . . . A 380 ALA HA . 19362 2 883 . 1 1 75 75 ALA HB1 H 1 1.535 0.040 . 1 . . . A 380 ALA HB1 . 19362 2 884 . 1 1 75 75 ALA HB2 H 1 1.535 0.040 . 1 . . . A 380 ALA HB2 . 19362 2 885 . 1 1 75 75 ALA HB3 H 1 1.535 0.040 . 1 . . . A 380 ALA HB3 . 19362 2 886 . 1 1 75 75 ALA C C 13 179.154 0.400 . 1 . . . A 380 ALA C . 19362 2 887 . 1 1 75 75 ALA CA C 13 53.952 0.400 . 1 . . . A 380 ALA CA . 19362 2 888 . 1 1 75 75 ALA CB C 13 18.602 0.400 . 1 . . . A 380 ALA CB . 19362 2 889 . 1 1 75 75 ALA N N 15 123.205 0.400 . 1 . . . A 380 ALA N . 19362 2 890 . 1 1 76 76 GLU H H 1 8.309 0.040 . 1 . . . A 381 GLU H . 19362 2 891 . 1 1 76 76 GLU HA H 1 4.196 0.040 . 1 . . . A 381 GLU HA . 19362 2 892 . 1 1 76 76 GLU HB2 H 1 2.144 0.040 . 2 . . . A 381 GLU HB2 . 19362 2 893 . 1 1 76 76 GLU HB3 H 1 2.144 0.040 . 2 . . . A 381 GLU HB3 . 19362 2 894 . 1 1 76 76 GLU HG2 H 1 2.42 0.040 . 2 . . . A 381 GLU HG2 . 19362 2 895 . 1 1 76 76 GLU HG3 H 1 2.357 0.040 . 2 . . . A 381 GLU HG3 . 19362 2 896 . 1 1 76 76 GLU C C 13 177.811 0.400 . 1 . . . A 381 GLU C . 19362 2 897 . 1 1 76 76 GLU CA C 13 57.877 0.400 . 1 . . . A 381 GLU CA . 19362 2 898 . 1 1 76 76 GLU CB C 13 29.685 0.400 . 1 . . . A 381 GLU CB . 19362 2 899 . 1 1 76 76 GLU CG C 13 36.32 0.400 . 1 . . . A 381 GLU CG . 19362 2 900 . 1 1 76 76 GLU N N 15 117.36 0.400 . 1 . . . A 381 GLU N . 19362 2 901 . 1 1 77 77 LYS H H 1 8.064 0.040 . 1 . . . A 382 LYS H . 19362 2 902 . 1 1 77 77 LYS HA H 1 4.21 0.040 . 1 . . . A 382 LYS HA . 19362 2 903 . 1 1 77 77 LYS HB2 H 1 1.953 0.040 . 2 . . . A 382 LYS HB2 . 19362 2 904 . 1 1 77 77 LYS HB3 H 1 1.953 0.040 . 2 . . . A 382 LYS HB3 . 19362 2 905 . 1 1 77 77 LYS HG2 H 1 1.616 0.040 . 2 . . . A 382 LYS HG2 . 19362 2 906 . 1 1 77 77 LYS HG3 H 1 1.515 0.040 . 2 . . . A 382 LYS HG3 . 19362 2 907 . 1 1 77 77 LYS HD2 H 1 1.749 0.040 . 2 . . . A 382 LYS HD2 . 19362 2 908 . 1 1 77 77 LYS HD3 H 1 1.749 0.040 . 2 . . . A 382 LYS HD3 . 19362 2 909 . 1 1 77 77 LYS HE2 H 1 2.959 0.040 . 2 . . . A 382 LYS HE2 . 19362 2 910 . 1 1 77 77 LYS HE3 H 1 2.959 0.040 . 2 . . . A 382 LYS HE3 . 19362 2 911 . 1 1 77 77 LYS C C 13 177.619 0.400 . 1 . . . A 382 LYS C . 19362 2 912 . 1 1 77 77 LYS CA C 13 57.899 0.400 . 1 . . . A 382 LYS CA . 19362 2 913 . 1 1 77 77 LYS CB C 13 32.647 0.400 . 1 . . . A 382 LYS CB . 19362 2 914 . 1 1 77 77 LYS CG C 13 25.224 0.002 . 1 . . . A 382 LYS CG . 19362 2 915 . 1 1 77 77 LYS CD C 13 28.96 0.400 . 1 . . . A 382 LYS CD . 19362 2 916 . 1 1 77 77 LYS CE C 13 41.847 0.400 . 1 . . . A 382 LYS CE . 19362 2 917 . 1 1 77 77 LYS N N 15 118.942 0.400 . 1 . . . A 382 LYS N . 19362 2 918 . 1 1 78 78 ILE H H 1 7.754 0.040 . 1 . . . A 383 ILE H . 19362 2 919 . 1 1 78 78 ILE HA H 1 4.127 0.040 . 1 . . . A 383 ILE HA . 19362 2 920 . 1 1 78 78 ILE HB H 1 1.996 0.040 . 1 . . . A 383 ILE HB . 19362 2 921 . 1 1 78 78 ILE HG12 H 1 1.571 0.040 . 2 . . . A 383 ILE HG12 . 19362 2 922 . 1 1 78 78 ILE HG13 H 1 1.3 0.040 . 2 . . . A 383 ILE HG13 . 19362 2 923 . 1 1 78 78 ILE HG21 H 1 0.97 0.040 . 1 . . . A 383 ILE HG21 . 19362 2 924 . 1 1 78 78 ILE HG22 H 1 0.97 0.040 . 1 . . . A 383 ILE HG22 . 19362 2 925 . 1 1 78 78 ILE HG23 H 1 0.97 0.040 . 1 . . . A 383 ILE HG23 . 19362 2 926 . 1 1 78 78 ILE HD11 H 1 0.915 0.040 . 1 . . . A 383 ILE HD11 . 19362 2 927 . 1 1 78 78 ILE HD12 H 1 0.915 0.040 . 1 . . . A 383 ILE HD12 . 19362 2 928 . 1 1 78 78 ILE HD13 H 1 0.915 0.040 . 1 . . . A 383 ILE HD13 . 19362 2 929 . 1 1 78 78 ILE C C 13 176.554 0.400 . 1 . . . A 383 ILE C . 19362 2 930 . 1 1 78 78 ILE CA C 13 61.95 0.400 . 1 . . . A 383 ILE CA . 19362 2 931 . 1 1 78 78 ILE CB C 13 38.376 0.400 . 1 . . . A 383 ILE CB . 19362 2 932 . 1 1 78 78 ILE CG1 C 13 27.709 0.003 . 1 . . . A 383 ILE CG1 . 19362 2 933 . 1 1 78 78 ILE CG2 C 13 17.386 0.400 . 1 . . . A 383 ILE CG2 . 19362 2 934 . 1 1 78 78 ILE CD1 C 13 12.786 0.400 . 1 . . . A 383 ILE CD1 . 19362 2 935 . 1 1 78 78 ILE N N 15 117.682 0.400 . 1 . . . A 383 ILE N . 19362 2 936 . 1 1 79 79 LYS H H 1 8.018 0.040 . 1 . . . A 384 LYS H . 19362 2 937 . 1 1 79 79 LYS HA H 1 4.288 0.040 . 1 . . . A 384 LYS HA . 19362 2 938 . 1 1 79 79 LYS HB2 H 1 1.911 0.040 . 2 . . . A 384 LYS HB2 . 19362 2 939 . 1 1 79 79 LYS HB3 H 1 1.869 0.040 . 2 . . . A 384 LYS HB3 . 19362 2 940 . 1 1 79 79 LYS HG2 H 1 1.577 0.040 . 2 . . . A 384 LYS HG2 . 19362 2 941 . 1 1 79 79 LYS HG3 H 1 1.489 0.040 . 2 . . . A 384 LYS HG3 . 19362 2 942 . 1 1 79 79 LYS HD2 H 1 1.729 0.040 . 2 . . . A 384 LYS HD2 . 19362 2 943 . 1 1 79 79 LYS HD3 H 1 1.729 0.040 . 2 . . . A 384 LYS HD3 . 19362 2 944 . 1 1 79 79 LYS HE2 H 1 2.954 0.040 . 2 . . . A 384 LYS HE2 . 19362 2 945 . 1 1 79 79 LYS HE3 H 1 2.954 0.040 . 2 . . . A 384 LYS HE3 . 19362 2 946 . 1 1 79 79 LYS C C 13 176.52 0.400 . 1 . . . A 384 LYS C . 19362 2 947 . 1 1 79 79 LYS CA C 13 56.798 0.400 . 1 . . . A 384 LYS CA . 19362 2 948 . 1 1 79 79 LYS CB C 13 32.832 0.400 . 1 . . . A 384 LYS CB . 19362 2 949 . 1 1 79 79 LYS CG C 13 24.869 0.002 . 1 . . . A 384 LYS CG . 19362 2 950 . 1 1 79 79 LYS CD C 13 28.877 0.400 . 1 . . . A 384 LYS CD . 19362 2 951 . 1 1 79 79 LYS CE C 13 41.847 0.400 . 1 . . . A 384 LYS CE . 19362 2 952 . 1 1 79 79 LYS N N 15 122.252 0.400 . 1 . . . A 384 LYS N . 19362 2 953 . 1 1 80 80 LYS H H 1 8.068 0.040 . 1 . . . A 385 LYS H . 19362 2 954 . 1 1 80 80 LYS HA H 1 4.351 0.040 . 1 . . . A 385 LYS HA . 19362 2 955 . 1 1 80 80 LYS HB2 H 1 1.927 0.040 . 2 . . . A 385 LYS HB2 . 19362 2 956 . 1 1 80 80 LYS HB3 H 1 1.832 0.040 . 2 . . . A 385 LYS HB3 . 19362 2 957 . 1 1 80 80 LYS HG2 H 1 1.511 0.040 . 2 . . . A 385 LYS HG2 . 19362 2 958 . 1 1 80 80 LYS HG3 H 1 1.511 0.040 . 2 . . . A 385 LYS HG3 . 19362 2 959 . 1 1 80 80 LYS HD2 H 1 1.734 0.040 . 2 . . . A 385 LYS HD2 . 19362 2 960 . 1 1 80 80 LYS HD3 H 1 1.734 0.040 . 2 . . . A 385 LYS HD3 . 19362 2 961 . 1 1 80 80 LYS HE2 H 1 2.966 0.040 . 2 . . . A 385 LYS HE2 . 19362 2 962 . 1 1 80 80 LYS HE3 H 1 2.966 0.040 . 2 . . . A 385 LYS HE3 . 19362 2 963 . 1 1 80 80 LYS C C 13 176.066 0.400 . 1 . . . A 385 LYS C . 19362 2 964 . 1 1 80 80 LYS CA C 13 56.266 0.400 . 1 . . . A 385 LYS CA . 19362 2 965 . 1 1 80 80 LYS CB C 13 33.078 0.002 . 1 . . . A 385 LYS CB . 19362 2 966 . 1 1 80 80 LYS CG C 13 24.673 0.400 . 1 . . . A 385 LYS CG . 19362 2 967 . 1 1 80 80 LYS CD C 13 28.783 0.400 . 1 . . . A 385 LYS CD . 19362 2 968 . 1 1 80 80 LYS CE C 13 41.847 0.400 . 1 . . . A 385 LYS CE . 19362 2 969 . 1 1 80 80 LYS N N 15 120.582 0.400 . 1 . . . A 385 LYS N . 19362 2 970 . 1 1 81 81 LYS H H 1 8.222 0.040 . 1 . . . A 386 LYS H . 19362 2 971 . 1 1 81 81 LYS HA H 1 4.342 0.040 . 1 . . . A 386 LYS HA . 19362 2 972 . 1 1 81 81 LYS HB2 H 1 1.932 0.040 . 2 . . . A 386 LYS HB2 . 19362 2 973 . 1 1 81 81 LYS HB3 H 1 1.84 0.040 . 2 . . . A 386 LYS HB3 . 19362 2 974 . 1 1 81 81 LYS HG2 H 1 1.511 0.040 . 2 . . . A 386 LYS HG2 . 19362 2 975 . 1 1 81 81 LYS HG3 H 1 1.511 0.040 . 2 . . . A 386 LYS HG3 . 19362 2 976 . 1 1 81 81 LYS HD2 H 1 1.736 0.040 . 2 . . . A 386 LYS HD2 . 19362 2 977 . 1 1 81 81 LYS HD3 H 1 1.736 0.040 . 2 . . . A 386 LYS HD3 . 19362 2 978 . 1 1 81 81 LYS HE2 H 1 2.966 0.040 . 2 . . . A 386 LYS HE2 . 19362 2 979 . 1 1 81 81 LYS HE3 H 1 2.966 0.040 . 2 . . . A 386 LYS HE3 . 19362 2 980 . 1 1 81 81 LYS C C 13 175.298 0.400 . 1 . . . A 386 LYS C . 19362 2 981 . 1 1 81 81 LYS CA C 13 56.46 0.400 . 1 . . . A 386 LYS CA . 19362 2 982 . 1 1 81 81 LYS CB C 13 33.034 0.400 . 1 . . . A 386 LYS CB . 19362 2 983 . 1 1 81 81 LYS CG C 13 24.631 0.400 . 1 . . . A 386 LYS CG . 19362 2 984 . 1 1 81 81 LYS CD C 13 28.82 0.400 . 1 . . . A 386 LYS CD . 19362 2 985 . 1 1 81 81 LYS CE C 13 41.847 0.400 . 1 . . . A 386 LYS CE . 19362 2 986 . 1 1 81 81 LYS N N 15 122.326 0.400 . 1 . . . A 386 LYS N . 19362 2 987 . 1 1 82 82 ARG H H 1 7.967 0.040 . 1 . . . A 387 ARG H . 19362 2 988 . 1 1 82 82 ARG HA H 1 4.226 0.040 . 1 . . . A 387 ARG HA . 19362 2 989 . 1 1 82 82 ARG HB2 H 1 1.897 0.040 . 2 . . . A 387 ARG HB2 . 19362 2 990 . 1 1 82 82 ARG HB3 H 1 1.771 0.040 . 2 . . . A 387 ARG HB3 . 19362 2 991 . 1 1 82 82 ARG HD2 H 1 3.038 0.040 . 2 . . . A 387 ARG HD2 . 19362 2 992 . 1 1 82 82 ARG HD3 H 1 3.038 0.040 . 2 . . . A 387 ARG HD3 . 19362 2 993 . 1 1 82 82 ARG CA C 13 57.374 0.400 . 1 . . . A 387 ARG CA . 19362 2 994 . 1 1 82 82 ARG CB C 13 31.631 0.004 . 1 . . . A 387 ARG CB . 19362 2 995 . 1 1 82 82 ARG CD C 13 41.894 0.400 . 1 . . . A 387 ARG CD . 19362 2 996 . 1 1 82 82 ARG N N 15 126.984 0.400 . 1 . . . A 387 ARG N . 19362 2 stop_ save_