data_36162 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 36162 _Entry.Title ; Solution structure of the SBDalpha domain of yeast Ssa1 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-02-01 _Entry.Accession_date 2018-09-26 _Entry.Last_release_date 2018-09-26 _Entry.Original_release_date 2018-09-26 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.2.0.16 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_experimental_methods.ID _Entry_experimental_methods.Method _Entry_experimental_methods.Subtype _Entry_experimental_methods.Entry_ID 1 'SOLUTION NMR' 'SOLUTION NMR' 36162 stop_ loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 W. Gong W. . . . 36162 2 W. Hu W. . . . 36162 3 S. Perrett S. . . . 36162 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID CHAPERONE . 36162 'SBDalpha domain' . 36162 'yeast Ssa1' . 36162 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 36162 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 405 36162 '15N chemical shifts' 107 36162 '1H chemical shifts' 616 36162 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2019-03-06 2018-02-01 update BMRB 'update entry citation' 36162 1 . . 2018-10-12 2018-02-01 original author 'original release' 36162 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 5Z8Q . 36162 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 36162 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1074/jbc.RA118.002691 _Citation.PubMed_ID 30228181 _Citation.Full_citation . _Citation.Title ; The C-terminal GGAP motif of Hsp70 mediates substrate recognition and stress response in yeast ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full 'The journal of biological chemistry' _Citation.Journal_volume 293 _Citation.Journal_issue 46 _Citation.Journal_ASTM JBCHA3 _Citation.Journal_ISSN 1083-351X _Citation.Journal_CSD 0071 _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 17663 _Citation.Page_last 17675 _Citation.Year 2018 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 W. Gong W. . . . 36162 1 2 W. Hu W. . . . 36162 1 3 L. Xu L. . . . 36162 1 4 H. Wu H. . . . 36162 1 5 S. Wu S. . . . 36162 1 6 H. Zhang H. . . . 36162 1 7 J. Wang J. . . . 36162 1 8 G. Jones G. W. . . 36162 1 9 S. Perrett S. . . . 36162 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 36162 _Assembly.ID 1 _Assembly.Name 'Heat shock protein SSA1' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity_1 1 $entity_1 A A yes . . . . . . 36162 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 36162 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; SKEEDEKESQRIASKNQLES IAYSLKNTISEAGDKLEQAD KDTVTKKAEETISWLDSNTT ASKEEFDDKLKELQDIANPI MSKLYQAGGAPGGAAGGAPG G ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 101 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 10788.742 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Heat shock protein YG100' na 36162 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 1 SER . 36162 1 2 2 LYS . 36162 1 3 3 GLU . 36162 1 4 4 GLU . 36162 1 5 5 ASP . 36162 1 6 6 GLU . 36162 1 7 7 LYS . 36162 1 8 8 GLU . 36162 1 9 9 SER . 36162 1 10 10 GLN . 36162 1 11 11 ARG . 36162 1 12 12 ILE . 36162 1 13 13 ALA . 36162 1 14 14 SER . 36162 1 15 15 LYS . 36162 1 16 16 ASN . 36162 1 17 17 GLN . 36162 1 18 18 LEU . 36162 1 19 19 GLU . 36162 1 20 20 SER . 36162 1 21 21 ILE . 36162 1 22 22 ALA . 36162 1 23 23 TYR . 36162 1 24 24 SER . 36162 1 25 25 LEU . 36162 1 26 26 LYS . 36162 1 27 27 ASN . 36162 1 28 28 THR . 36162 1 29 29 ILE . 36162 1 30 30 SER . 36162 1 31 31 GLU . 36162 1 32 32 ALA . 36162 1 33 33 GLY . 36162 1 34 34 ASP . 36162 1 35 35 LYS . 36162 1 36 36 LEU . 36162 1 37 37 GLU . 36162 1 38 38 GLN . 36162 1 39 39 ALA . 36162 1 40 40 ASP . 36162 1 41 41 LYS . 36162 1 42 42 ASP . 36162 1 43 43 THR . 36162 1 44 44 VAL . 36162 1 45 45 THR . 36162 1 46 46 LYS . 36162 1 47 47 LYS . 36162 1 48 48 ALA . 36162 1 49 49 GLU . 36162 1 50 50 GLU . 36162 1 51 51 THR . 36162 1 52 52 ILE . 36162 1 53 53 SER . 36162 1 54 54 TRP . 36162 1 55 55 LEU . 36162 1 56 56 ASP . 36162 1 57 57 SER . 36162 1 58 58 ASN . 36162 1 59 59 THR . 36162 1 60 60 THR . 36162 1 61 61 ALA . 36162 1 62 62 SER . 36162 1 63 63 LYS . 36162 1 64 64 GLU . 36162 1 65 65 GLU . 36162 1 66 66 PHE . 36162 1 67 67 ASP . 36162 1 68 68 ASP . 36162 1 69 69 LYS . 36162 1 70 70 LEU . 36162 1 71 71 LYS . 36162 1 72 72 GLU . 36162 1 73 73 LEU . 36162 1 74 74 GLN . 36162 1 75 75 ASP . 36162 1 76 76 ILE . 36162 1 77 77 ALA . 36162 1 78 78 ASN . 36162 1 79 79 PRO . 36162 1 80 80 ILE . 36162 1 81 81 MET . 36162 1 82 82 SER . 36162 1 83 83 LYS . 36162 1 84 84 LEU . 36162 1 85 85 TYR . 36162 1 86 86 GLN . 36162 1 87 87 ALA . 36162 1 88 88 GLY . 36162 1 89 89 GLY . 36162 1 90 90 ALA . 36162 1 91 91 PRO . 36162 1 92 92 GLY . 36162 1 93 93 GLY . 36162 1 94 94 ALA . 36162 1 95 95 ALA . 36162 1 96 96 GLY . 36162 1 97 97 GLY . 36162 1 98 98 ALA . 36162 1 99 99 PRO . 36162 1 100 100 GLY . 36162 1 101 101 GLY . 36162 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 . SER 1 1 36162 1 . LYS 2 2 36162 1 . GLU 3 3 36162 1 . GLU 4 4 36162 1 . ASP 5 5 36162 1 . GLU 6 6 36162 1 . LYS 7 7 36162 1 . GLU 8 8 36162 1 . SER 9 9 36162 1 . GLN 10 10 36162 1 . ARG 11 11 36162 1 . ILE 12 12 36162 1 . ALA 13 13 36162 1 . SER 14 14 36162 1 . LYS 15 15 36162 1 . ASN 16 16 36162 1 . GLN 17 17 36162 1 . LEU 18 18 36162 1 . GLU 19 19 36162 1 . SER 20 20 36162 1 . ILE 21 21 36162 1 . ALA 22 22 36162 1 . TYR 23 23 36162 1 . SER 24 24 36162 1 . LEU 25 25 36162 1 . LYS 26 26 36162 1 . ASN 27 27 36162 1 . THR 28 28 36162 1 . ILE 29 29 36162 1 . SER 30 30 36162 1 . GLU 31 31 36162 1 . ALA 32 32 36162 1 . GLY 33 33 36162 1 . ASP 34 34 36162 1 . LYS 35 35 36162 1 . LEU 36 36 36162 1 . GLU 37 37 36162 1 . GLN 38 38 36162 1 . ALA 39 39 36162 1 . ASP 40 40 36162 1 . LYS 41 41 36162 1 . ASP 42 42 36162 1 . THR 43 43 36162 1 . VAL 44 44 36162 1 . THR 45 45 36162 1 . LYS 46 46 36162 1 . LYS 47 47 36162 1 . ALA 48 48 36162 1 . GLU 49 49 36162 1 . GLU 50 50 36162 1 . THR 51 51 36162 1 . ILE 52 52 36162 1 . SER 53 53 36162 1 . TRP 54 54 36162 1 . LEU 55 55 36162 1 . ASP 56 56 36162 1 . SER 57 57 36162 1 . ASN 58 58 36162 1 . THR 59 59 36162 1 . THR 60 60 36162 1 . ALA 61 61 36162 1 . SER 62 62 36162 1 . LYS 63 63 36162 1 . GLU 64 64 36162 1 . GLU 65 65 36162 1 . PHE 66 66 36162 1 . ASP 67 67 36162 1 . ASP 68 68 36162 1 . LYS 69 69 36162 1 . LEU 70 70 36162 1 . LYS 71 71 36162 1 . GLU 72 72 36162 1 . LEU 73 73 36162 1 . GLN 74 74 36162 1 . ASP 75 75 36162 1 . ILE 76 76 36162 1 . ALA 77 77 36162 1 . ASN 78 78 36162 1 . PRO 79 79 36162 1 . ILE 80 80 36162 1 . MET 81 81 36162 1 . SER 82 82 36162 1 . LYS 83 83 36162 1 . LEU 84 84 36162 1 . TYR 85 85 36162 1 . GLN 86 86 36162 1 . ALA 87 87 36162 1 . GLY 88 88 36162 1 . GLY 89 89 36162 1 . ALA 90 90 36162 1 . PRO 91 91 36162 1 . GLY 92 92 36162 1 . GLY 93 93 36162 1 . ALA 94 94 36162 1 . ALA 95 95 36162 1 . GLY 96 96 36162 1 . GLY 97 97 36162 1 . ALA 98 98 36162 1 . PRO 99 99 36162 1 . GLY 100 100 36162 1 . GLY 101 101 36162 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 36162 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 559292 organism . 'Saccharomyces cerevisiae (strain ATCC 204508 / S288c)' "Baker's yeast" . . Eukaryota Fungi Saccharomyces 'Saccharomyces cerevisiae' 'ATCC 204508 / S288c' . . . . . . . . . . 'SSA1, YAL005C' . 36162 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 36162 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . . . . . 36162 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 36162 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '1.0 mM [U-13C; U-15N] Ssa1 SBDalpha, 90% H2O/10% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Ssa1 SBDalpha' '[U-13C; U-15N]' 1 $assembly 1 $entity_1 . protein 1.0 . . mM . . . . 36162 1 2 H2O 'natural abundance' . . . . . solvent 90 . . % . . . . 36162 1 3 D2O '[U-99% 2H]' . . . . . solvent 10 . . % . . . . 36162 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 36162 _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' 90 . mM 36162 1 pH 6.5 . pH 36162 1 pressure 1 . atm 36162 1 temperature 298 . K 36162 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 36162 _Software.ID 1 _Software.Type . _Software.Name CNS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 36162 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 36162 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 36162 _Software.ID 2 _Software.Type . _Software.Name CYANA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 36162 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure calculation' 36162 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 36162 _Software.ID 3 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 36162 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 36162 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 36162 _Software.ID 4 _Software.Type . _Software.Name NMRView _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 36162 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 36162 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 36162 _NMR_spectrometer.ID 1 _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 36162 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker Avance . 600 . . . 36162 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 36162 _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 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36162 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36162 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36162 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36162 1 5 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36162 1 6 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36162 1 7 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36162 1 8 '3D CCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36162 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36162 1 10 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36162 1 11 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36162 1 12 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36162 1 13 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36162 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 36162 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0 external indirect 0.101329118 . . . . . 36162 1 H 1 DSS 'methyl protons' . . . . ppm 0 external direct 1 . . . . . 36162 1 N 15 DSS 'methyl protons' . . . . ppm 0 external indirect 0.251449530 . . . . . 36162 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 36162 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' 1 $sample_1 isotropic 36162 1 2 '2D 1H-13C HSQC' 1 $sample_1 isotropic 36162 1 3 '2D 1H-13C HSQC aromatic' 1 $sample_1 isotropic 36162 1 4 '3D HNCACB' 1 $sample_1 isotropic 36162 1 5 '3D CBCA(CO)NH' 1 $sample_1 isotropic 36162 1 6 '3D 1H-13C NOESY' 1 $sample_1 isotropic 36162 1 7 '3D 1H-15N NOESY' 1 $sample_1 isotropic 36162 1 8 '3D CCH-TOCSY' 1 $sample_1 isotropic 36162 1 9 '3D HCCH-TOCSY' 1 $sample_1 isotropic 36162 1 10 '3D HBHA(CO)NH' 1 $sample_1 isotropic 36162 1 11 '3D C(CO)NH' 1 $sample_1 isotropic 36162 1 12 '3D HN(CA)CO' 1 $sample_1 isotropic 36162 1 13 '3D HNCO' 1 $sample_1 isotropic 36162 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.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 SER HA H 1 4.2700 . . 1 . . . . A 1 SER HA . 36162 1 2 . 1 1 1 1 SER HB2 H 1 4.0900 . . 2 . . . . A 1 SER HB2 . 36162 1 3 . 1 1 1 1 SER HB3 H 1 4.2700 . . 2 . . . . A 1 SER HB3 . 36162 1 4 . 1 1 1 1 SER CA C 13 56.8800 . . 1 . . . . A 1 SER CA . 36162 1 5 . 1 1 1 1 SER CB C 13 63.7970 . . 1 . . . . A 1 SER CB . 36162 1 6 . 1 1 2 2 LYS HA H 1 4.2670 . . 1 . . . . A 2 LYS HA . 36162 1 7 . 1 1 2 2 LYS HB2 H 1 1.8960 . . 2 . . . . A 2 LYS HB2 . 36162 1 8 . 1 1 2 2 LYS HG2 H 1 1.4950 . . 2 . . . . A 2 LYS HG2 . 36162 1 9 . 1 1 2 2 LYS HG3 H 1 1.4360 . . 2 . . . . A 2 LYS HG3 . 36162 1 10 . 1 1 2 2 LYS HD2 H 1 1.7370 . . 2 . . . . A 2 LYS HD2 . 36162 1 11 . 1 1 2 2 LYS HE2 H 1 3.0260 . . 2 . . . . A 2 LYS HE2 . 36162 1 12 . 1 1 2 2 LYS C C 13 177.8520 . . 1 . . . . A 2 LYS C . 36162 1 13 . 1 1 2 2 LYS CA C 13 58.7910 . . 1 . . . . A 2 LYS CA . 36162 1 14 . 1 1 2 2 LYS CB C 13 32.4390 . . 1 . . . . A 2 LYS CB . 36162 1 15 . 1 1 2 2 LYS CG C 13 24.7100 . . 1 . . . . A 2 LYS CG . 36162 1 16 . 1 1 2 2 LYS CD C 13 29.2620 . . 1 . . . . A 2 LYS CD . 36162 1 17 . 1 1 2 2 LYS CE C 13 42.2320 . . 1 . . . . A 2 LYS CE . 36162 1 18 . 1 1 3 3 GLU H H 1 8.9400 . . 1 . . . . A 3 GLU H . 36162 1 19 . 1 1 3 3 GLU HA H 1 4.1620 . . 1 . . . . A 3 GLU HA . 36162 1 20 . 1 1 3 3 GLU HB2 H 1 1.9980 . . 2 . . . . A 3 GLU HB2 . 36162 1 21 . 1 1 3 3 GLU HB3 H 1 2.0970 . . 2 . . . . A 3 GLU HB3 . 36162 1 22 . 1 1 3 3 GLU HG2 H 1 2.3050 . . 2 . . . . A 3 GLU HG2 . 36162 1 23 . 1 1 3 3 GLU HG3 H 1 2.4140 . . 2 . . . . A 3 GLU HG3 . 36162 1 24 . 1 1 3 3 GLU C C 13 179.1030 . . 1 . . . . A 3 GLU C . 36162 1 25 . 1 1 3 3 GLU CA C 13 59.5740 . . 1 . . . . A 3 GLU CA . 36162 1 26 . 1 1 3 3 GLU CB C 13 29.1740 . . 1 . . . . A 3 GLU CB . 36162 1 27 . 1 1 3 3 GLU CG C 13 36.5130 . . 1 . . . . A 3 GLU CG . 36162 1 28 . 1 1 3 3 GLU N N 15 120.2480 . . 1 . . . . A 3 GLU N . 36162 1 29 . 1 1 4 4 GLU H H 1 7.9630 . . 1 . . . . A 4 GLU H . 36162 1 30 . 1 1 4 4 GLU HA H 1 4.1290 . . 1 . . . . A 4 GLU HA . 36162 1 31 . 1 1 4 4 GLU HB2 H 1 2.1260 . . 2 . . . . A 4 GLU HB2 . 36162 1 32 . 1 1 4 4 GLU HG2 H 1 2.3450 . . 2 . . . . A 4 GLU HG2 . 36162 1 33 . 1 1 4 4 GLU HG3 H 1 2.3160 . . 2 . . . . A 4 GLU HG3 . 36162 1 34 . 1 1 4 4 GLU C C 13 178.8110 . . 1 . . . . A 4 GLU C . 36162 1 35 . 1 1 4 4 GLU CA C 13 58.7230 . . 1 . . . . A 4 GLU CA . 36162 1 36 . 1 1 4 4 GLU CB C 13 29.5880 . . 1 . . . . A 4 GLU CB . 36162 1 37 . 1 1 4 4 GLU CG C 13 36.7880 . . 1 . . . . A 4 GLU CG . 36162 1 38 . 1 1 4 4 GLU N N 15 120.4330 . . 1 . . . . A 4 GLU N . 36162 1 39 . 1 1 5 5 ASP H H 1 8.2330 . . 1 . . . . A 5 ASP H . 36162 1 40 . 1 1 5 5 ASP HA H 1 4.5200 . . 1 . . . . A 5 ASP HA . 36162 1 41 . 1 1 5 5 ASP HB2 H 1 2.8650 . . 2 . . . . A 5 ASP HB2 . 36162 1 42 . 1 1 5 5 ASP HB3 H 1 2.7990 . . 2 . . . . A 5 ASP HB3 . 36162 1 43 . 1 1 5 5 ASP C C 13 178.7110 . . 1 . . . . A 5 ASP C . 36162 1 44 . 1 1 5 5 ASP CA C 13 56.7070 . . 1 . . . . A 5 ASP CA . 36162 1 45 . 1 1 5 5 ASP CB C 13 40.2400 . . 1 . . . . A 5 ASP CB . 36162 1 46 . 1 1 5 5 ASP N N 15 122.2970 . . 1 . . . . A 5 ASP N . 36162 1 47 . 1 1 6 6 GLU H H 1 8.4760 . . 1 . . . . A 6 GLU H . 36162 1 48 . 1 1 6 6 GLU HA H 1 4.1580 . . 1 . . . . A 6 GLU HA . 36162 1 49 . 1 1 6 6 GLU HB2 H 1 2.0720 . . 2 . . . . A 6 GLU HB2 . 36162 1 50 . 1 1 6 6 GLU HB3 H 1 1.9910 . . 2 . . . . A 6 GLU HB3 . 36162 1 51 . 1 1 6 6 GLU HG2 H 1 2.4100 . . 2 . . . . A 6 GLU HG2 . 36162 1 52 . 1 1 6 6 GLU HG3 H 1 2.3170 . . 2 . . . . A 6 GLU HG3 . 36162 1 53 . 1 1 6 6 GLU C C 13 178.5920 . . 1 . . . . A 6 GLU C . 36162 1 54 . 1 1 6 6 GLU CA C 13 59.2000 . . 1 . . . . A 6 GLU CA . 36162 1 55 . 1 1 6 6 GLU CB C 13 29.4400 . . 1 . . . . A 6 GLU CB . 36162 1 56 . 1 1 6 6 GLU CG C 13 36.8680 . . 1 . . . . A 6 GLU CG . 36162 1 57 . 1 1 6 6 GLU N N 15 122.5970 . . 1 . . . . A 6 GLU N . 36162 1 58 . 1 1 7 7 LYS H H 1 7.9720 . . 1 . . . . A 7 LYS H . 36162 1 59 . 1 1 7 7 LYS HA H 1 4.1060 . . 1 . . . . A 7 LYS HA . 36162 1 60 . 1 1 7 7 LYS HB2 H 1 2.0300 . . 2 . . . . A 7 LYS HB2 . 36162 1 61 . 1 1 7 7 LYS HG2 H 1 1.5600 . . 2 . . . . A 7 LYS HG2 . 36162 1 62 . 1 1 7 7 LYS HG3 H 1 1.6800 . . 2 . . . . A 7 LYS HG3 . 36162 1 63 . 1 1 7 7 LYS HD2 H 1 1.7480 . . 2 . . . . A 7 LYS HD2 . 36162 1 64 . 1 1 7 7 LYS HE2 H 1 3.0450 . . 2 . . . . A 7 LYS HE2 . 36162 1 65 . 1 1 7 7 LYS C C 13 179.8850 . . 1 . . . . A 7 LYS C . 36162 1 66 . 1 1 7 7 LYS CA C 13 59.6810 . . 1 . . . . A 7 LYS CA . 36162 1 67 . 1 1 7 7 LYS CB C 13 32.3340 . . 1 . . . . A 7 LYS CB . 36162 1 68 . 1 1 7 7 LYS CG C 13 25.3760 . . 1 . . . . A 7 LYS CG . 36162 1 69 . 1 1 7 7 LYS CD C 13 29.6850 . . 1 . . . . A 7 LYS CD . 36162 1 70 . 1 1 7 7 LYS CE C 13 42.2150 . . 1 . . . . A 7 LYS CE . 36162 1 71 . 1 1 7 7 LYS N N 15 120.2800 . . 1 . . . . A 7 LYS N . 36162 1 72 . 1 1 8 8 GLU H H 1 8.1700 . . 1 . . . . A 8 GLU H . 36162 1 73 . 1 1 8 8 GLU HA H 1 4.7810 . . 1 . . . . A 8 GLU HA . 36162 1 74 . 1 1 8 8 GLU HB2 H 1 2.1700 . . 2 . . . . A 8 GLU HB2 . 36162 1 75 . 1 1 8 8 GLU HB3 H 1 2.0440 . . 2 . . . . A 8 GLU HB3 . 36162 1 76 . 1 1 8 8 GLU HG2 H 1 2.5330 . . 2 . . . . A 8 GLU HG2 . 36162 1 77 . 1 1 8 8 GLU HG3 H 1 2.3340 . . 2 . . . . A 8 GLU HG3 . 36162 1 78 . 1 1 8 8 GLU C C 13 178.3540 . . 1 . . . . A 8 GLU C . 36162 1 79 . 1 1 8 8 GLU CA C 13 58.2070 . . 1 . . . . A 8 GLU CA . 36162 1 80 . 1 1 8 8 GLU CB C 13 28.5350 . . 1 . . . . A 8 GLU CB . 36162 1 81 . 1 1 8 8 GLU CG C 13 33.9950 . . 1 . . . . A 8 GLU CG . 36162 1 82 . 1 1 8 8 GLU N N 15 122.2270 . . 1 . . . . A 8 GLU N . 36162 1 83 . 1 1 9 9 SER H H 1 8.3960 . . 1 . . . . A 9 SER H . 36162 1 84 . 1 1 9 9 SER HA H 1 4.0500 . . 1 . . . . A 9 SER HA . 36162 1 85 . 1 1 9 9 SER HB2 H 1 4.2530 . . 2 . . . . A 9 SER HB2 . 36162 1 86 . 1 1 9 9 SER HB3 H 1 4.3480 . . 2 . . . . A 9 SER HB3 . 36162 1 87 . 1 1 9 9 SER C C 13 178.2440 . . 1 . . . . A 9 SER C . 36162 1 88 . 1 1 9 9 SER CA C 13 62.5090 . . 1 . . . . A 9 SER CA . 36162 1 89 . 1 1 9 9 SER CB C 13 62.1660 . . 1 . . . . A 9 SER CB . 36162 1 90 . 1 1 9 9 SER N N 15 115.9380 . . 1 . . . . A 9 SER N . 36162 1 91 . 1 1 10 10 GLN H H 1 8.1180 . . 1 . . . . A 10 GLN H . 36162 1 92 . 1 1 10 10 GLN HA H 1 4.2090 . . 1 . . . . A 10 GLN HA . 36162 1 93 . 1 1 10 10 GLN HB2 H 1 2.2940 . . 2 . . . . A 10 GLN HB2 . 36162 1 94 . 1 1 10 10 GLN HB3 H 1 2.0860 . . 2 . . . . A 10 GLN HB3 . 36162 1 95 . 1 1 10 10 GLN HG2 H 1 2.6920 . . 2 . . . . A 10 GLN HG2 . 36162 1 96 . 1 1 10 10 GLN HG3 H 1 2.4970 . . 2 . . . . A 10 GLN HG3 . 36162 1 97 . 1 1 10 10 GLN HE21 H 1 7.6300 . . 2 . . . . A 10 GLN HE21 . 36162 1 98 . 1 1 10 10 GLN HE22 H 1 6.8470 . . 2 . . . . A 10 GLN HE22 . 36162 1 99 . 1 1 10 10 GLN C C 13 178.2280 . . 1 . . . . A 10 GLN C . 36162 1 100 . 1 1 10 10 GLN CA C 13 58.7830 . . 1 . . . . A 10 GLN CA . 36162 1 101 . 1 1 10 10 GLN CB C 13 28.4950 . . 1 . . . . A 10 GLN CB . 36162 1 102 . 1 1 10 10 GLN CG C 13 34.1330 . . 1 . . . . A 10 GLN CG . 36162 1 103 . 1 1 10 10 GLN N N 15 121.1130 . . 1 . . . . A 10 GLN N . 36162 1 104 . 1 1 10 10 GLN NE2 N 15 112.0410 . . 1 . . . . A 10 GLN NE2 . 36162 1 105 . 1 1 11 11 ARG H H 1 8.1620 . . 1 . . . . A 11 ARG H . 36162 1 106 . 1 1 11 11 ARG HA H 1 3.9100 . . 1 . . . . A 11 ARG HA . 36162 1 107 . 1 1 11 11 ARG HB2 H 1 2.4560 . . 2 . . . . A 11 ARG HB2 . 36162 1 108 . 1 1 11 11 ARG HB3 H 1 2.0870 . . 2 . . . . A 11 ARG HB3 . 36162 1 109 . 1 1 11 11 ARG HG2 H 1 1.6880 . . 2 . . . . A 11 ARG HG2 . 36162 1 110 . 1 1 11 11 ARG HG3 H 1 1.8360 . . 2 . . . . A 11 ARG HG3 . 36162 1 111 . 1 1 11 11 ARG HD2 H 1 4.1600 . . 2 . . . . A 11 ARG HD2 . 36162 1 112 . 1 1 11 11 ARG HD3 H 1 3.0260 . . 2 . . . . A 11 ARG HD3 . 36162 1 113 . 1 1 11 11 ARG HE H 1 9.0960 . . 1 . . . . A 11 ARG HE . 36162 1 114 . 1 1 11 11 ARG C C 13 178.0780 . . 1 . . . . A 11 ARG C . 36162 1 115 . 1 1 11 11 ARG CA C 13 61.0850 . . 1 . . . . A 11 ARG CA . 36162 1 116 . 1 1 11 11 ARG CB C 13 31.9140 . . 1 . . . . A 11 ARG CB . 36162 1 117 . 1 1 11 11 ARG CG C 13 28.8220 . . 1 . . . . A 11 ARG CG . 36162 1 118 . 1 1 11 11 ARG CD C 13 42.6610 . . 1 . . . . A 11 ARG CD . 36162 1 119 . 1 1 11 11 ARG N N 15 124.2010 . . 1 . . . . A 11 ARG N . 36162 1 120 . 1 1 11 11 ARG NE N 15 85.0350 . . 1 . . . . A 11 ARG NE . 36162 1 121 . 1 1 12 12 ILE H H 1 8.5350 . . 1 . . . . A 12 ILE H . 36162 1 122 . 1 1 12 12 ILE HA H 1 3.6670 . . 1 . . . . A 12 ILE HA . 36162 1 123 . 1 1 12 12 ILE HB H 1 2.0680 . . 1 . . . . A 12 ILE HB . 36162 1 124 . 1 1 12 12 ILE HG13 H 1 1.5650 . . 2 . . . . A 12 ILE HG13 . 36162 1 125 . 1 1 12 12 ILE HG21 H 1 0.9280 . . 1 . . . . A 12 ILE HG21 . 36162 1 126 . 1 1 12 12 ILE HG22 H 1 0.9280 . . 1 . . . . A 12 ILE HG22 . 36162 1 127 . 1 1 12 12 ILE HG23 H 1 0.9280 . . 1 . . . . A 12 ILE HG23 . 36162 1 128 . 1 1 12 12 ILE HD11 H 1 0.8140 . . 1 . . . . A 12 ILE HD11 . 36162 1 129 . 1 1 12 12 ILE HD12 H 1 0.8140 . . 1 . . . . A 12 ILE HD12 . 36162 1 130 . 1 1 12 12 ILE HD13 H 1 0.8140 . . 1 . . . . A 12 ILE HD13 . 36162 1 131 . 1 1 12 12 ILE C C 13 178.0360 . . 1 . . . . A 12 ILE C . 36162 1 132 . 1 1 12 12 ILE CA C 13 62.6860 . . 1 . . . . A 12 ILE CA . 36162 1 133 . 1 1 12 12 ILE CB C 13 36.8040 . . 1 . . . . A 12 ILE CB . 36162 1 134 . 1 1 12 12 ILE CG1 C 13 28.0540 . . 1 . . . . A 12 ILE CG1 . 36162 1 135 . 1 1 12 12 ILE CG2 C 13 17.7620 . . 1 . . . . A 12 ILE CG2 . 36162 1 136 . 1 1 12 12 ILE CD1 C 13 10.9540 . . 1 . . . . A 12 ILE CD1 . 36162 1 137 . 1 1 12 12 ILE N N 15 118.8630 . . 1 . . . . A 12 ILE N . 36162 1 138 . 1 1 13 13 ALA H H 1 8.0890 . . 1 . . . . A 13 ALA H . 36162 1 139 . 1 1 13 13 ALA HA H 1 4.2150 . . 1 . . . . A 13 ALA HA . 36162 1 140 . 1 1 13 13 ALA HB1 H 1 1.5700 . . 1 . . . . A 13 ALA HB1 . 36162 1 141 . 1 1 13 13 ALA HB2 H 1 1.5700 . . 1 . . . . A 13 ALA HB2 . 36162 1 142 . 1 1 13 13 ALA HB3 H 1 1.5700 . . 1 . . . . A 13 ALA HB3 . 36162 1 143 . 1 1 13 13 ALA C C 13 181.4740 . . 1 . . . . A 13 ALA C . 36162 1 144 . 1 1 13 13 ALA CA C 13 55.6470 . . 1 . . . . A 13 ALA CA . 36162 1 145 . 1 1 13 13 ALA CB C 13 17.7060 . . 1 . . . . A 13 ALA CB . 36162 1 146 . 1 1 13 13 ALA N N 15 122.6640 . . 1 . . . . A 13 ALA N . 36162 1 147 . 1 1 14 14 SER H H 1 7.9120 . . 1 . . . . A 14 SER H . 36162 1 148 . 1 1 14 14 SER HA H 1 4.3260 . . 1 . . . . A 14 SER HA . 36162 1 149 . 1 1 14 14 SER HB2 H 1 4.1890 . . 2 . . . . A 14 SER HB2 . 36162 1 150 . 1 1 14 14 SER CA C 13 64.0340 . . 1 . . . . A 14 SER CA . 36162 1 151 . 1 1 14 14 SER CB C 13 63.2210 . . 1 . . . . A 14 SER CB . 36162 1 152 . 1 1 14 14 SER N N 15 116.8010 . . 1 . . . . A 14 SER N . 36162 1 153 . 1 1 15 15 LYS H H 1 7.9210 . . 1 . . . . A 15 LYS H . 36162 1 154 . 1 1 15 15 LYS HA H 1 2.8350 . . 1 . . . . A 15 LYS HA . 36162 1 155 . 1 1 15 15 LYS HB2 H 1 1.6330 . . 2 . . . . A 15 LYS HB2 . 36162 1 156 . 1 1 15 15 LYS HB3 H 1 0.8710 . . 2 . . . . A 15 LYS HB3 . 36162 1 157 . 1 1 15 15 LYS HG2 H 1 1.1700 . . 2 . . . . A 15 LYS HG2 . 36162 1 158 . 1 1 15 15 LYS HG3 H 1 0.8210 . . 2 . . . . A 15 LYS HG3 . 36162 1 159 . 1 1 15 15 LYS HD2 H 1 1.5040 . . 2 . . . . A 15 LYS HD2 . 36162 1 160 . 1 1 15 15 LYS HD3 H 1 1.6140 . . 2 . . . . A 15 LYS HD3 . 36162 1 161 . 1 1 15 15 LYS HE2 H 1 2.8670 . . 2 . . . . A 15 LYS HE2 . 36162 1 162 . 1 1 15 15 LYS HE3 H 1 2.9770 . . 2 . . . . A 15 LYS HE3 . 36162 1 163 . 1 1 15 15 LYS C C 13 177.4770 . . 1 . . . . A 15 LYS C . 36162 1 164 . 1 1 15 15 LYS CA C 13 60.5810 . . 1 . . . . A 15 LYS CA . 36162 1 165 . 1 1 15 15 LYS CB C 13 31.7230 . . 1 . . . . A 15 LYS CB . 36162 1 166 . 1 1 15 15 LYS CG C 13 24.4880 . . 1 . . . . A 15 LYS CG . 36162 1 167 . 1 1 15 15 LYS CD C 13 29.5130 . . 1 . . . . A 15 LYS CD . 36162 1 168 . 1 1 15 15 LYS CE C 13 41.9940 . . 1 . . . . A 15 LYS CE . 36162 1 169 . 1 1 15 15 LYS N N 15 126.6560 . . 1 . . . . A 15 LYS N . 36162 1 170 . 1 1 16 16 ASN H H 1 8.7580 . . 1 . . . . A 16 ASN H . 36162 1 171 . 1 1 16 16 ASN HA H 1 4.4410 . . 1 . . . . A 16 ASN HA . 36162 1 172 . 1 1 16 16 ASN HB2 H 1 2.8550 . . 2 . . . . A 16 ASN HB2 . 36162 1 173 . 1 1 16 16 ASN HD21 H 1 7.5140 . . 2 . . . . A 16 ASN HD21 . 36162 1 174 . 1 1 16 16 ASN HD22 H 1 6.8110 . . 2 . . . . A 16 ASN HD22 . 36162 1 175 . 1 1 16 16 ASN C C 13 178.7640 . . 1 . . . . A 16 ASN C . 36162 1 176 . 1 1 16 16 ASN CA C 13 55.4640 . . 1 . . . . A 16 ASN CA . 36162 1 177 . 1 1 16 16 ASN CB C 13 37.6460 . . 1 . . . . A 16 ASN CB . 36162 1 178 . 1 1 16 16 ASN N N 15 116.6070 . . 1 . . . . A 16 ASN N . 36162 1 179 . 1 1 16 16 ASN ND2 N 15 111.1330 . . 1 . . . . A 16 ASN ND2 . 36162 1 180 . 1 1 17 17 GLN H H 1 8.2570 . . 1 . . . . A 17 GLN H . 36162 1 181 . 1 1 17 17 GLN HA H 1 4.1910 . . 1 . . . . A 17 GLN HA . 36162 1 182 . 1 1 17 17 GLN HB2 H 1 2.2440 . . 2 . . . . A 17 GLN HB2 . 36162 1 183 . 1 1 17 17 GLN HB3 H 1 2.1630 . . 2 . . . . A 17 GLN HB3 . 36162 1 184 . 1 1 17 17 GLN HG2 H 1 2.3970 . . 2 . . . . A 17 GLN HG2 . 36162 1 185 . 1 1 17 17 GLN HE21 H 1 7.5280 . . 2 . . . . A 17 GLN HE21 . 36162 1 186 . 1 1 17 17 GLN HE22 H 1 6.8730 . . 2 . . . . A 17 GLN HE22 . 36162 1 187 . 1 1 17 17 GLN C C 13 177.0150 . . 1 . . . . A 17 GLN C . 36162 1 188 . 1 1 17 17 GLN CA C 13 59.1000 . . 1 . . . . A 17 GLN CA . 36162 1 189 . 1 1 17 17 GLN CB C 13 28.9310 . . 1 . . . . A 17 GLN CB . 36162 1 190 . 1 1 17 17 GLN CG C 13 34.1960 . . 1 . . . . A 17 GLN CG . 36162 1 191 . 1 1 17 17 GLN N N 15 122.2980 . . 1 . . . . A 17 GLN N . 36162 1 192 . 1 1 17 17 GLN NE2 N 15 111.5870 . . 1 . . . . A 17 GLN NE2 . 36162 1 193 . 1 1 18 18 LEU H H 1 7.7400 . . 1 . . . . A 18 LEU H . 36162 1 194 . 1 1 18 18 LEU HA H 1 4.0970 . . 1 . . . . A 18 LEU HA . 36162 1 195 . 1 1 18 18 LEU HB2 H 1 2.2320 . . 2 . . . . A 18 LEU HB2 . 36162 1 196 . 1 1 18 18 LEU HB3 H 1 1.6700 . . 2 . . . . A 18 LEU HB3 . 36162 1 197 . 1 1 18 18 LEU HG H 1 1.3900 . . 1 . . . . A 18 LEU HG . 36162 1 198 . 1 1 18 18 LEU HD11 H 1 0.9340 . . 1 . . . . A 18 LEU HD11 . 36162 1 199 . 1 1 18 18 LEU HD12 H 1 0.9340 . . 1 . . . . A 18 LEU HD12 . 36162 1 200 . 1 1 18 18 LEU HD13 H 1 0.9340 . . 1 . . . . A 18 LEU HD13 . 36162 1 201 . 1 1 18 18 LEU C C 13 177.1380 . . 1 . . . . A 18 LEU C . 36162 1 202 . 1 1 18 18 LEU CA C 13 58.5710 . . 1 . . . . A 18 LEU CA . 36162 1 203 . 1 1 18 18 LEU CB C 13 41.5830 . . 1 . . . . A 18 LEU CB . 36162 1 204 . 1 1 18 18 LEU CG C 13 27.6140 . . 1 . . . . A 18 LEU CG . 36162 1 205 . 1 1 18 18 LEU CD1 C 13 23.4330 . . 2 . . . . A 18 LEU CD1 . 36162 1 206 . 1 1 18 18 LEU CD2 C 13 27.6140 . . 2 . . . . A 18 LEU CD2 . 36162 1 207 . 1 1 18 18 LEU N N 15 120.3290 . . 1 . . . . A 18 LEU N . 36162 1 208 . 1 1 19 19 GLU H H 1 8.2490 . . 1 . . . . A 19 GLU H . 36162 1 209 . 1 1 19 19 GLU HA H 1 3.6360 . . 1 . . . . A 19 GLU HA . 36162 1 210 . 1 1 19 19 GLU HB2 H 1 2.1810 . . 2 . . . . A 19 GLU HB2 . 36162 1 211 . 1 1 19 19 GLU HG2 H 1 2.3730 . . 2 . . . . A 19 GLU HG2 . 36162 1 212 . 1 1 19 19 GLU HG3 H 1 2.3100 . . 2 . . . . A 19 GLU HG3 . 36162 1 213 . 1 1 19 19 GLU C C 13 177.6680 . . 1 . . . . A 19 GLU C . 36162 1 214 . 1 1 19 19 GLU CA C 13 60.4390 . . 1 . . . . A 19 GLU CA . 36162 1 215 . 1 1 19 19 GLU CB C 13 30.7740 . . 1 . . . . A 19 GLU CB . 36162 1 216 . 1 1 19 19 GLU CG C 13 37.0540 . . 1 . . . . A 19 GLU CG . 36162 1 217 . 1 1 19 19 GLU N N 15 117.6720 . . 1 . . . . A 19 GLU N . 36162 1 218 . 1 1 20 20 SER H H 1 8.3560 . . 1 . . . . A 20 SER H . 36162 1 219 . 1 1 20 20 SER HA H 1 4.2990 . . 1 . . . . A 20 SER HA . 36162 1 220 . 1 1 20 20 SER HB2 H 1 4.0340 . . 2 . . . . A 20 SER HB2 . 36162 1 221 . 1 1 20 20 SER C C 13 177.6420 . . 1 . . . . A 20 SER C . 36162 1 222 . 1 1 20 20 SER CA C 13 61.7080 . . 1 . . . . A 20 SER CA . 36162 1 223 . 1 1 20 20 SER CB C 13 63.1800 . . 1 . . . . A 20 SER CB . 36162 1 224 . 1 1 20 20 SER N N 15 112.1220 . . 1 . . . . A 20 SER N . 36162 1 225 . 1 1 21 21 ILE H H 1 8.4850 . . 1 . . . . A 21 ILE H . 36162 1 226 . 1 1 21 21 ILE HA H 1 3.9190 . . 1 . . . . A 21 ILE HA . 36162 1 227 . 1 1 21 21 ILE HB H 1 1.9960 . . 1 . . . . A 21 ILE HB . 36162 1 228 . 1 1 21 21 ILE HG12 H 1 1.3910 . . 2 . . . . A 21 ILE HG12 . 36162 1 229 . 1 1 21 21 ILE HG13 H 1 1.7080 . . 2 . . . . A 21 ILE HG13 . 36162 1 230 . 1 1 21 21 ILE HG21 H 1 0.8970 . . 1 . . . . A 21 ILE HG21 . 36162 1 231 . 1 1 21 21 ILE HG22 H 1 0.8970 . . 1 . . . . A 21 ILE HG22 . 36162 1 232 . 1 1 21 21 ILE HG23 H 1 0.8970 . . 1 . . . . A 21 ILE HG23 . 36162 1 233 . 1 1 21 21 ILE HD11 H 1 0.8540 . . 1 . . . . A 21 ILE HD11 . 36162 1 234 . 1 1 21 21 ILE HD12 H 1 0.8540 . . 1 . . . . A 21 ILE HD12 . 36162 1 235 . 1 1 21 21 ILE HD13 H 1 0.8540 . . 1 . . . . A 21 ILE HD13 . 36162 1 236 . 1 1 21 21 ILE C C 13 177.7310 . . 1 . . . . A 21 ILE C . 36162 1 237 . 1 1 21 21 ILE CA C 13 64.3010 . . 1 . . . . A 21 ILE CA . 36162 1 238 . 1 1 21 21 ILE CB C 13 36.7830 . . 1 . . . . A 21 ILE CB . 36162 1 239 . 1 1 21 21 ILE CG1 C 13 29.5380 . . 1 . . . . A 21 ILE CG1 . 36162 1 240 . 1 1 21 21 ILE CG2 C 13 16.9020 . . 1 . . . . A 21 ILE CG2 . 36162 1 241 . 1 1 21 21 ILE CD1 C 13 12.4360 . . 1 . . . . A 21 ILE CD1 . 36162 1 242 . 1 1 21 21 ILE N N 15 123.3670 . . 1 . . . . A 21 ILE N . 36162 1 243 . 1 1 22 22 ALA H H 1 8.4030 . . 1 . . . . A 22 ALA H . 36162 1 244 . 1 1 22 22 ALA HA H 1 3.9690 . . 1 . . . . A 22 ALA HA . 36162 1 245 . 1 1 22 22 ALA HB1 H 1 1.3880 . . 1 . . . . A 22 ALA HB1 . 36162 1 246 . 1 1 22 22 ALA HB2 H 1 1.3880 . . 1 . . . . A 22 ALA HB2 . 36162 1 247 . 1 1 22 22 ALA HB3 H 1 1.3880 . . 1 . . . . A 22 ALA HB3 . 36162 1 248 . 1 1 22 22 ALA C C 13 179.4820 . . 1 . . . . A 22 ALA C . 36162 1 249 . 1 1 22 22 ALA CA C 13 56.9940 . . 1 . . . . A 22 ALA CA . 36162 1 250 . 1 1 22 22 ALA CB C 13 17.5520 . . 1 . . . . A 22 ALA CB . 36162 1 251 . 1 1 22 22 ALA N N 15 123.1360 . . 1 . . . . A 22 ALA N . 36162 1 252 . 1 1 23 23 TYR H H 1 8.2420 . . 1 . . . . A 23 TYR H . 36162 1 253 . 1 1 23 23 TYR HA H 1 4.1080 . . 1 . . . . A 23 TYR HA . 36162 1 254 . 1 1 23 23 TYR HB2 H 1 3.0250 . . 2 . . . . A 23 TYR HB2 . 36162 1 255 . 1 1 23 23 TYR HD1 H 1 7.3610 . . 3 . . . . A 23 TYR HD1 . 36162 1 256 . 1 1 23 23 TYR HE1 H 1 6.9220 . . 3 . . . . A 23 TYR HE1 . 36162 1 257 . 1 1 23 23 TYR C C 13 178.8250 . . 1 . . . . A 23 TYR C . 36162 1 258 . 1 1 23 23 TYR CA C 13 63.2140 . . 1 . . . . A 23 TYR CA . 36162 1 259 . 1 1 23 23 TYR CB C 13 37.8800 . . 1 . . . . A 23 TYR CB . 36162 1 260 . 1 1 23 23 TYR CD1 C 13 133.3450 . . 1 . . . . A 23 TYR CD1 . 36162 1 261 . 1 1 23 23 TYR CE1 C 13 118.0260 . . 1 . . . . A 23 TYR CE1 . 36162 1 262 . 1 1 23 23 TYR N N 15 113.9180 . . 1 . . . . A 23 TYR N . 36162 1 263 . 1 1 24 24 SER H H 1 8.4690 . . 1 . . . . A 24 SER H . 36162 1 264 . 1 1 24 24 SER HA H 1 4.3580 . . 1 . . . . A 24 SER HA . 36162 1 265 . 1 1 24 24 SER HB2 H 1 4.1150 . . 2 . . . . A 24 SER HB2 . 36162 1 266 . 1 1 24 24 SER CA C 13 61.8520 . . 1 . . . . A 24 SER CA . 36162 1 267 . 1 1 24 24 SER CB C 13 62.8600 . . 1 . . . . A 24 SER CB . 36162 1 268 . 1 1 24 24 SER N N 15 116.4280 . . 1 . . . . A 24 SER N . 36162 1 269 . 1 1 25 25 LEU H H 1 8.7910 . . 1 . . . . A 25 LEU H . 36162 1 270 . 1 1 25 25 LEU HA H 1 4.0840 . . 1 . . . . A 25 LEU HA . 36162 1 271 . 1 1 25 25 LEU HB2 H 1 1.9940 . . 2 . . . . A 25 LEU HB2 . 36162 1 272 . 1 1 25 25 LEU HB3 H 1 1.1050 . . 2 . . . . A 25 LEU HB3 . 36162 1 273 . 1 1 25 25 LEU HG H 1 1.9900 . . 1 . . . . A 25 LEU HG . 36162 1 274 . 1 1 25 25 LEU HD11 H 1 0.9630 . . 1 . . . . A 25 LEU HD11 . 36162 1 275 . 1 1 25 25 LEU HD12 H 1 0.9630 . . 1 . . . . A 25 LEU HD12 . 36162 1 276 . 1 1 25 25 LEU HD13 H 1 0.9630 . . 1 . . . . A 25 LEU HD13 . 36162 1 277 . 1 1 25 25 LEU HD21 H 1 0.7460 . . 1 . . . . A 25 LEU HD21 . 36162 1 278 . 1 1 25 25 LEU HD22 H 1 0.7460 . . 1 . . . . A 25 LEU HD22 . 36162 1 279 . 1 1 25 25 LEU HD23 H 1 0.7460 . . 1 . . . . A 25 LEU HD23 . 36162 1 280 . 1 1 25 25 LEU C C 13 178.6590 . . 1 . . . . A 25 LEU C . 36162 1 281 . 1 1 25 25 LEU CA C 13 58.4320 . . 1 . . . . A 25 LEU CA . 36162 1 282 . 1 1 25 25 LEU CB C 13 42.3230 . . 1 . . . . A 25 LEU CB . 36162 1 283 . 1 1 25 25 LEU CG C 13 26.5970 . . 1 . . . . A 25 LEU CG . 36162 1 284 . 1 1 25 25 LEU CD1 C 13 22.8930 . . 2 . . . . A 25 LEU CD1 . 36162 1 285 . 1 1 25 25 LEU CD2 C 13 26.5970 . . 2 . . . . A 25 LEU CD2 . 36162 1 286 . 1 1 25 25 LEU N N 15 123.4520 . . 1 . . . . A 25 LEU N . 36162 1 287 . 1 1 26 26 LYS H H 1 7.5820 . . 1 . . . . A 26 LYS H . 36162 1 288 . 1 1 26 26 LYS HA H 1 3.7590 . . 1 . . . . A 26 LYS HA . 36162 1 289 . 1 1 26 26 LYS HB2 H 1 2.0220 . . 2 . . . . A 26 LYS HB2 . 36162 1 290 . 1 1 26 26 LYS HB3 H 1 1.8720 . . 2 . . . . A 26 LYS HB3 . 36162 1 291 . 1 1 26 26 LYS HG2 H 1 1.6240 . . 2 . . . . A 26 LYS HG2 . 36162 1 292 . 1 1 26 26 LYS HG3 H 1 1.4500 . . 2 . . . . A 26 LYS HG3 . 36162 1 293 . 1 1 26 26 LYS HD2 H 1 1.6620 . . 2 . . . . A 26 LYS HD2 . 36162 1 294 . 1 1 26 26 LYS HE2 H 1 3.0150 . . 2 . . . . A 26 LYS HE2 . 36162 1 295 . 1 1 26 26 LYS C C 13 179.1790 . . 1 . . . . A 26 LYS C . 36162 1 296 . 1 1 26 26 LYS CA C 13 60.7580 . . 1 . . . . A 26 LYS CA . 36162 1 297 . 1 1 26 26 LYS CB C 13 32.2920 . . 1 . . . . A 26 LYS CB . 36162 1 298 . 1 1 26 26 LYS CG C 13 25.1980 . . 1 . . . . A 26 LYS CG . 36162 1 299 . 1 1 26 26 LYS CD C 13 30.0520 . . 1 . . . . A 26 LYS CD . 36162 1 300 . 1 1 26 26 LYS CE C 13 41.3560 . . 1 . . . . A 26 LYS CE . 36162 1 301 . 1 1 26 26 LYS N N 15 117.3430 . . 1 . . . . A 26 LYS N . 36162 1 302 . 1 1 27 27 ASN H H 1 8.3730 . . 1 . . . . A 27 ASN H . 36162 1 303 . 1 1 27 27 ASN HA H 1 4.5200 . . 1 . . . . A 27 ASN HA . 36162 1 304 . 1 1 27 27 ASN HB2 H 1 2.9470 . . 2 . . . . A 27 ASN HB2 . 36162 1 305 . 1 1 27 27 ASN HD21 H 1 7.6770 . . 2 . . . . A 27 ASN HD21 . 36162 1 306 . 1 1 27 27 ASN HD22 H 1 6.9430 . . 2 . . . . A 27 ASN HD22 . 36162 1 307 . 1 1 27 27 ASN C C 13 177.6980 . . 1 . . . . A 27 ASN C . 36162 1 308 . 1 1 27 27 ASN CA C 13 56.4970 . . 1 . . . . A 27 ASN CA . 36162 1 309 . 1 1 27 27 ASN CB C 13 38.3450 . . 1 . . . . A 27 ASN CB . 36162 1 310 . 1 1 27 27 ASN N N 15 118.6120 . . 1 . . . . A 27 ASN N . 36162 1 311 . 1 1 27 27 ASN ND2 N 15 113.0250 . . 1 . . . . A 27 ASN ND2 . 36162 1 312 . 1 1 28 28 THR H H 1 8.8140 . . 1 . . . . A 28 THR H . 36162 1 313 . 1 1 28 28 THR HA H 1 3.9420 . . 1 . . . . A 28 THR HA . 36162 1 314 . 1 1 28 28 THR HB H 1 4.2220 . . 1 . . . . A 28 THR HB . 36162 1 315 . 1 1 28 28 THR HG21 H 1 1.2000 . . 1 . . . . A 28 THR HG21 . 36162 1 316 . 1 1 28 28 THR HG22 H 1 1.2000 . . 1 . . . . A 28 THR HG22 . 36162 1 317 . 1 1 28 28 THR HG23 H 1 1.2000 . . 1 . . . . A 28 THR HG23 . 36162 1 318 . 1 1 28 28 THR CA C 13 67.0540 . . 1 . . . . A 28 THR CA . 36162 1 319 . 1 1 28 28 THR CB C 13 68.5610 . . 1 . . . . A 28 THR CB . 36162 1 320 . 1 1 28 28 THR CG2 C 13 22.3460 . . 1 . . . . A 28 THR CG2 . 36162 1 321 . 1 1 28 28 THR N N 15 119.1970 . . 1 . . . . A 28 THR N . 36162 1 322 . 1 1 29 29 ILE H H 1 8.2040 . . 1 . . . . A 29 ILE H . 36162 1 323 . 1 1 29 29 ILE HA H 1 3.6970 . . 1 . . . . A 29 ILE HA . 36162 1 324 . 1 1 29 29 ILE HB H 1 2.1540 . . 1 . . . . A 29 ILE HB . 36162 1 325 . 1 1 29 29 ILE HG12 H 1 1.2950 . . 2 . . . . A 29 ILE HG12 . 36162 1 326 . 1 1 29 29 ILE HG13 H 1 1.8160 . . 2 . . . . A 29 ILE HG13 . 36162 1 327 . 1 1 29 29 ILE HG21 H 1 0.9440 . . 1 . . . . A 29 ILE HG21 . 36162 1 328 . 1 1 29 29 ILE HG22 H 1 0.9440 . . 1 . . . . A 29 ILE HG22 . 36162 1 329 . 1 1 29 29 ILE HG23 H 1 0.9440 . . 1 . . . . A 29 ILE HG23 . 36162 1 330 . 1 1 29 29 ILE HD11 H 1 0.6740 . . 1 . . . . A 29 ILE HD11 . 36162 1 331 . 1 1 29 29 ILE HD12 H 1 0.6740 . . 1 . . . . A 29 ILE HD12 . 36162 1 332 . 1 1 29 29 ILE HD13 H 1 0.6740 . . 1 . . . . A 29 ILE HD13 . 36162 1 333 . 1 1 29 29 ILE C C 13 178.4880 . . 1 . . . . A 29 ILE C . 36162 1 334 . 1 1 29 29 ILE CA C 13 62.3550 . . 1 . . . . A 29 ILE CA . 36162 1 335 . 1 1 29 29 ILE CB C 13 35.2790 . . 1 . . . . A 29 ILE CB . 36162 1 336 . 1 1 29 29 ILE CG1 C 13 28.0160 . . 1 . . . . A 29 ILE CG1 . 36162 1 337 . 1 1 29 29 ILE CG2 C 13 18.6610 . . 1 . . . . A 29 ILE CG2 . 36162 1 338 . 1 1 29 29 ILE CD1 C 13 10.3450 . . 1 . . . . A 29 ILE CD1 . 36162 1 339 . 1 1 29 29 ILE N N 15 121.1210 . . 1 . . . . A 29 ILE N . 36162 1 340 . 1 1 30 30 SER H H 1 7.8410 . . 1 . . . . A 30 SER H . 36162 1 341 . 1 1 30 30 SER HA H 1 4.3020 . . 1 . . . . A 30 SER HA . 36162 1 342 . 1 1 30 30 SER HB2 H 1 4.1180 . . 2 . . . . A 30 SER HB2 . 36162 1 343 . 1 1 30 30 SER C C 13 175.7850 . . 1 . . . . A 30 SER C . 36162 1 344 . 1 1 30 30 SER CA C 13 61.6710 . . 1 . . . . A 30 SER CA . 36162 1 345 . 1 1 30 30 SER CB C 13 63.0390 . . 1 . . . . A 30 SER CB . 36162 1 346 . 1 1 30 30 SER N N 15 116.2130 . . 1 . . . . A 30 SER N . 36162 1 347 . 1 1 31 31 GLU H H 1 7.4380 . . 1 . . . . A 31 GLU H . 36162 1 348 . 1 1 31 31 GLU HA H 1 4.4610 . . 1 . . . . A 31 GLU HA . 36162 1 349 . 1 1 31 31 GLU HB2 H 1 2.2750 . . 2 . . . . A 31 GLU HB2 . 36162 1 350 . 1 1 31 31 GLU HB3 H 1 1.9770 . . 2 . . . . A 31 GLU HB3 . 36162 1 351 . 1 1 31 31 GLU HG2 H 1 2.4320 . . 2 . . . . A 31 GLU HG2 . 36162 1 352 . 1 1 31 31 GLU HG3 H 1 2.2900 . . 2 . . . . A 31 GLU HG3 . 36162 1 353 . 1 1 31 31 GLU C C 13 177.0580 . . 1 . . . . A 31 GLU C . 36162 1 354 . 1 1 31 31 GLU CA C 13 56.3220 . . 1 . . . . A 31 GLU CA . 36162 1 355 . 1 1 31 31 GLU CB C 13 30.3770 . . 1 . . . . A 31 GLU CB . 36162 1 356 . 1 1 31 31 GLU CG C 13 36.2100 . . 1 . . . . A 31 GLU CG . 36162 1 357 . 1 1 31 31 GLU N N 15 118.8840 . . 1 . . . . A 31 GLU N . 36162 1 358 . 1 1 32 32 ALA H H 1 7.6850 . . 1 . . . . A 32 ALA H . 36162 1 359 . 1 1 32 32 ALA HA H 1 4.1870 . . 1 . . . . A 32 ALA HA . 36162 1 360 . 1 1 32 32 ALA HB1 H 1 1.4530 . . 1 . . . . A 32 ALA HB1 . 36162 1 361 . 1 1 32 32 ALA HB2 H 1 1.4530 . . 1 . . . . A 32 ALA HB2 . 36162 1 362 . 1 1 32 32 ALA HB3 H 1 1.4530 . . 1 . . . . A 32 ALA HB3 . 36162 1 363 . 1 1 32 32 ALA C C 13 178.5460 . . 1 . . . . A 32 ALA C . 36162 1 364 . 1 1 32 32 ALA CA C 13 53.9960 . . 1 . . . . A 32 ALA CA . 36162 1 365 . 1 1 32 32 ALA CB C 13 19.7230 . . 1 . . . . A 32 ALA CB . 36162 1 366 . 1 1 32 32 ALA N N 15 122.0040 . . 1 . . . . A 32 ALA N . 36162 1 367 . 1 1 33 33 GLY H H 1 8.1870 . . 1 . . . . A 33 GLY H . 36162 1 368 . 1 1 33 33 GLY HA2 H 1 3.9000 . . 2 . . . . A 33 GLY HA2 . 36162 1 369 . 1 1 33 33 GLY HA3 H 1 3.7830 . . 2 . . . . A 33 GLY HA3 . 36162 1 370 . 1 1 33 33 GLY C C 13 175.5690 . . 1 . . . . A 33 GLY C . 36162 1 371 . 1 1 33 33 GLY CA C 13 46.9710 . . 1 . . . . A 33 GLY CA . 36162 1 372 . 1 1 33 33 GLY N N 15 106.2630 . . 1 . . . . A 33 GLY N . 36162 1 373 . 1 1 34 34 ASP H H 1 8.6420 . . 1 . . . . A 34 ASP H . 36162 1 374 . 1 1 34 34 ASP HA H 1 4.7020 . . 1 . . . . A 34 ASP HA . 36162 1 375 . 1 1 34 34 ASP HB2 H 1 2.8140 . . 2 . . . . A 34 ASP HB2 . 36162 1 376 . 1 1 34 34 ASP HB3 H 1 2.7440 . . 2 . . . . A 34 ASP HB3 . 36162 1 377 . 1 1 34 34 ASP C C 13 177.0390 . . 1 . . . . A 34 ASP C . 36162 1 378 . 1 1 34 34 ASP CA C 13 54.4210 . . 1 . . . . A 34 ASP CA . 36162 1 379 . 1 1 34 34 ASP CB C 13 40.1200 . . 1 . . . . A 34 ASP CB . 36162 1 380 . 1 1 34 34 ASP N N 15 124.4430 . . 1 . . . . A 34 ASP N . 36162 1 381 . 1 1 35 35 LYS H H 1 7.8920 . . 1 . . . . A 35 LYS H . 36162 1 382 . 1 1 35 35 LYS HA H 1 4.0730 . . 1 . . . . A 35 LYS HA . 36162 1 383 . 1 1 35 35 LYS HB2 H 1 1.9090 . . 2 . . . . A 35 LYS HB2 . 36162 1 384 . 1 1 35 35 LYS HB3 H 1 1.7770 . . 2 . . . . A 35 LYS HB3 . 36162 1 385 . 1 1 35 35 LYS HG2 H 1 1.6730 . . 2 . . . . A 35 LYS HG2 . 36162 1 386 . 1 1 35 35 LYS HG3 H 1 1.5020 . . 2 . . . . A 35 LYS HG3 . 36162 1 387 . 1 1 35 35 LYS HD2 H 1 1.6940 . . 2 . . . . A 35 LYS HD2 . 36162 1 388 . 1 1 35 35 LYS HE2 H 1 3.0380 . . 2 . . . . A 35 LYS HE2 . 36162 1 389 . 1 1 35 35 LYS C C 13 175.9870 . . 1 . . . . A 35 LYS C . 36162 1 390 . 1 1 35 35 LYS CA C 13 58.1500 . . 1 . . . . A 35 LYS CA . 36162 1 391 . 1 1 35 35 LYS CB C 13 33.5800 . . 1 . . . . A 35 LYS CB . 36162 1 392 . 1 1 35 35 LYS CG C 13 25.9820 . . 1 . . . . A 35 LYS CG . 36162 1 393 . 1 1 35 35 LYS CD C 13 29.3430 . . 1 . . . . A 35 LYS CD . 36162 1 394 . 1 1 35 35 LYS CE C 13 42.2130 . . 1 . . . . A 35 LYS CE . 36162 1 395 . 1 1 35 35 LYS N N 15 117.7430 . . 1 . . . . A 35 LYS N . 36162 1 396 . 1 1 36 36 LEU H H 1 6.9520 . . 1 . . . . A 36 LEU H . 36162 1 397 . 1 1 36 36 LEU HA H 1 4.7100 . . 1 . . . . A 36 LEU HA . 36162 1 398 . 1 1 36 36 LEU HB2 H 1 1.4750 . . 2 . . . . A 36 LEU HB2 . 36162 1 399 . 1 1 36 36 LEU HB3 H 1 1.2920 . . 2 . . . . A 36 LEU HB3 . 36162 1 400 . 1 1 36 36 LEU HG H 1 1.4580 . . 1 . . . . A 36 LEU HG . 36162 1 401 . 1 1 36 36 LEU HD11 H 1 0.9890 . . 1 . . . . A 36 LEU HD11 . 36162 1 402 . 1 1 36 36 LEU HD12 H 1 0.9890 . . 1 . . . . A 36 LEU HD12 . 36162 1 403 . 1 1 36 36 LEU HD13 H 1 0.9890 . . 1 . . . . A 36 LEU HD13 . 36162 1 404 . 1 1 36 36 LEU HD21 H 1 0.7050 . . 1 . . . . A 36 LEU HD21 . 36162 1 405 . 1 1 36 36 LEU HD22 H 1 0.7050 . . 1 . . . . A 36 LEU HD22 . 36162 1 406 . 1 1 36 36 LEU HD23 H 1 0.7050 . . 1 . . . . A 36 LEU HD23 . 36162 1 407 . 1 1 36 36 LEU C C 13 176.0680 . . 1 . . . . A 36 LEU C . 36162 1 408 . 1 1 36 36 LEU CA C 13 52.4340 . . 1 . . . . A 36 LEU CA . 36162 1 409 . 1 1 36 36 LEU CB C 13 47.8840 . . 1 . . . . A 36 LEU CB . 36162 1 410 . 1 1 36 36 LEU CG C 13 26.9880 . . 1 . . . . A 36 LEU CG . 36162 1 411 . 1 1 36 36 LEU CD1 C 13 23.6140 . . 2 . . . . A 36 LEU CD1 . 36162 1 412 . 1 1 36 36 LEU CD2 C 13 26.9880 . . 2 . . . . A 36 LEU CD2 . 36162 1 413 . 1 1 36 36 LEU N N 15 113.9360 . . 1 . . . . A 36 LEU N . 36162 1 414 . 1 1 37 37 GLU H H 1 9.3240 . . 1 . . . . A 37 GLU H . 36162 1 415 . 1 1 37 37 GLU HA H 1 4.2830 . . 1 . . . . A 37 GLU HA . 36162 1 416 . 1 1 37 37 GLU HB2 H 1 2.2700 . . 2 . . . . A 37 GLU HB2 . 36162 1 417 . 1 1 37 37 GLU HB3 H 1 1.9660 . . 2 . . . . A 37 GLU HB3 . 36162 1 418 . 1 1 37 37 GLU HG2 H 1 2.3990 . . 2 . . . . A 37 GLU HG2 . 36162 1 419 . 1 1 37 37 GLU C C 13 178.2500 . . 1 . . . . A 37 GLU C . 36162 1 420 . 1 1 37 37 GLU CA C 13 55.9230 . . 1 . . . . A 37 GLU CA . 36162 1 421 . 1 1 37 37 GLU CB C 13 30.3430 . . 1 . . . . A 37 GLU CB . 36162 1 422 . 1 1 37 37 GLU CG C 13 36.8330 . . 1 . . . . A 37 GLU CG . 36162 1 423 . 1 1 37 37 GLU N N 15 120.8520 . . 1 . . . . A 37 GLU N . 36162 1 424 . 1 1 38 38 GLN H H 1 9.0070 . . 1 . . . . A 38 GLN H . 36162 1 425 . 1 1 38 38 GLN HA H 1 3.6210 . . 1 . . . . A 38 GLN HA . 36162 1 426 . 1 1 38 38 GLN HB2 H 1 2.2990 . . 2 . . . . A 38 GLN HB2 . 36162 1 427 . 1 1 38 38 GLN HB3 H 1 2.0200 . . 2 . . . . A 38 GLN HB3 . 36162 1 428 . 1 1 38 38 GLN HG2 H 1 2.4170 . . 2 . . . . A 38 GLN HG2 . 36162 1 429 . 1 1 38 38 GLN HE21 H 1 8.0920 . . 2 . . . . A 38 GLN HE21 . 36162 1 430 . 1 1 38 38 GLN HE22 H 1 7.0110 . . 2 . . . . A 38 GLN HE22 . 36162 1 431 . 1 1 38 38 GLN C C 13 177.4950 . . 1 . . . . A 38 GLN C . 36162 1 432 . 1 1 38 38 GLN CA C 13 59.5480 . . 1 . . . . A 38 GLN CA . 36162 1 433 . 1 1 38 38 GLN CB C 13 28.3960 . . 1 . . . . A 38 GLN CB . 36162 1 434 . 1 1 38 38 GLN CG C 13 33.2040 . . 1 . . . . A 38 GLN CG . 36162 1 435 . 1 1 38 38 GLN N N 15 124.3710 . . 1 . . . . A 38 GLN N . 36162 1 436 . 1 1 38 38 GLN NE2 N 15 117.0210 . . 1 . . . . A 38 GLN NE2 . 36162 1 437 . 1 1 39 39 ALA H H 1 8.9310 . . 1 . . . . A 39 ALA H . 36162 1 438 . 1 1 39 39 ALA HA H 1 4.1900 . . 1 . . . . A 39 ALA HA . 36162 1 439 . 1 1 39 39 ALA HB1 H 1 1.4230 . . 1 . . . . A 39 ALA HB1 . 36162 1 440 . 1 1 39 39 ALA HB2 H 1 1.4230 . . 1 . . . . A 39 ALA HB2 . 36162 1 441 . 1 1 39 39 ALA HB3 H 1 1.4230 . . 1 . . . . A 39 ALA HB3 . 36162 1 442 . 1 1 39 39 ALA C C 13 180.5160 . . 1 . . . . A 39 ALA C . 36162 1 443 . 1 1 39 39 ALA CA C 13 55.5150 . . 1 . . . . A 39 ALA CA . 36162 1 444 . 1 1 39 39 ALA CB C 13 18.3240 . . 1 . . . . A 39 ALA CB . 36162 1 445 . 1 1 39 39 ALA N N 15 118.6030 . . 1 . . . . A 39 ALA N . 36162 1 446 . 1 1 40 40 ASP H H 1 6.8640 . . 1 . . . . A 40 ASP H . 36162 1 447 . 1 1 40 40 ASP HA H 1 4.4860 . . 1 . . . . A 40 ASP HA . 36162 1 448 . 1 1 40 40 ASP HB2 H 1 2.8380 . . 2 . . . . A 40 ASP HB2 . 36162 1 449 . 1 1 40 40 ASP HB3 H 1 2.6600 . . 2 . . . . A 40 ASP HB3 . 36162 1 450 . 1 1 40 40 ASP C C 13 177.9170 . . 1 . . . . A 40 ASP C . 36162 1 451 . 1 1 40 40 ASP CA C 13 57.0840 . . 1 . . . . A 40 ASP CA . 36162 1 452 . 1 1 40 40 ASP CB C 13 41.0870 . . 1 . . . . A 40 ASP CB . 36162 1 453 . 1 1 40 40 ASP N N 15 117.6260 . . 1 . . . . A 40 ASP N . 36162 1 454 . 1 1 41 41 LYS H H 1 7.6710 . . 1 . . . . A 41 LYS H . 36162 1 455 . 1 1 41 41 LYS HA H 1 3.7720 . . 1 . . . . A 41 LYS HA . 36162 1 456 . 1 1 41 41 LYS HB2 H 1 1.9930 . . 2 . . . . A 41 LYS HB2 . 36162 1 457 . 1 1 41 41 LYS HB3 H 1 1.8040 . . 2 . . . . A 41 LYS HB3 . 36162 1 458 . 1 1 41 41 LYS HG2 H 1 1.0850 . . 2 . . . . A 41 LYS HG2 . 36162 1 459 . 1 1 41 41 LYS HG3 H 1 1.5530 . . 2 . . . . A 41 LYS HG3 . 36162 1 460 . 1 1 41 41 LYS HD2 H 1 1.6720 . . 2 . . . . A 41 LYS HD2 . 36162 1 461 . 1 1 41 41 LYS HE2 H 1 3.0070 . . 2 . . . . A 41 LYS HE2 . 36162 1 462 . 1 1 41 41 LYS HE3 H 1 2.7900 . . 2 . . . . A 41 LYS HE3 . 36162 1 463 . 1 1 41 41 LYS C C 13 178.9410 . . 1 . . . . A 41 LYS C . 36162 1 464 . 1 1 41 41 LYS CA C 13 60.7530 . . 1 . . . . A 41 LYS CA . 36162 1 465 . 1 1 41 41 LYS CB C 13 31.8810 . . 1 . . . . A 41 LYS CB . 36162 1 466 . 1 1 41 41 LYS CG C 13 27.0170 . . 1 . . . . A 41 LYS CG . 36162 1 467 . 1 1 41 41 LYS CD C 13 30.0030 . . 1 . . . . A 41 LYS CD . 36162 1 468 . 1 1 41 41 LYS CE C 13 42.0890 . . 1 . . . . A 41 LYS CE . 36162 1 469 . 1 1 41 41 LYS N N 15 119.1170 . . 1 . . . . A 41 LYS N . 36162 1 470 . 1 1 42 42 ASP H H 1 8.8200 . . 1 . . . . A 42 ASP H . 36162 1 471 . 1 1 42 42 ASP HA H 1 4.3450 . . 1 . . . . A 42 ASP HA . 36162 1 472 . 1 1 42 42 ASP HB2 H 1 2.8000 . . 2 . . . . A 42 ASP HB2 . 36162 1 473 . 1 1 42 42 ASP HB3 H 1 2.6440 . . 2 . . . . A 42 ASP HB3 . 36162 1 474 . 1 1 42 42 ASP C C 13 178.1760 . . 1 . . . . A 42 ASP C . 36162 1 475 . 1 1 42 42 ASP CA C 13 57.4300 . . 1 . . . . A 42 ASP CA . 36162 1 476 . 1 1 42 42 ASP CB C 13 40.0990 . . 1 . . . . A 42 ASP CB . 36162 1 477 . 1 1 42 42 ASP N N 15 120.0550 . . 1 . . . . A 42 ASP N . 36162 1 478 . 1 1 43 43 THR H H 1 8.0600 . . 1 . . . . A 43 THR H . 36162 1 479 . 1 1 43 43 THR HA H 1 3.8610 . . 1 . . . . A 43 THR HA . 36162 1 480 . 1 1 43 43 THR HB H 1 4.3510 . . 1 . . . . A 43 THR HB . 36162 1 481 . 1 1 43 43 THR HG21 H 1 1.1380 . . 1 . . . . A 43 THR HG21 . 36162 1 482 . 1 1 43 43 THR HG22 H 1 1.1380 . . 1 . . . . A 43 THR HG22 . 36162 1 483 . 1 1 43 43 THR HG23 H 1 1.1380 . . 1 . . . . A 43 THR HG23 . 36162 1 484 . 1 1 43 43 THR CA C 13 67.0350 . . 1 . . . . A 43 THR CA . 36162 1 485 . 1 1 43 43 THR CB C 13 68.7650 . . 1 . . . . A 43 THR CB . 36162 1 486 . 1 1 43 43 THR CG2 C 13 21.8180 . . 1 . . . . A 43 THR CG2 . 36162 1 487 . 1 1 43 43 THR N N 15 117.5830 . . 1 . . . . A 43 THR N . 36162 1 488 . 1 1 44 44 VAL H H 1 7.4390 . . 1 . . . . A 44 VAL H . 36162 1 489 . 1 1 44 44 VAL HA H 1 3.4470 . . 1 . . . . A 44 VAL HA . 36162 1 490 . 1 1 44 44 VAL HB H 1 2.0430 . . 1 . . . . A 44 VAL HB . 36162 1 491 . 1 1 44 44 VAL HG11 H 1 1.0970 . . 1 . . . . A 44 VAL HG11 . 36162 1 492 . 1 1 44 44 VAL HG12 H 1 1.0970 . . 1 . . . . A 44 VAL HG12 . 36162 1 493 . 1 1 44 44 VAL HG13 H 1 1.0970 . . 1 . . . . A 44 VAL HG13 . 36162 1 494 . 1 1 44 44 VAL HG21 H 1 0.8870 . . 1 . . . . A 44 VAL HG21 . 36162 1 495 . 1 1 44 44 VAL HG22 H 1 0.8870 . . 1 . . . . A 44 VAL HG22 . 36162 1 496 . 1 1 44 44 VAL HG23 H 1 0.8870 . . 1 . . . . A 44 VAL HG23 . 36162 1 497 . 1 1 44 44 VAL CA C 13 67.5280 . . 1 . . . . A 44 VAL CA . 36162 1 498 . 1 1 44 44 VAL CB C 13 31.7370 . . 1 . . . . A 44 VAL CB . 36162 1 499 . 1 1 44 44 VAL CG1 C 13 24.4120 . . 2 . . . . A 44 VAL CG1 . 36162 1 500 . 1 1 44 44 VAL CG2 C 13 22.6840 . . 2 . . . . A 44 VAL CG2 . 36162 1 501 . 1 1 44 44 VAL N N 15 119.1820 . . 1 . . . . A 44 VAL N . 36162 1 502 . 1 1 45 45 THR H H 1 8.8090 . . 1 . . . . A 45 THR H . 36162 1 503 . 1 1 45 45 THR HA H 1 4.2450 . . 1 . . . . A 45 THR HA . 36162 1 504 . 1 1 45 45 THR HB H 1 3.5780 . . 1 . . . . A 45 THR HB . 36162 1 505 . 1 1 45 45 THR HG21 H 1 1.2360 . . 1 . . . . A 45 THR HG21 . 36162 1 506 . 1 1 45 45 THR HG22 H 1 1.2360 . . 1 . . . . A 45 THR HG22 . 36162 1 507 . 1 1 45 45 THR HG23 H 1 1.2360 . . 1 . . . . A 45 THR HG23 . 36162 1 508 . 1 1 45 45 THR C C 13 176.1720 . . 1 . . . . A 45 THR C . 36162 1 509 . 1 1 45 45 THR CA C 13 68.4590 . . 1 . . . . A 45 THR CA . 36162 1 510 . 1 1 45 45 THR CB C 13 68.4590 . . 1 . . . . A 45 THR CB . 36162 1 511 . 1 1 45 45 THR CG2 C 13 22.2330 . . 1 . . . . A 45 THR CG2 . 36162 1 512 . 1 1 45 45 THR N N 15 116.8800 . . 1 . . . . A 45 THR N . 36162 1 513 . 1 1 46 46 LYS H H 1 8.6190 . . 1 . . . . A 46 LYS H . 36162 1 514 . 1 1 46 46 LYS HA H 1 4.1180 . . 1 . . . . A 46 LYS HA . 36162 1 515 . 1 1 46 46 LYS HB2 H 1 1.9450 . . 2 . . . . A 46 LYS HB2 . 36162 1 516 . 1 1 46 46 LYS HB3 H 1 1.8690 . . 2 . . . . A 46 LYS HB3 . 36162 1 517 . 1 1 46 46 LYS HG2 H 1 1.5670 . . 2 . . . . A 46 LYS HG2 . 36162 1 518 . 1 1 46 46 LYS HD2 H 1 1.7690 . . 2 . . . . A 46 LYS HD2 . 36162 1 519 . 1 1 46 46 LYS HE2 H 1 3.0170 . . 2 . . . . A 46 LYS HE2 . 36162 1 520 . 1 1 46 46 LYS C C 13 179.2690 . . 1 . . . . A 46 LYS C . 36162 1 521 . 1 1 46 46 LYS CA C 13 59.7510 . . 1 . . . . A 46 LYS CA . 36162 1 522 . 1 1 46 46 LYS CB C 13 32.0810 . . 1 . . . . A 46 LYS CB . 36162 1 523 . 1 1 46 46 LYS CG C 13 25.4630 . . 1 . . . . A 46 LYS CG . 36162 1 524 . 1 1 46 46 LYS CD C 13 29.3290 . . 1 . . . . A 46 LYS CD . 36162 1 525 . 1 1 46 46 LYS CE C 13 42.2250 . . 1 . . . . A 46 LYS CE . 36162 1 526 . 1 1 46 46 LYS N N 15 119.9640 . . 1 . . . . A 46 LYS N . 36162 1 527 . 1 1 47 47 LYS H H 1 7.4340 . . 1 . . . . A 47 LYS H . 36162 1 528 . 1 1 47 47 LYS HA H 1 4.3670 . . 1 . . . . A 47 LYS HA . 36162 1 529 . 1 1 47 47 LYS HB2 H 1 2.0240 . . 2 . . . . A 47 LYS HB2 . 36162 1 530 . 1 1 47 47 LYS HB3 H 1 1.9540 . . 2 . . . . A 47 LYS HB3 . 36162 1 531 . 1 1 47 47 LYS HG2 H 1 1.4950 . . 2 . . . . A 47 LYS HG2 . 36162 1 532 . 1 1 47 47 LYS HD2 H 1 1.6710 . . 2 . . . . A 47 LYS HD2 . 36162 1 533 . 1 1 47 47 LYS HE2 H 1 2.8010 . . 2 . . . . A 47 LYS HE2 . 36162 1 534 . 1 1 47 47 LYS HE3 H 1 2.7230 . . 2 . . . . A 47 LYS HE3 . 36162 1 535 . 1 1 47 47 LYS C C 13 180.1060 . . 1 . . . . A 47 LYS C . 36162 1 536 . 1 1 47 47 LYS CA C 13 56.9350 . . 1 . . . . A 47 LYS CA . 36162 1 537 . 1 1 47 47 LYS CB C 13 31.2970 . . 1 . . . . A 47 LYS CB . 36162 1 538 . 1 1 47 47 LYS CG C 13 25.2870 . . 1 . . . . A 47 LYS CG . 36162 1 539 . 1 1 47 47 LYS CD C 13 28.1170 . . 1 . . . . A 47 LYS CD . 36162 1 540 . 1 1 47 47 LYS CE C 13 42.0480 . . 1 . . . . A 47 LYS CE . 36162 1 541 . 1 1 47 47 LYS N N 15 118.9940 . . 1 . . . . A 47 LYS N . 36162 1 542 . 1 1 48 48 ALA H H 1 9.0440 . . 1 . . . . A 48 ALA H . 36162 1 543 . 1 1 48 48 ALA HA H 1 3.9540 . . 1 . . . . A 48 ALA HA . 36162 1 544 . 1 1 48 48 ALA HB1 H 1 1.5490 . . 1 . . . . A 48 ALA HB1 . 36162 1 545 . 1 1 48 48 ALA HB2 H 1 1.5490 . . 1 . . . . A 48 ALA HB2 . 36162 1 546 . 1 1 48 48 ALA HB3 H 1 1.5490 . . 1 . . . . A 48 ALA HB3 . 36162 1 547 . 1 1 48 48 ALA C C 13 179.1610 . . 1 . . . . A 48 ALA C . 36162 1 548 . 1 1 48 48 ALA CA C 13 56.5710 . . 1 . . . . A 48 ALA CA . 36162 1 549 . 1 1 48 48 ALA CB C 13 17.5430 . . 1 . . . . A 48 ALA CB . 36162 1 550 . 1 1 48 48 ALA N N 15 125.5440 . . 1 . . . . A 48 ALA N . 36162 1 551 . 1 1 49 49 GLU H H 1 8.8610 . . 1 . . . . A 49 GLU H . 36162 1 552 . 1 1 49 49 GLU HA H 1 3.9860 . . 1 . . . . A 49 GLU HA . 36162 1 553 . 1 1 49 49 GLU HB2 H 1 2.2440 . . 2 . . . . A 49 GLU HB2 . 36162 1 554 . 1 1 49 49 GLU HB3 H 1 2.0500 . . 2 . . . . A 49 GLU HB3 . 36162 1 555 . 1 1 49 49 GLU HG2 H 1 2.5490 . . 2 . . . . A 49 GLU HG2 . 36162 1 556 . 1 1 49 49 GLU HG3 H 1 2.2430 . . 2 . . . . A 49 GLU HG3 . 36162 1 557 . 1 1 49 49 GLU C C 13 179.9640 . . 1 . . . . A 49 GLU C . 36162 1 558 . 1 1 49 49 GLU CA C 13 60.0720 . . 1 . . . . A 49 GLU CA . 36162 1 559 . 1 1 49 49 GLU CB C 13 29.1340 . . 1 . . . . A 49 GLU CB . 36162 1 560 . 1 1 49 49 GLU CG C 13 37.0200 . . 1 . . . . A 49 GLU CG . 36162 1 561 . 1 1 49 49 GLU N N 15 118.1870 . . 1 . . . . A 49 GLU N . 36162 1 562 . 1 1 50 50 GLU H H 1 8.6110 . . 1 . . . . A 50 GLU H . 36162 1 563 . 1 1 50 50 GLU HA H 1 4.1360 . . 1 . . . . A 50 GLU HA . 36162 1 564 . 1 1 50 50 GLU HB2 H 1 2.3130 . . 2 . . . . A 50 GLU HB2 . 36162 1 565 . 1 1 50 50 GLU HB3 H 1 2.2290 . . 2 . . . . A 50 GLU HB3 . 36162 1 566 . 1 1 50 50 GLU HG2 H 1 2.5360 . . 2 . . . . A 50 GLU HG2 . 36162 1 567 . 1 1 50 50 GLU HG3 H 1 2.2660 . . 2 . . . . A 50 GLU HG3 . 36162 1 568 . 1 1 50 50 GLU C C 13 179.5980 . . 1 . . . . A 50 GLU C . 36162 1 569 . 1 1 50 50 GLU CA C 13 59.4910 . . 1 . . . . A 50 GLU CA . 36162 1 570 . 1 1 50 50 GLU CB C 13 29.9230 . . 1 . . . . A 50 GLU CB . 36162 1 571 . 1 1 50 50 GLU CG C 13 36.4550 . . 1 . . . . A 50 GLU CG . 36162 1 572 . 1 1 50 50 GLU N N 15 121.3200 . . 1 . . . . A 50 GLU N . 36162 1 573 . 1 1 51 51 THR H H 1 8.0670 . . 1 . . . . A 51 THR H . 36162 1 574 . 1 1 51 51 THR HA H 1 4.5320 . . 1 . . . . A 51 THR HA . 36162 1 575 . 1 1 51 51 THR HB H 1 3.9650 . . 1 . . . . A 51 THR HB . 36162 1 576 . 1 1 51 51 THR HG1 H 1 5.1470 . . 1 . . . . A 51 THR HG1 . 36162 1 577 . 1 1 51 51 THR HG21 H 1 1.2420 . . 1 . . . . A 51 THR HG21 . 36162 1 578 . 1 1 51 51 THR HG22 H 1 1.2420 . . 1 . . . . A 51 THR HG22 . 36162 1 579 . 1 1 51 51 THR HG23 H 1 1.2420 . . 1 . . . . A 51 THR HG23 . 36162 1 580 . 1 1 51 51 THR C C 13 175.3280 . . 1 . . . . A 51 THR C . 36162 1 581 . 1 1 51 51 THR CA C 13 68.1480 . . 1 . . . . A 51 THR CA . 36162 1 582 . 1 1 51 51 THR CB C 13 67.9420 . . 1 . . . . A 51 THR CB . 36162 1 583 . 1 1 51 51 THR CG2 C 13 21.9720 . . 1 . . . . A 51 THR CG2 . 36162 1 584 . 1 1 51 51 THR N N 15 118.2240 . . 1 . . . . A 51 THR N . 36162 1 585 . 1 1 52 52 ILE H H 1 8.2670 . . 1 . . . . A 52 ILE H . 36162 1 586 . 1 1 52 52 ILE HA H 1 3.6500 . . 1 . . . . A 52 ILE HA . 36162 1 587 . 1 1 52 52 ILE HB H 1 1.8210 . . 1 . . . . A 52 ILE HB . 36162 1 588 . 1 1 52 52 ILE HG12 H 1 0.6950 . . 2 . . . . A 52 ILE HG12 . 36162 1 589 . 1 1 52 52 ILE HG13 H 1 1.5150 . . 2 . . . . A 52 ILE HG13 . 36162 1 590 . 1 1 52 52 ILE HG21 H 1 0.9650 . . 1 . . . . A 52 ILE HG21 . 36162 1 591 . 1 1 52 52 ILE HG22 H 1 0.9650 . . 1 . . . . A 52 ILE HG22 . 36162 1 592 . 1 1 52 52 ILE HG23 H 1 0.9650 . . 1 . . . . A 52 ILE HG23 . 36162 1 593 . 1 1 52 52 ILE HD11 H 1 0.1780 . . 1 . . . . A 52 ILE HD11 . 36162 1 594 . 1 1 52 52 ILE HD12 H 1 0.1780 . . 1 . . . . A 52 ILE HD12 . 36162 1 595 . 1 1 52 52 ILE HD13 H 1 0.1780 . . 1 . . . . A 52 ILE HD13 . 36162 1 596 . 1 1 52 52 ILE CA C 13 65.9590 . . 1 . . . . A 52 ILE CA . 36162 1 597 . 1 1 52 52 ILE CB C 13 38.1580 . . 1 . . . . A 52 ILE CB . 36162 1 598 . 1 1 52 52 ILE CG1 C 13 30.4030 . . 1 . . . . A 52 ILE CG1 . 36162 1 599 . 1 1 52 52 ILE CG2 C 13 17.6110 . . 1 . . . . A 52 ILE CG2 . 36162 1 600 . 1 1 52 52 ILE CD1 C 13 12.3180 . . 1 . . . . A 52 ILE CD1 . 36162 1 601 . 1 1 52 52 ILE N N 15 124.1890 . . 1 . . . . A 52 ILE N . 36162 1 602 . 1 1 53 53 SER H H 1 8.3190 . . 1 . . . . A 53 SER H . 36162 1 603 . 1 1 53 53 SER HA H 1 4.3210 . . 1 . . . . A 53 SER HA . 36162 1 604 . 1 1 53 53 SER HB2 H 1 4.0330 . . 2 . . . . A 53 SER HB2 . 36162 1 605 . 1 1 53 53 SER C C 13 177.5380 . . 1 . . . . A 53 SER C . 36162 1 606 . 1 1 53 53 SER CA C 13 61.7570 . . 1 . . . . A 53 SER CA . 36162 1 607 . 1 1 53 53 SER CB C 13 62.7660 . . 1 . . . . A 53 SER CB . 36162 1 608 . 1 1 53 53 SER N N 15 115.1540 . . 1 . . . . A 53 SER N . 36162 1 609 . 1 1 54 54 TRP H H 1 8.4790 . . 1 . . . . A 54 TRP H . 36162 1 610 . 1 1 54 54 TRP HA H 1 4.0880 . . 1 . . . . A 54 TRP HA . 36162 1 611 . 1 1 54 54 TRP HB2 H 1 3.7230 . . 2 . . . . A 54 TRP HB2 . 36162 1 612 . 1 1 54 54 TRP HB3 H 1 3.4380 . . 2 . . . . A 54 TRP HB3 . 36162 1 613 . 1 1 54 54 TRP HD1 H 1 7.3220 . . 1 . . . . A 54 TRP HD1 . 36162 1 614 . 1 1 54 54 TRP HE1 H 1 10.2130 . . 1 . . . . A 54 TRP HE1 . 36162 1 615 . 1 1 54 54 TRP HE3 H 1 7.5180 . . 1 . . . . A 54 TRP HE3 . 36162 1 616 . 1 1 54 54 TRP HZ2 H 1 7.2760 . . 1 . . . . A 54 TRP HZ2 . 36162 1 617 . 1 1 54 54 TRP HZ3 H 1 7.1390 . . 1 . . . . A 54 TRP HZ3 . 36162 1 618 . 1 1 54 54 TRP HH2 H 1 6.4810 . . 1 . . . . A 54 TRP HH2 . 36162 1 619 . 1 1 54 54 TRP C C 13 179.3660 . . 1 . . . . A 54 TRP C . 36162 1 620 . 1 1 54 54 TRP CA C 13 62.5600 . . 1 . . . . A 54 TRP CA . 36162 1 621 . 1 1 54 54 TRP CB C 13 28.3020 . . 1 . . . . A 54 TRP CB . 36162 1 622 . 1 1 54 54 TRP CD1 C 13 127.1590 . . 1 . . . . A 54 TRP CD1 . 36162 1 623 . 1 1 54 54 TRP CE3 C 13 119.5480 . . 1 . . . . A 54 TRP CE3 . 36162 1 624 . 1 1 54 54 TRP CZ2 C 13 114.6390 . . 1 . . . . A 54 TRP CZ2 . 36162 1 625 . 1 1 54 54 TRP CZ3 C 13 121.3280 . . 1 . . . . A 54 TRP CZ3 . 36162 1 626 . 1 1 54 54 TRP CH2 C 13 123.5990 . . 1 . . . . A 54 TRP CH2 . 36162 1 627 . 1 1 54 54 TRP N N 15 123.7880 . . 1 . . . . A 54 TRP N . 36162 1 628 . 1 1 54 54 TRP NE1 N 15 131.4820 . . 1 . . . . A 54 TRP NE1 . 36162 1 629 . 1 1 55 55 LEU H H 1 8.9610 . . 1 . . . . A 55 LEU H . 36162 1 630 . 1 1 55 55 LEU HA H 1 3.6840 . . 1 . . . . A 55 LEU HA . 36162 1 631 . 1 1 55 55 LEU HB2 H 1 2.1050 . . 2 . . . . A 55 LEU HB2 . 36162 1 632 . 1 1 55 55 LEU HB3 H 1 1.9360 . . 2 . . . . A 55 LEU HB3 . 36162 1 633 . 1 1 55 55 LEU HG H 1 2.0360 . . 1 . . . . A 55 LEU HG . 36162 1 634 . 1 1 55 55 LEU HD11 H 1 1.1060 . . 1 . . . . A 55 LEU HD11 . 36162 1 635 . 1 1 55 55 LEU HD12 H 1 1.1060 . . 1 . . . . A 55 LEU HD12 . 36162 1 636 . 1 1 55 55 LEU HD13 H 1 1.1060 . . 1 . . . . A 55 LEU HD13 . 36162 1 637 . 1 1 55 55 LEU HD21 H 1 0.9980 . . 1 . . . . A 55 LEU HD21 . 36162 1 638 . 1 1 55 55 LEU HD22 H 1 0.9980 . . 1 . . . . A 55 LEU HD22 . 36162 1 639 . 1 1 55 55 LEU HD23 H 1 0.9980 . . 1 . . . . A 55 LEU HD23 . 36162 1 640 . 1 1 55 55 LEU C C 13 178.9560 . . 1 . . . . A 55 LEU C . 36162 1 641 . 1 1 55 55 LEU CA C 13 59.0110 . . 1 . . . . A 55 LEU CA . 36162 1 642 . 1 1 55 55 LEU CB C 13 42.4290 . . 1 . . . . A 55 LEU CB . 36162 1 643 . 1 1 55 55 LEU CG C 13 27.5060 . . 1 . . . . A 55 LEU CG . 36162 1 644 . 1 1 55 55 LEU CD1 C 13 25.9610 . . 2 . . . . A 55 LEU CD1 . 36162 1 645 . 1 1 55 55 LEU CD2 C 13 25.7000 . . 2 . . . . A 55 LEU CD2 . 36162 1 646 . 1 1 55 55 LEU N N 15 123.3820 . . 1 . . . . A 55 LEU N . 36162 1 647 . 1 1 56 56 ASP H H 1 7.9670 . . 1 . . . . A 56 ASP H . 36162 1 648 . 1 1 56 56 ASP HA H 1 4.3930 . . 1 . . . . A 56 ASP HA . 36162 1 649 . 1 1 56 56 ASP HB2 H 1 2.8490 . . 2 . . . . A 56 ASP HB2 . 36162 1 650 . 1 1 56 56 ASP HB3 H 1 2.6970 . . 2 . . . . A 56 ASP HB3 . 36162 1 651 . 1 1 56 56 ASP C C 13 178.0860 . . 1 . . . . A 56 ASP C . 36162 1 652 . 1 1 56 56 ASP CA C 13 57.1290 . . 1 . . . . A 56 ASP CA . 36162 1 653 . 1 1 56 56 ASP CB C 13 41.0440 . . 1 . . . . A 56 ASP CB . 36162 1 654 . 1 1 56 56 ASP N N 15 117.7050 . . 1 . . . . A 56 ASP N . 36162 1 655 . 1 1 57 57 SER H H 1 7.2590 . . 1 . . . . A 57 SER H . 36162 1 656 . 1 1 57 57 SER HA H 1 4.5740 . . 1 . . . . A 57 SER HA . 36162 1 657 . 1 1 57 57 SER HB2 H 1 3.8780 . . 2 . . . . A 57 SER HB2 . 36162 1 658 . 1 1 57 57 SER HB3 H 1 3.7520 . . 2 . . . . A 57 SER HB3 . 36162 1 659 . 1 1 57 57 SER C C 13 173.9930 . . 1 . . . . A 57 SER C . 36162 1 660 . 1 1 57 57 SER CA C 13 58.9970 . . 1 . . . . A 57 SER CA . 36162 1 661 . 1 1 57 57 SER CB C 13 64.7590 . . 1 . . . . A 57 SER CB . 36162 1 662 . 1 1 57 57 SER N N 15 111.4850 . . 1 . . . . A 57 SER N . 36162 1 663 . 1 1 58 58 ASN H H 1 7.4730 . . 1 . . . . A 58 ASN H . 36162 1 664 . 1 1 58 58 ASN HA H 1 4.8400 . . 1 . . . . A 58 ASN HA . 36162 1 665 . 1 1 58 58 ASN HB2 H 1 1.8780 . . 2 . . . . A 58 ASN HB2 . 36162 1 666 . 1 1 58 58 ASN HB3 H 1 0.7610 . . 2 . . . . A 58 ASN HB3 . 36162 1 667 . 1 1 58 58 ASN HD21 H 1 6.4410 . . 2 . . . . A 58 ASN HD21 . 36162 1 668 . 1 1 58 58 ASN HD22 H 1 6.7930 . . 2 . . . . A 58 ASN HD22 . 36162 1 669 . 1 1 58 58 ASN C C 13 174.8390 . . 1 . . . . A 58 ASN C . 36162 1 670 . 1 1 58 58 ASN CA C 13 53.4230 . . 1 . . . . A 58 ASN CA . 36162 1 671 . 1 1 58 58 ASN CB C 13 38.2730 . . 1 . . . . A 58 ASN CB . 36162 1 672 . 1 1 58 58 ASN N N 15 121.7660 . . 1 . . . . A 58 ASN N . 36162 1 673 . 1 1 58 58 ASN ND2 N 15 117.2400 . . 1 . . . . A 58 ASN ND2 . 36162 1 674 . 1 1 59 59 THR H H 1 7.8910 . . 1 . . . . A 59 THR H . 36162 1 675 . 1 1 59 59 THR HA H 1 4.0730 . . 1 . . . . A 59 THR HA . 36162 1 676 . 1 1 59 59 THR HB H 1 4.3010 . . 1 . . . . A 59 THR HB . 36162 1 677 . 1 1 59 59 THR HG21 H 1 1.3850 . . 1 . . . . A 59 THR HG21 . 36162 1 678 . 1 1 59 59 THR HG22 H 1 1.3850 . . 1 . . . . A 59 THR HG22 . 36162 1 679 . 1 1 59 59 THR HG23 H 1 1.3850 . . 1 . . . . A 59 THR HG23 . 36162 1 680 . 1 1 59 59 THR C C 13 176.6000 . . 1 . . . . A 59 THR C . 36162 1 681 . 1 1 59 59 THR CA C 13 65.7070 . . 1 . . . . A 59 THR CA . 36162 1 682 . 1 1 59 59 THR CB C 13 69.1880 . . 1 . . . . A 59 THR CB . 36162 1 683 . 1 1 59 59 THR CG2 C 13 22.3390 . . 1 . . . . A 59 THR CG2 . 36162 1 684 . 1 1 59 59 THR N N 15 111.4440 . . 1 . . . . A 59 THR N . 36162 1 685 . 1 1 60 60 THR H H 1 7.6640 . . 1 . . . . A 60 THR H . 36162 1 686 . 1 1 60 60 THR HA H 1 4.3460 . . 1 . . . . A 60 THR HA . 36162 1 687 . 1 1 60 60 THR HB H 1 4.5870 . . 1 . . . . A 60 THR HB . 36162 1 688 . 1 1 60 60 THR HG21 H 1 1.1700 . . 1 . . . . A 60 THR HG21 . 36162 1 689 . 1 1 60 60 THR HG22 H 1 1.1700 . . 1 . . . . A 60 THR HG22 . 36162 1 690 . 1 1 60 60 THR HG23 H 1 1.1700 . . 1 . . . . A 60 THR HG23 . 36162 1 691 . 1 1 60 60 THR C C 13 173.7540 . . 1 . . . . A 60 THR C . 36162 1 692 . 1 1 60 60 THR CA C 13 61.2500 . . 1 . . . . A 60 THR CA . 36162 1 693 . 1 1 60 60 THR CB C 13 68.7330 . . 1 . . . . A 60 THR CB . 36162 1 694 . 1 1 60 60 THR CG2 C 13 21.5630 . . 1 . . . . A 60 THR CG2 . 36162 1 695 . 1 1 60 60 THR N N 15 108.9880 . . 1 . . . . A 60 THR N . 36162 1 696 . 1 1 61 61 ALA H H 1 7.0890 . . 1 . . . . A 61 ALA H . 36162 1 697 . 1 1 61 61 ALA HA H 1 4.0960 . . 1 . . . . A 61 ALA HA . 36162 1 698 . 1 1 61 61 ALA HB1 H 1 1.0080 . . 1 . . . . A 61 ALA HB1 . 36162 1 699 . 1 1 61 61 ALA HB2 H 1 1.0080 . . 1 . . . . A 61 ALA HB2 . 36162 1 700 . 1 1 61 61 ALA HB3 H 1 1.0080 . . 1 . . . . A 61 ALA HB3 . 36162 1 701 . 1 1 61 61 ALA C C 13 174.3270 . . 1 . . . . A 61 ALA C . 36162 1 702 . 1 1 61 61 ALA CA C 13 52.5670 . . 1 . . . . A 61 ALA CA . 36162 1 703 . 1 1 61 61 ALA CB C 13 18.7320 . . 1 . . . . A 61 ALA CB . 36162 1 704 . 1 1 61 61 ALA N N 15 125.4540 . . 1 . . . . A 61 ALA N . 36162 1 705 . 1 1 62 62 SER H H 1 8.2040 . . 1 . . . . A 62 SER H . 36162 1 706 . 1 1 62 62 SER HA H 1 4.3330 . . 1 . . . . A 62 SER HA . 36162 1 707 . 1 1 62 62 SER HB2 H 1 4.0790 . . 2 . . . . A 62 SER HB2 . 36162 1 708 . 1 1 62 62 SER HB3 H 1 4.3420 . . 2 . . . . A 62 SER HB3 . 36162 1 709 . 1 1 62 62 SER C C 13 174.2460 . . 1 . . . . A 62 SER C . 36162 1 710 . 1 1 62 62 SER CA C 13 57.6990 . . 1 . . . . A 62 SER CA . 36162 1 711 . 1 1 62 62 SER CB C 13 66.1250 . . 1 . . . . A 62 SER CB . 36162 1 712 . 1 1 62 62 SER N N 15 113.0540 . . 1 . . . . A 62 SER N . 36162 1 713 . 1 1 63 63 LYS H H 1 9.1250 . . 1 . . . . A 63 LYS H . 36162 1 714 . 1 1 63 63 LYS HA H 1 4.1500 . . 1 . . . . A 63 LYS HA . 36162 1 715 . 1 1 63 63 LYS HB2 H 1 1.9910 . . 2 . . . . A 63 LYS HB2 . 36162 1 716 . 1 1 63 63 LYS HB3 H 1 1.7950 . . 2 . . . . A 63 LYS HB3 . 36162 1 717 . 1 1 63 63 LYS HG2 H 1 1.4970 . . 2 . . . . A 63 LYS HG2 . 36162 1 718 . 1 1 63 63 LYS HG3 H 1 1.6530 . . 2 . . . . A 63 LYS HG3 . 36162 1 719 . 1 1 63 63 LYS HD2 H 1 1.6750 . . 2 . . . . A 63 LYS HD2 . 36162 1 720 . 1 1 63 63 LYS HE3 H 1 3.0340 . . 2 . . . . A 63 LYS HE3 . 36162 1 721 . 1 1 63 63 LYS C C 13 177.3370 . . 1 . . . . A 63 LYS C . 36162 1 722 . 1 1 63 63 LYS CA C 13 61.0090 . . 1 . . . . A 63 LYS CA . 36162 1 723 . 1 1 63 63 LYS CB C 13 33.5880 . . 1 . . . . A 63 LYS CB . 36162 1 724 . 1 1 63 63 LYS CG C 13 24.7530 . . 1 . . . . A 63 LYS CG . 36162 1 725 . 1 1 63 63 LYS CD C 13 29.7520 . . 1 . . . . A 63 LYS CD . 36162 1 726 . 1 1 63 63 LYS CE C 13 42.5960 . . 1 . . . . A 63 LYS CE . 36162 1 727 . 1 1 63 63 LYS N N 15 121.0260 . . 1 . . . . A 63 LYS N . 36162 1 728 . 1 1 64 64 GLU H H 1 8.8940 . . 1 . . . . A 64 GLU H . 36162 1 729 . 1 1 64 64 GLU HA H 1 4.0100 . . 1 . . . . A 64 GLU HA . 36162 1 730 . 1 1 64 64 GLU HB2 H 1 2.0490 . . 2 . . . . A 64 GLU HB2 . 36162 1 731 . 1 1 64 64 GLU HB3 H 1 1.9930 . . 2 . . . . A 64 GLU HB3 . 36162 1 732 . 1 1 64 64 GLU HG2 H 1 2.5410 . . 2 . . . . A 64 GLU HG2 . 36162 1 733 . 1 1 64 64 GLU HG3 H 1 2.3220 . . 2 . . . . A 64 GLU HG3 . 36162 1 734 . 1 1 64 64 GLU C C 13 178.8010 . . 1 . . . . A 64 GLU C . 36162 1 735 . 1 1 64 64 GLU CA C 13 60.8240 . . 1 . . . . A 64 GLU CA . 36162 1 736 . 1 1 64 64 GLU CB C 13 28.6810 . . 1 . . . . A 64 GLU CB . 36162 1 737 . 1 1 64 64 GLU CG C 13 37.4760 . . 1 . . . . A 64 GLU CG . 36162 1 738 . 1 1 64 64 GLU N N 15 115.8590 . . 1 . . . . A 64 GLU N . 36162 1 739 . 1 1 65 65 GLU H H 1 7.6080 . . 1 . . . . A 65 GLU H . 36162 1 740 . 1 1 65 65 GLU HA H 1 4.0880 . . 1 . . . . A 65 GLU HA . 36162 1 741 . 1 1 65 65 GLU HB2 H 1 2.3000 . . 2 . . . . A 65 GLU HB2 . 36162 1 742 . 1 1 65 65 GLU HB3 H 1 1.9910 . . 2 . . . . A 65 GLU HB3 . 36162 1 743 . 1 1 65 65 GLU HG2 H 1 2.3110 . . 2 . . . . A 65 GLU HG2 . 36162 1 744 . 1 1 65 65 GLU C C 13 180.1460 . . 1 . . . . A 65 GLU C . 36162 1 745 . 1 1 65 65 GLU CA C 13 59.6990 . . 1 . . . . A 65 GLU CA . 36162 1 746 . 1 1 65 65 GLU CB C 13 30.1270 . . 1 . . . . A 65 GLU CB . 36162 1 747 . 1 1 65 65 GLU CG C 13 38.3560 . . 1 . . . . A 65 GLU CG . 36162 1 748 . 1 1 65 65 GLU N N 15 119.2090 . . 1 . . . . A 65 GLU N . 36162 1 749 . 1 1 66 66 PHE H H 1 8.0000 . . 1 . . . . A 66 PHE H . 36162 1 750 . 1 1 66 66 PHE HA H 1 4.5410 . . 1 . . . . A 66 PHE HA . 36162 1 751 . 1 1 66 66 PHE HB2 H 1 3.3610 . . 2 . . . . A 66 PHE HB2 . 36162 1 752 . 1 1 66 66 PHE HB3 H 1 3.0870 . . 2 . . . . A 66 PHE HB3 . 36162 1 753 . 1 1 66 66 PHE HD1 H 1 7.3700 . . 3 . . . . A 66 PHE HD1 . 36162 1 754 . 1 1 66 66 PHE HE1 H 1 7.1950 . . 3 . . . . A 66 PHE HE1 . 36162 1 755 . 1 1 66 66 PHE CA C 13 61.0010 . . 1 . . . . A 66 PHE CA . 36162 1 756 . 1 1 66 66 PHE CB C 13 38.5330 . . 1 . . . . A 66 PHE CB . 36162 1 757 . 1 1 66 66 PHE CD1 C 13 130.4470 . . 1 . . . . A 66 PHE CD1 . 36162 1 758 . 1 1 66 66 PHE CE1 C 13 130.0400 . . 1 . . . . A 66 PHE CE1 . 36162 1 759 . 1 1 66 66 PHE N N 15 119.1590 . . 1 . . . . A 66 PHE N . 36162 1 760 . 1 1 67 67 ASP H H 1 9.0020 . . 1 . . . . A 67 ASP H . 36162 1 761 . 1 1 67 67 ASP HA H 1 4.4230 . . 1 . . . . A 67 ASP HA . 36162 1 762 . 1 1 67 67 ASP HB2 H 1 2.8400 . . 2 . . . . A 67 ASP HB2 . 36162 1 763 . 1 1 67 67 ASP HB3 H 1 2.6770 . . 2 . . . . A 67 ASP HB3 . 36162 1 764 . 1 1 67 67 ASP C C 13 179.7300 . . 1 . . . . A 67 ASP C . 36162 1 765 . 1 1 67 67 ASP CA C 13 57.5670 . . 1 . . . . A 67 ASP CA . 36162 1 766 . 1 1 67 67 ASP CB C 13 39.5160 . . 1 . . . . A 67 ASP CB . 36162 1 767 . 1 1 67 67 ASP N N 15 120.7990 . . 1 . . . . A 67 ASP N . 36162 1 768 . 1 1 68 68 ASP H H 1 8.5950 . . 1 . . . . A 68 ASP H . 36162 1 769 . 1 1 68 68 ASP HA H 1 4.4780 . . 1 . . . . A 68 ASP HA . 36162 1 770 . 1 1 68 68 ASP HB2 H 1 2.7660 . . 2 . . . . A 68 ASP HB2 . 36162 1 771 . 1 1 68 68 ASP HB3 H 1 2.5920 . . 2 . . . . A 68 ASP HB3 . 36162 1 772 . 1 1 68 68 ASP C C 13 179.1420 . . 1 . . . . A 68 ASP C . 36162 1 773 . 1 1 68 68 ASP CA C 13 57.4560 . . 1 . . . . A 68 ASP CA . 36162 1 774 . 1 1 68 68 ASP CB C 13 40.1830 . . 1 . . . . A 68 ASP CB . 36162 1 775 . 1 1 68 68 ASP N N 15 123.1910 . . 1 . . . . A 68 ASP N . 36162 1 776 . 1 1 69 69 LYS H H 1 7.8240 . . 1 . . . . A 69 LYS H . 36162 1 777 . 1 1 69 69 LYS HA H 1 3.8550 . . 1 . . . . A 69 LYS HA . 36162 1 778 . 1 1 69 69 LYS HB2 H 1 1.7410 . . 2 . . . . A 69 LYS HB2 . 36162 1 779 . 1 1 69 69 LYS HB3 H 1 1.4020 . . 2 . . . . A 69 LYS HB3 . 36162 1 780 . 1 1 69 69 LYS HG2 H 1 0.6670 . . 2 . . . . A 69 LYS HG2 . 36162 1 781 . 1 1 69 69 LYS HG3 H 1 -0.1110 . . 2 . . . . A 69 LYS HG3 . 36162 1 782 . 1 1 69 69 LYS HD2 H 1 0.9630 . . 2 . . . . A 69 LYS HD2 . 36162 1 783 . 1 1 69 69 LYS HD3 H 1 0.8100 . . 2 . . . . A 69 LYS HD3 . 36162 1 784 . 1 1 69 69 LYS HE2 H 1 1.6100 . . 2 . . . . A 69 LYS HE2 . 36162 1 785 . 1 1 69 69 LYS HE3 H 1 1.5330 . . 2 . . . . A 69 LYS HE3 . 36162 1 786 . 1 1 69 69 LYS C C 13 179.6070 . . 1 . . . . A 69 LYS C . 36162 1 787 . 1 1 69 69 LYS CA C 13 57.3820 . . 1 . . . . A 69 LYS CA . 36162 1 788 . 1 1 69 69 LYS CB C 13 31.4130 . . 1 . . . . A 69 LYS CB . 36162 1 789 . 1 1 69 69 LYS CG C 13 23.2220 . . 1 . . . . A 69 LYS CG . 36162 1 790 . 1 1 69 69 LYS CD C 13 27.5330 . . 1 . . . . A 69 LYS CD . 36162 1 791 . 1 1 69 69 LYS CE C 13 40.7320 . . 1 . . . . A 69 LYS CE . 36162 1 792 . 1 1 69 69 LYS N N 15 121.2530 . . 1 . . . . A 69 LYS N . 36162 1 793 . 1 1 70 70 LEU H H 1 8.3560 . . 1 . . . . A 70 LEU H . 36162 1 794 . 1 1 70 70 LEU HA H 1 3.9920 . . 1 . . . . A 70 LEU HA . 36162 1 795 . 1 1 70 70 LEU HB2 H 1 2.1740 . . 2 . . . . A 70 LEU HB2 . 36162 1 796 . 1 1 70 70 LEU HB3 H 1 1.6810 . . 2 . . . . A 70 LEU HB3 . 36162 1 797 . 1 1 70 70 LEU HG H 1 0.9410 . . 1 . . . . A 70 LEU HG . 36162 1 798 . 1 1 70 70 LEU HD11 H 1 0.9960 . . 1 . . . . A 70 LEU HD11 . 36162 1 799 . 1 1 70 70 LEU HD12 H 1 0.9960 . . 1 . . . . A 70 LEU HD12 . 36162 1 800 . 1 1 70 70 LEU HD13 H 1 0.9960 . . 1 . . . . A 70 LEU HD13 . 36162 1 801 . 1 1 70 70 LEU HD21 H 1 0.9600 . . 1 . . . . A 70 LEU HD21 . 36162 1 802 . 1 1 70 70 LEU HD22 H 1 0.9600 . . 1 . . . . A 70 LEU HD22 . 36162 1 803 . 1 1 70 70 LEU HD23 H 1 0.9600 . . 1 . . . . A 70 LEU HD23 . 36162 1 804 . 1 1 70 70 LEU C C 13 177.7350 . . 1 . . . . A 70 LEU C . 36162 1 805 . 1 1 70 70 LEU CA C 13 58.2110 . . 1 . . . . A 70 LEU CA . 36162 1 806 . 1 1 70 70 LEU CB C 13 40.7750 . . 1 . . . . A 70 LEU CB . 36162 1 807 . 1 1 70 70 LEU CG C 13 27.0930 . . 1 . . . . A 70 LEU CG . 36162 1 808 . 1 1 70 70 LEU CD1 C 13 23.9260 . . 2 . . . . A 70 LEU CD1 . 36162 1 809 . 1 1 70 70 LEU CD2 C 13 26.2470 . . 2 . . . . A 70 LEU CD2 . 36162 1 810 . 1 1 70 70 LEU N N 15 122.5850 . . 1 . . . . A 70 LEU N . 36162 1 811 . 1 1 71 71 LYS H H 1 7.8230 . . 1 . . . . A 71 LYS H . 36162 1 812 . 1 1 71 71 LYS HA H 1 4.1030 . . 1 . . . . A 71 LYS HA . 36162 1 813 . 1 1 71 71 LYS HB2 H 1 2.0290 . . 2 . . . . A 71 LYS HB2 . 36162 1 814 . 1 1 71 71 LYS HB3 H 1 1.9180 . . 2 . . . . A 71 LYS HB3 . 36162 1 815 . 1 1 71 71 LYS HG2 H 1 1.6570 . . 2 . . . . A 71 LYS HG2 . 36162 1 816 . 1 1 71 71 LYS HD2 H 1 1.6980 . . 2 . . . . A 71 LYS HD2 . 36162 1 817 . 1 1 71 71 LYS HE2 H 1 3.0300 . . 2 . . . . A 71 LYS HE2 . 36162 1 818 . 1 1 71 71 LYS C C 13 178.0690 . . 1 . . . . A 71 LYS C . 36162 1 819 . 1 1 71 71 LYS CA C 13 59.6450 . . 1 . . . . A 71 LYS CA . 36162 1 820 . 1 1 71 71 LYS CB C 13 32.0530 . . 1 . . . . A 71 LYS CB . 36162 1 821 . 1 1 71 71 LYS CG C 13 25.0510 . . 1 . . . . A 71 LYS CG . 36162 1 822 . 1 1 71 71 LYS CD C 13 29.9870 . . 1 . . . . A 71 LYS CD . 36162 1 823 . 1 1 71 71 LYS CE C 13 42.3400 . . 1 . . . . A 71 LYS CE . 36162 1 824 . 1 1 71 71 LYS N N 15 120.9080 . . 1 . . . . A 71 LYS N . 36162 1 825 . 1 1 72 72 GLU H H 1 7.8860 . . 1 . . . . A 72 GLU H . 36162 1 826 . 1 1 72 72 GLU HA H 1 4.0150 . . 1 . . . . A 72 GLU HA . 36162 1 827 . 1 1 72 72 GLU HB2 H 1 2.0500 . . 2 . . . . A 72 GLU HB2 . 36162 1 828 . 1 1 72 72 GLU HB3 H 1 1.9410 . . 2 . . . . A 72 GLU HB3 . 36162 1 829 . 1 1 72 72 GLU HG2 H 1 2.4480 . . 2 . . . . A 72 GLU HG2 . 36162 1 830 . 1 1 72 72 GLU HG3 H 1 2.0500 . . 2 . . . . A 72 GLU HG3 . 36162 1 831 . 1 1 72 72 GLU C C 13 178.9820 . . 1 . . . . A 72 GLU C . 36162 1 832 . 1 1 72 72 GLU CA C 13 59.2970 . . 1 . . . . A 72 GLU CA . 36162 1 833 . 1 1 72 72 GLU CB C 13 30.2810 . . 1 . . . . A 72 GLU CB . 36162 1 834 . 1 1 72 72 GLU CG C 13 36.4280 . . 1 . . . . A 72 GLU CG . 36162 1 835 . 1 1 72 72 GLU N N 15 117.7800 . . 1 . . . . A 72 GLU N . 36162 1 836 . 1 1 73 73 LEU H H 1 7.6640 . . 1 . . . . A 73 LEU H . 36162 1 837 . 1 1 73 73 LEU HA H 1 3.9440 . . 1 . . . . A 73 LEU HA . 36162 1 838 . 1 1 73 73 LEU HB2 H 1 2.1780 . . 2 . . . . A 73 LEU HB2 . 36162 1 839 . 1 1 73 73 LEU HB3 H 1 1.5740 . . 2 . . . . A 73 LEU HB3 . 36162 1 840 . 1 1 73 73 LEU HG H 1 1.3830 . . 1 . . . . A 73 LEU HG . 36162 1 841 . 1 1 73 73 LEU HD11 H 1 0.8010 . . 1 . . . . A 73 LEU HD11 . 36162 1 842 . 1 1 73 73 LEU HD12 H 1 0.8010 . . 1 . . . . A 73 LEU HD12 . 36162 1 843 . 1 1 73 73 LEU HD13 H 1 0.8010 . . 1 . . . . A 73 LEU HD13 . 36162 1 844 . 1 1 73 73 LEU HD21 H 1 0.9220 . . 1 . . . . A 73 LEU HD21 . 36162 1 845 . 1 1 73 73 LEU HD22 H 1 0.9220 . . 1 . . . . A 73 LEU HD22 . 36162 1 846 . 1 1 73 73 LEU HD23 H 1 0.9220 . . 1 . . . . A 73 LEU HD23 . 36162 1 847 . 1 1 73 73 LEU C C 13 178.1210 . . 1 . . . . A 73 LEU C . 36162 1 848 . 1 1 73 73 LEU CA C 13 58.0860 . . 1 . . . . A 73 LEU CA . 36162 1 849 . 1 1 73 73 LEU CB C 13 41.8890 . . 1 . . . . A 73 LEU CB . 36162 1 850 . 1 1 73 73 LEU CG C 13 26.5310 . . 1 . . . . A 73 LEU CG . 36162 1 851 . 1 1 73 73 LEU CD1 C 13 22.6110 . . 2 . . . . A 73 LEU CD1 . 36162 1 852 . 1 1 73 73 LEU CD2 C 13 26.5310 . . 2 . . . . A 73 LEU CD2 . 36162 1 853 . 1 1 73 73 LEU N N 15 119.1660 . . 1 . . . . A 73 LEU N . 36162 1 854 . 1 1 74 74 GLN H H 1 8.8630 . . 1 . . . . A 74 GLN H . 36162 1 855 . 1 1 74 74 GLN HA H 1 3.9470 . . 1 . . . . A 74 GLN HA . 36162 1 856 . 1 1 74 74 GLN HB2 H 1 2.2620 . . 2 . . . . A 74 GLN HB2 . 36162 1 857 . 1 1 74 74 GLN HB3 H 1 2.0110 . . 2 . . . . A 74 GLN HB3 . 36162 1 858 . 1 1 74 74 GLN HG2 H 1 2.2220 . . 2 . . . . A 74 GLN HG2 . 36162 1 859 . 1 1 74 74 GLN HG3 H 1 2.5740 . . 2 . . . . A 74 GLN HG3 . 36162 1 860 . 1 1 74 74 GLN HE21 H 1 7.3610 . . 2 . . . . A 74 GLN HE21 . 36162 1 861 . 1 1 74 74 GLN HE22 H 1 6.7720 . . 2 . . . . A 74 GLN HE22 . 36162 1 862 . 1 1 74 74 GLN C C 13 178.0790 . . 1 . . . . A 74 GLN C . 36162 1 863 . 1 1 74 74 GLN CA C 13 59.7850 . . 1 . . . . A 74 GLN CA . 36162 1 864 . 1 1 74 74 GLN CB C 13 28.6860 . . 1 . . . . A 74 GLN CB . 36162 1 865 . 1 1 74 74 GLN CG C 13 35.1040 . . 1 . . . . A 74 GLN CG . 36162 1 866 . 1 1 74 74 GLN N N 15 118.3160 . . 1 . . . . A 74 GLN N . 36162 1 867 . 1 1 74 74 GLN NE2 N 15 110.5690 . . 1 . . . . A 74 GLN NE2 . 36162 1 868 . 1 1 75 75 ASP H H 1 8.8680 . . 1 . . . . A 75 ASP H . 36162 1 869 . 1 1 75 75 ASP HA H 1 4.4260 . . 1 . . . . A 75 ASP HA . 36162 1 870 . 1 1 75 75 ASP HB2 H 1 2.8170 . . 2 . . . . A 75 ASP HB2 . 36162 1 871 . 1 1 75 75 ASP HB3 H 1 2.5720 . . 2 . . . . A 75 ASP HB3 . 36162 1 872 . 1 1 75 75 ASP C C 13 178.9920 . . 1 . . . . A 75 ASP C . 36162 1 873 . 1 1 75 75 ASP CA C 13 57.2590 . . 1 . . . . A 75 ASP CA . 36162 1 874 . 1 1 75 75 ASP CB C 13 40.1500 . . 1 . . . . A 75 ASP CB . 36162 1 875 . 1 1 75 75 ASP N N 15 119.6670 . . 1 . . . . A 75 ASP N . 36162 1 876 . 1 1 76 76 ILE H H 1 7.0710 . . 1 . . . . A 76 ILE H . 36162 1 877 . 1 1 76 76 ILE HA H 1 4.0330 . . 1 . . . . A 76 ILE HA . 36162 1 878 . 1 1 76 76 ILE HB H 1 1.9830 . . 1 . . . . A 76 ILE HB . 36162 1 879 . 1 1 76 76 ILE HG13 H 1 1.5340 . . 2 . . . . A 76 ILE HG13 . 36162 1 880 . 1 1 76 76 ILE HG21 H 1 0.7950 . . 1 . . . . A 76 ILE HG21 . 36162 1 881 . 1 1 76 76 ILE HG22 H 1 0.7950 . . 1 . . . . A 76 ILE HG22 . 36162 1 882 . 1 1 76 76 ILE HG23 H 1 0.7950 . . 1 . . . . A 76 ILE HG23 . 36162 1 883 . 1 1 76 76 ILE HD11 H 1 0.8390 . . 1 . . . . A 76 ILE HD11 . 36162 1 884 . 1 1 76 76 ILE HD12 H 1 0.8390 . . 1 . . . . A 76 ILE HD12 . 36162 1 885 . 1 1 76 76 ILE HD13 H 1 0.8390 . . 1 . . . . A 76 ILE HD13 . 36162 1 886 . 1 1 76 76 ILE C C 13 177.1940 . . 1 . . . . A 76 ILE C . 36162 1 887 . 1 1 76 76 ILE CA C 13 61.4730 . . 1 . . . . A 76 ILE CA . 36162 1 888 . 1 1 76 76 ILE CB C 13 38.0730 . . 1 . . . . A 76 ILE CB . 36162 1 889 . 1 1 76 76 ILE CG1 C 13 28.4560 . . 1 . . . . A 76 ILE CG1 . 36162 1 890 . 1 1 76 76 ILE CG2 C 13 17.5040 . . 1 . . . . A 76 ILE CG2 . 36162 1 891 . 1 1 76 76 ILE CD1 C 13 11.7020 . . 1 . . . . A 76 ILE CD1 . 36162 1 892 . 1 1 76 76 ILE N N 15 117.1720 . . 1 . . . . A 76 ILE N . 36162 1 893 . 1 1 77 77 ALA H H 1 8.6140 . . 1 . . . . A 77 ALA H . 36162 1 894 . 1 1 77 77 ALA HA H 1 4.1400 . . 1 . . . . A 77 ALA HA . 36162 1 895 . 1 1 77 77 ALA HB1 H 1 1.4250 . . 1 . . . . A 77 ALA HB1 . 36162 1 896 . 1 1 77 77 ALA HB2 H 1 1.4250 . . 1 . . . . A 77 ALA HB2 . 36162 1 897 . 1 1 77 77 ALA HB3 H 1 1.4250 . . 1 . . . . A 77 ALA HB3 . 36162 1 898 . 1 1 77 77 ALA CA C 13 54.6970 . . 1 . . . . A 77 ALA CA . 36162 1 899 . 1 1 77 77 ALA CB C 13 20.4400 . . 1 . . . . A 77 ALA CB . 36162 1 900 . 1 1 77 77 ALA N N 15 119.5700 . . 1 . . . . A 77 ALA N . 36162 1 901 . 1 1 78 78 ASN H H 1 9.3370 . . 1 . . . . A 78 ASN H . 36162 1 902 . 1 1 78 78 ASN HA H 1 4.5890 . . 1 . . . . A 78 ASN HA . 36162 1 903 . 1 1 78 78 ASN HB2 H 1 2.8230 . . 2 . . . . A 78 ASN HB2 . 36162 1 904 . 1 1 78 78 ASN HB3 H 1 3.1750 . . 2 . . . . A 78 ASN HB3 . 36162 1 905 . 1 1 78 78 ASN HD21 H 1 7.6280 . . 2 . . . . A 78 ASN HD21 . 36162 1 906 . 1 1 78 78 ASN HD22 H 1 6.7450 . . 2 . . . . A 78 ASN HD22 . 36162 1 907 . 1 1 78 78 ASN C C 13 175.6210 . . 1 . . . . A 78 ASN C . 36162 1 908 . 1 1 78 78 ASN CA C 13 58.0470 . . 1 . . . . A 78 ASN CA . 36162 1 909 . 1 1 78 78 ASN CB C 13 35.4240 . . 1 . . . . A 78 ASN CB . 36162 1 910 . 1 1 78 78 ASN N N 15 118.9190 . . 1 . . . . A 78 ASN N . 36162 1 911 . 1 1 78 78 ASN ND2 N 15 110.4120 . . 1 . . . . A 78 ASN ND2 . 36162 1 912 . 1 1 79 79 PRO HA H 1 4.3900 . . 1 . . . . A 79 PRO HA . 36162 1 913 . 1 1 79 79 PRO HB2 H 1 2.3950 . . 2 . . . . A 79 PRO HB2 . 36162 1 914 . 1 1 79 79 PRO HB3 H 1 1.8480 . . 2 . . . . A 79 PRO HB3 . 36162 1 915 . 1 1 79 79 PRO HG2 H 1 2.1110 . . 2 . . . . A 79 PRO HG2 . 36162 1 916 . 1 1 79 79 PRO HG3 H 1 2.0190 . . 2 . . . . A 79 PRO HG3 . 36162 1 917 . 1 1 79 79 PRO HD2 H 1 3.6520 . . 2 . . . . A 79 PRO HD2 . 36162 1 918 . 1 1 79 79 PRO HD3 H 1 3.6010 . . 2 . . . . A 79 PRO HD3 . 36162 1 919 . 1 1 79 79 PRO C C 13 178.7230 . . 1 . . . . A 79 PRO C . 36162 1 920 . 1 1 79 79 PRO CA C 13 65.8470 . . 1 . . . . A 79 PRO CA . 36162 1 921 . 1 1 79 79 PRO CB C 13 31.3120 . . 1 . . . . A 79 PRO CB . 36162 1 922 . 1 1 79 79 PRO CG C 13 28.4050 . . 1 . . . . A 79 PRO CG . 36162 1 923 . 1 1 79 79 PRO CD C 13 50.7920 . . 1 . . . . A 79 PRO CD . 36162 1 924 . 1 1 80 80 ILE H H 1 6.8320 . . 1 . . . . A 80 ILE H . 36162 1 925 . 1 1 80 80 ILE HA H 1 3.6930 . . 1 . . . . A 80 ILE HA . 36162 1 926 . 1 1 80 80 ILE HB H 1 1.7940 . . 1 . . . . A 80 ILE HB . 36162 1 927 . 1 1 80 80 ILE HG12 H 1 1.0940 . . 2 . . . . A 80 ILE HG12 . 36162 1 928 . 1 1 80 80 ILE HG13 H 1 1.6680 . . 2 . . . . A 80 ILE HG13 . 36162 1 929 . 1 1 80 80 ILE HG21 H 1 0.8830 . . 1 . . . . A 80 ILE HG21 . 36162 1 930 . 1 1 80 80 ILE HG22 H 1 0.8830 . . 1 . . . . A 80 ILE HG22 . 36162 1 931 . 1 1 80 80 ILE HG23 H 1 0.8830 . . 1 . . . . A 80 ILE HG23 . 36162 1 932 . 1 1 80 80 ILE HD11 H 1 0.9930 . . 1 . . . . A 80 ILE HD11 . 36162 1 933 . 1 1 80 80 ILE HD12 H 1 0.9930 . . 1 . . . . A 80 ILE HD12 . 36162 1 934 . 1 1 80 80 ILE HD13 H 1 0.9930 . . 1 . . . . A 80 ILE HD13 . 36162 1 935 . 1 1 80 80 ILE C C 13 177.3650 . . 1 . . . . A 80 ILE C . 36162 1 936 . 1 1 80 80 ILE CA C 13 64.5440 . . 1 . . . . A 80 ILE CA . 36162 1 937 . 1 1 80 80 ILE CB C 13 38.5210 . . 1 . . . . A 80 ILE CB . 36162 1 938 . 1 1 80 80 ILE CG1 C 13 30.2700 . . 1 . . . . A 80 ILE CG1 . 36162 1 939 . 1 1 80 80 ILE CG2 C 13 19.2470 . . 1 . . . . A 80 ILE CG2 . 36162 1 940 . 1 1 80 80 ILE CD1 C 13 13.6500 . . 1 . . . . A 80 ILE CD1 . 36162 1 941 . 1 1 80 80 ILE N N 15 117.9820 . . 1 . . . . A 80 ILE N . 36162 1 942 . 1 1 81 81 MET H H 1 8.6740 . . 1 . . . . A 81 MET H . 36162 1 943 . 1 1 81 81 MET HA H 1 4.2990 . . 1 . . . . A 81 MET HA . 36162 1 944 . 1 1 81 81 MET HB2 H 1 2.1250 . . 2 . . . . A 81 MET HB2 . 36162 1 945 . 1 1 81 81 MET HB3 H 1 2.0050 . . 2 . . . . A 81 MET HB3 . 36162 1 946 . 1 1 81 81 MET HG2 H 1 2.7580 . . 2 . . . . A 81 MET HG2 . 36162 1 947 . 1 1 81 81 MET HG3 H 1 2.5830 . . 2 . . . . A 81 MET HG3 . 36162 1 948 . 1 1 81 81 MET HE1 H 1 1.9730 . . 1 . . . . A 81 MET HE1 . 36162 1 949 . 1 1 81 81 MET HE2 H 1 1.9730 . . 1 . . . . A 81 MET HE2 . 36162 1 950 . 1 1 81 81 MET HE3 H 1 1.9730 . . 1 . . . . A 81 MET HE3 . 36162 1 951 . 1 1 81 81 MET C C 13 179.3900 . . 1 . . . . A 81 MET C . 36162 1 952 . 1 1 81 81 MET CA C 13 56.4260 . . 1 . . . . A 81 MET CA . 36162 1 953 . 1 1 81 81 MET CB C 13 29.9410 . . 1 . . . . A 81 MET CB . 36162 1 954 . 1 1 81 81 MET CG C 13 32.3900 . . 1 . . . . A 81 MET CG . 36162 1 955 . 1 1 81 81 MET CE C 13 17.3460 . . 1 . . . . A 81 MET CE . 36162 1 956 . 1 1 81 81 MET N N 15 118.2440 . . 1 . . . . A 81 MET N . 36162 1 957 . 1 1 82 82 SER H H 1 8.1330 . . 1 . . . . A 82 SER H . 36162 1 958 . 1 1 82 82 SER HA H 1 4.2140 . . 1 . . . . A 82 SER HA . 36162 1 959 . 1 1 82 82 SER HB2 H 1 3.9340 . . 2 . . . . A 82 SER HB2 . 36162 1 960 . 1 1 82 82 SER CA C 13 61.7770 . . 1 . . . . A 82 SER CA . 36162 1 961 . 1 1 82 82 SER CB C 13 62.8870 . . 1 . . . . A 82 SER CB . 36162 1 962 . 1 1 82 82 SER N N 15 113.4660 . . 1 . . . . A 82 SER N . 36162 1 963 . 1 1 83 83 LYS H H 1 7.3690 . . 1 . . . . A 83 LYS H . 36162 1 964 . 1 1 83 83 LYS HA H 1 4.0820 . . 1 . . . . A 83 LYS HA . 36162 1 965 . 1 1 83 83 LYS HB2 H 1 2.0340 . . 2 . . . . A 83 LYS HB2 . 36162 1 966 . 1 1 83 83 LYS HB3 H 1 1.9370 . . 2 . . . . A 83 LYS HB3 . 36162 1 967 . 1 1 83 83 LYS HG2 H 1 1.7310 . . 2 . . . . A 83 LYS HG2 . 36162 1 968 . 1 1 83 83 LYS HD2 H 1 1.7220 . . 2 . . . . A 83 LYS HD2 . 36162 1 969 . 1 1 83 83 LYS HE2 H 1 2.9530 . . 2 . . . . A 83 LYS HE2 . 36162 1 970 . 1 1 83 83 LYS C C 13 178.7020 . . 1 . . . . A 83 LYS C . 36162 1 971 . 1 1 83 83 LYS CA C 13 59.1820 . . 1 . . . . A 83 LYS CA . 36162 1 972 . 1 1 83 83 LYS CB C 13 32.4240 . . 1 . . . . A 83 LYS CB . 36162 1 973 . 1 1 83 83 LYS CG C 13 25.2920 . . 1 . . . . A 83 LYS CG . 36162 1 974 . 1 1 83 83 LYS CD C 13 30.1090 . . 1 . . . . A 83 LYS CD . 36162 1 975 . 1 1 83 83 LYS CE C 13 42.0400 . . 1 . . . . A 83 LYS CE . 36162 1 976 . 1 1 83 83 LYS N N 15 120.6720 . . 1 . . . . A 83 LYS N . 36162 1 977 . 1 1 84 84 LEU H H 1 7.6740 . . 1 . . . . A 84 LEU H . 36162 1 978 . 1 1 84 84 LEU HA H 1 4.0290 . . 1 . . . . A 84 LEU HA . 36162 1 979 . 1 1 84 84 LEU HB2 H 1 1.7400 . . 2 . . . . A 84 LEU HB2 . 36162 1 980 . 1 1 84 84 LEU HB3 H 1 1.4630 . . 2 . . . . A 84 LEU HB3 . 36162 1 981 . 1 1 84 84 LEU HG H 1 1.4230 . . 1 . . . . A 84 LEU HG . 36162 1 982 . 1 1 84 84 LEU HD11 H 1 0.8610 . . 1 . . . . A 84 LEU HD11 . 36162 1 983 . 1 1 84 84 LEU HD12 H 1 0.8610 . . 1 . . . . A 84 LEU HD12 . 36162 1 984 . 1 1 84 84 LEU HD13 H 1 0.8610 . . 1 . . . . A 84 LEU HD13 . 36162 1 985 . 1 1 84 84 LEU HD21 H 1 0.7440 . . 1 . . . . A 84 LEU HD21 . 36162 1 986 . 1 1 84 84 LEU HD22 H 1 0.7440 . . 1 . . . . A 84 LEU HD22 . 36162 1 987 . 1 1 84 84 LEU HD23 H 1 0.7440 . . 1 . . . . A 84 LEU HD23 . 36162 1 988 . 1 1 84 84 LEU C C 13 178.2480 . . 1 . . . . A 84 LEU C . 36162 1 989 . 1 1 84 84 LEU CA C 13 57.0770 . . 1 . . . . A 84 LEU CA . 36162 1 990 . 1 1 84 84 LEU CB C 13 41.8200 . . 1 . . . . A 84 LEU CB . 36162 1 991 . 1 1 84 84 LEU CG C 13 27.0540 . . 1 . . . . A 84 LEU CG . 36162 1 992 . 1 1 84 84 LEU CD1 C 13 24.8010 . . 2 . . . . A 84 LEU CD1 . 36162 1 993 . 1 1 84 84 LEU CD2 C 13 25.1710 . . 2 . . . . A 84 LEU CD2 . 36162 1 994 . 1 1 84 84 LEU N N 15 119.8410 . . 1 . . . . A 84 LEU N . 36162 1 995 . 1 1 85 85 TYR H H 1 7.9330 . . 1 . . . . A 85 TYR H . 36162 1 996 . 1 1 85 85 TYR HA H 1 4.5770 . . 1 . . . . A 85 TYR HA . 36162 1 997 . 1 1 85 85 TYR HB2 H 1 3.2340 . . 2 . . . . A 85 TYR HB2 . 36162 1 998 . 1 1 85 85 TYR HB3 H 1 2.9800 . . 2 . . . . A 85 TYR HB3 . 36162 1 999 . 1 1 85 85 TYR HD1 H 1 7.1010 . . 3 . . . . A 85 TYR HD1 . 36162 1 1000 . 1 1 85 85 TYR HE1 H 1 6.7710 . . 3 . . . . A 85 TYR HE1 . 36162 1 1001 . 1 1 85 85 TYR C C 13 177.5670 . . 1 . . . . A 85 TYR C . 36162 1 1002 . 1 1 85 85 TYR CA C 13 58.3440 . . 1 . . . . A 85 TYR CA . 36162 1 1003 . 1 1 85 85 TYR CB C 13 37.8170 . . 1 . . . . A 85 TYR CB . 36162 1 1004 . 1 1 85 85 TYR CD1 C 13 132.9310 . . 1 . . . . A 85 TYR CD1 . 36162 1 1005 . 1 1 85 85 TYR CE1 C 13 118.0260 . . 1 . . . . A 85 TYR CE1 . 36162 1 1006 . 1 1 85 85 TYR N N 15 118.3960 . . 1 . . . . A 85 TYR N . 36162 1 1007 . 1 1 86 86 GLN H H 1 8.0170 . . 1 . . . . A 86 GLN H . 36162 1 1008 . 1 1 86 86 GLN HA H 1 4.2450 . . 1 . . . . A 86 GLN HA . 36162 1 1009 . 1 1 86 86 GLN HB2 H 1 2.1670 . . 2 . . . . A 86 GLN HB2 . 36162 1 1010 . 1 1 86 86 GLN HB3 H 1 2.0950 . . 2 . . . . A 86 GLN HB3 . 36162 1 1011 . 1 1 86 86 GLN HG2 H 1 2.4540 . . 2 . . . . A 86 GLN HG2 . 36162 1 1012 . 1 1 86 86 GLN HE21 H 1 7.4700 . . 2 . . . . A 86 GLN HE21 . 36162 1 1013 . 1 1 86 86 GLN HE22 H 1 6.8520 . . 2 . . . . A 86 GLN HE22 . 36162 1 1014 . 1 1 86 86 GLN C C 13 176.3110 . . 1 . . . . A 86 GLN C . 36162 1 1015 . 1 1 86 86 GLN CA C 13 56.9630 . . 1 . . . . A 86 GLN CA . 36162 1 1016 . 1 1 86 86 GLN CB C 13 28.9970 . . 1 . . . . A 86 GLN CB . 36162 1 1017 . 1 1 86 86 GLN CG C 13 33.9820 . . 1 . . . . A 86 GLN CG . 36162 1 1018 . 1 1 86 86 GLN N N 15 120.2330 . . 1 . . . . A 86 GLN N . 36162 1 1019 . 1 1 86 86 GLN NE2 N 15 112.1190 . . 1 . . . . A 86 GLN NE2 . 36162 1 1020 . 1 1 87 87 ALA H H 1 8.0260 . . 1 . . . . A 87 ALA H . 36162 1 1021 . 1 1 87 87 ALA HA H 1 4.3740 . . 1 . . . . A 87 ALA HA . 36162 1 1022 . 1 1 87 87 ALA HB1 H 1 1.5130 . . 1 . . . . A 87 ALA HB1 . 36162 1 1023 . 1 1 87 87 ALA HB2 H 1 1.5130 . . 1 . . . . A 87 ALA HB2 . 36162 1 1024 . 1 1 87 87 ALA HB3 H 1 1.5130 . . 1 . . . . A 87 ALA HB3 . 36162 1 1025 . 1 1 87 87 ALA C C 13 178.1100 . . 1 . . . . A 87 ALA C . 36162 1 1026 . 1 1 87 87 ALA CA C 13 52.8830 . . 1 . . . . A 87 ALA CA . 36162 1 1027 . 1 1 87 87 ALA CB C 13 19.0270 . . 1 . . . . A 87 ALA CB . 36162 1 1028 . 1 1 87 87 ALA N N 15 123.5260 . . 1 . . . . A 87 ALA N . 36162 1 1029 . 1 1 88 88 GLY H H 1 8.1730 . . 1 . . . . A 88 GLY H . 36162 1 1030 . 1 1 88 88 GLY HA2 H 1 4.0500 . . 2 . . . . A 88 GLY HA2 . 36162 1 1031 . 1 1 88 88 GLY C C 13 174.7520 . . 1 . . . . A 88 GLY C . 36162 1 1032 . 1 1 88 88 GLY CA C 13 45.4580 . . 1 . . . . A 88 GLY CA . 36162 1 1033 . 1 1 88 88 GLY N N 15 107.4640 . . 1 . . . . A 88 GLY N . 36162 1 1034 . 1 1 89 89 GLY H H 1 8.1960 . . 1 . . . . A 89 GLY H . 36162 1 1035 . 1 1 89 89 GLY HA2 H 1 3.9770 . . 2 . . . . A 89 GLY HA2 . 36162 1 1036 . 1 1 89 89 GLY HA3 H 1 3.8720 . . 2 . . . . A 89 GLY HA3 . 36162 1 1037 . 1 1 89 89 GLY C C 13 173.1340 . . 1 . . . . A 89 GLY C . 36162 1 1038 . 1 1 89 89 GLY CA C 13 44.8600 . . 1 . . . . A 89 GLY CA . 36162 1 1039 . 1 1 89 89 GLY N N 15 108.2030 . . 1 . . . . A 89 GLY N . 36162 1 1040 . 1 1 90 90 ALA H H 1 8.2210 . . 1 . . . . A 90 ALA H . 36162 1 1041 . 1 1 90 90 ALA HA H 1 4.6080 . . 1 . . . . A 90 ALA HA . 36162 1 1042 . 1 1 90 90 ALA HB1 H 1 1.3310 . . 1 . . . . A 90 ALA HB1 . 36162 1 1043 . 1 1 90 90 ALA HB2 H 1 1.3310 . . 1 . . . . A 90 ALA HB2 . 36162 1 1044 . 1 1 90 90 ALA HB3 H 1 1.3310 . . 1 . . . . A 90 ALA HB3 . 36162 1 1045 . 1 1 90 90 ALA C C 13 175.6680 . . 1 . . . . A 90 ALA C . 36162 1 1046 . 1 1 90 90 ALA CA C 13 50.5600 . . 1 . . . . A 90 ALA CA . 36162 1 1047 . 1 1 90 90 ALA CB C 13 18.3900 . . 1 . . . . A 90 ALA CB . 36162 1 1048 . 1 1 90 90 ALA N N 15 124.4340 . . 1 . . . . A 90 ALA N . 36162 1 1049 . 1 1 91 91 PRO HA H 1 4.4190 . . 1 . . . . A 91 PRO HA . 36162 1 1050 . 1 1 91 91 PRO HB2 H 1 2.2860 . . 2 . . . . A 91 PRO HB2 . 36162 1 1051 . 1 1 91 91 PRO HB3 H 1 1.9560 . . 2 . . . . A 91 PRO HB3 . 36162 1 1052 . 1 1 91 91 PRO HG2 H 1 2.0350 . . 2 . . . . A 91 PRO HG2 . 36162 1 1053 . 1 1 91 91 PRO HD2 H 1 3.6370 . . 2 . . . . A 91 PRO HD2 . 36162 1 1054 . 1 1 91 91 PRO HD3 H 1 3.7800 . . 2 . . . . A 91 PRO HD3 . 36162 1 1055 . 1 1 91 91 PRO C C 13 177.6850 . . 1 . . . . A 91 PRO C . 36162 1 1056 . 1 1 91 91 PRO CA C 13 63.5370 . . 1 . . . . A 91 PRO CA . 36162 1 1057 . 1 1 91 91 PRO CB C 13 31.9610 . . 1 . . . . A 91 PRO CB . 36162 1 1058 . 1 1 91 91 PRO CG C 13 27.4110 . . 1 . . . . A 91 PRO CG . 36162 1 1059 . 1 1 91 91 PRO CD C 13 50.6020 . . 1 . . . . A 91 PRO CD . 36162 1 1060 . 1 1 92 92 GLY H H 1 8.4790 . . 1 . . . . A 92 GLY H . 36162 1 1061 . 1 1 92 92 GLY HA2 H 1 3.9480 . . 2 . . . . A 92 GLY HA2 . 36162 1 1062 . 1 1 92 92 GLY C C 13 174.7800 . . 1 . . . . A 92 GLY C . 36162 1 1063 . 1 1 92 92 GLY CA C 13 45.3320 . . 1 . . . . A 92 GLY CA . 36162 1 1064 . 1 1 92 92 GLY N N 15 109.8700 . . 1 . . . . A 92 GLY N . 36162 1 1065 . 1 1 93 93 GLY H H 1 8.2360 . . 1 . . . . A 93 GLY H . 36162 1 1066 . 1 1 93 93 GLY HA2 H 1 3.9480 . . 2 . . . . A 93 GLY HA2 . 36162 1 1067 . 1 1 93 93 GLY C C 13 174.0400 . . 1 . . . . A 93 GLY C . 36162 1 1068 . 1 1 93 93 GLY CA C 13 45.4140 . . 1 . . . . A 93 GLY CA . 36162 1 1069 . 1 1 93 93 GLY N N 15 108.8640 . . 1 . . . . A 93 GLY N . 36162 1 1070 . 1 1 94 94 ALA H H 1 8.2320 . . 1 . . . . A 94 ALA H . 36162 1 1071 . 1 1 94 94 ALA HA H 1 4.3090 . . 1 . . . . A 94 ALA HA . 36162 1 1072 . 1 1 94 94 ALA HB1 H 1 1.3680 . . 1 . . . . A 94 ALA HB1 . 36162 1 1073 . 1 1 94 94 ALA HB2 H 1 1.3680 . . 1 . . . . A 94 ALA HB2 . 36162 1 1074 . 1 1 94 94 ALA HB3 H 1 1.3680 . . 1 . . . . A 94 ALA HB3 . 36162 1 1075 . 1 1 94 94 ALA C C 13 177.7230 . . 1 . . . . A 94 ALA C . 36162 1 1076 . 1 1 94 94 ALA CA C 13 52.5860 . . 1 . . . . A 94 ALA CA . 36162 1 1077 . 1 1 94 94 ALA CB C 13 19.2580 . . 1 . . . . A 94 ALA CB . 36162 1 1078 . 1 1 94 94 ALA N N 15 124.1610 . . 1 . . . . A 94 ALA N . 36162 1 1079 . 1 1 95 95 ALA H H 1 8.3340 . . 1 . . . . A 95 ALA H . 36162 1 1080 . 1 1 95 95 ALA HA H 1 4.3170 . . 1 . . . . A 95 ALA HA . 36162 1 1081 . 1 1 95 95 ALA HB1 H 1 1.3940 . . 1 . . . . A 95 ALA HB1 . 36162 1 1082 . 1 1 95 95 ALA HB2 H 1 1.3940 . . 1 . . . . A 95 ALA HB2 . 36162 1 1083 . 1 1 95 95 ALA HB3 H 1 1.3940 . . 1 . . . . A 95 ALA HB3 . 36162 1 1084 . 1 1 95 95 ALA C C 13 178.3040 . . 1 . . . . A 95 ALA C . 36162 1 1085 . 1 1 95 95 ALA CA C 13 52.6570 . . 1 . . . . A 95 ALA CA . 36162 1 1086 . 1 1 95 95 ALA CB C 13 19.1430 . . 1 . . . . A 95 ALA CB . 36162 1 1087 . 1 1 95 95 ALA N N 15 123.5250 . . 1 . . . . A 95 ALA N . 36162 1 1088 . 1 1 96 96 GLY H H 1 8.3000 . . 1 . . . . A 96 GLY H . 36162 1 1089 . 1 1 96 96 GLY HA2 H 1 3.9490 . . 2 . . . . A 96 GLY HA2 . 36162 1 1090 . 1 1 96 96 GLY C C 13 174.6640 . . 1 . . . . A 96 GLY C . 36162 1 1091 . 1 1 96 96 GLY CA C 13 45.3970 . . 1 . . . . A 96 GLY CA . 36162 1 1092 . 1 1 96 96 GLY N N 15 108.2700 . . 1 . . . . A 96 GLY N . 36162 1 1093 . 1 1 97 97 GLY H H 1 8.1670 . . 1 . . . . A 97 GLY H . 36162 1 1094 . 1 1 97 97 GLY HA2 H 1 3.9360 . . 2 . . . . A 97 GLY HA2 . 36162 1 1095 . 1 1 97 97 GLY C C 13 173.4120 . . 1 . . . . A 97 GLY C . 36162 1 1096 . 1 1 97 97 GLY CA C 13 45.0480 . . 1 . . . . A 97 GLY CA . 36162 1 1097 . 1 1 97 97 GLY N N 15 108.6540 . . 1 . . . . A 97 GLY N . 36162 1 1098 . 1 1 98 98 ALA H H 1 8.1850 . . 1 . . . . A 98 ALA H . 36162 1 1099 . 1 1 98 98 ALA HA H 1 4.5280 . . 1 . . . . A 98 ALA HA . 36162 1 1100 . 1 1 98 98 ALA HB1 H 1 1.3070 . . 1 . . . . A 98 ALA HB1 . 36162 1 1101 . 1 1 98 98 ALA HB2 H 1 1.3070 . . 1 . . . . A 98 ALA HB2 . 36162 1 1102 . 1 1 98 98 ALA HB3 H 1 1.3070 . . 1 . . . . A 98 ALA HB3 . 36162 1 1103 . 1 1 98 98 ALA C C 13 175.8400 . . 1 . . . . A 98 ALA C . 36162 1 1104 . 1 1 98 98 ALA CA C 13 50.4820 . . 1 . . . . A 98 ALA CA . 36162 1 1105 . 1 1 98 98 ALA CB C 13 18.2840 . . 1 . . . . A 98 ALA CB . 36162 1 1106 . 1 1 98 98 ALA N N 15 125.0450 . . 1 . . . . A 98 ALA N . 36162 1 1107 . 1 1 99 99 PRO HA H 1 4.6020 . . 1 . . . . A 99 PRO HA . 36162 1 1108 . 1 1 99 99 PRO HB2 H 1 2.3080 . . 2 . . . . A 99 PRO HB2 . 36162 1 1109 . 1 1 99 99 PRO HB3 H 1 2.2290 . . 2 . . . . A 99 PRO HB3 . 36162 1 1110 . 1 1 99 99 PRO HG2 H 1 1.8620 . . 2 . . . . A 99 PRO HG2 . 36162 1 1111 . 1 1 99 99 PRO HG3 H 1 1.9640 . . 2 . . . . A 99 PRO HG3 . 36162 1 1112 . 1 1 99 99 PRO HD2 H 1 3.4840 . . 2 . . . . A 99 PRO HD2 . 36162 1 1113 . 1 1 99 99 PRO HD3 H 1 3.6270 . . 2 . . . . A 99 PRO HD3 . 36162 1 1114 . 1 1 99 99 PRO C C 13 176.9310 . . 1 . . . . A 99 PRO C . 36162 1 1115 . 1 1 99 99 PRO CA C 13 63.3560 . . 1 . . . . A 99 PRO CA . 36162 1 1116 . 1 1 99 99 PRO CB C 13 34.2640 . . 1 . . . . A 99 PRO CB . 36162 1 1117 . 1 1 99 99 PRO CG C 13 24.4100 . . 1 . . . . A 99 PRO CG . 36162 1 1118 . 1 1 99 99 PRO CD C 13 50.2380 . . 1 . . . . A 99 PRO CD . 36162 1 1119 . 1 1 100 100 GLY H H 1 8.5170 . . 1 . . . . A 100 GLY H . 36162 1 1120 . 1 1 100 100 GLY HA2 H 1 3.9470 . . 2 . . . . A 100 GLY HA2 . 36162 1 1121 . 1 1 100 100 GLY C C 13 173.4100 . . 1 . . . . A 100 GLY C . 36162 1 1122 . 1 1 100 100 GLY CA C 13 45.4590 . . 1 . . . . A 100 GLY CA . 36162 1 1123 . 1 1 100 100 GLY N N 15 111.7830 . . 1 . . . . A 100 GLY N . 36162 1 1124 . 1 1 101 101 GLY H H 1 7.9150 . . 1 . . . . A 101 GLY H . 36162 1 1125 . 1 1 101 101 GLY HA2 H 1 3.7690 . . 2 . . . . A 101 GLY HA2 . 36162 1 1126 . 1 1 101 101 GLY C C 13 179.1300 . . 1 . . . . A 101 GLY C . 36162 1 1127 . 1 1 101 101 GLY CA C 13 46.0170 . . 1 . . . . A 101 GLY CA . 36162 1 1128 . 1 1 101 101 GLY N N 15 115.3570 . . 1 . . . . A 101 GLY N . 36162 1 stop_ save_