data_36332 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 36332 _Entry.Title ; Solution NMR structure of NF4; de novo designed protein with a novel fold ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2020-03-24 _Entry.Accession_date 2020-05-07 _Entry.Last_release_date 2020-05-07 _Entry.Original_release_date 2020-05-07 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.2.0.16 _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' 36332 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 N. Kobayashi N. . . . 36332 2 T. Nagashima T. . . . 36332 3 S. Minami S. . . . 36332 4 R. Koga R. . . . 36332 5 T. Chikenji T. . . . 36332 6 N. Koga N. . . . 36332 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'DE NOVO PROTEIN' . 36332 'de novo designed protein' . 36332 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 36332 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 540 36332 '15N chemical shifts' 123 36332 '1H chemical shifts' 835 36332 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2023-12-18 2020-03-24 update BMRB 'update entry citation' 36332 1 . . 2021-03-29 2020-03-24 original author 'original release' 36332 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 36327 'Solution NMR structure of NF1; de novo designed protein with a novel fold' 36332 BMRB 36328 'Solution NMR structure of NF2; de novo designed protein with a novel fold' 36332 BMRB 36329 'Solution NMR structure of NF7; de novo designed protein with a novel fold' 36332 BMRB 36330 'Solution NMR structure of NF5; de novo designed protein with a novel fold' 36332 BMRB 36331 'Solution NMR structure of NF6; de novo designed protein with a novel fold' 36332 BMRB 36333 'Solution NMR structure of NF8 (knot fold); de novo designed protein with a novel fold' 36332 BMRB 36334 'Solution NMR structure of NF3; de novo designed protein with a novel fold' 36332 PDB 7BQC . 36332 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 36332 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 37400653 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Exploration of novel alpha-beta protein folds through de novo design ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Struct. Mol. Biol.' _Citation.Journal_name_full 'Nature structural & molecular biology' _Citation.Journal_volume 30 _Citation.Journal_issue 8 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1545-9985 _Citation.Journal_CSD 0353 _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 1132 _Citation.Page_last 1140 _Citation.Year 2023 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 S. Minami S. . . . 36332 1 2 N. Kobayashi N. . . . 36332 1 3 T. Sugiki T. . . . 36332 1 4 T. Nagashima T. . . . 36332 1 5 T. Fujiwara T. . . . 36332 1 6 R. Koga R. . . . 36332 1 7 G. Chikenji G. . . . 36332 1 8 N. Koga N. . . . 36332 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 36332 _Assembly.ID 1 _Assembly.Name NF4 _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 . . . . . . 36332 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 36332 _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 ; GSEEIRELVRKIYETVRKEN PNVKILIFIIFTSDGTIKVI IVIIADDPNDAKRIVKKIQE RFPKLTIKQSRNEEEAEKRI QKELEERNPNAEIQVVRSED ELKEILDKLDEKKGSWSLEH HHHHH ; _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 125 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _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 14838.945 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 GLY . 36332 1 2 2 SER . 36332 1 3 3 GLU . 36332 1 4 4 GLU . 36332 1 5 5 ILE . 36332 1 6 6 ARG . 36332 1 7 7 GLU . 36332 1 8 8 LEU . 36332 1 9 9 VAL . 36332 1 10 10 ARG . 36332 1 11 11 LYS . 36332 1 12 12 ILE . 36332 1 13 13 TYR . 36332 1 14 14 GLU . 36332 1 15 15 THR . 36332 1 16 16 VAL . 36332 1 17 17 ARG . 36332 1 18 18 LYS . 36332 1 19 19 GLU . 36332 1 20 20 ASN . 36332 1 21 21 PRO . 36332 1 22 22 ASN . 36332 1 23 23 VAL . 36332 1 24 24 LYS . 36332 1 25 25 ILE . 36332 1 26 26 LEU . 36332 1 27 27 ILE . 36332 1 28 28 PHE . 36332 1 29 29 ILE . 36332 1 30 30 ILE . 36332 1 31 31 PHE . 36332 1 32 32 THR . 36332 1 33 33 SER . 36332 1 34 34 ASP . 36332 1 35 35 GLY . 36332 1 36 36 THR . 36332 1 37 37 ILE . 36332 1 38 38 LYS . 36332 1 39 39 VAL . 36332 1 40 40 ILE . 36332 1 41 41 ILE . 36332 1 42 42 VAL . 36332 1 43 43 ILE . 36332 1 44 44 ILE . 36332 1 45 45 ALA . 36332 1 46 46 ASP . 36332 1 47 47 ASP . 36332 1 48 48 PRO . 36332 1 49 49 ASN . 36332 1 50 50 ASP . 36332 1 51 51 ALA . 36332 1 52 52 LYS . 36332 1 53 53 ARG . 36332 1 54 54 ILE . 36332 1 55 55 VAL . 36332 1 56 56 LYS . 36332 1 57 57 LYS . 36332 1 58 58 ILE . 36332 1 59 59 GLN . 36332 1 60 60 GLU . 36332 1 61 61 ARG . 36332 1 62 62 PHE . 36332 1 63 63 PRO . 36332 1 64 64 LYS . 36332 1 65 65 LEU . 36332 1 66 66 THR . 36332 1 67 67 ILE . 36332 1 68 68 LYS . 36332 1 69 69 GLN . 36332 1 70 70 SER . 36332 1 71 71 ARG . 36332 1 72 72 ASN . 36332 1 73 73 GLU . 36332 1 74 74 GLU . 36332 1 75 75 GLU . 36332 1 76 76 ALA . 36332 1 77 77 GLU . 36332 1 78 78 LYS . 36332 1 79 79 ARG . 36332 1 80 80 ILE . 36332 1 81 81 GLN . 36332 1 82 82 LYS . 36332 1 83 83 GLU . 36332 1 84 84 LEU . 36332 1 85 85 GLU . 36332 1 86 86 GLU . 36332 1 87 87 ARG . 36332 1 88 88 ASN . 36332 1 89 89 PRO . 36332 1 90 90 ASN . 36332 1 91 91 ALA . 36332 1 92 92 GLU . 36332 1 93 93 ILE . 36332 1 94 94 GLN . 36332 1 95 95 VAL . 36332 1 96 96 VAL . 36332 1 97 97 ARG . 36332 1 98 98 SER . 36332 1 99 99 GLU . 36332 1 100 100 ASP . 36332 1 101 101 GLU . 36332 1 102 102 LEU . 36332 1 103 103 LYS . 36332 1 104 104 GLU . 36332 1 105 105 ILE . 36332 1 106 106 LEU . 36332 1 107 107 ASP . 36332 1 108 108 LYS . 36332 1 109 109 LEU . 36332 1 110 110 ASP . 36332 1 111 111 GLU . 36332 1 112 112 LYS . 36332 1 113 113 LYS . 36332 1 114 114 GLY . 36332 1 115 115 SER . 36332 1 116 116 TRP . 36332 1 117 117 SER . 36332 1 118 118 LEU . 36332 1 119 119 GLU . 36332 1 120 120 HIS . 36332 1 121 121 HIS . 36332 1 122 122 HIS . 36332 1 123 123 HIS . 36332 1 124 124 HIS . 36332 1 125 125 HIS . 36332 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 36332 1 . SER 2 2 36332 1 . GLU 3 3 36332 1 . GLU 4 4 36332 1 . ILE 5 5 36332 1 . ARG 6 6 36332 1 . GLU 7 7 36332 1 . LEU 8 8 36332 1 . VAL 9 9 36332 1 . ARG 10 10 36332 1 . LYS 11 11 36332 1 . ILE 12 12 36332 1 . TYR 13 13 36332 1 . GLU 14 14 36332 1 . THR 15 15 36332 1 . VAL 16 16 36332 1 . ARG 17 17 36332 1 . LYS 18 18 36332 1 . GLU 19 19 36332 1 . ASN 20 20 36332 1 . PRO 21 21 36332 1 . ASN 22 22 36332 1 . VAL 23 23 36332 1 . LYS 24 24 36332 1 . ILE 25 25 36332 1 . LEU 26 26 36332 1 . ILE 27 27 36332 1 . PHE 28 28 36332 1 . ILE 29 29 36332 1 . ILE 30 30 36332 1 . PHE 31 31 36332 1 . THR 32 32 36332 1 . SER 33 33 36332 1 . ASP 34 34 36332 1 . GLY 35 35 36332 1 . THR 36 36 36332 1 . ILE 37 37 36332 1 . LYS 38 38 36332 1 . VAL 39 39 36332 1 . ILE 40 40 36332 1 . ILE 41 41 36332 1 . VAL 42 42 36332 1 . ILE 43 43 36332 1 . ILE 44 44 36332 1 . ALA 45 45 36332 1 . ASP 46 46 36332 1 . ASP 47 47 36332 1 . PRO 48 48 36332 1 . ASN 49 49 36332 1 . ASP 50 50 36332 1 . ALA 51 51 36332 1 . LYS 52 52 36332 1 . ARG 53 53 36332 1 . ILE 54 54 36332 1 . VAL 55 55 36332 1 . LYS 56 56 36332 1 . LYS 57 57 36332 1 . ILE 58 58 36332 1 . GLN 59 59 36332 1 . GLU 60 60 36332 1 . ARG 61 61 36332 1 . PHE 62 62 36332 1 . PRO 63 63 36332 1 . LYS 64 64 36332 1 . LEU 65 65 36332 1 . THR 66 66 36332 1 . ILE 67 67 36332 1 . LYS 68 68 36332 1 . GLN 69 69 36332 1 . SER 70 70 36332 1 . ARG 71 71 36332 1 . ASN 72 72 36332 1 . GLU 73 73 36332 1 . GLU 74 74 36332 1 . GLU 75 75 36332 1 . ALA 76 76 36332 1 . GLU 77 77 36332 1 . LYS 78 78 36332 1 . ARG 79 79 36332 1 . ILE 80 80 36332 1 . GLN 81 81 36332 1 . LYS 82 82 36332 1 . GLU 83 83 36332 1 . LEU 84 84 36332 1 . GLU 85 85 36332 1 . GLU 86 86 36332 1 . ARG 87 87 36332 1 . ASN 88 88 36332 1 . PRO 89 89 36332 1 . ASN 90 90 36332 1 . ALA 91 91 36332 1 . GLU 92 92 36332 1 . ILE 93 93 36332 1 . GLN 94 94 36332 1 . VAL 95 95 36332 1 . VAL 96 96 36332 1 . ARG 97 97 36332 1 . SER 98 98 36332 1 . GLU 99 99 36332 1 . ASP 100 100 36332 1 . GLU 101 101 36332 1 . LEU 102 102 36332 1 . LYS 103 103 36332 1 . GLU 104 104 36332 1 . ILE 105 105 36332 1 . LEU 106 106 36332 1 . ASP 107 107 36332 1 . LYS 108 108 36332 1 . LEU 109 109 36332 1 . ASP 110 110 36332 1 . GLU 111 111 36332 1 . LYS 112 112 36332 1 . LYS 113 113 36332 1 . GLY 114 114 36332 1 . SER 115 115 36332 1 . TRP 116 116 36332 1 . SER 117 117 36332 1 . LEU 118 118 36332 1 . GLU 119 119 36332 1 . HIS 120 120 36332 1 . HIS 121 121 36332 1 . HIS 122 122 36332 1 . HIS 123 123 36332 1 . HIS 124 124 36332 1 . HIS 125 125 36332 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 36332 _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 . 32630 . . 'synthetic construct' . . . . . synthetic construct . . . . . . . . . . . . . 36332 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 36332 _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 . . . . . . . . . . 36332 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 36332 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 0.45 mM [U-100% 13C; U-100% 15N] NF4, 5.6 mM sodium phosphate, 1.1 mM potassium phosphate, 137 mM sodium chloride, 95% H2O/5% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 NF4 '[U-100% 13C; U-100% 15N]' 1 $assembly 1 $entity_1 . protein 0.45 . . mM . . . . 36332 1 2 'potassium phosphate' 'natural abundance' . . . . . . 1.1 . . mM . . . . 36332 1 3 'sodium chloride' 'natural abundance' . . . . . salt 137 . . mM . . . . 36332 1 4 'sodium phosphate' 'natural abundance' . . . . . buffer 5.6 . . mM . . . . 36332 1 5 H2O 'natural abundance' . . . . . solvent 95 . . % . . . . 36332 1 6 D2O [U-2H] . . . . . solvent 5 . . % . . . . 36332 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 36332 _Sample.ID 2 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 0.2 mM [U-100% 13C; U-100% 15N] NF4, 5.6 mM sodium phosphate, 1.1 mM potassium phosphate, 137 mM sodium chloride, 10 mg/mL Pf1 phage, 95% H2O/5% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 NF4 '[U-100% 13C; U-100% 15N]' 1 $assembly 1 $entity_1 . protein 0.2 . . mM . . . . 36332 2 2 'Pf1 phage' 'natural abundance' . . . . . . 10 . . mg/mL . . . . 36332 2 3 'potassium phosphate' 'natural abundance' . . . . . . 1.1 . . mM . . . . 36332 2 4 'sodium chloride' 'natural abundance' . . . . . salt 137 . . mM . . . . 36332 2 5 'sodium phosphate' 'natural abundance' . . . . . buffer 5.6 . . mM . . . . 36332 2 6 H2O 'natural abundance' . . . . . solvent 95 . . % . . . . 36332 2 7 D2O [U-2H] . . . . . solvent 5 . . % . . . . 36332 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 36332 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 145.5 . mM 36332 1 pH 7.4 . pH 36332 1 pressure 1 . atm 36332 1 temperature 303 . K 36332 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 36332 _Software.ID 1 _Software.Type . _Software.Name Amber _Software.Version 12 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham III, Simmerling, Wang, Duke, Luo, ... and Kollman' . . 36332 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID refinement . 36332 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 36332 _Software.ID 2 _Software.Type . _Software.Name CYANA _Software.Version 3.98 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 36332 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 36332 2 'structure calculation' . 36332 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 36332 _Software.ID 3 _Software.Type . _Software.Name MAGRO _Software.Version 2.01.38 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 36332 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'peak picking' . 36332 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 36332 _Software.ID 4 _Software.Type . _Software.Name NMRPipe _Software.Version 2017 _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' . . 36332 4 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 36332 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 36332 _Software.ID 5 _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' . . 36332 5 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'data analysis' . 36332 5 stop_ save_ save_software_6 _Software.Sf_category software _Software.Sf_framecode software_6 _Software.Entry_ID 36332 _Software.ID 6 _Software.Type . _Software.Name TALOS _Software.Version 2017 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 36332 6 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'data analysis' . 36332 6 stop_ save_ save_software_7 _Software.Sf_category software _Software.Sf_framecode software_7 _Software.Entry_ID 36332 _Software.ID 7 _Software.Type . _Software.Name TopSpin _Software.Version 3.2 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 36332 7 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 36332 7 stop_ save_ save_software_8 _Software.Sf_category software _Software.Sf_framecode software_8 _Software.Entry_ID 36332 _Software.ID 8 _Software.Type . _Software.Name qMDD _Software.Version 2.6 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Orekhov, V. Jaravine, M. Mayzel, K. Kazimierczuk' . . 36332 8 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 36332 8 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 36332 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 36332 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 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 36332 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker 'AVANCE III' . 600 . . . 36332 1 2 NMR_spectrometer_2 Bruker 'AVANCE III' . 700 . . . 36332 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 36332 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36332 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36332 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 36332 1 4 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36332 1 5 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36332 1 6 '3D CBCA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 36332 1 7 '3D HCCH-TOCSY aliphatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 36332 1 8 '3D 1H-15N NOESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 36332 1 9 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 36332 1 10 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 36332 1 11 '2D 1H-15N HSQC IPAP' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 36332 1 12 '2D 1H-15N HSQC IPAP' no . . . . . . . . . . . . 2 $sample_2 anisotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 36332 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 36332 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.784ppm at 303K) and then those of 15N and 13C were calculated based on their gyro-magnetic ratios. ; loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.251449530 . . . . . 36332 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 36332 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.101329118 . . . . . 36332 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 36332 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' 1 $sample_1 isotropic 36332 1 2 '2D 1H-13C HSQC aliphatic' 1 $sample_1 isotropic 36332 1 3 '2D 1H-13C HSQC aromatic' 1 $sample_1 isotropic 36332 1 4 '3D HNCO' 1 $sample_1 isotropic 36332 1 5 '3D HNCACB' 1 $sample_1 isotropic 36332 1 6 '3D CBCA(CO)NH' 1 $sample_1 isotropic 36332 1 7 '3D HCCH-TOCSY aliphatic' 1 $sample_1 isotropic 36332 1 8 '3D 1H-15N NOESY' 1 $sample_1 isotropic 36332 1 9 '3D 1H-13C NOESY aliphatic' 1 $sample_1 isotropic 36332 1 10 '3D 1H-13C NOESY aromatic' 1 $sample_1 isotropic 36332 1 11 '2D 1H-15N HSQC IPAP' 1 $sample_1 isotropic 36332 1 12 '2D 1H-15N HSQC IPAP' 2 $sample_2 anisotropic 36332 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 GLY HA2 H 1 3.930 0.030 . 1 . . . . A 1 GLY HA2 . 36332 1 2 . 1 . 1 1 1 GLY HA3 H 1 3.930 0.030 . 1 . . . . A 1 GLY HA3 . 36332 1 3 . 1 . 1 1 1 GLY CA C 13 45.502 0.300 . 1 . . . . A 1 GLY CA . 36332 1 4 . 1 . 1 2 2 SER H H 1 7.976 0.030 . 1 . . . . A 2 SER H . 36332 1 5 . 1 . 1 2 2 SER HA H 1 4.258 0.030 . 1 . . . . A 2 SER HA . 36332 1 6 . 1 . 1 2 2 SER HB2 H 1 3.948 0.030 . 2 . . . . A 2 SER HB2 . 36332 1 7 . 1 . 1 2 2 SER HB3 H 1 4.057 0.030 . 2 . . . . A 2 SER HB3 . 36332 1 8 . 1 . 1 2 2 SER C C 13 176.514 0.300 . 1 . . . . A 2 SER C . 36332 1 9 . 1 . 1 2 2 SER CA C 13 60.953 0.300 . 1 . . . . A 2 SER CA . 36332 1 10 . 1 . 1 2 2 SER CB C 13 62.978 0.300 . 1 . . . . A 2 SER CB . 36332 1 11 . 1 . 1 2 2 SER N N 15 115.239 0.300 . 1 . . . . A 2 SER N . 36332 1 12 . 1 . 1 3 3 GLU H H 1 8.712 0.030 . 1 . . . . A 3 GLU H . 36332 1 13 . 1 . 1 3 3 GLU HA H 1 4.086 0.030 . 1 . . . . A 3 GLU HA . 36332 1 14 . 1 . 1 3 3 GLU HB2 H 1 2.074 0.030 . 1 . . . . A 3 GLU HB2 . 36332 1 15 . 1 . 1 3 3 GLU HB3 H 1 2.074 0.030 . 1 . . . . A 3 GLU HB3 . 36332 1 16 . 1 . 1 3 3 GLU HG2 H 1 2.340 0.030 . 1 . . . . A 3 GLU HG2 . 36332 1 17 . 1 . 1 3 3 GLU HG3 H 1 2.340 0.030 . 1 . . . . A 3 GLU HG3 . 36332 1 18 . 1 . 1 3 3 GLU C C 13 178.787 0.300 . 1 . . . . A 3 GLU C . 36332 1 19 . 1 . 1 3 3 GLU CA C 13 59.577 0.300 . 1 . . . . A 3 GLU CA . 36332 1 20 . 1 . 1 3 3 GLU CB C 13 29.276 0.300 . 1 . . . . A 3 GLU CB . 36332 1 21 . 1 . 1 3 3 GLU CG C 13 36.441 0.300 . 1 . . . . A 3 GLU CG . 36332 1 22 . 1 . 1 3 3 GLU N N 15 121.530 0.300 . 1 . . . . A 3 GLU N . 36332 1 23 . 1 . 1 4 4 GLU H H 1 7.996 0.030 . 1 . . . . A 4 GLU H . 36332 1 24 . 1 . 1 4 4 GLU HA H 1 4.125 0.030 . 1 . . . . A 4 GLU HA . 36332 1 25 . 1 . 1 4 4 GLU HB2 H 1 2.076 0.030 . 2 . . . . A 4 GLU HB2 . 36332 1 26 . 1 . 1 4 4 GLU HB3 H 1 2.228 0.030 . 2 . . . . A 4 GLU HB3 . 36332 1 27 . 1 . 1 4 4 GLU HG2 H 1 2.367 0.030 . 1 . . . . A 4 GLU HG2 . 36332 1 28 . 1 . 1 4 4 GLU HG3 H 1 2.367 0.030 . 1 . . . . A 4 GLU HG3 . 36332 1 29 . 1 . 1 4 4 GLU C C 13 179.488 0.300 . 1 . . . . A 4 GLU C . 36332 1 30 . 1 . 1 4 4 GLU CA C 13 59.546 0.300 . 1 . . . . A 4 GLU CA . 36332 1 31 . 1 . 1 4 4 GLU CB C 13 29.592 0.300 . 1 . . . . A 4 GLU CB . 36332 1 32 . 1 . 1 4 4 GLU CG C 13 37.139 0.300 . 1 . . . . A 4 GLU CG . 36332 1 33 . 1 . 1 4 4 GLU N N 15 119.621 0.300 . 1 . . . . A 4 GLU N . 36332 1 34 . 1 . 1 5 5 ILE H H 1 8.023 0.030 . 1 . . . . A 5 ILE H . 36332 1 35 . 1 . 1 5 5 ILE HA H 1 3.656 0.030 . 1 . . . . A 5 ILE HA . 36332 1 36 . 1 . 1 5 5 ILE HB H 1 1.883 0.030 . 1 . . . . A 5 ILE HB . 36332 1 37 . 1 . 1 5 5 ILE HG12 H 1 0.963 0.030 . 2 . . . . A 5 ILE HG12 . 36332 1 38 . 1 . 1 5 5 ILE HG13 H 1 1.631 0.030 . 2 . . . . A 5 ILE HG13 . 36332 1 39 . 1 . 1 5 5 ILE HG21 H 1 0.791 0.030 . 1 . . . . A 5 ILE HG21 . 36332 1 40 . 1 . 1 5 5 ILE HG22 H 1 0.791 0.030 . 1 . . . . A 5 ILE HG22 . 36332 1 41 . 1 . 1 5 5 ILE HG23 H 1 0.791 0.030 . 1 . . . . A 5 ILE HG23 . 36332 1 42 . 1 . 1 5 5 ILE HD11 H 1 0.664 0.030 . 1 . . . . A 5 ILE HD11 . 36332 1 43 . 1 . 1 5 5 ILE HD12 H 1 0.664 0.030 . 1 . . . . A 5 ILE HD12 . 36332 1 44 . 1 . 1 5 5 ILE HD13 H 1 0.664 0.030 . 1 . . . . A 5 ILE HD13 . 36332 1 45 . 1 . 1 5 5 ILE C C 13 176.988 0.300 . 1 . . . . A 5 ILE C . 36332 1 46 . 1 . 1 5 5 ILE CA C 13 64.572 0.300 . 1 . . . . A 5 ILE CA . 36332 1 47 . 1 . 1 5 5 ILE CB C 13 37.255 0.300 . 1 . . . . A 5 ILE CB . 36332 1 48 . 1 . 1 5 5 ILE CG1 C 13 29.097 0.300 . 1 . . . . A 5 ILE CG1 . 36332 1 49 . 1 . 1 5 5 ILE CG2 C 13 18.070 0.300 . 1 . . . . A 5 ILE CG2 . 36332 1 50 . 1 . 1 5 5 ILE CD1 C 13 13.108 0.300 . 1 . . . . A 5 ILE CD1 . 36332 1 51 . 1 . 1 5 5 ILE N N 15 119.692 0.300 . 1 . . . . A 5 ILE N . 36332 1 52 . 1 . 1 6 6 ARG H H 1 8.178 0.030 . 1 . . . . A 6 ARG H . 36332 1 53 . 1 . 1 6 6 ARG HA H 1 3.698 0.030 . 1 . . . . A 6 ARG HA . 36332 1 54 . 1 . 1 6 6 ARG HB2 H 1 1.871 0.030 . 1 . . . . A 6 ARG HB2 . 36332 1 55 . 1 . 1 6 6 ARG HB3 H 1 1.871 0.030 . 1 . . . . A 6 ARG HB3 . 36332 1 56 . 1 . 1 6 6 ARG HG2 H 1 1.676 0.030 . 1 . . . . A 6 ARG HG2 . 36332 1 57 . 1 . 1 6 6 ARG HG3 H 1 1.676 0.030 . 1 . . . . A 6 ARG HG3 . 36332 1 58 . 1 . 1 6 6 ARG HD2 H 1 2.983 0.030 . 1 . . . . A 6 ARG HD2 . 36332 1 59 . 1 . 1 6 6 ARG HD3 H 1 2.983 0.030 . 1 . . . . A 6 ARG HD3 . 36332 1 60 . 1 . 1 6 6 ARG C C 13 178.799 0.300 . 1 . . . . A 6 ARG C . 36332 1 61 . 1 . 1 6 6 ARG CA C 13 60.463 0.300 . 1 . . . . A 6 ARG CA . 36332 1 62 . 1 . 1 6 6 ARG CB C 13 30.051 0.300 . 1 . . . . A 6 ARG CB . 36332 1 63 . 1 . 1 6 6 ARG CG C 13 27.057 0.300 . 1 . . . . A 6 ARG CG . 36332 1 64 . 1 . 1 6 6 ARG CD C 13 37.707 0.300 . 1 . . . . A 6 ARG CD . 36332 1 65 . 1 . 1 6 6 ARG N N 15 119.292 0.300 . 1 . . . . A 6 ARG N . 36332 1 66 . 1 . 1 7 7 GLU H H 1 7.801 0.030 . 1 . . . . A 7 GLU H . 36332 1 67 . 1 . 1 7 7 GLU HA H 1 4.177 0.030 . 1 . . . . A 7 GLU HA . 36332 1 68 . 1 . 1 7 7 GLU HB2 H 1 2.016 0.030 . 1 . . . . A 7 GLU HB2 . 36332 1 69 . 1 . 1 7 7 GLU HB3 H 1 2.016 0.030 . 1 . . . . A 7 GLU HB3 . 36332 1 70 . 1 . 1 7 7 GLU HG2 H 1 2.320 0.030 . 1 . . . . A 7 GLU HG2 . 36332 1 71 . 1 . 1 7 7 GLU HG3 H 1 2.320 0.030 . 1 . . . . A 7 GLU HG3 . 36332 1 72 . 1 . 1 7 7 GLU C C 13 177.876 0.300 . 1 . . . . A 7 GLU C . 36332 1 73 . 1 . 1 7 7 GLU CA C 13 58.634 0.300 . 1 . . . . A 7 GLU CA . 36332 1 74 . 1 . 1 7 7 GLU CB C 13 29.757 0.300 . 1 . . . . A 7 GLU CB . 36332 1 75 . 1 . 1 7 7 GLU CG C 13 36.141 0.300 . 1 . . . . A 7 GLU CG . 36332 1 76 . 1 . 1 7 7 GLU N N 15 118.029 0.300 . 1 . . . . A 7 GLU N . 36332 1 77 . 1 . 1 8 8 LEU H H 1 7.967 0.030 . 1 . . . . A 8 LEU H . 36332 1 78 . 1 . 1 8 8 LEU HA H 1 3.979 0.030 . 1 . . . . A 8 LEU HA . 36332 1 79 . 1 . 1 8 8 LEU HB2 H 1 1.699 0.030 . 1 . . . . A 8 LEU HB2 . 36332 1 80 . 1 . 1 8 8 LEU HB3 H 1 1.699 0.030 . 1 . . . . A 8 LEU HB3 . 36332 1 81 . 1 . 1 8 8 LEU HD11 H 1 0.580 0.030 . 2 . . . . A 8 LEU HD11 . 36332 1 82 . 1 . 1 8 8 LEU HD12 H 1 0.580 0.030 . 2 . . . . A 8 LEU HD12 . 36332 1 83 . 1 . 1 8 8 LEU HD13 H 1 0.580 0.030 . 2 . . . . A 8 LEU HD13 . 36332 1 84 . 1 . 1 8 8 LEU HD21 H 1 0.722 0.030 . 2 . . . . A 8 LEU HD21 . 36332 1 85 . 1 . 1 8 8 LEU HD22 H 1 0.722 0.030 . 2 . . . . A 8 LEU HD22 . 36332 1 86 . 1 . 1 8 8 LEU HD23 H 1 0.722 0.030 . 2 . . . . A 8 LEU HD23 . 36332 1 87 . 1 . 1 8 8 LEU C C 13 178.289 0.300 . 1 . . . . A 8 LEU C . 36332 1 88 . 1 . 1 8 8 LEU CA C 13 58.535 0.300 . 1 . . . . A 8 LEU CA . 36332 1 89 . 1 . 1 8 8 LEU CB C 13 42.176 0.300 . 1 . . . . A 8 LEU CB . 36332 1 90 . 1 . 1 8 8 LEU CG C 13 24.462 0.300 . 1 . . . . A 8 LEU CG . 36332 1 91 . 1 . 1 8 8 LEU CD1 C 13 24.411 0.300 . 2 . . . . A 8 LEU CD1 . 36332 1 92 . 1 . 1 8 8 LEU CD2 C 13 24.411 0.300 . 2 . . . . A 8 LEU CD2 . 36332 1 93 . 1 . 1 8 8 LEU N N 15 121.009 0.300 . 1 . . . . A 8 LEU N . 36332 1 94 . 1 . 1 9 9 VAL H H 1 8.323 0.030 . 1 . . . . A 9 VAL H . 36332 1 95 . 1 . 1 9 9 VAL HA H 1 3.278 0.030 . 1 . . . . A 9 VAL HA . 36332 1 96 . 1 . 1 9 9 VAL HB H 1 2.024 0.030 . 1 . . . . A 9 VAL HB . 36332 1 97 . 1 . 1 9 9 VAL HG11 H 1 0.865 0.030 . 2 . . . . A 9 VAL HG11 . 36332 1 98 . 1 . 1 9 9 VAL HG12 H 1 0.865 0.030 . 2 . . . . A 9 VAL HG12 . 36332 1 99 . 1 . 1 9 9 VAL HG13 H 1 0.865 0.030 . 2 . . . . A 9 VAL HG13 . 36332 1 100 . 1 . 1 9 9 VAL HG21 H 1 0.888 0.030 . 2 . . . . A 9 VAL HG21 . 36332 1 101 . 1 . 1 9 9 VAL HG22 H 1 0.888 0.030 . 2 . . . . A 9 VAL HG22 . 36332 1 102 . 1 . 1 9 9 VAL HG23 H 1 0.888 0.030 . 2 . . . . A 9 VAL HG23 . 36332 1 103 . 1 . 1 9 9 VAL C C 13 177.275 0.300 . 1 . . . . A 9 VAL C . 36332 1 104 . 1 . 1 9 9 VAL CA C 13 67.350 0.300 . 1 . . . . A 9 VAL CA . 36332 1 105 . 1 . 1 9 9 VAL CB C 13 31.056 0.300 . 1 . . . . A 9 VAL CB . 36332 1 106 . 1 . 1 9 9 VAL CG1 C 13 22.675 0.300 . 2 . . . . A 9 VAL CG1 . 36332 1 107 . 1 . 1 9 9 VAL CG2 C 13 23.141 0.300 . 2 . . . . A 9 VAL CG2 . 36332 1 108 . 1 . 1 9 9 VAL N N 15 116.959 0.300 . 1 . . . . A 9 VAL N . 36332 1 109 . 1 . 1 10 10 ARG H H 1 7.959 0.030 . 1 . . . . A 10 ARG H . 36332 1 110 . 1 . 1 10 10 ARG HA H 1 4.097 0.030 . 1 . . . . A 10 ARG HA . 36332 1 111 . 1 . 1 10 10 ARG HB2 H 1 2.001 0.030 . 1 . . . . A 10 ARG HB2 . 36332 1 112 . 1 . 1 10 10 ARG HB3 H 1 2.001 0.030 . 1 . . . . A 10 ARG HB3 . 36332 1 113 . 1 . 1 10 10 ARG HG2 H 1 1.601 0.030 . 1 . . . . A 10 ARG HG2 . 36332 1 114 . 1 . 1 10 10 ARG HG3 H 1 1.601 0.030 . 1 . . . . A 10 ARG HG3 . 36332 1 115 . 1 . 1 10 10 ARG HD2 H 1 3.286 0.030 . 2 . . . . A 10 ARG HD2 . 36332 1 116 . 1 . 1 10 10 ARG HD3 H 1 3.308 0.030 . 2 . . . . A 10 ARG HD3 . 36332 1 117 . 1 . 1 10 10 ARG C C 13 179.480 0.300 . 1 . . . . A 10 ARG C . 36332 1 118 . 1 . 1 10 10 ARG CA C 13 60.149 0.300 . 1 . . . . A 10 ARG CA . 36332 1 119 . 1 . 1 10 10 ARG CB C 13 29.904 0.300 . 1 . . . . A 10 ARG CB . 36332 1 120 . 1 . 1 10 10 ARG CG C 13 27.159 0.300 . 1 . . . . A 10 ARG CG . 36332 1 121 . 1 . 1 10 10 ARG CD C 13 43.516 0.300 . 1 . . . . A 10 ARG CD . 36332 1 122 . 1 . 1 10 10 ARG N N 15 120.157 0.300 . 1 . . . . A 10 ARG N . 36332 1 123 . 1 . 1 11 11 LYS H H 1 8.056 0.030 . 1 . . . . A 11 LYS H . 36332 1 124 . 1 . 1 11 11 LYS HA H 1 4.180 0.030 . 1 . . . . A 11 LYS HA . 36332 1 125 . 1 . 1 11 11 LYS HB2 H 1 2.038 0.030 . 2 . . . . A 11 LYS HB2 . 36332 1 126 . 1 . 1 11 11 LYS HB3 H 1 2.226 0.030 . 2 . . . . A 11 LYS HB3 . 36332 1 127 . 1 . 1 11 11 LYS HG2 H 1 1.606 0.030 . 2 . . . . A 11 LYS HG2 . 36332 1 128 . 1 . 1 11 11 LYS HG3 H 1 1.807 0.030 . 2 . . . . A 11 LYS HG3 . 36332 1 129 . 1 . 1 11 11 LYS HD2 H 1 1.805 0.030 . 1 . . . . A 11 LYS HD2 . 36332 1 130 . 1 . 1 11 11 LYS HD3 H 1 1.805 0.030 . 1 . . . . A 11 LYS HD3 . 36332 1 131 . 1 . 1 11 11 LYS HE2 H 1 3.006 0.030 . 1 . . . . A 11 LYS HE2 . 36332 1 132 . 1 . 1 11 11 LYS HE3 H 1 3.006 0.030 . 1 . . . . A 11 LYS HE3 . 36332 1 133 . 1 . 1 11 11 LYS C C 13 180.376 0.300 . 1 . . . . A 11 LYS C . 36332 1 134 . 1 . 1 11 11 LYS CA C 13 59.295 0.300 . 1 . . . . A 11 LYS CA . 36332 1 135 . 1 . 1 11 11 LYS CB C 13 32.777 0.300 . 1 . . . . A 11 LYS CB . 36332 1 136 . 1 . 1 11 11 LYS CG C 13 26.097 0.300 . 1 . . . . A 11 LYS CG . 36332 1 137 . 1 . 1 11 11 LYS CD C 13 29.407 0.300 . 1 . . . . A 11 LYS CD . 36332 1 138 . 1 . 1 11 11 LYS CE C 13 42.265 0.300 . 1 . . . . A 11 LYS CE . 36332 1 139 . 1 . 1 11 11 LYS N N 15 118.240 0.300 . 1 . . . . A 11 LYS N . 36332 1 140 . 1 . 1 12 12 ILE H H 1 8.475 0.030 . 1 . . . . A 12 ILE H . 36332 1 141 . 1 . 1 12 12 ILE HA H 1 3.496 0.030 . 1 . . . . A 12 ILE HA . 36332 1 142 . 1 . 1 12 12 ILE HB H 1 1.827 0.030 . 1 . . . . A 12 ILE HB . 36332 1 143 . 1 . 1 12 12 ILE HG12 H 1 0.493 0.030 . 2 . . . . A 12 ILE HG12 . 36332 1 144 . 1 . 1 12 12 ILE HG13 H 1 1.362 0.030 . 2 . . . . A 12 ILE HG13 . 36332 1 145 . 1 . 1 12 12 ILE HG21 H 1 0.518 0.030 . 1 . . . . A 12 ILE HG21 . 36332 1 146 . 1 . 1 12 12 ILE HG22 H 1 0.518 0.030 . 1 . . . . A 12 ILE HG22 . 36332 1 147 . 1 . 1 12 12 ILE HG23 H 1 0.518 0.030 . 1 . . . . A 12 ILE HG23 . 36332 1 148 . 1 . 1 12 12 ILE HD11 H 1 0.325 0.030 . 1 . . . . A 12 ILE HD11 . 36332 1 149 . 1 . 1 12 12 ILE HD12 H 1 0.325 0.030 . 1 . . . . A 12 ILE HD12 . 36332 1 150 . 1 . 1 12 12 ILE HD13 H 1 0.325 0.030 . 1 . . . . A 12 ILE HD13 . 36332 1 151 . 1 . 1 12 12 ILE C C 13 177.574 0.300 . 1 . . . . A 12 ILE C . 36332 1 152 . 1 . 1 12 12 ILE CA C 13 66.087 0.300 . 1 . . . . A 12 ILE CA . 36332 1 153 . 1 . 1 12 12 ILE CB C 13 37.225 0.300 . 1 . . . . A 12 ILE CB . 36332 1 154 . 1 . 1 12 12 ILE CG1 C 13 28.764 0.300 . 1 . . . . A 12 ILE CG1 . 36332 1 155 . 1 . 1 12 12 ILE CG2 C 13 16.678 0.300 . 1 . . . . A 12 ILE CG2 . 36332 1 156 . 1 . 1 12 12 ILE CD1 C 13 13.461 0.300 . 1 . . . . A 12 ILE CD1 . 36332 1 157 . 1 . 1 12 12 ILE N N 15 124.051 0.300 . 1 . . . . A 12 ILE N . 36332 1 158 . 1 . 1 13 13 TYR H H 1 8.476 0.030 . 1 . . . . A 13 TYR H . 36332 1 159 . 1 . 1 13 13 TYR HA H 1 3.948 0.030 . 1 . . . . A 13 TYR HA . 36332 1 160 . 1 . 1 13 13 TYR HB2 H 1 3.014 0.030 . 1 . . . . A 13 TYR HB2 . 36332 1 161 . 1 . 1 13 13 TYR HB3 H 1 3.014 0.030 . 1 . . . . A 13 TYR HB3 . 36332 1 162 . 1 . 1 13 13 TYR HD1 H 1 7.076 0.030 . 1 . . . . A 13 TYR HD1 . 36332 1 163 . 1 . 1 13 13 TYR HD2 H 1 7.076 0.030 . 1 . . . . A 13 TYR HD2 . 36332 1 164 . 1 . 1 13 13 TYR HE1 H 1 6.527 0.030 . 1 . . . . A 13 TYR HE1 . 36332 1 165 . 1 . 1 13 13 TYR HE2 H 1 6.527 0.030 . 1 . . . . A 13 TYR HE2 . 36332 1 166 . 1 . 1 13 13 TYR C C 13 179.023 0.300 . 1 . . . . A 13 TYR C . 36332 1 167 . 1 . 1 13 13 TYR CA C 13 63.131 0.300 . 1 . . . . A 13 TYR CA . 36332 1 168 . 1 . 1 13 13 TYR CB C 13 37.947 0.300 . 1 . . . . A 13 TYR CB . 36332 1 169 . 1 . 1 13 13 TYR CD1 C 13 132.491 0.300 . 1 . . . . A 13 TYR CD1 . 36332 1 170 . 1 . 1 13 13 TYR CD2 C 13 132.491 0.300 . 1 . . . . A 13 TYR CD2 . 36332 1 171 . 1 . 1 13 13 TYR CE1 C 13 117.688 0.300 . 1 . . . . A 13 TYR CE1 . 36332 1 172 . 1 . 1 13 13 TYR CE2 C 13 117.688 0.300 . 1 . . . . A 13 TYR CE2 . 36332 1 173 . 1 . 1 13 13 TYR N N 15 119.153 0.300 . 1 . . . . A 13 TYR N . 36332 1 174 . 1 . 1 14 14 GLU H H 1 8.303 0.030 . 1 . . . . A 14 GLU H . 36332 1 175 . 1 . 1 14 14 GLU HA H 1 4.027 0.030 . 1 . . . . A 14 GLU HA . 36332 1 176 . 1 . 1 14 14 GLU HB2 H 1 2.207 0.030 . 1 . . . . A 14 GLU HB2 . 36332 1 177 . 1 . 1 14 14 GLU HB3 H 1 2.207 0.030 . 1 . . . . A 14 GLU HB3 . 36332 1 178 . 1 . 1 14 14 GLU HG2 H 1 2.553 0.030 . 1 . . . . A 14 GLU HG2 . 36332 1 179 . 1 . 1 14 14 GLU HG3 H 1 2.553 0.030 . 1 . . . . A 14 GLU HG3 . 36332 1 180 . 1 . 1 14 14 GLU C C 13 178.766 0.300 . 1 . . . . A 14 GLU C . 36332 1 181 . 1 . 1 14 14 GLU CA C 13 59.609 0.300 . 1 . . . . A 14 GLU CA . 36332 1 182 . 1 . 1 14 14 GLU CB C 13 29.982 0.300 . 1 . . . . A 14 GLU CB . 36332 1 183 . 1 . 1 14 14 GLU CG C 13 34.737 0.300 . 1 . . . . A 14 GLU CG . 36332 1 184 . 1 . 1 14 14 GLU N N 15 118.138 0.300 . 1 . . . . A 14 GLU N . 36332 1 185 . 1 . 1 15 15 THR H H 1 8.046 0.030 . 1 . . . . A 15 THR H . 36332 1 186 . 1 . 1 15 15 THR HA H 1 4.404 0.030 . 1 . . . . A 15 THR HA . 36332 1 187 . 1 . 1 15 15 THR HB H 1 3.948 0.030 . 1 . . . . A 15 THR HB . 36332 1 188 . 1 . 1 15 15 THR HG21 H 1 1.195 0.030 . 1 . . . . A 15 THR HG21 . 36332 1 189 . 1 . 1 15 15 THR HG22 H 1 1.195 0.030 . 1 . . . . A 15 THR HG22 . 36332 1 190 . 1 . 1 15 15 THR HG23 H 1 1.195 0.030 . 1 . . . . A 15 THR HG23 . 36332 1 191 . 1 . 1 15 15 THR C C 13 176.338 0.300 . 1 . . . . A 15 THR C . 36332 1 192 . 1 . 1 15 15 THR CA C 13 69.262 0.300 . 1 . . . . A 15 THR CA . 36332 1 193 . 1 . 1 15 15 THR CB C 13 67.133 0.300 . 1 . . . . A 15 THR CB . 36332 1 194 . 1 . 1 15 15 THR CG2 C 13 21.126 0.300 . 1 . . . . A 15 THR CG2 . 36332 1 195 . 1 . 1 15 15 THR N N 15 115.642 0.300 . 1 . . . . A 15 THR N . 36332 1 196 . 1 . 1 16 16 VAL H H 1 8.201 0.030 . 1 . . . . A 16 VAL H . 36332 1 197 . 1 . 1 16 16 VAL HA H 1 3.538 0.030 . 1 . . . . A 16 VAL HA . 36332 1 198 . 1 . 1 16 16 VAL HB H 1 2.046 0.030 . 1 . . . . A 16 VAL HB . 36332 1 199 . 1 . 1 16 16 VAL HG11 H 1 0.870 0.030 . 2 . . . . A 16 VAL HG11 . 36332 1 200 . 1 . 1 16 16 VAL HG12 H 1 0.870 0.030 . 2 . . . . A 16 VAL HG12 . 36332 1 201 . 1 . 1 16 16 VAL HG13 H 1 0.870 0.030 . 2 . . . . A 16 VAL HG13 . 36332 1 202 . 1 . 1 16 16 VAL HG21 H 1 0.890 0.030 . 2 . . . . A 16 VAL HG21 . 36332 1 203 . 1 . 1 16 16 VAL HG22 H 1 0.890 0.030 . 2 . . . . A 16 VAL HG22 . 36332 1 204 . 1 . 1 16 16 VAL HG23 H 1 0.890 0.030 . 2 . . . . A 16 VAL HG23 . 36332 1 205 . 1 . 1 16 16 VAL C C 13 177.079 0.300 . 1 . . . . A 16 VAL C . 36332 1 206 . 1 . 1 16 16 VAL CA C 13 66.905 0.300 . 1 . . . . A 16 VAL CA . 36332 1 207 . 1 . 1 16 16 VAL CB C 13 31.788 0.300 . 1 . . . . A 16 VAL CB . 36332 1 208 . 1 . 1 16 16 VAL CG1 C 13 21.793 0.300 . 2 . . . . A 16 VAL CG1 . 36332 1 209 . 1 . 1 16 16 VAL CG2 C 13 23.064 0.300 . 2 . . . . A 16 VAL CG2 . 36332 1 210 . 1 . 1 16 16 VAL N N 15 119.617 0.300 . 1 . . . . A 16 VAL N . 36332 1 211 . 1 . 1 17 17 ARG H H 1 8.201 0.030 . 1 . . . . A 17 ARG H . 36332 1 212 . 1 . 1 17 17 ARG HA H 1 3.898 0.030 . 1 . . . . A 17 ARG HA . 36332 1 213 . 1 . 1 17 17 ARG HB2 H 1 1.851 0.030 . 1 . . . . A 17 ARG HB2 . 36332 1 214 . 1 . 1 17 17 ARG HB3 H 1 1.851 0.030 . 1 . . . . A 17 ARG HB3 . 36332 1 215 . 1 . 1 17 17 ARG HG2 H 1 1.721 0.030 . 1 . . . . A 17 ARG HG2 . 36332 1 216 . 1 . 1 17 17 ARG HG3 H 1 1.721 0.030 . 1 . . . . A 17 ARG HG3 . 36332 1 217 . 1 . 1 17 17 ARG HD2 H 1 1.951 0.030 . 1 . . . . A 17 ARG HD2 . 36332 1 218 . 1 . 1 17 17 ARG HD3 H 1 1.951 0.030 . 1 . . . . A 17 ARG HD3 . 36332 1 219 . 1 . 1 17 17 ARG C C 13 177.813 0.300 . 1 . . . . A 17 ARG C . 36332 1 220 . 1 . 1 17 17 ARG CA C 13 59.683 0.300 . 1 . . . . A 17 ARG CA . 36332 1 221 . 1 . 1 17 17 ARG CB C 13 30.218 0.300 . 1 . . . . A 17 ARG CB . 36332 1 222 . 1 . 1 17 17 ARG CG C 13 28.456 0.300 . 1 . . . . A 17 ARG CG . 36332 1 223 . 1 . 1 17 17 ARG CD C 13 44.225 0.300 . 1 . . . . A 17 ARG CD . 36332 1 224 . 1 . 1 17 17 ARG N N 15 118.124 0.300 . 1 . . . . A 17 ARG N . 36332 1 225 . 1 . 1 18 18 LYS H H 1 7.430 0.030 . 1 . . . . A 18 LYS H . 36332 1 226 . 1 . 1 18 18 LYS HA H 1 3.738 0.030 . 1 . . . . A 18 LYS HA . 36332 1 227 . 1 . 1 18 18 LYS HB2 H 1 1.930 0.030 . 1 . . . . A 18 LYS HB2 . 36332 1 228 . 1 . 1 18 18 LYS HB3 H 1 1.930 0.030 . 1 . . . . A 18 LYS HB3 . 36332 1 229 . 1 . 1 18 18 LYS HG2 H 1 1.433 0.030 . 1 . . . . A 18 LYS HG2 . 36332 1 230 . 1 . 1 18 18 LYS HG3 H 1 1.433 0.030 . 1 . . . . A 18 LYS HG3 . 36332 1 231 . 1 . 1 18 18 LYS C C 13 177.642 0.300 . 1 . . . . A 18 LYS C . 36332 1 232 . 1 . 1 18 18 LYS CA C 13 58.381 0.300 . 1 . . . . A 18 LYS CA . 36332 1 233 . 1 . 1 18 18 LYS CB C 13 32.584 0.300 . 1 . . . . A 18 LYS CB . 36332 1 234 . 1 . 1 18 18 LYS CG C 13 24.963 0.300 . 1 . . . . A 18 LYS CG . 36332 1 235 . 1 . 1 18 18 LYS N N 15 115.638 0.300 . 1 . . . . A 18 LYS N . 36332 1 236 . 1 . 1 19 19 GLU H H 1 7.569 0.030 . 1 . . . . A 19 GLU H . 36332 1 237 . 1 . 1 19 19 GLU HA H 1 4.287 0.030 . 1 . . . . A 19 GLU HA . 36332 1 238 . 1 . 1 19 19 GLU HB2 H 1 2.041 0.030 . 1 . . . . A 19 GLU HB2 . 36332 1 239 . 1 . 1 19 19 GLU HB3 H 1 2.041 0.030 . 1 . . . . A 19 GLU HB3 . 36332 1 240 . 1 . 1 19 19 GLU HG2 H 1 2.378 0.030 . 1 . . . . A 19 GLU HG2 . 36332 1 241 . 1 . 1 19 19 GLU HG3 H 1 2.378 0.030 . 1 . . . . A 19 GLU HG3 . 36332 1 242 . 1 . 1 19 19 GLU C C 13 177.238 0.300 . 1 . . . . A 19 GLU C . 36332 1 243 . 1 . 1 19 19 GLU CA C 13 57.303 0.300 . 1 . . . . A 19 GLU CA . 36332 1 244 . 1 . 1 19 19 GLU CB C 13 30.689 0.300 . 1 . . . . A 19 GLU CB . 36332 1 245 . 1 . 1 19 19 GLU CG C 13 36.291 0.300 . 1 . . . . A 19 GLU CG . 36332 1 246 . 1 . 1 19 19 GLU N N 15 116.660 0.300 . 1 . . . . A 19 GLU N . 36332 1 247 . 1 . 1 20 20 ASN H H 1 8.367 0.030 . 1 . . . . A 20 ASN H . 36332 1 248 . 1 . 1 20 20 ASN HA H 1 4.874 0.030 . 1 . . . . A 20 ASN HA . 36332 1 249 . 1 . 1 20 20 ASN HB2 H 1 2.856 0.030 . 1 . . . . A 20 ASN HB2 . 36332 1 250 . 1 . 1 20 20 ASN HB3 H 1 2.856 0.030 . 1 . . . . A 20 ASN HB3 . 36332 1 251 . 1 . 1 20 20 ASN HD21 H 1 7.031 0.030 . 2 . . . . A 20 ASN HD21 . 36332 1 252 . 1 . 1 20 20 ASN HD22 H 1 7.745 0.030 . 2 . . . . A 20 ASN HD22 . 36332 1 253 . 1 . 1 20 20 ASN C C 13 172.628 0.300 . 1 . . . . A 20 ASN C . 36332 1 254 . 1 . 1 20 20 ASN CA C 13 51.964 0.300 . 1 . . . . A 20 ASN CA . 36332 1 255 . 1 . 1 20 20 ASN CB C 13 39.454 0.300 . 1 . . . . A 20 ASN CB . 36332 1 256 . 1 . 1 20 20 ASN N N 15 113.968 0.300 . 1 . . . . A 20 ASN N . 36332 1 257 . 1 . 1 20 20 ASN ND2 N 15 112.367 0.300 . 1 . . . . A 20 ASN ND2 . 36332 1 258 . 1 . 1 21 21 PRO HA H 1 4.535 0.030 . 1 . . . . A 21 PRO HA . 36332 1 259 . 1 . 1 21 21 PRO HB2 H 1 2.090 0.030 . 2 . . . . A 21 PRO HB2 . 36332 1 260 . 1 . 1 21 21 PRO HB3 H 1 2.404 0.030 . 2 . . . . A 21 PRO HB3 . 36332 1 261 . 1 . 1 21 21 PRO HG2 H 1 1.923 0.030 . 2 . . . . A 21 PRO HG2 . 36332 1 262 . 1 . 1 21 21 PRO HG3 H 1 2.099 0.030 . 2 . . . . A 21 PRO HG3 . 36332 1 263 . 1 . 1 21 21 PRO HD2 H 1 3.648 0.030 . 2 . . . . A 21 PRO HD2 . 36332 1 264 . 1 . 1 21 21 PRO HD3 H 1 3.835 0.030 . 2 . . . . A 21 PRO HD3 . 36332 1 265 . 1 . 1 21 21 PRO C C 13 176.604 0.300 . 1 . . . . A 21 PRO C . 36332 1 266 . 1 . 1 21 21 PRO CA C 13 64.105 0.300 . 1 . . . . A 21 PRO CA . 36332 1 267 . 1 . 1 21 21 PRO CB C 13 32.238 0.300 . 1 . . . . A 21 PRO CB . 36332 1 268 . 1 . 1 21 21 PRO CG C 13 26.657 0.300 . 1 . . . . A 21 PRO CG . 36332 1 269 . 1 . 1 21 21 PRO CD C 13 50.673 0.300 . 1 . . . . A 21 PRO CD . 36332 1 270 . 1 . 1 22 22 ASN H H 1 8.400 0.030 . 1 . . . . A 22 ASN H . 36332 1 271 . 1 . 1 22 22 ASN HA H 1 4.793 0.030 . 1 . . . . A 22 ASN HA . 36332 1 272 . 1 . 1 22 22 ASN HB2 H 1 2.798 0.030 . 2 . . . . A 22 ASN HB2 . 36332 1 273 . 1 . 1 22 22 ASN HB3 H 1 2.939 0.030 . 2 . . . . A 22 ASN HB3 . 36332 1 274 . 1 . 1 22 22 ASN HD21 H 1 7.027 0.030 . 2 . . . . A 22 ASN HD21 . 36332 1 275 . 1 . 1 22 22 ASN HD22 H 1 7.673 0.030 . 2 . . . . A 22 ASN HD22 . 36332 1 276 . 1 . 1 22 22 ASN C C 13 175.449 0.300 . 1 . . . . A 22 ASN C . 36332 1 277 . 1 . 1 22 22 ASN CA C 13 53.600 0.300 . 1 . . . . A 22 ASN CA . 36332 1 278 . 1 . 1 22 22 ASN CB C 13 38.942 0.300 . 1 . . . . A 22 ASN CB . 36332 1 279 . 1 . 1 22 22 ASN N N 15 116.109 0.300 . 1 . . . . A 22 ASN N . 36332 1 280 . 1 . 1 22 22 ASN ND2 N 15 114.164 0.300 . 1 . . . . A 22 ASN ND2 . 36332 1 281 . 1 . 1 23 23 VAL H H 1 7.256 0.030 . 1 . . . . A 23 VAL H . 36332 1 282 . 1 . 1 23 23 VAL HA H 1 4.272 0.030 . 1 . . . . A 23 VAL HA . 36332 1 283 . 1 . 1 23 23 VAL HB H 1 2.066 0.030 . 1 . . . . A 23 VAL HB . 36332 1 284 . 1 . 1 23 23 VAL HG11 H 1 0.866 0.030 . 2 . . . . A 23 VAL HG11 . 36332 1 285 . 1 . 1 23 23 VAL HG12 H 1 0.866 0.030 . 2 . . . . A 23 VAL HG12 . 36332 1 286 . 1 . 1 23 23 VAL HG13 H 1 0.866 0.030 . 2 . . . . A 23 VAL HG13 . 36332 1 287 . 1 . 1 23 23 VAL HG21 H 1 0.864 0.030 . 2 . . . . A 23 VAL HG21 . 36332 1 288 . 1 . 1 23 23 VAL HG22 H 1 0.864 0.030 . 2 . . . . A 23 VAL HG22 . 36332 1 289 . 1 . 1 23 23 VAL HG23 H 1 0.864 0.030 . 2 . . . . A 23 VAL HG23 . 36332 1 290 . 1 . 1 23 23 VAL C C 13 174.371 0.300 . 1 . . . . A 23 VAL C . 36332 1 291 . 1 . 1 23 23 VAL CA C 13 62.274 0.300 . 1 . . . . A 23 VAL CA . 36332 1 292 . 1 . 1 23 23 VAL CB C 13 32.469 0.300 . 1 . . . . A 23 VAL CB . 36332 1 293 . 1 . 1 23 23 VAL CG1 C 13 21.926 0.300 . 2 . . . . A 23 VAL CG1 . 36332 1 294 . 1 . 1 23 23 VAL CG2 C 13 21.926 0.300 . 2 . . . . A 23 VAL CG2 . 36332 1 295 . 1 . 1 23 23 VAL N N 15 119.072 0.300 . 1 . . . . A 23 VAL N . 36332 1 296 . 1 . 1 24 24 LYS H H 1 8.423 0.030 . 1 . . . . A 24 LYS H . 36332 1 297 . 1 . 1 24 24 LYS HA H 1 4.668 0.030 . 1 . . . . A 24 LYS HA . 36332 1 298 . 1 . 1 24 24 LYS HB2 H 1 1.659 0.030 . 2 . . . . A 24 LYS HB2 . 36332 1 299 . 1 . 1 24 24 LYS HB3 H 1 1.806 0.030 . 2 . . . . A 24 LYS HB3 . 36332 1 300 . 1 . 1 24 24 LYS HG2 H 1 1.437 0.030 . 1 . . . . A 24 LYS HG2 . 36332 1 301 . 1 . 1 24 24 LYS HG3 H 1 1.437 0.030 . 1 . . . . A 24 LYS HG3 . 36332 1 302 . 1 . 1 24 24 LYS C C 13 174.340 0.300 . 1 . . . . A 24 LYS C . 36332 1 303 . 1 . 1 24 24 LYS CA C 13 54.871 0.300 . 1 . . . . A 24 LYS CA . 36332 1 304 . 1 . 1 24 24 LYS CB C 13 34.770 0.300 . 1 . . . . A 24 LYS CB . 36332 1 305 . 1 . 1 24 24 LYS CG C 13 24.942 0.300 . 1 . . . . A 24 LYS CG . 36332 1 306 . 1 . 1 24 24 LYS N N 15 125.137 0.300 . 1 . . . . A 24 LYS N . 36332 1 307 . 1 . 1 25 25 ILE H H 1 8.218 0.030 . 1 . . . . A 25 ILE H . 36332 1 308 . 1 . 1 25 25 ILE HA H 1 4.942 0.030 . 1 . . . . A 25 ILE HA . 36332 1 309 . 1 . 1 25 25 ILE HB H 1 1.491 0.030 . 1 . . . . A 25 ILE HB . 36332 1 310 . 1 . 1 25 25 ILE HG12 H 1 1.235 0.030 . 1 . . . . A 25 ILE HG12 . 36332 1 311 . 1 . 1 25 25 ILE HG13 H 1 1.235 0.030 . 1 . . . . A 25 ILE HG13 . 36332 1 312 . 1 . 1 25 25 ILE HG21 H 1 0.533 0.030 . 1 . . . . A 25 ILE HG21 . 36332 1 313 . 1 . 1 25 25 ILE HG22 H 1 0.533 0.030 . 1 . . . . A 25 ILE HG22 . 36332 1 314 . 1 . 1 25 25 ILE HG23 H 1 0.533 0.030 . 1 . . . . A 25 ILE HG23 . 36332 1 315 . 1 . 1 25 25 ILE HD11 H 1 0.274 0.030 . 1 . . . . A 25 ILE HD11 . 36332 1 316 . 1 . 1 25 25 ILE HD12 H 1 0.274 0.030 . 1 . . . . A 25 ILE HD12 . 36332 1 317 . 1 . 1 25 25 ILE HD13 H 1 0.274 0.030 . 1 . . . . A 25 ILE HD13 . 36332 1 318 . 1 . 1 25 25 ILE C C 13 175.722 0.300 . 1 . . . . A 25 ILE C . 36332 1 319 . 1 . 1 25 25 ILE CA C 13 59.344 0.300 . 1 . . . . A 25 ILE CA . 36332 1 320 . 1 . 1 25 25 ILE CB C 13 40.748 0.300 . 1 . . . . A 25 ILE CB . 36332 1 321 . 1 . 1 25 25 ILE CG1 C 13 27.226 0.300 . 1 . . . . A 25 ILE CG1 . 36332 1 322 . 1 . 1 25 25 ILE CG2 C 13 17.558 0.300 . 1 . . . . A 25 ILE CG2 . 36332 1 323 . 1 . 1 25 25 ILE CD1 C 13 13.681 0.300 . 1 . . . . A 25 ILE CD1 . 36332 1 324 . 1 . 1 25 25 ILE N N 15 119.660 0.300 . 1 . . . . A 25 ILE N . 36332 1 325 . 1 . 1 26 26 LEU H H 1 9.124 0.030 . 1 . . . . A 26 LEU H . 36332 1 326 . 1 . 1 26 26 LEU HA H 1 4.650 0.030 . 1 . . . . A 26 LEU HA . 36332 1 327 . 1 . 1 26 26 LEU HB2 H 1 1.210 0.030 . 2 . . . . A 26 LEU HB2 . 36332 1 328 . 1 . 1 26 26 LEU HB3 H 1 1.418 0.030 . 2 . . . . A 26 LEU HB3 . 36332 1 329 . 1 . 1 26 26 LEU HD11 H 1 0.711 0.030 . 2 . . . . A 26 LEU HD11 . 36332 1 330 . 1 . 1 26 26 LEU HD12 H 1 0.711 0.030 . 2 . . . . A 26 LEU HD12 . 36332 1 331 . 1 . 1 26 26 LEU HD13 H 1 0.711 0.030 . 2 . . . . A 26 LEU HD13 . 36332 1 332 . 1 . 1 26 26 LEU HD21 H 1 0.758 0.030 . 2 . . . . A 26 LEU HD21 . 36332 1 333 . 1 . 1 26 26 LEU HD22 H 1 0.758 0.030 . 2 . . . . A 26 LEU HD22 . 36332 1 334 . 1 . 1 26 26 LEU HD23 H 1 0.758 0.030 . 2 . . . . A 26 LEU HD23 . 36332 1 335 . 1 . 1 26 26 LEU C C 13 174.314 0.300 . 1 . . . . A 26 LEU C . 36332 1 336 . 1 . 1 26 26 LEU CA C 13 53.801 0.300 . 1 . . . . A 26 LEU CA . 36332 1 337 . 1 . 1 26 26 LEU CB C 13 45.977 0.300 . 1 . . . . A 26 LEU CB . 36332 1 338 . 1 . 1 26 26 LEU CD1 C 13 25.538 0.300 . 2 . . . . A 26 LEU CD1 . 36332 1 339 . 1 . 1 26 26 LEU CD2 C 13 25.170 0.300 . 2 . . . . A 26 LEU CD2 . 36332 1 340 . 1 . 1 26 26 LEU N N 15 128.680 0.300 . 1 . . . . A 26 LEU N . 36332 1 341 . 1 . 1 27 27 ILE H H 1 7.980 0.030 . 1 . . . . A 27 ILE H . 36332 1 342 . 1 . 1 27 27 ILE HA H 1 4.815 0.030 . 1 . . . . A 27 ILE HA . 36332 1 343 . 1 . 1 27 27 ILE HB H 1 1.672 0.030 . 1 . . . . A 27 ILE HB . 36332 1 344 . 1 . 1 27 27 ILE HG21 H 1 0.636 0.030 . 1 . . . . A 27 ILE HG21 . 36332 1 345 . 1 . 1 27 27 ILE HG22 H 1 0.636 0.030 . 1 . . . . A 27 ILE HG22 . 36332 1 346 . 1 . 1 27 27 ILE HG23 H 1 0.636 0.030 . 1 . . . . A 27 ILE HG23 . 36332 1 347 . 1 . 1 27 27 ILE HD11 H 1 0.643 0.030 . 1 . . . . A 27 ILE HD11 . 36332 1 348 . 1 . 1 27 27 ILE HD12 H 1 0.643 0.030 . 1 . . . . A 27 ILE HD12 . 36332 1 349 . 1 . 1 27 27 ILE HD13 H 1 0.643 0.030 . 1 . . . . A 27 ILE HD13 . 36332 1 350 . 1 . 1 27 27 ILE C C 13 174.287 0.300 . 1 . . . . A 27 ILE C . 36332 1 351 . 1 . 1 27 27 ILE CA C 13 59.645 0.300 . 1 . . . . A 27 ILE CA . 36332 1 352 . 1 . 1 27 27 ILE CB C 13 40.346 0.300 . 1 . . . . A 27 ILE CB . 36332 1 353 . 1 . 1 27 27 ILE CG2 C 13 17.403 0.300 . 1 . . . . A 27 ILE CG2 . 36332 1 354 . 1 . 1 27 27 ILE CD1 C 13 14.698 0.300 . 1 . . . . A 27 ILE CD1 . 36332 1 355 . 1 . 1 27 27 ILE N N 15 122.085 0.300 . 1 . . . . A 27 ILE N . 36332 1 356 . 1 . 1 28 28 PHE H H 1 9.214 0.030 . 1 . . . . A 28 PHE H . 36332 1 357 . 1 . 1 28 28 PHE HA H 1 5.128 0.030 . 1 . . . . A 28 PHE HA . 36332 1 358 . 1 . 1 28 28 PHE HB2 H 1 2.417 0.030 . 2 . . . . A 28 PHE HB2 . 36332 1 359 . 1 . 1 28 28 PHE HB3 H 1 2.827 0.030 . 2 . . . . A 28 PHE HB3 . 36332 1 360 . 1 . 1 28 28 PHE HD1 H 1 6.844 0.030 . 1 . . . . A 28 PHE HD1 . 36332 1 361 . 1 . 1 28 28 PHE HD2 H 1 6.844 0.030 . 1 . . . . A 28 PHE HD2 . 36332 1 362 . 1 . 1 28 28 PHE HE1 H 1 7.035 0.030 . 1 . . . . A 28 PHE HE1 . 36332 1 363 . 1 . 1 28 28 PHE HE2 H 1 7.035 0.030 . 1 . . . . A 28 PHE HE2 . 36332 1 364 . 1 . 1 28 28 PHE C C 13 174.418 0.300 . 1 . . . . A 28 PHE C . 36332 1 365 . 1 . 1 28 28 PHE CA C 13 56.790 0.300 . 1 . . . . A 28 PHE CA . 36332 1 366 . 1 . 1 28 28 PHE CB C 13 41.258 0.300 . 1 . . . . A 28 PHE CB . 36332 1 367 . 1 . 1 28 28 PHE CD1 C 13 131.515 0.300 . 1 . . . . A 28 PHE CD1 . 36332 1 368 . 1 . 1 28 28 PHE CD2 C 13 131.515 0.300 . 1 . . . . A 28 PHE CD2 . 36332 1 369 . 1 . 1 28 28 PHE CE1 C 13 130.888 0.300 . 1 . . . . A 28 PHE CE1 . 36332 1 370 . 1 . 1 28 28 PHE CE2 C 13 130.888 0.300 . 1 . . . . A 28 PHE CE2 . 36332 1 371 . 1 . 1 28 28 PHE N N 15 124.862 0.300 . 1 . . . . A 28 PHE N . 36332 1 372 . 1 . 1 29 29 ILE H H 1 9.074 0.030 . 1 . . . . A 29 ILE H . 36332 1 373 . 1 . 1 29 29 ILE HA H 1 4.662 0.030 . 1 . . . . A 29 ILE HA . 36332 1 374 . 1 . 1 29 29 ILE HB H 1 1.607 0.030 . 1 . . . . A 29 ILE HB . 36332 1 375 . 1 . 1 29 29 ILE HG12 H 1 0.946 0.030 . 1 . . . . A 29 ILE HG12 . 36332 1 376 . 1 . 1 29 29 ILE HG13 H 1 0.946 0.030 . 1 . . . . A 29 ILE HG13 . 36332 1 377 . 1 . 1 29 29 ILE HG21 H 1 0.414 0.030 . 1 . . . . A 29 ILE HG21 . 36332 1 378 . 1 . 1 29 29 ILE HG22 H 1 0.414 0.030 . 1 . . . . A 29 ILE HG22 . 36332 1 379 . 1 . 1 29 29 ILE HG23 H 1 0.414 0.030 . 1 . . . . A 29 ILE HG23 . 36332 1 380 . 1 . 1 29 29 ILE HD11 H 1 0.612 0.030 . 1 . . . . A 29 ILE HD11 . 36332 1 381 . 1 . 1 29 29 ILE HD12 H 1 0.612 0.030 . 1 . . . . A 29 ILE HD12 . 36332 1 382 . 1 . 1 29 29 ILE HD13 H 1 0.612 0.030 . 1 . . . . A 29 ILE HD13 . 36332 1 383 . 1 . 1 29 29 ILE C C 13 174.158 0.300 . 1 . . . . A 29 ILE C . 36332 1 384 . 1 . 1 29 29 ILE CA C 13 59.372 0.300 . 1 . . . . A 29 ILE CA . 36332 1 385 . 1 . 1 29 29 ILE CB C 13 39.067 0.300 . 1 . . . . A 29 ILE CB . 36332 1 386 . 1 . 1 29 29 ILE CG1 C 13 27.059 0.300 . 1 . . . . A 29 ILE CG1 . 36332 1 387 . 1 . 1 29 29 ILE CG2 C 13 18.067 0.300 . 1 . . . . A 29 ILE CG2 . 36332 1 388 . 1 . 1 29 29 ILE CD1 C 13 13.755 0.300 . 1 . . . . A 29 ILE CD1 . 36332 1 389 . 1 . 1 29 29 ILE N N 15 122.563 0.300 . 1 . . . . A 29 ILE N . 36332 1 390 . 1 . 1 30 30 ILE H H 1 8.978 0.030 . 1 . . . . A 30 ILE H . 36332 1 391 . 1 . 1 30 30 ILE HA H 1 4.698 0.030 . 1 . . . . A 30 ILE HA . 36332 1 392 . 1 . 1 30 30 ILE HB H 1 1.755 0.030 . 1 . . . . A 30 ILE HB . 36332 1 393 . 1 . 1 30 30 ILE HG12 H 1 0.939 0.030 . 1 . . . . A 30 ILE HG12 . 36332 1 394 . 1 . 1 30 30 ILE HG13 H 1 0.939 0.030 . 1 . . . . A 30 ILE HG13 . 36332 1 395 . 1 . 1 30 30 ILE HG21 H 1 0.638 0.030 . 1 . . . . A 30 ILE HG21 . 36332 1 396 . 1 . 1 30 30 ILE HG22 H 1 0.638 0.030 . 1 . . . . A 30 ILE HG22 . 36332 1 397 . 1 . 1 30 30 ILE HG23 H 1 0.638 0.030 . 1 . . . . A 30 ILE HG23 . 36332 1 398 . 1 . 1 30 30 ILE HD11 H 1 0.724 0.030 . 1 . . . . A 30 ILE HD11 . 36332 1 399 . 1 . 1 30 30 ILE HD12 H 1 0.724 0.030 . 1 . . . . A 30 ILE HD12 . 36332 1 400 . 1 . 1 30 30 ILE HD13 H 1 0.724 0.030 . 1 . . . . A 30 ILE HD13 . 36332 1 401 . 1 . 1 30 30 ILE C C 13 174.467 0.300 . 1 . . . . A 30 ILE C . 36332 1 402 . 1 . 1 30 30 ILE CA C 13 60.042 0.300 . 1 . . . . A 30 ILE CA . 36332 1 403 . 1 . 1 30 30 ILE CB C 13 39.702 0.300 . 1 . . . . A 30 ILE CB . 36332 1 404 . 1 . 1 30 30 ILE CG1 C 13 27.492 0.300 . 1 . . . . A 30 ILE CG1 . 36332 1 405 . 1 . 1 30 30 ILE CG2 C 13 17.772 0.300 . 1 . . . . A 30 ILE CG2 . 36332 1 406 . 1 . 1 30 30 ILE CD1 C 13 15.147 0.300 . 1 . . . . A 30 ILE CD1 . 36332 1 407 . 1 . 1 30 30 ILE N N 15 126.751 0.300 . 1 . . . . A 30 ILE N . 36332 1 408 . 1 . 1 31 31 PHE H H 1 9.215 0.030 . 1 . . . . A 31 PHE H . 36332 1 409 . 1 . 1 31 31 PHE HA H 1 5.240 0.030 . 1 . . . . A 31 PHE HA . 36332 1 410 . 1 . 1 31 31 PHE HB2 H 1 3.028 0.030 . 1 . . . . A 31 PHE HB2 . 36332 1 411 . 1 . 1 31 31 PHE HB3 H 1 3.028 0.030 . 1 . . . . A 31 PHE HB3 . 36332 1 412 . 1 . 1 31 31 PHE HD1 H 1 6.930 0.030 . 1 . . . . A 31 PHE HD1 . 36332 1 413 . 1 . 1 31 31 PHE HD2 H 1 6.930 0.030 . 1 . . . . A 31 PHE HD2 . 36332 1 414 . 1 . 1 31 31 PHE HE1 H 1 6.920 0.030 . 1 . . . . A 31 PHE HE1 . 36332 1 415 . 1 . 1 31 31 PHE HE2 H 1 6.920 0.030 . 1 . . . . A 31 PHE HE2 . 36332 1 416 . 1 . 1 31 31 PHE HZ H 1 6.928 0.030 . 1 . . . . A 31 PHE HZ . 36332 1 417 . 1 . 1 31 31 PHE C C 13 176.654 0.300 . 1 . . . . A 31 PHE C . 36332 1 418 . 1 . 1 31 31 PHE CA C 13 55.891 0.300 . 1 . . . . A 31 PHE CA . 36332 1 419 . 1 . 1 31 31 PHE CB C 13 39.682 0.300 . 1 . . . . A 31 PHE CB . 36332 1 420 . 1 . 1 31 31 PHE CD1 C 13 132.231 0.300 . 1 . . . . A 31 PHE CD1 . 36332 1 421 . 1 . 1 31 31 PHE CD2 C 13 132.231 0.300 . 1 . . . . A 31 PHE CD2 . 36332 1 422 . 1 . 1 31 31 PHE CE1 C 13 130.750 0.300 . 1 . . . . A 31 PHE CE1 . 36332 1 423 . 1 . 1 31 31 PHE CE2 C 13 130.750 0.300 . 1 . . . . A 31 PHE CE2 . 36332 1 424 . 1 . 1 31 31 PHE N N 15 127.016 0.300 . 1 . . . . A 31 PHE N . 36332 1 425 . 1 . 1 32 32 THR H H 1 8.796 0.030 . 1 . . . . A 32 THR H . 36332 1 426 . 1 . 1 32 32 THR HA H 1 4.567 0.030 . 1 . . . . A 32 THR HA . 36332 1 427 . 1 . 1 32 32 THR HG21 H 1 1.173 0.030 . 1 . . . . A 32 THR HG21 . 36332 1 428 . 1 . 1 32 32 THR HG22 H 1 1.173 0.030 . 1 . . . . A 32 THR HG22 . 36332 1 429 . 1 . 1 32 32 THR HG23 H 1 1.173 0.030 . 1 . . . . A 32 THR HG23 . 36332 1 430 . 1 . 1 32 32 THR C C 13 176.669 0.300 . 1 . . . . A 32 THR C . 36332 1 431 . 1 . 1 32 32 THR CA C 13 61.799 0.300 . 1 . . . . A 32 THR CA . 36332 1 432 . 1 . 1 32 32 THR CB C 13 70.597 0.300 . 1 . . . . A 32 THR CB . 36332 1 433 . 1 . 1 32 32 THR CG2 C 13 21.898 0.300 . 1 . . . . A 32 THR CG2 . 36332 1 434 . 1 . 1 32 32 THR N N 15 116.332 0.300 . 1 . . . . A 32 THR N . 36332 1 435 . 1 . 1 33 33 SER H H 1 9.120 0.030 . 1 . . . . A 33 SER H . 36332 1 436 . 1 . 1 33 33 SER HA H 1 3.898 0.030 . 1 . . . . A 33 SER HA . 36332 1 437 . 1 . 1 33 33 SER HB2 H 1 3.999 0.030 . 1 . . . . A 33 SER HB2 . 36332 1 438 . 1 . 1 33 33 SER HB3 H 1 3.999 0.030 . 1 . . . . A 33 SER HB3 . 36332 1 439 . 1 . 1 33 33 SER C C 13 174.898 0.300 . 1 . . . . A 33 SER C . 36332 1 440 . 1 . 1 33 33 SER CA C 13 60.778 0.300 . 1 . . . . A 33 SER CA . 36332 1 441 . 1 . 1 33 33 SER CB C 13 63.370 0.300 . 1 . . . . A 33 SER CB . 36332 1 442 . 1 . 1 33 33 SER N N 15 116.381 0.300 . 1 . . . . A 33 SER N . 36332 1 443 . 1 . 1 34 34 ASP H H 1 7.835 0.030 . 1 . . . . A 34 ASP H . 36332 1 444 . 1 . 1 34 34 ASP HA H 1 4.696 0.030 . 1 . . . . A 34 ASP HA . 36332 1 445 . 1 . 1 34 34 ASP HB2 H 1 2.640 0.030 . 2 . . . . A 34 ASP HB2 . 36332 1 446 . 1 . 1 34 34 ASP HB3 H 1 2.863 0.030 . 2 . . . . A 34 ASP HB3 . 36332 1 447 . 1 . 1 34 34 ASP C C 13 176.474 0.300 . 1 . . . . A 34 ASP C . 36332 1 448 . 1 . 1 34 34 ASP CA C 13 53.443 0.300 . 1 . . . . A 34 ASP CA . 36332 1 449 . 1 . 1 34 34 ASP CB C 13 40.459 0.300 . 1 . . . . A 34 ASP CB . 36332 1 450 . 1 . 1 34 34 ASP N N 15 118.162 0.300 . 1 . . . . A 34 ASP N . 36332 1 451 . 1 . 1 35 35 GLY H H 1 7.923 0.030 . 1 . . . . A 35 GLY H . 36332 1 452 . 1 . 1 35 35 GLY HA2 H 1 3.330 0.030 . 2 . . . . A 35 GLY HA2 . 36332 1 453 . 1 . 1 35 35 GLY HA3 H 1 4.033 0.030 . 2 . . . . A 35 GLY HA3 . 36332 1 454 . 1 . 1 35 35 GLY C C 13 174.189 0.300 . 1 . . . . A 35 GLY C . 36332 1 455 . 1 . 1 35 35 GLY CA C 13 45.784 0.300 . 1 . . . . A 35 GLY CA . 36332 1 456 . 1 . 1 35 35 GLY N N 15 107.931 0.300 . 1 . . . . A 35 GLY N . 36332 1 457 . 1 . 1 36 36 THR H H 1 7.642 0.030 . 1 . . . . A 36 THR H . 36332 1 458 . 1 . 1 36 36 THR HA H 1 4.682 0.030 . 1 . . . . A 36 THR HA . 36332 1 459 . 1 . 1 36 36 THR HB H 1 4.187 0.030 . 1 . . . . A 36 THR HB . 36332 1 460 . 1 . 1 36 36 THR HG21 H 1 1.083 0.030 . 1 . . . . A 36 THR HG21 . 36332 1 461 . 1 . 1 36 36 THR HG22 H 1 1.083 0.030 . 1 . . . . A 36 THR HG22 . 36332 1 462 . 1 . 1 36 36 THR HG23 H 1 1.083 0.030 . 1 . . . . A 36 THR HG23 . 36332 1 463 . 1 . 1 36 36 THR C C 13 173.257 0.300 . 1 . . . . A 36 THR C . 36332 1 464 . 1 . 1 36 36 THR CA C 13 61.896 0.300 . 1 . . . . A 36 THR CA . 36332 1 465 . 1 . 1 36 36 THR CB C 13 70.025 0.300 . 1 . . . . A 36 THR CB . 36332 1 466 . 1 . 1 36 36 THR CG2 C 13 21.837 0.300 . 1 . . . . A 36 THR CG2 . 36332 1 467 . 1 . 1 36 36 THR N N 15 115.238 0.300 . 1 . . . . A 36 THR N . 36332 1 468 . 1 . 1 37 37 ILE H H 1 8.481 0.030 . 1 . . . . A 37 ILE H . 36332 1 469 . 1 . 1 37 37 ILE HA H 1 5.161 0.030 . 1 . . . . A 37 ILE HA . 36332 1 470 . 1 . 1 37 37 ILE HB H 1 1.533 0.030 . 1 . . . . A 37 ILE HB . 36332 1 471 . 1 . 1 37 37 ILE HG21 H 1 0.494 0.030 . 1 . . . . A 37 ILE HG21 . 36332 1 472 . 1 . 1 37 37 ILE HG22 H 1 0.494 0.030 . 1 . . . . A 37 ILE HG22 . 36332 1 473 . 1 . 1 37 37 ILE HG23 H 1 0.494 0.030 . 1 . . . . A 37 ILE HG23 . 36332 1 474 . 1 . 1 37 37 ILE HD11 H 1 0.631 0.030 . 1 . . . . A 37 ILE HD11 . 36332 1 475 . 1 . 1 37 37 ILE HD12 H 1 0.631 0.030 . 1 . . . . A 37 ILE HD12 . 36332 1 476 . 1 . 1 37 37 ILE HD13 H 1 0.631 0.030 . 1 . . . . A 37 ILE HD13 . 36332 1 477 . 1 . 1 37 37 ILE C C 13 175.461 0.300 . 1 . . . . A 37 ILE C . 36332 1 478 . 1 . 1 37 37 ILE CA C 13 59.961 0.300 . 1 . . . . A 37 ILE CA . 36332 1 479 . 1 . 1 37 37 ILE CB C 13 40.203 0.300 . 1 . . . . A 37 ILE CB . 36332 1 480 . 1 . 1 37 37 ILE CG1 C 13 28.035 0.300 . 1 . . . . A 37 ILE CG1 . 36332 1 481 . 1 . 1 37 37 ILE CG2 C 13 18.051 0.300 . 1 . . . . A 37 ILE CG2 . 36332 1 482 . 1 . 1 37 37 ILE CD1 C 13 13.954 0.300 . 1 . . . . A 37 ILE CD1 . 36332 1 483 . 1 . 1 37 37 ILE N N 15 123.501 0.300 . 1 . . . . A 37 ILE N . 36332 1 484 . 1 . 1 38 38 LYS H H 1 8.974 0.030 . 1 . . . . A 38 LYS H . 36332 1 485 . 1 . 1 38 38 LYS HA H 1 4.817 0.030 . 1 . . . . A 38 LYS HA . 36332 1 486 . 1 . 1 38 38 LYS HB2 H 1 1.534 0.030 . 2 . . . . A 38 LYS HB2 . 36332 1 487 . 1 . 1 38 38 LYS HB3 H 1 1.770 0.030 . 2 . . . . A 38 LYS HB3 . 36332 1 488 . 1 . 1 38 38 LYS HG2 H 1 1.308 0.030 . 1 . . . . A 38 LYS HG2 . 36332 1 489 . 1 . 1 38 38 LYS HG3 H 1 1.308 0.030 . 1 . . . . A 38 LYS HG3 . 36332 1 490 . 1 . 1 38 38 LYS HD2 H 1 1.308 0.030 . 1 . . . . A 38 LYS HD2 . 36332 1 491 . 1 . 1 38 38 LYS HD3 H 1 1.308 0.030 . 1 . . . . A 38 LYS HD3 . 36332 1 492 . 1 . 1 38 38 LYS HE2 H 1 2.844 0.030 . 1 . . . . A 38 LYS HE2 . 36332 1 493 . 1 . 1 38 38 LYS HE3 H 1 2.844 0.030 . 1 . . . . A 38 LYS HE3 . 36332 1 494 . 1 . 1 38 38 LYS C C 13 174.552 0.300 . 1 . . . . A 38 LYS C . 36332 1 495 . 1 . 1 38 38 LYS CA C 13 54.361 0.300 . 1 . . . . A 38 LYS CA . 36332 1 496 . 1 . 1 38 38 LYS CB C 13 35.761 0.300 . 1 . . . . A 38 LYS CB . 36332 1 497 . 1 . 1 38 38 LYS CG C 13 25.210 0.300 . 1 . . . . A 38 LYS CG . 36332 1 498 . 1 . 1 38 38 LYS CE C 13 42.038 0.300 . 1 . . . . A 38 LYS CE . 36332 1 499 . 1 . 1 38 38 LYS N N 15 125.780 0.300 . 1 . . . . A 38 LYS N . 36332 1 500 . 1 . 1 39 39 VAL H H 1 8.331 0.030 . 1 . . . . A 39 VAL H . 36332 1 501 . 1 . 1 39 39 VAL HA H 1 4.977 0.030 . 1 . . . . A 39 VAL HA . 36332 1 502 . 1 . 1 39 39 VAL HB H 1 1.800 0.030 . 1 . . . . A 39 VAL HB . 36332 1 503 . 1 . 1 39 39 VAL HG11 H 1 0.710 0.030 . 2 . . . . A 39 VAL HG11 . 36332 1 504 . 1 . 1 39 39 VAL HG12 H 1 0.710 0.030 . 2 . . . . A 39 VAL HG12 . 36332 1 505 . 1 . 1 39 39 VAL HG13 H 1 0.710 0.030 . 2 . . . . A 39 VAL HG13 . 36332 1 506 . 1 . 1 39 39 VAL HG21 H 1 0.664 0.030 . 2 . . . . A 39 VAL HG21 . 36332 1 507 . 1 . 1 39 39 VAL HG22 H 1 0.664 0.030 . 2 . . . . A 39 VAL HG22 . 36332 1 508 . 1 . 1 39 39 VAL HG23 H 1 0.664 0.030 . 2 . . . . A 39 VAL HG23 . 36332 1 509 . 1 . 1 39 39 VAL C C 13 174.326 0.300 . 1 . . . . A 39 VAL C . 36332 1 510 . 1 . 1 39 39 VAL CA C 13 60.602 0.300 . 1 . . . . A 39 VAL CA . 36332 1 511 . 1 . 1 39 39 VAL CB C 13 34.439 0.300 . 1 . . . . A 39 VAL CB . 36332 1 512 . 1 . 1 39 39 VAL CG1 C 13 21.119 0.300 . 2 . . . . A 39 VAL CG1 . 36332 1 513 . 1 . 1 39 39 VAL CG2 C 13 21.263 0.300 . 2 . . . . A 39 VAL CG2 . 36332 1 514 . 1 . 1 39 39 VAL N N 15 120.133 0.300 . 1 . . . . A 39 VAL N . 36332 1 515 . 1 . 1 40 40 ILE H H 1 8.946 0.030 . 1 . . . . A 40 ILE H . 36332 1 516 . 1 . 1 40 40 ILE HA H 1 4.612 0.030 . 1 . . . . A 40 ILE HA . 36332 1 517 . 1 . 1 40 40 ILE HB H 1 1.819 0.030 . 1 . . . . A 40 ILE HB . 36332 1 518 . 1 . 1 40 40 ILE HG12 H 1 1.189 0.030 . 2 . . . . A 40 ILE HG12 . 36332 1 519 . 1 . 1 40 40 ILE HG13 H 1 1.359 0.030 . 2 . . . . A 40 ILE HG13 . 36332 1 520 . 1 . 1 40 40 ILE HG21 H 1 0.640 0.030 . 1 . . . . A 40 ILE HG21 . 36332 1 521 . 1 . 1 40 40 ILE HG22 H 1 0.640 0.030 . 1 . . . . A 40 ILE HG22 . 36332 1 522 . 1 . 1 40 40 ILE HG23 H 1 0.640 0.030 . 1 . . . . A 40 ILE HG23 . 36332 1 523 . 1 . 1 40 40 ILE HD11 H 1 0.717 0.030 . 1 . . . . A 40 ILE HD11 . 36332 1 524 . 1 . 1 40 40 ILE HD12 H 1 0.717 0.030 . 1 . . . . A 40 ILE HD12 . 36332 1 525 . 1 . 1 40 40 ILE HD13 H 1 0.717 0.030 . 1 . . . . A 40 ILE HD13 . 36332 1 526 . 1 . 1 40 40 ILE C C 13 174.492 0.300 . 1 . . . . A 40 ILE C . 36332 1 527 . 1 . 1 40 40 ILE CA C 13 59.813 0.300 . 1 . . . . A 40 ILE CA . 36332 1 528 . 1 . 1 40 40 ILE CB C 13 40.836 0.300 . 1 . . . . A 40 ILE CB . 36332 1 529 . 1 . 1 40 40 ILE CG1 C 13 28.410 0.300 . 1 . . . . A 40 ILE CG1 . 36332 1 530 . 1 . 1 40 40 ILE CG2 C 13 17.519 0.300 . 1 . . . . A 40 ILE CG2 . 36332 1 531 . 1 . 1 40 40 ILE CD1 C 13 13.456 0.300 . 1 . . . . A 40 ILE CD1 . 36332 1 532 . 1 . 1 40 40 ILE N N 15 126.272 0.300 . 1 . . . . A 40 ILE N . 36332 1 533 . 1 . 1 41 41 ILE H H 1 8.347 0.030 . 1 . . . . A 41 ILE H . 36332 1 534 . 1 . 1 41 41 ILE HA H 1 4.618 0.030 . 1 . . . . A 41 ILE HA . 36332 1 535 . 1 . 1 41 41 ILE HB H 1 1.943 0.030 . 1 . . . . A 41 ILE HB . 36332 1 536 . 1 . 1 41 41 ILE HG21 H 1 0.722 0.030 . 1 . . . . A 41 ILE HG21 . 36332 1 537 . 1 . 1 41 41 ILE HG22 H 1 0.722 0.030 . 1 . . . . A 41 ILE HG22 . 36332 1 538 . 1 . 1 41 41 ILE HG23 H 1 0.722 0.030 . 1 . . . . A 41 ILE HG23 . 36332 1 539 . 1 . 1 41 41 ILE HD11 H 1 0.619 0.030 . 1 . . . . A 41 ILE HD11 . 36332 1 540 . 1 . 1 41 41 ILE HD12 H 1 0.619 0.030 . 1 . . . . A 41 ILE HD12 . 36332 1 541 . 1 . 1 41 41 ILE HD13 H 1 0.619 0.030 . 1 . . . . A 41 ILE HD13 . 36332 1 542 . 1 . 1 41 41 ILE C C 13 173.798 0.300 . 1 . . . . A 41 ILE C . 36332 1 543 . 1 . 1 41 41 ILE CA C 13 59.272 0.300 . 1 . . . . A 41 ILE CA . 36332 1 544 . 1 . 1 41 41 ILE CB C 13 38.664 0.300 . 1 . . . . A 41 ILE CB . 36332 1 545 . 1 . 1 41 41 ILE CG1 C 13 28.037 0.300 . 1 . . . . A 41 ILE CG1 . 36332 1 546 . 1 . 1 41 41 ILE CG2 C 13 17.930 0.300 . 1 . . . . A 41 ILE CG2 . 36332 1 547 . 1 . 1 41 41 ILE CD1 C 13 13.068 0.300 . 1 . . . . A 41 ILE CD1 . 36332 1 548 . 1 . 1 41 41 ILE N N 15 125.943 0.300 . 1 . . . . A 41 ILE N . 36332 1 549 . 1 . 1 42 42 VAL H H 1 9.241 0.030 . 1 . . . . A 42 VAL H . 36332 1 550 . 1 . 1 42 42 VAL HA H 1 4.654 0.030 . 1 . . . . A 42 VAL HA . 36332 1 551 . 1 . 1 42 42 VAL HB H 1 2.071 0.030 . 1 . . . . A 42 VAL HB . 36332 1 552 . 1 . 1 42 42 VAL HG11 H 1 0.651 0.030 . 2 . . . . A 42 VAL HG11 . 36332 1 553 . 1 . 1 42 42 VAL HG12 H 1 0.651 0.030 . 2 . . . . A 42 VAL HG12 . 36332 1 554 . 1 . 1 42 42 VAL HG13 H 1 0.651 0.030 . 2 . . . . A 42 VAL HG13 . 36332 1 555 . 1 . 1 42 42 VAL HG21 H 1 0.845 0.030 . 2 . . . . A 42 VAL HG21 . 36332 1 556 . 1 . 1 42 42 VAL HG22 H 1 0.845 0.030 . 2 . . . . A 42 VAL HG22 . 36332 1 557 . 1 . 1 42 42 VAL HG23 H 1 0.845 0.030 . 2 . . . . A 42 VAL HG23 . 36332 1 558 . 1 . 1 42 42 VAL C C 13 174.139 0.300 . 1 . . . . A 42 VAL C . 36332 1 559 . 1 . 1 42 42 VAL CA C 13 60.433 0.300 . 1 . . . . A 42 VAL CA . 36332 1 560 . 1 . 1 42 42 VAL CB C 13 33.639 0.300 . 1 . . . . A 42 VAL CB . 36332 1 561 . 1 . 1 42 42 VAL CG1 C 13 21.454 0.300 . 2 . . . . A 42 VAL CG1 . 36332 1 562 . 1 . 1 42 42 VAL CG2 C 13 21.971 0.300 . 2 . . . . A 42 VAL CG2 . 36332 1 563 . 1 . 1 42 42 VAL N N 15 126.339 0.300 . 1 . . . . A 42 VAL N . 36332 1 564 . 1 . 1 43 43 ILE H H 1 8.695 0.030 . 1 . . . . A 43 ILE H . 36332 1 565 . 1 . 1 43 43 ILE HA H 1 4.478 0.030 . 1 . . . . A 43 ILE HA . 36332 1 566 . 1 . 1 43 43 ILE HB H 1 1.835 0.030 . 1 . . . . A 43 ILE HB . 36332 1 567 . 1 . 1 43 43 ILE HG12 H 1 1.211 0.030 . 1 . . . . A 43 ILE HG12 . 36332 1 568 . 1 . 1 43 43 ILE HG13 H 1 1.211 0.030 . 1 . . . . A 43 ILE HG13 . 36332 1 569 . 1 . 1 43 43 ILE HG21 H 1 0.769 0.030 . 1 . . . . A 43 ILE HG21 . 36332 1 570 . 1 . 1 43 43 ILE HG22 H 1 0.769 0.030 . 1 . . . . A 43 ILE HG22 . 36332 1 571 . 1 . 1 43 43 ILE HG23 H 1 0.769 0.030 . 1 . . . . A 43 ILE HG23 . 36332 1 572 . 1 . 1 43 43 ILE HD11 H 1 0.594 0.030 . 1 . . . . A 43 ILE HD11 . 36332 1 573 . 1 . 1 43 43 ILE HD12 H 1 0.594 0.030 . 1 . . . . A 43 ILE HD12 . 36332 1 574 . 1 . 1 43 43 ILE HD13 H 1 0.594 0.030 . 1 . . . . A 43 ILE HD13 . 36332 1 575 . 1 . 1 43 43 ILE C C 13 174.558 0.300 . 1 . . . . A 43 ILE C . 36332 1 576 . 1 . 1 43 43 ILE CA C 13 58.526 0.300 . 1 . . . . A 43 ILE CA . 36332 1 577 . 1 . 1 43 43 ILE CB C 13 37.621 0.300 . 1 . . . . A 43 ILE CB . 36332 1 578 . 1 . 1 43 43 ILE CG1 C 13 27.251 0.300 . 1 . . . . A 43 ILE CG1 . 36332 1 579 . 1 . 1 43 43 ILE CG2 C 13 17.516 0.300 . 1 . . . . A 43 ILE CG2 . 36332 1 580 . 1 . 1 43 43 ILE CD1 C 13 11.713 0.300 . 1 . . . . A 43 ILE CD1 . 36332 1 581 . 1 . 1 43 43 ILE N N 15 126.922 0.300 . 1 . . . . A 43 ILE N . 36332 1 582 . 1 . 1 44 44 ILE H H 1 8.818 0.030 . 1 . . . . A 44 ILE H . 36332 1 583 . 1 . 1 44 44 ILE HA H 1 4.809 0.030 . 1 . . . . A 44 ILE HA . 36332 1 584 . 1 . 1 44 44 ILE HB H 1 1.731 0.030 . 1 . . . . A 44 ILE HB . 36332 1 585 . 1 . 1 44 44 ILE HG21 H 1 0.631 0.030 . 1 . . . . A 44 ILE HG21 . 36332 1 586 . 1 . 1 44 44 ILE HG22 H 1 0.631 0.030 . 1 . . . . A 44 ILE HG22 . 36332 1 587 . 1 . 1 44 44 ILE HG23 H 1 0.631 0.030 . 1 . . . . A 44 ILE HG23 . 36332 1 588 . 1 . 1 44 44 ILE HD11 H 1 0.550 0.030 . 1 . . . . A 44 ILE HD11 . 36332 1 589 . 1 . 1 44 44 ILE HD12 H 1 0.550 0.030 . 1 . . . . A 44 ILE HD12 . 36332 1 590 . 1 . 1 44 44 ILE HD13 H 1 0.550 0.030 . 1 . . . . A 44 ILE HD13 . 36332 1 591 . 1 . 1 44 44 ILE C C 13 174.793 0.300 . 1 . . . . A 44 ILE C . 36332 1 592 . 1 . 1 44 44 ILE CA C 13 59.434 0.300 . 1 . . . . A 44 ILE CA . 36332 1 593 . 1 . 1 44 44 ILE CB C 13 38.130 0.300 . 1 . . . . A 44 ILE CB . 36332 1 594 . 1 . 1 44 44 ILE CG1 C 13 27.097 0.300 . 1 . . . . A 44 ILE CG1 . 36332 1 595 . 1 . 1 44 44 ILE CG2 C 13 17.306 0.300 . 1 . . . . A 44 ILE CG2 . 36332 1 596 . 1 . 1 44 44 ILE CD1 C 13 13.442 0.300 . 1 . . . . A 44 ILE CD1 . 36332 1 597 . 1 . 1 44 44 ILE N N 15 127.865 0.300 . 1 . . . . A 44 ILE N . 36332 1 598 . 1 . 1 45 45 ALA H H 1 8.176 0.030 . 1 . . . . A 45 ALA H . 36332 1 599 . 1 . 1 45 45 ALA HA H 1 4.793 0.030 . 1 . . . . A 45 ALA HA . 36332 1 600 . 1 . 1 45 45 ALA HB1 H 1 1.357 0.030 . 1 . . . . A 45 ALA HB1 . 36332 1 601 . 1 . 1 45 45 ALA HB2 H 1 1.357 0.030 . 1 . . . . A 45 ALA HB2 . 36332 1 602 . 1 . 1 45 45 ALA HB3 H 1 1.357 0.030 . 1 . . . . A 45 ALA HB3 . 36332 1 603 . 1 . 1 45 45 ALA C C 13 175.873 0.300 . 1 . . . . A 45 ALA C . 36332 1 604 . 1 . 1 45 45 ALA CA C 13 50.829 0.300 . 1 . . . . A 45 ALA CA . 36332 1 605 . 1 . 1 45 45 ALA CB C 13 22.998 0.300 . 1 . . . . A 45 ALA CB . 36332 1 606 . 1 . 1 45 45 ALA N N 15 127.842 0.300 . 1 . . . . A 45 ALA N . 36332 1 607 . 1 . 1 46 46 ASP H H 1 8.614 0.030 . 1 . . . . A 46 ASP H . 36332 1 608 . 1 . 1 46 46 ASP HA H 1 4.547 0.030 . 1 . . . . A 46 ASP HA . 36332 1 609 . 1 . 1 46 46 ASP HB2 H 1 2.690 0.030 . 1 . . . . A 46 ASP HB2 . 36332 1 610 . 1 . 1 46 46 ASP HB3 H 1 2.690 0.030 . 1 . . . . A 46 ASP HB3 . 36332 1 611 . 1 . 1 46 46 ASP C C 13 175.858 0.300 . 1 . . . . A 46 ASP C . 36332 1 612 . 1 . 1 46 46 ASP CA C 13 56.689 0.300 . 1 . . . . A 46 ASP CA . 36332 1 613 . 1 . 1 46 46 ASP CB C 13 41.531 0.300 . 1 . . . . A 46 ASP CB . 36332 1 614 . 1 . 1 46 46 ASP N N 15 121.615 0.300 . 1 . . . . A 46 ASP N . 36332 1 615 . 1 . 1 47 47 ASP H H 1 8.119 0.030 . 1 . . . . A 47 ASP H . 36332 1 616 . 1 . 1 47 47 ASP HA H 1 5.147 0.030 . 1 . . . . A 47 ASP HA . 36332 1 617 . 1 . 1 47 47 ASP HB2 H 1 2.555 0.030 . 1 . . . . A 47 ASP HB2 . 36332 1 618 . 1 . 1 47 47 ASP HB3 H 1 2.555 0.030 . 1 . . . . A 47 ASP HB3 . 36332 1 619 . 1 . 1 47 47 ASP C C 13 175.550 0.300 . 1 . . . . A 47 ASP C . 36332 1 620 . 1 . 1 47 47 ASP CA C 13 50.249 0.300 . 1 . . . . A 47 ASP CA . 36332 1 621 . 1 . 1 47 47 ASP CB C 13 42.409 0.300 . 1 . . . . A 47 ASP CB . 36332 1 622 . 1 . 1 47 47 ASP N N 15 118.241 0.300 . 1 . . . . A 47 ASP N . 36332 1 623 . 1 . 1 48 48 PRO HA H 1 4.335 0.030 . 1 . . . . A 48 PRO HA . 36332 1 624 . 1 . 1 48 48 PRO HB2 H 1 1.969 0.030 . 2 . . . . A 48 PRO HB2 . 36332 1 625 . 1 . 1 48 48 PRO HB3 H 1 2.349 0.030 . 2 . . . . A 48 PRO HB3 . 36332 1 626 . 1 . 1 48 48 PRO HG2 H 1 2.049 0.030 . 1 . . . . A 48 PRO HG2 . 36332 1 627 . 1 . 1 48 48 PRO HG3 H 1 2.049 0.030 . 1 . . . . A 48 PRO HG3 . 36332 1 628 . 1 . 1 48 48 PRO HD2 H 1 4.011 0.030 . 1 . . . . A 48 PRO HD2 . 36332 1 629 . 1 . 1 48 48 PRO HD3 H 1 4.011 0.030 . 1 . . . . A 48 PRO HD3 . 36332 1 630 . 1 . 1 48 48 PRO C C 13 179.155 0.300 . 1 . . . . A 48 PRO C . 36332 1 631 . 1 . 1 48 48 PRO CA C 13 64.469 0.300 . 1 . . . . A 48 PRO CA . 36332 1 632 . 1 . 1 48 48 PRO CB C 13 32.341 0.300 . 1 . . . . A 48 PRO CB . 36332 1 633 . 1 . 1 48 48 PRO CG C 13 27.236 0.300 . 1 . . . . A 48 PRO CG . 36332 1 634 . 1 . 1 48 48 PRO CD C 13 51.360 0.300 . 1 . . . . A 48 PRO CD . 36332 1 635 . 1 . 1 49 49 ASN H H 1 8.600 0.030 . 1 . . . . A 49 ASN H . 36332 1 636 . 1 . 1 49 49 ASN HA H 1 4.469 0.030 . 1 . . . . A 49 ASN HA . 36332 1 637 . 1 . 1 49 49 ASN HB2 H 1 2.699 0.030 . 2 . . . . A 49 ASN HB2 . 36332 1 638 . 1 . 1 49 49 ASN HB3 H 1 2.920 0.030 . 2 . . . . A 49 ASN HB3 . 36332 1 639 . 1 . 1 49 49 ASN HD21 H 1 8.599 0.030 . 1 . . . . A 49 ASN HD21 . 36332 1 640 . 1 . 1 49 49 ASN HD22 H 1 8.599 0.030 . 1 . . . . A 49 ASN HD22 . 36332 1 641 . 1 . 1 49 49 ASN C C 13 178.234 0.300 . 1 . . . . A 49 ASN C . 36332 1 642 . 1 . 1 49 49 ASN CA C 13 56.396 0.300 . 1 . . . . A 49 ASN CA . 36332 1 643 . 1 . 1 49 49 ASN CB C 13 38.100 0.300 . 1 . . . . A 49 ASN CB . 36332 1 644 . 1 . 1 49 49 ASN N N 15 117.135 0.300 . 1 . . . . A 49 ASN N . 36332 1 645 . 1 . 1 49 49 ASN ND2 N 15 117.134 0.300 . 1 . . . . A 49 ASN ND2 . 36332 1 646 . 1 . 1 50 50 ASP H H 1 7.892 0.030 . 1 . . . . A 50 ASP H . 36332 1 647 . 1 . 1 50 50 ASP HA H 1 4.485 0.030 . 1 . . . . A 50 ASP HA . 36332 1 648 . 1 . 1 50 50 ASP HB2 H 1 2.448 0.030 . 2 . . . . A 50 ASP HB2 . 36332 1 649 . 1 . 1 50 50 ASP HB3 H 1 2.853 0.030 . 2 . . . . A 50 ASP HB3 . 36332 1 650 . 1 . 1 50 50 ASP C C 13 178.277 0.300 . 1 . . . . A 50 ASP C . 36332 1 651 . 1 . 1 50 50 ASP CA C 13 57.007 0.300 . 1 . . . . A 50 ASP CA . 36332 1 652 . 1 . 1 50 50 ASP CB C 13 40.603 0.300 . 1 . . . . A 50 ASP CB . 36332 1 653 . 1 . 1 50 50 ASP N N 15 121.222 0.300 . 1 . . . . A 50 ASP N . 36332 1 654 . 1 . 1 51 51 ALA H H 1 7.420 0.030 . 1 . . . . A 51 ALA H . 36332 1 655 . 1 . 1 51 51 ALA HA H 1 3.845 0.030 . 1 . . . . A 51 ALA HA . 36332 1 656 . 1 . 1 51 51 ALA HB1 H 1 1.376 0.030 . 1 . . . . A 51 ALA HB1 . 36332 1 657 . 1 . 1 51 51 ALA HB2 H 1 1.376 0.030 . 1 . . . . A 51 ALA HB2 . 36332 1 658 . 1 . 1 51 51 ALA HB3 H 1 1.376 0.030 . 1 . . . . A 51 ALA HB3 . 36332 1 659 . 1 . 1 51 51 ALA C C 13 178.294 0.300 . 1 . . . . A 51 ALA C . 36332 1 660 . 1 . 1 51 51 ALA CA C 13 54.998 0.300 . 1 . . . . A 51 ALA CA . 36332 1 661 . 1 . 1 51 51 ALA CB C 13 18.823 0.300 . 1 . . . . A 51 ALA CB . 36332 1 662 . 1 . 1 51 51 ALA N N 15 119.281 0.300 . 1 . . . . A 51 ALA N . 36332 1 663 . 1 . 1 52 52 LYS H H 1 7.883 0.030 . 1 . . . . A 52 LYS H . 36332 1 664 . 1 . 1 52 52 LYS HA H 1 3.834 0.030 . 1 . . . . A 52 LYS HA . 36332 1 665 . 1 . 1 52 52 LYS HB2 H 1 1.907 0.030 . 2 . . . . A 52 LYS HB2 . 36332 1 666 . 1 . 1 52 52 LYS HB3 H 1 1.931 0.030 . 2 . . . . A 52 LYS HB3 . 36332 1 667 . 1 . 1 52 52 LYS HG2 H 1 1.555 0.030 . 1 . . . . A 52 LYS HG2 . 36332 1 668 . 1 . 1 52 52 LYS HG3 H 1 1.555 0.030 . 1 . . . . A 52 LYS HG3 . 36332 1 669 . 1 . 1 52 52 LYS C C 13 178.784 0.300 . 1 . . . . A 52 LYS C . 36332 1 670 . 1 . 1 52 52 LYS CA C 13 60.117 0.300 . 1 . . . . A 52 LYS CA . 36332 1 671 . 1 . 1 52 52 LYS CB C 13 32.457 0.300 . 1 . . . . A 52 LYS CB . 36332 1 672 . 1 . 1 52 52 LYS CG C 13 25.242 0.300 . 1 . . . . A 52 LYS CG . 36332 1 673 . 1 . 1 52 52 LYS CD C 13 25.854 0.300 . 1 . . . . A 52 LYS CD . 36332 1 674 . 1 . 1 52 52 LYS CE C 13 41.937 0.300 . 1 . . . . A 52 LYS CE . 36332 1 675 . 1 . 1 52 52 LYS N N 15 116.698 0.300 . 1 . . . . A 52 LYS N . 36332 1 676 . 1 . 1 53 53 ARG H H 1 7.554 0.030 . 1 . . . . A 53 ARG H . 36332 1 677 . 1 . 1 53 53 ARG HA H 1 4.063 0.030 . 1 . . . . A 53 ARG HA . 36332 1 678 . 1 . 1 53 53 ARG HB2 H 1 1.967 0.030 . 1 . . . . A 53 ARG HB2 . 36332 1 679 . 1 . 1 53 53 ARG HB3 H 1 1.967 0.030 . 1 . . . . A 53 ARG HB3 . 36332 1 680 . 1 . 1 53 53 ARG HG2 H 1 1.569 0.030 . 2 . . . . A 53 ARG HG2 . 36332 1 681 . 1 . 1 53 53 ARG HG3 H 1 1.807 0.030 . 2 . . . . A 53 ARG HG3 . 36332 1 682 . 1 . 1 53 53 ARG HD2 H 1 3.289 0.030 . 1 . . . . A 53 ARG HD2 . 36332 1 683 . 1 . 1 53 53 ARG HD3 H 1 3.289 0.030 . 1 . . . . A 53 ARG HD3 . 36332 1 684 . 1 . 1 53 53 ARG C C 13 178.784 0.300 . 1 . . . . A 53 ARG C . 36332 1 685 . 1 . 1 53 53 ARG CA C 13 59.466 0.300 . 1 . . . . A 53 ARG CA . 36332 1 686 . 1 . 1 53 53 ARG CB C 13 30.349 0.300 . 1 . . . . A 53 ARG CB . 36332 1 687 . 1 . 1 53 53 ARG CG C 13 28.008 0.300 . 1 . . . . A 53 ARG CG . 36332 1 688 . 1 . 1 53 53 ARG CD C 13 43.495 0.300 . 1 . . . . A 53 ARG CD . 36332 1 689 . 1 . 1 53 53 ARG N N 15 118.327 0.300 . 1 . . . . A 53 ARG N . 36332 1 690 . 1 . 1 54 54 ILE H H 1 7.743 0.030 . 1 . . . . A 54 ILE H . 36332 1 691 . 1 . 1 54 54 ILE HA H 1 3.681 0.030 . 1 . . . . A 54 ILE HA . 36332 1 692 . 1 . 1 54 54 ILE HB H 1 1.954 0.030 . 1 . . . . A 54 ILE HB . 36332 1 693 . 1 . 1 54 54 ILE HG12 H 1 1.161 0.030 . 2 . . . . A 54 ILE HG12 . 36332 1 694 . 1 . 1 54 54 ILE HG13 H 1 1.722 0.030 . 2 . . . . A 54 ILE HG13 . 36332 1 695 . 1 . 1 54 54 ILE HG21 H 1 0.880 0.030 . 1 . . . . A 54 ILE HG21 . 36332 1 696 . 1 . 1 54 54 ILE HG22 H 1 0.880 0.030 . 1 . . . . A 54 ILE HG22 . 36332 1 697 . 1 . 1 54 54 ILE HG23 H 1 0.880 0.030 . 1 . . . . A 54 ILE HG23 . 36332 1 698 . 1 . 1 54 54 ILE HD11 H 1 0.854 0.030 . 1 . . . . A 54 ILE HD11 . 36332 1 699 . 1 . 1 54 54 ILE HD12 H 1 0.854 0.030 . 1 . . . . A 54 ILE HD12 . 36332 1 700 . 1 . 1 54 54 ILE HD13 H 1 0.854 0.030 . 1 . . . . A 54 ILE HD13 . 36332 1 701 . 1 . 1 54 54 ILE C C 13 177.260 0.300 . 1 . . . . A 54 ILE C . 36332 1 702 . 1 . 1 54 54 ILE CA C 13 64.267 0.300 . 1 . . . . A 54 ILE CA . 36332 1 703 . 1 . 1 54 54 ILE CB C 13 37.687 0.300 . 1 . . . . A 54 ILE CB . 36332 1 704 . 1 . 1 54 54 ILE CG1 C 13 29.429 0.300 . 1 . . . . A 54 ILE CG1 . 36332 1 705 . 1 . 1 54 54 ILE CG2 C 13 18.881 0.300 . 1 . . . . A 54 ILE CG2 . 36332 1 706 . 1 . 1 54 54 ILE CD1 C 13 13.853 0.300 . 1 . . . . A 54 ILE CD1 . 36332 1 707 . 1 . 1 54 54 ILE N N 15 119.676 0.300 . 1 . . . . A 54 ILE N . 36332 1 708 . 1 . 1 55 55 VAL H H 1 8.549 0.030 . 1 . . . . A 55 VAL H . 36332 1 709 . 1 . 1 55 55 VAL HA H 1 3.318 0.030 . 1 . . . . A 55 VAL HA . 36332 1 710 . 1 . 1 55 55 VAL HB H 1 2.098 0.030 . 1 . . . . A 55 VAL HB . 36332 1 711 . 1 . 1 55 55 VAL HG11 H 1 0.823 0.030 . 2 . . . . A 55 VAL HG11 . 36332 1 712 . 1 . 1 55 55 VAL HG12 H 1 0.823 0.030 . 2 . . . . A 55 VAL HG12 . 36332 1 713 . 1 . 1 55 55 VAL HG13 H 1 0.823 0.030 . 2 . . . . A 55 VAL HG13 . 36332 1 714 . 1 . 1 55 55 VAL HG21 H 1 0.910 0.030 . 2 . . . . A 55 VAL HG21 . 36332 1 715 . 1 . 1 55 55 VAL HG22 H 1 0.910 0.030 . 2 . . . . A 55 VAL HG22 . 36332 1 716 . 1 . 1 55 55 VAL HG23 H 1 0.910 0.030 . 2 . . . . A 55 VAL HG23 . 36332 1 717 . 1 . 1 55 55 VAL C C 13 177.282 0.300 . 1 . . . . A 55 VAL C . 36332 1 718 . 1 . 1 55 55 VAL CA C 13 67.708 0.300 . 1 . . . . A 55 VAL CA . 36332 1 719 . 1 . 1 55 55 VAL CB C 13 31.512 0.300 . 1 . . . . A 55 VAL CB . 36332 1 720 . 1 . 1 55 55 VAL CG1 C 13 20.914 0.300 . 2 . . . . A 55 VAL CG1 . 36332 1 721 . 1 . 1 55 55 VAL CG2 C 13 23.340 0.300 . 2 . . . . A 55 VAL CG2 . 36332 1 722 . 1 . 1 55 55 VAL N N 15 120.537 0.300 . 1 . . . . A 55 VAL N . 36332 1 723 . 1 . 1 56 56 LYS H H 1 7.597 0.030 . 1 . . . . A 56 LYS H . 36332 1 724 . 1 . 1 56 56 LYS HA H 1 4.072 0.030 . 1 . . . . A 56 LYS HA . 36332 1 725 . 1 . 1 56 56 LYS HB2 H 1 1.887 0.030 . 1 . . . . A 56 LYS HB2 . 36332 1 726 . 1 . 1 56 56 LYS HB3 H 1 1.887 0.030 . 1 . . . . A 56 LYS HB3 . 36332 1 727 . 1 . 1 56 56 LYS HG2 H 1 1.474 0.030 . 1 . . . . A 56 LYS HG2 . 36332 1 728 . 1 . 1 56 56 LYS HG3 H 1 1.474 0.030 . 1 . . . . A 56 LYS HG3 . 36332 1 729 . 1 . 1 56 56 LYS HD2 H 1 1.715 0.030 . 1 . . . . A 56 LYS HD2 . 36332 1 730 . 1 . 1 56 56 LYS HD3 H 1 1.715 0.030 . 1 . . . . A 56 LYS HD3 . 36332 1 731 . 1 . 1 56 56 LYS C C 13 178.749 0.300 . 1 . . . . A 56 LYS C . 36332 1 732 . 1 . 1 56 56 LYS CA C 13 59.423 0.300 . 1 . . . . A 56 LYS CA . 36332 1 733 . 1 . 1 56 56 LYS CB C 13 32.325 0.300 . 1 . . . . A 56 LYS CB . 36332 1 734 . 1 . 1 56 56 LYS CG C 13 24.859 0.300 . 1 . . . . A 56 LYS CG . 36332 1 735 . 1 . 1 56 56 LYS CD C 13 29.124 0.300 . 1 . . . . A 56 LYS CD . 36332 1 736 . 1 . 1 56 56 LYS CE C 13 43.448 0.300 . 1 . . . . A 56 LYS CE . 36332 1 737 . 1 . 1 56 56 LYS N N 15 117.222 0.300 . 1 . . . . A 56 LYS N . 36332 1 738 . 1 . 1 57 57 LYS H H 1 7.485 0.030 . 1 . . . . A 57 LYS H . 36332 1 739 . 1 . 1 57 57 LYS HA H 1 4.097 0.030 . 1 . . . . A 57 LYS HA . 36332 1 740 . 1 . 1 57 57 LYS HB2 H 1 1.821 0.030 . 1 . . . . A 57 LYS HB2 . 36332 1 741 . 1 . 1 57 57 LYS HB3 H 1 1.821 0.030 . 1 . . . . A 57 LYS HB3 . 36332 1 742 . 1 . 1 57 57 LYS HG2 H 1 1.469 0.030 . 1 . . . . A 57 LYS HG2 . 36332 1 743 . 1 . 1 57 57 LYS HG3 H 1 1.469 0.030 . 1 . . . . A 57 LYS HG3 . 36332 1 744 . 1 . 1 57 57 LYS C C 13 179.708 0.300 . 1 . . . . A 57 LYS C . 36332 1 745 . 1 . 1 57 57 LYS CA C 13 58.527 0.300 . 1 . . . . A 57 LYS CA . 36332 1 746 . 1 . 1 57 57 LYS CB C 13 32.400 0.300 . 1 . . . . A 57 LYS CB . 36332 1 747 . 1 . 1 57 57 LYS CG C 13 25.069 0.300 . 1 . . . . A 57 LYS CG . 36332 1 748 . 1 . 1 57 57 LYS CD C 13 29.042 0.300 . 1 . . . . A 57 LYS CD . 36332 1 749 . 1 . 1 57 57 LYS CE C 13 42.064 0.300 . 1 . . . . A 57 LYS CE . 36332 1 750 . 1 . 1 57 57 LYS N N 15 117.529 0.300 . 1 . . . . A 57 LYS N . 36332 1 751 . 1 . 1 58 58 ILE H H 1 8.363 0.030 . 1 . . . . A 58 ILE H . 36332 1 752 . 1 . 1 58 58 ILE HA H 1 3.841 0.030 . 1 . . . . A 58 ILE HA . 36332 1 753 . 1 . 1 58 58 ILE HB H 1 1.988 0.030 . 1 . . . . A 58 ILE HB . 36332 1 754 . 1 . 1 58 58 ILE HG12 H 1 1.226 0.030 . 2 . . . . A 58 ILE HG12 . 36332 1 755 . 1 . 1 58 58 ILE HG13 H 1 1.714 0.030 . 2 . . . . A 58 ILE HG13 . 36332 1 756 . 1 . 1 58 58 ILE HG21 H 1 0.982 0.030 . 1 . . . . A 58 ILE HG21 . 36332 1 757 . 1 . 1 58 58 ILE HG22 H 1 0.982 0.030 . 1 . . . . A 58 ILE HG22 . 36332 1 758 . 1 . 1 58 58 ILE HG23 H 1 0.982 0.030 . 1 . . . . A 58 ILE HG23 . 36332 1 759 . 1 . 1 58 58 ILE HD11 H 1 0.728 0.030 . 1 . . . . A 58 ILE HD11 . 36332 1 760 . 1 . 1 58 58 ILE HD12 H 1 0.728 0.030 . 1 . . . . A 58 ILE HD12 . 36332 1 761 . 1 . 1 58 58 ILE HD13 H 1 0.728 0.030 . 1 . . . . A 58 ILE HD13 . 36332 1 762 . 1 . 1 58 58 ILE C C 13 177.719 0.300 . 1 . . . . A 58 ILE C . 36332 1 763 . 1 . 1 58 58 ILE CA C 13 64.676 0.300 . 1 . . . . A 58 ILE CA . 36332 1 764 . 1 . 1 58 58 ILE CB C 13 37.441 0.300 . 1 . . . . A 58 ILE CB . 36332 1 765 . 1 . 1 58 58 ILE CG1 C 13 28.427 0.300 . 1 . . . . A 58 ILE CG1 . 36332 1 766 . 1 . 1 58 58 ILE CG2 C 13 18.926 0.300 . 1 . . . . A 58 ILE CG2 . 36332 1 767 . 1 . 1 58 58 ILE CD1 C 13 13.365 0.300 . 1 . . . . A 58 ILE CD1 . 36332 1 768 . 1 . 1 58 58 ILE N N 15 118.451 0.300 . 1 . . . . A 58 ILE N . 36332 1 769 . 1 . 1 59 59 GLN H H 1 8.850 0.030 . 1 . . . . A 59 GLN H . 36332 1 770 . 1 . 1 59 59 GLN HA H 1 4.005 0.030 . 1 . . . . A 59 GLN HA . 36332 1 771 . 1 . 1 59 59 GLN HB2 H 1 2.044 0.030 . 1 . . . . A 59 GLN HB2 . 36332 1 772 . 1 . 1 59 59 GLN HB3 H 1 2.044 0.030 . 1 . . . . A 59 GLN HB3 . 36332 1 773 . 1 . 1 59 59 GLN HG2 H 1 2.548 0.030 . 1 . . . . A 59 GLN HG2 . 36332 1 774 . 1 . 1 59 59 GLN HG3 H 1 2.548 0.030 . 1 . . . . A 59 GLN HG3 . 36332 1 775 . 1 . 1 59 59 GLN HE21 H 1 7.154 0.030 . 2 . . . . A 59 GLN HE21 . 36332 1 776 . 1 . 1 59 59 GLN HE22 H 1 7.329 0.030 . 2 . . . . A 59 GLN HE22 . 36332 1 777 . 1 . 1 59 59 GLN C C 13 178.119 0.300 . 1 . . . . A 59 GLN C . 36332 1 778 . 1 . 1 59 59 GLN CA C 13 58.560 0.300 . 1 . . . . A 59 GLN CA . 36332 1 779 . 1 . 1 59 59 GLN CB C 13 28.804 0.300 . 1 . . . . A 59 GLN CB . 36332 1 780 . 1 . 1 59 59 GLN CG C 13 34.743 0.300 . 1 . . . . A 59 GLN CG . 36332 1 781 . 1 . 1 59 59 GLN N N 15 120.027 0.300 . 1 . . . . A 59 GLN N . 36332 1 782 . 1 . 1 59 59 GLN NE2 N 15 113.079 0.300 . 1 . . . . A 59 GLN NE2 . 36332 1 783 . 1 . 1 60 60 GLU H H 1 7.675 0.030 . 1 . . . . A 60 GLU H . 36332 1 784 . 1 . 1 60 60 GLU HA H 1 3.971 0.030 . 1 . . . . A 60 GLU HA . 36332 1 785 . 1 . 1 60 60 GLU HB2 H 1 2.116 0.030 . 1 . . . . A 60 GLU HB2 . 36332 1 786 . 1 . 1 60 60 GLU HB3 H 1 2.116 0.030 . 1 . . . . A 60 GLU HB3 . 36332 1 787 . 1 . 1 60 60 GLU HG2 H 1 2.470 0.030 . 1 . . . . A 60 GLU HG2 . 36332 1 788 . 1 . 1 60 60 GLU HG3 H 1 2.470 0.030 . 1 . . . . A 60 GLU HG3 . 36332 1 789 . 1 . 1 60 60 GLU C C 13 177.918 0.300 . 1 . . . . A 60 GLU C . 36332 1 790 . 1 . 1 60 60 GLU CA C 13 58.632 0.300 . 1 . . . . A 60 GLU CA . 36332 1 791 . 1 . 1 60 60 GLU CB C 13 29.802 0.300 . 1 . . . . A 60 GLU CB . 36332 1 792 . 1 . 1 60 60 GLU CG C 13 36.580 0.300 . 1 . . . . A 60 GLU CG . 36332 1 793 . 1 . 1 60 60 GLU N N 15 115.494 0.300 . 1 . . . . A 60 GLU N . 36332 1 794 . 1 . 1 61 61 ARG H H 1 7.143 0.030 . 1 . . . . A 61 ARG H . 36332 1 795 . 1 . 1 61 61 ARG HA H 1 3.987 0.030 . 1 . . . . A 61 ARG HA . 36332 1 796 . 1 . 1 61 61 ARG HB2 H 1 1.285 0.030 . 2 . . . . A 61 ARG HB2 . 36332 1 797 . 1 . 1 61 61 ARG HB3 H 1 1.557 0.030 . 2 . . . . A 61 ARG HB3 . 36332 1 798 . 1 . 1 61 61 ARG HG2 H 1 1.119 0.030 . 2 . . . . A 61 ARG HG2 . 36332 1 799 . 1 . 1 61 61 ARG HG3 H 1 1.262 0.030 . 2 . . . . A 61 ARG HG3 . 36332 1 800 . 1 . 1 61 61 ARG HD2 H 1 2.983 0.030 . 1 . . . . A 61 ARG HD2 . 36332 1 801 . 1 . 1 61 61 ARG HD3 H 1 2.983 0.030 . 1 . . . . A 61 ARG HD3 . 36332 1 802 . 1 . 1 61 61 ARG HE H 1 7.142 0.030 . 1 . . . . A 61 ARG HE . 36332 1 803 . 1 . 1 61 61 ARG C C 13 175.785 0.300 . 1 . . . . A 61 ARG C . 36332 1 804 . 1 . 1 61 61 ARG CA C 13 57.095 0.300 . 1 . . . . A 61 ARG CA . 36332 1 805 . 1 . 1 61 61 ARG CB C 13 31.436 0.300 . 1 . . . . A 61 ARG CB . 36332 1 806 . 1 . 1 61 61 ARG CG C 13 27.052 0.300 . 1 . . . . A 61 ARG CG . 36332 1 807 . 1 . 1 61 61 ARG CD C 13 43.239 0.300 . 1 . . . . A 61 ARG CD . 36332 1 808 . 1 . 1 61 61 ARG N N 15 116.981 0.300 . 1 . . . . A 61 ARG N . 36332 1 809 . 1 . 1 62 62 PHE H H 1 8.179 0.030 . 1 . . . . A 62 PHE H . 36332 1 810 . 1 . 1 62 62 PHE HA H 1 5.110 0.030 . 1 . . . . A 62 PHE HA . 36332 1 811 . 1 . 1 62 62 PHE HB2 H 1 2.953 0.030 . 1 . . . . A 62 PHE HB2 . 36332 1 812 . 1 . 1 62 62 PHE HB3 H 1 2.953 0.030 . 1 . . . . A 62 PHE HB3 . 36332 1 813 . 1 . 1 62 62 PHE HD1 H 1 7.323 0.030 . 1 . . . . A 62 PHE HD1 . 36332 1 814 . 1 . 1 62 62 PHE HD2 H 1 7.323 0.030 . 1 . . . . A 62 PHE HD2 . 36332 1 815 . 1 . 1 62 62 PHE HE1 H 1 7.138 0.030 . 1 . . . . A 62 PHE HE1 . 36332 1 816 . 1 . 1 62 62 PHE HE2 H 1 7.138 0.030 . 1 . . . . A 62 PHE HE2 . 36332 1 817 . 1 . 1 62 62 PHE C C 13 173.374 0.300 . 1 . . . . A 62 PHE C . 36332 1 818 . 1 . 1 62 62 PHE CA C 13 54.675 0.300 . 1 . . . . A 62 PHE CA . 36332 1 819 . 1 . 1 62 62 PHE CB C 13 39.201 0.300 . 1 . . . . A 62 PHE CB . 36332 1 820 . 1 . 1 62 62 PHE CD1 C 13 133.103 0.300 . 1 . . . . A 62 PHE CD1 . 36332 1 821 . 1 . 1 62 62 PHE CD2 C 13 133.103 0.300 . 1 . . . . A 62 PHE CD2 . 36332 1 822 . 1 . 1 62 62 PHE CE1 C 13 130.258 0.300 . 1 . . . . A 62 PHE CE1 . 36332 1 823 . 1 . 1 62 62 PHE CE2 C 13 130.258 0.300 . 1 . . . . A 62 PHE CE2 . 36332 1 824 . 1 . 1 62 62 PHE N N 15 117.075 0.300 . 1 . . . . A 62 PHE N . 36332 1 825 . 1 . 1 63 63 PRO HA H 1 4.607 0.030 . 1 . . . . A 63 PRO HA . 36332 1 826 . 1 . 1 63 63 PRO HB2 H 1 1.937 0.030 . 2 . . . . A 63 PRO HB2 . 36332 1 827 . 1 . 1 63 63 PRO HB3 H 1 2.432 0.030 . 2 . . . . A 63 PRO HB3 . 36332 1 828 . 1 . 1 63 63 PRO HG2 H 1 1.926 0.030 . 2 . . . . A 63 PRO HG2 . 36332 1 829 . 1 . 1 63 63 PRO HG3 H 1 2.003 0.030 . 2 . . . . A 63 PRO HG3 . 36332 1 830 . 1 . 1 63 63 PRO HD2 H 1 3.305 0.030 . 2 . . . . A 63 PRO HD2 . 36332 1 831 . 1 . 1 63 63 PRO HD3 H 1 3.644 0.030 . 2 . . . . A 63 PRO HD3 . 36332 1 832 . 1 . 1 63 63 PRO C C 13 178.168 0.300 . 1 . . . . A 63 PRO C . 36332 1 833 . 1 . 1 63 63 PRO CA C 13 64.885 0.300 . 1 . . . . A 63 PRO CA . 36332 1 834 . 1 . 1 63 63 PRO CB C 13 32.479 0.300 . 1 . . . . A 63 PRO CB . 36332 1 835 . 1 . 1 63 63 PRO CG C 13 27.311 0.300 . 1 . . . . A 63 PRO CG . 36332 1 836 . 1 . 1 63 63 PRO CD C 13 50.395 0.300 . 1 . . . . A 63 PRO CD . 36332 1 837 . 1 . 1 64 64 LYS H H 1 8.545 0.030 . 1 . . . . A 64 LYS H . 36332 1 838 . 1 . 1 64 64 LYS HA H 1 4.346 0.030 . 1 . . . . A 64 LYS HA . 36332 1 839 . 1 . 1 64 64 LYS HB2 H 1 1.757 0.030 . 2 . . . . A 64 LYS HB2 . 36332 1 840 . 1 . 1 64 64 LYS HB3 H 1 1.927 0.030 . 2 . . . . A 64 LYS HB3 . 36332 1 841 . 1 . 1 64 64 LYS HD2 H 1 1.619 0.030 . 1 . . . . A 64 LYS HD2 . 36332 1 842 . 1 . 1 64 64 LYS HD3 H 1 1.619 0.030 . 1 . . . . A 64 LYS HD3 . 36332 1 843 . 1 . 1 64 64 LYS C C 13 176.637 0.300 . 1 . . . . A 64 LYS C . 36332 1 844 . 1 . 1 64 64 LYS CA C 13 56.190 0.300 . 1 . . . . A 64 LYS CA . 36332 1 845 . 1 . 1 64 64 LYS CB C 13 32.322 0.300 . 1 . . . . A 64 LYS CB . 36332 1 846 . 1 . 1 64 64 LYS CG C 13 25.317 0.300 . 1 . . . . A 64 LYS CG . 36332 1 847 . 1 . 1 64 64 LYS CD C 13 31.903 0.300 . 1 . . . . A 64 LYS CD . 36332 1 848 . 1 . 1 64 64 LYS CE C 13 41.952 0.300 . 1 . . . . A 64 LYS CE . 36332 1 849 . 1 . 1 64 64 LYS N N 15 115.408 0.300 . 1 . . . . A 64 LYS N . 36332 1 850 . 1 . 1 65 65 LEU H H 1 7.411 0.030 . 1 . . . . A 65 LEU H . 36332 1 851 . 1 . 1 65 65 LEU HA H 1 4.479 0.030 . 1 . . . . A 65 LEU HA . 36332 1 852 . 1 . 1 65 65 LEU HB2 H 1 1.536 0.030 . 2 . . . . A 65 LEU HB2 . 36332 1 853 . 1 . 1 65 65 LEU HB3 H 1 1.619 0.030 . 2 . . . . A 65 LEU HB3 . 36332 1 854 . 1 . 1 65 65 LEU HD11 H 1 0.717 0.030 . 2 . . . . A 65 LEU HD11 . 36332 1 855 . 1 . 1 65 65 LEU HD12 H 1 0.717 0.030 . 2 . . . . A 65 LEU HD12 . 36332 1 856 . 1 . 1 65 65 LEU HD13 H 1 0.717 0.030 . 2 . . . . A 65 LEU HD13 . 36332 1 857 . 1 . 1 65 65 LEU HD21 H 1 0.718 0.030 . 2 . . . . A 65 LEU HD21 . 36332 1 858 . 1 . 1 65 65 LEU HD22 H 1 0.718 0.030 . 2 . . . . A 65 LEU HD22 . 36332 1 859 . 1 . 1 65 65 LEU HD23 H 1 0.718 0.030 . 2 . . . . A 65 LEU HD23 . 36332 1 860 . 1 . 1 65 65 LEU C C 13 176.514 0.300 . 1 . . . . A 65 LEU C . 36332 1 861 . 1 . 1 65 65 LEU CA C 13 54.314 0.300 . 1 . . . . A 65 LEU CA . 36332 1 862 . 1 . 1 65 65 LEU CB C 13 43.804 0.300 . 1 . . . . A 65 LEU CB . 36332 1 863 . 1 . 1 65 65 LEU CD1 C 13 24.859 0.300 . 2 . . . . A 65 LEU CD1 . 36332 1 864 . 1 . 1 65 65 LEU CD2 C 13 24.664 0.300 . 2 . . . . A 65 LEU CD2 . 36332 1 865 . 1 . 1 65 65 LEU N N 15 120.298 0.300 . 1 . . . . A 65 LEU N . 36332 1 866 . 1 . 1 66 66 THR H H 1 8.717 0.030 . 1 . . . . A 66 THR H . 36332 1 867 . 1 . 1 66 66 THR HA H 1 4.359 0.030 . 1 . . . . A 66 THR HA . 36332 1 868 . 1 . 1 66 66 THR HB H 1 4.195 0.030 . 1 . . . . A 66 THR HB . 36332 1 869 . 1 . 1 66 66 THR HG21 H 1 1.181 0.030 . 1 . . . . A 66 THR HG21 . 36332 1 870 . 1 . 1 66 66 THR HG22 H 1 1.181 0.030 . 1 . . . . A 66 THR HG22 . 36332 1 871 . 1 . 1 66 66 THR HG23 H 1 1.181 0.030 . 1 . . . . A 66 THR HG23 . 36332 1 872 . 1 . 1 66 66 THR C C 13 172.364 0.300 . 1 . . . . A 66 THR C . 36332 1 873 . 1 . 1 66 66 THR CA C 13 63.841 0.300 . 1 . . . . A 66 THR CA . 36332 1 874 . 1 . 1 66 66 THR CB C 13 69.026 0.300 . 1 . . . . A 66 THR CB . 36332 1 875 . 1 . 1 66 66 THR CG2 C 13 21.908 0.300 . 1 . . . . A 66 THR CG2 . 36332 1 876 . 1 . 1 66 66 THR N N 15 121.698 0.300 . 1 . . . . A 66 THR N . 36332 1 877 . 1 . 1 67 67 ILE H H 1 8.505 0.030 . 1 . . . . A 67 ILE H . 36332 1 878 . 1 . 1 67 67 ILE HA H 1 5.124 0.030 . 1 . . . . A 67 ILE HA . 36332 1 879 . 1 . 1 67 67 ILE HB H 1 1.714 0.030 . 1 . . . . A 67 ILE HB . 36332 1 880 . 1 . 1 67 67 ILE HG12 H 1 0.998 0.030 . 2 . . . . A 67 ILE HG12 . 36332 1 881 . 1 . 1 67 67 ILE HG13 H 1 1.455 0.030 . 2 . . . . A 67 ILE HG13 . 36332 1 882 . 1 . 1 67 67 ILE HG21 H 1 0.884 0.030 . 1 . . . . A 67 ILE HG21 . 36332 1 883 . 1 . 1 67 67 ILE HG22 H 1 0.884 0.030 . 1 . . . . A 67 ILE HG22 . 36332 1 884 . 1 . 1 67 67 ILE HG23 H 1 0.884 0.030 . 1 . . . . A 67 ILE HG23 . 36332 1 885 . 1 . 1 67 67 ILE HD11 H 1 0.811 0.030 . 1 . . . . A 67 ILE HD11 . 36332 1 886 . 1 . 1 67 67 ILE HD12 H 1 0.811 0.030 . 1 . . . . A 67 ILE HD12 . 36332 1 887 . 1 . 1 67 67 ILE HD13 H 1 0.811 0.030 . 1 . . . . A 67 ILE HD13 . 36332 1 888 . 1 . 1 67 67 ILE C C 13 175.393 0.300 . 1 . . . . A 67 ILE C . 36332 1 889 . 1 . 1 67 67 ILE CA C 13 59.068 0.300 . 1 . . . . A 67 ILE CA . 36332 1 890 . 1 . 1 67 67 ILE CB C 13 39.717 0.300 . 1 . . . . A 67 ILE CB . 36332 1 891 . 1 . 1 67 67 ILE CG1 C 13 27.613 0.300 . 1 . . . . A 67 ILE CG1 . 36332 1 892 . 1 . 1 67 67 ILE CG2 C 13 18.903 0.300 . 1 . . . . A 67 ILE CG2 . 36332 1 893 . 1 . 1 67 67 ILE CD1 C 13 14.533 0.300 . 1 . . . . A 67 ILE CD1 . 36332 1 894 . 1 . 1 67 67 ILE N N 15 127.607 0.300 . 1 . . . . A 67 ILE N . 36332 1 895 . 1 . 1 68 68 LYS H H 1 9.235 0.030 . 1 . . . . A 68 LYS H . 36332 1 896 . 1 . 1 68 68 LYS HA H 1 4.786 0.030 . 1 . . . . A 68 LYS HA . 36332 1 897 . 1 . 1 68 68 LYS HB2 H 1 1.511 0.030 . 2 . . . . A 68 LYS HB2 . 36332 1 898 . 1 . 1 68 68 LYS HB3 H 1 1.966 0.030 . 2 . . . . A 68 LYS HB3 . 36332 1 899 . 1 . 1 68 68 LYS HG2 H 1 1.178 0.030 . 1 . . . . A 68 LYS HG2 . 36332 1 900 . 1 . 1 68 68 LYS HG3 H 1 1.178 0.030 . 1 . . . . A 68 LYS HG3 . 36332 1 901 . 1 . 1 68 68 LYS HE2 H 1 2.669 0.030 . 1 . . . . A 68 LYS HE2 . 36332 1 902 . 1 . 1 68 68 LYS HE3 H 1 2.669 0.030 . 1 . . . . A 68 LYS HE3 . 36332 1 903 . 1 . 1 68 68 LYS C C 13 174.129 0.300 . 1 . . . . A 68 LYS C . 36332 1 904 . 1 . 1 68 68 LYS CA C 13 53.992 0.300 . 1 . . . . A 68 LYS CA . 36332 1 905 . 1 . 1 68 68 LYS CB C 13 36.627 0.300 . 1 . . . . A 68 LYS CB . 36332 1 906 . 1 . 1 68 68 LYS CG C 13 24.777 0.300 . 1 . . . . A 68 LYS CG . 36332 1 907 . 1 . 1 68 68 LYS CD C 13 29.192 0.300 . 1 . . . . A 68 LYS CD . 36332 1 908 . 1 . 1 68 68 LYS CE C 13 41.721 0.300 . 1 . . . . A 68 LYS CE . 36332 1 909 . 1 . 1 68 68 LYS N N 15 126.458 0.300 . 1 . . . . A 68 LYS N . 36332 1 910 . 1 . 1 69 69 GLN H H 1 8.503 0.030 . 1 . . . . A 69 GLN H . 36332 1 911 . 1 . 1 69 69 GLN HA H 1 5.540 0.030 . 1 . . . . A 69 GLN HA . 36332 1 912 . 1 . 1 69 69 GLN HB2 H 1 1.952 0.030 . 1 . . . . A 69 GLN HB2 . 36332 1 913 . 1 . 1 69 69 GLN HB3 H 1 1.952 0.030 . 1 . . . . A 69 GLN HB3 . 36332 1 914 . 1 . 1 69 69 GLN HG2 H 1 2.161 0.030 . 1 . . . . A 69 GLN HG2 . 36332 1 915 . 1 . 1 69 69 GLN HG3 H 1 2.161 0.030 . 1 . . . . A 69 GLN HG3 . 36332 1 916 . 1 . 1 69 69 GLN HE21 H 1 6.571 0.030 . 2 . . . . A 69 GLN HE21 . 36332 1 917 . 1 . 1 69 69 GLN HE22 H 1 7.472 0.030 . 2 . . . . A 69 GLN HE22 . 36332 1 918 . 1 . 1 69 69 GLN C C 13 174.984 0.300 . 1 . . . . A 69 GLN C . 36332 1 919 . 1 . 1 69 69 GLN CA C 13 54.180 0.300 . 1 . . . . A 69 GLN CA . 36332 1 920 . 1 . 1 69 69 GLN CB C 13 32.441 0.300 . 1 . . . . A 69 GLN CB . 36332 1 921 . 1 . 1 69 69 GLN CG C 13 33.455 0.300 . 1 . . . . A 69 GLN CG . 36332 1 922 . 1 . 1 69 69 GLN N N 15 117.134 0.300 . 1 . . . . A 69 GLN N . 36332 1 923 . 1 . 1 69 69 GLN NE2 N 15 110.272 0.300 . 1 . . . . A 69 GLN NE2 . 36332 1 924 . 1 . 1 70 70 SER H H 1 8.398 0.030 . 1 . . . . A 70 SER H . 36332 1 925 . 1 . 1 70 70 SER HA H 1 4.649 0.030 . 1 . . . . A 70 SER HA . 36332 1 926 . 1 . 1 70 70 SER HB2 H 1 3.375 0.030 . 2 . . . . A 70 SER HB2 . 36332 1 927 . 1 . 1 70 70 SER HB3 H 1 3.535 0.030 . 2 . . . . A 70 SER HB3 . 36332 1 928 . 1 . 1 70 70 SER C C 13 173.287 0.300 . 1 . . . . A 70 SER C . 36332 1 929 . 1 . 1 70 70 SER CA C 13 57.635 0.300 . 1 . . . . A 70 SER CA . 36332 1 930 . 1 . 1 70 70 SER CB C 13 66.193 0.300 . 1 . . . . A 70 SER CB . 36332 1 931 . 1 . 1 70 70 SER N N 15 114.858 0.300 . 1 . . . . A 70 SER N . 36332 1 932 . 1 . 1 71 71 ARG CA C 13 60.171 0.300 . 1 . . . . A 71 ARG CA . 36332 1 933 . 1 . 1 71 71 ARG CB C 13 29.654 0.300 . 1 . . . . A 71 ARG CB . 36332 1 934 . 1 . 1 71 71 ARG CD C 13 41.433 0.300 . 1 . . . . A 71 ARG CD . 36332 1 935 . 1 . 1 72 72 ASN H H 1 8.263 0.030 . 1 . . . . A 72 ASN H . 36332 1 936 . 1 . 1 72 72 ASN HA H 1 4.395 0.030 . 1 . . . . A 72 ASN HA . 36332 1 937 . 1 . 1 72 72 ASN HB2 H 1 2.522 0.030 . 1 . . . . A 72 ASN HB2 . 36332 1 938 . 1 . 1 72 72 ASN HB3 H 1 2.522 0.030 . 1 . . . . A 72 ASN HB3 . 36332 1 939 . 1 . 1 72 72 ASN HD21 H 1 7.407 0.030 . 2 . . . . A 72 ASN HD21 . 36332 1 940 . 1 . 1 72 72 ASN HD22 H 1 7.965 0.030 . 2 . . . . A 72 ASN HD22 . 36332 1 941 . 1 . 1 72 72 ASN C C 13 178.393 0.300 . 1 . . . . A 72 ASN C . 36332 1 942 . 1 . 1 72 72 ASN CA C 13 56.759 0.300 . 1 . . . . A 72 ASN CA . 36332 1 943 . 1 . 1 72 72 ASN CB C 13 40.313 0.300 . 1 . . . . A 72 ASN CB . 36332 1 944 . 1 . 1 72 72 ASN N N 15 119.224 0.300 . 1 . . . . A 72 ASN N . 36332 1 945 . 1 . 1 72 72 ASN ND2 N 15 115.979 0.300 . 1 . . . . A 72 ASN ND2 . 36332 1 946 . 1 . 1 73 73 GLU H H 1 7.660 0.030 . 1 . . . . A 73 GLU H . 36332 1 947 . 1 . 1 73 73 GLU HG2 H 1 2.362 0.030 . 1 . . . . A 73 GLU HG2 . 36332 1 948 . 1 . 1 73 73 GLU HG3 H 1 2.362 0.030 . 1 . . . . A 73 GLU HG3 . 36332 1 949 . 1 . 1 73 73 GLU CA C 13 58.531 0.300 . 1 . . . . A 73 GLU CA . 36332 1 950 . 1 . 1 73 73 GLU CB C 13 30.532 0.300 . 1 . . . . A 73 GLU CB . 36332 1 951 . 1 . 1 73 73 GLU N N 15 119.756 0.300 . 1 . . . . A 73 GLU N . 36332 1 952 . 1 . 1 75 75 GLU C C 13 178.335 0.300 . 1 . . . . A 75 GLU C . 36332 1 953 . 1 . 1 75 75 GLU CA C 13 58.462 0.300 . 1 . . . . A 75 GLU CA . 36332 1 954 . 1 . 1 75 75 GLU CB C 13 29.421 0.300 . 1 . . . . A 75 GLU CB . 36332 1 955 . 1 . 1 75 75 GLU CG C 13 37.125 0.300 . 1 . . . . A 75 GLU CG . 36332 1 956 . 1 . 1 76 76 ALA H H 1 7.733 0.030 . 1 . . . . A 76 ALA H . 36332 1 957 . 1 . 1 76 76 ALA HA H 1 4.011 0.030 . 1 . . . . A 76 ALA HA . 36332 1 958 . 1 . 1 76 76 ALA HB1 H 1 1.485 0.030 . 1 . . . . A 76 ALA HB1 . 36332 1 959 . 1 . 1 76 76 ALA HB2 H 1 1.485 0.030 . 1 . . . . A 76 ALA HB2 . 36332 1 960 . 1 . 1 76 76 ALA HB3 H 1 1.485 0.030 . 1 . . . . A 76 ALA HB3 . 36332 1 961 . 1 . 1 76 76 ALA C C 13 178.949 0.300 . 1 . . . . A 76 ALA C . 36332 1 962 . 1 . 1 76 76 ALA CA C 13 55.529 0.300 . 1 . . . . A 76 ALA CA . 36332 1 963 . 1 . 1 76 76 ALA CB C 13 18.851 0.300 . 1 . . . . A 76 ALA CB . 36332 1 964 . 1 . 1 76 76 ALA N N 15 121.219 0.300 . 1 . . . . A 76 ALA N . 36332 1 965 . 1 . 1 77 77 GLU H H 1 8.329 0.030 . 1 . . . . A 77 GLU H . 36332 1 966 . 1 . 1 77 77 GLU HA H 1 3.958 0.030 . 1 . . . . A 77 GLU HA . 36332 1 967 . 1 . 1 77 77 GLU HB2 H 1 2.136 0.030 . 1 . . . . A 77 GLU HB2 . 36332 1 968 . 1 . 1 77 77 GLU HB3 H 1 2.136 0.030 . 1 . . . . A 77 GLU HB3 . 36332 1 969 . 1 . 1 77 77 GLU HG2 H 1 2.149 0.030 . 2 . . . . A 77 GLU HG2 . 36332 1 970 . 1 . 1 77 77 GLU HG3 H 1 2.360 0.030 . 2 . . . . A 77 GLU HG3 . 36332 1 971 . 1 . 1 77 77 GLU C C 13 177.884 0.300 . 1 . . . . A 77 GLU C . 36332 1 972 . 1 . 1 77 77 GLU CA C 13 60.167 0.300 . 1 . . . . A 77 GLU CA . 36332 1 973 . 1 . 1 77 77 GLU CB C 13 29.813 0.300 . 1 . . . . A 77 GLU CB . 36332 1 974 . 1 . 1 77 77 GLU CG C 13 36.958 0.300 . 1 . . . . A 77 GLU CG . 36332 1 975 . 1 . 1 77 77 GLU N N 15 116.134 0.300 . 1 . . . . A 77 GLU N . 36332 1 976 . 1 . 1 78 78 LYS H H 1 7.845 0.030 . 1 . . . . A 78 LYS H . 36332 1 977 . 1 . 1 78 78 LYS HA H 1 4.136 0.030 . 1 . . . . A 78 LYS HA . 36332 1 978 . 1 . 1 78 78 LYS HB2 H 1 1.901 0.030 . 1 . . . . A 78 LYS HB2 . 36332 1 979 . 1 . 1 78 78 LYS HB3 H 1 1.901 0.030 . 1 . . . . A 78 LYS HB3 . 36332 1 980 . 1 . 1 78 78 LYS HG2 H 1 1.437 0.030 . 1 . . . . A 78 LYS HG2 . 36332 1 981 . 1 . 1 78 78 LYS HG3 H 1 1.437 0.030 . 1 . . . . A 78 LYS HG3 . 36332 1 982 . 1 . 1 78 78 LYS C C 13 178.744 0.300 . 1 . . . . A 78 LYS C . 36332 1 983 . 1 . 1 78 78 LYS CA C 13 58.584 0.300 . 1 . . . . A 78 LYS CA . 36332 1 984 . 1 . 1 78 78 LYS CB C 13 32.462 0.300 . 1 . . . . A 78 LYS CB . 36332 1 985 . 1 . 1 78 78 LYS CG C 13 25.153 0.300 . 1 . . . . A 78 LYS CG . 36332 1 986 . 1 . 1 78 78 LYS CE C 13 42.132 0.300 . 1 . . . . A 78 LYS CE . 36332 1 987 . 1 . 1 78 78 LYS N N 15 116.601 0.300 . 1 . . . . A 78 LYS N . 36332 1 988 . 1 . 1 79 79 ARG H H 1 8.246 0.030 . 1 . . . . A 79 ARG H . 36332 1 989 . 1 . 1 79 79 ARG HA H 1 4.140 0.030 . 1 . . . . A 79 ARG HA . 36332 1 990 . 1 . 1 79 79 ARG HB2 H 1 1.906 0.030 . 1 . . . . A 79 ARG HB2 . 36332 1 991 . 1 . 1 79 79 ARG HB3 H 1 1.906 0.030 . 1 . . . . A 79 ARG HB3 . 36332 1 992 . 1 . 1 79 79 ARG HG2 H 1 1.510 0.030 . 1 . . . . A 79 ARG HG2 . 36332 1 993 . 1 . 1 79 79 ARG HG3 H 1 1.510 0.030 . 1 . . . . A 79 ARG HG3 . 36332 1 994 . 1 . 1 79 79 ARG HD2 H 1 3.182 0.030 . 1 . . . . A 79 ARG HD2 . 36332 1 995 . 1 . 1 79 79 ARG HD3 H 1 3.182 0.030 . 1 . . . . A 79 ARG HD3 . 36332 1 996 . 1 . 1 79 79 ARG C C 13 178.893 0.300 . 1 . . . . A 79 ARG C . 36332 1 997 . 1 . 1 79 79 ARG CA C 13 58.740 0.300 . 1 . . . . A 79 ARG CA . 36332 1 998 . 1 . 1 79 79 ARG CB C 13 30.401 0.300 . 1 . . . . A 79 ARG CB . 36332 1 999 . 1 . 1 79 79 ARG CG C 13 27.345 0.300 . 1 . . . . A 79 ARG CG . 36332 1 1000 . 1 . 1 79 79 ARG CD C 13 43.356 0.300 . 1 . . . . A 79 ARG CD . 36332 1 1001 . 1 . 1 79 79 ARG N N 15 118.564 0.300 . 1 . . . . A 79 ARG N . 36332 1 1002 . 1 . 1 80 80 ILE H H 1 8.091 0.030 . 1 . . . . A 80 ILE H . 36332 1 1003 . 1 . 1 80 80 ILE HA H 1 3.647 0.030 . 1 . . . . A 80 ILE HA . 36332 1 1004 . 1 . 1 80 80 ILE HB H 1 1.876 0.030 . 1 . . . . A 80 ILE HB . 36332 1 1005 . 1 . 1 80 80 ILE HG12 H 1 1.016 0.030 . 1 . . . . A 80 ILE HG12 . 36332 1 1006 . 1 . 1 80 80 ILE HG13 H 1 1.016 0.030 . 1 . . . . A 80 ILE HG13 . 36332 1 1007 . 1 . 1 80 80 ILE HG21 H 1 0.230 0.030 . 1 . . . . A 80 ILE HG21 . 36332 1 1008 . 1 . 1 80 80 ILE HG22 H 1 0.230 0.030 . 1 . . . . A 80 ILE HG22 . 36332 1 1009 . 1 . 1 80 80 ILE HG23 H 1 0.230 0.030 . 1 . . . . A 80 ILE HG23 . 36332 1 1010 . 1 . 1 80 80 ILE HD11 H 1 0.657 0.030 . 1 . . . . A 80 ILE HD11 . 36332 1 1011 . 1 . 1 80 80 ILE HD12 H 1 0.657 0.030 . 1 . . . . A 80 ILE HD12 . 36332 1 1012 . 1 . 1 80 80 ILE HD13 H 1 0.657 0.030 . 1 . . . . A 80 ILE HD13 . 36332 1 1013 . 1 . 1 80 80 ILE C C 13 177.533 0.300 . 1 . . . . A 80 ILE C . 36332 1 1014 . 1 . 1 80 80 ILE CA C 13 64.407 0.300 . 1 . . . . A 80 ILE CA . 36332 1 1015 . 1 . 1 80 80 ILE CB C 13 36.385 0.300 . 1 . . . . A 80 ILE CB . 36332 1 1016 . 1 . 1 80 80 ILE CG1 C 13 28.955 0.300 . 1 . . . . A 80 ILE CG1 . 36332 1 1017 . 1 . 1 80 80 ILE CG2 C 13 16.869 0.300 . 1 . . . . A 80 ILE CG2 . 36332 1 1018 . 1 . 1 80 80 ILE CD1 C 13 13.266 0.300 . 1 . . . . A 80 ILE CD1 . 36332 1 1019 . 1 . 1 80 80 ILE N N 15 119.693 0.300 . 1 . . . . A 80 ILE N . 36332 1 1020 . 1 . 1 81 81 GLN H H 1 7.945 0.030 . 1 . . . . A 81 GLN H . 36332 1 1021 . 1 . 1 81 81 GLN HA H 1 3.428 0.030 . 1 . . . . A 81 GLN HA . 36332 1 1022 . 1 . 1 81 81 GLN HB2 H 1 2.164 0.030 . 2 . . . . A 81 GLN HB2 . 36332 1 1023 . 1 . 1 81 81 GLN HB3 H 1 2.369 0.030 . 2 . . . . A 81 GLN HB3 . 36332 1 1024 . 1 . 1 81 81 GLN HG2 H 1 2.165 0.030 . 2 . . . . A 81 GLN HG2 . 36332 1 1025 . 1 . 1 81 81 GLN HG3 H 1 2.369 0.030 . 2 . . . . A 81 GLN HG3 . 36332 1 1026 . 1 . 1 81 81 GLN HE21 H 1 6.564 0.030 . 2 . . . . A 81 GLN HE21 . 36332 1 1027 . 1 . 1 81 81 GLN HE22 H 1 7.647 0.030 . 2 . . . . A 81 GLN HE22 . 36332 1 1028 . 1 . 1 81 81 GLN C C 13 177.466 0.300 . 1 . . . . A 81 GLN C . 36332 1 1029 . 1 . 1 81 81 GLN CA C 13 60.430 0.300 . 1 . . . . A 81 GLN CA . 36332 1 1030 . 1 . 1 81 81 GLN CB C 13 27.968 0.300 . 1 . . . . A 81 GLN CB . 36332 1 1031 . 1 . 1 81 81 GLN CG C 13 33.368 0.300 . 1 . . . . A 81 GLN CG . 36332 1 1032 . 1 . 1 81 81 GLN N N 15 119.290 0.300 . 1 . . . . A 81 GLN N . 36332 1 1033 . 1 . 1 81 81 GLN NE2 N 15 109.913 0.300 . 1 . . . . A 81 GLN NE2 . 36332 1 1034 . 1 . 1 82 82 LYS H H 1 8.047 0.030 . 1 . . . . A 82 LYS H . 36332 1 1035 . 1 . 1 82 82 LYS HA H 1 4.070 0.030 . 1 . . . . A 82 LYS HA . 36332 1 1036 . 1 . 1 82 82 LYS HB2 H 1 1.881 0.030 . 1 . . . . A 82 LYS HB2 . 36332 1 1037 . 1 . 1 82 82 LYS HB3 H 1 1.881 0.030 . 1 . . . . A 82 LYS HB3 . 36332 1 1038 . 1 . 1 82 82 LYS HG2 H 1 1.501 0.030 . 1 . . . . A 82 LYS HG2 . 36332 1 1039 . 1 . 1 82 82 LYS HG3 H 1 1.501 0.030 . 1 . . . . A 82 LYS HG3 . 36332 1 1040 . 1 . 1 82 82 LYS HE2 H 1 3.123 0.030 . 1 . . . . A 82 LYS HE2 . 36332 1 1041 . 1 . 1 82 82 LYS HE3 H 1 3.123 0.030 . 1 . . . . A 82 LYS HE3 . 36332 1 1042 . 1 . 1 82 82 LYS C C 13 178.636 0.300 . 1 . . . . A 82 LYS C . 36332 1 1043 . 1 . 1 82 82 LYS CA C 13 58.892 0.300 . 1 . . . . A 82 LYS CA . 36332 1 1044 . 1 . 1 82 82 LYS CB C 13 31.868 0.300 . 1 . . . . A 82 LYS CB . 36332 1 1045 . 1 . 1 82 82 LYS CG C 13 24.694 0.300 . 1 . . . . A 82 LYS CG . 36332 1 1046 . 1 . 1 82 82 LYS CD C 13 28.926 0.300 . 1 . . . . A 82 LYS CD . 36332 1 1047 . 1 . 1 82 82 LYS CE C 13 43.282 0.300 . 1 . . . . A 82 LYS CE . 36332 1 1048 . 1 . 1 82 82 LYS N N 15 119.457 0.300 . 1 . . . . A 82 LYS N . 36332 1 1049 . 1 . 1 83 83 GLU H H 1 7.585 0.030 . 1 . . . . A 83 GLU H . 36332 1 1050 . 1 . 1 83 83 GLU HA H 1 4.037 0.030 . 1 . . . . A 83 GLU HA . 36332 1 1051 . 1 . 1 83 83 GLU HB2 H 1 2.073 0.030 . 1 . . . . A 83 GLU HB2 . 36332 1 1052 . 1 . 1 83 83 GLU HB3 H 1 2.073 0.030 . 1 . . . . A 83 GLU HB3 . 36332 1 1053 . 1 . 1 83 83 GLU HG2 H 1 2.373 0.030 . 1 . . . . A 83 GLU HG2 . 36332 1 1054 . 1 . 1 83 83 GLU HG3 H 1 2.373 0.030 . 1 . . . . A 83 GLU HG3 . 36332 1 1055 . 1 . 1 83 83 GLU C C 13 179.284 0.300 . 1 . . . . A 83 GLU C . 36332 1 1056 . 1 . 1 83 83 GLU CA C 13 59.424 0.300 . 1 . . . . A 83 GLU CA . 36332 1 1057 . 1 . 1 83 83 GLU CB C 13 29.556 0.300 . 1 . . . . A 83 GLU CB . 36332 1 1058 . 1 . 1 83 83 GLU CG C 13 36.378 0.300 . 1 . . . . A 83 GLU CG . 36332 1 1059 . 1 . 1 83 83 GLU N N 15 119.280 0.300 . 1 . . . . A 83 GLU N . 36332 1 1060 . 1 . 1 84 84 LEU H H 1 8.170 0.030 . 1 . . . . A 84 LEU H . 36332 1 1061 . 1 . 1 84 84 LEU HA H 1 3.830 0.030 . 1 . . . . A 84 LEU HA . 36332 1 1062 . 1 . 1 84 84 LEU HB2 H 1 1.090 0.030 . 2 . . . . A 84 LEU HB2 . 36332 1 1063 . 1 . 1 84 84 LEU HB3 H 1 1.818 0.030 . 2 . . . . A 84 LEU HB3 . 36332 1 1064 . 1 . 1 84 84 LEU HG H 1 1.682 0.030 . 1 . . . . A 84 LEU HG . 36332 1 1065 . 1 . 1 84 84 LEU HD11 H 1 0.586 0.030 . 2 . . . . A 84 LEU HD11 . 36332 1 1066 . 1 . 1 84 84 LEU HD12 H 1 0.586 0.030 . 2 . . . . A 84 LEU HD12 . 36332 1 1067 . 1 . 1 84 84 LEU HD13 H 1 0.586 0.030 . 2 . . . . A 84 LEU HD13 . 36332 1 1068 . 1 . 1 84 84 LEU HD21 H 1 0.247 0.030 . 2 . . . . A 84 LEU HD21 . 36332 1 1069 . 1 . 1 84 84 LEU HD22 H 1 0.247 0.030 . 2 . . . . A 84 LEU HD22 . 36332 1 1070 . 1 . 1 84 84 LEU HD23 H 1 0.247 0.030 . 2 . . . . A 84 LEU HD23 . 36332 1 1071 . 1 . 1 84 84 LEU C C 13 179.914 0.300 . 1 . . . . A 84 LEU C . 36332 1 1072 . 1 . 1 84 84 LEU CA C 13 57.594 0.300 . 1 . . . . A 84 LEU CA . 36332 1 1073 . 1 . 1 84 84 LEU CB C 13 41.560 0.300 . 1 . . . . A 84 LEU CB . 36332 1 1074 . 1 . 1 84 84 LEU CG C 13 26.250 0.300 . 1 . . . . A 84 LEU CG . 36332 1 1075 . 1 . 1 84 84 LEU CD1 C 13 22.056 0.300 . 2 . . . . A 84 LEU CD1 . 36332 1 1076 . 1 . 1 84 84 LEU CD2 C 13 26.123 0.300 . 2 . . . . A 84 LEU CD2 . 36332 1 1077 . 1 . 1 84 84 LEU N N 15 117.781 0.300 . 1 . . . . A 84 LEU N . 36332 1 1078 . 1 . 1 85 85 GLU H H 1 8.357 0.030 . 1 . . . . A 85 GLU H . 36332 1 1079 . 1 . 1 85 85 GLU HA H 1 3.850 0.030 . 1 . . . . A 85 GLU HA . 36332 1 1080 . 1 . 1 85 85 GLU HB2 H 1 1.998 0.030 . 1 . . . . A 85 GLU HB2 . 36332 1 1081 . 1 . 1 85 85 GLU HB3 H 1 1.998 0.030 . 1 . . . . A 85 GLU HB3 . 36332 1 1082 . 1 . 1 85 85 GLU HG2 H 1 2.594 0.030 . 1 . . . . A 85 GLU HG2 . 36332 1 1083 . 1 . 1 85 85 GLU HG3 H 1 2.594 0.030 . 1 . . . . A 85 GLU HG3 . 36332 1 1084 . 1 . 1 85 85 GLU C C 13 179.231 0.300 . 1 . . . . A 85 GLU C . 36332 1 1085 . 1 . 1 85 85 GLU CA C 13 59.508 0.300 . 1 . . . . A 85 GLU CA . 36332 1 1086 . 1 . 1 85 85 GLU CB C 13 29.942 0.300 . 1 . . . . A 85 GLU CB . 36332 1 1087 . 1 . 1 85 85 GLU CG C 13 37.139 0.300 . 1 . . . . A 85 GLU CG . 36332 1 1088 . 1 . 1 85 85 GLU N N 15 120.671 0.300 . 1 . . . . A 85 GLU N . 36332 1 1089 . 1 . 1 86 86 GLU H H 1 7.826 0.030 . 1 . . . . A 86 GLU H . 36332 1 1090 . 1 . 1 86 86 GLU HA H 1 3.968 0.030 . 1 . . . . A 86 GLU HA . 36332 1 1091 . 1 . 1 86 86 GLU HB2 H 1 2.200 0.030 . 1 . . . . A 86 GLU HB2 . 36332 1 1092 . 1 . 1 86 86 GLU HB3 H 1 2.200 0.030 . 1 . . . . A 86 GLU HB3 . 36332 1 1093 . 1 . 1 86 86 GLU HG2 H 1 2.442 0.030 . 1 . . . . A 86 GLU HG2 . 36332 1 1094 . 1 . 1 86 86 GLU HG3 H 1 2.442 0.030 . 1 . . . . A 86 GLU HG3 . 36332 1 1095 . 1 . 1 86 86 GLU C C 13 178.678 0.300 . 1 . . . . A 86 GLU C . 36332 1 1096 . 1 . 1 86 86 GLU CA C 13 58.971 0.300 . 1 . . . . A 86 GLU CA . 36332 1 1097 . 1 . 1 86 86 GLU CB C 13 29.816 0.300 . 1 . . . . A 86 GLU CB . 36332 1 1098 . 1 . 1 86 86 GLU CG C 13 36.640 0.300 . 1 . . . . A 86 GLU CG . 36332 1 1099 . 1 . 1 86 86 GLU N N 15 117.896 0.300 . 1 . . . . A 86 GLU N . 36332 1 1100 . 1 . 1 87 87 ARG H H 1 7.561 0.030 . 1 . . . . A 87 ARG H . 36332 1 1101 . 1 . 1 87 87 ARG HA H 1 4.275 0.030 . 1 . . . . A 87 ARG HA . 36332 1 1102 . 1 . 1 87 87 ARG HB2 H 1 1.665 0.030 . 2 . . . . A 87 ARG HB2 . 36332 1 1103 . 1 . 1 87 87 ARG HB3 H 1 1.968 0.030 . 2 . . . . A 87 ARG HB3 . 36332 1 1104 . 1 . 1 87 87 ARG HG2 H 1 1.792 0.030 . 1 . . . . A 87 ARG HG2 . 36332 1 1105 . 1 . 1 87 87 ARG HG3 H 1 1.792 0.030 . 1 . . . . A 87 ARG HG3 . 36332 1 1106 . 1 . 1 87 87 ARG HD2 H 1 3.131 0.030 . 1 . . . . A 87 ARG HD2 . 36332 1 1107 . 1 . 1 87 87 ARG HD3 H 1 3.131 0.030 . 1 . . . . A 87 ARG HD3 . 36332 1 1108 . 1 . 1 87 87 ARG C C 13 175.858 0.300 . 1 . . . . A 87 ARG C . 36332 1 1109 . 1 . 1 87 87 ARG CA C 13 56.456 0.300 . 1 . . . . A 87 ARG CA . 36332 1 1110 . 1 . 1 87 87 ARG CB C 13 31.590 0.300 . 1 . . . . A 87 ARG CB . 36332 1 1111 . 1 . 1 87 87 ARG CG C 13 27.436 0.300 . 1 . . . . A 87 ARG CG . 36332 1 1112 . 1 . 1 87 87 ARG CD C 13 43.279 0.300 . 1 . . . . A 87 ARG CD . 36332 1 1113 . 1 . 1 87 87 ARG N N 15 114.362 0.300 . 1 . . . . A 87 ARG N . 36332 1 1114 . 1 . 1 88 88 ASN H H 1 7.577 0.030 . 1 . . . . A 88 ASN H . 36332 1 1115 . 1 . 1 88 88 ASN HA H 1 5.147 0.030 . 1 . . . . A 88 ASN HA . 36332 1 1116 . 1 . 1 88 88 ASN HB2 H 1 2.241 0.030 . 2 . . . . A 88 ASN HB2 . 36332 1 1117 . 1 . 1 88 88 ASN HB3 H 1 2.697 0.030 . 2 . . . . A 88 ASN HB3 . 36332 1 1118 . 1 . 1 88 88 ASN HD21 H 1 7.973 0.030 . 1 . . . . A 88 ASN HD21 . 36332 1 1119 . 1 . 1 88 88 ASN HD22 H 1 7.973 0.030 . 1 . . . . A 88 ASN HD22 . 36332 1 1120 . 1 . 1 88 88 ASN C C 13 180.536 0.300 . 1 . . . . A 88 ASN C . 36332 1 1121 . 1 . 1 88 88 ASN CA C 13 51.117 0.300 . 1 . . . . A 88 ASN CA . 36332 1 1122 . 1 . 1 88 88 ASN CB C 13 40.563 0.300 . 1 . . . . A 88 ASN CB . 36332 1 1123 . 1 . 1 88 88 ASN N N 15 117.114 0.300 . 1 . . . . A 88 ASN N . 36332 1 1124 . 1 . 1 88 88 ASN ND2 N 15 119.823 0.300 . 1 . . . . A 88 ASN ND2 . 36332 1 1125 . 1 . 1 89 89 PRO HA H 1 4.454 0.030 . 1 . . . . A 89 PRO HA . 36332 1 1126 . 1 . 1 89 89 PRO HB2 H 1 2.332 0.030 . 1 . . . . A 89 PRO HB2 . 36332 1 1127 . 1 . 1 89 89 PRO HB3 H 1 2.332 0.030 . 1 . . . . A 89 PRO HB3 . 36332 1 1128 . 1 . 1 89 89 PRO HG2 H 1 1.997 0.030 . 1 . . . . A 89 PRO HG2 . 36332 1 1129 . 1 . 1 89 89 PRO HG3 H 1 1.997 0.030 . 1 . . . . A 89 PRO HG3 . 36332 1 1130 . 1 . 1 89 89 PRO HD2 H 1 3.346 0.030 . 2 . . . . A 89 PRO HD2 . 36332 1 1131 . 1 . 1 89 89 PRO HD3 H 1 3.581 0.030 . 2 . . . . A 89 PRO HD3 . 36332 1 1132 . 1 . 1 89 89 PRO C C 13 176.566 0.300 . 1 . . . . A 89 PRO C . 36332 1 1133 . 1 . 1 89 89 PRO CA C 13 64.142 0.300 . 1 . . . . A 89 PRO CA . 36332 1 1134 . 1 . 1 89 89 PRO CB C 13 31.851 0.300 . 1 . . . . A 89 PRO CB . 36332 1 1135 . 1 . 1 89 89 PRO CG C 13 27.384 0.300 . 1 . . . . A 89 PRO CG . 36332 1 1136 . 1 . 1 89 89 PRO CD C 13 50.258 0.300 . 1 . . . . A 89 PRO CD . 36332 1 1137 . 1 . 1 90 90 ASN H H 1 7.414 0.030 . 1 . . . . A 90 ASN H . 36332 1 1138 . 1 . 1 90 90 ASN HA H 1 4.598 0.030 . 1 . . . . A 90 ASN HA . 36332 1 1139 . 1 . 1 90 90 ASN HB2 H 1 2.928 0.030 . 2 . . . . A 90 ASN HB2 . 36332 1 1140 . 1 . 1 90 90 ASN HB3 H 1 3.019 0.030 . 2 . . . . A 90 ASN HB3 . 36332 1 1141 . 1 . 1 90 90 ASN HD21 H 1 6.953 0.030 . 2 . . . . A 90 ASN HD21 . 36332 1 1142 . 1 . 1 90 90 ASN HD22 H 1 7.603 0.030 . 2 . . . . A 90 ASN HD22 . 36332 1 1143 . 1 . 1 90 90 ASN C C 13 173.748 0.300 . 1 . . . . A 90 ASN C . 36332 1 1144 . 1 . 1 90 90 ASN CA C 13 54.070 0.300 . 1 . . . . A 90 ASN CA . 36332 1 1145 . 1 . 1 90 90 ASN CB C 13 37.917 0.300 . 1 . . . . A 90 ASN CB . 36332 1 1146 . 1 . 1 90 90 ASN N N 15 120.362 0.300 . 1 . . . . A 90 ASN N . 36332 1 1147 . 1 . 1 90 90 ASN ND2 N 15 113.464 0.300 . 1 . . . . A 90 ASN ND2 . 36332 1 1148 . 1 . 1 91 91 ALA H H 1 7.565 0.030 . 1 . . . . A 91 ALA H . 36332 1 1149 . 1 . 1 91 91 ALA HA H 1 4.669 0.030 . 1 . . . . A 91 ALA HA . 36332 1 1150 . 1 . 1 91 91 ALA HB1 H 1 1.260 0.030 . 1 . . . . A 91 ALA HB1 . 36332 1 1151 . 1 . 1 91 91 ALA HB2 H 1 1.260 0.030 . 1 . . . . A 91 ALA HB2 . 36332 1 1152 . 1 . 1 91 91 ALA HB3 H 1 1.260 0.030 . 1 . . . . A 91 ALA HB3 . 36332 1 1153 . 1 . 1 91 91 ALA C C 13 176.831 0.300 . 1 . . . . A 91 ALA C . 36332 1 1154 . 1 . 1 91 91 ALA CA C 13 51.375 0.300 . 1 . . . . A 91 ALA CA . 36332 1 1155 . 1 . 1 91 91 ALA CB C 13 22.060 0.300 . 1 . . . . A 91 ALA CB . 36332 1 1156 . 1 . 1 91 91 ALA N N 15 120.824 0.300 . 1 . . . . A 91 ALA N . 36332 1 1157 . 1 . 1 92 92 GLU H H 1 8.330 0.030 . 1 . . . . A 92 GLU H . 36332 1 1158 . 1 . 1 92 92 GLU HA H 1 4.637 0.030 . 1 . . . . A 92 GLU HA . 36332 1 1159 . 1 . 1 92 92 GLU HB2 H 1 2.014 0.030 . 2 . . . . A 92 GLU HB2 . 36332 1 1160 . 1 . 1 92 92 GLU HB3 H 1 2.058 0.030 . 2 . . . . A 92 GLU HB3 . 36332 1 1161 . 1 . 1 92 92 GLU HG2 H 1 2.330 0.030 . 1 . . . . A 92 GLU HG2 . 36332 1 1162 . 1 . 1 92 92 GLU HG3 H 1 2.330 0.030 . 1 . . . . A 92 GLU HG3 . 36332 1 1163 . 1 . 1 92 92 GLU C C 13 175.054 0.300 . 1 . . . . A 92 GLU C . 36332 1 1164 . 1 . 1 92 92 GLU CA C 13 55.642 0.300 . 1 . . . . A 92 GLU CA . 36332 1 1165 . 1 . 1 92 92 GLU CB C 13 31.594 0.300 . 1 . . . . A 92 GLU CB . 36332 1 1166 . 1 . 1 92 92 GLU CG C 13 36.378 0.300 . 1 . . . . A 92 GLU CG . 36332 1 1167 . 1 . 1 92 92 GLU N N 15 121.175 0.300 . 1 . . . . A 92 GLU N . 36332 1 1168 . 1 . 1 93 93 ILE H H 1 8.758 0.030 . 1 . . . . A 93 ILE H . 36332 1 1169 . 1 . 1 93 93 ILE HA H 1 4.974 0.030 . 1 . . . . A 93 ILE HA . 36332 1 1170 . 1 . 1 93 93 ILE HB H 1 1.841 0.030 . 1 . . . . A 93 ILE HB . 36332 1 1171 . 1 . 1 93 93 ILE HG12 H 1 0.983 0.030 . 2 . . . . A 93 ILE HG12 . 36332 1 1172 . 1 . 1 93 93 ILE HG13 H 1 1.547 0.030 . 2 . . . . A 93 ILE HG13 . 36332 1 1173 . 1 . 1 93 93 ILE HG21 H 1 0.873 0.030 . 1 . . . . A 93 ILE HG21 . 36332 1 1174 . 1 . 1 93 93 ILE HG22 H 1 0.873 0.030 . 1 . . . . A 93 ILE HG22 . 36332 1 1175 . 1 . 1 93 93 ILE HG23 H 1 0.873 0.030 . 1 . . . . A 93 ILE HG23 . 36332 1 1176 . 1 . 1 93 93 ILE HD11 H 1 0.810 0.030 . 1 . . . . A 93 ILE HD11 . 36332 1 1177 . 1 . 1 93 93 ILE HD12 H 1 0.810 0.030 . 1 . . . . A 93 ILE HD12 . 36332 1 1178 . 1 . 1 93 93 ILE HD13 H 1 0.810 0.030 . 1 . . . . A 93 ILE HD13 . 36332 1 1179 . 1 . 1 93 93 ILE C C 13 175.469 0.300 . 1 . . . . A 93 ILE C . 36332 1 1180 . 1 . 1 93 93 ILE CA C 13 60.640 0.300 . 1 . . . . A 93 ILE CA . 36332 1 1181 . 1 . 1 93 93 ILE CB C 13 39.887 0.300 . 1 . . . . A 93 ILE CB . 36332 1 1182 . 1 . 1 93 93 ILE CG1 C 13 28.474 0.300 . 1 . . . . A 93 ILE CG1 . 36332 1 1183 . 1 . 1 93 93 ILE CG2 C 13 18.040 0.300 . 1 . . . . A 93 ILE CG2 . 36332 1 1184 . 1 . 1 93 93 ILE CD1 C 13 14.437 0.300 . 1 . . . . A 93 ILE CD1 . 36332 1 1185 . 1 . 1 93 93 ILE N N 15 126.198 0.300 . 1 . . . . A 93 ILE N . 36332 1 1186 . 1 . 1 94 94 GLN H H 1 9.103 0.030 . 1 . . . . A 94 GLN H . 36332 1 1187 . 1 . 1 94 94 GLN HA H 1 4.818 0.030 . 1 . . . . A 94 GLN HA . 36332 1 1188 . 1 . 1 94 94 GLN HB2 H 1 1.801 0.030 . 2 . . . . A 94 GLN HB2 . 36332 1 1189 . 1 . 1 94 94 GLN HB3 H 1 2.077 0.030 . 2 . . . . A 94 GLN HB3 . 36332 1 1190 . 1 . 1 94 94 GLN HG2 H 1 2.268 0.030 . 1 . . . . A 94 GLN HG2 . 36332 1 1191 . 1 . 1 94 94 GLN HG3 H 1 2.268 0.030 . 1 . . . . A 94 GLN HG3 . 36332 1 1192 . 1 . 1 94 94 GLN HE21 H 1 6.620 0.030 . 2 . . . . A 94 GLN HE21 . 36332 1 1193 . 1 . 1 94 94 GLN HE22 H 1 7.637 0.030 . 2 . . . . A 94 GLN HE22 . 36332 1 1194 . 1 . 1 94 94 GLN C C 13 173.803 0.300 . 1 . . . . A 94 GLN C . 36332 1 1195 . 1 . 1 94 94 GLN CA C 13 54.087 0.300 . 1 . . . . A 94 GLN CA . 36332 1 1196 . 1 . 1 94 94 GLN CB C 13 32.187 0.300 . 1 . . . . A 94 GLN CB . 36332 1 1197 . 1 . 1 94 94 GLN CG C 13 33.469 0.300 . 1 . . . . A 94 GLN CG . 36332 1 1198 . 1 . 1 94 94 GLN N N 15 126.267 0.300 . 1 . . . . A 94 GLN N . 36332 1 1199 . 1 . 1 94 94 GLN NE2 N 15 111.122 0.300 . 1 . . . . A 94 GLN NE2 . 36332 1 1200 . 1 . 1 95 95 VAL H H 1 8.522 0.030 . 1 . . . . A 95 VAL H . 36332 1 1201 . 1 . 1 95 95 VAL HA H 1 4.392 0.030 . 1 . . . . A 95 VAL HA . 36332 1 1202 . 1 . 1 95 95 VAL HB H 1 1.667 0.030 . 1 . . . . A 95 VAL HB . 36332 1 1203 . 1 . 1 95 95 VAL HG11 H 1 0.497 0.030 . 2 . . . . A 95 VAL HG11 . 36332 1 1204 . 1 . 1 95 95 VAL HG12 H 1 0.497 0.030 . 2 . . . . A 95 VAL HG12 . 36332 1 1205 . 1 . 1 95 95 VAL HG13 H 1 0.497 0.030 . 2 . . . . A 95 VAL HG13 . 36332 1 1206 . 1 . 1 95 95 VAL HG21 H 1 0.409 0.030 . 2 . . . . A 95 VAL HG21 . 36332 1 1207 . 1 . 1 95 95 VAL HG22 H 1 0.409 0.030 . 2 . . . . A 95 VAL HG22 . 36332 1 1208 . 1 . 1 95 95 VAL HG23 H 1 0.409 0.030 . 2 . . . . A 95 VAL HG23 . 36332 1 1209 . 1 . 1 95 95 VAL C C 13 174.586 0.300 . 1 . . . . A 95 VAL C . 36332 1 1210 . 1 . 1 95 95 VAL CA C 13 60.926 0.300 . 1 . . . . A 95 VAL CA . 36332 1 1211 . 1 . 1 95 95 VAL CB C 13 33.225 0.300 . 1 . . . . A 95 VAL CB . 36332 1 1212 . 1 . 1 95 95 VAL CG1 C 13 20.517 0.300 . 2 . . . . A 95 VAL CG1 . 36332 1 1213 . 1 . 1 95 95 VAL CG2 C 13 21.946 0.300 . 2 . . . . A 95 VAL CG2 . 36332 1 1214 . 1 . 1 95 95 VAL N N 15 123.630 0.300 . 1 . . . . A 95 VAL N . 36332 1 1215 . 1 . 1 96 96 VAL H H 1 9.073 0.030 . 1 . . . . A 96 VAL H . 36332 1 1216 . 1 . 1 96 96 VAL HA H 1 4.347 0.030 . 1 . . . . A 96 VAL HA . 36332 1 1217 . 1 . 1 96 96 VAL HB H 1 2.059 0.030 . 1 . . . . A 96 VAL HB . 36332 1 1218 . 1 . 1 96 96 VAL HG11 H 1 0.779 0.030 . 2 . . . . A 96 VAL HG11 . 36332 1 1219 . 1 . 1 96 96 VAL HG12 H 1 0.779 0.030 . 2 . . . . A 96 VAL HG12 . 36332 1 1220 . 1 . 1 96 96 VAL HG13 H 1 0.779 0.030 . 2 . . . . A 96 VAL HG13 . 36332 1 1221 . 1 . 1 96 96 VAL HG21 H 1 0.910 0.030 . 2 . . . . A 96 VAL HG21 . 36332 1 1222 . 1 . 1 96 96 VAL HG22 H 1 0.910 0.030 . 2 . . . . A 96 VAL HG22 . 36332 1 1223 . 1 . 1 96 96 VAL HG23 H 1 0.910 0.030 . 2 . . . . A 96 VAL HG23 . 36332 1 1224 . 1 . 1 96 96 VAL C C 13 176.152 0.300 . 1 . . . . A 96 VAL C . 36332 1 1225 . 1 . 1 96 96 VAL CA C 13 61.247 0.300 . 1 . . . . A 96 VAL CA . 36332 1 1226 . 1 . 1 96 96 VAL CB C 13 34.355 0.300 . 1 . . . . A 96 VAL CB . 36332 1 1227 . 1 . 1 96 96 VAL CG1 C 13 21.285 0.300 . 2 . . . . A 96 VAL CG1 . 36332 1 1228 . 1 . 1 96 96 VAL CG2 C 13 22.729 0.300 . 2 . . . . A 96 VAL CG2 . 36332 1 1229 . 1 . 1 96 96 VAL N N 15 125.388 0.300 . 1 . . . . A 96 VAL N . 36332 1 1230 . 1 . 1 97 97 ARG H H 1 9.095 0.030 . 1 . . . . A 97 ARG H . 36332 1 1231 . 1 . 1 97 97 ARG HA H 1 4.577 0.030 . 1 . . . . A 97 ARG HA . 36332 1 1232 . 1 . 1 97 97 ARG HB2 H 1 1.733 0.030 . 2 . . . . A 97 ARG HB2 . 36332 1 1233 . 1 . 1 97 97 ARG HB3 H 1 2.012 0.030 . 2 . . . . A 97 ARG HB3 . 36332 1 1234 . 1 . 1 97 97 ARG HG2 H 1 0.737 0.030 . 1 . . . . A 97 ARG HG2 . 36332 1 1235 . 1 . 1 97 97 ARG HG3 H 1 0.737 0.030 . 1 . . . . A 97 ARG HG3 . 36332 1 1236 . 1 . 1 97 97 ARG HD2 H 1 3.177 0.030 . 1 . . . . A 97 ARG HD2 . 36332 1 1237 . 1 . 1 97 97 ARG HD3 H 1 3.177 0.030 . 1 . . . . A 97 ARG HD3 . 36332 1 1238 . 1 . 1 97 97 ARG C C 13 175.697 0.300 . 1 . . . . A 97 ARG C . 36332 1 1239 . 1 . 1 97 97 ARG CA C 13 56.378 0.300 . 1 . . . . A 97 ARG CA . 36332 1 1240 . 1 . 1 97 97 ARG CB C 13 31.313 0.300 . 1 . . . . A 97 ARG CB . 36332 1 1241 . 1 . 1 97 97 ARG CG C 13 25.102 0.300 . 1 . . . . A 97 ARG CG . 36332 1 1242 . 1 . 1 97 97 ARG CD C 13 43.238 0.300 . 1 . . . . A 97 ARG CD . 36332 1 1243 . 1 . 1 97 97 ARG N N 15 123.645 0.300 . 1 . . . . A 97 ARG N . 36332 1 1244 . 1 . 1 98 98 SER H H 1 7.536 0.030 . 1 . . . . A 98 SER H . 36332 1 1245 . 1 . 1 98 98 SER HA H 1 4.578 0.030 . 1 . . . . A 98 SER HA . 36332 1 1246 . 1 . 1 98 98 SER HB2 H 1 3.951 0.030 . 2 . . . . A 98 SER HB2 . 36332 1 1247 . 1 . 1 98 98 SER HB3 H 1 4.094 0.030 . 2 . . . . A 98 SER HB3 . 36332 1 1248 . 1 . 1 98 98 SER C C 13 174.077 0.300 . 1 . . . . A 98 SER C . 36332 1 1249 . 1 . 1 98 98 SER CA C 13 57.093 0.300 . 1 . . . . A 98 SER CA . 36332 1 1250 . 1 . 1 98 98 SER CB C 13 65.889 0.300 . 1 . . . . A 98 SER CB . 36332 1 1251 . 1 . 1 98 98 SER N N 15 112.003 0.300 . 1 . . . . A 98 SER N . 36332 1 1252 . 1 . 1 99 99 GLU H H 1 9.019 0.030 . 1 . . . . A 99 GLU H . 36332 1 1253 . 1 . 1 99 99 GLU HA H 1 3.678 0.030 . 1 . . . . A 99 GLU HA . 36332 1 1254 . 1 . 1 99 99 GLU C C 13 178.547 0.300 . 1 . . . . A 99 GLU C . 36332 1 1255 . 1 . 1 99 99 GLU CA C 13 60.508 0.300 . 1 . . . . A 99 GLU CA . 36332 1 1256 . 1 . 1 99 99 GLU CB C 13 30.103 0.300 . 1 . . . . A 99 GLU CB . 36332 1 1257 . 1 . 1 99 99 GLU N N 15 121.084 0.300 . 1 . . . . A 99 GLU N . 36332 1 1258 . 1 . 1 100 100 ASP H H 1 8.240 0.030 . 1 . . . . A 100 ASP H . 36332 1 1259 . 1 . 1 100 100 ASP HA H 1 4.387 0.030 . 1 . . . . A 100 ASP HA . 36332 1 1260 . 1 . 1 100 100 ASP HB2 H 1 2.540 0.030 . 1 . . . . A 100 ASP HB2 . 36332 1 1261 . 1 . 1 100 100 ASP HB3 H 1 2.540 0.030 . 1 . . . . A 100 ASP HB3 . 36332 1 1262 . 1 . 1 100 100 ASP C C 13 178.335 0.300 . 1 . . . . A 100 ASP C . 36332 1 1263 . 1 . 1 100 100 ASP CA C 13 57.085 0.300 . 1 . . . . A 100 ASP CA . 36332 1 1264 . 1 . 1 100 100 ASP CB C 13 40.195 0.300 . 1 . . . . A 100 ASP CB . 36332 1 1265 . 1 . 1 100 100 ASP N N 15 119.224 0.300 . 1 . . . . A 100 ASP N . 36332 1 1266 . 1 . 1 101 101 GLU H H 1 7.654 0.030 . 1 . . . . A 101 GLU H . 36332 1 1267 . 1 . 1 101 101 GLU HA H 1 4.117 0.030 . 1 . . . . A 101 GLU HA . 36332 1 1268 . 1 . 1 101 101 GLU HB2 H 1 2.330 0.030 . 1 . . . . A 101 GLU HB2 . 36332 1 1269 . 1 . 1 101 101 GLU HB3 H 1 2.330 0.030 . 1 . . . . A 101 GLU HB3 . 36332 1 1270 . 1 . 1 101 101 GLU C C 13 178.376 0.300 . 1 . . . . A 101 GLU C . 36332 1 1271 . 1 . 1 101 101 GLU CA C 13 58.799 0.300 . 1 . . . . A 101 GLU CA . 36332 1 1272 . 1 . 1 101 101 GLU CB C 13 30.519 0.300 . 1 . . . . A 101 GLU CB . 36332 1 1273 . 1 . 1 101 101 GLU CG C 13 37.239 0.300 . 1 . . . . A 101 GLU CG . 36332 1 1274 . 1 . 1 101 101 GLU N N 15 119.950 0.300 . 1 . . . . A 101 GLU N . 36332 1 1275 . 1 . 1 102 102 LEU H H 1 7.584 0.030 . 1 . . . . A 102 LEU H . 36332 1 1276 . 1 . 1 102 102 LEU HA H 1 3.979 0.030 . 1 . . . . A 102 LEU HA . 36332 1 1277 . 1 . 1 102 102 LEU HB2 H 1 1.516 0.030 . 2 . . . . A 102 LEU HB2 . 36332 1 1278 . 1 . 1 102 102 LEU HB3 H 1 2.119 0.030 . 2 . . . . A 102 LEU HB3 . 36332 1 1279 . 1 . 1 102 102 LEU HG H 1 1.640 0.030 . 1 . . . . A 102 LEU HG . 36332 1 1280 . 1 . 1 102 102 LEU HD11 H 1 0.928 0.030 . 2 . . . . A 102 LEU HD11 . 36332 1 1281 . 1 . 1 102 102 LEU HD12 H 1 0.928 0.030 . 2 . . . . A 102 LEU HD12 . 36332 1 1282 . 1 . 1 102 102 LEU HD13 H 1 0.928 0.030 . 2 . . . . A 102 LEU HD13 . 36332 1 1283 . 1 . 1 102 102 LEU HD21 H 1 0.858 0.030 . 2 . . . . A 102 LEU HD21 . 36332 1 1284 . 1 . 1 102 102 LEU HD22 H 1 0.858 0.030 . 2 . . . . A 102 LEU HD22 . 36332 1 1285 . 1 . 1 102 102 LEU HD23 H 1 0.858 0.030 . 2 . . . . A 102 LEU HD23 . 36332 1 1286 . 1 . 1 102 102 LEU C C 13 177.421 0.300 . 1 . . . . A 102 LEU C . 36332 1 1287 . 1 . 1 102 102 LEU CA C 13 57.577 0.300 . 1 . . . . A 102 LEU CA . 36332 1 1288 . 1 . 1 102 102 LEU CB C 13 41.514 0.300 . 1 . . . . A 102 LEU CB . 36332 1 1289 . 1 . 1 102 102 LEU CG C 13 27.013 0.300 . 1 . . . . A 102 LEU CG . 36332 1 1290 . 1 . 1 102 102 LEU CD1 C 13 26.463 0.300 . 2 . . . . A 102 LEU CD1 . 36332 1 1291 . 1 . 1 102 102 LEU CD2 C 13 23.822 0.300 . 2 . . . . A 102 LEU CD2 . 36332 1 1292 . 1 . 1 102 102 LEU N N 15 119.038 0.300 . 1 . . . . A 102 LEU N . 36332 1 1293 . 1 . 1 103 103 LYS H H 1 7.816 0.030 . 1 . . . . A 103 LYS H . 36332 1 1294 . 1 . 1 103 103 LYS HA H 1 4.097 0.030 . 1 . . . . A 103 LYS HA . 36332 1 1295 . 1 . 1 103 103 LYS HB2 H 1 1.890 0.030 . 1 . . . . A 103 LYS HB2 . 36332 1 1296 . 1 . 1 103 103 LYS HB3 H 1 1.890 0.030 . 1 . . . . A 103 LYS HB3 . 36332 1 1297 . 1 . 1 103 103 LYS C C 13 177.642 0.300 . 1 . . . . A 103 LYS C . 36332 1 1298 . 1 . 1 103 103 LYS CA C 13 60.322 0.300 . 1 . . . . A 103 LYS CA . 36332 1 1299 . 1 . 1 103 103 LYS CB C 13 32.364 0.300 . 1 . . . . A 103 LYS CB . 36332 1 1300 . 1 . 1 103 103 LYS CD C 13 26.489 0.300 . 1 . . . . A 103 LYS CD . 36332 1 1301 . 1 . 1 103 103 LYS N N 15 118.356 0.300 . 1 . . . . A 103 LYS N . 36332 1 1302 . 1 . 1 104 104 GLU H H 1 7.572 0.030 . 1 . . . . A 104 GLU H . 36332 1 1303 . 1 . 1 104 104 GLU HA H 1 4.080 0.030 . 1 . . . . A 104 GLU HA . 36332 1 1304 . 1 . 1 104 104 GLU HB2 H 1 2.088 0.030 . 1 . . . . A 104 GLU HB2 . 36332 1 1305 . 1 . 1 104 104 GLU HB3 H 1 2.088 0.030 . 1 . . . . A 104 GLU HB3 . 36332 1 1306 . 1 . 1 104 104 GLU HG2 H 1 2.257 0.030 . 1 . . . . A 104 GLU HG2 . 36332 1 1307 . 1 . 1 104 104 GLU HG3 H 1 2.257 0.030 . 1 . . . . A 104 GLU HG3 . 36332 1 1308 . 1 . 1 104 104 GLU C C 13 179.236 0.300 . 1 . . . . A 104 GLU C . 36332 1 1309 . 1 . 1 104 104 GLU CA C 13 59.444 0.300 . 1 . . . . A 104 GLU CA . 36332 1 1310 . 1 . 1 104 104 GLU CB C 13 29.648 0.300 . 1 . . . . A 104 GLU CB . 36332 1 1311 . 1 . 1 104 104 GLU CG C 13 36.558 0.300 . 1 . . . . A 104 GLU CG . 36332 1 1312 . 1 . 1 104 104 GLU N N 15 116.624 0.300 . 1 . . . . A 104 GLU N . 36332 1 1313 . 1 . 1 105 105 ILE H H 1 7.635 0.030 . 1 . . . . A 105 ILE H . 36332 1 1314 . 1 . 1 105 105 ILE HA H 1 3.838 0.030 . 1 . . . . A 105 ILE HA . 36332 1 1315 . 1 . 1 105 105 ILE HB H 1 1.969 0.030 . 1 . . . . A 105 ILE HB . 36332 1 1316 . 1 . 1 105 105 ILE HG12 H 1 1.301 0.030 . 1 . . . . A 105 ILE HG12 . 36332 1 1317 . 1 . 1 105 105 ILE HG13 H 1 1.301 0.030 . 1 . . . . A 105 ILE HG13 . 36332 1 1318 . 1 . 1 105 105 ILE HG21 H 1 0.852 0.030 . 1 . . . . A 105 ILE HG21 . 36332 1 1319 . 1 . 1 105 105 ILE HG22 H 1 0.852 0.030 . 1 . . . . A 105 ILE HG22 . 36332 1 1320 . 1 . 1 105 105 ILE HG23 H 1 0.852 0.030 . 1 . . . . A 105 ILE HG23 . 36332 1 1321 . 1 . 1 105 105 ILE HD11 H 1 0.792 0.030 . 1 . . . . A 105 ILE HD11 . 36332 1 1322 . 1 . 1 105 105 ILE HD12 H 1 0.792 0.030 . 1 . . . . A 105 ILE HD12 . 36332 1 1323 . 1 . 1 105 105 ILE HD13 H 1 0.792 0.030 . 1 . . . . A 105 ILE HD13 . 36332 1 1324 . 1 . 1 105 105 ILE C C 13 178.365 0.300 . 1 . . . . A 105 ILE C . 36332 1 1325 . 1 . 1 105 105 ILE CA C 13 63.884 0.300 . 1 . . . . A 105 ILE CA . 36332 1 1326 . 1 . 1 105 105 ILE CB C 13 37.779 0.300 . 1 . . . . A 105 ILE CB . 36332 1 1327 . 1 . 1 105 105 ILE CG1 C 13 29.233 0.300 . 1 . . . . A 105 ILE CG1 . 36332 1 1328 . 1 . 1 105 105 ILE CG2 C 13 17.350 0.300 . 1 . . . . A 105 ILE CG2 . 36332 1 1329 . 1 . 1 105 105 ILE CD1 C 13 13.664 0.300 . 1 . . . . A 105 ILE CD1 . 36332 1 1330 . 1 . 1 105 105 ILE N N 15 118.388 0.300 . 1 . . . . A 105 ILE N . 36332 1 1331 . 1 . 1 106 106 LEU H H 1 8.392 0.030 . 1 . . . . A 106 LEU H . 36332 1 1332 . 1 . 1 106 106 LEU HA H 1 4.036 0.030 . 1 . . . . A 106 LEU HA . 36332 1 1333 . 1 . 1 106 106 LEU HB2 H 1 1.512 0.030 . 2 . . . . A 106 LEU HB2 . 36332 1 1334 . 1 . 1 106 106 LEU HB3 H 1 1.899 0.030 . 2 . . . . A 106 LEU HB3 . 36332 1 1335 . 1 . 1 106 106 LEU HG H 1 0.849 0.030 . 1 . . . . A 106 LEU HG . 36332 1 1336 . 1 . 1 106 106 LEU HD11 H 1 0.782 0.030 . 2 . . . . A 106 LEU HD11 . 36332 1 1337 . 1 . 1 106 106 LEU HD12 H 1 0.782 0.030 . 2 . . . . A 106 LEU HD12 . 36332 1 1338 . 1 . 1 106 106 LEU HD13 H 1 0.782 0.030 . 2 . . . . A 106 LEU HD13 . 36332 1 1339 . 1 . 1 106 106 LEU HD21 H 1 0.850 0.030 . 2 . . . . A 106 LEU HD21 . 36332 1 1340 . 1 . 1 106 106 LEU HD22 H 1 0.850 0.030 . 2 . . . . A 106 LEU HD22 . 36332 1 1341 . 1 . 1 106 106 LEU HD23 H 1 0.850 0.030 . 2 . . . . A 106 LEU HD23 . 36332 1 1342 . 1 . 1 106 106 LEU C C 13 179.143 0.300 . 1 . . . . A 106 LEU C . 36332 1 1343 . 1 . 1 106 106 LEU CA C 13 57.757 0.300 . 1 . . . . A 106 LEU CA . 36332 1 1344 . 1 . 1 106 106 LEU CB C 13 40.192 0.300 . 1 . . . . A 106 LEU CB . 36332 1 1345 . 1 . 1 106 106 LEU CG C 13 26.409 0.300 . 1 . . . . A 106 LEU CG . 36332 1 1346 . 1 . 1 106 106 LEU CD1 C 13 21.886 0.300 . 2 . . . . A 106 LEU CD1 . 36332 1 1347 . 1 . 1 106 106 LEU CD2 C 13 21.886 0.300 . 2 . . . . A 106 LEU CD2 . 36332 1 1348 . 1 . 1 106 106 LEU N N 15 119.728 0.300 . 1 . . . . A 106 LEU N . 36332 1 1349 . 1 . 1 107 107 ASP H H 1 8.475 0.030 . 1 . . . . A 107 ASP H . 36332 1 1350 . 1 . 1 107 107 ASP HA H 1 4.380 0.030 . 1 . . . . A 107 ASP HA . 36332 1 1351 . 1 . 1 107 107 ASP HB2 H 1 2.640 0.030 . 2 . . . . A 107 ASP HB2 . 36332 1 1352 . 1 . 1 107 107 ASP HB3 H 1 2.811 0.030 . 2 . . . . A 107 ASP HB3 . 36332 1 1353 . 1 . 1 107 107 ASP C C 13 178.995 0.300 . 1 . . . . A 107 ASP C . 36332 1 1354 . 1 . 1 107 107 ASP CA C 13 57.503 0.300 . 1 . . . . A 107 ASP CA . 36332 1 1355 . 1 . 1 107 107 ASP CB C 13 39.959 0.300 . 1 . . . . A 107 ASP CB . 36332 1 1356 . 1 . 1 107 107 ASP N N 15 119.930 0.300 . 1 . . . . A 107 ASP N . 36332 1 1357 . 1 . 1 108 108 LYS H H 1 7.454 0.030 . 1 . . . . A 108 LYS H . 36332 1 1358 . 1 . 1 108 108 LYS HA H 1 4.147 0.030 . 1 . . . . A 108 LYS HA . 36332 1 1359 . 1 . 1 108 108 LYS HB2 H 1 1.889 0.030 . 1 . . . . A 108 LYS HB2 . 36332 1 1360 . 1 . 1 108 108 LYS HB3 H 1 1.889 0.030 . 1 . . . . A 108 LYS HB3 . 36332 1 1361 . 1 . 1 108 108 LYS HG2 H 1 1.458 0.030 . 1 . . . . A 108 LYS HG2 . 36332 1 1362 . 1 . 1 108 108 LYS HG3 H 1 1.458 0.030 . 1 . . . . A 108 LYS HG3 . 36332 1 1363 . 1 . 1 108 108 LYS HD2 H 1 1.571 0.030 . 1 . . . . A 108 LYS HD2 . 36332 1 1364 . 1 . 1 108 108 LYS HD3 H 1 1.571 0.030 . 1 . . . . A 108 LYS HD3 . 36332 1 1365 . 1 . 1 108 108 LYS C C 13 179.034 0.300 . 1 . . . . A 108 LYS C . 36332 1 1366 . 1 . 1 108 108 LYS CA C 13 58.547 0.300 . 1 . . . . A 108 LYS CA . 36332 1 1367 . 1 . 1 108 108 LYS CB C 13 32.343 0.300 . 1 . . . . A 108 LYS CB . 36332 1 1368 . 1 . 1 108 108 LYS CG C 13 25.153 0.300 . 1 . . . . A 108 LYS CG . 36332 1 1369 . 1 . 1 108 108 LYS CD C 13 28.885 0.300 . 1 . . . . A 108 LYS CD . 36332 1 1370 . 1 . 1 108 108 LYS CE C 13 41.926 0.300 . 1 . . . . A 108 LYS CE . 36332 1 1371 . 1 . 1 108 108 LYS N N 15 119.048 0.300 . 1 . . . . A 108 LYS N . 36332 1 1372 . 1 . 1 109 109 LEU H H 1 7.850 0.030 . 1 . . . . A 109 LEU H . 36332 1 1373 . 1 . 1 109 109 LEU HA H 1 3.951 0.030 . 1 . . . . A 109 LEU HA . 36332 1 1374 . 1 . 1 109 109 LEU HB2 H 1 1.443 0.030 . 2 . . . . A 109 LEU HB2 . 36332 1 1375 . 1 . 1 109 109 LEU HB3 H 1 1.698 0.030 . 2 . . . . A 109 LEU HB3 . 36332 1 1376 . 1 . 1 109 109 LEU HG H 1 1.679 0.030 . 1 . . . . A 109 LEU HG . 36332 1 1377 . 1 . 1 109 109 LEU HD11 H 1 0.454 0.030 . 2 . . . . A 109 LEU HD11 . 36332 1 1378 . 1 . 1 109 109 LEU HD12 H 1 0.454 0.030 . 2 . . . . A 109 LEU HD12 . 36332 1 1379 . 1 . 1 109 109 LEU HD13 H 1 0.454 0.030 . 2 . . . . A 109 LEU HD13 . 36332 1 1380 . 1 . 1 109 109 LEU HD21 H 1 0.586 0.030 . 2 . . . . A 109 LEU HD21 . 36332 1 1381 . 1 . 1 109 109 LEU HD22 H 1 0.586 0.030 . 2 . . . . A 109 LEU HD22 . 36332 1 1382 . 1 . 1 109 109 LEU HD23 H 1 0.586 0.030 . 2 . . . . A 109 LEU HD23 . 36332 1 1383 . 1 . 1 109 109 LEU C C 13 178.894 0.300 . 1 . . . . A 109 LEU C . 36332 1 1384 . 1 . 1 109 109 LEU CA C 13 57.476 0.300 . 1 . . . . A 109 LEU CA . 36332 1 1385 . 1 . 1 109 109 LEU CB C 13 41.543 0.300 . 1 . . . . A 109 LEU CB . 36332 1 1386 . 1 . 1 109 109 LEU CG C 13 26.491 0.300 . 1 . . . . A 109 LEU CG . 36332 1 1387 . 1 . 1 109 109 LEU CD1 C 13 23.202 0.300 . 2 . . . . A 109 LEU CD1 . 36332 1 1388 . 1 . 1 109 109 LEU CD2 C 13 25.097 0.300 . 2 . . . . A 109 LEU CD2 . 36332 1 1389 . 1 . 1 109 109 LEU N N 15 120.980 0.300 . 1 . . . . A 109 LEU N . 36332 1 1390 . 1 . 1 110 110 ASP H H 1 8.272 0.030 . 1 . . . . A 110 ASP H . 36332 1 1391 . 1 . 1 110 110 ASP HA H 1 4.535 0.030 . 1 . . . . A 110 ASP HA . 36332 1 1392 . 1 . 1 110 110 ASP HB2 H 1 2.726 0.030 . 2 . . . . A 110 ASP HB2 . 36332 1 1393 . 1 . 1 110 110 ASP HB3 H 1 2.800 0.030 . 2 . . . . A 110 ASP HB3 . 36332 1 1394 . 1 . 1 110 110 ASP C C 13 178.361 0.300 . 1 . . . . A 110 ASP C . 36332 1 1395 . 1 . 1 110 110 ASP CA C 13 56.521 0.300 . 1 . . . . A 110 ASP CA . 36332 1 1396 . 1 . 1 110 110 ASP CB C 13 40.625 0.300 . 1 . . . . A 110 ASP CB . 36332 1 1397 . 1 . 1 110 110 ASP N N 15 119.791 0.300 . 1 . . . . A 110 ASP N . 36332 1 1398 . 1 . 1 111 111 GLU H H 1 7.821 0.030 . 1 . . . . A 111 GLU H . 36332 1 1399 . 1 . 1 111 111 GLU HA H 1 4.154 0.030 . 1 . . . . A 111 GLU HA . 36332 1 1400 . 1 . 1 111 111 GLU HB2 H 1 2.126 0.030 . 1 . . . . A 111 GLU HB2 . 36332 1 1401 . 1 . 1 111 111 GLU HB3 H 1 2.126 0.030 . 1 . . . . A 111 GLU HB3 . 36332 1 1402 . 1 . 1 111 111 GLU HG2 H 1 2.366 0.030 . 1 . . . . A 111 GLU HG2 . 36332 1 1403 . 1 . 1 111 111 GLU HG3 H 1 2.366 0.030 . 1 . . . . A 111 GLU HG3 . 36332 1 1404 . 1 . 1 111 111 GLU C C 13 177.878 0.300 . 1 . . . . A 111 GLU C . 36332 1 1405 . 1 . 1 111 111 GLU CA C 13 58.513 0.300 . 1 . . . . A 111 GLU CA . 36332 1 1406 . 1 . 1 111 111 GLU CB C 13 29.820 0.300 . 1 . . . . A 111 GLU CB . 36332 1 1407 . 1 . 1 111 111 GLU CG C 13 36.323 0.300 . 1 . . . . A 111 GLU CG . 36332 1 1408 . 1 . 1 111 111 GLU N N 15 120.000 0.300 . 1 . . . . A 111 GLU N . 36332 1 1409 . 1 . 1 112 112 LYS H H 1 7.835 0.030 . 1 . . . . A 112 LYS H . 36332 1 1410 . 1 . 1 112 112 LYS HA H 1 4.237 0.030 . 1 . . . . A 112 LYS HA . 36332 1 1411 . 1 . 1 112 112 LYS HB2 H 1 1.877 0.030 . 1 . . . . A 112 LYS HB2 . 36332 1 1412 . 1 . 1 112 112 LYS HB3 H 1 1.877 0.030 . 1 . . . . A 112 LYS HB3 . 36332 1 1413 . 1 . 1 112 112 LYS HE2 H 1 2.786 0.030 . 1 . . . . A 112 LYS HE2 . 36332 1 1414 . 1 . 1 112 112 LYS HE3 H 1 2.786 0.030 . 1 . . . . A 112 LYS HE3 . 36332 1 1415 . 1 . 1 112 112 LYS C C 13 177.336 0.300 . 1 . . . . A 112 LYS C . 36332 1 1416 . 1 . 1 112 112 LYS CA C 13 57.184 0.300 . 1 . . . . A 112 LYS CA . 36332 1 1417 . 1 . 1 112 112 LYS CB C 13 32.395 0.300 . 1 . . . . A 112 LYS CB . 36332 1 1418 . 1 . 1 112 112 LYS CE C 13 41.976 0.300 . 1 . . . . A 112 LYS CE . 36332 1 1419 . 1 . 1 112 112 LYS N N 15 119.214 0.300 . 1 . . . . A 112 LYS N . 36332 1 1420 . 1 . 1 113 113 LYS H H 1 7.593 0.030 . 1 . . . . A 113 LYS H . 36332 1 1421 . 1 . 1 113 113 LYS HB2 H 1 1.885 0.030 . 1 . . . . A 113 LYS HB2 . 36332 1 1422 . 1 . 1 113 113 LYS HB3 H 1 1.885 0.030 . 1 . . . . A 113 LYS HB3 . 36332 1 1423 . 1 . 1 113 113 LYS HG2 H 1 1.465 0.030 . 1 . . . . A 113 LYS HG2 . 36332 1 1424 . 1 . 1 113 113 LYS HG3 H 1 1.465 0.030 . 1 . . . . A 113 LYS HG3 . 36332 1 1425 . 1 . 1 113 113 LYS HD2 H 1 1.698 0.030 . 1 . . . . A 113 LYS HD2 . 36332 1 1426 . 1 . 1 113 113 LYS HD3 H 1 1.698 0.030 . 1 . . . . A 113 LYS HD3 . 36332 1 1427 . 1 . 1 113 113 LYS HE2 H 1 2.987 0.030 . 1 . . . . A 113 LYS HE2 . 36332 1 1428 . 1 . 1 113 113 LYS HE3 H 1 2.987 0.030 . 1 . . . . A 113 LYS HE3 . 36332 1 1429 . 1 . 1 113 113 LYS C C 13 175.778 0.300 . 1 . . . . A 113 LYS C . 36332 1 1430 . 1 . 1 113 113 LYS CA C 13 60.071 0.300 . 1 . . . . A 113 LYS CA . 36332 1 1431 . 1 . 1 113 113 LYS CB C 13 33.596 0.300 . 1 . . . . A 113 LYS CB . 36332 1 1432 . 1 . 1 113 113 LYS CG C 13 25.047 0.300 . 1 . . . . A 113 LYS CG . 36332 1 1433 . 1 . 1 113 113 LYS CD C 13 29.179 0.300 . 1 . . . . A 113 LYS CD . 36332 1 1434 . 1 . 1 113 113 LYS CE C 13 42.112 0.300 . 1 . . . . A 113 LYS CE . 36332 1 1435 . 1 . 1 113 113 LYS N N 15 117.055 0.300 . 1 . . . . A 113 LYS N . 36332 1 1436 . 1 . 1 114 114 GLY H H 1 8.688 0.030 . 1 . . . . A 114 GLY H . 36332 1 1437 . 1 . 1 114 114 GLY HA2 H 1 4.022 0.030 . 2 . . . . A 114 GLY HA2 . 36332 1 1438 . 1 . 1 114 114 GLY HA3 H 1 4.364 0.030 . 2 . . . . A 114 GLY HA3 . 36332 1 1439 . 1 . 1 114 114 GLY C C 13 174.876 0.300 . 1 . . . . A 114 GLY C . 36332 1 1440 . 1 . 1 114 114 GLY CA C 13 44.675 0.300 . 1 . . . . A 114 GLY CA . 36332 1 1441 . 1 . 1 114 114 GLY N N 15 109.843 0.300 . 1 . . . . A 114 GLY N . 36332 1 1442 . 1 . 1 115 115 SER H H 1 8.875 0.030 . 1 . . . . A 115 SER H . 36332 1 1443 . 1 . 1 115 115 SER HA H 1 4.500 0.030 . 1 . . . . A 115 SER HA . 36332 1 1444 . 1 . 1 115 115 SER HB2 H 1 3.819 0.030 . 1 . . . . A 115 SER HB2 . 36332 1 1445 . 1 . 1 115 115 SER HB3 H 1 3.819 0.030 . 1 . . . . A 115 SER HB3 . 36332 1 1446 . 1 . 1 115 115 SER C C 13 174.215 0.300 . 1 . . . . A 115 SER C . 36332 1 1447 . 1 . 1 115 115 SER CA C 13 58.513 0.300 . 1 . . . . A 115 SER CA . 36332 1 1448 . 1 . 1 115 115 SER CB C 13 63.906 0.300 . 1 . . . . A 115 SER CB . 36332 1 1449 . 1 . 1 115 115 SER N N 15 116.444 0.300 . 1 . . . . A 115 SER N . 36332 1 1450 . 1 . 1 116 116 TRP H H 1 8.078 0.030 . 1 . . . . A 116 TRP H . 36332 1 1451 . 1 . 1 116 116 TRP HE1 H 1 10.070 0.030 . 1 . . . . A 116 TRP HE1 . 36332 1 1452 . 1 . 1 116 116 TRP HZ2 H 1 7.376 0.030 . 1 . . . . A 116 TRP HZ2 . 36332 1 1453 . 1 . 1 116 116 TRP HZ3 H 1 7.109 0.030 . 1 . . . . A 116 TRP HZ3 . 36332 1 1454 . 1 . 1 116 116 TRP C C 13 176.302 0.300 . 1 . . . . A 116 TRP C . 36332 1 1455 . 1 . 1 116 116 TRP CA C 13 57.323 0.300 . 1 . . . . A 116 TRP CA . 36332 1 1456 . 1 . 1 116 116 TRP CB C 13 30.631 0.300 . 1 . . . . A 116 TRP CB . 36332 1 1457 . 1 . 1 116 116 TRP CZ2 C 13 114.368 0.300 . 1 . . . . A 116 TRP CZ2 . 36332 1 1458 . 1 . 1 116 116 TRP N N 15 122.943 0.300 . 1 . . . . A 116 TRP N . 36332 1 1459 . 1 . 1 116 116 TRP NE1 N 15 129.114 0.300 . 1 . . . . A 116 TRP NE1 . 36332 1 1460 . 1 . 1 117 117 SER H H 1 8.176 0.030 . 1 . . . . A 117 SER H . 36332 1 1461 . 1 . 1 117 117 SER HB2 H 1 3.556 0.030 . 2 . . . . A 117 SER HB2 . 36332 1 1462 . 1 . 1 117 117 SER HB3 H 1 3.635 0.030 . 2 . . . . A 117 SER HB3 . 36332 1 1463 . 1 . 1 117 117 SER C C 13 174.113 0.300 . 1 . . . . A 117 SER C . 36332 1 1464 . 1 . 1 117 117 SER CA C 13 58.264 0.300 . 1 . . . . A 117 SER CA . 36332 1 1465 . 1 . 1 117 117 SER CB C 13 64.391 0.300 . 1 . . . . A 117 SER CB . 36332 1 1466 . 1 . 1 117 117 SER N N 15 115.771 0.300 . 1 . . . . A 117 SER N . 36332 1 1467 . 1 . 1 118 118 LEU H H 1 8.360 0.030 . 1 . . . . A 118 LEU H . 36332 1 1468 . 1 . 1 118 118 LEU HA H 1 4.417 0.030 . 1 . . . . A 118 LEU HA . 36332 1 1469 . 1 . 1 118 118 LEU HB2 H 1 1.569 0.030 . 1 . . . . A 118 LEU HB2 . 36332 1 1470 . 1 . 1 118 118 LEU HB3 H 1 1.569 0.030 . 1 . . . . A 118 LEU HB3 . 36332 1 1471 . 1 . 1 118 118 LEU HD11 H 1 0.833 0.030 . 2 . . . . A 118 LEU HD11 . 36332 1 1472 . 1 . 1 118 118 LEU HD12 H 1 0.833 0.030 . 2 . . . . A 118 LEU HD12 . 36332 1 1473 . 1 . 1 118 118 LEU HD13 H 1 0.833 0.030 . 2 . . . . A 118 LEU HD13 . 36332 1 1474 . 1 . 1 118 118 LEU HD21 H 1 0.895 0.030 . 2 . . . . A 118 LEU HD21 . 36332 1 1475 . 1 . 1 118 118 LEU HD22 H 1 0.895 0.030 . 2 . . . . A 118 LEU HD22 . 36332 1 1476 . 1 . 1 118 118 LEU HD23 H 1 0.895 0.030 . 2 . . . . A 118 LEU HD23 . 36332 1 1477 . 1 . 1 118 118 LEU C C 13 177.465 0.300 . 1 . . . . A 118 LEU C . 36332 1 1478 . 1 . 1 118 118 LEU CA C 13 55.526 0.300 . 1 . . . . A 118 LEU CA . 36332 1 1479 . 1 . 1 118 118 LEU CB C 13 42.452 0.300 . 1 . . . . A 118 LEU CB . 36332 1 1480 . 1 . 1 118 118 LEU CG C 13 26.497 0.300 . 1 . . . . A 118 LEU CG . 36332 1 1481 . 1 . 1 118 118 LEU CD1 C 13 24.006 0.300 . 2 . . . . A 118 LEU CD1 . 36332 1 1482 . 1 . 1 118 118 LEU CD2 C 13 24.922 0.300 . 2 . . . . A 118 LEU CD2 . 36332 1 1483 . 1 . 1 118 118 LEU N N 15 124.394 0.300 . 1 . . . . A 118 LEU N . 36332 1 1484 . 1 . 1 119 119 GLU H H 1 8.352 0.030 . 1 . . . . A 119 GLU H . 36332 1 1485 . 1 . 1 119 119 GLU HA H 1 3.896 0.030 . 1 . . . . A 119 GLU HA . 36332 1 1486 . 1 . 1 119 119 GLU C C 13 176.159 0.300 . 1 . . . . A 119 GLU C . 36332 1 1487 . 1 . 1 119 119 GLU CA C 13 57.259 0.300 . 1 . . . . A 119 GLU CA . 36332 1 1488 . 1 . 1 119 119 GLU CB C 13 30.436 0.300 . 1 . . . . A 119 GLU CB . 36332 1 1489 . 1 . 1 119 119 GLU N N 15 121.615 0.300 . 1 . . . . A 119 GLU N . 36332 1 1490 . 1 . 1 120 120 HIS HB2 H 1 3.234 0.030 . 1 . . . . A 120 HIS HB2 . 36332 1 1491 . 1 . 1 120 120 HIS HB3 H 1 3.234 0.030 . 1 . . . . A 120 HIS HB3 . 36332 1 1492 . 1 . 1 120 120 HIS HD1 H 1 7.434 0.030 . 1 . . . . A 120 HIS HD1 . 36332 1 1493 . 1 . 1 120 120 HIS C C 13 177.687 0.300 . 1 . . . . A 120 HIS C . 36332 1 1494 . 1 . 1 120 120 HIS CA C 13 59.555 0.300 . 1 . . . . A 120 HIS CA . 36332 1 1495 . 1 . 1 120 120 HIS CB C 13 30.328 0.300 . 1 . . . . A 120 HIS CB . 36332 1 1496 . 1 . 1 120 120 HIS CE1 C 13 127.129 0.300 . 1 . . . . A 120 HIS CE1 . 36332 1 1497 . 1 . 1 125 125 HIS H H 1 7.858 0.030 . 1 . . . . A 125 HIS H . 36332 1 1498 . 1 . 1 125 125 HIS N N 15 125.775 0.300 . 1 . . . . A 125 HIS N . 36332 1 stop_ save_