data_11208 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11208 _Entry.Title ; Solution structure of the second fn3 domain of Eph receptor A8 protein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-07-22 _Entry.Accession_date 2010-07-23 _Entry.Last_release_date 2011-07-21 _Entry.Original_release_date 2011-07-21 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.14 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 X. Qin . . . 11208 2 T. Nagashima . . . 11208 3 F. Hayashi . . . 11208 4 S. Yokoyama . . . 11208 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID . 'Protein 3000' 'RIKEN Structural Genomics/Proteomics Initiative (RSGI)' . 11208 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11208 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 454 11208 '15N chemical shifts' 108 11208 '1H chemical shifts' 724 11208 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2011-07-21 2010-07-22 original author . 11208 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1X5L 'BMRB Entry Tracking System' 11208 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11208 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'Solution structure of the second fn3 domain of Eph receptor A8 protein' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 X. Qin . . . 11208 1 2 T. Nagashima . . . 11208 1 3 F. Hayashi . . . 11208 1 4 S. Yokoyama . . . 11208 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11208 _Assembly.ID 1 _Assembly.Name 'Ephrin type-A receptor 8' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _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 E.C.2.7.1.112 _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 'fn3 domain of Eph receptor A8 protein' 1 $entity_1 A . yes native no no . . . 11208 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 1x5l . . . . . . 11208 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11208 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'fn3 domain' _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 ; GSSGSSGQAAPSQVVVIRQE RAGQTSVSLLWQEPEQPNGI ILEYEIKYYEKDKEMQSYST LKAVTTRATVSGLKPGTRYV FQVRARTSAGCGRFSQAMEV ETGKPSGPSSG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 111 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1X5L . "Solution Structure Of The Second Fn3 Domain Of Eph Receptor A8 Protein" . . . . . 100.00 111 100.00 100.00 3.99e-72 . . . . 11208 1 2 no DBJ BAA95983 . "KIAA1459 protein [Homo sapiens]" . . . . . 90.99 853 97.03 99.01 1.03e-57 . . . . 11208 1 3 no DBJ BAD90254 . "mKIAA1459 protein [Mus musculus]" . . . . . 90.99 855 97.03 99.01 9.63e-58 . . . . 11208 1 4 no DBJ BAI45300 . "EPH receptor A8 [synthetic construct]" . . . . . 90.99 1005 97.03 99.01 2.07e-57 . . . . 11208 1 5 no GB AAB39218 . "Eph-and Elk-related kinase [Mus musculus]" . . . . . 90.99 1004 97.03 99.01 1.91e-57 . . . . 11208 1 6 no GB AAI41437 . "EPH receptor A8, partial [synthetic construct]" . . . . . 90.99 1005 97.03 99.01 2.07e-57 . . . . 11208 1 7 no GB AAI67187 . "Eph receptor A8 [synthetic construct]" . . . . . 90.99 1004 97.03 99.01 1.87e-57 . . . . 11208 1 8 no GB EAW95013 . "EPH receptor A8 [Homo sapiens]" . . . . . 90.99 1005 97.03 99.01 2.07e-57 . . . . 11208 1 9 no GB EDL29925 . "Eph receptor A8 [Mus musculus]" . . . . . 90.99 930 97.03 99.01 1.03e-57 . . . . 11208 1 10 no REF NP_031965 . "ephrin type-A receptor 8 precursor [Mus musculus]" . . . . . 90.99 1004 97.03 99.01 1.87e-57 . . . . 11208 1 11 no REF NP_065387 . "ephrin type-A receptor 8 isoform 1 precursor [Homo sapiens]" . . . . . 90.99 1005 97.03 99.01 2.07e-57 . . . . 11208 1 12 no REF XP_001101560 . "PREDICTED: ephrin type-A receptor 8-like [Macaca mulatta]" . . . . . 90.99 1005 97.03 99.01 2.68e-57 . . . . 11208 1 13 no REF XP_001501554 . "PREDICTED: ephrin type-A receptor 8 [Equus caballus]" . . . . . 90.99 1025 97.03 99.01 3.80e-57 . . . . 11208 1 14 no REF XP_002685829 . "PREDICTED: ephrin type-A receptor 8 [Bos taurus]" . . . . . 90.99 1000 97.03 99.01 2.84e-57 . . . . 11208 1 15 no SP O09127 . "RecName: Full=Ephrin type-A receptor 8; AltName: Full=EPH- and ELK-related kinase; AltName: Full=Tyrosine-protein kinase recept" . . . . . 90.99 1004 97.03 99.01 1.87e-57 . . . . 11208 1 16 no SP P29322 . "RecName: Full=Ephrin type-A receptor 8; AltName: Full=EPH- and ELK-related kinase; AltName: Full=EPH-like kinase 3; Short=EK3; " . . . . . 90.99 1005 97.03 99.01 2.07e-57 . . . . 11208 1 17 no TPG DAA32242 . "TPA: EPH receptor A8 [Bos taurus]" . . . . . 90.99 1000 97.03 99.01 2.84e-57 . . . . 11208 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'fn3 domain' . 11208 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 11208 1 2 . SER . 11208 1 3 . SER . 11208 1 4 . GLY . 11208 1 5 . SER . 11208 1 6 . SER . 11208 1 7 . GLY . 11208 1 8 . GLN . 11208 1 9 . ALA . 11208 1 10 . ALA . 11208 1 11 . PRO . 11208 1 12 . SER . 11208 1 13 . GLN . 11208 1 14 . VAL . 11208 1 15 . VAL . 11208 1 16 . VAL . 11208 1 17 . ILE . 11208 1 18 . ARG . 11208 1 19 . GLN . 11208 1 20 . GLU . 11208 1 21 . ARG . 11208 1 22 . ALA . 11208 1 23 . GLY . 11208 1 24 . GLN . 11208 1 25 . THR . 11208 1 26 . SER . 11208 1 27 . VAL . 11208 1 28 . SER . 11208 1 29 . LEU . 11208 1 30 . LEU . 11208 1 31 . TRP . 11208 1 32 . GLN . 11208 1 33 . GLU . 11208 1 34 . PRO . 11208 1 35 . GLU . 11208 1 36 . GLN . 11208 1 37 . PRO . 11208 1 38 . ASN . 11208 1 39 . GLY . 11208 1 40 . ILE . 11208 1 41 . ILE . 11208 1 42 . LEU . 11208 1 43 . GLU . 11208 1 44 . TYR . 11208 1 45 . GLU . 11208 1 46 . ILE . 11208 1 47 . LYS . 11208 1 48 . TYR . 11208 1 49 . TYR . 11208 1 50 . GLU . 11208 1 51 . LYS . 11208 1 52 . ASP . 11208 1 53 . LYS . 11208 1 54 . GLU . 11208 1 55 . MET . 11208 1 56 . GLN . 11208 1 57 . SER . 11208 1 58 . TYR . 11208 1 59 . SER . 11208 1 60 . THR . 11208 1 61 . LEU . 11208 1 62 . LYS . 11208 1 63 . ALA . 11208 1 64 . VAL . 11208 1 65 . THR . 11208 1 66 . THR . 11208 1 67 . ARG . 11208 1 68 . ALA . 11208 1 69 . THR . 11208 1 70 . VAL . 11208 1 71 . SER . 11208 1 72 . GLY . 11208 1 73 . LEU . 11208 1 74 . LYS . 11208 1 75 . PRO . 11208 1 76 . GLY . 11208 1 77 . THR . 11208 1 78 . ARG . 11208 1 79 . TYR . 11208 1 80 . VAL . 11208 1 81 . PHE . 11208 1 82 . GLN . 11208 1 83 . VAL . 11208 1 84 . ARG . 11208 1 85 . ALA . 11208 1 86 . ARG . 11208 1 87 . THR . 11208 1 88 . SER . 11208 1 89 . ALA . 11208 1 90 . GLY . 11208 1 91 . CYS . 11208 1 92 . GLY . 11208 1 93 . ARG . 11208 1 94 . PHE . 11208 1 95 . SER . 11208 1 96 . GLN . 11208 1 97 . ALA . 11208 1 98 . MET . 11208 1 99 . GLU . 11208 1 100 . VAL . 11208 1 101 . GLU . 11208 1 102 . THR . 11208 1 103 . GLY . 11208 1 104 . LYS . 11208 1 105 . PRO . 11208 1 106 . SER . 11208 1 107 . GLY . 11208 1 108 . PRO . 11208 1 109 . SER . 11208 1 110 . SER . 11208 1 111 . GLY . 11208 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 11208 1 . SER 2 2 11208 1 . SER 3 3 11208 1 . GLY 4 4 11208 1 . SER 5 5 11208 1 . SER 6 6 11208 1 . GLY 7 7 11208 1 . GLN 8 8 11208 1 . ALA 9 9 11208 1 . ALA 10 10 11208 1 . PRO 11 11 11208 1 . SER 12 12 11208 1 . GLN 13 13 11208 1 . VAL 14 14 11208 1 . VAL 15 15 11208 1 . VAL 16 16 11208 1 . ILE 17 17 11208 1 . ARG 18 18 11208 1 . GLN 19 19 11208 1 . GLU 20 20 11208 1 . ARG 21 21 11208 1 . ALA 22 22 11208 1 . GLY 23 23 11208 1 . GLN 24 24 11208 1 . THR 25 25 11208 1 . SER 26 26 11208 1 . VAL 27 27 11208 1 . SER 28 28 11208 1 . LEU 29 29 11208 1 . LEU 30 30 11208 1 . TRP 31 31 11208 1 . GLN 32 32 11208 1 . GLU 33 33 11208 1 . PRO 34 34 11208 1 . GLU 35 35 11208 1 . GLN 36 36 11208 1 . PRO 37 37 11208 1 . ASN 38 38 11208 1 . GLY 39 39 11208 1 . ILE 40 40 11208 1 . ILE 41 41 11208 1 . LEU 42 42 11208 1 . GLU 43 43 11208 1 . TYR 44 44 11208 1 . GLU 45 45 11208 1 . ILE 46 46 11208 1 . LYS 47 47 11208 1 . TYR 48 48 11208 1 . TYR 49 49 11208 1 . GLU 50 50 11208 1 . LYS 51 51 11208 1 . ASP 52 52 11208 1 . LYS 53 53 11208 1 . GLU 54 54 11208 1 . MET 55 55 11208 1 . GLN 56 56 11208 1 . SER 57 57 11208 1 . TYR 58 58 11208 1 . SER 59 59 11208 1 . THR 60 60 11208 1 . LEU 61 61 11208 1 . LYS 62 62 11208 1 . ALA 63 63 11208 1 . VAL 64 64 11208 1 . THR 65 65 11208 1 . THR 66 66 11208 1 . ARG 67 67 11208 1 . ALA 68 68 11208 1 . THR 69 69 11208 1 . VAL 70 70 11208 1 . SER 71 71 11208 1 . GLY 72 72 11208 1 . LEU 73 73 11208 1 . LYS 74 74 11208 1 . PRO 75 75 11208 1 . GLY 76 76 11208 1 . THR 77 77 11208 1 . ARG 78 78 11208 1 . TYR 79 79 11208 1 . VAL 80 80 11208 1 . PHE 81 81 11208 1 . GLN 82 82 11208 1 . VAL 83 83 11208 1 . ARG 84 84 11208 1 . ALA 85 85 11208 1 . ARG 86 86 11208 1 . THR 87 87 11208 1 . SER 88 88 11208 1 . ALA 89 89 11208 1 . GLY 90 90 11208 1 . CYS 91 91 11208 1 . GLY 92 92 11208 1 . ARG 93 93 11208 1 . PHE 94 94 11208 1 . SER 95 95 11208 1 . GLN 96 96 11208 1 . ALA 97 97 11208 1 . MET 98 98 11208 1 . GLU 99 99 11208 1 . VAL 100 100 11208 1 . GLU 101 101 11208 1 . THR 102 102 11208 1 . GLY 103 103 11208 1 . LYS 104 104 11208 1 . PRO 105 105 11208 1 . SER 106 106 11208 1 . GLY 107 107 11208 1 . PRO 108 108 11208 1 . SER 109 109 11208 1 . SER 110 110 11208 1 . GLY 111 111 11208 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 11208 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 11208 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 11208 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'cell free synthesis' 'E. coli - cell free' 'E. coli' . 562 Escherichia coli . . . . . . . . . . . . . plasmid . . p040705-14 . . . . . . 11208 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11208 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.42mM 13C, 15N-labeled {protein;} 20mM {d-Tris-HCl;} 100mM {NaCl;} 1mM {d-DTT;} 0.02% NaN3 ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'fn3 domain' '[U-13C; U-15N]' . . 1 $entity_1 . protein 1.42 . . mM . . . . 11208 1 2 d-Tris-HCl 'natural abundance' . . . . . buffer 20 . . mM . . . . 11208 1 3 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 11208 1 4 d-DTT 'natural abundance' . . . . . salt 1 . . mM . . . . 11208 1 5 NaN3 'natural abundance' . . . . . salt 0.02 . . % . . . . 11208 1 6 H2O . . . . . . solvent 90 . . % . . . . 11208 1 7 D2O . . . . . . solvent 10 . . % . . . . 11208 1 stop_ save_ ####################### # Sample conditions # ####################### save_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_1 _Sample_condition_list.Entry_ID 11208 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 120 0.1 mM 11208 1 pH 7.0 0.05 pH 11208 1 pressure 1 0.001 atm 11208 1 temperature 298 0.1 K 11208 1 stop_ save_ ############################ # Computer software used # ############################ save_VNMR _Software.Sf_category software _Software.Sf_framecode VNMR _Software.Entry_ID 11208 _Software.ID 1 _Software.Name VNMR _Software.Version 6.1C _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . 11208 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11208 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11208 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20031121 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F.' . . 11208 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11208 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 11208 _Software.ID 3 _Software.Name NMRView _Software.Version 5.0.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, B.A.' . . 11208 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11208 3 stop_ save_ save_Kujira _Software.Sf_category software _Software.Sf_framecode Kujira _Software.Entry_ID 11208 _Software.ID 4 _Software.Name Kujira _Software.Version 0.9296 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 11208 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11208 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11208 _Software.ID 5 _Software.Name CYANA _Software.Version 2.0.17 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 11208 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 11208 5 'structure solution' 11208 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 11208 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 11208 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 11208 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian INOVA . 800 . . . 11208 1 2 spectrometer_2 Varian INOVA . 900 . . . 11208 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 11208 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11208 1 2 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11208 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode reference_1 _Chem_shift_reference.Entry_ID 11208 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.784ppm at 298K) and then those of 15N and 13C were calculated based on their gyromagnetic 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.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 11208 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11208 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11208 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_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 11208 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $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 '3D 15N-separated NOESY' 1 $sample_1 isotropic 11208 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11208 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $VNMR . . 11208 1 2 $NMRPipe . . 11208 1 3 $NMRView . . 11208 1 4 $Kujira . . 11208 1 5 $CYANA . . 11208 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 7 7 GLY H H 1 8.383 0.030 . 1 . . . . 7 GLY H . 11208 1 2 . 1 1 7 7 GLY HA2 H 1 3.966 0.030 . 1 . . . . 7 GLY HA2 . 11208 1 3 . 1 1 7 7 GLY HA3 H 1 3.966 0.030 . 1 . . . . 7 GLY HA3 . 11208 1 4 . 1 1 7 7 GLY C C 13 173.939 0.300 . 1 . . . . 7 GLY C . 11208 1 5 . 1 1 7 7 GLY CA C 13 45.346 0.300 . 1 . . . . 7 GLY CA . 11208 1 6 . 1 1 7 7 GLY N N 15 121.319 0.300 . 1 . . . . 7 GLY N . 11208 1 7 . 1 1 8 8 GLN H H 1 8.140 0.030 . 1 . . . . 8 GLN H . 11208 1 8 . 1 1 8 8 GLN HA H 1 4.339 0.030 . 1 . . . . 8 GLN HA . 11208 1 9 . 1 1 8 8 GLN HB2 H 1 2.052 0.030 . 2 . . . . 8 GLN HB2 . 11208 1 10 . 1 1 8 8 GLN HB3 H 1 1.926 0.030 . 2 . . . . 8 GLN HB3 . 11208 1 11 . 1 1 8 8 GLN HE21 H 1 7.493 0.030 . 1 . . . . 8 GLN HE21 . 11208 1 12 . 1 1 8 8 GLN HE22 H 1 7.493 0.030 . 1 . . . . 8 GLN HE22 . 11208 1 13 . 1 1 8 8 GLN HG2 H 1 2.360 0.030 . 1 . . . . 8 GLN HG2 . 11208 1 14 . 1 1 8 8 GLN HG3 H 1 2.360 0.030 . 1 . . . . 8 GLN HG3 . 11208 1 15 . 1 1 8 8 GLN C C 13 175.156 0.300 . 1 . . . . 8 GLN C . 11208 1 16 . 1 1 8 8 GLN CA C 13 55.521 0.300 . 1 . . . . 8 GLN CA . 11208 1 17 . 1 1 8 8 GLN CB C 13 29.818 0.300 . 1 . . . . 8 GLN CB . 11208 1 18 . 1 1 8 8 GLN CG C 13 33.846 0.300 . 1 . . . . 8 GLN CG . 11208 1 19 . 1 1 8 8 GLN N N 15 120.000 0.300 . 1 . . . . 8 GLN N . 11208 1 20 . 1 1 8 8 GLN NE2 N 15 112.002 0.300 . 1 . . . . 8 GLN NE2 . 11208 1 21 . 1 1 9 9 ALA H H 1 8.306 0.030 . 1 . . . . 9 ALA H . 11208 1 22 . 1 1 9 9 ALA HA H 1 4.320 0.030 . 1 . . . . 9 ALA HA . 11208 1 23 . 1 1 9 9 ALA HB1 H 1 1.309 0.030 . 1 . . . . 9 ALA HB . 11208 1 24 . 1 1 9 9 ALA HB2 H 1 1.309 0.030 . 1 . . . . 9 ALA HB . 11208 1 25 . 1 1 9 9 ALA HB3 H 1 1.309 0.030 . 1 . . . . 9 ALA HB . 11208 1 26 . 1 1 9 9 ALA C C 13 176.139 0.300 . 1 . . . . 9 ALA C . 11208 1 27 . 1 1 9 9 ALA CA C 13 51.766 0.300 . 1 . . . . 9 ALA CA . 11208 1 28 . 1 1 9 9 ALA CB C 13 19.991 0.300 . 1 . . . . 9 ALA CB . 11208 1 29 . 1 1 9 9 ALA N N 15 125.559 0.300 . 1 . . . . 9 ALA N . 11208 1 30 . 1 1 10 10 ALA H H 1 8.113 0.030 . 1 . . . . 10 ALA H . 11208 1 31 . 1 1 10 10 ALA HA H 1 4.074 0.030 . 1 . . . . 10 ALA HA . 11208 1 32 . 1 1 10 10 ALA HB1 H 1 1.195 0.030 . 1 . . . . 10 ALA HB . 11208 1 33 . 1 1 10 10 ALA HB2 H 1 1.195 0.030 . 1 . . . . 10 ALA HB . 11208 1 34 . 1 1 10 10 ALA HB3 H 1 1.195 0.030 . 1 . . . . 10 ALA HB . 11208 1 35 . 1 1 10 10 ALA C C 13 174.740 0.300 . 1 . . . . 10 ALA C . 11208 1 36 . 1 1 10 10 ALA CA C 13 50.491 0.300 . 1 . . . . 10 ALA CA . 11208 1 37 . 1 1 10 10 ALA CB C 13 17.560 0.300 . 1 . . . . 10 ALA CB . 11208 1 38 . 1 1 10 10 ALA N N 15 123.274 0.300 . 1 . . . . 10 ALA N . 11208 1 39 . 1 1 11 11 PRO HA H 1 4.631 0.030 . 1 . . . . 11 PRO HA . 11208 1 40 . 1 1 11 11 PRO HB2 H 1 2.387 0.030 . 2 . . . . 11 PRO HB2 . 11208 1 41 . 1 1 11 11 PRO HB3 H 1 1.817 0.030 . 2 . . . . 11 PRO HB3 . 11208 1 42 . 1 1 11 11 PRO HD2 H 1 3.719 0.030 . 2 . . . . 11 PRO HD2 . 11208 1 43 . 1 1 11 11 PRO HD3 H 1 3.302 0.030 . 2 . . . . 11 PRO HD3 . 11208 1 44 . 1 1 11 11 PRO HG2 H 1 1.873 0.030 . 2 . . . . 11 PRO HG2 . 11208 1 45 . 1 1 11 11 PRO HG3 H 1 1.797 0.030 . 2 . . . . 11 PRO HG3 . 11208 1 46 . 1 1 11 11 PRO C C 13 175.951 0.300 . 1 . . . . 11 PRO C . 11208 1 47 . 1 1 11 11 PRO CA C 13 62.720 0.300 . 1 . . . . 11 PRO CA . 11208 1 48 . 1 1 11 11 PRO CB C 13 32.188 0.300 . 1 . . . . 11 PRO CB . 11208 1 49 . 1 1 11 11 PRO CD C 13 49.457 0.300 . 1 . . . . 11 PRO CD . 11208 1 50 . 1 1 11 11 PRO CG C 13 27.677 0.300 . 1 . . . . 11 PRO CG . 11208 1 51 . 1 1 12 12 SER H H 1 7.989 0.030 . 1 . . . . 12 SER H . 11208 1 52 . 1 1 12 12 SER HA H 1 4.299 0.030 . 1 . . . . 12 SER HA . 11208 1 53 . 1 1 12 12 SER HB2 H 1 4.019 0.030 . 1 . . . . 12 SER HB2 . 11208 1 54 . 1 1 12 12 SER HB3 H 1 4.019 0.030 . 1 . . . . 12 SER HB3 . 11208 1 55 . 1 1 12 12 SER C C 13 172.588 0.300 . 1 . . . . 12 SER C . 11208 1 56 . 1 1 12 12 SER CA C 13 58.619 0.300 . 1 . . . . 12 SER CA . 11208 1 57 . 1 1 12 12 SER CB C 13 63.683 0.300 . 1 . . . . 12 SER CB . 11208 1 58 . 1 1 12 12 SER N N 15 114.075 0.300 . 1 . . . . 12 SER N . 11208 1 59 . 1 1 13 13 GLN H H 1 8.202 0.030 . 1 . . . . 13 GLN H . 11208 1 60 . 1 1 13 13 GLN HA H 1 4.079 0.030 . 1 . . . . 13 GLN HA . 11208 1 61 . 1 1 13 13 GLN HB2 H 1 2.056 0.030 . 2 . . . . 13 GLN HB2 . 11208 1 62 . 1 1 13 13 GLN HB3 H 1 1.832 0.030 . 2 . . . . 13 GLN HB3 . 11208 1 63 . 1 1 13 13 GLN HE21 H 1 7.046 0.030 . 2 . . . . 13 GLN HE21 . 11208 1 64 . 1 1 13 13 GLN HE22 H 1 7.726 0.030 . 2 . . . . 13 GLN HE22 . 11208 1 65 . 1 1 13 13 GLN HG2 H 1 2.422 0.030 . 2 . . . . 13 GLN HG2 . 11208 1 66 . 1 1 13 13 GLN HG3 H 1 2.184 0.030 . 2 . . . . 13 GLN HG3 . 11208 1 67 . 1 1 13 13 GLN C C 13 176.379 0.300 . 1 . . . . 13 GLN C . 11208 1 68 . 1 1 13 13 GLN CA C 13 56.232 0.300 . 1 . . . . 13 GLN CA . 11208 1 69 . 1 1 13 13 GLN CB C 13 30.731 0.300 . 1 . . . . 13 GLN CB . 11208 1 70 . 1 1 13 13 GLN CG C 13 33.551 0.300 . 1 . . . . 13 GLN CG . 11208 1 71 . 1 1 13 13 GLN N N 15 117.986 0.300 . 1 . . . . 13 GLN N . 11208 1 72 . 1 1 13 13 GLN NE2 N 15 112.008 0.300 . 1 . . . . 13 GLN NE2 . 11208 1 73 . 1 1 14 14 VAL H H 1 8.236 0.030 . 1 . . . . 14 VAL H . 11208 1 74 . 1 1 14 14 VAL HA H 1 3.953 0.030 . 1 . . . . 14 VAL HA . 11208 1 75 . 1 1 14 14 VAL HB H 1 1.916 0.030 . 1 . . . . 14 VAL HB . 11208 1 76 . 1 1 14 14 VAL HG11 H 1 0.965 0.030 . 1 . . . . 14 VAL HG1 . 11208 1 77 . 1 1 14 14 VAL HG12 H 1 0.965 0.030 . 1 . . . . 14 VAL HG1 . 11208 1 78 . 1 1 14 14 VAL HG13 H 1 0.965 0.030 . 1 . . . . 14 VAL HG1 . 11208 1 79 . 1 1 14 14 VAL HG21 H 1 1.102 0.030 . 1 . . . . 14 VAL HG2 . 11208 1 80 . 1 1 14 14 VAL HG22 H 1 1.102 0.030 . 1 . . . . 14 VAL HG2 . 11208 1 81 . 1 1 14 14 VAL HG23 H 1 1.102 0.030 . 1 . . . . 14 VAL HG2 . 11208 1 82 . 1 1 14 14 VAL C C 13 175.347 0.300 . 1 . . . . 14 VAL C . 11208 1 83 . 1 1 14 14 VAL CA C 13 64.521 0.300 . 1 . . . . 14 VAL CA . 11208 1 84 . 1 1 14 14 VAL CB C 13 32.084 0.300 . 1 . . . . 14 VAL CB . 11208 1 85 . 1 1 14 14 VAL CG1 C 13 21.611 0.300 . 2 . . . . 14 VAL CG1 . 11208 1 86 . 1 1 14 14 VAL CG2 C 13 21.542 0.300 . 2 . . . . 14 VAL CG2 . 11208 1 87 . 1 1 15 15 VAL H H 1 8.893 0.030 . 1 . . . . 15 VAL H . 11208 1 88 . 1 1 15 15 VAL HA H 1 4.374 0.030 . 1 . . . . 15 VAL HA . 11208 1 89 . 1 1 15 15 VAL HB H 1 2.242 0.030 . 1 . . . . 15 VAL HB . 11208 1 90 . 1 1 15 15 VAL HG11 H 1 0.948 0.030 . 1 . . . . 15 VAL HG1 . 11208 1 91 . 1 1 15 15 VAL HG12 H 1 0.948 0.030 . 1 . . . . 15 VAL HG1 . 11208 1 92 . 1 1 15 15 VAL HG13 H 1 0.948 0.030 . 1 . . . . 15 VAL HG1 . 11208 1 93 . 1 1 15 15 VAL HG21 H 1 0.971 0.030 . 1 . . . . 15 VAL HG2 . 11208 1 94 . 1 1 15 15 VAL HG22 H 1 0.971 0.030 . 1 . . . . 15 VAL HG2 . 11208 1 95 . 1 1 15 15 VAL HG23 H 1 0.971 0.030 . 1 . . . . 15 VAL HG2 . 11208 1 96 . 1 1 15 15 VAL C C 13 175.761 0.300 . 1 . . . . 15 VAL C . 11208 1 97 . 1 1 15 15 VAL CA C 13 62.500 0.300 . 1 . . . . 15 VAL CA . 11208 1 98 . 1 1 15 15 VAL CB C 13 33.817 0.300 . 1 . . . . 15 VAL CB . 11208 1 99 . 1 1 15 15 VAL CG1 C 13 21.737 0.300 . 2 . . . . 15 VAL CG1 . 11208 1 100 . 1 1 15 15 VAL CG2 C 13 19.464 0.300 . 2 . . . . 15 VAL CG2 . 11208 1 101 . 1 1 15 15 VAL N N 15 123.460 0.300 . 1 . . . . 15 VAL N . 11208 1 102 . 1 1 16 16 VAL H H 1 7.931 0.030 . 1 . . . . 16 VAL H . 11208 1 103 . 1 1 16 16 VAL HA H 1 4.291 0.030 . 1 . . . . 16 VAL HA . 11208 1 104 . 1 1 16 16 VAL HB H 1 1.870 0.030 . 1 . . . . 16 VAL HB . 11208 1 105 . 1 1 16 16 VAL HG11 H 1 0.934 0.030 . 1 . . . . 16 VAL HG1 . 11208 1 106 . 1 1 16 16 VAL HG12 H 1 0.934 0.030 . 1 . . . . 16 VAL HG1 . 11208 1 107 . 1 1 16 16 VAL HG13 H 1 0.934 0.030 . 1 . . . . 16 VAL HG1 . 11208 1 108 . 1 1 16 16 VAL HG21 H 1 0.849 0.030 . 1 . . . . 16 VAL HG2 . 11208 1 109 . 1 1 16 16 VAL HG22 H 1 0.849 0.030 . 1 . . . . 16 VAL HG2 . 11208 1 110 . 1 1 16 16 VAL HG23 H 1 0.849 0.030 . 1 . . . . 16 VAL HG2 . 11208 1 111 . 1 1 16 16 VAL C C 13 173.439 0.300 . 1 . . . . 16 VAL C . 11208 1 112 . 1 1 16 16 VAL CA C 13 62.550 0.300 . 1 . . . . 16 VAL CA . 11208 1 113 . 1 1 16 16 VAL CB C 13 33.360 0.300 . 1 . . . . 16 VAL CB . 11208 1 114 . 1 1 16 16 VAL CG1 C 13 20.871 0.300 . 2 . . . . 16 VAL CG1 . 11208 1 115 . 1 1 16 16 VAL CG2 C 13 20.775 0.300 . 2 . . . . 16 VAL CG2 . 11208 1 116 . 1 1 16 16 VAL N N 15 123.492 0.300 . 1 . . . . 16 VAL N . 11208 1 117 . 1 1 17 17 ILE H H 1 8.096 0.030 . 1 . . . . 17 ILE H . 11208 1 118 . 1 1 17 17 ILE HA H 1 4.946 0.030 . 1 . . . . 17 ILE HA . 11208 1 119 . 1 1 17 17 ILE HB H 1 1.733 0.030 . 1 . . . . 17 ILE HB . 11208 1 120 . 1 1 17 17 ILE HD11 H 1 0.791 0.030 . 1 . . . . 17 ILE HD1 . 11208 1 121 . 1 1 17 17 ILE HD12 H 1 0.791 0.030 . 1 . . . . 17 ILE HD1 . 11208 1 122 . 1 1 17 17 ILE HD13 H 1 0.791 0.030 . 1 . . . . 17 ILE HD1 . 11208 1 123 . 1 1 17 17 ILE HG12 H 1 1.022 0.030 . 2 . . . . 17 ILE HG12 . 11208 1 124 . 1 1 17 17 ILE HG13 H 1 1.640 0.030 . 2 . . . . 17 ILE HG13 . 11208 1 125 . 1 1 17 17 ILE HG21 H 1 0.955 0.030 . 1 . . . . 17 ILE HG2 . 11208 1 126 . 1 1 17 17 ILE HG22 H 1 0.955 0.030 . 1 . . . . 17 ILE HG2 . 11208 1 127 . 1 1 17 17 ILE HG23 H 1 0.955 0.030 . 1 . . . . 17 ILE HG2 . 11208 1 128 . 1 1 17 17 ILE C C 13 173.554 0.300 . 1 . . . . 17 ILE C . 11208 1 129 . 1 1 17 17 ILE CA C 13 59.989 0.300 . 1 . . . . 17 ILE CA . 11208 1 130 . 1 1 17 17 ILE CB C 13 40.920 0.300 . 1 . . . . 17 ILE CB . 11208 1 131 . 1 1 17 17 ILE CD1 C 13 14.752 0.300 . 1 . . . . 17 ILE CD1 . 11208 1 132 . 1 1 17 17 ILE CG1 C 13 28.395 0.300 . 1 . . . . 17 ILE CG1 . 11208 1 133 . 1 1 17 17 ILE CG2 C 13 16.240 0.300 . 1 . . . . 17 ILE CG2 . 11208 1 134 . 1 1 17 17 ILE N N 15 124.112 0.300 . 1 . . . . 17 ILE N . 11208 1 135 . 1 1 18 18 ARG H H 1 9.373 0.030 . 1 . . . . 18 ARG H . 11208 1 136 . 1 1 18 18 ARG HA H 1 4.787 0.030 . 1 . . . . 18 ARG HA . 11208 1 137 . 1 1 18 18 ARG HB2 H 1 1.801 0.030 . 2 . . . . 18 ARG HB2 . 11208 1 138 . 1 1 18 18 ARG HB3 H 1 1.628 0.030 . 2 . . . . 18 ARG HB3 . 11208 1 139 . 1 1 18 18 ARG HD2 H 1 3.142 0.030 . 2 . . . . 18 ARG HD2 . 11208 1 140 . 1 1 18 18 ARG HD3 H 1 3.101 0.030 . 2 . . . . 18 ARG HD3 . 11208 1 141 . 1 1 18 18 ARG HG2 H 1 1.511 0.030 . 2 . . . . 18 ARG HG2 . 11208 1 142 . 1 1 18 18 ARG HG3 H 1 1.366 0.030 . 2 . . . . 18 ARG HG3 . 11208 1 143 . 1 1 18 18 ARG C C 13 174.239 0.300 . 1 . . . . 18 ARG C . 11208 1 144 . 1 1 18 18 ARG CA C 13 54.275 0.300 . 1 . . . . 18 ARG CA . 11208 1 145 . 1 1 18 18 ARG CB C 13 33.998 0.300 . 1 . . . . 18 ARG CB . 11208 1 146 . 1 1 18 18 ARG CD C 13 43.427 0.300 . 1 . . . . 18 ARG CD . 11208 1 147 . 1 1 18 18 ARG CG C 13 26.890 0.300 . 1 . . . . 18 ARG CG . 11208 1 148 . 1 1 18 18 ARG N N 15 123.925 0.300 . 1 . . . . 18 ARG N . 11208 1 149 . 1 1 19 19 GLN H H 1 8.727 0.030 . 1 . . . . 19 GLN H . 11208 1 150 . 1 1 19 19 GLN HA H 1 4.596 0.030 . 1 . . . . 19 GLN HA . 11208 1 151 . 1 1 19 19 GLN HB2 H 1 1.933 0.030 . 2 . . . . 19 GLN HB2 . 11208 1 152 . 1 1 19 19 GLN HB3 H 1 1.843 0.030 . 2 . . . . 19 GLN HB3 . 11208 1 153 . 1 1 19 19 GLN HE21 H 1 6.791 0.030 . 2 . . . . 19 GLN HE21 . 11208 1 154 . 1 1 19 19 GLN HE22 H 1 7.107 0.030 . 2 . . . . 19 GLN HE22 . 11208 1 155 . 1 1 19 19 GLN HG2 H 1 2.122 0.030 . 2 . . . . 19 GLN HG2 . 11208 1 156 . 1 1 19 19 GLN HG3 H 1 2.065 0.030 . 2 . . . . 19 GLN HG3 . 11208 1 157 . 1 1 19 19 GLN C C 13 175.014 0.300 . 1 . . . . 19 GLN C . 11208 1 158 . 1 1 19 19 GLN CA C 13 54.656 0.300 . 1 . . . . 19 GLN CA . 11208 1 159 . 1 1 19 19 GLN CB C 13 29.855 0.300 . 1 . . . . 19 GLN CB . 11208 1 160 . 1 1 19 19 GLN CG C 13 33.383 0.300 . 1 . . . . 19 GLN CG . 11208 1 161 . 1 1 19 19 GLN N N 15 119.969 0.300 . 1 . . . . 19 GLN N . 11208 1 162 . 1 1 19 19 GLN NE2 N 15 109.866 0.300 . 1 . . . . 19 GLN NE2 . 11208 1 163 . 1 1 20 20 GLU H H 1 8.856 0.030 . 1 . . . . 20 GLU H . 11208 1 164 . 1 1 20 20 GLU HA H 1 4.337 0.030 . 1 . . . . 20 GLU HA . 11208 1 165 . 1 1 20 20 GLU HB2 H 1 1.785 0.030 . 2 . . . . 20 GLU HB2 . 11208 1 166 . 1 1 20 20 GLU HB3 H 1 1.664 0.030 . 2 . . . . 20 GLU HB3 . 11208 1 167 . 1 1 20 20 GLU HG2 H 1 1.952 0.030 . 2 . . . . 20 GLU HG2 . 11208 1 168 . 1 1 20 20 GLU HG3 H 1 2.050 0.030 . 2 . . . . 20 GLU HG3 . 11208 1 169 . 1 1 20 20 GLU C C 13 175.990 0.300 . 1 . . . . 20 GLU C . 11208 1 170 . 1 1 20 20 GLU CA C 13 57.159 0.300 . 1 . . . . 20 GLU CA . 11208 1 171 . 1 1 20 20 GLU CB C 13 31.382 0.300 . 1 . . . . 20 GLU CB . 11208 1 172 . 1 1 20 20 GLU CG C 13 36.790 0.300 . 1 . . . . 20 GLU CG . 11208 1 173 . 1 1 20 20 GLU N N 15 125.650 0.300 . 1 . . . . 20 GLU N . 11208 1 174 . 1 1 21 21 ARG H H 1 7.707 0.030 . 1 . . . . 21 ARG H . 11208 1 175 . 1 1 21 21 ARG HA H 1 4.409 0.030 . 1 . . . . 21 ARG HA . 11208 1 176 . 1 1 21 21 ARG HB2 H 1 1.829 0.030 . 2 . . . . 21 ARG HB2 . 11208 1 177 . 1 1 21 21 ARG HB3 H 1 1.735 0.030 . 2 . . . . 21 ARG HB3 . 11208 1 178 . 1 1 21 21 ARG HD2 H 1 3.132 0.030 . 1 . . . . 21 ARG HD2 . 11208 1 179 . 1 1 21 21 ARG HD3 H 1 3.132 0.030 . 1 . . . . 21 ARG HD3 . 11208 1 180 . 1 1 21 21 ARG HG2 H 1 1.458 0.030 . 1 . . . . 21 ARG HG2 . 11208 1 181 . 1 1 21 21 ARG HG3 H 1 1.458 0.030 . 1 . . . . 21 ARG HG3 . 11208 1 182 . 1 1 21 21 ARG C C 13 173.868 0.300 . 1 . . . . 21 ARG C . 11208 1 183 . 1 1 21 21 ARG CA C 13 56.094 0.300 . 1 . . . . 21 ARG CA . 11208 1 184 . 1 1 21 21 ARG CB C 13 32.460 0.300 . 1 . . . . 21 ARG CB . 11208 1 185 . 1 1 21 21 ARG CD C 13 43.107 0.300 . 1 . . . . 21 ARG CD . 11208 1 186 . 1 1 21 21 ARG CG C 13 26.794 0.300 . 1 . . . . 21 ARG CG . 11208 1 187 . 1 1 21 21 ARG N N 15 115.574 0.300 . 1 . . . . 21 ARG N . 11208 1 188 . 1 1 22 22 ALA H H 1 8.658 0.030 . 1 . . . . 22 ALA H . 11208 1 189 . 1 1 22 22 ALA HA H 1 4.799 0.030 . 1 . . . . 22 ALA HA . 11208 1 190 . 1 1 22 22 ALA HB1 H 1 1.384 0.030 . 1 . . . . 22 ALA HB . 11208 1 191 . 1 1 22 22 ALA HB2 H 1 1.384 0.030 . 1 . . . . 22 ALA HB . 11208 1 192 . 1 1 22 22 ALA HB3 H 1 1.384 0.030 . 1 . . . . 22 ALA HB . 11208 1 193 . 1 1 22 22 ALA C C 13 176.763 0.300 . 1 . . . . 22 ALA C . 11208 1 194 . 1 1 22 22 ALA CA C 13 52.176 0.300 . 1 . . . . 22 ALA CA . 11208 1 195 . 1 1 22 22 ALA CB C 13 20.651 0.300 . 1 . . . . 22 ALA CB . 11208 1 196 . 1 1 22 22 ALA N N 15 125.911 0.300 . 1 . . . . 22 ALA N . 11208 1 197 . 1 1 23 23 GLY H H 1 8.465 0.030 . 1 . . . . 23 GLY H . 11208 1 198 . 1 1 23 23 GLY HA2 H 1 4.606 0.030 . 2 . . . . 23 GLY HA2 . 11208 1 199 . 1 1 23 23 GLY HA3 H 1 3.811 0.030 . 2 . . . . 23 GLY HA3 . 11208 1 200 . 1 1 23 23 GLY C C 13 173.914 0.300 . 1 . . . . 23 GLY C . 11208 1 201 . 1 1 23 23 GLY CA C 13 43.715 0.300 . 1 . . . . 23 GLY CA . 11208 1 202 . 1 1 23 23 GLY N N 15 111.943 0.300 . 1 . . . . 23 GLY N . 11208 1 203 . 1 1 24 24 GLN H H 1 8.544 0.030 . 1 . . . . 24 GLN H . 11208 1 204 . 1 1 24 24 GLN HA H 1 4.275 0.030 . 1 . . . . 24 GLN HA . 11208 1 205 . 1 1 24 24 GLN HB2 H 1 2.052 0.030 . 1 . . . . 24 GLN HB2 . 11208 1 206 . 1 1 24 24 GLN HB3 H 1 2.052 0.030 . 1 . . . . 24 GLN HB3 . 11208 1 207 . 1 1 24 24 GLN HE21 H 1 6.908 0.030 . 2 . . . . 24 GLN HE21 . 11208 1 208 . 1 1 24 24 GLN HE22 H 1 7.484 0.030 . 2 . . . . 24 GLN HE22 . 11208 1 209 . 1 1 24 24 GLN HG2 H 1 2.415 0.030 . 2 . . . . 24 GLN HG2 . 11208 1 210 . 1 1 24 24 GLN HG3 H 1 2.167 0.030 . 2 . . . . 24 GLN HG3 . 11208 1 211 . 1 1 24 24 GLN C C 13 175.641 0.300 . 1 . . . . 24 GLN C . 11208 1 212 . 1 1 24 24 GLN CA C 13 59.045 0.300 . 1 . . . . 24 GLN CA . 11208 1 213 . 1 1 24 24 GLN CB C 13 29.899 0.300 . 1 . . . . 24 GLN CB . 11208 1 214 . 1 1 24 24 GLN CG C 13 34.666 0.300 . 1 . . . . 24 GLN CG . 11208 1 215 . 1 1 24 24 GLN N N 15 119.511 0.300 . 1 . . . . 24 GLN N . 11208 1 216 . 1 1 24 24 GLN NE2 N 15 111.703 0.300 . 1 . . . . 24 GLN NE2 . 11208 1 217 . 1 1 25 25 THR H H 1 7.725 0.030 . 1 . . . . 25 THR H . 11208 1 218 . 1 1 25 25 THR HA H 1 4.585 0.030 . 1 . . . . 25 THR HA . 11208 1 219 . 1 1 25 25 THR HB H 1 4.742 0.030 . 1 . . . . 25 THR HB . 11208 1 220 . 1 1 25 25 THR HG21 H 1 1.120 0.030 . 1 . . . . 25 THR HG2 . 11208 1 221 . 1 1 25 25 THR HG22 H 1 1.120 0.030 . 1 . . . . 25 THR HG2 . 11208 1 222 . 1 1 25 25 THR HG23 H 1 1.120 0.030 . 1 . . . . 25 THR HG2 . 11208 1 223 . 1 1 25 25 THR C C 13 174.099 0.300 . 1 . . . . 25 THR C . 11208 1 224 . 1 1 25 25 THR CA C 13 59.224 0.300 . 1 . . . . 25 THR CA . 11208 1 225 . 1 1 25 25 THR CB C 13 70.701 0.300 . 1 . . . . 25 THR CB . 11208 1 226 . 1 1 25 25 THR CG2 C 13 21.233 0.300 . 1 . . . . 25 THR CG2 . 11208 1 227 . 1 1 25 25 THR N N 15 141.606 0.300 . 1 . . . . 25 THR N . 11208 1 228 . 1 1 26 26 SER H H 1 7.118 0.030 . 1 . . . . 26 SER H . 11208 1 229 . 1 1 26 26 SER HA H 1 5.467 0.030 . 1 . . . . 26 SER HA . 11208 1 230 . 1 1 26 26 SER HB2 H 1 3.676 0.030 . 2 . . . . 26 SER HB2 . 11208 1 231 . 1 1 26 26 SER HB3 H 1 3.510 0.030 . 2 . . . . 26 SER HB3 . 11208 1 232 . 1 1 26 26 SER C C 13 172.017 0.300 . 1 . . . . 26 SER C . 11208 1 233 . 1 1 26 26 SER CA C 13 56.286 0.300 . 1 . . . . 26 SER CA . 11208 1 234 . 1 1 26 26 SER CB C 13 66.737 0.300 . 1 . . . . 26 SER CB . 11208 1 235 . 1 1 26 26 SER N N 15 113.148 0.300 . 1 . . . . 26 SER N . 11208 1 236 . 1 1 27 27 VAL H H 1 8.361 0.030 . 1 . . . . 27 VAL H . 11208 1 237 . 1 1 27 27 VAL HA H 1 4.400 0.030 . 1 . . . . 27 VAL HA . 11208 1 238 . 1 1 27 27 VAL HB H 1 1.431 0.030 . 1 . . . . 27 VAL HB . 11208 1 239 . 1 1 27 27 VAL HG11 H 1 0.657 0.030 . 1 . . . . 27 VAL HG1 . 11208 1 240 . 1 1 27 27 VAL HG12 H 1 0.657 0.030 . 1 . . . . 27 VAL HG1 . 11208 1 241 . 1 1 27 27 VAL HG13 H 1 0.657 0.030 . 1 . . . . 27 VAL HG1 . 11208 1 242 . 1 1 27 27 VAL HG21 H 1 0.395 0.030 . 1 . . . . 27 VAL HG2 . 11208 1 243 . 1 1 27 27 VAL HG22 H 1 0.395 0.030 . 1 . . . . 27 VAL HG2 . 11208 1 244 . 1 1 27 27 VAL HG23 H 1 0.395 0.030 . 1 . . . . 27 VAL HG2 . 11208 1 245 . 1 1 27 27 VAL C C 13 173.790 0.300 . 1 . . . . 27 VAL C . 11208 1 246 . 1 1 27 27 VAL CA C 13 61.250 0.300 . 1 . . . . 27 VAL CA . 11208 1 247 . 1 1 27 27 VAL CB C 13 36.368 0.300 . 1 . . . . 27 VAL CB . 11208 1 248 . 1 1 27 27 VAL CG1 C 13 21.630 0.300 . 2 . . . . 27 VAL CG1 . 11208 1 249 . 1 1 27 27 VAL CG2 C 13 20.770 0.300 . 2 . . . . 27 VAL CG2 . 11208 1 250 . 1 1 27 27 VAL N N 15 118.210 0.300 . 1 . . . . 27 VAL N . 11208 1 251 . 1 1 28 28 SER H H 1 8.730 0.030 . 1 . . . . 28 SER H . 11208 1 252 . 1 1 28 28 SER HA H 1 5.336 0.030 . 1 . . . . 28 SER HA . 11208 1 253 . 1 1 28 28 SER HB2 H 1 4.095 0.030 . 2 . . . . 28 SER HB2 . 11208 1 254 . 1 1 28 28 SER HB3 H 1 3.578 0.030 . 2 . . . . 28 SER HB3 . 11208 1 255 . 1 1 28 28 SER C C 13 172.961 0.300 . 1 . . . . 28 SER C . 11208 1 256 . 1 1 28 28 SER CA C 13 57.447 0.300 . 1 . . . . 28 SER CA . 11208 1 257 . 1 1 28 28 SER CB C 13 63.788 0.300 . 1 . . . . 28 SER CB . 11208 1 258 . 1 1 28 28 SER N N 15 121.961 0.300 . 1 . . . . 28 SER N . 11208 1 259 . 1 1 29 29 LEU H H 1 9.112 0.030 . 1 . . . . 29 LEU H . 11208 1 260 . 1 1 29 29 LEU HA H 1 5.055 0.030 . 1 . . . . 29 LEU HA . 11208 1 261 . 1 1 29 29 LEU HB2 H 1 1.816 0.030 . 2 . . . . 29 LEU HB2 . 11208 1 262 . 1 1 29 29 LEU HB3 H 1 1.426 0.030 . 2 . . . . 29 LEU HB3 . 11208 1 263 . 1 1 29 29 LEU HD11 H 1 0.285 0.030 . 1 . . . . 29 LEU HD1 . 11208 1 264 . 1 1 29 29 LEU HD12 H 1 0.285 0.030 . 1 . . . . 29 LEU HD1 . 11208 1 265 . 1 1 29 29 LEU HD13 H 1 0.285 0.030 . 1 . . . . 29 LEU HD1 . 11208 1 266 . 1 1 29 29 LEU HD21 H 1 0.328 0.030 . 1 . . . . 29 LEU HD2 . 11208 1 267 . 1 1 29 29 LEU HD22 H 1 0.328 0.030 . 1 . . . . 29 LEU HD2 . 11208 1 268 . 1 1 29 29 LEU HD23 H 1 0.328 0.030 . 1 . . . . 29 LEU HD2 . 11208 1 269 . 1 1 29 29 LEU HG H 1 1.256 0.030 . 1 . . . . 29 LEU HG . 11208 1 270 . 1 1 29 29 LEU C C 13 175.171 0.300 . 1 . . . . 29 LEU C . 11208 1 271 . 1 1 29 29 LEU CA C 13 53.669 0.300 . 1 . . . . 29 LEU CA . 11208 1 272 . 1 1 29 29 LEU CB C 13 46.744 0.300 . 1 . . . . 29 LEU CB . 11208 1 273 . 1 1 29 29 LEU CD1 C 13 23.448 0.300 . 2 . . . . 29 LEU CD1 . 11208 1 274 . 1 1 29 29 LEU CD2 C 13 25.539 0.300 . 2 . . . . 29 LEU CD2 . 11208 1 275 . 1 1 29 29 LEU CG C 13 26.829 0.300 . 1 . . . . 29 LEU CG . 11208 1 276 . 1 1 29 29 LEU N N 15 125.870 0.300 . 1 . . . . 29 LEU N . 11208 1 277 . 1 1 30 30 LEU H H 1 8.814 0.030 . 1 . . . . 30 LEU H . 11208 1 278 . 1 1 30 30 LEU HA H 1 4.742 0.030 . 1 . . . . 30 LEU HA . 11208 1 279 . 1 1 30 30 LEU HB2 H 1 1.420 0.030 . 1 . . . . 30 LEU HB2 . 11208 1 280 . 1 1 30 30 LEU HB3 H 1 1.420 0.030 . 1 . . . . 30 LEU HB3 . 11208 1 281 . 1 1 30 30 LEU HD11 H 1 0.665 0.030 . 1 . . . . 30 LEU HD1 . 11208 1 282 . 1 1 30 30 LEU HD12 H 1 0.665 0.030 . 1 . . . . 30 LEU HD1 . 11208 1 283 . 1 1 30 30 LEU HD13 H 1 0.665 0.030 . 1 . . . . 30 LEU HD1 . 11208 1 284 . 1 1 30 30 LEU HD21 H 1 0.665 0.030 . 1 . . . . 30 LEU HD2 . 11208 1 285 . 1 1 30 30 LEU HD22 H 1 0.665 0.030 . 1 . . . . 30 LEU HD2 . 11208 1 286 . 1 1 30 30 LEU HD23 H 1 0.665 0.030 . 1 . . . . 30 LEU HD2 . 11208 1 287 . 1 1 30 30 LEU HG H 1 1.356 0.030 . 1 . . . . 30 LEU HG . 11208 1 288 . 1 1 30 30 LEU C C 13 174.464 0.300 . 1 . . . . 30 LEU C . 11208 1 289 . 1 1 30 30 LEU CA C 13 54.739 0.300 . 1 . . . . 30 LEU CA . 11208 1 290 . 1 1 30 30 LEU CB C 13 45.952 0.300 . 1 . . . . 30 LEU CB . 11208 1 291 . 1 1 30 30 LEU CD1 C 13 25.399 0.300 . 2 . . . . 30 LEU CD1 . 11208 1 292 . 1 1 30 30 LEU CD2 C 13 24.910 0.300 . 2 . . . . 30 LEU CD2 . 11208 1 293 . 1 1 30 30 LEU CG C 13 27.053 0.300 . 1 . . . . 30 LEU CG . 11208 1 294 . 1 1 30 30 LEU N N 15 122.082 0.300 . 1 . . . . 30 LEU N . 11208 1 295 . 1 1 31 31 TRP H H 1 7.946 0.030 . 1 . . . . 31 TRP H . 11208 1 296 . 1 1 31 31 TRP HA H 1 5.326 0.030 . 1 . . . . 31 TRP HA . 11208 1 297 . 1 1 31 31 TRP HB2 H 1 3.372 0.030 . 2 . . . . 31 TRP HB2 . 11208 1 298 . 1 1 31 31 TRP HB3 H 1 3.269 0.030 . 2 . . . . 31 TRP HB3 . 11208 1 299 . 1 1 31 31 TRP HD1 H 1 6.448 0.030 . 1 . . . . 31 TRP HD1 . 11208 1 300 . 1 1 31 31 TRP HE1 H 1 5.611 0.030 . 1 . . . . 31 TRP HE1 . 11208 1 301 . 1 1 31 31 TRP HE3 H 1 6.825 0.030 . 1 . . . . 31 TRP HE3 . 11208 1 302 . 1 1 31 31 TRP HH2 H 1 6.546 0.030 . 1 . . . . 31 TRP HH2 . 11208 1 303 . 1 1 31 31 TRP HZ2 H 1 7.006 0.030 . 1 . . . . 31 TRP HZ2 . 11208 1 304 . 1 1 31 31 TRP HZ3 H 1 6.524 0.030 . 1 . . . . 31 TRP HZ3 . 11208 1 305 . 1 1 31 31 TRP C C 13 173.483 0.300 . 1 . . . . 31 TRP C . 11208 1 306 . 1 1 31 31 TRP CA C 13 56.296 0.300 . 1 . . . . 31 TRP CA . 11208 1 307 . 1 1 31 31 TRP CB C 13 31.150 0.300 . 1 . . . . 31 TRP CB . 11208 1 308 . 1 1 31 31 TRP CD1 C 13 124.765 0.300 . 1 . . . . 31 TRP CD1 . 11208 1 309 . 1 1 31 31 TRP CE3 C 13 119.256 0.300 . 1 . . . . 31 TRP CE3 . 11208 1 310 . 1 1 31 31 TRP CH2 C 13 123.531 0.300 . 1 . . . . 31 TRP CH2 . 11208 1 311 . 1 1 31 31 TRP CZ2 C 13 115.474 0.300 . 1 . . . . 31 TRP CZ2 . 11208 1 312 . 1 1 31 31 TRP CZ3 C 13 120.777 0.300 . 1 . . . . 31 TRP CZ3 . 11208 1 313 . 1 1 31 31 TRP N N 15 120.738 0.300 . 1 . . . . 31 TRP N . 11208 1 314 . 1 1 31 31 TRP NE1 N 15 123.997 0.300 . 1 . . . . 31 TRP NE1 . 11208 1 315 . 1 1 32 32 GLN H H 1 7.717 0.030 . 1 . . . . 32 GLN H . 11208 1 316 . 1 1 32 32 GLN HA H 1 4.674 0.030 . 1 . . . . 32 GLN HA . 11208 1 317 . 1 1 32 32 GLN HB2 H 1 2.213 0.030 . 2 . . . . 32 GLN HB2 . 11208 1 318 . 1 1 32 32 GLN HB3 H 1 1.966 0.030 . 2 . . . . 32 GLN HB3 . 11208 1 319 . 1 1 32 32 GLN HE21 H 1 6.910 0.030 . 2 . . . . 32 GLN HE21 . 11208 1 320 . 1 1 32 32 GLN HE22 H 1 7.555 0.030 . 2 . . . . 32 GLN HE22 . 11208 1 321 . 1 1 32 32 GLN HG2 H 1 2.477 0.030 . 2 . . . . 32 GLN HG2 . 11208 1 322 . 1 1 32 32 GLN HG3 H 1 2.325 0.030 . 2 . . . . 32 GLN HG3 . 11208 1 323 . 1 1 32 32 GLN C C 13 176.053 0.300 . 1 . . . . 32 GLN C . 11208 1 324 . 1 1 32 32 GLN CA C 13 53.707 0.300 . 1 . . . . 32 GLN CA . 11208 1 325 . 1 1 32 32 GLN CB C 13 31.421 0.300 . 1 . . . . 32 GLN CB . 11208 1 326 . 1 1 32 32 GLN CG C 13 34.327 0.300 . 1 . . . . 32 GLN CG . 11208 1 327 . 1 1 32 32 GLN N N 15 115.368 0.300 . 1 . . . . 32 GLN N . 11208 1 328 . 1 1 32 32 GLN NE2 N 15 111.450 0.300 . 1 . . . . 32 GLN NE2 . 11208 1 329 . 1 1 33 33 GLU H H 1 9.023 0.030 . 1 . . . . 33 GLU H . 11208 1 330 . 1 1 33 33 GLU HA H 1 4.684 0.030 . 1 . . . . 33 GLU HA . 11208 1 331 . 1 1 33 33 GLU HB2 H 1 2.055 0.030 . 2 . . . . 33 GLU HB2 . 11208 1 332 . 1 1 33 33 GLU HB3 H 1 2.012 0.030 . 2 . . . . 33 GLU HB3 . 11208 1 333 . 1 1 33 33 GLU HG2 H 1 2.519 0.030 . 2 . . . . 33 GLU HG2 . 11208 1 334 . 1 1 33 33 GLU HG3 H 1 2.402 0.030 . 2 . . . . 33 GLU HG3 . 11208 1 335 . 1 1 33 33 GLU C C 13 174.308 0.300 . 1 . . . . 33 GLU C . 11208 1 336 . 1 1 33 33 GLU CA C 13 55.199 0.300 . 1 . . . . 33 GLU CA . 11208 1 337 . 1 1 33 33 GLU CB C 13 30.055 0.300 . 1 . . . . 33 GLU CB . 11208 1 338 . 1 1 33 33 GLU CG C 13 36.353 0.300 . 1 . . . . 33 GLU CG . 11208 1 339 . 1 1 33 33 GLU N N 15 124.787 0.300 . 1 . . . . 33 GLU N . 11208 1 340 . 1 1 34 34 PRO HA H 1 4.242 0.030 . 1 . . . . 34 PRO HA . 11208 1 341 . 1 1 34 34 PRO HB2 H 1 2.345 0.030 . 2 . . . . 34 PRO HB2 . 11208 1 342 . 1 1 34 34 PRO HB3 H 1 1.452 0.030 . 2 . . . . 34 PRO HB3 . 11208 1 343 . 1 1 34 34 PRO HD2 H 1 3.774 0.030 . 2 . . . . 34 PRO HD2 . 11208 1 344 . 1 1 34 34 PRO HD3 H 1 4.078 0.030 . 2 . . . . 34 PRO HD3 . 11208 1 345 . 1 1 34 34 PRO HG2 H 1 1.808 0.030 . 2 . . . . 34 PRO HG2 . 11208 1 346 . 1 1 34 34 PRO HG3 H 1 1.865 0.030 . 2 . . . . 34 PRO HG3 . 11208 1 347 . 1 1 34 34 PRO C C 13 175.151 0.300 . 1 . . . . 34 PRO C . 11208 1 348 . 1 1 34 34 PRO CA C 13 62.923 0.300 . 1 . . . . 34 PRO CA . 11208 1 349 . 1 1 34 34 PRO CB C 13 33.121 0.300 . 1 . . . . 34 PRO CB . 11208 1 350 . 1 1 34 34 PRO CD C 13 50.954 0.300 . 1 . . . . 34 PRO CD . 11208 1 351 . 1 1 34 34 PRO CG C 13 28.193 0.300 . 1 . . . . 34 PRO CG . 11208 1 352 . 1 1 35 35 GLU H H 1 8.507 0.030 . 1 . . . . 35 GLU H . 11208 1 353 . 1 1 35 35 GLU HA H 1 3.988 0.030 . 1 . . . . 35 GLU HA . 11208 1 354 . 1 1 35 35 GLU HB2 H 1 2.067 0.030 . 2 . . . . 35 GLU HB2 . 11208 1 355 . 1 1 35 35 GLU HB3 H 1 1.999 0.030 . 2 . . . . 35 GLU HB3 . 11208 1 356 . 1 1 35 35 GLU HG2 H 1 2.460 0.030 . 2 . . . . 35 GLU HG2 . 11208 1 357 . 1 1 35 35 GLU HG3 H 1 2.314 0.030 . 2 . . . . 35 GLU HG3 . 11208 1 358 . 1 1 35 35 GLU C C 13 176.868 0.300 . 1 . . . . 35 GLU C . 11208 1 359 . 1 1 35 35 GLU CA C 13 58.874 0.300 . 1 . . . . 35 GLU CA . 11208 1 360 . 1 1 35 35 GLU CB C 13 30.270 0.300 . 1 . . . . 35 GLU CB . 11208 1 361 . 1 1 35 35 GLU CG C 13 36.811 0.300 . 1 . . . . 35 GLU CG . 11208 1 362 . 1 1 35 35 GLU N N 15 121.036 0.300 . 1 . . . . 35 GLU N . 11208 1 363 . 1 1 36 36 GLN H H 1 8.084 0.030 . 1 . . . . 36 GLN H . 11208 1 364 . 1 1 36 36 GLN HA H 1 4.850 0.030 . 1 . . . . 36 GLN HA . 11208 1 365 . 1 1 36 36 GLN HB2 H 1 1.957 0.030 . 2 . . . . 36 GLN HB2 . 11208 1 366 . 1 1 36 36 GLN HB3 H 1 2.007 0.030 . 2 . . . . 36 GLN HB3 . 11208 1 367 . 1 1 36 36 GLN HE21 H 1 6.823 0.030 . 2 . . . . 36 GLN HE21 . 11208 1 368 . 1 1 36 36 GLN HE22 H 1 7.578 0.030 . 2 . . . . 36 GLN HE22 . 11208 1 369 . 1 1 36 36 GLN HG2 H 1 2.320 0.030 . 2 . . . . 36 GLN HG2 . 11208 1 370 . 1 1 36 36 GLN HG3 H 1 2.259 0.030 . 2 . . . . 36 GLN HG3 . 11208 1 371 . 1 1 36 36 GLN C C 13 172.633 0.300 . 1 . . . . 36 GLN C . 11208 1 372 . 1 1 36 36 GLN CA C 13 52.319 0.300 . 1 . . . . 36 GLN CA . 11208 1 373 . 1 1 36 36 GLN CB C 13 28.961 0.300 . 1 . . . . 36 GLN CB . 11208 1 374 . 1 1 36 36 GLN CG C 13 33.402 0.300 . 1 . . . . 36 GLN CG . 11208 1 375 . 1 1 36 36 GLN N N 15 115.201 0.300 . 1 . . . . 36 GLN N . 11208 1 376 . 1 1 36 36 GLN NE2 N 15 112.172 0.300 . 1 . . . . 36 GLN NE2 . 11208 1 377 . 1 1 37 37 PRO HA H 1 3.986 0.030 . 1 . . . . 37 PRO HA . 11208 1 378 . 1 1 37 37 PRO HB2 H 1 2.061 0.030 . 2 . . . . 37 PRO HB2 . 11208 1 379 . 1 1 37 37 PRO HB3 H 1 2.303 0.030 . 2 . . . . 37 PRO HB3 . 11208 1 380 . 1 1 37 37 PRO HD2 H 1 3.760 0.030 . 2 . . . . 37 PRO HD2 . 11208 1 381 . 1 1 37 37 PRO HD3 H 1 3.558 0.030 . 2 . . . . 37 PRO HD3 . 11208 1 382 . 1 1 37 37 PRO HG2 H 1 2.199 0.030 . 2 . . . . 37 PRO HG2 . 11208 1 383 . 1 1 37 37 PRO HG3 H 1 1.991 0.030 . 2 . . . . 37 PRO HG3 . 11208 1 384 . 1 1 37 37 PRO CA C 13 64.361 0.300 . 1 . . . . 37 PRO CA . 11208 1 385 . 1 1 37 37 PRO CB C 13 31.996 0.300 . 1 . . . . 37 PRO CB . 11208 1 386 . 1 1 37 37 PRO CD C 13 50.293 0.300 . 1 . . . . 37 PRO CD . 11208 1 387 . 1 1 37 37 PRO CG C 13 27.447 0.300 . 1 . . . . 37 PRO CG . 11208 1 388 . 1 1 38 38 ASN H H 1 8.380 0.030 . 1 . . . . 38 ASN H . 11208 1 389 . 1 1 38 38 ASN HA H 1 4.247 0.030 . 1 . . . . 38 ASN HA . 11208 1 390 . 1 1 38 38 ASN HB2 H 1 2.806 0.030 . 2 . . . . 38 ASN HB2 . 11208 1 391 . 1 1 38 38 ASN HB3 H 1 2.472 0.030 . 2 . . . . 38 ASN HB3 . 11208 1 392 . 1 1 38 38 ASN HD21 H 1 6.972 0.030 . 2 . . . . 38 ASN HD21 . 11208 1 393 . 1 1 38 38 ASN HD22 H 1 7.339 0.030 . 2 . . . . 38 ASN HD22 . 11208 1 394 . 1 1 38 38 ASN C C 13 173.563 0.300 . 1 . . . . 38 ASN C . 11208 1 395 . 1 1 38 38 ASN CA C 13 53.910 0.300 . 1 . . . . 38 ASN CA . 11208 1 396 . 1 1 38 38 ASN CB C 13 37.237 0.300 . 1 . . . . 38 ASN CB . 11208 1 397 . 1 1 38 38 ASN N N 15 109.219 0.300 . 1 . . . . 38 ASN N . 11208 1 398 . 1 1 38 38 ASN ND2 N 15 115.865 0.300 . 1 . . . . 38 ASN ND2 . 11208 1 399 . 1 1 39 39 GLY H H 1 7.455 0.030 . 1 . . . . 39 GLY H . 11208 1 400 . 1 1 39 39 GLY HA2 H 1 4.239 0.030 . 2 . . . . 39 GLY HA2 . 11208 1 401 . 1 1 39 39 GLY HA3 H 1 3.794 0.030 . 2 . . . . 39 GLY HA3 . 11208 1 402 . 1 1 39 39 GLY C C 13 171.933 0.300 . 1 . . . . 39 GLY C . 11208 1 403 . 1 1 39 39 GLY CA C 13 44.109 0.300 . 1 . . . . 39 GLY CA . 11208 1 404 . 1 1 39 39 GLY N N 15 104.528 0.300 . 1 . . . . 39 GLY N . 11208 1 405 . 1 1 40 40 ILE H H 1 8.168 0.030 . 1 . . . . 40 ILE H . 11208 1 406 . 1 1 40 40 ILE HA H 1 4.054 0.030 . 1 . . . . 40 ILE HA . 11208 1 407 . 1 1 40 40 ILE HB H 1 1.728 0.030 . 1 . . . . 40 ILE HB . 11208 1 408 . 1 1 40 40 ILE HD11 H 1 0.859 0.030 . 1 . . . . 40 ILE HD1 . 11208 1 409 . 1 1 40 40 ILE HD12 H 1 0.859 0.030 . 1 . . . . 40 ILE HD1 . 11208 1 410 . 1 1 40 40 ILE HD13 H 1 0.859 0.030 . 1 . . . . 40 ILE HD1 . 11208 1 411 . 1 1 40 40 ILE HG12 H 1 1.545 0.030 . 2 . . . . 40 ILE HG12 . 11208 1 412 . 1 1 40 40 ILE HG13 H 1 1.201 0.030 . 2 . . . . 40 ILE HG13 . 11208 1 413 . 1 1 40 40 ILE HG21 H 1 0.831 0.030 . 1 . . . . 40 ILE HG2 . 11208 1 414 . 1 1 40 40 ILE HG22 H 1 0.831 0.030 . 1 . . . . 40 ILE HG2 . 11208 1 415 . 1 1 40 40 ILE HG23 H 1 0.831 0.030 . 1 . . . . 40 ILE HG2 . 11208 1 416 . 1 1 40 40 ILE C C 13 176.689 0.300 . 1 . . . . 40 ILE C . 11208 1 417 . 1 1 40 40 ILE CA C 13 60.281 0.300 . 1 . . . . 40 ILE CA . 11208 1 418 . 1 1 40 40 ILE CB C 13 38.786 0.300 . 1 . . . . 40 ILE CB . 11208 1 419 . 1 1 40 40 ILE CD1 C 13 12.328 0.300 . 1 . . . . 40 ILE CD1 . 11208 1 420 . 1 1 40 40 ILE CG1 C 13 27.543 0.300 . 1 . . . . 40 ILE CG1 . 11208 1 421 . 1 1 40 40 ILE CG2 C 13 17.063 0.300 . 1 . . . . 40 ILE CG2 . 11208 1 422 . 1 1 40 40 ILE N N 15 120.028 0.300 . 1 . . . . 40 ILE N . 11208 1 423 . 1 1 41 41 ILE H H 1 8.779 0.030 . 1 . . . . 41 ILE H . 11208 1 424 . 1 1 41 41 ILE HA H 1 3.686 0.030 . 1 . . . . 41 ILE HA . 11208 1 425 . 1 1 41 41 ILE HB H 1 1.810 0.030 . 1 . . . . 41 ILE HB . 11208 1 426 . 1 1 41 41 ILE HD11 H 1 0.834 0.030 . 1 . . . . 41 ILE HD1 . 11208 1 427 . 1 1 41 41 ILE HD12 H 1 0.834 0.030 . 1 . . . . 41 ILE HD1 . 11208 1 428 . 1 1 41 41 ILE HD13 H 1 0.834 0.030 . 1 . . . . 41 ILE HD1 . 11208 1 429 . 1 1 41 41 ILE HG12 H 1 1.661 0.030 . 2 . . . . 41 ILE HG12 . 11208 1 430 . 1 1 41 41 ILE HG13 H 1 0.864 0.030 . 2 . . . . 41 ILE HG13 . 11208 1 431 . 1 1 41 41 ILE HG21 H 1 0.383 0.030 . 1 . . . . 41 ILE HG2 . 11208 1 432 . 1 1 41 41 ILE HG22 H 1 0.383 0.030 . 1 . . . . 41 ILE HG2 . 11208 1 433 . 1 1 41 41 ILE HG23 H 1 0.383 0.030 . 1 . . . . 41 ILE HG2 . 11208 1 434 . 1 1 41 41 ILE C C 13 175.811 0.300 . 1 . . . . 41 ILE C . 11208 1 435 . 1 1 41 41 ILE CA C 13 62.305 0.300 . 1 . . . . 41 ILE CA . 11208 1 436 . 1 1 41 41 ILE CB C 13 36.896 0.300 . 1 . . . . 41 ILE CB . 11208 1 437 . 1 1 41 41 ILE CD1 C 13 13.212 0.300 . 1 . . . . 41 ILE CD1 . 11208 1 438 . 1 1 41 41 ILE CG1 C 13 28.547 0.300 . 1 . . . . 41 ILE CG1 . 11208 1 439 . 1 1 41 41 ILE CG2 C 13 17.145 0.300 . 1 . . . . 41 ILE CG2 . 11208 1 440 . 1 1 41 41 ILE N N 15 128.245 0.300 . 1 . . . . 41 ILE N . 11208 1 441 . 1 1 42 42 LEU H H 1 8.917 0.030 . 1 . . . . 42 LEU H . 11208 1 442 . 1 1 42 42 LEU HA H 1 4.280 0.030 . 1 . . . . 42 LEU HA . 11208 1 443 . 1 1 42 42 LEU HB2 H 1 1.477 0.030 . 2 . . . . 42 LEU HB2 . 11208 1 444 . 1 1 42 42 LEU HB3 H 1 1.398 0.030 . 2 . . . . 42 LEU HB3 . 11208 1 445 . 1 1 42 42 LEU HD11 H 1 0.743 0.030 . 1 . . . . 42 LEU HD1 . 11208 1 446 . 1 1 42 42 LEU HD12 H 1 0.743 0.030 . 1 . . . . 42 LEU HD1 . 11208 1 447 . 1 1 42 42 LEU HD13 H 1 0.743 0.030 . 1 . . . . 42 LEU HD1 . 11208 1 448 . 1 1 42 42 LEU HD21 H 1 0.813 0.030 . 1 . . . . 42 LEU HD2 . 11208 1 449 . 1 1 42 42 LEU HD22 H 1 0.813 0.030 . 1 . . . . 42 LEU HD2 . 11208 1 450 . 1 1 42 42 LEU HD23 H 1 0.813 0.030 . 1 . . . . 42 LEU HD2 . 11208 1 451 . 1 1 42 42 LEU HG H 1 1.724 0.030 . 1 . . . . 42 LEU HG . 11208 1 452 . 1 1 42 42 LEU C C 13 177.254 0.300 . 1 . . . . 42 LEU C . 11208 1 453 . 1 1 42 42 LEU CA C 13 55.919 0.300 . 1 . . . . 42 LEU CA . 11208 1 454 . 1 1 42 42 LEU CB C 13 43.502 0.300 . 1 . . . . 42 LEU CB . 11208 1 455 . 1 1 42 42 LEU CD1 C 13 25.380 0.300 . 2 . . . . 42 LEU CD1 . 11208 1 456 . 1 1 42 42 LEU CD2 C 13 21.992 0.300 . 2 . . . . 42 LEU CD2 . 11208 1 457 . 1 1 42 42 LEU CG C 13 27.095 0.300 . 1 . . . . 42 LEU CG . 11208 1 458 . 1 1 42 42 LEU N N 15 129.747 0.300 . 1 . . . . 42 LEU N . 11208 1 459 . 1 1 43 43 GLU H H 1 7.480 0.030 . 1 . . . . 43 GLU H . 11208 1 460 . 1 1 43 43 GLU HA H 1 4.629 0.030 . 1 . . . . 43 GLU HA . 11208 1 461 . 1 1 43 43 GLU HB2 H 1 2.363 0.030 . 2 . . . . 43 GLU HB2 . 11208 1 462 . 1 1 43 43 GLU HB3 H 1 1.944 0.030 . 2 . . . . 43 GLU HB3 . 11208 1 463 . 1 1 43 43 GLU HG2 H 1 1.899 0.030 . 2 . . . . 43 GLU HG2 . 11208 1 464 . 1 1 43 43 GLU HG3 H 1 2.052 0.030 . 2 . . . . 43 GLU HG3 . 11208 1 465 . 1 1 43 43 GLU C C 13 172.165 0.300 . 1 . . . . 43 GLU C . 11208 1 466 . 1 1 43 43 GLU CA C 13 54.730 0.300 . 1 . . . . 43 GLU CA . 11208 1 467 . 1 1 43 43 GLU CB C 13 31.847 0.300 . 1 . . . . 43 GLU CB . 11208 1 468 . 1 1 43 43 GLU CG C 13 34.921 0.300 . 1 . . . . 43 GLU CG . 11208 1 469 . 1 1 43 43 GLU N N 15 112.151 0.300 . 1 . . . . 43 GLU N . 11208 1 470 . 1 1 44 44 TYR H H 1 9.440 0.030 . 1 . . . . 44 TYR H . 11208 1 471 . 1 1 44 44 TYR HA H 1 5.293 0.030 . 1 . . . . 44 TYR HA . 11208 1 472 . 1 1 44 44 TYR HB2 H 1 2.958 0.030 . 2 . . . . 44 TYR HB2 . 11208 1 473 . 1 1 44 44 TYR HB3 H 1 2.703 0.030 . 2 . . . . 44 TYR HB3 . 11208 1 474 . 1 1 44 44 TYR HD1 H 1 7.139 0.030 . 3 . . . . 44 TYR HD1 . 11208 1 475 . 1 1 44 44 TYR HD2 H 1 6.700 0.030 . 3 . . . . 44 TYR HD2 . 11208 1 476 . 1 1 44 44 TYR HE1 H 1 6.619 0.030 . 3 . . . . 44 TYR HE1 . 11208 1 477 . 1 1 44 44 TYR HE2 H 1 6.662 0.030 . 3 . . . . 44 TYR HE2 . 11208 1 478 . 1 1 44 44 TYR C C 13 174.570 0.300 . 1 . . . . 44 TYR C . 11208 1 479 . 1 1 44 44 TYR CA C 13 56.659 0.300 . 1 . . . . 44 TYR CA . 11208 1 480 . 1 1 44 44 TYR CB C 13 41.865 0.300 . 1 . . . . 44 TYR CB . 11208 1 481 . 1 1 44 44 TYR CD1 C 13 135.946 0.300 . 3 . . . . 44 TYR CD1 . 11208 1 482 . 1 1 44 44 TYR CD2 C 13 132.567 0.300 . 3 . . . . 44 TYR CD2 . 11208 1 483 . 1 1 44 44 TYR CE1 C 13 116.871 0.300 . 1 . . . . 44 TYR CE1 . 11208 1 484 . 1 1 44 44 TYR CE2 C 13 116.871 0.300 . 1 . . . . 44 TYR CE2 . 11208 1 485 . 1 1 44 44 TYR N N 15 116.207 0.300 . 1 . . . . 44 TYR N . 11208 1 486 . 1 1 45 45 GLU H H 1 9.189 0.030 . 1 . . . . 45 GLU H . 11208 1 487 . 1 1 45 45 GLU HA H 1 5.028 0.030 . 1 . . . . 45 GLU HA . 11208 1 488 . 1 1 45 45 GLU HB2 H 1 1.951 0.030 . 2 . . . . 45 GLU HB2 . 11208 1 489 . 1 1 45 45 GLU HB3 H 1 1.834 0.030 . 2 . . . . 45 GLU HB3 . 11208 1 490 . 1 1 45 45 GLU HG2 H 1 2.168 0.030 . 2 . . . . 45 GLU HG2 . 11208 1 491 . 1 1 45 45 GLU HG3 H 1 2.086 0.030 . 2 . . . . 45 GLU HG3 . 11208 1 492 . 1 1 45 45 GLU C C 13 174.468 0.300 . 1 . . . . 45 GLU C . 11208 1 493 . 1 1 45 45 GLU CA C 13 54.847 0.300 . 1 . . . . 45 GLU CA . 11208 1 494 . 1 1 45 45 GLU CB C 13 33.637 0.300 . 1 . . . . 45 GLU CB . 11208 1 495 . 1 1 45 45 GLU CG C 13 36.822 0.300 . 1 . . . . 45 GLU CG . 11208 1 496 . 1 1 45 45 GLU N N 15 120.734 0.300 . 1 . . . . 45 GLU N . 11208 1 497 . 1 1 46 46 ILE H H 1 9.480 0.030 . 1 . . . . 46 ILE H . 11208 1 498 . 1 1 46 46 ILE HA H 1 4.923 0.030 . 1 . . . . 46 ILE HA . 11208 1 499 . 1 1 46 46 ILE HB H 1 2.015 0.030 . 1 . . . . 46 ILE HB . 11208 1 500 . 1 1 46 46 ILE HD11 H 1 0.787 0.030 . 1 . . . . 46 ILE HD1 . 11208 1 501 . 1 1 46 46 ILE HD12 H 1 0.787 0.030 . 1 . . . . 46 ILE HD1 . 11208 1 502 . 1 1 46 46 ILE HD13 H 1 0.787 0.030 . 1 . . . . 46 ILE HD1 . 11208 1 503 . 1 1 46 46 ILE HG12 H 1 1.320 0.030 . 2 . . . . 46 ILE HG12 . 11208 1 504 . 1 1 46 46 ILE HG13 H 1 0.647 0.030 . 2 . . . . 46 ILE HG13 . 11208 1 505 . 1 1 46 46 ILE HG21 H 1 0.925 0.030 . 1 . . . . 46 ILE HG2 . 11208 1 506 . 1 1 46 46 ILE HG22 H 1 0.925 0.030 . 1 . . . . 46 ILE HG2 . 11208 1 507 . 1 1 46 46 ILE HG23 H 1 0.925 0.030 . 1 . . . . 46 ILE HG2 . 11208 1 508 . 1 1 46 46 ILE C C 13 174.745 0.300 . 1 . . . . 46 ILE C . 11208 1 509 . 1 1 46 46 ILE CA C 13 60.225 0.300 . 1 . . . . 46 ILE CA . 11208 1 510 . 1 1 46 46 ILE CB C 13 39.746 0.300 . 1 . . . . 46 ILE CB . 11208 1 511 . 1 1 46 46 ILE CD1 C 13 15.689 0.300 . 1 . . . . 46 ILE CD1 . 11208 1 512 . 1 1 46 46 ILE CG1 C 13 28.480 0.300 . 1 . . . . 46 ILE CG1 . 11208 1 513 . 1 1 46 46 ILE CG2 C 13 18.748 0.300 . 1 . . . . 46 ILE CG2 . 11208 1 514 . 1 1 46 46 ILE N N 15 126.476 0.300 . 1 . . . . 46 ILE N . 11208 1 515 . 1 1 47 47 LYS H H 1 9.273 0.030 . 1 . . . . 47 LYS H . 11208 1 516 . 1 1 47 47 LYS HA H 1 5.399 0.030 . 1 . . . . 47 LYS HA . 11208 1 517 . 1 1 47 47 LYS HB2 H 1 1.491 0.030 . 2 . . . . 47 LYS HB2 . 11208 1 518 . 1 1 47 47 LYS HB3 H 1 1.085 0.030 . 2 . . . . 47 LYS HB3 . 11208 1 519 . 1 1 47 47 LYS HD2 H 1 0.836 0.030 . 2 . . . . 47 LYS HD2 . 11208 1 520 . 1 1 47 47 LYS HD3 H 1 0.711 0.030 . 2 . . . . 47 LYS HD3 . 11208 1 521 . 1 1 47 47 LYS HE2 H 1 1.748 0.030 . 2 . . . . 47 LYS HE2 . 11208 1 522 . 1 1 47 47 LYS HE3 H 1 1.606 0.030 . 2 . . . . 47 LYS HE3 . 11208 1 523 . 1 1 47 47 LYS HG2 H 1 0.845 0.030 . 2 . . . . 47 LYS HG2 . 11208 1 524 . 1 1 47 47 LYS HG3 H 1 1.147 0.030 . 2 . . . . 47 LYS HG3 . 11208 1 525 . 1 1 47 47 LYS C C 13 174.796 0.300 . 1 . . . . 47 LYS C . 11208 1 526 . 1 1 47 47 LYS CA C 13 54.243 0.300 . 1 . . . . 47 LYS CA . 11208 1 527 . 1 1 47 47 LYS CB C 13 36.300 0.300 . 1 . . . . 47 LYS CB . 11208 1 528 . 1 1 47 47 LYS CD C 13 29.530 0.300 . 1 . . . . 47 LYS CD . 11208 1 529 . 1 1 47 47 LYS CE C 13 40.985 0.300 . 1 . . . . 47 LYS CE . 11208 1 530 . 1 1 47 47 LYS CG C 13 25.270 0.300 . 1 . . . . 47 LYS CG . 11208 1 531 . 1 1 47 47 LYS N N 15 129.075 0.300 . 1 . . . . 47 LYS N . 11208 1 532 . 1 1 48 48 TYR H H 1 8.944 0.030 . 1 . . . . 48 TYR H . 11208 1 533 . 1 1 48 48 TYR HA H 1 5.791 0.030 . 1 . . . . 48 TYR HA . 11208 1 534 . 1 1 48 48 TYR HB2 H 1 2.554 0.030 . 2 . . . . 48 TYR HB2 . 11208 1 535 . 1 1 48 48 TYR HB3 H 1 1.889 0.030 . 2 . . . . 48 TYR HB3 . 11208 1 536 . 1 1 48 48 TYR HD1 H 1 6.589 0.030 . 1 . . . . 48 TYR HD1 . 11208 1 537 . 1 1 48 48 TYR HD2 H 1 6.589 0.030 . 1 . . . . 48 TYR HD2 . 11208 1 538 . 1 1 48 48 TYR HE1 H 1 6.501 0.030 . 1 . . . . 48 TYR HE1 . 11208 1 539 . 1 1 48 48 TYR HE2 H 1 6.501 0.030 . 1 . . . . 48 TYR HE2 . 11208 1 540 . 1 1 48 48 TYR C C 13 173.813 0.300 . 1 . . . . 48 TYR C . 11208 1 541 . 1 1 48 48 TYR CA C 13 55.167 0.300 . 1 . . . . 48 TYR CA . 11208 1 542 . 1 1 48 48 TYR CB C 13 42.924 0.300 . 1 . . . . 48 TYR CB . 11208 1 543 . 1 1 48 48 TYR CD1 C 13 132.916 0.300 . 1 . . . . 48 TYR CD1 . 11208 1 544 . 1 1 48 48 TYR CD2 C 13 132.916 0.300 . 1 . . . . 48 TYR CD2 . 11208 1 545 . 1 1 48 48 TYR CE1 C 13 118.142 0.300 . 1 . . . . 48 TYR CE1 . 11208 1 546 . 1 1 48 48 TYR CE2 C 13 118.142 0.300 . 1 . . . . 48 TYR CE2 . 11208 1 547 . 1 1 48 48 TYR N N 15 122.556 0.300 . 1 . . . . 48 TYR N . 11208 1 548 . 1 1 49 49 TYR H H 1 7.796 0.030 . 1 . . . . 49 TYR H . 11208 1 549 . 1 1 49 49 TYR HA H 1 4.883 0.030 . 1 . . . . 49 TYR HA . 11208 1 550 . 1 1 49 49 TYR HB2 H 1 3.228 0.030 . 2 . . . . 49 TYR HB2 . 11208 1 551 . 1 1 49 49 TYR HB3 H 1 2.946 0.030 . 2 . . . . 49 TYR HB3 . 11208 1 552 . 1 1 49 49 TYR HD1 H 1 6.661 0.030 . 1 . . . . 49 TYR HD1 . 11208 1 553 . 1 1 49 49 TYR HD2 H 1 6.661 0.030 . 1 . . . . 49 TYR HD2 . 11208 1 554 . 1 1 49 49 TYR HE1 H 1 6.511 0.030 . 1 . . . . 49 TYR HE1 . 11208 1 555 . 1 1 49 49 TYR HE2 H 1 6.511 0.030 . 1 . . . . 49 TYR HE2 . 11208 1 556 . 1 1 49 49 TYR C C 13 173.901 0.300 . 1 . . . . 49 TYR C . 11208 1 557 . 1 1 49 49 TYR CA C 13 55.150 0.300 . 1 . . . . 49 TYR CA . 11208 1 558 . 1 1 49 49 TYR CB C 13 39.262 0.300 . 1 . . . . 49 TYR CB . 11208 1 559 . 1 1 49 49 TYR CD1 C 13 133.965 0.300 . 1 . . . . 49 TYR CD1 . 11208 1 560 . 1 1 49 49 TYR CD2 C 13 133.965 0.300 . 1 . . . . 49 TYR CD2 . 11208 1 561 . 1 1 49 49 TYR CE1 C 13 117.139 0.300 . 1 . . . . 49 TYR CE1 . 11208 1 562 . 1 1 49 49 TYR CE2 C 13 117.139 0.300 . 1 . . . . 49 TYR CE2 . 11208 1 563 . 1 1 49 49 TYR N N 15 113.659 0.300 . 1 . . . . 49 TYR N . 11208 1 564 . 1 1 50 50 GLU H H 1 9.007 0.030 . 1 . . . . 50 GLU H . 11208 1 565 . 1 1 50 50 GLU HA H 1 3.847 0.030 . 1 . . . . 50 GLU HA . 11208 1 566 . 1 1 50 50 GLU HB2 H 1 1.850 0.030 . 2 . . . . 50 GLU HB2 . 11208 1 567 . 1 1 50 50 GLU HB3 H 1 1.746 0.030 . 2 . . . . 50 GLU HB3 . 11208 1 568 . 1 1 50 50 GLU HG2 H 1 2.050 0.030 . 2 . . . . 50 GLU HG2 . 11208 1 569 . 1 1 50 50 GLU HG3 H 1 1.810 0.030 . 2 . . . . 50 GLU HG3 . 11208 1 570 . 1 1 50 50 GLU C C 13 176.407 0.300 . 1 . . . . 50 GLU C . 11208 1 571 . 1 1 50 50 GLU CA C 13 56.254 0.300 . 1 . . . . 50 GLU CA . 11208 1 572 . 1 1 50 50 GLU CB C 13 29.838 0.300 . 1 . . . . 50 GLU CB . 11208 1 573 . 1 1 50 50 GLU CG C 13 36.716 0.300 . 1 . . . . 50 GLU CG . 11208 1 574 . 1 1 50 50 GLU N N 15 122.047 0.300 . 1 . . . . 50 GLU N . 11208 1 575 . 1 1 51 51 LYS H H 1 8.242 0.030 . 1 . . . . 51 LYS H . 11208 1 576 . 1 1 51 51 LYS HA H 1 3.778 0.030 . 1 . . . . 51 LYS HA . 11208 1 577 . 1 1 51 51 LYS HB2 H 1 1.687 0.030 . 2 . . . . 51 LYS HB2 . 11208 1 578 . 1 1 51 51 LYS HB3 H 1 1.191 0.030 . 2 . . . . 51 LYS HB3 . 11208 1 579 . 1 1 51 51 LYS HD2 H 1 1.496 0.030 . 2 . . . . 51 LYS HD2 . 11208 1 580 . 1 1 51 51 LYS HD3 H 1 1.422 0.030 . 2 . . . . 51 LYS HD3 . 11208 1 581 . 1 1 51 51 LYS HE2 H 1 2.957 0.030 . 1 . . . . 51 LYS HE2 . 11208 1 582 . 1 1 51 51 LYS HE3 H 1 2.957 0.030 . 1 . . . . 51 LYS HE3 . 11208 1 583 . 1 1 51 51 LYS HG2 H 1 1.337 0.030 . 2 . . . . 51 LYS HG2 . 11208 1 584 . 1 1 51 51 LYS HG3 H 1 1.257 0.030 . 2 . . . . 51 LYS HG3 . 11208 1 585 . 1 1 51 51 LYS C C 13 176.556 0.300 . 1 . . . . 51 LYS C . 11208 1 586 . 1 1 51 51 LYS CA C 13 58.853 0.300 . 1 . . . . 51 LYS CA . 11208 1 587 . 1 1 51 51 LYS CB C 13 33.264 0.300 . 1 . . . . 51 LYS CB . 11208 1 588 . 1 1 51 51 LYS CD C 13 29.558 0.300 . 1 . . . . 51 LYS CD . 11208 1 589 . 1 1 51 51 LYS CE C 13 42.197 0.300 . 1 . . . . 51 LYS CE . 11208 1 590 . 1 1 51 51 LYS CG C 13 24.853 0.300 . 1 . . . . 51 LYS CG . 11208 1 591 . 1 1 51 51 LYS N N 15 126.564 0.300 . 1 . . . . 51 LYS N . 11208 1 592 . 1 1 52 52 ASP H H 1 8.881 0.030 . 1 . . . . 52 ASP H . 11208 1 593 . 1 1 52 52 ASP HA H 1 4.530 0.030 . 1 . . . . 52 ASP HA . 11208 1 594 . 1 1 52 52 ASP HB2 H 1 2.877 0.030 . 1 . . . . 52 ASP HB2 . 11208 1 595 . 1 1 52 52 ASP HB3 H 1 2.877 0.030 . 1 . . . . 52 ASP HB3 . 11208 1 596 . 1 1 52 52 ASP C C 13 176.303 0.300 . 1 . . . . 52 ASP C . 11208 1 597 . 1 1 52 52 ASP CA C 13 56.254 0.300 . 1 . . . . 52 ASP CA . 11208 1 598 . 1 1 52 52 ASP CB C 13 39.901 0.300 . 1 . . . . 52 ASP CB . 11208 1 599 . 1 1 52 52 ASP N N 15 117.774 0.300 . 1 . . . . 52 ASP N . 11208 1 600 . 1 1 53 53 LYS H H 1 8.057 0.030 . 1 . . . . 53 LYS H . 11208 1 601 . 1 1 53 53 LYS HA H 1 4.658 0.030 . 1 . . . . 53 LYS HA . 11208 1 602 . 1 1 53 53 LYS HB2 H 1 2.024 0.030 . 2 . . . . 53 LYS HB2 . 11208 1 603 . 1 1 53 53 LYS HB3 H 1 1.734 0.030 . 2 . . . . 53 LYS HB3 . 11208 1 604 . 1 1 53 53 LYS HD2 H 1 1.638 0.030 . 2 . . . . 53 LYS HD2 . 11208 1 605 . 1 1 53 53 LYS HD3 H 1 1.537 0.030 . 2 . . . . 53 LYS HD3 . 11208 1 606 . 1 1 53 53 LYS HE2 H 1 2.954 0.030 . 1 . . . . 53 LYS HE2 . 11208 1 607 . 1 1 53 53 LYS HE3 H 1 2.954 0.030 . 1 . . . . 53 LYS HE3 . 11208 1 608 . 1 1 53 53 LYS HG2 H 1 1.358 0.030 . 2 . . . . 53 LYS HG2 . 11208 1 609 . 1 1 53 53 LYS HG3 H 1 1.250 0.030 . 2 . . . . 53 LYS HG3 . 11208 1 610 . 1 1 53 53 LYS C C 13 177.089 0.300 . 1 . . . . 53 LYS C . 11208 1 611 . 1 1 53 53 LYS CA C 13 55.074 0.300 . 1 . . . . 53 LYS CA . 11208 1 612 . 1 1 53 53 LYS CB C 13 33.032 0.300 . 1 . . . . 53 LYS CB . 11208 1 613 . 1 1 53 53 LYS CD C 13 28.871 0.300 . 1 . . . . 53 LYS CD . 11208 1 614 . 1 1 53 53 LYS CE C 13 42.426 0.300 . 1 . . . . 53 LYS CE . 11208 1 615 . 1 1 53 53 LYS CG C 13 24.805 0.300 . 1 . . . . 53 LYS CG . 11208 1 616 . 1 1 53 53 LYS N N 15 119.129 0.300 . 1 . . . . 53 LYS N . 11208 1 617 . 1 1 54 54 GLU H H 1 8.371 0.030 . 1 . . . . 54 GLU H . 11208 1 618 . 1 1 54 54 GLU HA H 1 3.641 0.030 . 1 . . . . 54 GLU HA . 11208 1 619 . 1 1 54 54 GLU HB2 H 1 1.684 0.030 . 2 . . . . 54 GLU HB2 . 11208 1 620 . 1 1 54 54 GLU HB3 H 1 1.568 0.030 . 2 . . . . 54 GLU HB3 . 11208 1 621 . 1 1 54 54 GLU HG2 H 1 1.885 0.030 . 2 . . . . 54 GLU HG2 . 11208 1 622 . 1 1 54 54 GLU HG3 H 1 1.608 0.030 . 2 . . . . 54 GLU HG3 . 11208 1 623 . 1 1 54 54 GLU C C 13 176.769 0.300 . 1 . . . . 54 GLU C . 11208 1 624 . 1 1 54 54 GLU CA C 13 59.045 0.300 . 1 . . . . 54 GLU CA . 11208 1 625 . 1 1 54 54 GLU CB C 13 29.276 0.300 . 1 . . . . 54 GLU CB . 11208 1 626 . 1 1 54 54 GLU CG C 13 35.494 0.300 . 1 . . . . 54 GLU CG . 11208 1 627 . 1 1 54 54 GLU N N 15 122.097 0.300 . 1 . . . . 54 GLU N . 11208 1 628 . 1 1 55 55 MET H H 1 8.292 0.030 . 1 . . . . 55 MET H . 11208 1 629 . 1 1 55 55 MET HA H 1 4.074 0.030 . 1 . . . . 55 MET HA . 11208 1 630 . 1 1 55 55 MET HB2 H 1 2.021 0.030 . 2 . . . . 55 MET HB2 . 11208 1 631 . 1 1 55 55 MET HB3 H 1 1.939 0.030 . 2 . . . . 55 MET HB3 . 11208 1 632 . 1 1 55 55 MET HE1 H 1 2.008 0.030 . 1 . . . . 55 MET HE . 11208 1 633 . 1 1 55 55 MET HE2 H 1 2.008 0.030 . 1 . . . . 55 MET HE . 11208 1 634 . 1 1 55 55 MET HE3 H 1 2.008 0.030 . 1 . . . . 55 MET HE . 11208 1 635 . 1 1 55 55 MET HG2 H 1 2.526 0.030 . 2 . . . . 55 MET HG2 . 11208 1 636 . 1 1 55 55 MET HG3 H 1 2.392 0.030 . 2 . . . . 55 MET HG3 . 11208 1 637 . 1 1 55 55 MET C C 13 176.723 0.300 . 1 . . . . 55 MET C . 11208 1 638 . 1 1 55 55 MET CA C 13 56.413 0.300 . 1 . . . . 55 MET CA . 11208 1 639 . 1 1 55 55 MET CB C 13 31.317 0.300 . 1 . . . . 55 MET CB . 11208 1 640 . 1 1 55 55 MET CE C 13 16.782 0.300 . 1 . . . . 55 MET CE . 11208 1 641 . 1 1 55 55 MET CG C 13 32.240 0.300 . 1 . . . . 55 MET CG . 11208 1 642 . 1 1 55 55 MET N N 15 115.673 0.300 . 1 . . . . 55 MET N . 11208 1 643 . 1 1 56 56 GLN H H 1 8.073 0.030 . 1 . . . . 56 GLN H . 11208 1 644 . 1 1 56 56 GLN HA H 1 4.324 0.030 . 1 . . . . 56 GLN HA . 11208 1 645 . 1 1 56 56 GLN HB2 H 1 2.118 0.030 . 2 . . . . 56 GLN HB2 . 11208 1 646 . 1 1 56 56 GLN HB3 H 1 2.021 0.030 . 2 . . . . 56 GLN HB3 . 11208 1 647 . 1 1 56 56 GLN HE21 H 1 6.862 0.030 . 2 . . . . 56 GLN HE21 . 11208 1 648 . 1 1 56 56 GLN HE22 H 1 7.520 0.030 . 2 . . . . 56 GLN HE22 . 11208 1 649 . 1 1 56 56 GLN HG2 H 1 2.334 0.030 . 1 . . . . 56 GLN HG2 . 11208 1 650 . 1 1 56 56 GLN HG3 H 1 2.334 0.030 . 1 . . . . 56 GLN HG3 . 11208 1 651 . 1 1 56 56 GLN C C 13 176.040 0.300 . 1 . . . . 56 GLN C . 11208 1 652 . 1 1 56 56 GLN CA C 13 56.999 0.300 . 1 . . . . 56 GLN CA . 11208 1 653 . 1 1 56 56 GLN CB C 13 29.418 0.300 . 1 . . . . 56 GLN CB . 11208 1 654 . 1 1 56 56 GLN CG C 13 34.020 0.300 . 1 . . . . 56 GLN CG . 11208 1 655 . 1 1 56 56 GLN N N 15 118.453 0.300 . 1 . . . . 56 GLN N . 11208 1 656 . 1 1 56 56 GLN NE2 N 15 112.349 0.300 . 1 . . . . 56 GLN NE2 . 11208 1 657 . 1 1 57 57 SER H H 1 7.900 0.030 . 1 . . . . 57 SER H . 11208 1 658 . 1 1 57 57 SER HA H 1 4.520 0.030 . 1 . . . . 57 SER HA . 11208 1 659 . 1 1 57 57 SER HB2 H 1 3.760 0.030 . 2 . . . . 57 SER HB2 . 11208 1 660 . 1 1 57 57 SER HB3 H 1 3.905 0.030 . 2 . . . . 57 SER HB3 . 11208 1 661 . 1 1 57 57 SER C C 13 173.101 0.300 . 1 . . . . 57 SER C . 11208 1 662 . 1 1 57 57 SER CA C 13 57.990 0.300 . 1 . . . . 57 SER CA . 11208 1 663 . 1 1 57 57 SER CB C 13 64.525 0.300 . 1 . . . . 57 SER CB . 11208 1 664 . 1 1 57 57 SER N N 15 113.310 0.300 . 1 . . . . 57 SER N . 11208 1 665 . 1 1 58 58 TYR H H 1 7.670 0.030 . 1 . . . . 58 TYR H . 11208 1 666 . 1 1 58 58 TYR HA H 1 4.934 0.030 . 1 . . . . 58 TYR HA . 11208 1 667 . 1 1 58 58 TYR HB2 H 1 2.959 0.030 . 2 . . . . 58 TYR HB2 . 11208 1 668 . 1 1 58 58 TYR HB3 H 1 2.904 0.030 . 2 . . . . 58 TYR HB3 . 11208 1 669 . 1 1 58 58 TYR HD1 H 1 6.926 0.030 . 1 . . . . 58 TYR HD1 . 11208 1 670 . 1 1 58 58 TYR HD2 H 1 6.926 0.030 . 1 . . . . 58 TYR HD2 . 11208 1 671 . 1 1 58 58 TYR HE1 H 1 6.685 0.030 . 1 . . . . 58 TYR HE1 . 11208 1 672 . 1 1 58 58 TYR HE2 H 1 6.685 0.030 . 1 . . . . 58 TYR HE2 . 11208 1 673 . 1 1 58 58 TYR C C 13 174.332 0.300 . 1 . . . . 58 TYR C . 11208 1 674 . 1 1 58 58 TYR CA C 13 57.037 0.300 . 1 . . . . 58 TYR CA . 11208 1 675 . 1 1 58 58 TYR CB C 13 39.678 0.300 . 1 . . . . 58 TYR CB . 11208 1 676 . 1 1 58 58 TYR CD1 C 13 133.570 0.300 . 1 . . . . 58 TYR CD1 . 11208 1 677 . 1 1 58 58 TYR CD2 C 13 133.570 0.300 . 1 . . . . 58 TYR CD2 . 11208 1 678 . 1 1 58 58 TYR CE1 C 13 118.107 0.300 . 1 . . . . 58 TYR CE1 . 11208 1 679 . 1 1 58 58 TYR CE2 C 13 118.107 0.300 . 1 . . . . 58 TYR CE2 . 11208 1 680 . 1 1 58 58 TYR N N 15 119.385 0.300 . 1 . . . . 58 TYR N . 11208 1 681 . 1 1 59 59 SER H H 1 8.663 0.030 . 1 . . . . 59 SER H . 11208 1 682 . 1 1 59 59 SER HA H 1 4.700 0.030 . 1 . . . . 59 SER HA . 11208 1 683 . 1 1 59 59 SER HB2 H 1 3.481 0.030 . 2 . . . . 59 SER HB2 . 11208 1 684 . 1 1 59 59 SER HB3 H 1 2.465 0.030 . 2 . . . . 59 SER HB3 . 11208 1 685 . 1 1 59 59 SER C C 13 171.958 0.300 . 1 . . . . 59 SER C . 11208 1 686 . 1 1 59 59 SER CA C 13 57.525 0.300 . 1 . . . . 59 SER CA . 11208 1 687 . 1 1 59 59 SER CB C 13 65.482 0.300 . 1 . . . . 59 SER CB . 11208 1 688 . 1 1 59 59 SER N N 15 117.936 0.300 . 1 . . . . 59 SER N . 11208 1 689 . 1 1 60 60 THR H H 1 8.302 0.030 . 1 . . . . 60 THR H . 11208 1 690 . 1 1 60 60 THR HA H 1 5.867 0.030 . 1 . . . . 60 THR HA . 11208 1 691 . 1 1 60 60 THR HB H 1 4.096 0.030 . 1 . . . . 60 THR HB . 11208 1 692 . 1 1 60 60 THR HG21 H 1 1.256 0.030 . 1 . . . . 60 THR HG2 . 11208 1 693 . 1 1 60 60 THR HG22 H 1 1.256 0.030 . 1 . . . . 60 THR HG2 . 11208 1 694 . 1 1 60 60 THR HG23 H 1 1.256 0.030 . 1 . . . . 60 THR HG2 . 11208 1 695 . 1 1 60 60 THR C C 13 174.137 0.300 . 1 . . . . 60 THR C . 11208 1 696 . 1 1 60 60 THR CA C 13 60.334 0.300 . 1 . . . . 60 THR CA . 11208 1 697 . 1 1 60 60 THR CB C 13 72.556 0.300 . 1 . . . . 60 THR CB . 11208 1 698 . 1 1 60 60 THR CG2 C 13 21.885 0.300 . 1 . . . . 60 THR CG2 . 11208 1 699 . 1 1 60 60 THR N N 15 113.605 0.300 . 1 . . . . 60 THR N . 11208 1 700 . 1 1 61 61 LEU H H 1 9.355 0.030 . 1 . . . . 61 LEU H . 11208 1 701 . 1 1 61 61 LEU HA H 1 4.905 0.030 . 1 . . . . 61 LEU HA . 11208 1 702 . 1 1 61 61 LEU HB2 H 1 1.851 0.030 . 1 . . . . 61 LEU HB2 . 11208 1 703 . 1 1 61 61 LEU HB3 H 1 1.851 0.030 . 1 . . . . 61 LEU HB3 . 11208 1 704 . 1 1 61 61 LEU HD11 H 1 1.047 0.030 . 1 . . . . 61 LEU HD1 . 11208 1 705 . 1 1 61 61 LEU HD12 H 1 1.047 0.030 . 1 . . . . 61 LEU HD1 . 11208 1 706 . 1 1 61 61 LEU HD13 H 1 1.047 0.030 . 1 . . . . 61 LEU HD1 . 11208 1 707 . 1 1 61 61 LEU HD21 H 1 1.179 0.030 . 1 . . . . 61 LEU HD2 . 11208 1 708 . 1 1 61 61 LEU HD22 H 1 1.179 0.030 . 1 . . . . 61 LEU HD2 . 11208 1 709 . 1 1 61 61 LEU HD23 H 1 1.179 0.030 . 1 . . . . 61 LEU HD2 . 11208 1 710 . 1 1 61 61 LEU HG H 1 1.831 0.030 . 1 . . . . 61 LEU HG . 11208 1 711 . 1 1 61 61 LEU C C 13 174.897 0.300 . 1 . . . . 61 LEU C . 11208 1 712 . 1 1 61 61 LEU CA C 13 54.398 0.300 . 1 . . . . 61 LEU CA . 11208 1 713 . 1 1 61 61 LEU CB C 13 46.442 0.300 . 1 . . . . 61 LEU CB . 11208 1 714 . 1 1 61 61 LEU CD1 C 13 26.701 0.300 . 2 . . . . 61 LEU CD1 . 11208 1 715 . 1 1 61 61 LEU CD2 C 13 25.121 0.300 . 2 . . . . 61 LEU CD2 . 11208 1 716 . 1 1 61 61 LEU CG C 13 27.330 0.300 . 1 . . . . 61 LEU CG . 11208 1 717 . 1 1 61 61 LEU N N 15 125.914 0.300 . 1 . . . . 61 LEU N . 11208 1 718 . 1 1 62 62 LYS H H 1 8.569 0.030 . 1 . . . . 62 LYS H . 11208 1 719 . 1 1 62 62 LYS HA H 1 5.461 0.030 . 1 . . . . 62 LYS HA . 11208 1 720 . 1 1 62 62 LYS HB2 H 1 1.898 0.030 . 2 . . . . 62 LYS HB2 . 11208 1 721 . 1 1 62 62 LYS HB3 H 1 1.820 0.030 . 2 . . . . 62 LYS HB3 . 11208 1 722 . 1 1 62 62 LYS HD2 H 1 1.728 0.030 . 2 . . . . 62 LYS HD2 . 11208 1 723 . 1 1 62 62 LYS HD3 H 1 1.595 0.030 . 2 . . . . 62 LYS HD3 . 11208 1 724 . 1 1 62 62 LYS HE2 H 1 2.942 0.030 . 1 . . . . 62 LYS HE2 . 11208 1 725 . 1 1 62 62 LYS HE3 H 1 2.942 0.030 . 1 . . . . 62 LYS HE3 . 11208 1 726 . 1 1 62 62 LYS HG2 H 1 1.562 0.030 . 2 . . . . 62 LYS HG2 . 11208 1 727 . 1 1 62 62 LYS HG3 H 1 1.413 0.030 . 2 . . . . 62 LYS HG3 . 11208 1 728 . 1 1 62 62 LYS C C 13 176.016 0.300 . 1 . . . . 62 LYS C . 11208 1 729 . 1 1 62 62 LYS CA C 13 54.819 0.300 . 1 . . . . 62 LYS CA . 11208 1 730 . 1 1 62 62 LYS CB C 13 34.716 0.300 . 1 . . . . 62 LYS CB . 11208 1 731 . 1 1 62 62 LYS CD C 13 28.960 0.300 . 1 . . . . 62 LYS CD . 11208 1 732 . 1 1 62 62 LYS CE C 13 42.089 0.300 . 1 . . . . 62 LYS CE . 11208 1 733 . 1 1 62 62 LYS CG C 13 25.294 0.300 . 1 . . . . 62 LYS CG . 11208 1 734 . 1 1 62 62 LYS N N 15 122.938 0.300 . 1 . . . . 62 LYS N . 11208 1 735 . 1 1 63 63 ALA H H 1 9.127 0.030 . 1 . . . . 63 ALA H . 11208 1 736 . 1 1 63 63 ALA HA H 1 5.079 0.030 . 1 . . . . 63 ALA HA . 11208 1 737 . 1 1 63 63 ALA HB1 H 1 1.804 0.030 . 1 . . . . 63 ALA HB . 11208 1 738 . 1 1 63 63 ALA HB2 H 1 1.804 0.030 . 1 . . . . 63 ALA HB . 11208 1 739 . 1 1 63 63 ALA HB3 H 1 1.804 0.030 . 1 . . . . 63 ALA HB . 11208 1 740 . 1 1 63 63 ALA C C 13 176.716 0.300 . 1 . . . . 63 ALA C . 11208 1 741 . 1 1 63 63 ALA CA C 13 51.345 0.300 . 1 . . . . 63 ALA CA . 11208 1 742 . 1 1 63 63 ALA CB C 13 23.516 0.300 . 1 . . . . 63 ALA CB . 11208 1 743 . 1 1 63 63 ALA N N 15 124.588 0.300 . 1 . . . . 63 ALA N . 11208 1 744 . 1 1 64 64 VAL H H 1 8.891 0.030 . 1 . . . . 64 VAL H . 11208 1 745 . 1 1 64 64 VAL HA H 1 4.750 0.030 . 1 . . . . 64 VAL HA . 11208 1 746 . 1 1 64 64 VAL HB H 1 2.556 0.030 . 1 . . . . 64 VAL HB . 11208 1 747 . 1 1 64 64 VAL HG11 H 1 1.173 0.030 . 1 . . . . 64 VAL HG1 . 11208 1 748 . 1 1 64 64 VAL HG12 H 1 1.173 0.030 . 1 . . . . 64 VAL HG1 . 11208 1 749 . 1 1 64 64 VAL HG13 H 1 1.173 0.030 . 1 . . . . 64 VAL HG1 . 11208 1 750 . 1 1 64 64 VAL HG21 H 1 1.080 0.030 . 1 . . . . 64 VAL HG2 . 11208 1 751 . 1 1 64 64 VAL HG22 H 1 1.080 0.030 . 1 . . . . 64 VAL HG2 . 11208 1 752 . 1 1 64 64 VAL HG23 H 1 1.080 0.030 . 1 . . . . 64 VAL HG2 . 11208 1 753 . 1 1 64 64 VAL C C 13 175.712 0.300 . 1 . . . . 64 VAL C . 11208 1 754 . 1 1 64 64 VAL CA C 13 62.081 0.300 . 1 . . . . 64 VAL CA . 11208 1 755 . 1 1 64 64 VAL CB C 13 32.154 0.300 . 1 . . . . 64 VAL CB . 11208 1 756 . 1 1 64 64 VAL CG1 C 13 21.540 0.300 . 2 . . . . 64 VAL CG1 . 11208 1 757 . 1 1 64 64 VAL CG2 C 13 19.471 0.300 . 2 . . . . 64 VAL CG2 . 11208 1 758 . 1 1 64 64 VAL N N 15 115.162 0.300 . 1 . . . . 64 VAL N . 11208 1 759 . 1 1 65 65 THR H H 1 7.675 0.030 . 1 . . . . 65 THR H . 11208 1 760 . 1 1 65 65 THR HA H 1 4.799 0.030 . 1 . . . . 65 THR HA . 11208 1 761 . 1 1 65 65 THR HB H 1 4.346 0.030 . 1 . . . . 65 THR HB . 11208 1 762 . 1 1 65 65 THR HG21 H 1 1.245 0.030 . 1 . . . . 65 THR HG2 . 11208 1 763 . 1 1 65 65 THR HG22 H 1 1.245 0.030 . 1 . . . . 65 THR HG2 . 11208 1 764 . 1 1 65 65 THR HG23 H 1 1.245 0.030 . 1 . . . . 65 THR HG2 . 11208 1 765 . 1 1 65 65 THR C C 13 172.440 0.300 . 1 . . . . 65 THR C . 11208 1 766 . 1 1 65 65 THR CA C 13 59.222 0.300 . 1 . . . . 65 THR CA . 11208 1 767 . 1 1 65 65 THR CB C 13 70.103 0.300 . 1 . . . . 65 THR CB . 11208 1 768 . 1 1 65 65 THR CG2 C 13 20.387 0.300 . 1 . . . . 65 THR CG2 . 11208 1 769 . 1 1 65 65 THR N N 15 113.733 0.300 . 1 . . . . 65 THR N . 11208 1 770 . 1 1 66 66 THR H H 1 7.441 0.030 . 1 . . . . 66 THR H . 11208 1 771 . 1 1 66 66 THR HA H 1 2.807 0.030 . 1 . . . . 66 THR HA . 11208 1 772 . 1 1 66 66 THR HB H 1 4.054 0.030 . 1 . . . . 66 THR HB . 11208 1 773 . 1 1 66 66 THR HG21 H 1 0.822 0.030 . 1 . . . . 66 THR HG2 . 11208 1 774 . 1 1 66 66 THR HG22 H 1 0.822 0.030 . 1 . . . . 66 THR HG2 . 11208 1 775 . 1 1 66 66 THR HG23 H 1 0.822 0.030 . 1 . . . . 66 THR HG2 . 11208 1 776 . 1 1 66 66 THR C C 13 171.796 0.300 . 1 . . . . 66 THR C . 11208 1 777 . 1 1 66 66 THR CA C 13 59.892 0.300 . 1 . . . . 66 THR CA . 11208 1 778 . 1 1 66 66 THR CB C 13 66.012 0.300 . 1 . . . . 66 THR CB . 11208 1 779 . 1 1 66 66 THR CG2 C 13 21.520 0.300 . 1 . . . . 66 THR CG2 . 11208 1 780 . 1 1 66 66 THR N N 15 107.110 0.300 . 1 . . . . 66 THR N . 11208 1 781 . 1 1 67 67 ARG H H 1 6.675 0.030 . 1 . . . . 67 ARG H . 11208 1 782 . 1 1 67 67 ARG HA H 1 4.237 0.030 . 1 . . . . 67 ARG HA . 11208 1 783 . 1 1 67 67 ARG HB2 H 1 1.587 0.030 . 2 . . . . 67 ARG HB2 . 11208 1 784 . 1 1 67 67 ARG HB3 H 1 1.490 0.030 . 2 . . . . 67 ARG HB3 . 11208 1 785 . 1 1 67 67 ARG HD2 H 1 2.967 0.030 . 1 . . . . 67 ARG HD2 . 11208 1 786 . 1 1 67 67 ARG HD3 H 1 2.967 0.030 . 1 . . . . 67 ARG HD3 . 11208 1 787 . 1 1 67 67 ARG HG2 H 1 1.276 0.030 . 2 . . . . 67 ARG HG2 . 11208 1 788 . 1 1 67 67 ARG HG3 H 1 1.237 0.030 . 2 . . . . 67 ARG HG3 . 11208 1 789 . 1 1 67 67 ARG C C 13 174.758 0.300 . 1 . . . . 67 ARG C . 11208 1 790 . 1 1 67 67 ARG CA C 13 54.581 0.300 . 1 . . . . 67 ARG CA . 11208 1 791 . 1 1 67 67 ARG CB C 13 33.381 0.300 . 1 . . . . 67 ARG CB . 11208 1 792 . 1 1 67 67 ARG CD C 13 43.466 0.300 . 1 . . . . 67 ARG CD . 11208 1 793 . 1 1 67 67 ARG CG C 13 26.370 0.300 . 1 . . . . 67 ARG CG . 11208 1 794 . 1 1 67 67 ARG N N 15 115.531 0.300 . 1 . . . . 67 ARG N . 11208 1 795 . 1 1 68 68 ALA H H 1 8.120 0.030 . 1 . . . . 68 ALA H . 11208 1 796 . 1 1 68 68 ALA HA H 1 4.534 0.030 . 1 . . . . 68 ALA HA . 11208 1 797 . 1 1 68 68 ALA HB1 H 1 1.451 0.030 . 1 . . . . 68 ALA HB . 11208 1 798 . 1 1 68 68 ALA HB2 H 1 1.451 0.030 . 1 . . . . 68 ALA HB . 11208 1 799 . 1 1 68 68 ALA HB3 H 1 1.451 0.030 . 1 . . . . 68 ALA HB . 11208 1 800 . 1 1 68 68 ALA C C 13 175.601 0.300 . 1 . . . . 68 ALA C . 11208 1 801 . 1 1 68 68 ALA CA C 13 52.421 0.300 . 1 . . . . 68 ALA CA . 11208 1 802 . 1 1 68 68 ALA CB C 13 22.834 0.300 . 1 . . . . 68 ALA CB . 11208 1 803 . 1 1 68 68 ALA N N 15 118.781 0.300 . 1 . . . . 68 ALA N . 11208 1 804 . 1 1 69 69 THR H H 1 8.621 0.030 . 1 . . . . 69 THR H . 11208 1 805 . 1 1 69 69 THR HA H 1 4.903 0.030 . 1 . . . . 69 THR HA . 11208 1 806 . 1 1 69 69 THR HB H 1 3.881 0.030 . 1 . . . . 69 THR HB . 11208 1 807 . 1 1 69 69 THR HG21 H 1 0.933 0.030 . 1 . . . . 69 THR HG2 . 11208 1 808 . 1 1 69 69 THR HG22 H 1 0.933 0.030 . 1 . . . . 69 THR HG2 . 11208 1 809 . 1 1 69 69 THR HG23 H 1 0.933 0.030 . 1 . . . . 69 THR HG2 . 11208 1 810 . 1 1 69 69 THR C C 13 172.878 0.300 . 1 . . . . 69 THR C . 11208 1 811 . 1 1 69 69 THR CA C 13 62.123 0.300 . 1 . . . . 69 THR CA . 11208 1 812 . 1 1 69 69 THR CB C 13 70.529 0.300 . 1 . . . . 69 THR CB . 11208 1 813 . 1 1 69 69 THR CG2 C 13 21.223 0.300 . 1 . . . . 69 THR CG2 . 11208 1 814 . 1 1 69 69 THR N N 15 117.717 0.300 . 1 . . . . 69 THR N . 11208 1 815 . 1 1 70 70 VAL H H 1 8.996 0.030 . 1 . . . . 70 VAL H . 11208 1 816 . 1 1 70 70 VAL HA H 1 3.973 0.030 . 1 . . . . 70 VAL HA . 11208 1 817 . 1 1 70 70 VAL HB H 1 1.691 0.030 . 1 . . . . 70 VAL HB . 11208 1 818 . 1 1 70 70 VAL HG11 H 1 0.289 0.030 . 1 . . . . 70 VAL HG1 . 11208 1 819 . 1 1 70 70 VAL HG12 H 1 0.289 0.030 . 1 . . . . 70 VAL HG1 . 11208 1 820 . 1 1 70 70 VAL HG13 H 1 0.289 0.030 . 1 . . . . 70 VAL HG1 . 11208 1 821 . 1 1 70 70 VAL HG21 H 1 0.626 0.030 . 1 . . . . 70 VAL HG2 . 11208 1 822 . 1 1 70 70 VAL HG22 H 1 0.626 0.030 . 1 . . . . 70 VAL HG2 . 11208 1 823 . 1 1 70 70 VAL HG23 H 1 0.626 0.030 . 1 . . . . 70 VAL HG2 . 11208 1 824 . 1 1 70 70 VAL C C 13 174.293 0.300 . 1 . . . . 70 VAL C . 11208 1 825 . 1 1 70 70 VAL CA C 13 61.895 0.300 . 1 . . . . 70 VAL CA . 11208 1 826 . 1 1 70 70 VAL CB C 13 31.920 0.300 . 1 . . . . 70 VAL CB . 11208 1 827 . 1 1 70 70 VAL CG1 C 13 20.967 0.300 . 2 . . . . 70 VAL CG1 . 11208 1 828 . 1 1 70 70 VAL CG2 C 13 20.151 0.300 . 2 . . . . 70 VAL CG2 . 11208 1 829 . 1 1 70 70 VAL N N 15 129.786 0.300 . 1 . . . . 70 VAL N . 11208 1 830 . 1 1 71 71 SER H H 1 8.396 0.030 . 1 . . . . 71 SER H . 11208 1 831 . 1 1 71 71 SER HA H 1 5.053 0.030 . 1 . . . . 71 SER HA . 11208 1 832 . 1 1 71 71 SER HB2 H 1 3.913 0.030 . 2 . . . . 71 SER HB2 . 11208 1 833 . 1 1 71 71 SER HB3 H 1 3.787 0.030 . 2 . . . . 71 SER HB3 . 11208 1 834 . 1 1 71 71 SER C C 13 173.551 0.300 . 1 . . . . 71 SER C . 11208 1 835 . 1 1 71 71 SER CA C 13 56.857 0.300 . 1 . . . . 71 SER CA . 11208 1 836 . 1 1 71 71 SER CB C 13 65.192 0.300 . 1 . . . . 71 SER CB . 11208 1 837 . 1 1 71 71 SER N N 15 121.752 0.300 . 1 . . . . 71 SER N . 11208 1 838 . 1 1 72 72 GLY H H 1 8.686 0.030 . 1 . . . . 72 GLY H . 11208 1 839 . 1 1 72 72 GLY HA2 H 1 4.008 0.030 . 2 . . . . 72 GLY HA2 . 11208 1 840 . 1 1 72 72 GLY HA3 H 1 3.862 0.030 . 2 . . . . 72 GLY HA3 . 11208 1 841 . 1 1 72 72 GLY C C 13 175.062 0.300 . 1 . . . . 72 GLY C . 11208 1 842 . 1 1 72 72 GLY CA C 13 46.176 0.300 . 1 . . . . 72 GLY CA . 11208 1 843 . 1 1 72 72 GLY N N 15 108.032 0.300 . 1 . . . . 72 GLY N . 11208 1 844 . 1 1 73 73 LEU H H 1 8.256 0.030 . 1 . . . . 73 LEU H . 11208 1 845 . 1 1 73 73 LEU HA H 1 4.269 0.030 . 1 . . . . 73 LEU HA . 11208 1 846 . 1 1 73 73 LEU HB2 H 1 1.295 0.030 . 2 . . . . 73 LEU HB2 . 11208 1 847 . 1 1 73 73 LEU HB3 H 1 0.962 0.030 . 2 . . . . 73 LEU HB3 . 11208 1 848 . 1 1 73 73 LEU HD11 H 1 0.115 0.030 . 1 . . . . 73 LEU HD1 . 11208 1 849 . 1 1 73 73 LEU HD12 H 1 0.115 0.030 . 1 . . . . 73 LEU HD1 . 11208 1 850 . 1 1 73 73 LEU HD13 H 1 0.115 0.030 . 1 . . . . 73 LEU HD1 . 11208 1 851 . 1 1 73 73 LEU HD21 H 1 0.010 0.030 . 1 . . . . 73 LEU HD2 . 11208 1 852 . 1 1 73 73 LEU HD22 H 1 0.010 0.030 . 1 . . . . 73 LEU HD2 . 11208 1 853 . 1 1 73 73 LEU HD23 H 1 0.010 0.030 . 1 . . . . 73 LEU HD2 . 11208 1 854 . 1 1 73 73 LEU HG H 1 1.060 0.030 . 1 . . . . 73 LEU HG . 11208 1 855 . 1 1 73 73 LEU C C 13 175.912 0.300 . 1 . . . . 73 LEU C . 11208 1 856 . 1 1 73 73 LEU CA C 13 53.173 0.300 . 1 . . . . 73 LEU CA . 11208 1 857 . 1 1 73 73 LEU CB C 13 41.350 0.300 . 1 . . . . 73 LEU CB . 11208 1 858 . 1 1 73 73 LEU CD1 C 13 25.828 0.300 . 2 . . . . 73 LEU CD1 . 11208 1 859 . 1 1 73 73 LEU CD2 C 13 19.952 0.300 . 2 . . . . 73 LEU CD2 . 11208 1 860 . 1 1 73 73 LEU CG C 13 26.126 0.300 . 1 . . . . 73 LEU CG . 11208 1 861 . 1 1 73 73 LEU N N 15 119.006 0.300 . 1 . . . . 73 LEU N . 11208 1 862 . 1 1 74 74 LYS H H 1 8.529 0.030 . 1 . . . . 74 LYS H . 11208 1 863 . 1 1 74 74 LYS HA H 1 4.651 0.030 . 1 . . . . 74 LYS HA . 11208 1 864 . 1 1 74 74 LYS HB2 H 1 1.844 0.030 . 1 . . . . 74 LYS HB2 . 11208 1 865 . 1 1 74 74 LYS HB3 H 1 1.844 0.030 . 1 . . . . 74 LYS HB3 . 11208 1 866 . 1 1 74 74 LYS HD2 H 1 1.753 0.030 . 2 . . . . 74 LYS HD2 . 11208 1 867 . 1 1 74 74 LYS HD3 H 1 1.672 0.030 . 2 . . . . 74 LYS HD3 . 11208 1 868 . 1 1 74 74 LYS HE2 H 1 2.993 0.030 . 1 . . . . 74 LYS HE2 . 11208 1 869 . 1 1 74 74 LYS HE3 H 1 2.993 0.030 . 1 . . . . 74 LYS HE3 . 11208 1 870 . 1 1 74 74 LYS HG2 H 1 1.643 0.030 . 2 . . . . 74 LYS HG2 . 11208 1 871 . 1 1 74 74 LYS HG3 H 1 1.548 0.030 . 2 . . . . 74 LYS HG3 . 11208 1 872 . 1 1 74 74 LYS C C 13 175.154 0.300 . 1 . . . . 74 LYS C . 11208 1 873 . 1 1 74 74 LYS CA C 13 54.324 0.300 . 1 . . . . 74 LYS CA . 11208 1 874 . 1 1 74 74 LYS CB C 13 33.519 0.300 . 1 . . . . 74 LYS CB . 11208 1 875 . 1 1 74 74 LYS CD C 13 29.759 0.300 . 1 . . . . 74 LYS CD . 11208 1 876 . 1 1 74 74 LYS CE C 13 42.085 0.300 . 1 . . . . 74 LYS CE . 11208 1 877 . 1 1 74 74 LYS CG C 13 25.156 0.300 . 1 . . . . 74 LYS CG . 11208 1 878 . 1 1 74 74 LYS N N 15 121.109 0.300 . 1 . . . . 74 LYS N . 11208 1 879 . 1 1 75 75 PRO HA H 1 5.381 0.030 . 1 . . . . 75 PRO HA . 11208 1 880 . 1 1 75 75 PRO HB2 H 1 2.433 0.030 . 2 . . . . 75 PRO HB2 . 11208 1 881 . 1 1 75 75 PRO HB3 H 1 1.850 0.030 . 2 . . . . 75 PRO HB3 . 11208 1 882 . 1 1 75 75 PRO HD2 H 1 3.673 0.030 . 2 . . . . 75 PRO HD2 . 11208 1 883 . 1 1 75 75 PRO HD3 H 1 3.927 0.030 . 2 . . . . 75 PRO HD3 . 11208 1 884 . 1 1 75 75 PRO HG2 H 1 2.023 0.030 . 2 . . . . 75 PRO HG2 . 11208 1 885 . 1 1 75 75 PRO HG3 H 1 1.935 0.030 . 2 . . . . 75 PRO HG3 . 11208 1 886 . 1 1 75 75 PRO C C 13 179.276 0.300 . 1 . . . . 75 PRO C . 11208 1 887 . 1 1 75 75 PRO CA C 13 62.827 0.300 . 1 . . . . 75 PRO CA . 11208 1 888 . 1 1 75 75 PRO CB C 13 33.061 0.300 . 1 . . . . 75 PRO CB . 11208 1 889 . 1 1 75 75 PRO CD C 13 51.074 0.300 . 1 . . . . 75 PRO CD . 11208 1 890 . 1 1 75 75 PRO CG C 13 27.230 0.300 . 1 . . . . 75 PRO CG . 11208 1 891 . 1 1 76 76 GLY H H 1 8.104 0.030 . 1 . . . . 76 GLY H . 11208 1 892 . 1 1 76 76 GLY HA2 H 1 3.885 0.030 . 2 . . . . 76 GLY HA2 . 11208 1 893 . 1 1 76 76 GLY HA3 H 1 3.719 0.030 . 2 . . . . 76 GLY HA3 . 11208 1 894 . 1 1 76 76 GLY C C 13 174.635 0.300 . 1 . . . . 76 GLY C . 11208 1 895 . 1 1 76 76 GLY CA C 13 47.598 0.300 . 1 . . . . 76 GLY CA . 11208 1 896 . 1 1 76 76 GLY N N 15 114.838 0.300 . 1 . . . . 76 GLY N . 11208 1 897 . 1 1 77 77 THR H H 1 8.378 0.030 . 1 . . . . 77 THR H . 11208 1 898 . 1 1 77 77 THR HA H 1 4.468 0.030 . 1 . . . . 77 THR HA . 11208 1 899 . 1 1 77 77 THR HB H 1 3.934 0.030 . 1 . . . . 77 THR HB . 11208 1 900 . 1 1 77 77 THR HG21 H 1 0.686 0.030 . 1 . . . . 77 THR HG2 . 11208 1 901 . 1 1 77 77 THR HG22 H 1 0.686 0.030 . 1 . . . . 77 THR HG2 . 11208 1 902 . 1 1 77 77 THR HG23 H 1 0.686 0.030 . 1 . . . . 77 THR HG2 . 11208 1 903 . 1 1 77 77 THR C C 13 171.307 0.300 . 1 . . . . 77 THR C . 11208 1 904 . 1 1 77 77 THR CA C 13 62.838 0.300 . 1 . . . . 77 THR CA . 11208 1 905 . 1 1 77 77 THR CB C 13 71.733 0.300 . 1 . . . . 77 THR CB . 11208 1 906 . 1 1 77 77 THR CG2 C 13 20.365 0.300 . 1 . . . . 77 THR CG2 . 11208 1 907 . 1 1 77 77 THR N N 15 116.189 0.300 . 1 . . . . 77 THR N . 11208 1 908 . 1 1 78 78 ARG H H 1 8.554 0.030 . 1 . . . . 78 ARG H . 11208 1 909 . 1 1 78 78 ARG HA H 1 4.733 0.030 . 1 . . . . 78 ARG HA . 11208 1 910 . 1 1 78 78 ARG HB2 H 1 1.721 0.030 . 2 . . . . 78 ARG HB2 . 11208 1 911 . 1 1 78 78 ARG HB3 H 1 1.679 0.030 . 2 . . . . 78 ARG HB3 . 11208 1 912 . 1 1 78 78 ARG HD2 H 1 3.305 0.030 . 2 . . . . 78 ARG HD2 . 11208 1 913 . 1 1 78 78 ARG HD3 H 1 3.128 0.030 . 2 . . . . 78 ARG HD3 . 11208 1 914 . 1 1 78 78 ARG HE H 1 7.598 0.030 . 1 . . . . 78 ARG HE . 11208 1 915 . 1 1 78 78 ARG HG2 H 1 1.391 0.030 . 2 . . . . 78 ARG HG2 . 11208 1 916 . 1 1 78 78 ARG HG3 H 1 1.541 0.030 . 2 . . . . 78 ARG HG3 . 11208 1 917 . 1 1 78 78 ARG C C 13 174.379 0.300 . 1 . . . . 78 ARG C . 11208 1 918 . 1 1 78 78 ARG CA C 13 56.154 0.300 . 1 . . . . 78 ARG CA . 11208 1 919 . 1 1 78 78 ARG CB C 13 30.941 0.300 . 1 . . . . 78 ARG CB . 11208 1 920 . 1 1 78 78 ARG CD C 13 43.065 0.300 . 1 . . . . 78 ARG CD . 11208 1 921 . 1 1 78 78 ARG CG C 13 28.351 0.300 . 1 . . . . 78 ARG CG . 11208 1 922 . 1 1 78 78 ARG N N 15 125.677 0.300 . 1 . . . . 78 ARG N . 11208 1 923 . 1 1 78 78 ARG NE N 15 83.933 0.300 . 1 . . . . 78 ARG NE . 11208 1 924 . 1 1 79 79 TYR H H 1 9.185 0.030 . 1 . . . . 79 TYR H . 11208 1 925 . 1 1 79 79 TYR HA H 1 4.824 0.030 . 1 . . . . 79 TYR HA . 11208 1 926 . 1 1 79 79 TYR HB2 H 1 2.714 0.030 . 2 . . . . 79 TYR HB2 . 11208 1 927 . 1 1 79 79 TYR HB3 H 1 2.331 0.030 . 2 . . . . 79 TYR HB3 . 11208 1 928 . 1 1 79 79 TYR HD1 H 1 6.853 0.030 . 1 . . . . 79 TYR HD1 . 11208 1 929 . 1 1 79 79 TYR HD2 H 1 6.853 0.030 . 1 . . . . 79 TYR HD2 . 11208 1 930 . 1 1 79 79 TYR HE1 H 1 6.983 0.030 . 1 . . . . 79 TYR HE1 . 11208 1 931 . 1 1 79 79 TYR HE2 H 1 6.983 0.030 . 1 . . . . 79 TYR HE2 . 11208 1 932 . 1 1 79 79 TYR C C 13 173.704 0.300 . 1 . . . . 79 TYR C . 11208 1 933 . 1 1 79 79 TYR CA C 13 57.819 0.300 . 1 . . . . 79 TYR CA . 11208 1 934 . 1 1 79 79 TYR CB C 13 44.642 0.300 . 1 . . . . 79 TYR CB . 11208 1 935 . 1 1 79 79 TYR CD1 C 13 132.389 0.300 . 1 . . . . 79 TYR CD1 . 11208 1 936 . 1 1 79 79 TYR CD2 C 13 132.389 0.300 . 1 . . . . 79 TYR CD2 . 11208 1 937 . 1 1 79 79 TYR CE1 C 13 118.660 0.300 . 1 . . . . 79 TYR CE1 . 11208 1 938 . 1 1 79 79 TYR CE2 C 13 118.660 0.300 . 1 . . . . 79 TYR CE2 . 11208 1 939 . 1 1 79 79 TYR N N 15 126.335 0.300 . 1 . . . . 79 TYR N . 11208 1 940 . 1 1 80 80 VAL H H 1 8.493 0.030 . 1 . . . . 80 VAL H . 11208 1 941 . 1 1 80 80 VAL HA H 1 4.396 0.030 . 1 . . . . 80 VAL HA . 11208 1 942 . 1 1 80 80 VAL HB H 1 0.484 0.030 . 1 . . . . 80 VAL HB . 11208 1 943 . 1 1 80 80 VAL HG11 H 1 0.648 0.030 . 1 . . . . 80 VAL HG1 . 11208 1 944 . 1 1 80 80 VAL HG12 H 1 0.648 0.030 . 1 . . . . 80 VAL HG1 . 11208 1 945 . 1 1 80 80 VAL HG13 H 1 0.648 0.030 . 1 . . . . 80 VAL HG1 . 11208 1 946 . 1 1 80 80 VAL HG21 H 1 0.588 0.030 . 1 . . . . 80 VAL HG2 . 11208 1 947 . 1 1 80 80 VAL HG22 H 1 0.588 0.030 . 1 . . . . 80 VAL HG2 . 11208 1 948 . 1 1 80 80 VAL HG23 H 1 0.588 0.030 . 1 . . . . 80 VAL HG2 . 11208 1 949 . 1 1 80 80 VAL C C 13 174.100 0.300 . 1 . . . . 80 VAL C . 11208 1 950 . 1 1 80 80 VAL CA C 13 60.979 0.300 . 1 . . . . 80 VAL CA . 11208 1 951 . 1 1 80 80 VAL CB C 13 33.183 0.300 . 1 . . . . 80 VAL CB . 11208 1 952 . 1 1 80 80 VAL CG1 C 13 22.957 0.300 . 2 . . . . 80 VAL CG1 . 11208 1 953 . 1 1 80 80 VAL CG2 C 13 21.006 0.300 . 2 . . . . 80 VAL CG2 . 11208 1 954 . 1 1 80 80 VAL N N 15 119.984 0.300 . 1 . . . . 80 VAL N . 11208 1 955 . 1 1 81 81 PHE H H 1 8.755 0.030 . 1 . . . . 81 PHE H . 11208 1 956 . 1 1 81 81 PHE HA H 1 5.229 0.030 . 1 . . . . 81 PHE HA . 11208 1 957 . 1 1 81 81 PHE HB2 H 1 2.765 0.030 . 2 . . . . 81 PHE HB2 . 11208 1 958 . 1 1 81 81 PHE HB3 H 1 2.510 0.030 . 2 . . . . 81 PHE HB3 . 11208 1 959 . 1 1 81 81 PHE HD1 H 1 6.952 0.030 . 1 . . . . 81 PHE HD1 . 11208 1 960 . 1 1 81 81 PHE HD2 H 1 6.952 0.030 . 1 . . . . 81 PHE HD2 . 11208 1 961 . 1 1 81 81 PHE HE1 H 1 6.721 0.030 . 1 . . . . 81 PHE HE1 . 11208 1 962 . 1 1 81 81 PHE HE2 H 1 6.721 0.030 . 1 . . . . 81 PHE HE2 . 11208 1 963 . 1 1 81 81 PHE HZ H 1 6.404 0.030 . 1 . . . . 81 PHE HZ . 11208 1 964 . 1 1 81 81 PHE C C 13 176.335 0.300 . 1 . . . . 81 PHE C . 11208 1 965 . 1 1 81 81 PHE CA C 13 56.695 0.300 . 1 . . . . 81 PHE CA . 11208 1 966 . 1 1 81 81 PHE CB C 13 43.695 0.300 . 1 . . . . 81 PHE CB . 11208 1 967 . 1 1 81 81 PHE CD1 C 13 132.062 0.300 . 1 . . . . 81 PHE CD1 . 11208 1 968 . 1 1 81 81 PHE CD2 C 13 132.062 0.300 . 1 . . . . 81 PHE CD2 . 11208 1 969 . 1 1 81 81 PHE CE1 C 13 130.307 0.300 . 1 . . . . 81 PHE CE1 . 11208 1 970 . 1 1 81 81 PHE CE2 C 13 130.307 0.300 . 1 . . . . 81 PHE CE2 . 11208 1 971 . 1 1 81 81 PHE CZ C 13 127.965 0.300 . 1 . . . . 81 PHE CZ . 11208 1 972 . 1 1 81 81 PHE N N 15 120.442 0.300 . 1 . . . . 81 PHE N . 11208 1 973 . 1 1 82 82 GLN H H 1 9.064 0.030 . 1 . . . . 82 GLN H . 11208 1 974 . 1 1 82 82 GLN HA H 1 4.434 0.030 . 1 . . . . 82 GLN HA . 11208 1 975 . 1 1 82 82 GLN HB2 H 1 1.508 0.030 . 2 . . . . 82 GLN HB2 . 11208 1 976 . 1 1 82 82 GLN HB3 H 1 2.099 0.030 . 2 . . . . 82 GLN HB3 . 11208 1 977 . 1 1 82 82 GLN HE21 H 1 6.868 0.030 . 2 . . . . 82 GLN HE21 . 11208 1 978 . 1 1 82 82 GLN HE22 H 1 7.692 0.030 . 2 . . . . 82 GLN HE22 . 11208 1 979 . 1 1 82 82 GLN HG2 H 1 2.207 0.030 . 2 . . . . 82 GLN HG2 . 11208 1 980 . 1 1 82 82 GLN HG3 H 1 1.757 0.030 . 2 . . . . 82 GLN HG3 . 11208 1 981 . 1 1 82 82 GLN C C 13 173.607 0.300 . 1 . . . . 82 GLN C . 11208 1 982 . 1 1 82 82 GLN CA C 13 55.332 0.300 . 1 . . . . 82 GLN CA . 11208 1 983 . 1 1 82 82 GLN CB C 13 35.863 0.300 . 1 . . . . 82 GLN CB . 11208 1 984 . 1 1 82 82 GLN CG C 13 36.161 0.300 . 1 . . . . 82 GLN CG . 11208 1 985 . 1 1 82 82 GLN N N 15 117.959 0.300 . 1 . . . . 82 GLN N . 11208 1 986 . 1 1 82 82 GLN NE2 N 15 111.997 0.300 . 1 . . . . 82 GLN NE2 . 11208 1 987 . 1 1 83 83 VAL H H 1 8.897 0.030 . 1 . . . . 83 VAL H . 11208 1 988 . 1 1 83 83 VAL HA H 1 5.590 0.030 . 1 . . . . 83 VAL HA . 11208 1 989 . 1 1 83 83 VAL HB H 1 1.150 0.030 . 1 . . . . 83 VAL HB . 11208 1 990 . 1 1 83 83 VAL HG11 H 1 0.096 0.030 . 1 . . . . 83 VAL HG1 . 11208 1 991 . 1 1 83 83 VAL HG12 H 1 0.096 0.030 . 1 . . . . 83 VAL HG1 . 11208 1 992 . 1 1 83 83 VAL HG13 H 1 0.096 0.030 . 1 . . . . 83 VAL HG1 . 11208 1 993 . 1 1 83 83 VAL HG21 H 1 -0.108 0.030 . 1 . . . . 83 VAL HG2 . 11208 1 994 . 1 1 83 83 VAL HG22 H 1 -0.108 0.030 . 1 . . . . 83 VAL HG2 . 11208 1 995 . 1 1 83 83 VAL HG23 H 1 -0.108 0.030 . 1 . . . . 83 VAL HG2 . 11208 1 996 . 1 1 83 83 VAL C C 13 175.909 0.300 . 1 . . . . 83 VAL C . 11208 1 997 . 1 1 83 83 VAL CA C 13 60.217 0.300 . 1 . . . . 83 VAL CA . 11208 1 998 . 1 1 83 83 VAL CB C 13 35.874 0.300 . 1 . . . . 83 VAL CB . 11208 1 999 . 1 1 83 83 VAL CG1 C 13 21.101 0.300 . 2 . . . . 83 VAL CG1 . 11208 1 1000 . 1 1 83 83 VAL CG2 C 13 20.057 0.300 . 2 . . . . 83 VAL CG2 . 11208 1 1001 . 1 1 83 83 VAL N N 15 119.313 0.300 . 1 . . . . 83 VAL N . 11208 1 1002 . 1 1 84 84 ARG H H 1 9.236 0.030 . 1 . . . . 84 ARG H . 11208 1 1003 . 1 1 84 84 ARG HA H 1 4.947 0.030 . 1 . . . . 84 ARG HA . 11208 1 1004 . 1 1 84 84 ARG HB2 H 1 0.780 0.030 . 2 . . . . 84 ARG HB2 . 11208 1 1005 . 1 1 84 84 ARG HB3 H 1 1.455 0.030 . 2 . . . . 84 ARG HB3 . 11208 1 1006 . 1 1 84 84 ARG HD2 H 1 2.702 0.030 . 2 . . . . 84 ARG HD2 . 11208 1 1007 . 1 1 84 84 ARG HD3 H 1 0.642 0.030 . 2 . . . . 84 ARG HD3 . 11208 1 1008 . 1 1 84 84 ARG HE H 1 6.526 0.030 . 1 . . . . 84 ARG HE . 11208 1 1009 . 1 1 84 84 ARG HG2 H 1 1.022 0.030 . 2 . . . . 84 ARG HG2 . 11208 1 1010 . 1 1 84 84 ARG HG3 H 1 1.145 0.030 . 2 . . . . 84 ARG HG3 . 11208 1 1011 . 1 1 84 84 ARG C C 13 172.377 0.300 . 1 . . . . 84 ARG C . 11208 1 1012 . 1 1 84 84 ARG CA C 13 54.189 0.300 . 1 . . . . 84 ARG CA . 11208 1 1013 . 1 1 84 84 ARG CB C 13 33.839 0.300 . 1 . . . . 84 ARG CB . 11208 1 1014 . 1 1 84 84 ARG CD C 13 43.054 0.300 . 1 . . . . 84 ARG CD . 11208 1 1015 . 1 1 84 84 ARG CG C 13 24.940 0.300 . 1 . . . . 84 ARG CG . 11208 1 1016 . 1 1 84 84 ARG N N 15 124.431 0.300 . 1 . . . . 84 ARG N . 11208 1 1017 . 1 1 84 84 ARG NE N 15 84.415 0.300 . 1 . . . . 84 ARG NE . 11208 1 1018 . 1 1 85 85 ALA H H 1 8.837 0.030 . 1 . . . . 85 ALA H . 11208 1 1019 . 1 1 85 85 ALA HA H 1 4.647 0.030 . 1 . . . . 85 ALA HA . 11208 1 1020 . 1 1 85 85 ALA HB1 H 1 1.265 0.030 . 1 . . . . 85 ALA HB . 11208 1 1021 . 1 1 85 85 ALA HB2 H 1 1.265 0.030 . 1 . . . . 85 ALA HB . 11208 1 1022 . 1 1 85 85 ALA HB3 H 1 1.265 0.030 . 1 . . . . 85 ALA HB . 11208 1 1023 . 1 1 85 85 ALA C C 13 175.017 0.300 . 1 . . . . 85 ALA C . 11208 1 1024 . 1 1 85 85 ALA CA C 13 50.619 0.300 . 1 . . . . 85 ALA CA . 11208 1 1025 . 1 1 85 85 ALA CB C 13 22.404 0.300 . 1 . . . . 85 ALA CB . 11208 1 1026 . 1 1 85 85 ALA N N 15 123.683 0.300 . 1 . . . . 85 ALA N . 11208 1 1027 . 1 1 86 86 ARG H H 1 8.367 0.030 . 1 . . . . 86 ARG H . 11208 1 1028 . 1 1 86 86 ARG HA H 1 4.997 0.030 . 1 . . . . 86 ARG HA . 11208 1 1029 . 1 1 86 86 ARG HB2 H 1 1.755 0.030 . 2 . . . . 86 ARG HB2 . 11208 1 1030 . 1 1 86 86 ARG HB3 H 1 1.624 0.030 . 2 . . . . 86 ARG HB3 . 11208 1 1031 . 1 1 86 86 ARG HD2 H 1 3.066 0.030 . 2 . . . . 86 ARG HD2 . 11208 1 1032 . 1 1 86 86 ARG HD3 H 1 3.156 0.030 . 2 . . . . 86 ARG HD3 . 11208 1 1033 . 1 1 86 86 ARG HG2 H 1 1.473 0.030 . 2 . . . . 86 ARG HG2 . 11208 1 1034 . 1 1 86 86 ARG HG3 H 1 1.422 0.030 . 2 . . . . 86 ARG HG3 . 11208 1 1035 . 1 1 86 86 ARG C C 13 175.442 0.300 . 1 . . . . 86 ARG C . 11208 1 1036 . 1 1 86 86 ARG CA C 13 55.806 0.300 . 1 . . . . 86 ARG CA . 11208 1 1037 . 1 1 86 86 ARG CB C 13 34.075 0.300 . 1 . . . . 86 ARG CB . 11208 1 1038 . 1 1 86 86 ARG CD C 13 43.193 0.300 . 1 . . . . 86 ARG CD . 11208 1 1039 . 1 1 86 86 ARG CG C 13 28.485 0.300 . 1 . . . . 86 ARG CG . 11208 1 1040 . 1 1 86 86 ARG N N 15 119.836 0.300 . 1 . . . . 86 ARG N . 11208 1 1041 . 1 1 87 87 THR H H 1 8.587 0.030 . 1 . . . . 87 THR H . 11208 1 1042 . 1 1 87 87 THR HA H 1 4.973 0.030 . 1 . . . . 87 THR HA . 11208 1 1043 . 1 1 87 87 THR HB H 1 4.532 0.030 . 1 . . . . 87 THR HB . 11208 1 1044 . 1 1 87 87 THR HG21 H 1 0.982 0.030 . 1 . . . . 87 THR HG2 . 11208 1 1045 . 1 1 87 87 THR HG22 H 1 0.982 0.030 . 1 . . . . 87 THR HG2 . 11208 1 1046 . 1 1 87 87 THR HG23 H 1 0.982 0.030 . 1 . . . . 87 THR HG2 . 11208 1 1047 . 1 1 87 87 THR C C 13 175.977 0.300 . 1 . . . . 87 THR C . 11208 1 1048 . 1 1 87 87 THR CA C 13 59.526 0.300 . 1 . . . . 87 THR CA . 11208 1 1049 . 1 1 87 87 THR CB C 13 72.298 0.300 . 1 . . . . 87 THR CB . 11208 1 1050 . 1 1 87 87 THR CG2 C 13 20.980 0.300 . 1 . . . . 87 THR CG2 . 11208 1 1051 . 1 1 87 87 THR N N 15 116.435 0.300 . 1 . . . . 87 THR N . 11208 1 1052 . 1 1 88 88 SER H H 1 9.818 0.030 . 1 . . . . 88 SER H . 11208 1 1053 . 1 1 88 88 SER HA H 1 4.107 0.030 . 1 . . . . 88 SER HA . 11208 1 1054 . 1 1 88 88 SER HB2 H 1 3.928 0.030 . 2 . . . . 88 SER HB2 . 11208 1 1055 . 1 1 88 88 SER HB3 H 1 4.039 0.030 . 2 . . . . 88 SER HB3 . 11208 1 1056 . 1 1 88 88 SER C C 13 174.738 0.300 . 1 . . . . 88 SER C . 11208 1 1057 . 1 1 88 88 SER CA C 13 61.169 0.300 . 1 . . . . 88 SER CA . 11208 1 1058 . 1 1 88 88 SER CB C 13 62.592 0.300 . 1 . . . . 88 SER CB . 11208 1 1059 . 1 1 88 88 SER N N 15 116.635 0.300 . 1 . . . . 88 SER N . 11208 1 1060 . 1 1 89 89 ALA H H 1 8.034 0.030 . 1 . . . . 89 ALA H . 11208 1 1061 . 1 1 89 89 ALA HA H 1 4.347 0.030 . 1 . . . . 89 ALA HA . 11208 1 1062 . 1 1 89 89 ALA HB1 H 1 1.180 0.030 . 1 . . . . 89 ALA HB . 11208 1 1063 . 1 1 89 89 ALA HB2 H 1 1.180 0.030 . 1 . . . . 89 ALA HB . 11208 1 1064 . 1 1 89 89 ALA HB3 H 1 1.180 0.030 . 1 . . . . 89 ALA HB . 11208 1 1065 . 1 1 89 89 ALA C C 13 177.416 0.300 . 1 . . . . 89 ALA C . 11208 1 1066 . 1 1 89 89 ALA CA C 13 52.621 0.300 . 1 . . . . 89 ALA CA . 11208 1 1067 . 1 1 89 89 ALA CB C 13 20.104 0.300 . 1 . . . . 89 ALA CB . 11208 1 1068 . 1 1 89 89 ALA N N 15 122.135 0.300 . 1 . . . . 89 ALA N . 11208 1 1069 . 1 1 90 90 GLY H H 1 7.467 0.030 . 1 . . . . 90 GLY H . 11208 1 1070 . 1 1 90 90 GLY HA2 H 1 4.425 0.030 . 2 . . . . 90 GLY HA2 . 11208 1 1071 . 1 1 90 90 GLY HA3 H 1 3.886 0.030 . 2 . . . . 90 GLY HA3 . 11208 1 1072 . 1 1 90 90 GLY C C 13 171.812 0.300 . 1 . . . . 90 GLY C . 11208 1 1073 . 1 1 90 90 GLY CA C 13 44.333 0.300 . 1 . . . . 90 GLY CA . 11208 1 1074 . 1 1 90 90 GLY N N 15 105.449 0.300 . 1 . . . . 90 GLY N . 11208 1 1075 . 1 1 91 91 CYS H H 1 8.533 0.030 . 1 . . . . 91 CYS H . 11208 1 1076 . 1 1 91 91 CYS HA H 1 5.218 0.030 . 1 . . . . 91 CYS HA . 11208 1 1077 . 1 1 91 91 CYS HB2 H 1 2.724 0.030 . 2 . . . . 91 CYS HB2 . 11208 1 1078 . 1 1 91 91 CYS HB3 H 1 2.555 0.030 . 2 . . . . 91 CYS HB3 . 11208 1 1079 . 1 1 91 91 CYS C C 13 175.916 0.300 . 1 . . . . 91 CYS C . 11208 1 1080 . 1 1 91 91 CYS CA C 13 57.266 0.300 . 1 . . . . 91 CYS CA . 11208 1 1081 . 1 1 91 91 CYS CB C 13 29.673 0.300 . 1 . . . . 91 CYS CB . 11208 1 1082 . 1 1 92 92 GLY H H 1 8.544 0.030 . 1 . . . . 92 GLY H . 11208 1 1083 . 1 1 92 92 GLY HA2 H 1 4.210 0.030 . 2 . . . . 92 GLY HA2 . 11208 1 1084 . 1 1 92 92 GLY HA3 H 1 3.893 0.030 . 2 . . . . 92 GLY HA3 . 11208 1 1085 . 1 1 92 92 GLY C C 13 173.214 0.300 . 1 . . . . 92 GLY C . 11208 1 1086 . 1 1 92 92 GLY CA C 13 44.251 0.300 . 1 . . . . 92 GLY CA . 11208 1 1087 . 1 1 92 92 GLY N N 15 109.140 0.300 . 1 . . . . 92 GLY N . 11208 1 1088 . 1 1 93 93 ARG H H 1 8.680 0.030 . 1 . . . . 93 ARG H . 11208 1 1089 . 1 1 93 93 ARG HA H 1 4.181 0.030 . 1 . . . . 93 ARG HA . 11208 1 1090 . 1 1 93 93 ARG HB2 H 1 1.796 0.030 . 2 . . . . 93 ARG HB2 . 11208 1 1091 . 1 1 93 93 ARG HB3 H 1 1.607 0.030 . 2 . . . . 93 ARG HB3 . 11208 1 1092 . 1 1 93 93 ARG HD2 H 1 3.219 0.030 . 1 . . . . 93 ARG HD2 . 11208 1 1093 . 1 1 93 93 ARG HD3 H 1 3.219 0.030 . 1 . . . . 93 ARG HD3 . 11208 1 1094 . 1 1 93 93 ARG HG2 H 1 1.804 0.030 . 1 . . . . 93 ARG HG2 . 11208 1 1095 . 1 1 93 93 ARG HG3 H 1 1.804 0.030 . 1 . . . . 93 ARG HG3 . 11208 1 1096 . 1 1 93 93 ARG C C 13 177.963 0.300 . 1 . . . . 93 ARG C . 11208 1 1097 . 1 1 93 93 ARG CA C 13 56.126 0.300 . 1 . . . . 93 ARG CA . 11208 1 1098 . 1 1 93 93 ARG CB C 13 31.271 0.300 . 1 . . . . 93 ARG CB . 11208 1 1099 . 1 1 93 93 ARG CD C 13 43.657 0.300 . 1 . . . . 93 ARG CD . 11208 1 1100 . 1 1 93 93 ARG CG C 13 27.298 0.300 . 1 . . . . 93 ARG CG . 11208 1 1101 . 1 1 93 93 ARG N N 15 118.966 0.300 . 1 . . . . 93 ARG N . 11208 1 1102 . 1 1 94 94 PHE H H 1 8.888 0.030 . 1 . . . . 94 PHE H . 11208 1 1103 . 1 1 94 94 PHE HA H 1 4.278 0.030 . 1 . . . . 94 PHE HA . 11208 1 1104 . 1 1 94 94 PHE HB2 H 1 3.267 0.030 . 2 . . . . 94 PHE HB2 . 11208 1 1105 . 1 1 94 94 PHE HB3 H 1 2.887 0.030 . 2 . . . . 94 PHE HB3 . 11208 1 1106 . 1 1 94 94 PHE HD1 H 1 7.135 0.030 . 1 . . . . 94 PHE HD1 . 11208 1 1107 . 1 1 94 94 PHE HD2 H 1 7.135 0.030 . 1 . . . . 94 PHE HD2 . 11208 1 1108 . 1 1 94 94 PHE HE1 H 1 7.242 0.030 . 1 . . . . 94 PHE HE1 . 11208 1 1109 . 1 1 94 94 PHE HE2 H 1 7.242 0.030 . 1 . . . . 94 PHE HE2 . 11208 1 1110 . 1 1 94 94 PHE HZ H 1 7.171 0.030 . 1 . . . . 94 PHE HZ . 11208 1 1111 . 1 1 94 94 PHE C C 13 177.364 0.300 . 1 . . . . 94 PHE C . 11208 1 1112 . 1 1 94 94 PHE CA C 13 60.998 0.300 . 1 . . . . 94 PHE CA . 11208 1 1113 . 1 1 94 94 PHE CB C 13 40.324 0.300 . 1 . . . . 94 PHE CB . 11208 1 1114 . 1 1 94 94 PHE CD1 C 13 131.677 0.300 . 1 . . . . 94 PHE CD1 . 11208 1 1115 . 1 1 94 94 PHE CD2 C 13 131.677 0.300 . 1 . . . . 94 PHE CD2 . 11208 1 1116 . 1 1 94 94 PHE CE1 C 13 131.677 0.300 . 1 . . . . 94 PHE CE1 . 11208 1 1117 . 1 1 94 94 PHE CE2 C 13 131.677 0.300 . 1 . . . . 94 PHE CE2 . 11208 1 1118 . 1 1 94 94 PHE CZ C 13 129.841 0.300 . 1 . . . . 94 PHE CZ . 11208 1 1119 . 1 1 94 94 PHE N N 15 122.038 0.300 . 1 . . . . 94 PHE N . 11208 1 1120 . 1 1 95 95 SER H H 1 8.476 0.030 . 1 . . . . 95 SER H . 11208 1 1121 . 1 1 95 95 SER HA H 1 4.454 0.030 . 1 . . . . 95 SER HA . 11208 1 1122 . 1 1 95 95 SER HB2 H 1 4.297 0.030 . 2 . . . . 95 SER HB2 . 11208 1 1123 . 1 1 95 95 SER HB3 H 1 4.133 0.030 . 2 . . . . 95 SER HB3 . 11208 1 1124 . 1 1 95 95 SER C C 13 173.261 0.300 . 1 . . . . 95 SER C . 11208 1 1125 . 1 1 95 95 SER CA C 13 58.363 0.300 . 1 . . . . 95 SER CA . 11208 1 1126 . 1 1 95 95 SER CB C 13 65.980 0.300 . 1 . . . . 95 SER CB . 11208 1 1127 . 1 1 95 95 SER N N 15 115.710 0.300 . 1 . . . . 95 SER N . 11208 1 1128 . 1 1 96 96 GLN H H 1 9.017 0.030 . 1 . . . . 96 GLN H . 11208 1 1129 . 1 1 96 96 GLN HA H 1 4.254 0.030 . 1 . . . . 96 GLN HA . 11208 1 1130 . 1 1 96 96 GLN HB2 H 1 2.118 0.030 . 1 . . . . 96 GLN HB2 . 11208 1 1131 . 1 1 96 96 GLN HB3 H 1 2.118 0.030 . 1 . . . . 96 GLN HB3 . 11208 1 1132 . 1 1 96 96 GLN HE21 H 1 6.975 0.030 . 2 . . . . 96 GLN HE21 . 11208 1 1133 . 1 1 96 96 GLN HE22 H 1 7.684 0.030 . 2 . . . . 96 GLN HE22 . 11208 1 1134 . 1 1 96 96 GLN HG2 H 1 2.510 0.030 . 1 . . . . 96 GLN HG2 . 11208 1 1135 . 1 1 96 96 GLN HG3 H 1 2.510 0.030 . 1 . . . . 96 GLN HG3 . 11208 1 1136 . 1 1 96 96 GLN C C 13 176.813 0.300 . 1 . . . . 96 GLN C . 11208 1 1137 . 1 1 96 96 GLN CA C 13 56.599 0.300 . 1 . . . . 96 GLN CA . 11208 1 1138 . 1 1 96 96 GLN CB C 13 28.777 0.300 . 1 . . . . 96 GLN CB . 11208 1 1139 . 1 1 96 96 GLN CG C 13 33.839 0.300 . 1 . . . . 96 GLN CG . 11208 1 1140 . 1 1 96 96 GLN N N 15 119.516 0.300 . 1 . . . . 96 GLN N . 11208 1 1141 . 1 1 96 96 GLN NE2 N 15 112.259 0.300 . 1 . . . . 96 GLN NE2 . 11208 1 1142 . 1 1 97 97 ALA H H 1 8.803 0.030 . 1 . . . . 97 ALA H . 11208 1 1143 . 1 1 97 97 ALA HA H 1 4.091 0.030 . 1 . . . . 97 ALA HA . 11208 1 1144 . 1 1 97 97 ALA HB1 H 1 1.266 0.030 . 1 . . . . 97 ALA HB . 11208 1 1145 . 1 1 97 97 ALA HB2 H 1 1.266 0.030 . 1 . . . . 97 ALA HB . 11208 1 1146 . 1 1 97 97 ALA HB3 H 1 1.266 0.030 . 1 . . . . 97 ALA HB . 11208 1 1147 . 1 1 97 97 ALA C C 13 176.495 0.300 . 1 . . . . 97 ALA C . 11208 1 1148 . 1 1 97 97 ALA CA C 13 53.249 0.300 . 1 . . . . 97 ALA CA . 11208 1 1149 . 1 1 97 97 ALA CB C 13 19.422 0.300 . 1 . . . . 97 ALA CB . 11208 1 1150 . 1 1 97 97 ALA N N 15 128.237 0.300 . 1 . . . . 97 ALA N . 11208 1 1151 . 1 1 98 98 MET H H 1 8.460 0.030 . 1 . . . . 98 MET H . 11208 1 1152 . 1 1 98 98 MET HA H 1 4.791 0.030 . 1 . . . . 98 MET HA . 11208 1 1153 . 1 1 98 98 MET HB2 H 1 2.074 0.030 . 2 . . . . 98 MET HB2 . 11208 1 1154 . 1 1 98 98 MET HB3 H 1 2.009 0.030 . 2 . . . . 98 MET HB3 . 11208 1 1155 . 1 1 98 98 MET HE1 H 1 1.773 0.030 . 1 . . . . 98 MET HE . 11208 1 1156 . 1 1 98 98 MET HE2 H 1 1.773 0.030 . 1 . . . . 98 MET HE . 11208 1 1157 . 1 1 98 98 MET HE3 H 1 1.773 0.030 . 1 . . . . 98 MET HE . 11208 1 1158 . 1 1 98 98 MET HG2 H 1 2.554 0.030 . 2 . . . . 98 MET HG2 . 11208 1 1159 . 1 1 98 98 MET HG3 H 1 2.318 0.030 . 2 . . . . 98 MET HG3 . 11208 1 1160 . 1 1 98 98 MET C C 13 174.155 0.300 . 1 . . . . 98 MET C . 11208 1 1161 . 1 1 98 98 MET CA C 13 54.257 0.300 . 1 . . . . 98 MET CA . 11208 1 1162 . 1 1 98 98 MET CB C 13 35.079 0.300 . 1 . . . . 98 MET CB . 11208 1 1163 . 1 1 98 98 MET CE C 13 17.432 0.300 . 1 . . . . 98 MET CE . 11208 1 1164 . 1 1 98 98 MET CG C 13 31.644 0.300 . 1 . . . . 98 MET CG . 11208 1 1165 . 1 1 98 98 MET N N 15 123.269 0.300 . 1 . . . . 98 MET N . 11208 1 1166 . 1 1 99 99 GLU H H 1 8.793 0.030 . 1 . . . . 99 GLU H . 11208 1 1167 . 1 1 99 99 GLU HA H 1 5.566 0.030 . 1 . . . . 99 GLU HA . 11208 1 1168 . 1 1 99 99 GLU HB2 H 1 1.939 0.030 . 2 . . . . 99 GLU HB2 . 11208 1 1169 . 1 1 99 99 GLU HB3 H 1 1.887 0.030 . 2 . . . . 99 GLU HB3 . 11208 1 1170 . 1 1 99 99 GLU HG2 H 1 2.242 0.030 . 2 . . . . 99 GLU HG2 . 11208 1 1171 . 1 1 99 99 GLU HG3 H 1 2.051 0.030 . 2 . . . . 99 GLU HG3 . 11208 1 1172 . 1 1 99 99 GLU C C 13 176.393 0.300 . 1 . . . . 99 GLU C . 11208 1 1173 . 1 1 99 99 GLU CA C 13 54.922 0.300 . 1 . . . . 99 GLU CA . 11208 1 1174 . 1 1 99 99 GLU CB C 13 31.943 0.300 . 1 . . . . 99 GLU CB . 11208 1 1175 . 1 1 99 99 GLU CG C 13 36.875 0.300 . 1 . . . . 99 GLU CG . 11208 1 1176 . 1 1 99 99 GLU N N 15 126.093 0.300 . 1 . . . . 99 GLU N . 11208 1 1177 . 1 1 100 100 VAL H H 1 9.219 0.030 . 1 . . . . 100 VAL H . 11208 1 1178 . 1 1 100 100 VAL HA H 1 4.338 0.030 . 1 . . . . 100 VAL HA . 11208 1 1179 . 1 1 100 100 VAL HB H 1 2.027 0.030 . 1 . . . . 100 VAL HB . 11208 1 1180 . 1 1 100 100 VAL HG11 H 1 0.857 0.030 . 1 . . . . 100 VAL HG1 . 11208 1 1181 . 1 1 100 100 VAL HG12 H 1 0.857 0.030 . 1 . . . . 100 VAL HG1 . 11208 1 1182 . 1 1 100 100 VAL HG13 H 1 0.857 0.030 . 1 . . . . 100 VAL HG1 . 11208 1 1183 . 1 1 100 100 VAL HG21 H 1 0.823 0.030 . 1 . . . . 100 VAL HG2 . 11208 1 1184 . 1 1 100 100 VAL HG22 H 1 0.823 0.030 . 1 . . . . 100 VAL HG2 . 11208 1 1185 . 1 1 100 100 VAL HG23 H 1 0.823 0.030 . 1 . . . . 100 VAL HG2 . 11208 1 1186 . 1 1 100 100 VAL C C 13 173.435 0.300 . 1 . . . . 100 VAL C . 11208 1 1187 . 1 1 100 100 VAL CA C 13 61.186 0.300 . 1 . . . . 100 VAL CA . 11208 1 1188 . 1 1 100 100 VAL CB C 13 36.686 0.300 . 1 . . . . 100 VAL CB . 11208 1 1189 . 1 1 100 100 VAL CG1 C 13 21.850 0.300 . 2 . . . . 100 VAL CG1 . 11208 1 1190 . 1 1 100 100 VAL CG2 C 13 21.655 0.300 . 2 . . . . 100 VAL CG2 . 11208 1 1191 . 1 1 100 100 VAL N N 15 122.853 0.300 . 1 . . . . 100 VAL N . 11208 1 1192 . 1 1 101 101 GLU H H 1 8.639 0.030 . 1 . . . . 101 GLU H . 11208 1 1193 . 1 1 101 101 GLU HA H 1 5.379 0.030 . 1 . . . . 101 GLU HA . 11208 1 1194 . 1 1 101 101 GLU HB2 H 1 2.002 0.030 . 2 . . . . 101 GLU HB2 . 11208 1 1195 . 1 1 101 101 GLU HB3 H 1 1.760 0.030 . 2 . . . . 101 GLU HB3 . 11208 1 1196 . 1 1 101 101 GLU HG2 H 1 2.333 0.030 . 2 . . . . 101 GLU HG2 . 11208 1 1197 . 1 1 101 101 GLU HG3 H 1 1.913 0.030 . 2 . . . . 101 GLU HG3 . 11208 1 1198 . 1 1 101 101 GLU C C 13 176.803 0.300 . 1 . . . . 101 GLU C . 11208 1 1199 . 1 1 101 101 GLU CA C 13 53.995 0.300 . 1 . . . . 101 GLU CA . 11208 1 1200 . 1 1 101 101 GLU CB C 13 32.315 0.300 . 1 . . . . 101 GLU CB . 11208 1 1201 . 1 1 101 101 GLU CG C 13 36.406 0.300 . 1 . . . . 101 GLU CG . 11208 1 1202 . 1 1 101 101 GLU N N 15 127.166 0.300 . 1 . . . . 101 GLU N . 11208 1 1203 . 1 1 102 102 THR H H 1 8.950 0.030 . 1 . . . . 102 THR H . 11208 1 1204 . 1 1 102 102 THR HA H 1 4.239 0.030 . 1 . . . . 102 THR HA . 11208 1 1205 . 1 1 102 102 THR HB H 1 4.840 0.030 . 1 . . . . 102 THR HB . 11208 1 1206 . 1 1 102 102 THR HG21 H 1 1.082 0.030 . 1 . . . . 102 THR HG2 . 11208 1 1207 . 1 1 102 102 THR HG22 H 1 1.082 0.030 . 1 . . . . 102 THR HG2 . 11208 1 1208 . 1 1 102 102 THR HG23 H 1 1.082 0.030 . 1 . . . . 102 THR HG2 . 11208 1 1209 . 1 1 102 102 THR C C 13 176.156 0.300 . 1 . . . . 102 THR C . 11208 1 1210 . 1 1 102 102 THR CA C 13 61.112 0.300 . 1 . . . . 102 THR CA . 11208 1 1211 . 1 1 102 102 THR CB C 13 69.672 0.300 . 1 . . . . 102 THR CB . 11208 1 1212 . 1 1 102 102 THR CG2 C 13 24.313 0.300 . 1 . . . . 102 THR CG2 . 11208 1 1213 . 1 1 102 102 THR N N 15 116.679 0.300 . 1 . . . . 102 THR N . 11208 1 1214 . 1 1 103 103 GLY H H 1 8.057 0.030 . 1 . . . . 103 GLY H . 11208 1 1215 . 1 1 103 103 GLY HA2 H 1 4.038 0.030 . 2 . . . . 103 GLY HA2 . 11208 1 1216 . 1 1 103 103 GLY HA3 H 1 3.697 0.030 . 2 . . . . 103 GLY HA3 . 11208 1 1217 . 1 1 103 103 GLY C C 13 173.067 0.300 . 1 . . . . 103 GLY C . 11208 1 1218 . 1 1 103 103 GLY CA C 13 45.014 0.300 . 1 . . . . 103 GLY CA . 11208 1 1219 . 1 1 103 103 GLY N N 15 106.445 0.300 . 1 . . . . 103 GLY N . 11208 1 1220 . 1 1 104 104 LYS H H 1 8.248 0.030 . 1 . . . . 104 LYS H . 11208 1 1221 . 1 1 104 104 LYS HA H 1 4.485 0.030 . 1 . . . . 104 LYS HA . 11208 1 1222 . 1 1 104 104 LYS HB2 H 1 1.851 0.030 . 2 . . . . 104 LYS HB2 . 11208 1 1223 . 1 1 104 104 LYS HB3 H 1 1.725 0.030 . 2 . . . . 104 LYS HB3 . 11208 1 1224 . 1 1 104 104 LYS HD2 H 1 1.710 0.030 . 1 . . . . 104 LYS HD2 . 11208 1 1225 . 1 1 104 104 LYS HD3 H 1 1.710 0.030 . 1 . . . . 104 LYS HD3 . 11208 1 1226 . 1 1 104 104 LYS HE2 H 1 3.024 0.030 . 1 . . . . 104 LYS HE2 . 11208 1 1227 . 1 1 104 104 LYS HE3 H 1 3.024 0.030 . 1 . . . . 104 LYS HE3 . 11208 1 1228 . 1 1 104 104 LYS HG2 H 1 1.571 0.030 . 2 . . . . 104 LYS HG2 . 11208 1 1229 . 1 1 104 104 LYS HG3 H 1 1.505 0.030 . 2 . . . . 104 LYS HG3 . 11208 1 1230 . 1 1 104 104 LYS C C 13 174.794 0.300 . 1 . . . . 104 LYS C . 11208 1 1231 . 1 1 104 104 LYS CA C 13 54.475 0.300 . 1 . . . . 104 LYS CA . 11208 1 1232 . 1 1 104 104 LYS CB C 13 32.831 0.300 . 1 . . . . 104 LYS CB . 11208 1 1233 . 1 1 104 104 LYS CD C 13 29.338 0.300 . 1 . . . . 104 LYS CD . 11208 1 1234 . 1 1 104 104 LYS CE C 13 42.073 0.300 . 1 . . . . 104 LYS CE . 11208 1 1235 . 1 1 104 104 LYS CG C 13 24.963 0.300 . 1 . . . . 104 LYS CG . 11208 1 1236 . 1 1 104 104 LYS N N 15 118.993 0.300 . 1 . . . . 104 LYS N . 11208 1 1237 . 1 1 105 105 PRO HA H 1 4.478 0.030 . 1 . . . . 105 PRO HA . 11208 1 1238 . 1 1 105 105 PRO HB2 H 1 2.275 0.030 . 2 . . . . 105 PRO HB2 . 11208 1 1239 . 1 1 105 105 PRO HB3 H 1 1.990 0.030 . 2 . . . . 105 PRO HB3 . 11208 1 1240 . 1 1 105 105 PRO HD2 H 1 3.725 0.030 . 2 . . . . 105 PRO HD2 . 11208 1 1241 . 1 1 105 105 PRO HD3 H 1 3.570 0.030 . 2 . . . . 105 PRO HD3 . 11208 1 1242 . 1 1 105 105 PRO HG2 H 1 1.972 0.030 . 2 . . . . 105 PRO HG2 . 11208 1 1243 . 1 1 105 105 PRO HG3 H 1 2.077 0.030 . 2 . . . . 105 PRO HG3 . 11208 1 1244 . 1 1 105 105 PRO C C 13 176.748 0.300 . 1 . . . . 105 PRO C . 11208 1 1245 . 1 1 105 105 PRO CA C 13 62.947 0.300 . 1 . . . . 105 PRO CA . 11208 1 1246 . 1 1 105 105 PRO CB C 13 31.970 0.300 . 1 . . . . 105 PRO CB . 11208 1 1247 . 1 1 105 105 PRO CD C 13 50.473 0.300 . 1 . . . . 105 PRO CD . 11208 1 1248 . 1 1 105 105 PRO CG C 13 27.300 0.300 . 1 . . . . 105 PRO CG . 11208 1 1249 . 1 1 106 106 SER H H 1 8.457 0.030 . 1 . . . . 106 SER H . 11208 1 1250 . 1 1 106 106 SER HA H 1 4.476 0.030 . 1 . . . . 106 SER HA . 11208 1 1251 . 1 1 106 106 SER HB2 H 1 3.893 0.030 . 1 . . . . 106 SER HB2 . 11208 1 1252 . 1 1 106 106 SER HB3 H 1 3.893 0.030 . 1 . . . . 106 SER HB3 . 11208 1 1253 . 1 1 106 106 SER C C 13 174.561 0.300 . 1 . . . . 106 SER C . 11208 1 1254 . 1 1 106 106 SER CA C 13 58.331 0.300 . 1 . . . . 106 SER CA . 11208 1 1255 . 1 1 106 106 SER CB C 13 64.020 0.300 . 1 . . . . 106 SER CB . 11208 1 1256 . 1 1 106 106 SER N N 15 116.454 0.300 . 1 . . . . 106 SER N . 11208 1 1257 . 1 1 107 107 GLY H H 1 8.247 0.030 . 1 . . . . 107 GLY H . 11208 1 1258 . 1 1 107 107 GLY HA2 H 1 4.177 0.030 . 2 . . . . 107 GLY HA2 . 11208 1 1259 . 1 1 107 107 GLY HA3 H 1 4.115 0.030 . 2 . . . . 107 GLY HA3 . 11208 1 1260 . 1 1 107 107 GLY C C 13 171.769 0.300 . 1 . . . . 107 GLY C . 11208 1 1261 . 1 1 107 107 GLY CA C 13 44.631 0.300 . 1 . . . . 107 GLY CA . 11208 1 1262 . 1 1 107 107 GLY N N 15 110.674 0.300 . 1 . . . . 107 GLY N . 11208 1 1263 . 1 1 108 108 PRO HA H 1 4.489 0.030 . 1 . . . . 108 PRO HA . 11208 1 1264 . 1 1 108 108 PRO HB2 H 1 2.306 0.030 . 2 . . . . 108 PRO HB2 . 11208 1 1265 . 1 1 108 108 PRO HB3 H 1 1.990 0.030 . 2 . . . . 108 PRO HB3 . 11208 1 1266 . 1 1 108 108 PRO HD2 H 1 3.641 0.030 . 1 . . . . 108 PRO HD2 . 11208 1 1267 . 1 1 108 108 PRO HD3 H 1 3.641 0.030 . 1 . . . . 108 PRO HD3 . 11208 1 1268 . 1 1 108 108 PRO HG2 H 1 2.032 0.030 . 1 . . . . 108 PRO HG2 . 11208 1 1269 . 1 1 108 108 PRO HG3 H 1 2.032 0.030 . 1 . . . . 108 PRO HG3 . 11208 1 1270 . 1 1 108 108 PRO CA C 13 63.226 0.300 . 1 . . . . 108 PRO CA . 11208 1 1271 . 1 1 108 108 PRO CB C 13 32.176 0.300 . 1 . . . . 108 PRO CB . 11208 1 1272 . 1 1 108 108 PRO CD C 13 49.764 0.300 . 1 . . . . 108 PRO CD . 11208 1 1273 . 1 1 108 108 PRO CG C 13 27.153 0.300 . 1 . . . . 108 PRO CG . 11208 1 1274 . 1 1 110 110 SER H H 1 8.498 0.030 . 1 . . . . 110 SER H . 11208 1 1275 . 1 1 110 110 SER HA H 1 4.499 0.030 . 1 . . . . 110 SER HA . 11208 1 1276 . 1 1 110 110 SER HB2 H 1 3.893 0.030 . 1 . . . . 110 SER HB2 . 11208 1 1277 . 1 1 110 110 SER HB3 H 1 3.893 0.030 . 1 . . . . 110 SER HB3 . 11208 1 1278 . 1 1 110 110 SER C C 13 173.924 0.300 . 1 . . . . 110 SER C . 11208 1 1279 . 1 1 110 110 SER CA C 13 58.597 0.300 . 1 . . . . 110 SER CA . 11208 1 1280 . 1 1 110 110 SER CB C 13 63.988 0.300 . 1 . . . . 110 SER CB . 11208 1 1281 . 1 1 111 111 GLY H H 1 8.052 0.030 . 1 . . . . 111 GLY H . 11208 1 1282 . 1 1 111 111 GLY HA2 H 1 3.785 0.030 . 1 . . . . 111 GLY HA2 . 11208 1 1283 . 1 1 111 111 GLY HA3 H 1 3.785 0.030 . 1 . . . . 111 GLY HA3 . 11208 1 1284 . 1 1 111 111 GLY C C 13 179.008 0.300 . 1 . . . . 111 GLY C . 11208 1 1285 . 1 1 111 111 GLY CA C 13 46.235 0.300 . 1 . . . . 111 GLY CA . 11208 1 1286 . 1 1 111 111 GLY N N 15 116.895 0.300 . 1 . . . . 111 GLY N . 11208 1 stop_ save_