data_11338 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11338 _Entry.Title ; Solution structure of the RWD domain of human RWD domain containing protein 1 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-08-10 _Entry.Accession_date 2010-08-10 _Entry.Last_release_date 2011-08-19 _Entry.Original_release_date 2011-08-19 _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 M. Yoneyama . . . 11338 2 T. Tomizawa . . . 11338 3 S. Koshiba . . . 11338 4 S. Watabe . . . 11338 5 T. Harada . . . 11338 6 T. Kigawa . . . 11338 7 S. Yokoyama . . . 11338 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)' . 11338 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11338 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 552 11338 '15N chemical shifts' 130 11338 '1H chemical shifts' 878 11338 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 . . 2011-08-19 2010-08-10 original author . 11338 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2EBM 'BMRB Entry Tracking System' 11338 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11338 _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 RWD domain of human RWD domain containing protein 1' _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 M. Yoneyama . . . 11338 1 2 T. Tomizawa . . . 11338 1 3 S. Koshiba . . . 11338 1 4 S. Watabe . . . 11338 1 5 T. Harada . . . 11338 1 6 T. Kigawa . . . 11338 1 7 S. Yokoyama . . . 11338 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11338 _Assembly.ID 1 _Assembly.Name 'RWD domain-containing protein 1' _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 . _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 'RWD domain' 1 $entity_1 A . yes native no no . . . 11338 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 2ebm . . . . . . 11338 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11338 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'RWD 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 ; GSSGSSGMTDYGEEQRNELE ALESIYPDSFTVLSENPPSF TITVTSEAGENDETVQTTLK FTYSEKYPDEAPLYEIFSQE NLEDNDVSDILKLLALQAEE NLGMVMIFTLVTAVQEKLNE IVDQIKTR ; _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 128 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _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 2EBM . "Solution Structure Of The Rwd Domain Of Human Rwd Domain Containing Protein 1" . . . . . 100.00 128 100.00 100.00 1.09e-84 . . . . 11338 1 2 no DBJ BAB23927 . "unnamed protein product [Mus musculus]" . . . . . 94.53 243 98.35 99.17 2.07e-76 . . . . 11338 1 3 no DBJ BAB27511 . "unnamed protein product [Mus musculus]" . . . . . 94.53 243 98.35 99.17 2.07e-76 . . . . 11338 1 4 no DBJ BAB28287 . "unnamed protein product [Mus musculus]" . . . . . 70.31 111 97.78 97.78 5.62e-54 . . . . 11338 1 5 no DBJ BAF83416 . "unnamed protein product [Homo sapiens]" . . . . . 94.53 243 100.00 100.00 3.86e-78 . . . . 11338 1 6 no DBJ BAI46567 . "RWD domain containing 1 [synthetic construct]" . . . . . 94.53 243 100.00 100.00 3.86e-78 . . . . 11338 1 7 no EMBL CAC24710 . "small androgen receptor-interacting protein [Rattus norvegicus]" . . . . . 94.53 243 100.00 100.00 4.70e-78 . . . . 11338 1 8 no GB AAD27733 . "CGI-24 protein [Homo sapiens]" . . . . . 92.97 241 100.00 100.00 2.63e-76 . . . . 11338 1 9 no GB AAD40376 . "PTD013 [Homo sapiens]" . . . . . 94.53 243 100.00 100.00 3.78e-78 . . . . 11338 1 10 no GB AAH15802 . "RWD domain containing 1 [Homo sapiens]" . . . . . 94.53 243 100.00 100.00 3.86e-78 . . . . 11338 1 11 no GB AAH62136 . "RWD domain containing 1 [Mus musculus]" . . . . . 94.53 243 98.35 99.17 2.07e-76 . . . . 11338 1 12 no GB AAI02911 . "RWD domain containing 1 [Bos taurus]" . . . . . 94.53 243 97.52 99.17 4.19e-76 . . . . 11338 1 13 no REF NP_001029898 . "RWD domain-containing protein 1 [Bos taurus]" . . . . . 94.53 243 97.52 99.17 4.19e-76 . . . . 11338 1 14 no REF NP_001253784 . "RWD domain-containing protein 1 [Macaca mulatta]" . . . . . 94.53 243 100.00 100.00 3.86e-78 . . . . 11338 1 15 no REF NP_001296170 . "RWD domain containing 1 [Equus caballus]" . . . . . 94.53 243 100.00 100.00 4.17e-78 . . . . 11338 1 16 no REF NP_057036 . "RWD domain-containing protein 1 isoform a [Homo sapiens]" . . . . . 94.53 243 100.00 100.00 3.86e-78 . . . . 11338 1 17 no REF NP_079890 . "RWD domain-containing protein 1 [Mus musculus]" . . . . . 94.53 243 98.35 99.17 2.07e-76 . . . . 11338 1 18 no SP Q99ND9 . "RecName: Full=RWD domain-containing protein 1; AltName: Full=Small androgen receptor-interacting protein" . . . . . 94.53 243 100.00 100.00 4.70e-78 . . . . 11338 1 19 no SP Q9CQK7 . "RecName: Full=RWD domain-containing protein 1; AltName: Full=DRG family-regulatory protein 2; AltName: Full=IH1" . . . . . 94.53 243 98.35 99.17 2.07e-76 . . . . 11338 1 20 no SP Q9H446 . "RecName: Full=RWD domain-containing protein 1; AltName: Full=DRG family-regulatory protein 2" . . . . . 94.53 243 100.00 100.00 3.86e-78 . . . . 11338 1 21 no TPG DAA26307 . "TPA: RWD domain containing 1 [Bos taurus]" . . . . . 94.53 243 97.52 99.17 4.19e-76 . . . . 11338 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'RWD domain' . 11338 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 . 11338 1 2 . SER . 11338 1 3 . SER . 11338 1 4 . GLY . 11338 1 5 . SER . 11338 1 6 . SER . 11338 1 7 . GLY . 11338 1 8 . MET . 11338 1 9 . THR . 11338 1 10 . ASP . 11338 1 11 . TYR . 11338 1 12 . GLY . 11338 1 13 . GLU . 11338 1 14 . GLU . 11338 1 15 . GLN . 11338 1 16 . ARG . 11338 1 17 . ASN . 11338 1 18 . GLU . 11338 1 19 . LEU . 11338 1 20 . GLU . 11338 1 21 . ALA . 11338 1 22 . LEU . 11338 1 23 . GLU . 11338 1 24 . SER . 11338 1 25 . ILE . 11338 1 26 . TYR . 11338 1 27 . PRO . 11338 1 28 . ASP . 11338 1 29 . SER . 11338 1 30 . PHE . 11338 1 31 . THR . 11338 1 32 . VAL . 11338 1 33 . LEU . 11338 1 34 . SER . 11338 1 35 . GLU . 11338 1 36 . ASN . 11338 1 37 . PRO . 11338 1 38 . PRO . 11338 1 39 . SER . 11338 1 40 . PHE . 11338 1 41 . THR . 11338 1 42 . ILE . 11338 1 43 . THR . 11338 1 44 . VAL . 11338 1 45 . THR . 11338 1 46 . SER . 11338 1 47 . GLU . 11338 1 48 . ALA . 11338 1 49 . GLY . 11338 1 50 . GLU . 11338 1 51 . ASN . 11338 1 52 . ASP . 11338 1 53 . GLU . 11338 1 54 . THR . 11338 1 55 . VAL . 11338 1 56 . GLN . 11338 1 57 . THR . 11338 1 58 . THR . 11338 1 59 . LEU . 11338 1 60 . LYS . 11338 1 61 . PHE . 11338 1 62 . THR . 11338 1 63 . TYR . 11338 1 64 . SER . 11338 1 65 . GLU . 11338 1 66 . LYS . 11338 1 67 . TYR . 11338 1 68 . PRO . 11338 1 69 . ASP . 11338 1 70 . GLU . 11338 1 71 . ALA . 11338 1 72 . PRO . 11338 1 73 . LEU . 11338 1 74 . TYR . 11338 1 75 . GLU . 11338 1 76 . ILE . 11338 1 77 . PHE . 11338 1 78 . SER . 11338 1 79 . GLN . 11338 1 80 . GLU . 11338 1 81 . ASN . 11338 1 82 . LEU . 11338 1 83 . GLU . 11338 1 84 . ASP . 11338 1 85 . ASN . 11338 1 86 . ASP . 11338 1 87 . VAL . 11338 1 88 . SER . 11338 1 89 . ASP . 11338 1 90 . ILE . 11338 1 91 . LEU . 11338 1 92 . LYS . 11338 1 93 . LEU . 11338 1 94 . LEU . 11338 1 95 . ALA . 11338 1 96 . LEU . 11338 1 97 . GLN . 11338 1 98 . ALA . 11338 1 99 . GLU . 11338 1 100 . GLU . 11338 1 101 . ASN . 11338 1 102 . LEU . 11338 1 103 . GLY . 11338 1 104 . MET . 11338 1 105 . VAL . 11338 1 106 . MET . 11338 1 107 . ILE . 11338 1 108 . PHE . 11338 1 109 . THR . 11338 1 110 . LEU . 11338 1 111 . VAL . 11338 1 112 . THR . 11338 1 113 . ALA . 11338 1 114 . VAL . 11338 1 115 . GLN . 11338 1 116 . GLU . 11338 1 117 . LYS . 11338 1 118 . LEU . 11338 1 119 . ASN . 11338 1 120 . GLU . 11338 1 121 . ILE . 11338 1 122 . VAL . 11338 1 123 . ASP . 11338 1 124 . GLN . 11338 1 125 . ILE . 11338 1 126 . LYS . 11338 1 127 . THR . 11338 1 128 . ARG . 11338 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 11338 1 . SER 2 2 11338 1 . SER 3 3 11338 1 . GLY 4 4 11338 1 . SER 5 5 11338 1 . SER 6 6 11338 1 . GLY 7 7 11338 1 . MET 8 8 11338 1 . THR 9 9 11338 1 . ASP 10 10 11338 1 . TYR 11 11 11338 1 . GLY 12 12 11338 1 . GLU 13 13 11338 1 . GLU 14 14 11338 1 . GLN 15 15 11338 1 . ARG 16 16 11338 1 . ASN 17 17 11338 1 . GLU 18 18 11338 1 . LEU 19 19 11338 1 . GLU 20 20 11338 1 . ALA 21 21 11338 1 . LEU 22 22 11338 1 . GLU 23 23 11338 1 . SER 24 24 11338 1 . ILE 25 25 11338 1 . TYR 26 26 11338 1 . PRO 27 27 11338 1 . ASP 28 28 11338 1 . SER 29 29 11338 1 . PHE 30 30 11338 1 . THR 31 31 11338 1 . VAL 32 32 11338 1 . LEU 33 33 11338 1 . SER 34 34 11338 1 . GLU 35 35 11338 1 . ASN 36 36 11338 1 . PRO 37 37 11338 1 . PRO 38 38 11338 1 . SER 39 39 11338 1 . PHE 40 40 11338 1 . THR 41 41 11338 1 . ILE 42 42 11338 1 . THR 43 43 11338 1 . VAL 44 44 11338 1 . THR 45 45 11338 1 . SER 46 46 11338 1 . GLU 47 47 11338 1 . ALA 48 48 11338 1 . GLY 49 49 11338 1 . GLU 50 50 11338 1 . ASN 51 51 11338 1 . ASP 52 52 11338 1 . GLU 53 53 11338 1 . THR 54 54 11338 1 . VAL 55 55 11338 1 . GLN 56 56 11338 1 . THR 57 57 11338 1 . THR 58 58 11338 1 . LEU 59 59 11338 1 . LYS 60 60 11338 1 . PHE 61 61 11338 1 . THR 62 62 11338 1 . TYR 63 63 11338 1 . SER 64 64 11338 1 . GLU 65 65 11338 1 . LYS 66 66 11338 1 . TYR 67 67 11338 1 . PRO 68 68 11338 1 . ASP 69 69 11338 1 . GLU 70 70 11338 1 . ALA 71 71 11338 1 . PRO 72 72 11338 1 . LEU 73 73 11338 1 . TYR 74 74 11338 1 . GLU 75 75 11338 1 . ILE 76 76 11338 1 . PHE 77 77 11338 1 . SER 78 78 11338 1 . GLN 79 79 11338 1 . GLU 80 80 11338 1 . ASN 81 81 11338 1 . LEU 82 82 11338 1 . GLU 83 83 11338 1 . ASP 84 84 11338 1 . ASN 85 85 11338 1 . ASP 86 86 11338 1 . VAL 87 87 11338 1 . SER 88 88 11338 1 . ASP 89 89 11338 1 . ILE 90 90 11338 1 . LEU 91 91 11338 1 . LYS 92 92 11338 1 . LEU 93 93 11338 1 . LEU 94 94 11338 1 . ALA 95 95 11338 1 . LEU 96 96 11338 1 . GLN 97 97 11338 1 . ALA 98 98 11338 1 . GLU 99 99 11338 1 . GLU 100 100 11338 1 . ASN 101 101 11338 1 . LEU 102 102 11338 1 . GLY 103 103 11338 1 . MET 104 104 11338 1 . VAL 105 105 11338 1 . MET 106 106 11338 1 . ILE 107 107 11338 1 . PHE 108 108 11338 1 . THR 109 109 11338 1 . LEU 110 110 11338 1 . VAL 111 111 11338 1 . THR 112 112 11338 1 . ALA 113 113 11338 1 . VAL 114 114 11338 1 . GLN 115 115 11338 1 . GLU 116 116 11338 1 . LYS 117 117 11338 1 . LEU 118 118 11338 1 . ASN 119 119 11338 1 . GLU 120 120 11338 1 . ILE 121 121 11338 1 . VAL 122 122 11338 1 . ASP 123 123 11338 1 . GLN 124 124 11338 1 . ILE 125 125 11338 1 . LYS 126 126 11338 1 . THR 127 127 11338 1 . ARG 128 128 11338 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 11338 _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 . . . . . . . . . . . . . . . . . . . . . 11338 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 11338 _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 . . P060522-12 . . . . . . 11338 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11338 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.19mM RWD domain {U-15N,13C;} 20mM d-Tris-HCl(pH {7.0);} 100mM {NaCl;} 1mM {d-DTT;} 0.02% {NaN3;} 10% D2O, 90% H2O ; _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 'RWD domain' '[U-13C; U-15N]' . . 1 $entity_1 . protein 1.19 . . mM . . . . 11338 1 2 d-Tris-HCl 'natural abundance' . . . . . buffer 20 . . mM . . . . 11338 1 3 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 11338 1 4 d-DTT 'natural abundance' . . . . . salt 1 . . mM . . . . 11338 1 5 NaN3 'natural abundance' . . . . . salt 0.02 . . % . . . . 11338 1 6 H2O . . . . . . solvent 90 . . % . . . . 11338 1 7 D2O . . . . . . solvent 10 . . % . . . . 11338 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 11338 _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 11338 1 pH 7.0 0.05 pH 11338 1 pressure 1 0.001 atm 11338 1 temperature 296 0.1 K 11338 1 stop_ save_ ############################ # Computer software used # ############################ save_XWINNMR _Software.Sf_category software _Software.Sf_framecode XWINNMR _Software.Entry_ID 11338 _Software.ID 1 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 11338 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11338 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11338 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20030801 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F.' . . 11338 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11338 2 stop_ save_ save_NMRVIEW _Software.Sf_category software _Software.Sf_framecode NMRVIEW _Software.Entry_ID 11338 _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.' . . 11338 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11338 3 stop_ save_ save_Kujira _Software.Sf_category software _Software.Sf_framecode Kujira _Software.Entry_ID 11338 _Software.ID 4 _Software.Name Kujira _Software.Version 0.9820 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 11338 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11338 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11338 _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.' . . 11338 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 11338 5 'structure solution' 11338 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 11338 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 11338 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker AVANCE . 800 . . . 11338 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 11338 _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 . . . . . . . . . . . . . . . . 11338 1 2 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11338 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 11338 _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 . . . . . . . . . 11338 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11338 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11338 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 11338 _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 11338 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11338 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 $XWINNMR . . 11338 1 2 $NMRPipe . . 11338 1 3 $NMRVIEW . . 11338 1 4 $Kujira . . 11338 1 5 $CYANA . . 11338 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 6 6 SER HA H 1 4.478 0.030 . 1 . . . . 6 SER HA . 11338 1 2 . 1 1 6 6 SER HB2 H 1 3.903 0.030 . 1 . . . . 6 SER HB2 . 11338 1 3 . 1 1 6 6 SER HB3 H 1 3.903 0.030 . 1 . . . . 6 SER HB3 . 11338 1 4 . 1 1 6 6 SER C C 13 175.057 0.300 . 1 . . . . 6 SER C . 11338 1 5 . 1 1 6 6 SER CA C 13 58.709 0.300 . 1 . . . . 6 SER CA . 11338 1 6 . 1 1 6 6 SER CB C 13 63.883 0.300 . 1 . . . . 6 SER CB . 11338 1 7 . 1 1 7 7 GLY H H 1 8.400 0.030 . 1 . . . . 7 GLY H . 11338 1 8 . 1 1 7 7 GLY HA2 H 1 3.991 0.030 . 2 . . . . 7 GLY HA2 . 11338 1 9 . 1 1 7 7 GLY HA3 H 1 3.963 0.030 . 2 . . . . 7 GLY HA3 . 11338 1 10 . 1 1 7 7 GLY C C 13 173.910 0.300 . 1 . . . . 7 GLY C . 11338 1 11 . 1 1 7 7 GLY CA C 13 45.374 0.300 . 1 . . . . 7 GLY CA . 11338 1 12 . 1 1 7 7 GLY N N 15 110.742 0.300 . 1 . . . . 7 GLY N . 11338 1 13 . 1 1 8 8 MET H H 1 8.134 0.030 . 1 . . . . 8 MET H . 11338 1 14 . 1 1 8 8 MET HA H 1 4.521 0.030 . 1 . . . . 8 MET HA . 11338 1 15 . 1 1 8 8 MET HB2 H 1 2.054 0.030 . 2 . . . . 8 MET HB2 . 11338 1 16 . 1 1 8 8 MET HB3 H 1 1.936 0.030 . 2 . . . . 8 MET HB3 . 11338 1 17 . 1 1 8 8 MET HG2 H 1 2.547 0.030 . 2 . . . . 8 MET HG2 . 11338 1 18 . 1 1 8 8 MET HG3 H 1 2.483 0.030 . 2 . . . . 8 MET HG3 . 11338 1 19 . 1 1 8 8 MET C C 13 175.973 0.300 . 1 . . . . 8 MET C . 11338 1 20 . 1 1 8 8 MET CA C 13 55.162 0.300 . 1 . . . . 8 MET CA . 11338 1 21 . 1 1 8 8 MET CB C 13 33.268 0.300 . 1 . . . . 8 MET CB . 11338 1 22 . 1 1 8 8 MET CG C 13 32.518 0.300 . 1 . . . . 8 MET CG . 11338 1 23 . 1 1 8 8 MET N N 15 119.779 0.300 . 1 . . . . 8 MET N . 11338 1 24 . 1 1 9 9 THR H H 1 8.239 0.030 . 1 . . . . 9 THR H . 11338 1 25 . 1 1 9 9 THR HA H 1 3.953 0.030 . 1 . . . . 9 THR HA . 11338 1 26 . 1 1 9 9 THR HB H 1 3.598 0.030 . 1 . . . . 9 THR HB . 11338 1 27 . 1 1 9 9 THR HG21 H 1 0.778 0.030 . 1 . . . . 9 THR HG2 . 11338 1 28 . 1 1 9 9 THR HG22 H 1 0.778 0.030 . 1 . . . . 9 THR HG2 . 11338 1 29 . 1 1 9 9 THR HG23 H 1 0.778 0.030 . 1 . . . . 9 THR HG2 . 11338 1 30 . 1 1 9 9 THR C C 13 172.928 0.300 . 1 . . . . 9 THR C . 11338 1 31 . 1 1 9 9 THR CA C 13 62.739 0.300 . 1 . . . . 9 THR CA . 11338 1 32 . 1 1 9 9 THR CB C 13 69.485 0.300 . 1 . . . . 9 THR CB . 11338 1 33 . 1 1 9 9 THR CG2 C 13 22.028 0.300 . 1 . . . . 9 THR CG2 . 11338 1 34 . 1 1 9 9 THR N N 15 119.230 0.300 . 1 . . . . 9 THR N . 11338 1 35 . 1 1 10 10 ASP H H 1 8.696 0.030 . 1 . . . . 10 ASP H . 11338 1 36 . 1 1 10 10 ASP HA H 1 4.601 0.030 . 1 . . . . 10 ASP HA . 11338 1 37 . 1 1 10 10 ASP HB2 H 1 2.986 0.030 . 2 . . . . 10 ASP HB2 . 11338 1 38 . 1 1 10 10 ASP HB3 H 1 2.429 0.030 . 2 . . . . 10 ASP HB3 . 11338 1 39 . 1 1 10 10 ASP C C 13 175.683 0.300 . 1 . . . . 10 ASP C . 11338 1 40 . 1 1 10 10 ASP CA C 13 52.509 0.300 . 1 . . . . 10 ASP CA . 11338 1 41 . 1 1 10 10 ASP CB C 13 40.451 0.300 . 1 . . . . 10 ASP CB . 11338 1 42 . 1 1 10 10 ASP N N 15 126.201 0.300 . 1 . . . . 10 ASP N . 11338 1 43 . 1 1 11 11 TYR H H 1 7.516 0.030 . 1 . . . . 11 TYR H . 11338 1 44 . 1 1 11 11 TYR HA H 1 4.158 0.030 . 1 . . . . 11 TYR HA . 11338 1 45 . 1 1 11 11 TYR HB2 H 1 3.485 0.030 . 2 . . . . 11 TYR HB2 . 11338 1 46 . 1 1 11 11 TYR HB3 H 1 2.809 0.030 . 2 . . . . 11 TYR HB3 . 11338 1 47 . 1 1 11 11 TYR HD1 H 1 7.131 0.030 . 1 . . . . 11 TYR HD1 . 11338 1 48 . 1 1 11 11 TYR HD2 H 1 7.131 0.030 . 1 . . . . 11 TYR HD2 . 11338 1 49 . 1 1 11 11 TYR HE1 H 1 6.726 0.030 . 1 . . . . 11 TYR HE1 . 11338 1 50 . 1 1 11 11 TYR HE2 H 1 6.726 0.030 . 1 . . . . 11 TYR HE2 . 11338 1 51 . 1 1 11 11 TYR C C 13 177.864 0.300 . 1 . . . . 11 TYR C . 11338 1 52 . 1 1 11 11 TYR CA C 13 61.517 0.300 . 1 . . . . 11 TYR CA . 11338 1 53 . 1 1 11 11 TYR CB C 13 38.000 0.300 . 1 . . . . 11 TYR CB . 11338 1 54 . 1 1 11 11 TYR CD1 C 13 133.072 0.300 . 1 . . . . 11 TYR CD1 . 11338 1 55 . 1 1 11 11 TYR CD2 C 13 133.072 0.300 . 1 . . . . 11 TYR CD2 . 11338 1 56 . 1 1 11 11 TYR CE1 C 13 118.086 0.300 . 1 . . . . 11 TYR CE1 . 11338 1 57 . 1 1 11 11 TYR CE2 C 13 118.086 0.300 . 1 . . . . 11 TYR CE2 . 11338 1 58 . 1 1 11 11 TYR N N 15 123.983 0.300 . 1 . . . . 11 TYR N . 11338 1 59 . 1 1 12 12 GLY H H 1 8.538 0.030 . 1 . . . . 12 GLY H . 11338 1 60 . 1 1 12 12 GLY HA2 H 1 4.036 0.030 . 2 . . . . 12 GLY HA2 . 11338 1 61 . 1 1 12 12 GLY HA3 H 1 3.810 0.030 . 2 . . . . 12 GLY HA3 . 11338 1 62 . 1 1 12 12 GLY C C 13 176.414 0.300 . 1 . . . . 12 GLY C . 11338 1 63 . 1 1 12 12 GLY CA C 13 47.495 0.300 . 1 . . . . 12 GLY CA . 11338 1 64 . 1 1 12 12 GLY N N 15 105.666 0.300 . 1 . . . . 12 GLY N . 11338 1 65 . 1 1 13 13 GLU H H 1 7.891 0.030 . 1 . . . . 13 GLU H . 11338 1 66 . 1 1 13 13 GLU HA H 1 4.104 0.030 . 1 . . . . 13 GLU HA . 11338 1 67 . 1 1 13 13 GLU HB2 H 1 2.056 0.030 . 2 . . . . 13 GLU HB2 . 11338 1 68 . 1 1 13 13 GLU HB3 H 1 2.000 0.030 . 2 . . . . 13 GLU HB3 . 11338 1 69 . 1 1 13 13 GLU HG2 H 1 2.251 0.030 . 1 . . . . 13 GLU HG2 . 11338 1 70 . 1 1 13 13 GLU HG3 H 1 2.251 0.030 . 1 . . . . 13 GLU HG3 . 11338 1 71 . 1 1 13 13 GLU C C 13 178.498 0.300 . 1 . . . . 13 GLU C . 11338 1 72 . 1 1 13 13 GLU CA C 13 59.008 0.300 . 1 . . . . 13 GLU CA . 11338 1 73 . 1 1 13 13 GLU CB C 13 29.769 0.300 . 1 . . . . 13 GLU CB . 11338 1 74 . 1 1 13 13 GLU CG C 13 36.011 0.300 . 1 . . . . 13 GLU CG . 11338 1 75 . 1 1 13 13 GLU N N 15 123.295 0.300 . 1 . . . . 13 GLU N . 11338 1 76 . 1 1 14 14 GLU H H 1 8.261 0.030 . 1 . . . . 14 GLU H . 11338 1 77 . 1 1 14 14 GLU HA H 1 4.117 0.030 . 1 . . . . 14 GLU HA . 11338 1 78 . 1 1 14 14 GLU HB2 H 1 2.083 0.030 . 2 . . . . 14 GLU HB2 . 11338 1 79 . 1 1 14 14 GLU HB3 H 1 2.008 0.030 . 2 . . . . 14 GLU HB3 . 11338 1 80 . 1 1 14 14 GLU HG2 H 1 2.410 0.030 . 2 . . . . 14 GLU HG2 . 11338 1 81 . 1 1 14 14 GLU HG3 H 1 2.170 0.030 . 2 . . . . 14 GLU HG3 . 11338 1 82 . 1 1 14 14 GLU C C 13 180.441 0.300 . 1 . . . . 14 GLU C . 11338 1 83 . 1 1 14 14 GLU CA C 13 59.162 0.300 . 1 . . . . 14 GLU CA . 11338 1 84 . 1 1 14 14 GLU CB C 13 29.032 0.300 . 1 . . . . 14 GLU CB . 11338 1 85 . 1 1 14 14 GLU CG C 13 35.772 0.300 . 1 . . . . 14 GLU CG . 11338 1 86 . 1 1 14 14 GLU N N 15 118.108 0.300 . 1 . . . . 14 GLU N . 11338 1 87 . 1 1 15 15 GLN H H 1 8.352 0.030 . 1 . . . . 15 GLN H . 11338 1 88 . 1 1 15 15 GLN HA H 1 3.838 0.030 . 1 . . . . 15 GLN HA . 11338 1 89 . 1 1 15 15 GLN HB2 H 1 2.291 0.030 . 2 . . . . 15 GLN HB2 . 11338 1 90 . 1 1 15 15 GLN HB3 H 1 2.222 0.030 . 2 . . . . 15 GLN HB3 . 11338 1 91 . 1 1 15 15 GLN HE21 H 1 8.101 0.030 . 2 . . . . 15 GLN HE21 . 11338 1 92 . 1 1 15 15 GLN HE22 H 1 6.383 0.030 . 2 . . . . 15 GLN HE22 . 11338 1 93 . 1 1 15 15 GLN HG2 H 1 2.801 0.030 . 2 . . . . 15 GLN HG2 . 11338 1 94 . 1 1 15 15 GLN HG3 H 1 1.670 0.030 . 2 . . . . 15 GLN HG3 . 11338 1 95 . 1 1 15 15 GLN C C 13 177.206 0.300 . 1 . . . . 15 GLN C . 11338 1 96 . 1 1 15 15 GLN CA C 13 59.501 0.300 . 1 . . . . 15 GLN CA . 11338 1 97 . 1 1 15 15 GLN CB C 13 28.275 0.300 . 1 . . . . 15 GLN CB . 11338 1 98 . 1 1 15 15 GLN CG C 13 35.261 0.300 . 1 . . . . 15 GLN CG . 11338 1 99 . 1 1 15 15 GLN N N 15 117.724 0.300 . 1 . . . . 15 GLN N . 11338 1 100 . 1 1 15 15 GLN NE2 N 15 110.003 0.300 . 1 . . . . 15 GLN NE2 . 11338 1 101 . 1 1 16 16 ARG H H 1 8.395 0.030 . 1 . . . . 16 ARG H . 11338 1 102 . 1 1 16 16 ARG HA H 1 4.092 0.030 . 1 . . . . 16 ARG HA . 11338 1 103 . 1 1 16 16 ARG HB2 H 1 2.059 0.030 . 2 . . . . 16 ARG HB2 . 11338 1 104 . 1 1 16 16 ARG HB3 H 1 1.925 0.030 . 2 . . . . 16 ARG HB3 . 11338 1 105 . 1 1 16 16 ARG HD2 H 1 3.268 0.030 . 1 . . . . 16 ARG HD2 . 11338 1 106 . 1 1 16 16 ARG HD3 H 1 3.268 0.030 . 1 . . . . 16 ARG HD3 . 11338 1 107 . 1 1 16 16 ARG HE H 1 7.490 0.030 . 1 . . . . 16 ARG HE . 11338 1 108 . 1 1 16 16 ARG HG2 H 1 1.916 0.030 . 2 . . . . 16 ARG HG2 . 11338 1 109 . 1 1 16 16 ARG HG3 H 1 1.652 0.030 . 2 . . . . 16 ARG HG3 . 11338 1 110 . 1 1 16 16 ARG C C 13 179.590 0.300 . 1 . . . . 16 ARG C . 11338 1 111 . 1 1 16 16 ARG CA C 13 60.011 0.300 . 1 . . . . 16 ARG CA . 11338 1 112 . 1 1 16 16 ARG CB C 13 30.024 0.300 . 1 . . . . 16 ARG CB . 11338 1 113 . 1 1 16 16 ARG CD C 13 43.266 0.300 . 1 . . . . 16 ARG CD . 11338 1 114 . 1 1 16 16 ARG CG C 13 27.515 0.300 . 1 . . . . 16 ARG CG . 11338 1 115 . 1 1 16 16 ARG N N 15 118.850 0.300 . 1 . . . . 16 ARG N . 11338 1 116 . 1 1 16 16 ARG NE N 15 83.416 0.300 . 1 . . . . 16 ARG NE . 11338 1 117 . 1 1 17 17 ASN H H 1 8.505 0.030 . 1 . . . . 17 ASN H . 11338 1 118 . 1 1 17 17 ASN HA H 1 4.481 0.030 . 1 . . . . 17 ASN HA . 11338 1 119 . 1 1 17 17 ASN HB2 H 1 3.017 0.030 . 2 . . . . 17 ASN HB2 . 11338 1 120 . 1 1 17 17 ASN HB3 H 1 2.769 0.030 . 2 . . . . 17 ASN HB3 . 11338 1 121 . 1 1 17 17 ASN HD21 H 1 7.657 0.030 . 2 . . . . 17 ASN HD21 . 11338 1 122 . 1 1 17 17 ASN HD22 H 1 6.951 0.030 . 2 . . . . 17 ASN HD22 . 11338 1 123 . 1 1 17 17 ASN C C 13 178.435 0.300 . 1 . . . . 17 ASN C . 11338 1 124 . 1 1 17 17 ASN CA C 13 55.902 0.300 . 1 . . . . 17 ASN CA . 11338 1 125 . 1 1 17 17 ASN CB C 13 37.771 0.300 . 1 . . . . 17 ASN CB . 11338 1 126 . 1 1 17 17 ASN N N 15 116.826 0.300 . 1 . . . . 17 ASN N . 11338 1 127 . 1 1 17 17 ASN ND2 N 15 112.193 0.300 . 1 . . . . 17 ASN ND2 . 11338 1 128 . 1 1 18 18 GLU H H 1 8.180 0.030 . 1 . . . . 18 GLU H . 11338 1 129 . 1 1 18 18 GLU HA H 1 4.178 0.030 . 1 . . . . 18 GLU HA . 11338 1 130 . 1 1 18 18 GLU HB2 H 1 2.757 0.030 . 2 . . . . 18 GLU HB2 . 11338 1 131 . 1 1 18 18 GLU HB3 H 1 2.049 0.030 . 2 . . . . 18 GLU HB3 . 11338 1 132 . 1 1 18 18 GLU HG2 H 1 2.335 0.030 . 2 . . . . 18 GLU HG2 . 11338 1 133 . 1 1 18 18 GLU HG3 H 1 2.208 0.030 . 2 . . . . 18 GLU HG3 . 11338 1 134 . 1 1 18 18 GLU C C 13 177.753 0.300 . 1 . . . . 18 GLU C . 11338 1 135 . 1 1 18 18 GLU CA C 13 59.999 0.300 . 1 . . . . 18 GLU CA . 11338 1 136 . 1 1 18 18 GLU CB C 13 28.912 0.300 . 1 . . . . 18 GLU CB . 11338 1 137 . 1 1 18 18 GLU CG C 13 37.521 0.300 . 1 . . . . 18 GLU CG . 11338 1 138 . 1 1 18 18 GLU N N 15 123.260 0.300 . 1 . . . . 18 GLU N . 11338 1 139 . 1 1 19 19 LEU H H 1 8.474 0.030 . 1 . . . . 19 LEU H . 11338 1 140 . 1 1 19 19 LEU HA H 1 3.707 0.030 . 1 . . . . 19 LEU HA . 11338 1 141 . 1 1 19 19 LEU HB2 H 1 2.058 0.030 . 2 . . . . 19 LEU HB2 . 11338 1 142 . 1 1 19 19 LEU HB3 H 1 1.508 0.030 . 2 . . . . 19 LEU HB3 . 11338 1 143 . 1 1 19 19 LEU HD11 H 1 0.964 0.030 . 1 . . . . 19 LEU HD1 . 11338 1 144 . 1 1 19 19 LEU HD12 H 1 0.964 0.030 . 1 . . . . 19 LEU HD1 . 11338 1 145 . 1 1 19 19 LEU HD13 H 1 0.964 0.030 . 1 . . . . 19 LEU HD1 . 11338 1 146 . 1 1 19 19 LEU HD21 H 1 0.576 0.030 . 1 . . . . 19 LEU HD2 . 11338 1 147 . 1 1 19 19 LEU HD22 H 1 0.576 0.030 . 1 . . . . 19 LEU HD2 . 11338 1 148 . 1 1 19 19 LEU HD23 H 1 0.576 0.030 . 1 . . . . 19 LEU HD2 . 11338 1 149 . 1 1 19 19 LEU HG H 1 2.204 0.030 . 1 . . . . 19 LEU HG . 11338 1 150 . 1 1 19 19 LEU C C 13 179.880 0.300 . 1 . . . . 19 LEU C . 11338 1 151 . 1 1 19 19 LEU CA C 13 58.916 0.300 . 1 . . . . 19 LEU CA . 11338 1 152 . 1 1 19 19 LEU CB C 13 41.858 0.300 . 1 . . . . 19 LEU CB . 11338 1 153 . 1 1 19 19 LEU CD1 C 13 25.776 0.300 . 2 . . . . 19 LEU CD1 . 11338 1 154 . 1 1 19 19 LEU CD2 C 13 23.764 0.300 . 2 . . . . 19 LEU CD2 . 11338 1 155 . 1 1 19 19 LEU CG C 13 26.515 0.300 . 1 . . . . 19 LEU CG . 11338 1 156 . 1 1 19 19 LEU N N 15 120.246 0.300 . 1 . . . . 19 LEU N . 11338 1 157 . 1 1 20 20 GLU H H 1 7.646 0.030 . 1 . . . . 20 GLU H . 11338 1 158 . 1 1 20 20 GLU HA H 1 3.961 0.030 . 1 . . . . 20 GLU HA . 11338 1 159 . 1 1 20 20 GLU HB2 H 1 2.074 0.030 . 1 . . . . 20 GLU HB2 . 11338 1 160 . 1 1 20 20 GLU HB3 H 1 2.074 0.030 . 1 . . . . 20 GLU HB3 . 11338 1 161 . 1 1 20 20 GLU HG2 H 1 2.447 0.030 . 2 . . . . 20 GLU HG2 . 11338 1 162 . 1 1 20 20 GLU HG3 H 1 2.185 0.030 . 2 . . . . 20 GLU HG3 . 11338 1 163 . 1 1 20 20 GLU C C 13 179.088 0.300 . 1 . . . . 20 GLU C . 11338 1 164 . 1 1 20 20 GLU CA C 13 59.251 0.300 . 1 . . . . 20 GLU CA . 11338 1 165 . 1 1 20 20 GLU CB C 13 29.785 0.300 . 1 . . . . 20 GLU CB . 11338 1 166 . 1 1 20 20 GLU CG C 13 36.522 0.300 . 1 . . . . 20 GLU CG . 11338 1 167 . 1 1 20 20 GLU N N 15 117.399 0.300 . 1 . . . . 20 GLU N . 11338 1 168 . 1 1 21 21 ALA H H 1 7.708 0.030 . 1 . . . . 21 ALA H . 11338 1 169 . 1 1 21 21 ALA HA H 1 4.063 0.030 . 1 . . . . 21 ALA HA . 11338 1 170 . 1 1 21 21 ALA HB1 H 1 1.489 0.030 . 1 . . . . 21 ALA HB . 11338 1 171 . 1 1 21 21 ALA HB2 H 1 1.489 0.030 . 1 . . . . 21 ALA HB . 11338 1 172 . 1 1 21 21 ALA HB3 H 1 1.489 0.030 . 1 . . . . 21 ALA HB . 11338 1 173 . 1 1 21 21 ALA C C 13 180.914 0.300 . 1 . . . . 21 ALA C . 11338 1 174 . 1 1 21 21 ALA CA C 13 55.003 0.300 . 1 . . . . 21 ALA CA . 11338 1 175 . 1 1 21 21 ALA CB C 13 18.024 0.300 . 1 . . . . 21 ALA CB . 11338 1 176 . 1 1 21 21 ALA N N 15 123.147 0.300 . 1 . . . . 21 ALA N . 11338 1 177 . 1 1 22 22 LEU H H 1 8.786 0.030 . 1 . . . . 22 LEU H . 11338 1 178 . 1 1 22 22 LEU HA H 1 3.754 0.030 . 1 . . . . 22 LEU HA . 11338 1 179 . 1 1 22 22 LEU HB2 H 1 1.261 0.030 . 2 . . . . 22 LEU HB2 . 11338 1 180 . 1 1 22 22 LEU HB3 H 1 0.674 0.030 . 2 . . . . 22 LEU HB3 . 11338 1 181 . 1 1 22 22 LEU HD11 H 1 0.535 0.030 . 1 . . . . 22 LEU HD1 . 11338 1 182 . 1 1 22 22 LEU HD12 H 1 0.535 0.030 . 1 . . . . 22 LEU HD1 . 11338 1 183 . 1 1 22 22 LEU HD13 H 1 0.535 0.030 . 1 . . . . 22 LEU HD1 . 11338 1 184 . 1 1 22 22 LEU HD21 H 1 0.825 0.030 . 1 . . . . 22 LEU HD2 . 11338 1 185 . 1 1 22 22 LEU HD22 H 1 0.825 0.030 . 1 . . . . 22 LEU HD2 . 11338 1 186 . 1 1 22 22 LEU HD23 H 1 0.825 0.030 . 1 . . . . 22 LEU HD2 . 11338 1 187 . 1 1 22 22 LEU HG H 1 1.903 0.030 . 1 . . . . 22 LEU HG . 11338 1 188 . 1 1 22 22 LEU C C 13 177.826 0.300 . 1 . . . . 22 LEU C . 11338 1 189 . 1 1 22 22 LEU CA C 13 57.751 0.300 . 1 . . . . 22 LEU CA . 11338 1 190 . 1 1 22 22 LEU CB C 13 42.008 0.300 . 1 . . . . 22 LEU CB . 11338 1 191 . 1 1 22 22 LEU CD1 C 13 26.891 0.300 . 2 . . . . 22 LEU CD1 . 11338 1 192 . 1 1 22 22 LEU CD2 C 13 21.777 0.300 . 2 . . . . 22 LEU CD2 . 11338 1 193 . 1 1 22 22 LEU CG C 13 26.268 0.300 . 1 . . . . 22 LEU CG . 11338 1 194 . 1 1 22 22 LEU N N 15 118.929 0.300 . 1 . . . . 22 LEU N . 11338 1 195 . 1 1 23 23 GLU H H 1 6.925 0.030 . 1 . . . . 23 GLU H . 11338 1 196 . 1 1 23 23 GLU HA H 1 3.381 0.030 . 1 . . . . 23 GLU HA . 11338 1 197 . 1 1 23 23 GLU HB2 H 1 1.849 0.030 . 2 . . . . 23 GLU HB2 . 11338 1 198 . 1 1 23 23 GLU HB3 H 1 1.747 0.030 . 2 . . . . 23 GLU HB3 . 11338 1 199 . 1 1 23 23 GLU HG2 H 1 2.331 0.030 . 2 . . . . 23 GLU HG2 . 11338 1 200 . 1 1 23 23 GLU HG3 H 1 2.256 0.030 . 2 . . . . 23 GLU HG3 . 11338 1 201 . 1 1 23 23 GLU C C 13 177.219 0.300 . 1 . . . . 23 GLU C . 11338 1 202 . 1 1 23 23 GLU CA C 13 58.936 0.300 . 1 . . . . 23 GLU CA . 11338 1 203 . 1 1 23 23 GLU CB C 13 29.264 0.300 . 1 . . . . 23 GLU CB . 11338 1 204 . 1 1 23 23 GLU CG C 13 36.011 0.300 . 1 . . . . 23 GLU CG . 11338 1 205 . 1 1 23 23 GLU N N 15 117.117 0.300 . 1 . . . . 23 GLU N . 11338 1 206 . 1 1 24 24 SER H H 1 7.025 0.030 . 1 . . . . 24 SER H . 11338 1 207 . 1 1 24 24 SER HA H 1 4.292 0.030 . 1 . . . . 24 SER HA . 11338 1 208 . 1 1 24 24 SER HB2 H 1 3.907 0.030 . 2 . . . . 24 SER HB2 . 11338 1 209 . 1 1 24 24 SER HB3 H 1 3.880 0.030 . 2 . . . . 24 SER HB3 . 11338 1 210 . 1 1 24 24 SER C C 13 175.777 0.300 . 1 . . . . 24 SER C . 11338 1 211 . 1 1 24 24 SER CA C 13 60.168 0.300 . 1 . . . . 24 SER CA . 11338 1 212 . 1 1 24 24 SER CB C 13 63.749 0.300 . 1 . . . . 24 SER CB . 11338 1 213 . 1 1 24 24 SER N N 15 110.150 0.300 . 1 . . . . 24 SER N . 11338 1 214 . 1 1 25 25 ILE H H 1 7.677 0.030 . 1 . . . . 25 ILE H . 11338 1 215 . 1 1 25 25 ILE HA H 1 3.718 0.030 . 1 . . . . 25 ILE HA . 11338 1 216 . 1 1 25 25 ILE HB H 1 1.242 0.030 . 1 . . . . 25 ILE HB . 11338 1 217 . 1 1 25 25 ILE HD11 H 1 0.456 0.030 . 1 . . . . 25 ILE HD1 . 11338 1 218 . 1 1 25 25 ILE HD12 H 1 0.456 0.030 . 1 . . . . 25 ILE HD1 . 11338 1 219 . 1 1 25 25 ILE HD13 H 1 0.456 0.030 . 1 . . . . 25 ILE HD1 . 11338 1 220 . 1 1 25 25 ILE HG12 H 1 1.412 0.030 . 2 . . . . 25 ILE HG12 . 11338 1 221 . 1 1 25 25 ILE HG13 H 1 0.763 0.030 . 2 . . . . 25 ILE HG13 . 11338 1 222 . 1 1 25 25 ILE HG21 H 1 0.123 0.030 . 1 . . . . 25 ILE HG2 . 11338 1 223 . 1 1 25 25 ILE HG22 H 1 0.123 0.030 . 1 . . . . 25 ILE HG2 . 11338 1 224 . 1 1 25 25 ILE HG23 H 1 0.123 0.030 . 1 . . . . 25 ILE HG2 . 11338 1 225 . 1 1 25 25 ILE C C 13 175.849 0.300 . 1 . . . . 25 ILE C . 11338 1 226 . 1 1 25 25 ILE CA C 13 63.381 0.300 . 1 . . . . 25 ILE CA . 11338 1 227 . 1 1 25 25 ILE CB C 13 39.639 0.300 . 1 . . . . 25 ILE CB . 11338 1 228 . 1 1 25 25 ILE CD1 C 13 13.184 0.300 . 1 . . . . 25 ILE CD1 . 11338 1 229 . 1 1 25 25 ILE CG1 C 13 28.370 0.300 . 1 . . . . 25 ILE CG1 . 11338 1 230 . 1 1 25 25 ILE CG2 C 13 17.014 0.300 . 1 . . . . 25 ILE CG2 . 11338 1 231 . 1 1 25 25 ILE N N 15 122.313 0.300 . 1 . . . . 25 ILE N . 11338 1 232 . 1 1 26 26 TYR H H 1 7.893 0.030 . 1 . . . . 26 TYR H . 11338 1 233 . 1 1 26 26 TYR HA H 1 5.282 0.030 . 1 . . . . 26 TYR HA . 11338 1 234 . 1 1 26 26 TYR HB2 H 1 3.542 0.030 . 2 . . . . 26 TYR HB2 . 11338 1 235 . 1 1 26 26 TYR HB3 H 1 2.832 0.030 . 2 . . . . 26 TYR HB3 . 11338 1 236 . 1 1 26 26 TYR HD1 H 1 7.128 0.030 . 1 . . . . 26 TYR HD1 . 11338 1 237 . 1 1 26 26 TYR HD2 H 1 7.128 0.030 . 1 . . . . 26 TYR HD2 . 11338 1 238 . 1 1 26 26 TYR HE1 H 1 6.643 0.030 . 1 . . . . 26 TYR HE1 . 11338 1 239 . 1 1 26 26 TYR HE2 H 1 6.643 0.030 . 1 . . . . 26 TYR HE2 . 11338 1 240 . 1 1 26 26 TYR C C 13 174.294 0.300 . 1 . . . . 26 TYR C . 11338 1 241 . 1 1 26 26 TYR CA C 13 55.242 0.300 . 1 . . . . 26 TYR CA . 11338 1 242 . 1 1 26 26 TYR CB C 13 38.749 0.300 . 1 . . . . 26 TYR CB . 11338 1 243 . 1 1 26 26 TYR CD1 C 13 133.476 0.300 . 1 . . . . 26 TYR CD1 . 11338 1 244 . 1 1 26 26 TYR CD2 C 13 133.476 0.300 . 1 . . . . 26 TYR CD2 . 11338 1 245 . 1 1 26 26 TYR CE1 C 13 117.240 0.300 . 1 . . . . 26 TYR CE1 . 11338 1 246 . 1 1 26 26 TYR CE2 C 13 117.240 0.300 . 1 . . . . 26 TYR CE2 . 11338 1 247 . 1 1 26 26 TYR N N 15 118.098 0.300 . 1 . . . . 26 TYR N . 11338 1 248 . 1 1 27 27 PRO HA H 1 4.641 0.030 . 1 . . . . 27 PRO HA . 11338 1 249 . 1 1 27 27 PRO HB2 H 1 2.422 0.030 . 2 . . . . 27 PRO HB2 . 11338 1 250 . 1 1 27 27 PRO HB3 H 1 2.044 0.030 . 2 . . . . 27 PRO HB3 . 11338 1 251 . 1 1 27 27 PRO HD2 H 1 3.656 0.030 . 2 . . . . 27 PRO HD2 . 11338 1 252 . 1 1 27 27 PRO HD3 H 1 3.277 0.030 . 2 . . . . 27 PRO HD3 . 11338 1 253 . 1 1 27 27 PRO HG2 H 1 2.054 0.030 . 2 . . . . 27 PRO HG2 . 11338 1 254 . 1 1 27 27 PRO HG3 H 1 1.968 0.030 . 2 . . . . 27 PRO HG3 . 11338 1 255 . 1 1 27 27 PRO C C 13 178.677 0.300 . 1 . . . . 27 PRO C . 11338 1 256 . 1 1 27 27 PRO CA C 13 65.759 0.300 . 1 . . . . 27 PRO CA . 11338 1 257 . 1 1 27 27 PRO CB C 13 31.502 0.300 . 1 . . . . 27 PRO CB . 11338 1 258 . 1 1 27 27 PRO CD C 13 50.505 0.300 . 1 . . . . 27 PRO CD . 11338 1 259 . 1 1 27 27 PRO CG C 13 27.644 0.300 . 1 . . . . 27 PRO CG . 11338 1 260 . 1 1 28 28 ASP H H 1 8.607 0.030 . 1 . . . . 28 ASP H . 11338 1 261 . 1 1 28 28 ASP HA H 1 4.777 0.030 . 1 . . . . 28 ASP HA . 11338 1 262 . 1 1 28 28 ASP HB2 H 1 2.824 0.030 . 2 . . . . 28 ASP HB2 . 11338 1 263 . 1 1 28 28 ASP HB3 H 1 2.747 0.030 . 2 . . . . 28 ASP HB3 . 11338 1 264 . 1 1 28 28 ASP C C 13 176.584 0.300 . 1 . . . . 28 ASP C . 11338 1 265 . 1 1 28 28 ASP CA C 13 54.616 0.300 . 1 . . . . 28 ASP CA . 11338 1 266 . 1 1 28 28 ASP CB C 13 41.237 0.300 . 1 . . . . 28 ASP CB . 11338 1 267 . 1 1 28 28 ASP N N 15 114.771 0.300 . 1 . . . . 28 ASP N . 11338 1 268 . 1 1 29 29 SER H H 1 7.654 0.030 . 1 . . . . 29 SER H . 11338 1 269 . 1 1 29 29 SER HA H 1 4.777 0.030 . 1 . . . . 29 SER HA . 11338 1 270 . 1 1 29 29 SER HB2 H 1 4.106 0.030 . 2 . . . . 29 SER HB2 . 11338 1 271 . 1 1 29 29 SER HB3 H 1 3.920 0.030 . 2 . . . . 29 SER HB3 . 11338 1 272 . 1 1 29 29 SER C C 13 173.783 0.300 . 1 . . . . 29 SER C . 11338 1 273 . 1 1 29 29 SER CA C 13 58.845 0.300 . 1 . . . . 29 SER CA . 11338 1 274 . 1 1 29 29 SER CB C 13 65.248 0.300 . 1 . . . . 29 SER CB . 11338 1 275 . 1 1 29 29 SER N N 15 111.284 0.300 . 1 . . . . 29 SER N . 11338 1 276 . 1 1 30 30 PHE H H 1 8.310 0.030 . 1 . . . . 30 PHE H . 11338 1 277 . 1 1 30 30 PHE HA H 1 5.474 0.030 . 1 . . . . 30 PHE HA . 11338 1 278 . 1 1 30 30 PHE HB2 H 1 3.230 0.030 . 1 . . . . 30 PHE HB2 . 11338 1 279 . 1 1 30 30 PHE HB3 H 1 3.230 0.030 . 1 . . . . 30 PHE HB3 . 11338 1 280 . 1 1 30 30 PHE HD1 H 1 7.031 0.030 . 1 . . . . 30 PHE HD1 . 11338 1 281 . 1 1 30 30 PHE HD2 H 1 7.031 0.030 . 1 . . . . 30 PHE HD2 . 11338 1 282 . 1 1 30 30 PHE HE1 H 1 6.774 0.030 . 1 . . . . 30 PHE HE1 . 11338 1 283 . 1 1 30 30 PHE HE2 H 1 6.774 0.030 . 1 . . . . 30 PHE HE2 . 11338 1 284 . 1 1 30 30 PHE HZ H 1 6.711 0.030 . 1 . . . . 30 PHE HZ . 11338 1 285 . 1 1 30 30 PHE C C 13 175.243 0.300 . 1 . . . . 30 PHE C . 11338 1 286 . 1 1 30 30 PHE CA C 13 58.360 0.300 . 1 . . . . 30 PHE CA . 11338 1 287 . 1 1 30 30 PHE CB C 13 41.020 0.300 . 1 . . . . 30 PHE CB . 11338 1 288 . 1 1 30 30 PHE CD1 C 13 130.949 0.300 . 1 . . . . 30 PHE CD1 . 11338 1 289 . 1 1 30 30 PHE CD2 C 13 130.949 0.300 . 1 . . . . 30 PHE CD2 . 11338 1 290 . 1 1 30 30 PHE CE1 C 13 131.569 0.300 . 1 . . . . 30 PHE CE1 . 11338 1 291 . 1 1 30 30 PHE CE2 C 13 131.569 0.300 . 1 . . . . 30 PHE CE2 . 11338 1 292 . 1 1 30 30 PHE CZ C 13 129.596 0.300 . 1 . . . . 30 PHE CZ . 11338 1 293 . 1 1 30 30 PHE N N 15 127.381 0.300 . 1 . . . . 30 PHE N . 11338 1 294 . 1 1 31 31 THR H H 1 8.320 0.030 . 1 . . . . 31 THR H . 11338 1 295 . 1 1 31 31 THR HA H 1 4.235 0.030 . 1 . . . . 31 THR HA . 11338 1 296 . 1 1 31 31 THR HB H 1 3.900 0.030 . 1 . . . . 31 THR HB . 11338 1 297 . 1 1 31 31 THR HG21 H 1 0.941 0.030 . 1 . . . . 31 THR HG2 . 11338 1 298 . 1 1 31 31 THR HG22 H 1 0.941 0.030 . 1 . . . . 31 THR HG2 . 11338 1 299 . 1 1 31 31 THR HG23 H 1 0.941 0.030 . 1 . . . . 31 THR HG2 . 11338 1 300 . 1 1 31 31 THR C C 13 172.154 0.300 . 1 . . . . 31 THR C . 11338 1 301 . 1 1 31 31 THR CA C 13 61.631 0.300 . 1 . . . . 31 THR CA . 11338 1 302 . 1 1 31 31 THR CB C 13 71.756 0.300 . 1 . . . . 31 THR CB . 11338 1 303 . 1 1 31 31 THR CG2 C 13 20.270 0.300 . 1 . . . . 31 THR CG2 . 11338 1 304 . 1 1 31 31 THR N N 15 125.220 0.300 . 1 . . . . 31 THR N . 11338 1 305 . 1 1 32 32 VAL H H 1 8.732 0.030 . 1 . . . . 32 VAL H . 11338 1 306 . 1 1 32 32 VAL HA H 1 3.789 0.030 . 1 . . . . 32 VAL HA . 11338 1 307 . 1 1 32 32 VAL HB H 1 1.931 0.030 . 1 . . . . 32 VAL HB . 11338 1 308 . 1 1 32 32 VAL HG11 H 1 0.915 0.030 . 1 . . . . 32 VAL HG1 . 11338 1 309 . 1 1 32 32 VAL HG12 H 1 0.915 0.030 . 1 . . . . 32 VAL HG1 . 11338 1 310 . 1 1 32 32 VAL HG13 H 1 0.915 0.030 . 1 . . . . 32 VAL HG1 . 11338 1 311 . 1 1 32 32 VAL HG21 H 1 0.951 0.030 . 1 . . . . 32 VAL HG2 . 11338 1 312 . 1 1 32 32 VAL HG22 H 1 0.951 0.030 . 1 . . . . 32 VAL HG2 . 11338 1 313 . 1 1 32 32 VAL HG23 H 1 0.951 0.030 . 1 . . . . 32 VAL HG2 . 11338 1 314 . 1 1 32 32 VAL C C 13 175.931 0.300 . 1 . . . . 32 VAL C . 11338 1 315 . 1 1 32 32 VAL CA C 13 63.902 0.300 . 1 . . . . 32 VAL CA . 11338 1 316 . 1 1 32 32 VAL CB C 13 32.263 0.300 . 1 . . . . 32 VAL CB . 11338 1 317 . 1 1 32 32 VAL CG1 C 13 21.371 0.300 . 2 . . . . 32 VAL CG1 . 11338 1 318 . 1 1 32 32 VAL CG2 C 13 23.431 0.300 . 2 . . . . 32 VAL CG2 . 11338 1 319 . 1 1 32 32 VAL N N 15 126.792 0.300 . 1 . . . . 32 VAL N . 11338 1 320 . 1 1 33 33 LEU H H 1 9.198 0.030 . 1 . . . . 33 LEU H . 11338 1 321 . 1 1 33 33 LEU HA H 1 4.373 0.030 . 1 . . . . 33 LEU HA . 11338 1 322 . 1 1 33 33 LEU HB2 H 1 1.475 0.030 . 2 . . . . 33 LEU HB2 . 11338 1 323 . 1 1 33 33 LEU HB3 H 1 1.380 0.030 . 2 . . . . 33 LEU HB3 . 11338 1 324 . 1 1 33 33 LEU HD11 H 1 0.510 0.030 . 1 . . . . 33 LEU HD1 . 11338 1 325 . 1 1 33 33 LEU HD12 H 1 0.510 0.030 . 1 . . . . 33 LEU HD1 . 11338 1 326 . 1 1 33 33 LEU HD13 H 1 0.510 0.030 . 1 . . . . 33 LEU HD1 . 11338 1 327 . 1 1 33 33 LEU HD21 H 1 0.598 0.030 . 1 . . . . 33 LEU HD2 . 11338 1 328 . 1 1 33 33 LEU HD22 H 1 0.598 0.030 . 1 . . . . 33 LEU HD2 . 11338 1 329 . 1 1 33 33 LEU HD23 H 1 0.598 0.030 . 1 . . . . 33 LEU HD2 . 11338 1 330 . 1 1 33 33 LEU HG H 1 1.385 0.030 . 1 . . . . 33 LEU HG . 11338 1 331 . 1 1 33 33 LEU C C 13 177.250 0.300 . 1 . . . . 33 LEU C . 11338 1 332 . 1 1 33 33 LEU CA C 13 55.514 0.300 . 1 . . . . 33 LEU CA . 11338 1 333 . 1 1 33 33 LEU CB C 13 43.242 0.300 . 1 . . . . 33 LEU CB . 11338 1 334 . 1 1 33 33 LEU CD1 C 13 25.516 0.300 . 2 . . . . 33 LEU CD1 . 11338 1 335 . 1 1 33 33 LEU CD2 C 13 22.102 0.300 . 2 . . . . 33 LEU CD2 . 11338 1 336 . 1 1 33 33 LEU CG C 13 27.265 0.300 . 1 . . . . 33 LEU CG . 11338 1 337 . 1 1 33 33 LEU N N 15 128.609 0.300 . 1 . . . . 33 LEU N . 11338 1 338 . 1 1 34 34 SER H H 1 7.946 0.030 . 1 . . . . 34 SER H . 11338 1 339 . 1 1 34 34 SER HA H 1 4.553 0.030 . 1 . . . . 34 SER HA . 11338 1 340 . 1 1 34 34 SER HB2 H 1 3.877 0.030 . 2 . . . . 34 SER HB2 . 11338 1 341 . 1 1 34 34 SER HB3 H 1 3.756 0.030 . 2 . . . . 34 SER HB3 . 11338 1 342 . 1 1 34 34 SER C C 13 172.658 0.300 . 1 . . . . 34 SER C . 11338 1 343 . 1 1 34 34 SER CA C 13 57.508 0.300 . 1 . . . . 34 SER CA . 11338 1 344 . 1 1 34 34 SER CB C 13 64.617 0.300 . 1 . . . . 34 SER CB . 11338 1 345 . 1 1 34 34 SER N N 15 111.489 0.300 . 1 . . . . 34 SER N . 11338 1 346 . 1 1 35 35 GLU H H 1 8.434 0.030 . 1 . . . . 35 GLU H . 11338 1 347 . 1 1 35 35 GLU HA H 1 4.405 0.030 . 1 . . . . 35 GLU HA . 11338 1 348 . 1 1 35 35 GLU HB2 H 1 2.081 0.030 . 2 . . . . 35 GLU HB2 . 11338 1 349 . 1 1 35 35 GLU HB3 H 1 1.867 0.030 . 2 . . . . 35 GLU HB3 . 11338 1 350 . 1 1 35 35 GLU HG2 H 1 2.219 0.030 . 1 . . . . 35 GLU HG2 . 11338 1 351 . 1 1 35 35 GLU HG3 H 1 2.219 0.030 . 1 . . . . 35 GLU HG3 . 11338 1 352 . 1 1 35 35 GLU C C 13 175.828 0.300 . 1 . . . . 35 GLU C . 11338 1 353 . 1 1 35 35 GLU CA C 13 56.752 0.300 . 1 . . . . 35 GLU CA . 11338 1 354 . 1 1 35 35 GLU CB C 13 31.763 0.300 . 1 . . . . 35 GLU CB . 11338 1 355 . 1 1 35 35 GLU CG C 13 36.642 0.300 . 1 . . . . 35 GLU CG . 11338 1 356 . 1 1 35 35 GLU N N 15 119.801 0.300 . 1 . . . . 35 GLU N . 11338 1 357 . 1 1 36 36 ASN H H 1 7.938 0.030 . 1 . . . . 36 ASN H . 11338 1 358 . 1 1 36 36 ASN HA H 1 4.959 0.030 . 1 . . . . 36 ASN HA . 11338 1 359 . 1 1 36 36 ASN HB2 H 1 2.798 0.030 . 2 . . . . 36 ASN HB2 . 11338 1 360 . 1 1 36 36 ASN HB3 H 1 2.664 0.030 . 2 . . . . 36 ASN HB3 . 11338 1 361 . 1 1 36 36 ASN HD21 H 1 7.628 0.030 . 2 . . . . 36 ASN HD21 . 11338 1 362 . 1 1 36 36 ASN HD22 H 1 6.922 0.030 . 2 . . . . 36 ASN HD22 . 11338 1 363 . 1 1 36 36 ASN C C 13 172.279 0.300 . 1 . . . . 36 ASN C . 11338 1 364 . 1 1 36 36 ASN CA C 13 51.010 0.300 . 1 . . . . 36 ASN CA . 11338 1 365 . 1 1 36 36 ASN CB C 13 40.274 0.300 . 1 . . . . 36 ASN CB . 11338 1 366 . 1 1 36 36 ASN N N 15 115.930 0.300 . 1 . . . . 36 ASN N . 11338 1 367 . 1 1 36 36 ASN ND2 N 15 112.888 0.300 . 1 . . . . 36 ASN ND2 . 11338 1 368 . 1 1 37 37 PRO HA H 1 5.153 0.030 . 1 . . . . 37 PRO HA . 11338 1 369 . 1 1 37 37 PRO HB2 H 1 2.402 0.030 . 2 . . . . 37 PRO HB2 . 11338 1 370 . 1 1 37 37 PRO HB3 H 1 2.002 0.030 . 2 . . . . 37 PRO HB3 . 11338 1 371 . 1 1 37 37 PRO HD2 H 1 3.554 0.030 . 2 . . . . 37 PRO HD2 . 11338 1 372 . 1 1 37 37 PRO HD3 H 1 3.440 0.030 . 2 . . . . 37 PRO HD3 . 11338 1 373 . 1 1 37 37 PRO HG2 H 1 1.932 0.030 . 2 . . . . 37 PRO HG2 . 11338 1 374 . 1 1 37 37 PRO HG3 H 1 1.678 0.030 . 2 . . . . 37 PRO HG3 . 11338 1 375 . 1 1 37 37 PRO CA C 13 62.250 0.300 . 1 . . . . 37 PRO CA . 11338 1 376 . 1 1 37 37 PRO CB C 13 33.018 0.300 . 1 . . . . 37 PRO CB . 11338 1 377 . 1 1 37 37 PRO CD C 13 50.244 0.300 . 1 . . . . 37 PRO CD . 11338 1 378 . 1 1 37 37 PRO CG C 13 24.521 0.300 . 1 . . . . 37 PRO CG . 11338 1 379 . 1 1 38 38 PRO HA H 1 4.579 0.030 . 1 . . . . 38 PRO HA . 11338 1 380 . 1 1 38 38 PRO HB2 H 1 2.429 0.030 . 2 . . . . 38 PRO HB2 . 11338 1 381 . 1 1 38 38 PRO HB3 H 1 2.011 0.030 . 2 . . . . 38 PRO HB3 . 11338 1 382 . 1 1 38 38 PRO HD2 H 1 4.138 0.030 . 2 . . . . 38 PRO HD2 . 11338 1 383 . 1 1 38 38 PRO HD3 H 1 3.725 0.030 . 2 . . . . 38 PRO HD3 . 11338 1 384 . 1 1 38 38 PRO HG2 H 1 2.466 0.030 . 2 . . . . 38 PRO HG2 . 11338 1 385 . 1 1 38 38 PRO HG3 H 1 2.309 0.030 . 2 . . . . 38 PRO HG3 . 11338 1 386 . 1 1 38 38 PRO C C 13 175.530 0.300 . 1 . . . . 38 PRO C . 11338 1 387 . 1 1 38 38 PRO CA C 13 63.269 0.300 . 1 . . . . 38 PRO CA . 11338 1 388 . 1 1 38 38 PRO CB C 13 31.505 0.300 . 1 . . . . 38 PRO CB . 11338 1 389 . 1 1 38 38 PRO CD C 13 50.839 0.300 . 1 . . . . 38 PRO CD . 11338 1 390 . 1 1 38 38 PRO CG C 13 28.181 0.300 . 1 . . . . 38 PRO CG . 11338 1 391 . 1 1 39 39 SER H H 1 8.234 0.030 . 1 . . . . 39 SER H . 11338 1 392 . 1 1 39 39 SER HA H 1 5.430 0.030 . 1 . . . . 39 SER HA . 11338 1 393 . 1 1 39 39 SER HB2 H 1 3.542 0.030 . 1 . . . . 39 SER HB2 . 11338 1 394 . 1 1 39 39 SER HB3 H 1 3.542 0.030 . 1 . . . . 39 SER HB3 . 11338 1 395 . 1 1 39 39 SER C C 13 174.178 0.300 . 1 . . . . 39 SER C . 11338 1 396 . 1 1 39 39 SER CA C 13 56.772 0.300 . 1 . . . . 39 SER CA . 11338 1 397 . 1 1 39 39 SER CB C 13 66.164 0.300 . 1 . . . . 39 SER CB . 11338 1 398 . 1 1 39 39 SER N N 15 117.821 0.300 . 1 . . . . 39 SER N . 11338 1 399 . 1 1 40 40 PHE H H 1 8.572 0.030 . 1 . . . . 40 PHE H . 11338 1 400 . 1 1 40 40 PHE HA H 1 5.338 0.030 . 1 . . . . 40 PHE HA . 11338 1 401 . 1 1 40 40 PHE HB2 H 1 2.847 0.030 . 2 . . . . 40 PHE HB2 . 11338 1 402 . 1 1 40 40 PHE HB3 H 1 2.484 0.030 . 2 . . . . 40 PHE HB3 . 11338 1 403 . 1 1 40 40 PHE HD1 H 1 6.583 0.030 . 1 . . . . 40 PHE HD1 . 11338 1 404 . 1 1 40 40 PHE HD2 H 1 6.583 0.030 . 1 . . . . 40 PHE HD2 . 11338 1 405 . 1 1 40 40 PHE HE1 H 1 6.629 0.030 . 1 . . . . 40 PHE HE1 . 11338 1 406 . 1 1 40 40 PHE HE2 H 1 6.629 0.030 . 1 . . . . 40 PHE HE2 . 11338 1 407 . 1 1 40 40 PHE HZ H 1 6.378 0.030 . 1 . . . . 40 PHE HZ . 11338 1 408 . 1 1 40 40 PHE C C 13 172.721 0.300 . 1 . . . . 40 PHE C . 11338 1 409 . 1 1 40 40 PHE CA C 13 55.493 0.300 . 1 . . . . 40 PHE CA . 11338 1 410 . 1 1 40 40 PHE CB C 13 41.529 0.300 . 1 . . . . 40 PHE CB . 11338 1 411 . 1 1 40 40 PHE CD1 C 13 132.654 0.300 . 1 . . . . 40 PHE CD1 . 11338 1 412 . 1 1 40 40 PHE CD2 C 13 132.654 0.300 . 1 . . . . 40 PHE CD2 . 11338 1 413 . 1 1 40 40 PHE CE1 C 13 129.559 0.300 . 1 . . . . 40 PHE CE1 . 11338 1 414 . 1 1 40 40 PHE CE2 C 13 129.559 0.300 . 1 . . . . 40 PHE CE2 . 11338 1 415 . 1 1 40 40 PHE N N 15 122.739 0.300 . 1 . . . . 40 PHE N . 11338 1 416 . 1 1 41 41 THR H H 1 9.124 0.030 . 1 . . . . 41 THR H . 11338 1 417 . 1 1 41 41 THR HA H 1 5.818 0.030 . 1 . . . . 41 THR HA . 11338 1 418 . 1 1 41 41 THR HB H 1 3.760 0.030 . 1 . . . . 41 THR HB . 11338 1 419 . 1 1 41 41 THR HG21 H 1 0.337 0.030 . 1 . . . . 41 THR HG2 . 11338 1 420 . 1 1 41 41 THR HG22 H 1 0.337 0.030 . 1 . . . . 41 THR HG2 . 11338 1 421 . 1 1 41 41 THR HG23 H 1 0.337 0.030 . 1 . . . . 41 THR HG2 . 11338 1 422 . 1 1 41 41 THR C C 13 174.223 0.300 . 1 . . . . 41 THR C . 11338 1 423 . 1 1 41 41 THR CA C 13 58.211 0.300 . 1 . . . . 41 THR CA . 11338 1 424 . 1 1 41 41 THR CB C 13 71.002 0.300 . 1 . . . . 41 THR CB . 11338 1 425 . 1 1 41 41 THR CG2 C 13 20.135 0.300 . 1 . . . . 41 THR CG2 . 11338 1 426 . 1 1 41 41 THR N N 15 108.506 0.300 . 1 . . . . 41 THR N . 11338 1 427 . 1 1 42 42 ILE H H 1 8.427 0.030 . 1 . . . . 42 ILE H . 11338 1 428 . 1 1 42 42 ILE HA H 1 4.615 0.030 . 1 . . . . 42 ILE HA . 11338 1 429 . 1 1 42 42 ILE HB H 1 1.478 0.030 . 1 . . . . 42 ILE HB . 11338 1 430 . 1 1 42 42 ILE HD11 H 1 0.967 0.030 . 1 . . . . 42 ILE HD1 . 11338 1 431 . 1 1 42 42 ILE HD12 H 1 0.967 0.030 . 1 . . . . 42 ILE HD1 . 11338 1 432 . 1 1 42 42 ILE HD13 H 1 0.967 0.030 . 1 . . . . 42 ILE HD1 . 11338 1 433 . 1 1 42 42 ILE HG12 H 1 1.966 0.030 . 2 . . . . 42 ILE HG12 . 11338 1 434 . 1 1 42 42 ILE HG13 H 1 1.230 0.030 . 2 . . . . 42 ILE HG13 . 11338 1 435 . 1 1 42 42 ILE HG21 H 1 0.423 0.030 . 1 . . . . 42 ILE HG2 . 11338 1 436 . 1 1 42 42 ILE HG22 H 1 0.423 0.030 . 1 . . . . 42 ILE HG2 . 11338 1 437 . 1 1 42 42 ILE HG23 H 1 0.423 0.030 . 1 . . . . 42 ILE HG2 . 11338 1 438 . 1 1 42 42 ILE C C 13 175.284 0.300 . 1 . . . . 42 ILE C . 11338 1 439 . 1 1 42 42 ILE CA C 13 61.005 0.300 . 1 . . . . 42 ILE CA . 11338 1 440 . 1 1 42 42 ILE CB C 13 44.110 0.300 . 1 . . . . 42 ILE CB . 11338 1 441 . 1 1 42 42 ILE CD1 C 13 15.904 0.300 . 1 . . . . 42 ILE CD1 . 11338 1 442 . 1 1 42 42 ILE CG1 C 13 29.917 0.300 . 1 . . . . 42 ILE CG1 . 11338 1 443 . 1 1 42 42 ILE CG2 C 13 17.029 0.300 . 1 . . . . 42 ILE CG2 . 11338 1 444 . 1 1 42 42 ILE N N 15 117.846 0.300 . 1 . . . . 42 ILE N . 11338 1 445 . 1 1 43 43 THR H H 1 8.435 0.030 . 1 . . . . 43 THR H . 11338 1 446 . 1 1 43 43 THR HA H 1 4.871 0.030 . 1 . . . . 43 THR HA . 11338 1 447 . 1 1 43 43 THR HB H 1 3.845 0.030 . 1 . . . . 43 THR HB . 11338 1 448 . 1 1 43 43 THR HG21 H 1 1.026 0.030 . 1 . . . . 43 THR HG2 . 11338 1 449 . 1 1 43 43 THR HG22 H 1 1.026 0.030 . 1 . . . . 43 THR HG2 . 11338 1 450 . 1 1 43 43 THR HG23 H 1 1.026 0.030 . 1 . . . . 43 THR HG2 . 11338 1 451 . 1 1 43 43 THR C C 13 172.827 0.300 . 1 . . . . 43 THR C . 11338 1 452 . 1 1 43 43 THR CA C 13 62.988 0.300 . 1 . . . . 43 THR CA . 11338 1 453 . 1 1 43 43 THR CB C 13 69.985 0.300 . 1 . . . . 43 THR CB . 11338 1 454 . 1 1 43 43 THR CG2 C 13 21.868 0.300 . 1 . . . . 43 THR CG2 . 11338 1 455 . 1 1 43 43 THR N N 15 124.430 0.300 . 1 . . . . 43 THR N . 11338 1 456 . 1 1 44 44 VAL H H 1 9.176 0.030 . 1 . . . . 44 VAL H . 11338 1 457 . 1 1 44 44 VAL HA H 1 4.345 0.030 . 1 . . . . 44 VAL HA . 11338 1 458 . 1 1 44 44 VAL HB H 1 1.961 0.030 . 1 . . . . 44 VAL HB . 11338 1 459 . 1 1 44 44 VAL HG11 H 1 0.854 0.030 . 1 . . . . 44 VAL HG1 . 11338 1 460 . 1 1 44 44 VAL HG12 H 1 0.854 0.030 . 1 . . . . 44 VAL HG1 . 11338 1 461 . 1 1 44 44 VAL HG13 H 1 0.854 0.030 . 1 . . . . 44 VAL HG1 . 11338 1 462 . 1 1 44 44 VAL HG21 H 1 0.857 0.030 . 1 . . . . 44 VAL HG2 . 11338 1 463 . 1 1 44 44 VAL HG22 H 1 0.857 0.030 . 1 . . . . 44 VAL HG2 . 11338 1 464 . 1 1 44 44 VAL HG23 H 1 0.857 0.030 . 1 . . . . 44 VAL HG2 . 11338 1 465 . 1 1 44 44 VAL C C 13 173.260 0.300 . 1 . . . . 44 VAL C . 11338 1 466 . 1 1 44 44 VAL CA C 13 60.908 0.300 . 1 . . . . 44 VAL CA . 11338 1 467 . 1 1 44 44 VAL CB C 13 33.510 0.300 . 1 . . . . 44 VAL CB . 11338 1 468 . 1 1 44 44 VAL CG1 C 13 22.033 0.300 . 2 . . . . 44 VAL CG1 . 11338 1 469 . 1 1 44 44 VAL CG2 C 13 21.527 0.300 . 2 . . . . 44 VAL CG2 . 11338 1 470 . 1 1 44 44 VAL N N 15 129.164 0.300 . 1 . . . . 44 VAL N . 11338 1 471 . 1 1 45 45 THR H H 1 9.109 0.030 . 1 . . . . 45 THR H . 11338 1 472 . 1 1 45 45 THR HA H 1 4.984 0.030 . 1 . . . . 45 THR HA . 11338 1 473 . 1 1 45 45 THR HB H 1 3.883 0.030 . 1 . . . . 45 THR HB . 11338 1 474 . 1 1 45 45 THR HG21 H 1 1.440 0.030 . 1 . . . . 45 THR HG2 . 11338 1 475 . 1 1 45 45 THR HG22 H 1 1.440 0.030 . 1 . . . . 45 THR HG2 . 11338 1 476 . 1 1 45 45 THR HG23 H 1 1.440 0.030 . 1 . . . . 45 THR HG2 . 11338 1 477 . 1 1 45 45 THR C C 13 175.077 0.300 . 1 . . . . 45 THR C . 11338 1 478 . 1 1 45 45 THR CA C 13 61.248 0.300 . 1 . . . . 45 THR CA . 11338 1 479 . 1 1 45 45 THR CB C 13 70.870 0.300 . 1 . . . . 45 THR CB . 11338 1 480 . 1 1 45 45 THR CG2 C 13 21.177 0.300 . 1 . . . . 45 THR CG2 . 11338 1 481 . 1 1 45 45 THR N N 15 122.308 0.300 . 1 . . . . 45 THR N . 11338 1 482 . 1 1 46 46 SER H H 1 9.074 0.030 . 1 . . . . 46 SER H . 11338 1 483 . 1 1 46 46 SER HA H 1 4.266 0.030 . 1 . . . . 46 SER HA . 11338 1 484 . 1 1 46 46 SER HB2 H 1 4.211 0.030 . 2 . . . . 46 SER HB2 . 11338 1 485 . 1 1 46 46 SER HB3 H 1 3.758 0.030 . 2 . . . . 46 SER HB3 . 11338 1 486 . 1 1 46 46 SER C C 13 174.190 0.300 . 1 . . . . 46 SER C . 11338 1 487 . 1 1 46 46 SER CA C 13 59.249 0.300 . 1 . . . . 46 SER CA . 11338 1 488 . 1 1 46 46 SER CB C 13 65.746 0.300 . 1 . . . . 46 SER CB . 11338 1 489 . 1 1 46 46 SER N N 15 121.804 0.300 . 1 . . . . 46 SER N . 11338 1 490 . 1 1 47 47 GLU H H 1 8.420 0.030 . 1 . . . . 47 GLU H . 11338 1 491 . 1 1 47 47 GLU HA H 1 4.299 0.030 . 1 . . . . 47 GLU HA . 11338 1 492 . 1 1 47 47 GLU HB2 H 1 2.072 0.030 . 2 . . . . 47 GLU HB2 . 11338 1 493 . 1 1 47 47 GLU HB3 H 1 1.854 0.030 . 2 . . . . 47 GLU HB3 . 11338 1 494 . 1 1 47 47 GLU HG2 H 1 2.365 0.030 . 2 . . . . 47 GLU HG2 . 11338 1 495 . 1 1 47 47 GLU HG3 H 1 2.312 0.030 . 2 . . . . 47 GLU HG3 . 11338 1 496 . 1 1 47 47 GLU C C 13 176.058 0.300 . 1 . . . . 47 GLU C . 11338 1 497 . 1 1 47 47 GLU CA C 13 56.483 0.300 . 1 . . . . 47 GLU CA . 11338 1 498 . 1 1 47 47 GLU CB C 13 30.526 0.300 . 1 . . . . 47 GLU CB . 11338 1 499 . 1 1 47 47 GLU CG C 13 36.118 0.300 . 1 . . . . 47 GLU CG . 11338 1 500 . 1 1 47 47 GLU N N 15 119.508 0.300 . 1 . . . . 47 GLU N . 11338 1 501 . 1 1 48 48 ALA H H 1 8.441 0.030 . 1 . . . . 48 ALA H . 11338 1 502 . 1 1 48 48 ALA HA H 1 4.442 0.030 . 1 . . . . 48 ALA HA . 11338 1 503 . 1 1 48 48 ALA HB1 H 1 1.355 0.030 . 1 . . . . 48 ALA HB . 11338 1 504 . 1 1 48 48 ALA HB2 H 1 1.355 0.030 . 1 . . . . 48 ALA HB . 11338 1 505 . 1 1 48 48 ALA HB3 H 1 1.355 0.030 . 1 . . . . 48 ALA HB . 11338 1 506 . 1 1 48 48 ALA C C 13 179.003 0.300 . 1 . . . . 48 ALA C . 11338 1 507 . 1 1 48 48 ALA CA C 13 52.303 0.300 . 1 . . . . 48 ALA CA . 11338 1 508 . 1 1 48 48 ALA CB C 13 19.765 0.300 . 1 . . . . 48 ALA CB . 11338 1 509 . 1 1 48 48 ALA N N 15 125.180 0.300 . 1 . . . . 48 ALA N . 11338 1 510 . 1 1 49 49 GLY H H 1 8.936 0.030 . 1 . . . . 49 GLY H . 11338 1 511 . 1 1 49 49 GLY HA2 H 1 4.290 0.030 . 2 . . . . 49 GLY HA2 . 11338 1 512 . 1 1 49 49 GLY HA3 H 1 3.804 0.030 . 2 . . . . 49 GLY HA3 . 11338 1 513 . 1 1 49 49 GLY C C 13 174.993 0.300 . 1 . . . . 49 GLY C . 11338 1 514 . 1 1 49 49 GLY CA C 13 44.269 0.300 . 1 . . . . 49 GLY CA . 11338 1 515 . 1 1 49 49 GLY N N 15 109.765 0.300 . 1 . . . . 49 GLY N . 11338 1 516 . 1 1 50 50 GLU H H 1 8.793 0.030 . 1 . . . . 50 GLU H . 11338 1 517 . 1 1 50 50 GLU HA H 1 4.131 0.030 . 1 . . . . 50 GLU HA . 11338 1 518 . 1 1 50 50 GLU HB2 H 1 2.011 0.030 . 1 . . . . 50 GLU HB2 . 11338 1 519 . 1 1 50 50 GLU HB3 H 1 2.011 0.030 . 1 . . . . 50 GLU HB3 . 11338 1 520 . 1 1 50 50 GLU HG2 H 1 2.424 0.030 . 2 . . . . 50 GLU HG2 . 11338 1 521 . 1 1 50 50 GLU HG3 H 1 2.297 0.030 . 2 . . . . 50 GLU HG3 . 11338 1 522 . 1 1 50 50 GLU C C 13 177.318 0.300 . 1 . . . . 50 GLU C . 11338 1 523 . 1 1 50 50 GLU CA C 13 58.141 0.300 . 1 . . . . 50 GLU CA . 11338 1 524 . 1 1 50 50 GLU CB C 13 29.939 0.300 . 1 . . . . 50 GLU CB . 11338 1 525 . 1 1 50 50 GLU CG C 13 36.271 0.300 . 1 . . . . 50 GLU CG . 11338 1 526 . 1 1 50 50 GLU N N 15 121.870 0.300 . 1 . . . . 50 GLU N . 11338 1 527 . 1 1 51 51 ASN H H 1 9.008 0.030 . 1 . . . . 51 ASN H . 11338 1 528 . 1 1 51 51 ASN HA H 1 4.707 0.030 . 1 . . . . 51 ASN HA . 11338 1 529 . 1 1 51 51 ASN HB2 H 1 2.939 0.030 . 2 . . . . 51 ASN HB2 . 11338 1 530 . 1 1 51 51 ASN HB3 H 1 2.796 0.030 . 2 . . . . 51 ASN HB3 . 11338 1 531 . 1 1 51 51 ASN HD21 H 1 7.815 0.030 . 2 . . . . 51 ASN HD21 . 11338 1 532 . 1 1 51 51 ASN HD22 H 1 6.961 0.030 . 2 . . . . 51 ASN HD22 . 11338 1 533 . 1 1 51 51 ASN C C 13 174.543 0.300 . 1 . . . . 51 ASN C . 11338 1 534 . 1 1 51 51 ASN CA C 13 53.346 0.300 . 1 . . . . 51 ASN CA . 11338 1 535 . 1 1 51 51 ASN CB C 13 38.384 0.300 . 1 . . . . 51 ASN CB . 11338 1 536 . 1 1 51 51 ASN N N 15 118.278 0.300 . 1 . . . . 51 ASN N . 11338 1 537 . 1 1 51 51 ASN ND2 N 15 114.433 0.300 . 1 . . . . 51 ASN ND2 . 11338 1 538 . 1 1 52 52 ASP H H 1 8.063 0.030 . 1 . . . . 52 ASP H . 11338 1 539 . 1 1 52 52 ASP HA H 1 4.341 0.030 . 1 . . . . 52 ASP HA . 11338 1 540 . 1 1 52 52 ASP HB2 H 1 2.881 0.030 . 2 . . . . 52 ASP HB2 . 11338 1 541 . 1 1 52 52 ASP HB3 H 1 2.777 0.030 . 2 . . . . 52 ASP HB3 . 11338 1 542 . 1 1 52 52 ASP C C 13 175.130 0.300 . 1 . . . . 52 ASP C . 11338 1 543 . 1 1 52 52 ASP CA C 13 55.855 0.300 . 1 . . . . 52 ASP CA . 11338 1 544 . 1 1 52 52 ASP CB C 13 40.031 0.300 . 1 . . . . 52 ASP CB . 11338 1 545 . 1 1 52 52 ASP N N 15 114.768 0.300 . 1 . . . . 52 ASP N . 11338 1 546 . 1 1 53 53 GLU H H 1 8.579 0.030 . 1 . . . . 53 GLU H . 11338 1 547 . 1 1 53 53 GLU HA H 1 4.337 0.030 . 1 . . . . 53 GLU HA . 11338 1 548 . 1 1 53 53 GLU HB2 H 1 1.962 0.030 . 2 . . . . 53 GLU HB2 . 11338 1 549 . 1 1 53 53 GLU HB3 H 1 1.919 0.030 . 2 . . . . 53 GLU HB3 . 11338 1 550 . 1 1 53 53 GLU HG2 H 1 2.273 0.030 . 1 . . . . 53 GLU HG2 . 11338 1 551 . 1 1 53 53 GLU HG3 H 1 2.273 0.030 . 1 . . . . 53 GLU HG3 . 11338 1 552 . 1 1 53 53 GLU C C 13 175.685 0.300 . 1 . . . . 53 GLU C . 11338 1 553 . 1 1 53 53 GLU CA C 13 56.763 0.300 . 1 . . . . 53 GLU CA . 11338 1 554 . 1 1 53 53 GLU CB C 13 30.275 0.300 . 1 . . . . 53 GLU CB . 11338 1 555 . 1 1 53 53 GLU CG C 13 36.201 0.300 . 1 . . . . 53 GLU CG . 11338 1 556 . 1 1 53 53 GLU N N 15 120.856 0.300 . 1 . . . . 53 GLU N . 11338 1 557 . 1 1 54 54 THR H H 1 8.093 0.030 . 1 . . . . 54 THR H . 11338 1 558 . 1 1 54 54 THR HA H 1 4.484 0.030 . 1 . . . . 54 THR HA . 11338 1 559 . 1 1 54 54 THR HB H 1 4.086 0.030 . 1 . . . . 54 THR HB . 11338 1 560 . 1 1 54 54 THR HG21 H 1 1.039 0.030 . 1 . . . . 54 THR HG2 . 11338 1 561 . 1 1 54 54 THR HG22 H 1 1.039 0.030 . 1 . . . . 54 THR HG2 . 11338 1 562 . 1 1 54 54 THR HG23 H 1 1.039 0.030 . 1 . . . . 54 THR HG2 . 11338 1 563 . 1 1 54 54 THR C C 13 174.105 0.300 . 1 . . . . 54 THR C . 11338 1 564 . 1 1 54 54 THR CA C 13 60.555 0.300 . 1 . . . . 54 THR CA . 11338 1 565 . 1 1 54 54 THR CB C 13 72.496 0.300 . 1 . . . . 54 THR CB . 11338 1 566 . 1 1 54 54 THR CG2 C 13 21.874 0.300 . 1 . . . . 54 THR CG2 . 11338 1 567 . 1 1 54 54 THR N N 15 111.522 0.300 . 1 . . . . 54 THR N . 11338 1 568 . 1 1 55 55 VAL H H 1 8.352 0.030 . 1 . . . . 55 VAL H . 11338 1 569 . 1 1 55 55 VAL HA H 1 4.758 0.030 . 1 . . . . 55 VAL HA . 11338 1 570 . 1 1 55 55 VAL HB H 1 2.106 0.030 . 1 . . . . 55 VAL HB . 11338 1 571 . 1 1 55 55 VAL HG11 H 1 0.944 0.030 . 1 . . . . 55 VAL HG1 . 11338 1 572 . 1 1 55 55 VAL HG12 H 1 0.944 0.030 . 1 . . . . 55 VAL HG1 . 11338 1 573 . 1 1 55 55 VAL HG13 H 1 0.944 0.030 . 1 . . . . 55 VAL HG1 . 11338 1 574 . 1 1 55 55 VAL HG21 H 1 0.922 0.030 . 1 . . . . 55 VAL HG2 . 11338 1 575 . 1 1 55 55 VAL HG22 H 1 0.922 0.030 . 1 . . . . 55 VAL HG2 . 11338 1 576 . 1 1 55 55 VAL HG23 H 1 0.922 0.030 . 1 . . . . 55 VAL HG2 . 11338 1 577 . 1 1 55 55 VAL C C 13 174.387 0.300 . 1 . . . . 55 VAL C . 11338 1 578 . 1 1 55 55 VAL CA C 13 59.868 0.300 . 1 . . . . 55 VAL CA . 11338 1 579 . 1 1 55 55 VAL CB C 13 34.009 0.300 . 1 . . . . 55 VAL CB . 11338 1 580 . 1 1 55 55 VAL CG1 C 13 22.243 0.300 . 2 . . . . 55 VAL CG1 . 11338 1 581 . 1 1 55 55 VAL CG2 C 13 21.506 0.300 . 2 . . . . 55 VAL CG2 . 11338 1 582 . 1 1 55 55 VAL N N 15 115.338 0.300 . 1 . . . . 55 VAL N . 11338 1 583 . 1 1 56 56 GLN H H 1 8.383 0.030 . 1 . . . . 56 GLN H . 11338 1 584 . 1 1 56 56 GLN HA H 1 5.475 0.030 . 1 . . . . 56 GLN HA . 11338 1 585 . 1 1 56 56 GLN HB2 H 1 2.022 0.030 . 2 . . . . 56 GLN HB2 . 11338 1 586 . 1 1 56 56 GLN HB3 H 1 1.904 0.030 . 2 . . . . 56 GLN HB3 . 11338 1 587 . 1 1 56 56 GLN HE21 H 1 7.666 0.030 . 2 . . . . 56 GLN HE21 . 11338 1 588 . 1 1 56 56 GLN HE22 H 1 6.683 0.030 . 2 . . . . 56 GLN HE22 . 11338 1 589 . 1 1 56 56 GLN HG2 H 1 2.334 0.030 . 2 . . . . 56 GLN HG2 . 11338 1 590 . 1 1 56 56 GLN HG3 H 1 2.012 0.030 . 2 . . . . 56 GLN HG3 . 11338 1 591 . 1 1 56 56 GLN C C 13 174.498 0.300 . 1 . . . . 56 GLN C . 11338 1 592 . 1 1 56 56 GLN CA C 13 54.750 0.300 . 1 . . . . 56 GLN CA . 11338 1 593 . 1 1 56 56 GLN CB C 13 35.344 0.300 . 1 . . . . 56 GLN CB . 11338 1 594 . 1 1 56 56 GLN CG C 13 34.518 0.300 . 1 . . . . 56 GLN CG . 11338 1 595 . 1 1 56 56 GLN N N 15 119.788 0.300 . 1 . . . . 56 GLN N . 11338 1 596 . 1 1 56 56 GLN NE2 N 15 112.754 0.300 . 1 . . . . 56 GLN NE2 . 11338 1 597 . 1 1 57 57 THR H H 1 8.992 0.030 . 1 . . . . 57 THR H . 11338 1 598 . 1 1 57 57 THR HA H 1 4.922 0.030 . 1 . . . . 57 THR HA . 11338 1 599 . 1 1 57 57 THR HB H 1 3.924 0.030 . 1 . . . . 57 THR HB . 11338 1 600 . 1 1 57 57 THR HG21 H 1 1.041 0.030 . 1 . . . . 57 THR HG2 . 11338 1 601 . 1 1 57 57 THR HG22 H 1 1.041 0.030 . 1 . . . . 57 THR HG2 . 11338 1 602 . 1 1 57 57 THR HG23 H 1 1.041 0.030 . 1 . . . . 57 THR HG2 . 11338 1 603 . 1 1 57 57 THR C C 13 172.942 0.300 . 1 . . . . 57 THR C . 11338 1 604 . 1 1 57 57 THR CA C 13 60.511 0.300 . 1 . . . . 57 THR CA . 11338 1 605 . 1 1 57 57 THR CB C 13 71.479 0.300 . 1 . . . . 57 THR CB . 11338 1 606 . 1 1 57 57 THR CG2 C 13 21.006 0.300 . 1 . . . . 57 THR CG2 . 11338 1 607 . 1 1 57 57 THR N N 15 113.834 0.300 . 1 . . . . 57 THR N . 11338 1 608 . 1 1 58 58 THR H H 1 8.960 0.030 . 1 . . . . 58 THR H . 11338 1 609 . 1 1 58 58 THR HA H 1 4.970 0.030 . 1 . . . . 58 THR HA . 11338 1 610 . 1 1 58 58 THR HB H 1 4.266 0.030 . 1 . . . . 58 THR HB . 11338 1 611 . 1 1 58 58 THR HG21 H 1 1.073 0.030 . 1 . . . . 58 THR HG2 . 11338 1 612 . 1 1 58 58 THR HG22 H 1 1.073 0.030 . 1 . . . . 58 THR HG2 . 11338 1 613 . 1 1 58 58 THR HG23 H 1 1.073 0.030 . 1 . . . . 58 THR HG2 . 11338 1 614 . 1 1 58 58 THR C C 13 173.207 0.300 . 1 . . . . 58 THR C . 11338 1 615 . 1 1 58 58 THR CA C 13 62.670 0.300 . 1 . . . . 58 THR CA . 11338 1 616 . 1 1 58 58 THR CB C 13 68.735 0.300 . 1 . . . . 58 THR CB . 11338 1 617 . 1 1 58 58 THR CG2 C 13 21.700 0.300 . 1 . . . . 58 THR CG2 . 11338 1 618 . 1 1 58 58 THR N N 15 124.985 0.300 . 1 . . . . 58 THR N . 11338 1 619 . 1 1 59 59 LEU H H 1 8.940 0.030 . 1 . . . . 59 LEU H . 11338 1 620 . 1 1 59 59 LEU HA H 1 4.612 0.030 . 1 . . . . 59 LEU HA . 11338 1 621 . 1 1 59 59 LEU HB2 H 1 1.701 0.030 . 2 . . . . 59 LEU HB2 . 11338 1 622 . 1 1 59 59 LEU HB3 H 1 0.636 0.030 . 2 . . . . 59 LEU HB3 . 11338 1 623 . 1 1 59 59 LEU HD11 H 1 0.911 0.030 . 1 . . . . 59 LEU HD1 . 11338 1 624 . 1 1 59 59 LEU HD12 H 1 0.911 0.030 . 1 . . . . 59 LEU HD1 . 11338 1 625 . 1 1 59 59 LEU HD13 H 1 0.911 0.030 . 1 . . . . 59 LEU HD1 . 11338 1 626 . 1 1 59 59 LEU HD21 H 1 0.664 0.030 . 1 . . . . 59 LEU HD2 . 11338 1 627 . 1 1 59 59 LEU HD22 H 1 0.664 0.030 . 1 . . . . 59 LEU HD2 . 11338 1 628 . 1 1 59 59 LEU HD23 H 1 0.664 0.030 . 1 . . . . 59 LEU HD2 . 11338 1 629 . 1 1 59 59 LEU HG H 1 1.677 0.030 . 1 . . . . 59 LEU HG . 11338 1 630 . 1 1 59 59 LEU C C 13 174.431 0.300 . 1 . . . . 59 LEU C . 11338 1 631 . 1 1 59 59 LEU CA C 13 53.253 0.300 . 1 . . . . 59 LEU CA . 11338 1 632 . 1 1 59 59 LEU CB C 13 44.192 0.300 . 1 . . . . 59 LEU CB . 11338 1 633 . 1 1 59 59 LEU CD1 C 13 26.625 0.300 . 2 . . . . 59 LEU CD1 . 11338 1 634 . 1 1 59 59 LEU CD2 C 13 23.760 0.300 . 2 . . . . 59 LEU CD2 . 11338 1 635 . 1 1 59 59 LEU CG C 13 27.253 0.300 . 1 . . . . 59 LEU CG . 11338 1 636 . 1 1 59 59 LEU N N 15 129.021 0.300 . 1 . . . . 59 LEU N . 11338 1 637 . 1 1 60 60 LYS H H 1 8.490 0.030 . 1 . . . . 60 LYS H . 11338 1 638 . 1 1 60 60 LYS HA H 1 4.777 0.030 . 1 . . . . 60 LYS HA . 11338 1 639 . 1 1 60 60 LYS HB2 H 1 1.467 0.030 . 2 . . . . 60 LYS HB2 . 11338 1 640 . 1 1 60 60 LYS HB3 H 1 1.044 0.030 . 2 . . . . 60 LYS HB3 . 11338 1 641 . 1 1 60 60 LYS HD2 H 1 1.193 0.030 . 1 . . . . 60 LYS HD2 . 11338 1 642 . 1 1 60 60 LYS HD3 H 1 1.193 0.030 . 1 . . . . 60 LYS HD3 . 11338 1 643 . 1 1 60 60 LYS HE2 H 1 2.481 0.030 . 2 . . . . 60 LYS HE2 . 11338 1 644 . 1 1 60 60 LYS HE3 H 1 2.434 0.030 . 2 . . . . 60 LYS HE3 . 11338 1 645 . 1 1 60 60 LYS HG2 H 1 0.803 0.030 . 2 . . . . 60 LYS HG2 . 11338 1 646 . 1 1 60 60 LYS HG3 H 1 0.746 0.030 . 2 . . . . 60 LYS HG3 . 11338 1 647 . 1 1 60 60 LYS C C 13 174.592 0.300 . 1 . . . . 60 LYS C . 11338 1 648 . 1 1 60 60 LYS CA C 13 53.981 0.300 . 1 . . . . 60 LYS CA . 11338 1 649 . 1 1 60 60 LYS CB C 13 35.816 0.300 . 1 . . . . 60 LYS CB . 11338 1 650 . 1 1 60 60 LYS CD C 13 29.768 0.300 . 1 . . . . 60 LYS CD . 11338 1 651 . 1 1 60 60 LYS CE C 13 41.770 0.300 . 1 . . . . 60 LYS CE . 11338 1 652 . 1 1 60 60 LYS CG C 13 24.502 0.300 . 1 . . . . 60 LYS CG . 11338 1 653 . 1 1 60 60 LYS N N 15 121.729 0.300 . 1 . . . . 60 LYS N . 11338 1 654 . 1 1 61 61 PHE H H 1 8.719 0.030 . 1 . . . . 61 PHE H . 11338 1 655 . 1 1 61 61 PHE HA H 1 5.331 0.030 . 1 . . . . 61 PHE HA . 11338 1 656 . 1 1 61 61 PHE HB2 H 1 2.084 0.030 . 2 . . . . 61 PHE HB2 . 11338 1 657 . 1 1 61 61 PHE HB3 H 1 1.330 0.030 . 2 . . . . 61 PHE HB3 . 11338 1 658 . 1 1 61 61 PHE HD1 H 1 6.944 0.030 . 1 . . . . 61 PHE HD1 . 11338 1 659 . 1 1 61 61 PHE HD2 H 1 6.944 0.030 . 1 . . . . 61 PHE HD2 . 11338 1 660 . 1 1 61 61 PHE HE1 H 1 6.954 0.030 . 1 . . . . 61 PHE HE1 . 11338 1 661 . 1 1 61 61 PHE HE2 H 1 6.954 0.030 . 1 . . . . 61 PHE HE2 . 11338 1 662 . 1 1 61 61 PHE HZ H 1 6.817 0.030 . 1 . . . . 61 PHE HZ . 11338 1 663 . 1 1 61 61 PHE C C 13 174.592 0.300 . 1 . . . . 61 PHE C . 11338 1 664 . 1 1 61 61 PHE CA C 13 55.876 0.300 . 1 . . . . 61 PHE CA . 11338 1 665 . 1 1 61 61 PHE CB C 13 43.204 0.300 . 1 . . . . 61 PHE CB . 11338 1 666 . 1 1 61 61 PHE CD1 C 13 132.475 0.300 . 1 . . . . 61 PHE CD1 . 11338 1 667 . 1 1 61 61 PHE CD2 C 13 132.475 0.300 . 1 . . . . 61 PHE CD2 . 11338 1 668 . 1 1 61 61 PHE CE1 C 13 130.476 0.300 . 1 . . . . 61 PHE CE1 . 11338 1 669 . 1 1 61 61 PHE CE2 C 13 130.476 0.300 . 1 . . . . 61 PHE CE2 . 11338 1 670 . 1 1 61 61 PHE CZ C 13 127.987 0.300 . 1 . . . . 61 PHE CZ . 11338 1 671 . 1 1 61 61 PHE N N 15 125.636 0.300 . 1 . . . . 61 PHE N . 11338 1 672 . 1 1 62 62 THR H H 1 8.393 0.030 . 1 . . . . 62 THR H . 11338 1 673 . 1 1 62 62 THR HA H 1 4.906 0.030 . 1 . . . . 62 THR HA . 11338 1 674 . 1 1 62 62 THR HB H 1 3.767 0.030 . 1 . . . . 62 THR HB . 11338 1 675 . 1 1 62 62 THR HG21 H 1 1.050 0.030 . 1 . . . . 62 THR HG2 . 11338 1 676 . 1 1 62 62 THR HG22 H 1 1.050 0.030 . 1 . . . . 62 THR HG2 . 11338 1 677 . 1 1 62 62 THR HG23 H 1 1.050 0.030 . 1 . . . . 62 THR HG2 . 11338 1 678 . 1 1 62 62 THR C C 13 174.666 0.300 . 1 . . . . 62 THR C . 11338 1 679 . 1 1 62 62 THR CA C 13 60.961 0.300 . 1 . . . . 62 THR CA . 11338 1 680 . 1 1 62 62 THR CB C 13 71.746 0.300 . 1 . . . . 62 THR CB . 11338 1 681 . 1 1 62 62 THR CG2 C 13 20.273 0.300 . 1 . . . . 62 THR CG2 . 11338 1 682 . 1 1 62 62 THR N N 15 115.186 0.300 . 1 . . . . 62 THR N . 11338 1 683 . 1 1 63 63 TYR H H 1 8.258 0.030 . 1 . . . . 63 TYR H . 11338 1 684 . 1 1 63 63 TYR HA H 1 4.582 0.030 . 1 . . . . 63 TYR HA . 11338 1 685 . 1 1 63 63 TYR HB2 H 1 3.151 0.030 . 2 . . . . 63 TYR HB2 . 11338 1 686 . 1 1 63 63 TYR HB3 H 1 2.825 0.030 . 2 . . . . 63 TYR HB3 . 11338 1 687 . 1 1 63 63 TYR HD1 H 1 6.481 0.030 . 1 . . . . 63 TYR HD1 . 11338 1 688 . 1 1 63 63 TYR HD2 H 1 6.481 0.030 . 1 . . . . 63 TYR HD2 . 11338 1 689 . 1 1 63 63 TYR HE1 H 1 6.571 0.030 . 1 . . . . 63 TYR HE1 . 11338 1 690 . 1 1 63 63 TYR HE2 H 1 6.571 0.030 . 1 . . . . 63 TYR HE2 . 11338 1 691 . 1 1 63 63 TYR C C 13 176.043 0.300 . 1 . . . . 63 TYR C . 11338 1 692 . 1 1 63 63 TYR CA C 13 55.409 0.300 . 1 . . . . 63 TYR CA . 11338 1 693 . 1 1 63 63 TYR CB C 13 37.230 0.300 . 1 . . . . 63 TYR CB . 11338 1 694 . 1 1 63 63 TYR CD1 C 13 129.305 0.300 . 1 . . . . 63 TYR CD1 . 11338 1 695 . 1 1 63 63 TYR CD2 C 13 129.305 0.300 . 1 . . . . 63 TYR CD2 . 11338 1 696 . 1 1 63 63 TYR CE1 C 13 120.988 0.300 . 1 . . . . 63 TYR CE1 . 11338 1 697 . 1 1 63 63 TYR CE2 C 13 120.988 0.300 . 1 . . . . 63 TYR CE2 . 11338 1 698 . 1 1 63 63 TYR N N 15 124.311 0.300 . 1 . . . . 63 TYR N . 11338 1 699 . 1 1 64 64 SER H H 1 7.078 0.030 . 1 . . . . 64 SER H . 11338 1 700 . 1 1 64 64 SER HA H 1 4.600 0.030 . 1 . . . . 64 SER HA . 11338 1 701 . 1 1 64 64 SER HB2 H 1 4.218 0.030 . 2 . . . . 64 SER HB2 . 11338 1 702 . 1 1 64 64 SER HB3 H 1 3.913 0.030 . 2 . . . . 64 SER HB3 . 11338 1 703 . 1 1 64 64 SER C C 13 175.444 0.300 . 1 . . . . 64 SER C . 11338 1 704 . 1 1 64 64 SER CA C 13 55.885 0.300 . 1 . . . . 64 SER CA . 11338 1 705 . 1 1 64 64 SER CB C 13 64.487 0.300 . 1 . . . . 64 SER CB . 11338 1 706 . 1 1 64 64 SER N N 15 116.130 0.300 . 1 . . . . 64 SER N . 11338 1 707 . 1 1 65 65 GLU H H 1 8.894 0.030 . 1 . . . . 65 GLU H . 11338 1 708 . 1 1 65 65 GLU HA H 1 4.083 0.030 . 1 . . . . 65 GLU HA . 11338 1 709 . 1 1 65 65 GLU HB2 H 1 2.087 0.030 . 2 . . . . 65 GLU HB2 . 11338 1 710 . 1 1 65 65 GLU HB3 H 1 2.007 0.030 . 2 . . . . 65 GLU HB3 . 11338 1 711 . 1 1 65 65 GLU HG2 H 1 2.411 0.030 . 2 . . . . 65 GLU HG2 . 11338 1 712 . 1 1 65 65 GLU HG3 H 1 2.260 0.030 . 2 . . . . 65 GLU HG3 . 11338 1 713 . 1 1 65 65 GLU C C 13 177.638 0.300 . 1 . . . . 65 GLU C . 11338 1 714 . 1 1 65 65 GLU CA C 13 60.023 0.300 . 1 . . . . 65 GLU CA . 11338 1 715 . 1 1 65 65 GLU CB C 13 29.865 0.300 . 1 . . . . 65 GLU CB . 11338 1 716 . 1 1 65 65 GLU CG C 13 36.522 0.300 . 1 . . . . 65 GLU CG . 11338 1 717 . 1 1 65 65 GLU N N 15 121.468 0.300 . 1 . . . . 65 GLU N . 11338 1 718 . 1 1 66 66 LYS H H 1 7.930 0.030 . 1 . . . . 66 LYS H . 11338 1 719 . 1 1 66 66 LYS HA H 1 3.497 0.030 . 1 . . . . 66 LYS HA . 11338 1 720 . 1 1 66 66 LYS HB2 H 1 1.586 0.030 . 2 . . . . 66 LYS HB2 . 11338 1 721 . 1 1 66 66 LYS HB3 H 1 1.136 0.030 . 2 . . . . 66 LYS HB3 . 11338 1 722 . 1 1 66 66 LYS HD2 H 1 1.550 0.030 . 2 . . . . 66 LYS HD2 . 11338 1 723 . 1 1 66 66 LYS HD3 H 1 1.505 0.030 . 2 . . . . 66 LYS HD3 . 11338 1 724 . 1 1 66 66 LYS HE2 H 1 2.936 0.030 . 1 . . . . 66 LYS HE2 . 11338 1 725 . 1 1 66 66 LYS HE3 H 1 2.936 0.030 . 1 . . . . 66 LYS HE3 . 11338 1 726 . 1 1 66 66 LYS HG2 H 1 1.129 0.030 . 2 . . . . 66 LYS HG2 . 11338 1 727 . 1 1 66 66 LYS HG3 H 1 0.920 0.030 . 2 . . . . 66 LYS HG3 . 11338 1 728 . 1 1 66 66 LYS C C 13 175.358 0.300 . 1 . . . . 66 LYS C . 11338 1 729 . 1 1 66 66 LYS CA C 13 53.804 0.300 . 1 . . . . 66 LYS CA . 11338 1 730 . 1 1 66 66 LYS CB C 13 31.257 0.300 . 1 . . . . 66 LYS CB . 11338 1 731 . 1 1 66 66 LYS CD C 13 29.261 0.300 . 1 . . . . 66 LYS CD . 11338 1 732 . 1 1 66 66 LYS CE C 13 42.263 0.300 . 1 . . . . 66 LYS CE . 11338 1 733 . 1 1 66 66 LYS CG C 13 25.325 0.300 . 1 . . . . 66 LYS CG . 11338 1 734 . 1 1 66 66 LYS N N 15 112.483 0.300 . 1 . . . . 66 LYS N . 11338 1 735 . 1 1 67 67 TYR H H 1 7.023 0.030 . 1 . . . . 67 TYR H . 11338 1 736 . 1 1 67 67 TYR HA H 1 4.860 0.030 . 1 . . . . 67 TYR HA . 11338 1 737 . 1 1 67 67 TYR HB2 H 1 3.354 0.030 . 2 . . . . 67 TYR HB2 . 11338 1 738 . 1 1 67 67 TYR HB3 H 1 2.810 0.030 . 2 . . . . 67 TYR HB3 . 11338 1 739 . 1 1 67 67 TYR HD1 H 1 6.311 0.030 . 3 . . . . 67 TYR HD1 . 11338 1 740 . 1 1 67 67 TYR HD2 H 1 7.529 0.030 . 3 . . . . 67 TYR HD2 . 11338 1 741 . 1 1 67 67 TYR HE1 H 1 6.639 0.030 . 3 . . . . 67 TYR HE1 . 11338 1 742 . 1 1 67 67 TYR HE2 H 1 6.891 0.030 . 3 . . . . 67 TYR HE2 . 11338 1 743 . 1 1 67 67 TYR C C 13 175.993 0.300 . 1 . . . . 67 TYR C . 11338 1 744 . 1 1 67 67 TYR CA C 13 56.995 0.300 . 1 . . . . 67 TYR CA . 11338 1 745 . 1 1 67 67 TYR CB C 13 37.436 0.300 . 1 . . . . 67 TYR CB . 11338 1 746 . 1 1 67 67 TYR CD1 C 13 133.716 0.300 . 3 . . . . 67 TYR CD1 . 11338 1 747 . 1 1 67 67 TYR CD2 C 13 133.345 0.300 . 3 . . . . 67 TYR CD2 . 11338 1 748 . 1 1 67 67 TYR CE1 C 13 120.600 0.300 . 3 . . . . 67 TYR CE1 . 11338 1 749 . 1 1 67 67 TYR CE2 C 13 118.344 0.300 . 3 . . . . 67 TYR CE2 . 11338 1 750 . 1 1 67 67 TYR N N 15 123.584 0.300 . 1 . . . . 67 TYR N . 11338 1 751 . 1 1 68 68 PRO HA H 1 3.826 0.030 . 1 . . . . 68 PRO HA . 11338 1 752 . 1 1 68 68 PRO HB2 H 1 1.793 0.030 . 2 . . . . 68 PRO HB2 . 11338 1 753 . 1 1 68 68 PRO HB3 H 1 0.279 0.030 . 2 . . . . 68 PRO HB3 . 11338 1 754 . 1 1 68 68 PRO HD2 H 1 3.233 0.030 . 2 . . . . 68 PRO HD2 . 11338 1 755 . 1 1 68 68 PRO HD3 H 1 3.100 0.030 . 2 . . . . 68 PRO HD3 . 11338 1 756 . 1 1 68 68 PRO HG2 H 1 1.454 0.030 . 2 . . . . 68 PRO HG2 . 11338 1 757 . 1 1 68 68 PRO HG3 H 1 1.098 0.030 . 2 . . . . 68 PRO HG3 . 11338 1 758 . 1 1 68 68 PRO C C 13 175.348 0.300 . 1 . . . . 68 PRO C . 11338 1 759 . 1 1 68 68 PRO CA C 13 64.327 0.300 . 1 . . . . 68 PRO CA . 11338 1 760 . 1 1 68 68 PRO CB C 13 32.823 0.300 . 1 . . . . 68 PRO CB . 11338 1 761 . 1 1 68 68 PRO CD C 13 48.641 0.300 . 1 . . . . 68 PRO CD . 11338 1 762 . 1 1 68 68 PRO CG C 13 24.419 0.300 . 1 . . . . 68 PRO CG . 11338 1 763 . 1 1 69 69 ASP H H 1 9.049 0.030 . 1 . . . . 69 ASP H . 11338 1 764 . 1 1 69 69 ASP HA H 1 4.558 0.030 . 1 . . . . 69 ASP HA . 11338 1 765 . 1 1 69 69 ASP HB2 H 1 2.901 0.030 . 2 . . . . 69 ASP HB2 . 11338 1 766 . 1 1 69 69 ASP HB3 H 1 2.806 0.030 . 2 . . . . 69 ASP HB3 . 11338 1 767 . 1 1 69 69 ASP C C 13 175.575 0.300 . 1 . . . . 69 ASP C . 11338 1 768 . 1 1 69 69 ASP CA C 13 57.136 0.300 . 1 . . . . 69 ASP CA . 11338 1 769 . 1 1 69 69 ASP CB C 13 40.320 0.300 . 1 . . . . 69 ASP CB . 11338 1 770 . 1 1 69 69 ASP N N 15 126.597 0.300 . 1 . . . . 69 ASP N . 11338 1 771 . 1 1 70 70 GLU H H 1 6.963 0.030 . 1 . . . . 70 GLU H . 11338 1 772 . 1 1 70 70 GLU HA H 1 4.405 0.030 . 1 . . . . 70 GLU HA . 11338 1 773 . 1 1 70 70 GLU HB2 H 1 1.851 0.030 . 2 . . . . 70 GLU HB2 . 11338 1 774 . 1 1 70 70 GLU HB3 H 1 1.606 0.030 . 2 . . . . 70 GLU HB3 . 11338 1 775 . 1 1 70 70 GLU HG2 H 1 2.088 0.030 . 1 . . . . 70 GLU HG2 . 11338 1 776 . 1 1 70 70 GLU HG3 H 1 2.088 0.030 . 1 . . . . 70 GLU HG3 . 11338 1 777 . 1 1 70 70 GLU C C 13 174.015 0.300 . 1 . . . . 70 GLU C . 11338 1 778 . 1 1 70 70 GLU CA C 13 53.822 0.300 . 1 . . . . 70 GLU CA . 11338 1 779 . 1 1 70 70 GLU CB C 13 32.697 0.300 . 1 . . . . 70 GLU CB . 11338 1 780 . 1 1 70 70 GLU CG C 13 35.871 0.300 . 1 . . . . 70 GLU CG . 11338 1 781 . 1 1 70 70 GLU N N 15 116.890 0.300 . 1 . . . . 70 GLU N . 11338 1 782 . 1 1 71 71 ALA H H 1 8.602 0.030 . 1 . . . . 71 ALA H . 11338 1 783 . 1 1 71 71 ALA HA H 1 4.254 0.030 . 1 . . . . 71 ALA HA . 11338 1 784 . 1 1 71 71 ALA HB1 H 1 1.535 0.030 . 1 . . . . 71 ALA HB . 11338 1 785 . 1 1 71 71 ALA HB2 H 1 1.535 0.030 . 1 . . . . 71 ALA HB . 11338 1 786 . 1 1 71 71 ALA HB3 H 1 1.535 0.030 . 1 . . . . 71 ALA HB . 11338 1 787 . 1 1 71 71 ALA C C 13 176.916 0.300 . 1 . . . . 71 ALA C . 11338 1 788 . 1 1 71 71 ALA CA C 13 51.011 0.300 . 1 . . . . 71 ALA CA . 11338 1 789 . 1 1 71 71 ALA CB C 13 17.165 0.300 . 1 . . . . 71 ALA CB . 11338 1 790 . 1 1 71 71 ALA N N 15 121.905 0.300 . 1 . . . . 71 ALA N . 11338 1 791 . 1 1 72 72 PRO HA H 1 4.933 0.030 . 1 . . . . 72 PRO HA . 11338 1 792 . 1 1 72 72 PRO HB2 H 1 2.210 0.030 . 2 . . . . 72 PRO HB2 . 11338 1 793 . 1 1 72 72 PRO HB3 H 1 2.152 0.030 . 2 . . . . 72 PRO HB3 . 11338 1 794 . 1 1 72 72 PRO HD2 H 1 4.349 0.030 . 2 . . . . 72 PRO HD2 . 11338 1 795 . 1 1 72 72 PRO HD3 H 1 3.951 0.030 . 2 . . . . 72 PRO HD3 . 11338 1 796 . 1 1 72 72 PRO HG2 H 1 2.219 0.030 . 1 . . . . 72 PRO HG2 . 11338 1 797 . 1 1 72 72 PRO HG3 H 1 2.219 0.030 . 1 . . . . 72 PRO HG3 . 11338 1 798 . 1 1 72 72 PRO C C 13 174.790 0.300 . 1 . . . . 72 PRO C . 11338 1 799 . 1 1 72 72 PRO CA C 13 62.976 0.300 . 1 . . . . 72 PRO CA . 11338 1 800 . 1 1 72 72 PRO CB C 13 31.165 0.300 . 1 . . . . 72 PRO CB . 11338 1 801 . 1 1 72 72 PRO CD C 13 50.396 0.300 . 1 . . . . 72 PRO CD . 11338 1 802 . 1 1 72 72 PRO CG C 13 26.104 0.300 . 1 . . . . 72 PRO CG . 11338 1 803 . 1 1 73 73 LEU H H 1 8.675 0.030 . 1 . . . . 73 LEU H . 11338 1 804 . 1 1 73 73 LEU HA H 1 4.343 0.030 . 1 . . . . 73 LEU HA . 11338 1 805 . 1 1 73 73 LEU HB2 H 1 1.666 0.030 . 2 . . . . 73 LEU HB2 . 11338 1 806 . 1 1 73 73 LEU HB3 H 1 1.453 0.030 . 2 . . . . 73 LEU HB3 . 11338 1 807 . 1 1 73 73 LEU HD11 H 1 0.792 0.030 . 1 . . . . 73 LEU HD1 . 11338 1 808 . 1 1 73 73 LEU HD12 H 1 0.792 0.030 . 1 . . . . 73 LEU HD1 . 11338 1 809 . 1 1 73 73 LEU HD13 H 1 0.792 0.030 . 1 . . . . 73 LEU HD1 . 11338 1 810 . 1 1 73 73 LEU HD21 H 1 0.775 0.030 . 1 . . . . 73 LEU HD2 . 11338 1 811 . 1 1 73 73 LEU HD22 H 1 0.775 0.030 . 1 . . . . 73 LEU HD2 . 11338 1 812 . 1 1 73 73 LEU HD23 H 1 0.775 0.030 . 1 . . . . 73 LEU HD2 . 11338 1 813 . 1 1 73 73 LEU HG H 1 1.599 0.030 . 1 . . . . 73 LEU HG . 11338 1 814 . 1 1 73 73 LEU C C 13 176.784 0.300 . 1 . . . . 73 LEU C . 11338 1 815 . 1 1 73 73 LEU CA C 13 54.741 0.300 . 1 . . . . 73 LEU CA . 11338 1 816 . 1 1 73 73 LEU CB C 13 41.646 0.300 . 1 . . . . 73 LEU CB . 11338 1 817 . 1 1 73 73 LEU CD1 C 13 24.527 0.300 . 2 . . . . 73 LEU CD1 . 11338 1 818 . 1 1 73 73 LEU CD2 C 13 23.369 0.300 . 2 . . . . 73 LEU CD2 . 11338 1 819 . 1 1 73 73 LEU CG C 13 27.656 0.300 . 1 . . . . 73 LEU CG . 11338 1 820 . 1 1 73 73 LEU N N 15 119.590 0.300 . 1 . . . . 73 LEU N . 11338 1 821 . 1 1 74 74 TYR H H 1 7.368 0.030 . 1 . . . . 74 TYR H . 11338 1 822 . 1 1 74 74 TYR HA H 1 5.570 0.030 . 1 . . . . 74 TYR HA . 11338 1 823 . 1 1 74 74 TYR HB2 H 1 2.843 0.030 . 2 . . . . 74 TYR HB2 . 11338 1 824 . 1 1 74 74 TYR HB3 H 1 2.220 0.030 . 2 . . . . 74 TYR HB3 . 11338 1 825 . 1 1 74 74 TYR HD1 H 1 6.632 0.030 . 1 . . . . 74 TYR HD1 . 11338 1 826 . 1 1 74 74 TYR HD2 H 1 6.632 0.030 . 1 . . . . 74 TYR HD2 . 11338 1 827 . 1 1 74 74 TYR HE1 H 1 6.759 0.030 . 1 . . . . 74 TYR HE1 . 11338 1 828 . 1 1 74 74 TYR HE2 H 1 6.759 0.030 . 1 . . . . 74 TYR HE2 . 11338 1 829 . 1 1 74 74 TYR C C 13 174.056 0.300 . 1 . . . . 74 TYR C . 11338 1 830 . 1 1 74 74 TYR CA C 13 54.298 0.300 . 1 . . . . 74 TYR CA . 11338 1 831 . 1 1 74 74 TYR CB C 13 41.272 0.300 . 1 . . . . 74 TYR CB . 11338 1 832 . 1 1 74 74 TYR CD1 C 13 133.975 0.300 . 1 . . . . 74 TYR CD1 . 11338 1 833 . 1 1 74 74 TYR CD2 C 13 133.975 0.300 . 1 . . . . 74 TYR CD2 . 11338 1 834 . 1 1 74 74 TYR CE1 C 13 117.390 0.300 . 1 . . . . 74 TYR CE1 . 11338 1 835 . 1 1 74 74 TYR CE2 C 13 117.390 0.300 . 1 . . . . 74 TYR CE2 . 11338 1 836 . 1 1 74 74 TYR N N 15 116.411 0.300 . 1 . . . . 74 TYR N . 11338 1 837 . 1 1 75 75 GLU H H 1 8.210 0.030 . 1 . . . . 75 GLU H . 11338 1 838 . 1 1 75 75 GLU HA H 1 4.408 0.030 . 1 . . . . 75 GLU HA . 11338 1 839 . 1 1 75 75 GLU HB2 H 1 2.007 0.030 . 2 . . . . 75 GLU HB2 . 11338 1 840 . 1 1 75 75 GLU HB3 H 1 1.795 0.030 . 2 . . . . 75 GLU HB3 . 11338 1 841 . 1 1 75 75 GLU HG2 H 1 2.014 0.030 . 2 . . . . 75 GLU HG2 . 11338 1 842 . 1 1 75 75 GLU HG3 H 1 1.806 0.030 . 2 . . . . 75 GLU HG3 . 11338 1 843 . 1 1 75 75 GLU C C 13 174.447 0.300 . 1 . . . . 75 GLU C . 11338 1 844 . 1 1 75 75 GLU CA C 13 54.316 0.300 . 1 . . . . 75 GLU CA . 11338 1 845 . 1 1 75 75 GLU CB C 13 34.075 0.300 . 1 . . . . 75 GLU CB . 11338 1 846 . 1 1 75 75 GLU CG C 13 36.283 0.300 . 1 . . . . 75 GLU CG . 11338 1 847 . 1 1 75 75 GLU N N 15 115.562 0.300 . 1 . . . . 75 GLU N . 11338 1 848 . 1 1 76 76 ILE H H 1 9.117 0.030 . 1 . . . . 76 ILE H . 11338 1 849 . 1 1 76 76 ILE HA H 1 4.081 0.030 . 1 . . . . 76 ILE HA . 11338 1 850 . 1 1 76 76 ILE HB H 1 1.997 0.030 . 1 . . . . 76 ILE HB . 11338 1 851 . 1 1 76 76 ILE HD11 H 1 0.718 0.030 . 1 . . . . 76 ILE HD1 . 11338 1 852 . 1 1 76 76 ILE HD12 H 1 0.718 0.030 . 1 . . . . 76 ILE HD1 . 11338 1 853 . 1 1 76 76 ILE HD13 H 1 0.718 0.030 . 1 . . . . 76 ILE HD1 . 11338 1 854 . 1 1 76 76 ILE HG12 H 1 1.448 0.030 . 2 . . . . 76 ILE HG12 . 11338 1 855 . 1 1 76 76 ILE HG13 H 1 1.244 0.030 . 2 . . . . 76 ILE HG13 . 11338 1 856 . 1 1 76 76 ILE HG21 H 1 0.726 0.030 . 1 . . . . 76 ILE HG2 . 11338 1 857 . 1 1 76 76 ILE HG22 H 1 0.726 0.030 . 1 . . . . 76 ILE HG2 . 11338 1 858 . 1 1 76 76 ILE HG23 H 1 0.726 0.030 . 1 . . . . 76 ILE HG2 . 11338 1 859 . 1 1 76 76 ILE C C 13 174.677 0.300 . 1 . . . . 76 ILE C . 11338 1 860 . 1 1 76 76 ILE CA C 13 60.762 0.300 . 1 . . . . 76 ILE CA . 11338 1 861 . 1 1 76 76 ILE CB C 13 35.357 0.300 . 1 . . . . 76 ILE CB . 11338 1 862 . 1 1 76 76 ILE CD1 C 13 11.522 0.300 . 1 . . . . 76 ILE CD1 . 11338 1 863 . 1 1 76 76 ILE CG1 C 13 27.303 0.300 . 1 . . . . 76 ILE CG1 . 11338 1 864 . 1 1 76 76 ILE CG2 C 13 17.379 0.300 . 1 . . . . 76 ILE CG2 . 11338 1 865 . 1 1 76 76 ILE N N 15 122.517 0.300 . 1 . . . . 76 ILE N . 11338 1 866 . 1 1 77 77 PHE H H 1 8.921 0.030 . 1 . . . . 77 PHE H . 11338 1 867 . 1 1 77 77 PHE HA H 1 4.331 0.030 . 1 . . . . 77 PHE HA . 11338 1 868 . 1 1 77 77 PHE HB2 H 1 2.753 0.030 . 2 . . . . 77 PHE HB2 . 11338 1 869 . 1 1 77 77 PHE HB3 H 1 2.691 0.030 . 2 . . . . 77 PHE HB3 . 11338 1 870 . 1 1 77 77 PHE HD1 H 1 7.056 0.030 . 1 . . . . 77 PHE HD1 . 11338 1 871 . 1 1 77 77 PHE HD2 H 1 7.056 0.030 . 1 . . . . 77 PHE HD2 . 11338 1 872 . 1 1 77 77 PHE HE1 H 1 7.296 0.030 . 1 . . . . 77 PHE HE1 . 11338 1 873 . 1 1 77 77 PHE HE2 H 1 7.296 0.030 . 1 . . . . 77 PHE HE2 . 11338 1 874 . 1 1 77 77 PHE C C 13 175.612 0.300 . 1 . . . . 77 PHE C . 11338 1 875 . 1 1 77 77 PHE CA C 13 59.833 0.300 . 1 . . . . 77 PHE CA . 11338 1 876 . 1 1 77 77 PHE CB C 13 41.520 0.300 . 1 . . . . 77 PHE CB . 11338 1 877 . 1 1 77 77 PHE CD1 C 13 131.323 0.300 . 1 . . . . 77 PHE CD1 . 11338 1 878 . 1 1 77 77 PHE CD2 C 13 131.323 0.300 . 1 . . . . 77 PHE CD2 . 11338 1 879 . 1 1 77 77 PHE CE1 C 13 131.563 0.300 . 1 . . . . 77 PHE CE1 . 11338 1 880 . 1 1 77 77 PHE CE2 C 13 131.563 0.300 . 1 . . . . 77 PHE CE2 . 11338 1 881 . 1 1 77 77 PHE N N 15 132.967 0.300 . 1 . . . . 77 PHE N . 11338 1 882 . 1 1 78 78 SER H H 1 8.035 0.030 . 1 . . . . 78 SER H . 11338 1 883 . 1 1 78 78 SER HA H 1 4.482 0.030 . 1 . . . . 78 SER HA . 11338 1 884 . 1 1 78 78 SER HB2 H 1 3.871 0.030 . 2 . . . . 78 SER HB2 . 11338 1 885 . 1 1 78 78 SER HB3 H 1 3.697 0.030 . 2 . . . . 78 SER HB3 . 11338 1 886 . 1 1 78 78 SER C C 13 172.070 0.300 . 1 . . . . 78 SER C . 11338 1 887 . 1 1 78 78 SER CA C 13 57.263 0.300 . 1 . . . . 78 SER CA . 11338 1 888 . 1 1 78 78 SER CB C 13 64.498 0.300 . 1 . . . . 78 SER CB . 11338 1 889 . 1 1 78 78 SER N N 15 109.477 0.300 . 1 . . . . 78 SER N . 11338 1 890 . 1 1 79 79 GLN H H 1 8.529 0.030 . 1 . . . . 79 GLN H . 11338 1 891 . 1 1 79 79 GLN HA H 1 5.086 0.030 . 1 . . . . 79 GLN HA . 11338 1 892 . 1 1 79 79 GLN HB2 H 1 2.394 0.030 . 2 . . . . 79 GLN HB2 . 11338 1 893 . 1 1 79 79 GLN HB3 H 1 1.943 0.030 . 2 . . . . 79 GLN HB3 . 11338 1 894 . 1 1 79 79 GLN HE21 H 1 7.046 0.030 . 2 . . . . 79 GLN HE21 . 11338 1 895 . 1 1 79 79 GLN HE22 H 1 6.210 0.030 . 2 . . . . 79 GLN HE22 . 11338 1 896 . 1 1 79 79 GLN HG2 H 1 2.355 0.030 . 2 . . . . 79 GLN HG2 . 11338 1 897 . 1 1 79 79 GLN HG3 H 1 2.074 0.030 . 2 . . . . 79 GLN HG3 . 11338 1 898 . 1 1 79 79 GLN C C 13 174.084 0.300 . 1 . . . . 79 GLN C . 11338 1 899 . 1 1 79 79 GLN CA C 13 55.014 0.300 . 1 . . . . 79 GLN CA . 11338 1 900 . 1 1 79 79 GLN CB C 13 29.502 0.300 . 1 . . . . 79 GLN CB . 11338 1 901 . 1 1 79 79 GLN CG C 13 30.263 0.300 . 1 . . . . 79 GLN CG . 11338 1 902 . 1 1 79 79 GLN N N 15 118.058 0.300 . 1 . . . . 79 GLN N . 11338 1 903 . 1 1 79 79 GLN NE2 N 15 107.366 0.300 . 1 . . . . 79 GLN NE2 . 11338 1 904 . 1 1 80 80 GLU H H 1 8.672 0.030 . 1 . . . . 80 GLU H . 11338 1 905 . 1 1 80 80 GLU HA H 1 4.424 0.030 . 1 . . . . 80 GLU HA . 11338 1 906 . 1 1 80 80 GLU HB2 H 1 1.935 0.030 . 2 . . . . 80 GLU HB2 . 11338 1 907 . 1 1 80 80 GLU HB3 H 1 1.729 0.030 . 2 . . . . 80 GLU HB3 . 11338 1 908 . 1 1 80 80 GLU HG2 H 1 2.139 0.030 . 1 . . . . 80 GLU HG2 . 11338 1 909 . 1 1 80 80 GLU HG3 H 1 2.139 0.030 . 1 . . . . 80 GLU HG3 . 11338 1 910 . 1 1 80 80 GLU C C 13 175.830 0.300 . 1 . . . . 80 GLU C . 11338 1 911 . 1 1 80 80 GLU CA C 13 56.252 0.300 . 1 . . . . 80 GLU CA . 11338 1 912 . 1 1 80 80 GLU CB C 13 33.023 0.300 . 1 . . . . 80 GLU CB . 11338 1 913 . 1 1 80 80 GLU CG C 13 35.511 0.300 . 1 . . . . 80 GLU CG . 11338 1 914 . 1 1 80 80 GLU N N 15 118.952 0.300 . 1 . . . . 80 GLU N . 11338 1 915 . 1 1 81 81 ASN H H 1 8.719 0.030 . 1 . . . . 81 ASN H . 11338 1 916 . 1 1 81 81 ASN HA H 1 4.349 0.030 . 1 . . . . 81 ASN HA . 11338 1 917 . 1 1 81 81 ASN HB2 H 1 3.291 0.030 . 2 . . . . 81 ASN HB2 . 11338 1 918 . 1 1 81 81 ASN HB3 H 1 3.217 0.030 . 2 . . . . 81 ASN HB3 . 11338 1 919 . 1 1 81 81 ASN HD21 H 1 7.671 0.030 . 2 . . . . 81 ASN HD21 . 11338 1 920 . 1 1 81 81 ASN HD22 H 1 7.080 0.030 . 2 . . . . 81 ASN HD22 . 11338 1 921 . 1 1 81 81 ASN C C 13 173.387 0.300 . 1 . . . . 81 ASN C . 11338 1 922 . 1 1 81 81 ASN CA C 13 54.491 0.300 . 1 . . . . 81 ASN CA . 11338 1 923 . 1 1 81 81 ASN CB C 13 37.601 0.300 . 1 . . . . 81 ASN CB . 11338 1 924 . 1 1 81 81 ASN N N 15 115.425 0.300 . 1 . . . . 81 ASN N . 11338 1 925 . 1 1 81 81 ASN ND2 N 15 113.600 0.300 . 1 . . . . 81 ASN ND2 . 11338 1 926 . 1 1 82 82 LEU H H 1 8.396 0.030 . 1 . . . . 82 LEU H . 11338 1 927 . 1 1 82 82 LEU HA H 1 4.765 0.030 . 1 . . . . 82 LEU HA . 11338 1 928 . 1 1 82 82 LEU HB2 H 1 1.550 0.030 . 2 . . . . 82 LEU HB2 . 11338 1 929 . 1 1 82 82 LEU HB3 H 1 1.371 0.030 . 2 . . . . 82 LEU HB3 . 11338 1 930 . 1 1 82 82 LEU HD11 H 1 0.675 0.030 . 1 . . . . 82 LEU HD1 . 11338 1 931 . 1 1 82 82 LEU HD12 H 1 0.675 0.030 . 1 . . . . 82 LEU HD1 . 11338 1 932 . 1 1 82 82 LEU HD13 H 1 0.675 0.030 . 1 . . . . 82 LEU HD1 . 11338 1 933 . 1 1 82 82 LEU HD21 H 1 0.821 0.030 . 1 . . . . 82 LEU HD2 . 11338 1 934 . 1 1 82 82 LEU HD22 H 1 0.821 0.030 . 1 . . . . 82 LEU HD2 . 11338 1 935 . 1 1 82 82 LEU HD23 H 1 0.821 0.030 . 1 . . . . 82 LEU HD2 . 11338 1 936 . 1 1 82 82 LEU HG H 1 1.757 0.030 . 1 . . . . 82 LEU HG . 11338 1 937 . 1 1 82 82 LEU C C 13 177.843 0.300 . 1 . . . . 82 LEU C . 11338 1 938 . 1 1 82 82 LEU CA C 13 53.876 0.300 . 1 . . . . 82 LEU CA . 11338 1 939 . 1 1 82 82 LEU CB C 13 43.757 0.300 . 1 . . . . 82 LEU CB . 11338 1 940 . 1 1 82 82 LEU CD1 C 13 26.784 0.300 . 2 . . . . 82 LEU CD1 . 11338 1 941 . 1 1 82 82 LEU CD2 C 13 24.516 0.300 . 2 . . . . 82 LEU CD2 . 11338 1 942 . 1 1 82 82 LEU CG C 13 26.515 0.300 . 1 . . . . 82 LEU CG . 11338 1 943 . 1 1 82 82 LEU N N 15 116.630 0.300 . 1 . . . . 82 LEU N . 11338 1 944 . 1 1 83 83 GLU H H 1 9.356 0.030 . 1 . . . . 83 GLU H . 11338 1 945 . 1 1 83 83 GLU HA H 1 4.547 0.030 . 1 . . . . 83 GLU HA . 11338 1 946 . 1 1 83 83 GLU HB2 H 1 2.315 0.030 . 2 . . . . 83 GLU HB2 . 11338 1 947 . 1 1 83 83 GLU HB3 H 1 1.943 0.030 . 2 . . . . 83 GLU HB3 . 11338 1 948 . 1 1 83 83 GLU HG2 H 1 2.419 0.030 . 2 . . . . 83 GLU HG2 . 11338 1 949 . 1 1 83 83 GLU HG3 H 1 2.293 0.030 . 2 . . . . 83 GLU HG3 . 11338 1 950 . 1 1 83 83 GLU C C 13 178.202 0.300 . 1 . . . . 83 GLU C . 11338 1 951 . 1 1 83 83 GLU CA C 13 54.845 0.300 . 1 . . . . 83 GLU CA . 11338 1 952 . 1 1 83 83 GLU CB C 13 31.013 0.300 . 1 . . . . 83 GLU CB . 11338 1 953 . 1 1 83 83 GLU CG C 13 36.511 0.300 . 1 . . . . 83 GLU CG . 11338 1 954 . 1 1 83 83 GLU N N 15 122.125 0.300 . 1 . . . . 83 GLU N . 11338 1 955 . 1 1 84 84 ASP H H 1 9.071 0.030 . 1 . . . . 84 ASP H . 11338 1 956 . 1 1 84 84 ASP HA H 1 4.251 0.030 . 1 . . . . 84 ASP HA . 11338 1 957 . 1 1 84 84 ASP HB2 H 1 2.663 0.030 . 1 . . . . 84 ASP HB2 . 11338 1 958 . 1 1 84 84 ASP HB3 H 1 2.663 0.030 . 1 . . . . 84 ASP HB3 . 11338 1 959 . 1 1 84 84 ASP C C 13 179.238 0.300 . 1 . . . . 84 ASP C . 11338 1 960 . 1 1 84 84 ASP CA C 13 58.373 0.300 . 1 . . . . 84 ASP CA . 11338 1 961 . 1 1 84 84 ASP CB C 13 39.908 0.300 . 1 . . . . 84 ASP CB . 11338 1 962 . 1 1 84 84 ASP N N 15 123.000 0.300 . 1 . . . . 84 ASP N . 11338 1 963 . 1 1 85 85 ASN H H 1 8.975 0.030 . 1 . . . . 85 ASN H . 11338 1 964 . 1 1 85 85 ASN HA H 1 4.440 0.030 . 1 . . . . 85 ASN HA . 11338 1 965 . 1 1 85 85 ASN HB2 H 1 2.811 0.030 . 2 . . . . 85 ASN HB2 . 11338 1 966 . 1 1 85 85 ASN HB3 H 1 2.770 0.030 . 2 . . . . 85 ASN HB3 . 11338 1 967 . 1 1 85 85 ASN C C 13 176.912 0.300 . 1 . . . . 85 ASN C . 11338 1 968 . 1 1 85 85 ASN CA C 13 56.002 0.300 . 1 . . . . 85 ASN CA . 11338 1 969 . 1 1 85 85 ASN CB C 13 37.601 0.300 . 1 . . . . 85 ASN CB . 11338 1 970 . 1 1 85 85 ASN N N 15 116.181 0.300 . 1 . . . . 85 ASN N . 11338 1 971 . 1 1 86 86 ASP H H 1 7.077 0.030 . 1 . . . . 86 ASP H . 11338 1 972 . 1 1 86 86 ASP HA H 1 4.409 0.030 . 1 . . . . 86 ASP HA . 11338 1 973 . 1 1 86 86 ASP HB2 H 1 3.058 0.030 . 2 . . . . 86 ASP HB2 . 11338 1 974 . 1 1 86 86 ASP HB3 H 1 2.615 0.030 . 2 . . . . 86 ASP HB3 . 11338 1 975 . 1 1 86 86 ASP C C 13 178.038 0.300 . 1 . . . . 86 ASP C . 11338 1 976 . 1 1 86 86 ASP CA C 13 57.648 0.300 . 1 . . . . 86 ASP CA . 11338 1 977 . 1 1 86 86 ASP CB C 13 42.269 0.300 . 1 . . . . 86 ASP CB . 11338 1 978 . 1 1 86 86 ASP N N 15 118.952 0.300 . 1 . . . . 86 ASP N . 11338 1 979 . 1 1 87 87 VAL H H 1 7.634 0.030 . 1 . . . . 87 VAL H . 11338 1 980 . 1 1 87 87 VAL HA H 1 3.339 0.030 . 1 . . . . 87 VAL HA . 11338 1 981 . 1 1 87 87 VAL HB H 1 2.258 0.030 . 1 . . . . 87 VAL HB . 11338 1 982 . 1 1 87 87 VAL HG11 H 1 0.939 0.030 . 1 . . . . 87 VAL HG1 . 11338 1 983 . 1 1 87 87 VAL HG12 H 1 0.939 0.030 . 1 . . . . 87 VAL HG1 . 11338 1 984 . 1 1 87 87 VAL HG13 H 1 0.939 0.030 . 1 . . . . 87 VAL HG1 . 11338 1 985 . 1 1 87 87 VAL HG21 H 1 0.927 0.030 . 1 . . . . 87 VAL HG2 . 11338 1 986 . 1 1 87 87 VAL HG22 H 1 0.927 0.030 . 1 . . . . 87 VAL HG2 . 11338 1 987 . 1 1 87 87 VAL HG23 H 1 0.927 0.030 . 1 . . . . 87 VAL HG2 . 11338 1 988 . 1 1 87 87 VAL C C 13 177.737 0.300 . 1 . . . . 87 VAL C . 11338 1 989 . 1 1 87 87 VAL CA C 13 67.508 0.300 . 1 . . . . 87 VAL CA . 11338 1 990 . 1 1 87 87 VAL CB C 13 31.524 0.300 . 1 . . . . 87 VAL CB . 11338 1 991 . 1 1 87 87 VAL CG1 C 13 21.370 0.300 . 2 . . . . 87 VAL CG1 . 11338 1 992 . 1 1 87 87 VAL CG2 C 13 23.266 0.300 . 2 . . . . 87 VAL CG2 . 11338 1 993 . 1 1 87 87 VAL N N 15 119.361 0.300 . 1 . . . . 87 VAL N . 11338 1 994 . 1 1 88 88 SER H H 1 7.959 0.030 . 1 . . . . 88 SER H . 11338 1 995 . 1 1 88 88 SER HA H 1 4.168 0.030 . 1 . . . . 88 SER HA . 11338 1 996 . 1 1 88 88 SER HB2 H 1 3.995 0.030 . 1 . . . . 88 SER HB2 . 11338 1 997 . 1 1 88 88 SER HB3 H 1 3.995 0.030 . 1 . . . . 88 SER HB3 . 11338 1 998 . 1 1 88 88 SER C C 13 177.587 0.300 . 1 . . . . 88 SER C . 11338 1 999 . 1 1 88 88 SER CA C 13 61.761 0.300 . 1 . . . . 88 SER CA . 11338 1 1000 . 1 1 88 88 SER CB C 13 62.470 0.300 . 1 . . . . 88 SER CB . 11338 1 1001 . 1 1 88 88 SER N N 15 113.039 0.300 . 1 . . . . 88 SER N . 11338 1 1002 . 1 1 89 89 ASP H H 1 8.135 0.030 . 1 . . . . 89 ASP H . 11338 1 1003 . 1 1 89 89 ASP HA H 1 4.479 0.030 . 1 . . . . 89 ASP HA . 11338 1 1004 . 1 1 89 89 ASP HB2 H 1 3.082 0.030 . 2 . . . . 89 ASP HB2 . 11338 1 1005 . 1 1 89 89 ASP HB3 H 1 2.532 0.030 . 2 . . . . 89 ASP HB3 . 11338 1 1006 . 1 1 89 89 ASP C C 13 179.762 0.300 . 1 . . . . 89 ASP C . 11338 1 1007 . 1 1 89 89 ASP CA C 13 57.629 0.300 . 1 . . . . 89 ASP CA . 11338 1 1008 . 1 1 89 89 ASP CB C 13 40.259 0.300 . 1 . . . . 89 ASP CB . 11338 1 1009 . 1 1 89 89 ASP N N 15 121.748 0.300 . 1 . . . . 89 ASP N . 11338 1 1010 . 1 1 90 90 ILE H H 1 8.412 0.030 . 1 . . . . 90 ILE H . 11338 1 1011 . 1 1 90 90 ILE HA H 1 3.618 0.030 . 1 . . . . 90 ILE HA . 11338 1 1012 . 1 1 90 90 ILE HB H 1 2.047 0.030 . 1 . . . . 90 ILE HB . 11338 1 1013 . 1 1 90 90 ILE HD11 H 1 0.718 0.030 . 1 . . . . 90 ILE HD1 . 11338 1 1014 . 1 1 90 90 ILE HD12 H 1 0.718 0.030 . 1 . . . . 90 ILE HD1 . 11338 1 1015 . 1 1 90 90 ILE HD13 H 1 0.718 0.030 . 1 . . . . 90 ILE HD1 . 11338 1 1016 . 1 1 90 90 ILE HG12 H 1 1.881 0.030 . 2 . . . . 90 ILE HG12 . 11338 1 1017 . 1 1 90 90 ILE HG13 H 1 0.844 0.030 . 2 . . . . 90 ILE HG13 . 11338 1 1018 . 1 1 90 90 ILE HG21 H 1 0.824 0.030 . 1 . . . . 90 ILE HG2 . 11338 1 1019 . 1 1 90 90 ILE HG22 H 1 0.824 0.030 . 1 . . . . 90 ILE HG2 . 11338 1 1020 . 1 1 90 90 ILE HG23 H 1 0.824 0.030 . 1 . . . . 90 ILE HG2 . 11338 1 1021 . 1 1 90 90 ILE C C 13 176.993 0.300 . 1 . . . . 90 ILE C . 11338 1 1022 . 1 1 90 90 ILE CA C 13 65.759 0.300 . 1 . . . . 90 ILE CA . 11338 1 1023 . 1 1 90 90 ILE CB C 13 37.657 0.300 . 1 . . . . 90 ILE CB . 11338 1 1024 . 1 1 90 90 ILE CD1 C 13 14.532 0.300 . 1 . . . . 90 ILE CD1 . 11338 1 1025 . 1 1 90 90 ILE CG1 C 13 30.763 0.300 . 1 . . . . 90 ILE CG1 . 11338 1 1026 . 1 1 90 90 ILE CG2 C 13 18.010 0.300 . 1 . . . . 90 ILE CG2 . 11338 1 1027 . 1 1 90 90 ILE N N 15 123.294 0.300 . 1 . . . . 90 ILE N . 11338 1 1028 . 1 1 91 91 LEU H H 1 8.284 0.030 . 1 . . . . 91 LEU H . 11338 1 1029 . 1 1 91 91 LEU HA H 1 4.110 0.030 . 1 . . . . 91 LEU HA . 11338 1 1030 . 1 1 91 91 LEU HB2 H 1 2.073 0.030 . 2 . . . . 91 LEU HB2 . 11338 1 1031 . 1 1 91 91 LEU HB3 H 1 1.669 0.030 . 2 . . . . 91 LEU HB3 . 11338 1 1032 . 1 1 91 91 LEU HD11 H 1 0.987 0.030 . 1 . . . . 91 LEU HD1 . 11338 1 1033 . 1 1 91 91 LEU HD12 H 1 0.987 0.030 . 1 . . . . 91 LEU HD1 . 11338 1 1034 . 1 1 91 91 LEU HD13 H 1 0.987 0.030 . 1 . . . . 91 LEU HD1 . 11338 1 1035 . 1 1 91 91 LEU HD21 H 1 0.995 0.030 . 1 . . . . 91 LEU HD2 . 11338 1 1036 . 1 1 91 91 LEU HD22 H 1 0.995 0.030 . 1 . . . . 91 LEU HD2 . 11338 1 1037 . 1 1 91 91 LEU HD23 H 1 0.995 0.030 . 1 . . . . 91 LEU HD2 . 11338 1 1038 . 1 1 91 91 LEU HG H 1 1.886 0.030 . 1 . . . . 91 LEU HG . 11338 1 1039 . 1 1 91 91 LEU C C 13 180.041 0.300 . 1 . . . . 91 LEU C . 11338 1 1040 . 1 1 91 91 LEU CA C 13 58.739 0.300 . 1 . . . . 91 LEU CA . 11338 1 1041 . 1 1 91 91 LEU CB C 13 41.350 0.300 . 1 . . . . 91 LEU CB . 11338 1 1042 . 1 1 91 91 LEU CD1 C 13 25.617 0.300 . 2 . . . . 91 LEU CD1 . 11338 1 1043 . 1 1 91 91 LEU CD2 C 13 22.267 0.300 . 2 . . . . 91 LEU CD2 . 11338 1 1044 . 1 1 91 91 LEU CG C 13 27.140 0.300 . 1 . . . . 91 LEU CG . 11338 1 1045 . 1 1 91 91 LEU N N 15 120.350 0.300 . 1 . . . . 91 LEU N . 11338 1 1046 . 1 1 92 92 LYS H H 1 8.092 0.030 . 1 . . . . 92 LYS H . 11338 1 1047 . 1 1 92 92 LYS HA H 1 4.117 0.030 . 1 . . . . 92 LYS HA . 11338 1 1048 . 1 1 92 92 LYS HB2 H 1 1.950 0.030 . 1 . . . . 92 LYS HB2 . 11338 1 1049 . 1 1 92 92 LYS HB3 H 1 1.950 0.030 . 1 . . . . 92 LYS HB3 . 11338 1 1050 . 1 1 92 92 LYS HD2 H 1 1.739 0.030 . 1 . . . . 92 LYS HD2 . 11338 1 1051 . 1 1 92 92 LYS HD3 H 1 1.739 0.030 . 1 . . . . 92 LYS HD3 . 11338 1 1052 . 1 1 92 92 LYS HE2 H 1 2.982 0.030 . 1 . . . . 92 LYS HE2 . 11338 1 1053 . 1 1 92 92 LYS HE3 H 1 2.982 0.030 . 1 . . . . 92 LYS HE3 . 11338 1 1054 . 1 1 92 92 LYS HG2 H 1 1.668 0.030 . 2 . . . . 92 LYS HG2 . 11338 1 1055 . 1 1 92 92 LYS HG3 H 1 1.479 0.030 . 2 . . . . 92 LYS HG3 . 11338 1 1056 . 1 1 92 92 LYS C C 13 178.576 0.300 . 1 . . . . 92 LYS C . 11338 1 1057 . 1 1 92 92 LYS CA C 13 59.656 0.300 . 1 . . . . 92 LYS CA . 11338 1 1058 . 1 1 92 92 LYS CB C 13 32.648 0.300 . 1 . . . . 92 LYS CB . 11338 1 1059 . 1 1 92 92 LYS CD C 13 29.514 0.300 . 1 . . . . 92 LYS CD . 11338 1 1060 . 1 1 92 92 LYS CE C 13 42.246 0.300 . 1 . . . . 92 LYS CE . 11338 1 1061 . 1 1 92 92 LYS CG C 13 25.401 0.300 . 1 . . . . 92 LYS CG . 11338 1 1062 . 1 1 92 92 LYS N N 15 120.206 0.300 . 1 . . . . 92 LYS N . 11338 1 1063 . 1 1 93 93 LEU H H 1 7.886 0.030 . 1 . . . . 93 LEU H . 11338 1 1064 . 1 1 93 93 LEU HA H 1 4.192 0.030 . 1 . . . . 93 LEU HA . 11338 1 1065 . 1 1 93 93 LEU HB2 H 1 2.080 0.030 . 2 . . . . 93 LEU HB2 . 11338 1 1066 . 1 1 93 93 LEU HB3 H 1 1.705 0.030 . 2 . . . . 93 LEU HB3 . 11338 1 1067 . 1 1 93 93 LEU HD11 H 1 0.933 0.030 . 1 . . . . 93 LEU HD1 . 11338 1 1068 . 1 1 93 93 LEU HD12 H 1 0.933 0.030 . 1 . . . . 93 LEU HD1 . 11338 1 1069 . 1 1 93 93 LEU HD13 H 1 0.933 0.030 . 1 . . . . 93 LEU HD1 . 11338 1 1070 . 1 1 93 93 LEU HD21 H 1 0.796 0.030 . 1 . . . . 93 LEU HD2 . 11338 1 1071 . 1 1 93 93 LEU HD22 H 1 0.796 0.030 . 1 . . . . 93 LEU HD2 . 11338 1 1072 . 1 1 93 93 LEU HD23 H 1 0.796 0.030 . 1 . . . . 93 LEU HD2 . 11338 1 1073 . 1 1 93 93 LEU HG H 1 1.630 0.030 . 1 . . . . 93 LEU HG . 11338 1 1074 . 1 1 93 93 LEU C C 13 178.643 0.300 . 1 . . . . 93 LEU C . 11338 1 1075 . 1 1 93 93 LEU CA C 13 58.017 0.300 . 1 . . . . 93 LEU CA . 11338 1 1076 . 1 1 93 93 LEU CB C 13 42.019 0.300 . 1 . . . . 93 LEU CB . 11338 1 1077 . 1 1 93 93 LEU CD1 C 13 24.640 0.300 . 2 . . . . 93 LEU CD1 . 11338 1 1078 . 1 1 93 93 LEU CD2 C 13 26.526 0.300 . 2 . . . . 93 LEU CD2 . 11338 1 1079 . 1 1 93 93 LEU CG C 13 26.764 0.300 . 1 . . . . 93 LEU CG . 11338 1 1080 . 1 1 93 93 LEU N N 15 122.089 0.300 . 1 . . . . 93 LEU N . 11338 1 1081 . 1 1 94 94 LEU H H 1 8.257 0.030 . 1 . . . . 94 LEU H . 11338 1 1082 . 1 1 94 94 LEU HA H 1 3.601 0.030 . 1 . . . . 94 LEU HA . 11338 1 1083 . 1 1 94 94 LEU HB2 H 1 1.607 0.030 . 2 . . . . 94 LEU HB2 . 11338 1 1084 . 1 1 94 94 LEU HB3 H 1 0.168 0.030 . 2 . . . . 94 LEU HB3 . 11338 1 1085 . 1 1 94 94 LEU HD11 H 1 0.480 0.030 . 1 . . . . 94 LEU HD1 . 11338 1 1086 . 1 1 94 94 LEU HD12 H 1 0.480 0.030 . 1 . . . . 94 LEU HD1 . 11338 1 1087 . 1 1 94 94 LEU HD13 H 1 0.480 0.030 . 1 . . . . 94 LEU HD1 . 11338 1 1088 . 1 1 94 94 LEU HD21 H 1 0.616 0.030 . 1 . . . . 94 LEU HD2 . 11338 1 1089 . 1 1 94 94 LEU HD22 H 1 0.616 0.030 . 1 . . . . 94 LEU HD2 . 11338 1 1090 . 1 1 94 94 LEU HD23 H 1 0.616 0.030 . 1 . . . . 94 LEU HD2 . 11338 1 1091 . 1 1 94 94 LEU HG H 1 1.521 0.030 . 1 . . . . 94 LEU HG . 11338 1 1092 . 1 1 94 94 LEU C C 13 177.641 0.300 . 1 . . . . 94 LEU C . 11338 1 1093 . 1 1 94 94 LEU CA C 13 58.501 0.300 . 1 . . . . 94 LEU CA . 11338 1 1094 . 1 1 94 94 LEU CB C 13 41.508 0.300 . 1 . . . . 94 LEU CB . 11338 1 1095 . 1 1 94 94 LEU CD1 C 13 26.152 0.300 . 2 . . . . 94 LEU CD1 . 11338 1 1096 . 1 1 94 94 LEU CD2 C 13 24.516 0.300 . 2 . . . . 94 LEU CD2 . 11338 1 1097 . 1 1 94 94 LEU CG C 13 27.026 0.300 . 1 . . . . 94 LEU CG . 11338 1 1098 . 1 1 94 94 LEU N N 15 120.342 0.300 . 1 . . . . 94 LEU N . 11338 1 1099 . 1 1 95 95 ALA H H 1 7.604 0.030 . 1 . . . . 95 ALA H . 11338 1 1100 . 1 1 95 95 ALA HA H 1 4.145 0.030 . 1 . . . . 95 ALA HA . 11338 1 1101 . 1 1 95 95 ALA HB1 H 1 1.635 0.030 . 1 . . . . 95 ALA HB . 11338 1 1102 . 1 1 95 95 ALA HB2 H 1 1.635 0.030 . 1 . . . . 95 ALA HB . 11338 1 1103 . 1 1 95 95 ALA HB3 H 1 1.635 0.030 . 1 . . . . 95 ALA HB . 11338 1 1104 . 1 1 95 95 ALA C C 13 181.569 0.300 . 1 . . . . 95 ALA C . 11338 1 1105 . 1 1 95 95 ALA CA C 13 55.513 0.300 . 1 . . . . 95 ALA CA . 11338 1 1106 . 1 1 95 95 ALA CB C 13 18.280 0.300 . 1 . . . . 95 ALA CB . 11338 1 1107 . 1 1 95 95 ALA N N 15 120.113 0.300 . 1 . . . . 95 ALA N . 11338 1 1108 . 1 1 96 96 LEU H H 1 7.950 0.030 . 1 . . . . 96 LEU H . 11338 1 1109 . 1 1 96 96 LEU HA H 1 4.182 0.030 . 1 . . . . 96 LEU HA . 11338 1 1110 . 1 1 96 96 LEU HB2 H 1 1.891 0.030 . 2 . . . . 96 LEU HB2 . 11338 1 1111 . 1 1 96 96 LEU HB3 H 1 1.727 0.030 . 2 . . . . 96 LEU HB3 . 11338 1 1112 . 1 1 96 96 LEU HD11 H 1 0.915 0.030 . 1 . . . . 96 LEU HD1 . 11338 1 1113 . 1 1 96 96 LEU HD12 H 1 0.915 0.030 . 1 . . . . 96 LEU HD1 . 11338 1 1114 . 1 1 96 96 LEU HD13 H 1 0.915 0.030 . 1 . . . . 96 LEU HD1 . 11338 1 1115 . 1 1 96 96 LEU HD21 H 1 0.935 0.030 . 1 . . . . 96 LEU HD2 . 11338 1 1116 . 1 1 96 96 LEU HD22 H 1 0.935 0.030 . 1 . . . . 96 LEU HD2 . 11338 1 1117 . 1 1 96 96 LEU HD23 H 1 0.935 0.030 . 1 . . . . 96 LEU HD2 . 11338 1 1118 . 1 1 96 96 LEU HG H 1 1.771 0.030 . 1 . . . . 96 LEU HG . 11338 1 1119 . 1 1 96 96 LEU C C 13 180.138 0.300 . 1 . . . . 96 LEU C . 11338 1 1120 . 1 1 96 96 LEU CA C 13 57.990 0.300 . 1 . . . . 96 LEU CA . 11338 1 1121 . 1 1 96 96 LEU CB C 13 42.269 0.300 . 1 . . . . 96 LEU CB . 11338 1 1122 . 1 1 96 96 LEU CD1 C 13 24.022 0.300 . 2 . . . . 96 LEU CD1 . 11338 1 1123 . 1 1 96 96 LEU CD2 C 13 25.006 0.300 . 2 . . . . 96 LEU CD2 . 11338 1 1124 . 1 1 96 96 LEU CG C 13 27.003 0.300 . 1 . . . . 96 LEU CG . 11338 1 1125 . 1 1 96 96 LEU N N 15 119.624 0.300 . 1 . . . . 96 LEU N . 11338 1 1126 . 1 1 97 97 GLN H H 1 8.722 0.030 . 1 . . . . 97 GLN H . 11338 1 1127 . 1 1 97 97 GLN HA H 1 3.916 0.030 . 1 . . . . 97 GLN HA . 11338 1 1128 . 1 1 97 97 GLN HB2 H 1 2.049 0.030 . 2 . . . . 97 GLN HB2 . 11338 1 1129 . 1 1 97 97 GLN HB3 H 1 1.915 0.030 . 2 . . . . 97 GLN HB3 . 11338 1 1130 . 1 1 97 97 GLN HE21 H 1 6.943 0.030 . 2 . . . . 97 GLN HE21 . 11338 1 1131 . 1 1 97 97 GLN HE22 H 1 6.806 0.030 . 2 . . . . 97 GLN HE22 . 11338 1 1132 . 1 1 97 97 GLN HG2 H 1 2.465 0.030 . 2 . . . . 97 GLN HG2 . 11338 1 1133 . 1 1 97 97 GLN HG3 H 1 1.996 0.030 . 2 . . . . 97 GLN HG3 . 11338 1 1134 . 1 1 97 97 GLN C C 13 179.238 0.300 . 1 . . . . 97 GLN C . 11338 1 1135 . 1 1 97 97 GLN CA C 13 58.264 0.300 . 1 . . . . 97 GLN CA . 11338 1 1136 . 1 1 97 97 GLN CB C 13 28.291 0.300 . 1 . . . . 97 GLN CB . 11338 1 1137 . 1 1 97 97 GLN CG C 13 34.125 0.300 . 1 . . . . 97 GLN CG . 11338 1 1138 . 1 1 97 97 GLN N N 15 117.515 0.300 . 1 . . . . 97 GLN N . 11338 1 1139 . 1 1 97 97 GLN NE2 N 15 111.839 0.300 . 1 . . . . 97 GLN NE2 . 11338 1 1140 . 1 1 98 98 ALA H H 1 8.958 0.030 . 1 . . . . 98 ALA H . 11338 1 1141 . 1 1 98 98 ALA HA H 1 4.588 0.030 . 1 . . . . 98 ALA HA . 11338 1 1142 . 1 1 98 98 ALA HB1 H 1 1.604 0.030 . 1 . . . . 98 ALA HB . 11338 1 1143 . 1 1 98 98 ALA HB2 H 1 1.604 0.030 . 1 . . . . 98 ALA HB . 11338 1 1144 . 1 1 98 98 ALA HB3 H 1 1.604 0.030 . 1 . . . . 98 ALA HB . 11338 1 1145 . 1 1 98 98 ALA C C 13 178.683 0.300 . 1 . . . . 98 ALA C . 11338 1 1146 . 1 1 98 98 ALA CA C 13 55.502 0.300 . 1 . . . . 98 ALA CA . 11338 1 1147 . 1 1 98 98 ALA CB C 13 17.536 0.300 . 1 . . . . 98 ALA CB . 11338 1 1148 . 1 1 98 98 ALA N N 15 123.864 0.300 . 1 . . . . 98 ALA N . 11338 1 1149 . 1 1 99 99 GLU H H 1 7.366 0.030 . 1 . . . . 99 GLU H . 11338 1 1150 . 1 1 99 99 GLU HA H 1 4.042 0.030 . 1 . . . . 99 GLU HA . 11338 1 1151 . 1 1 99 99 GLU HB2 H 1 2.204 0.030 . 1 . . . . 99 GLU HB2 . 11338 1 1152 . 1 1 99 99 GLU HB3 H 1 2.204 0.030 . 1 . . . . 99 GLU HB3 . 11338 1 1153 . 1 1 99 99 GLU HG2 H 1 2.378 0.030 . 1 . . . . 99 GLU HG2 . 11338 1 1154 . 1 1 99 99 GLU HG3 H 1 2.378 0.030 . 1 . . . . 99 GLU HG3 . 11338 1 1155 . 1 1 99 99 GLU C C 13 179.358 0.300 . 1 . . . . 99 GLU C . 11338 1 1156 . 1 1 99 99 GLU CA C 13 59.001 0.300 . 1 . . . . 99 GLU CA . 11338 1 1157 . 1 1 99 99 GLU CB C 13 29.514 0.300 . 1 . . . . 99 GLU CB . 11338 1 1158 . 1 1 99 99 GLU CG C 13 36.011 0.300 . 1 . . . . 99 GLU CG . 11338 1 1159 . 1 1 99 99 GLU N N 15 114.959 0.300 . 1 . . . . 99 GLU N . 11338 1 1160 . 1 1 100 100 GLU H H 1 7.801 0.030 . 1 . . . . 100 GLU H . 11338 1 1161 . 1 1 100 100 GLU HA H 1 4.135 0.030 . 1 . . . . 100 GLU HA . 11338 1 1162 . 1 1 100 100 GLU HB2 H 1 2.067 0.030 . 1 . . . . 100 GLU HB2 . 11338 1 1163 . 1 1 100 100 GLU HB3 H 1 2.067 0.030 . 1 . . . . 100 GLU HB3 . 11338 1 1164 . 1 1 100 100 GLU HG2 H 1 2.404 0.030 . 1 . . . . 100 GLU HG2 . 11338 1 1165 . 1 1 100 100 GLU HG3 H 1 2.404 0.030 . 1 . . . . 100 GLU HG3 . 11338 1 1166 . 1 1 100 100 GLU C C 13 177.560 0.300 . 1 . . . . 100 GLU C . 11338 1 1167 . 1 1 100 100 GLU CA C 13 58.388 0.300 . 1 . . . . 100 GLU CA . 11338 1 1168 . 1 1 100 100 GLU CB C 13 30.252 0.300 . 1 . . . . 100 GLU CB . 11338 1 1169 . 1 1 100 100 GLU CG C 13 36.272 0.300 . 1 . . . . 100 GLU CG . 11338 1 1170 . 1 1 100 100 GLU N N 15 116.353 0.300 . 1 . . . . 100 GLU N . 11338 1 1171 . 1 1 101 101 ASN H H 1 7.530 0.030 . 1 . . . . 101 ASN H . 11338 1 1172 . 1 1 101 101 ASN HA H 1 4.765 0.030 . 1 . . . . 101 ASN HA . 11338 1 1173 . 1 1 101 101 ASN HB2 H 1 3.083 0.030 . 2 . . . . 101 ASN HB2 . 11338 1 1174 . 1 1 101 101 ASN HB3 H 1 2.755 0.030 . 2 . . . . 101 ASN HB3 . 11338 1 1175 . 1 1 101 101 ASN HD21 H 1 8.320 0.030 . 2 . . . . 101 ASN HD21 . 11338 1 1176 . 1 1 101 101 ASN HD22 H 1 7.258 0.030 . 2 . . . . 101 ASN HD22 . 11338 1 1177 . 1 1 101 101 ASN C C 13 172.525 0.300 . 1 . . . . 101 ASN C . 11338 1 1178 . 1 1 101 101 ASN CA C 13 54.122 0.300 . 1 . . . . 101 ASN CA . 11338 1 1179 . 1 1 101 101 ASN CB C 13 41.762 0.300 . 1 . . . . 101 ASN CB . 11338 1 1180 . 1 1 101 101 ASN N N 15 115.282 0.300 . 1 . . . . 101 ASN N . 11338 1 1181 . 1 1 101 101 ASN ND2 N 15 117.256 0.300 . 1 . . . . 101 ASN ND2 . 11338 1 1182 . 1 1 102 102 LEU H H 1 6.944 0.030 . 1 . . . . 102 LEU H . 11338 1 1183 . 1 1 102 102 LEU HA H 1 3.922 0.030 . 1 . . . . 102 LEU HA . 11338 1 1184 . 1 1 102 102 LEU HB2 H 1 1.783 0.030 . 2 . . . . 102 LEU HB2 . 11338 1 1185 . 1 1 102 102 LEU HB3 H 1 1.449 0.030 . 2 . . . . 102 LEU HB3 . 11338 1 1186 . 1 1 102 102 LEU HD11 H 1 0.993 0.030 . 1 . . . . 102 LEU HD1 . 11338 1 1187 . 1 1 102 102 LEU HD12 H 1 0.993 0.030 . 1 . . . . 102 LEU HD1 . 11338 1 1188 . 1 1 102 102 LEU HD13 H 1 0.993 0.030 . 1 . . . . 102 LEU HD1 . 11338 1 1189 . 1 1 102 102 LEU HD21 H 1 0.766 0.030 . 1 . . . . 102 LEU HD2 . 11338 1 1190 . 1 1 102 102 LEU HD22 H 1 0.766 0.030 . 1 . . . . 102 LEU HD2 . 11338 1 1191 . 1 1 102 102 LEU HD23 H 1 0.766 0.030 . 1 . . . . 102 LEU HD2 . 11338 1 1192 . 1 1 102 102 LEU HG H 1 2.191 0.030 . 1 . . . . 102 LEU HG . 11338 1 1193 . 1 1 102 102 LEU C C 13 178.128 0.300 . 1 . . . . 102 LEU C . 11338 1 1194 . 1 1 102 102 LEU CA C 13 57.504 0.300 . 1 . . . . 102 LEU CA . 11338 1 1195 . 1 1 102 102 LEU CB C 13 42.144 0.300 . 1 . . . . 102 LEU CB . 11338 1 1196 . 1 1 102 102 LEU CD1 C 13 25.413 0.300 . 2 . . . . 102 LEU CD1 . 11338 1 1197 . 1 1 102 102 LEU CD2 C 13 23.019 0.300 . 2 . . . . 102 LEU CD2 . 11338 1 1198 . 1 1 102 102 LEU CG C 13 26.021 0.300 . 1 . . . . 102 LEU CG . 11338 1 1199 . 1 1 102 102 LEU N N 15 117.813 0.300 . 1 . . . . 102 LEU N . 11338 1 1200 . 1 1 103 103 GLY H H 1 8.659 0.030 . 1 . . . . 103 GLY H . 11338 1 1201 . 1 1 103 103 GLY HA2 H 1 4.397 0.030 . 2 . . . . 103 GLY HA2 . 11338 1 1202 . 1 1 103 103 GLY HA3 H 1 3.754 0.030 . 2 . . . . 103 GLY HA3 . 11338 1 1203 . 1 1 103 103 GLY C C 13 173.640 0.300 . 1 . . . . 103 GLY C . 11338 1 1204 . 1 1 103 103 GLY CA C 13 44.269 0.300 . 1 . . . . 103 GLY CA . 11338 1 1205 . 1 1 103 103 GLY N N 15 110.784 0.300 . 1 . . . . 103 GLY N . 11338 1 1206 . 1 1 104 104 MET H H 1 8.161 0.030 . 1 . . . . 104 MET H . 11338 1 1207 . 1 1 104 104 MET HA H 1 4.657 0.030 . 1 . . . . 104 MET HA . 11338 1 1208 . 1 1 104 104 MET HB2 H 1 2.075 0.030 . 2 . . . . 104 MET HB2 . 11338 1 1209 . 1 1 104 104 MET HB3 H 1 2.022 0.030 . 2 . . . . 104 MET HB3 . 11338 1 1210 . 1 1 104 104 MET HE1 H 1 2.121 0.030 . 1 . . . . 104 MET HE . 11338 1 1211 . 1 1 104 104 MET HE2 H 1 2.121 0.030 . 1 . . . . 104 MET HE . 11338 1 1212 . 1 1 104 104 MET HE3 H 1 2.121 0.030 . 1 . . . . 104 MET HE . 11338 1 1213 . 1 1 104 104 MET HG2 H 1 2.631 0.030 . 2 . . . . 104 MET HG2 . 11338 1 1214 . 1 1 104 104 MET HG3 H 1 2.486 0.030 . 2 . . . . 104 MET HG3 . 11338 1 1215 . 1 1 104 104 MET C C 13 173.774 0.300 . 1 . . . . 104 MET C . 11338 1 1216 . 1 1 104 104 MET CA C 13 53.538 0.300 . 1 . . . . 104 MET CA . 11338 1 1217 . 1 1 104 104 MET CB C 13 36.022 0.300 . 1 . . . . 104 MET CB . 11338 1 1218 . 1 1 104 104 MET CE C 13 17.024 0.300 . 1 . . . . 104 MET CE . 11338 1 1219 . 1 1 104 104 MET CG C 13 31.513 0.300 . 1 . . . . 104 MET CG . 11338 1 1220 . 1 1 104 104 MET N N 15 120.258 0.300 . 1 . . . . 104 MET N . 11338 1 1221 . 1 1 105 105 VAL H H 1 8.242 0.030 . 1 . . . . 105 VAL H . 11338 1 1222 . 1 1 105 105 VAL HA H 1 3.872 0.030 . 1 . . . . 105 VAL HA . 11338 1 1223 . 1 1 105 105 VAL HB H 1 2.637 0.030 . 1 . . . . 105 VAL HB . 11338 1 1224 . 1 1 105 105 VAL HG11 H 1 1.060 0.030 . 1 . . . . 105 VAL HG1 . 11338 1 1225 . 1 1 105 105 VAL HG12 H 1 1.060 0.030 . 1 . . . . 105 VAL HG1 . 11338 1 1226 . 1 1 105 105 VAL HG13 H 1 1.060 0.030 . 1 . . . . 105 VAL HG1 . 11338 1 1227 . 1 1 105 105 VAL HG21 H 1 1.001 0.030 . 1 . . . . 105 VAL HG2 . 11338 1 1228 . 1 1 105 105 VAL HG22 H 1 1.001 0.030 . 1 . . . . 105 VAL HG2 . 11338 1 1229 . 1 1 105 105 VAL HG23 H 1 1.001 0.030 . 1 . . . . 105 VAL HG2 . 11338 1 1230 . 1 1 105 105 VAL C C 13 178.745 0.300 . 1 . . . . 105 VAL C . 11338 1 1231 . 1 1 105 105 VAL CA C 13 64.498 0.300 . 1 . . . . 105 VAL CA . 11338 1 1232 . 1 1 105 105 VAL CB C 13 29.346 0.300 . 1 . . . . 105 VAL CB . 11338 1 1233 . 1 1 105 105 VAL CG1 C 13 22.755 0.300 . 2 . . . . 105 VAL CG1 . 11338 1 1234 . 1 1 105 105 VAL CG2 C 13 17.515 0.300 . 2 . . . . 105 VAL CG2 . 11338 1 1235 . 1 1 105 105 VAL N N 15 113.875 0.300 . 1 . . . . 105 VAL N . 11338 1 1236 . 1 1 106 106 MET H H 1 8.318 0.030 . 1 . . . . 106 MET H . 11338 1 1237 . 1 1 106 106 MET HA H 1 5.270 0.030 . 1 . . . . 106 MET HA . 11338 1 1238 . 1 1 106 106 MET HB2 H 1 2.357 0.030 . 2 . . . . 106 MET HB2 . 11338 1 1239 . 1 1 106 106 MET HB3 H 1 2.078 0.030 . 2 . . . . 106 MET HB3 . 11338 1 1240 . 1 1 106 106 MET HE1 H 1 2.277 0.030 . 1 . . . . 106 MET HE . 11338 1 1241 . 1 1 106 106 MET HE2 H 1 2.277 0.030 . 1 . . . . 106 MET HE . 11338 1 1242 . 1 1 106 106 MET HE3 H 1 2.277 0.030 . 1 . . . . 106 MET HE . 11338 1 1243 . 1 1 106 106 MET HG2 H 1 2.960 0.030 . 2 . . . . 106 MET HG2 . 11338 1 1244 . 1 1 106 106 MET HG3 H 1 2.257 0.030 . 2 . . . . 106 MET HG3 . 11338 1 1245 . 1 1 106 106 MET C C 13 176.354 0.300 . 1 . . . . 106 MET C . 11338 1 1246 . 1 1 106 106 MET CA C 13 56.490 0.300 . 1 . . . . 106 MET CA . 11338 1 1247 . 1 1 106 106 MET CB C 13 37.386 0.300 . 1 . . . . 106 MET CB . 11338 1 1248 . 1 1 106 106 MET CE C 13 16.775 0.300 . 1 . . . . 106 MET CE . 11338 1 1249 . 1 1 106 106 MET CG C 13 30.263 0.300 . 1 . . . . 106 MET CG . 11338 1 1250 . 1 1 106 106 MET N N 15 117.250 0.300 . 1 . . . . 106 MET N . 11338 1 1251 . 1 1 107 107 ILE H H 1 9.811 0.030 . 1 . . . . 107 ILE H . 11338 1 1252 . 1 1 107 107 ILE HA H 1 3.499 0.030 . 1 . . . . 107 ILE HA . 11338 1 1253 . 1 1 107 107 ILE HB H 1 2.181 0.030 . 1 . . . . 107 ILE HB . 11338 1 1254 . 1 1 107 107 ILE HD11 H 1 0.083 0.030 . 1 . . . . 107 ILE HD1 . 11338 1 1255 . 1 1 107 107 ILE HD12 H 1 0.083 0.030 . 1 . . . . 107 ILE HD1 . 11338 1 1256 . 1 1 107 107 ILE HD13 H 1 0.083 0.030 . 1 . . . . 107 ILE HD1 . 11338 1 1257 . 1 1 107 107 ILE HG12 H 1 2.499 0.030 . 2 . . . . 107 ILE HG12 . 11338 1 1258 . 1 1 107 107 ILE HG13 H 1 1.368 0.030 . 2 . . . . 107 ILE HG13 . 11338 1 1259 . 1 1 107 107 ILE HG21 H 1 0.514 0.030 . 1 . . . . 107 ILE HG2 . 11338 1 1260 . 1 1 107 107 ILE HG22 H 1 0.514 0.030 . 1 . . . . 107 ILE HG2 . 11338 1 1261 . 1 1 107 107 ILE HG23 H 1 0.514 0.030 . 1 . . . . 107 ILE HG2 . 11338 1 1262 . 1 1 107 107 ILE C C 13 177.636 0.300 . 1 . . . . 107 ILE C . 11338 1 1263 . 1 1 107 107 ILE CA C 13 63.874 0.300 . 1 . . . . 107 ILE CA . 11338 1 1264 . 1 1 107 107 ILE CB C 13 33.762 0.300 . 1 . . . . 107 ILE CB . 11338 1 1265 . 1 1 107 107 ILE CD1 C 13 7.169 0.300 . 1 . . . . 107 ILE CD1 . 11338 1 1266 . 1 1 107 107 ILE CG1 C 13 26.682 0.300 . 1 . . . . 107 ILE CG1 . 11338 1 1267 . 1 1 107 107 ILE CG2 C 13 19.032 0.300 . 1 . . . . 107 ILE CG2 . 11338 1 1268 . 1 1 107 107 ILE N N 15 126.112 0.300 . 1 . . . . 107 ILE N . 11338 1 1269 . 1 1 108 108 PHE H H 1 9.191 0.030 . 1 . . . . 108 PHE H . 11338 1 1270 . 1 1 108 108 PHE HA H 1 4.534 0.030 . 1 . . . . 108 PHE HA . 11338 1 1271 . 1 1 108 108 PHE HB2 H 1 3.095 0.030 . 1 . . . . 108 PHE HB2 . 11338 1 1272 . 1 1 108 108 PHE HB3 H 1 3.095 0.030 . 1 . . . . 108 PHE HB3 . 11338 1 1273 . 1 1 108 108 PHE HD1 H 1 7.364 0.030 . 1 . . . . 108 PHE HD1 . 11338 1 1274 . 1 1 108 108 PHE HD2 H 1 7.364 0.030 . 1 . . . . 108 PHE HD2 . 11338 1 1275 . 1 1 108 108 PHE HE1 H 1 7.247 0.030 . 1 . . . . 108 PHE HE1 . 11338 1 1276 . 1 1 108 108 PHE HE2 H 1 7.247 0.030 . 1 . . . . 108 PHE HE2 . 11338 1 1277 . 1 1 108 108 PHE C C 13 178.636 0.300 . 1 . . . . 108 PHE C . 11338 1 1278 . 1 1 108 108 PHE CA C 13 61.473 0.300 . 1 . . . . 108 PHE CA . 11338 1 1279 . 1 1 108 108 PHE CB C 13 38.779 0.300 . 1 . . . . 108 PHE CB . 11338 1 1280 . 1 1 108 108 PHE CD1 C 13 132.091 0.300 . 1 . . . . 108 PHE CD1 . 11338 1 1281 . 1 1 108 108 PHE CD2 C 13 132.091 0.300 . 1 . . . . 108 PHE CD2 . 11338 1 1282 . 1 1 108 108 PHE CE1 C 13 131.226 0.300 . 1 . . . . 108 PHE CE1 . 11338 1 1283 . 1 1 108 108 PHE CE2 C 13 131.226 0.300 . 1 . . . . 108 PHE CE2 . 11338 1 1284 . 1 1 108 108 PHE N N 15 118.912 0.300 . 1 . . . . 108 PHE N . 11338 1 1285 . 1 1 109 109 THR H H 1 7.832 0.030 . 1 . . . . 109 THR H . 11338 1 1286 . 1 1 109 109 THR HA H 1 3.673 0.030 . 1 . . . . 109 THR HA . 11338 1 1287 . 1 1 109 109 THR HB H 1 4.267 0.030 . 1 . . . . 109 THR HB . 11338 1 1288 . 1 1 109 109 THR HG21 H 1 1.262 0.030 . 1 . . . . 109 THR HG2 . 11338 1 1289 . 1 1 109 109 THR HG22 H 1 1.262 0.030 . 1 . . . . 109 THR HG2 . 11338 1 1290 . 1 1 109 109 THR HG23 H 1 1.262 0.030 . 1 . . . . 109 THR HG2 . 11338 1 1291 . 1 1 109 109 THR C C 13 176.429 0.300 . 1 . . . . 109 THR C . 11338 1 1292 . 1 1 109 109 THR CA C 13 66.565 0.300 . 1 . . . . 109 THR CA . 11338 1 1293 . 1 1 109 109 THR CB C 13 68.480 0.300 . 1 . . . . 109 THR CB . 11338 1 1294 . 1 1 109 109 THR CG2 C 13 22.278 0.300 . 1 . . . . 109 THR CG2 . 11338 1 1295 . 1 1 109 109 THR N N 15 119.391 0.300 . 1 . . . . 109 THR N . 11338 1 1296 . 1 1 110 110 LEU H H 1 8.473 0.030 . 1 . . . . 110 LEU H . 11338 1 1297 . 1 1 110 110 LEU HA H 1 3.822 0.030 . 1 . . . . 110 LEU HA . 11338 1 1298 . 1 1 110 110 LEU HB2 H 1 1.976 0.030 . 2 . . . . 110 LEU HB2 . 11338 1 1299 . 1 1 110 110 LEU HB3 H 1 1.393 0.030 . 2 . . . . 110 LEU HB3 . 11338 1 1300 . 1 1 110 110 LEU HD11 H 1 0.867 0.030 . 1 . . . . 110 LEU HD1 . 11338 1 1301 . 1 1 110 110 LEU HD12 H 1 0.867 0.030 . 1 . . . . 110 LEU HD1 . 11338 1 1302 . 1 1 110 110 LEU HD13 H 1 0.867 0.030 . 1 . . . . 110 LEU HD1 . 11338 1 1303 . 1 1 110 110 LEU HD21 H 1 0.778 0.030 . 1 . . . . 110 LEU HD2 . 11338 1 1304 . 1 1 110 110 LEU HD22 H 1 0.778 0.030 . 1 . . . . 110 LEU HD2 . 11338 1 1305 . 1 1 110 110 LEU HD23 H 1 0.778 0.030 . 1 . . . . 110 LEU HD2 . 11338 1 1306 . 1 1 110 110 LEU HG H 1 1.985 0.030 . 1 . . . . 110 LEU HG . 11338 1 1307 . 1 1 110 110 LEU C C 13 178.348 0.300 . 1 . . . . 110 LEU C . 11338 1 1308 . 1 1 110 110 LEU CA C 13 58.986 0.300 . 1 . . . . 110 LEU CA . 11338 1 1309 . 1 1 110 110 LEU CB C 13 40.701 0.300 . 1 . . . . 110 LEU CB . 11338 1 1310 . 1 1 110 110 LEU CD1 C 13 25.015 0.300 . 2 . . . . 110 LEU CD1 . 11338 1 1311 . 1 1 110 110 LEU CD2 C 13 23.028 0.300 . 2 . . . . 110 LEU CD2 . 11338 1 1312 . 1 1 110 110 LEU CG C 13 27.572 0.300 . 1 . . . . 110 LEU CG . 11338 1 1313 . 1 1 110 110 LEU N N 15 122.476 0.300 . 1 . . . . 110 LEU N . 11338 1 1314 . 1 1 111 111 VAL H H 1 9.027 0.030 . 1 . . . . 111 VAL H . 11338 1 1315 . 1 1 111 111 VAL HA H 1 3.256 0.030 . 1 . . . . 111 VAL HA . 11338 1 1316 . 1 1 111 111 VAL HB H 1 2.274 0.030 . 1 . . . . 111 VAL HB . 11338 1 1317 . 1 1 111 111 VAL HG11 H 1 0.953 0.030 . 1 . . . . 111 VAL HG1 . 11338 1 1318 . 1 1 111 111 VAL HG12 H 1 0.953 0.030 . 1 . . . . 111 VAL HG1 . 11338 1 1319 . 1 1 111 111 VAL HG13 H 1 0.953 0.030 . 1 . . . . 111 VAL HG1 . 11338 1 1320 . 1 1 111 111 VAL HG21 H 1 0.819 0.030 . 1 . . . . 111 VAL HG2 . 11338 1 1321 . 1 1 111 111 VAL HG22 H 1 0.819 0.030 . 1 . . . . 111 VAL HG2 . 11338 1 1322 . 1 1 111 111 VAL HG23 H 1 0.819 0.030 . 1 . . . . 111 VAL HG2 . 11338 1 1323 . 1 1 111 111 VAL C C 13 178.185 0.300 . 1 . . . . 111 VAL C . 11338 1 1324 . 1 1 111 111 VAL CA C 13 67.747 0.300 . 1 . . . . 111 VAL CA . 11338 1 1325 . 1 1 111 111 VAL CB C 13 31.262 0.300 . 1 . . . . 111 VAL CB . 11338 1 1326 . 1 1 111 111 VAL CG1 C 13 24.749 0.300 . 2 . . . . 111 VAL CG1 . 11338 1 1327 . 1 1 111 111 VAL CG2 C 13 22.403 0.300 . 2 . . . . 111 VAL CG2 . 11338 1 1328 . 1 1 111 111 VAL N N 15 119.067 0.300 . 1 . . . . 111 VAL N . 11338 1 1329 . 1 1 112 112 THR H H 1 8.201 0.030 . 1 . . . . 112 THR H . 11338 1 1330 . 1 1 112 112 THR HA H 1 3.745 0.030 . 1 . . . . 112 THR HA . 11338 1 1331 . 1 1 112 112 THR HB H 1 4.031 0.030 . 1 . . . . 112 THR HB . 11338 1 1332 . 1 1 112 112 THR HG21 H 1 1.090 0.030 . 1 . . . . 112 THR HG2 . 11338 1 1333 . 1 1 112 112 THR HG22 H 1 1.090 0.030 . 1 . . . . 112 THR HG2 . 11338 1 1334 . 1 1 112 112 THR HG23 H 1 1.090 0.030 . 1 . . . . 112 THR HG2 . 11338 1 1335 . 1 1 112 112 THR C C 13 175.815 0.300 . 1 . . . . 112 THR C . 11338 1 1336 . 1 1 112 112 THR CA C 13 67.135 0.300 . 1 . . . . 112 THR CA . 11338 1 1337 . 1 1 112 112 THR CB C 13 68.604 0.300 . 1 . . . . 112 THR CB . 11338 1 1338 . 1 1 112 112 THR CG2 C 13 21.033 0.300 . 1 . . . . 112 THR CG2 . 11338 1 1339 . 1 1 112 112 THR N N 15 116.555 0.300 . 1 . . . . 112 THR N . 11338 1 1340 . 1 1 113 113 ALA H H 1 7.640 0.030 . 1 . . . . 113 ALA H . 11338 1 1341 . 1 1 113 113 ALA HA H 1 4.175 0.030 . 1 . . . . 113 ALA HA . 11338 1 1342 . 1 1 113 113 ALA HB1 H 1 1.457 0.030 . 1 . . . . 113 ALA HB . 11338 1 1343 . 1 1 113 113 ALA HB2 H 1 1.457 0.030 . 1 . . . . 113 ALA HB . 11338 1 1344 . 1 1 113 113 ALA HB3 H 1 1.457 0.030 . 1 . . . . 113 ALA HB . 11338 1 1345 . 1 1 113 113 ALA C C 13 180.947 0.300 . 1 . . . . 113 ALA C . 11338 1 1346 . 1 1 113 113 ALA CA C 13 55.109 0.300 . 1 . . . . 113 ALA CA . 11338 1 1347 . 1 1 113 113 ALA CB C 13 17.023 0.300 . 1 . . . . 113 ALA CB . 11338 1 1348 . 1 1 113 113 ALA N N 15 123.520 0.300 . 1 . . . . 113 ALA N . 11338 1 1349 . 1 1 114 114 VAL H H 1 8.047 0.030 . 1 . . . . 114 VAL H . 11338 1 1350 . 1 1 114 114 VAL HA H 1 3.416 0.030 . 1 . . . . 114 VAL HA . 11338 1 1351 . 1 1 114 114 VAL HB H 1 2.276 0.030 . 1 . . . . 114 VAL HB . 11338 1 1352 . 1 1 114 114 VAL HG11 H 1 0.856 0.030 . 1 . . . . 114 VAL HG1 . 11338 1 1353 . 1 1 114 114 VAL HG12 H 1 0.856 0.030 . 1 . . . . 114 VAL HG1 . 11338 1 1354 . 1 1 114 114 VAL HG13 H 1 0.856 0.030 . 1 . . . . 114 VAL HG1 . 11338 1 1355 . 1 1 114 114 VAL HG21 H 1 1.038 0.030 . 1 . . . . 114 VAL HG2 . 11338 1 1356 . 1 1 114 114 VAL HG22 H 1 1.038 0.030 . 1 . . . . 114 VAL HG2 . 11338 1 1357 . 1 1 114 114 VAL HG23 H 1 1.038 0.030 . 1 . . . . 114 VAL HG2 . 11338 1 1358 . 1 1 114 114 VAL C C 13 176.768 0.300 . 1 . . . . 114 VAL C . 11338 1 1359 . 1 1 114 114 VAL CA C 13 67.343 0.300 . 1 . . . . 114 VAL CA . 11338 1 1360 . 1 1 114 114 VAL CB C 13 31.257 0.300 . 1 . . . . 114 VAL CB . 11338 1 1361 . 1 1 114 114 VAL CG1 C 13 21.528 0.300 . 2 . . . . 114 VAL CG1 . 11338 1 1362 . 1 1 114 114 VAL CG2 C 13 24.266 0.300 . 2 . . . . 114 VAL CG2 . 11338 1 1363 . 1 1 114 114 VAL N N 15 120.063 0.300 . 1 . . . . 114 VAL N . 11338 1 1364 . 1 1 115 115 GLN H H 1 9.145 0.030 . 1 . . . . 115 GLN H . 11338 1 1365 . 1 1 115 115 GLN HA H 1 3.640 0.030 . 1 . . . . 115 GLN HA . 11338 1 1366 . 1 1 115 115 GLN HB2 H 1 2.518 0.030 . 2 . . . . 115 GLN HB2 . 11338 1 1367 . 1 1 115 115 GLN HB3 H 1 2.090 0.030 . 2 . . . . 115 GLN HB3 . 11338 1 1368 . 1 1 115 115 GLN HE21 H 1 7.492 0.030 . 2 . . . . 115 GLN HE21 . 11338 1 1369 . 1 1 115 115 GLN HE22 H 1 7.015 0.030 . 2 . . . . 115 GLN HE22 . 11338 1 1370 . 1 1 115 115 GLN HG2 H 1 2.416 0.030 . 2 . . . . 115 GLN HG2 . 11338 1 1371 . 1 1 115 115 GLN HG3 H 1 2.177 0.030 . 2 . . . . 115 GLN HG3 . 11338 1 1372 . 1 1 115 115 GLN C C 13 177.946 0.300 . 1 . . . . 115 GLN C . 11338 1 1373 . 1 1 115 115 GLN CA C 13 59.512 0.300 . 1 . . . . 115 GLN CA . 11338 1 1374 . 1 1 115 115 GLN CB C 13 29.241 0.300 . 1 . . . . 115 GLN CB . 11338 1 1375 . 1 1 115 115 GLN CG C 13 34.273 0.300 . 1 . . . . 115 GLN CG . 11338 1 1376 . 1 1 115 115 GLN N N 15 121.614 0.300 . 1 . . . . 115 GLN N . 11338 1 1377 . 1 1 115 115 GLN NE2 N 15 114.162 0.300 . 1 . . . . 115 GLN NE2 . 11338 1 1378 . 1 1 116 116 GLU H H 1 8.006 0.030 . 1 . . . . 116 GLU H . 11338 1 1379 . 1 1 116 116 GLU HA H 1 4.063 0.030 . 1 . . . . 116 GLU HA . 11338 1 1380 . 1 1 116 116 GLU HB2 H 1 2.107 0.030 . 1 . . . . 116 GLU HB2 . 11338 1 1381 . 1 1 116 116 GLU HB3 H 1 2.107 0.030 . 1 . . . . 116 GLU HB3 . 11338 1 1382 . 1 1 116 116 GLU HG2 H 1 2.490 0.030 . 2 . . . . 116 GLU HG2 . 11338 1 1383 . 1 1 116 116 GLU HG3 H 1 2.263 0.030 . 2 . . . . 116 GLU HG3 . 11338 1 1384 . 1 1 116 116 GLU C C 13 179.231 0.300 . 1 . . . . 116 GLU C . 11338 1 1385 . 1 1 116 116 GLU CA C 13 59.500 0.300 . 1 . . . . 116 GLU CA . 11338 1 1386 . 1 1 116 116 GLU CB C 13 29.403 0.300 . 1 . . . . 116 GLU CB . 11338 1 1387 . 1 1 116 116 GLU CG C 13 36.365 0.300 . 1 . . . . 116 GLU CG . 11338 1 1388 . 1 1 116 116 GLU N N 15 117.398 0.300 . 1 . . . . 116 GLU N . 11338 1 1389 . 1 1 117 117 LYS H H 1 7.683 0.030 . 1 . . . . 117 LYS H . 11338 1 1390 . 1 1 117 117 LYS HA H 1 4.324 0.030 . 1 . . . . 117 LYS HA . 11338 1 1391 . 1 1 117 117 LYS HB2 H 1 2.131 0.030 . 2 . . . . 117 LYS HB2 . 11338 1 1392 . 1 1 117 117 LYS HB3 H 1 1.857 0.030 . 2 . . . . 117 LYS HB3 . 11338 1 1393 . 1 1 117 117 LYS HD2 H 1 2.000 0.030 . 2 . . . . 117 LYS HD2 . 11338 1 1394 . 1 1 117 117 LYS HD3 H 1 1.697 0.030 . 2 . . . . 117 LYS HD3 . 11338 1 1395 . 1 1 117 117 LYS HE2 H 1 2.822 0.030 . 1 . . . . 117 LYS HE2 . 11338 1 1396 . 1 1 117 117 LYS HE3 H 1 2.822 0.030 . 1 . . . . 117 LYS HE3 . 11338 1 1397 . 1 1 117 117 LYS HG2 H 1 1.340 0.030 . 1 . . . . 117 LYS HG2 . 11338 1 1398 . 1 1 117 117 LYS HG3 H 1 1.340 0.030 . 1 . . . . 117 LYS HG3 . 11338 1 1399 . 1 1 117 117 LYS C C 13 178.435 0.300 . 1 . . . . 117 LYS C . 11338 1 1400 . 1 1 117 117 LYS CA C 13 57.479 0.300 . 1 . . . . 117 LYS CA . 11338 1 1401 . 1 1 117 117 LYS CB C 13 31.024 0.300 . 1 . . . . 117 LYS CB . 11338 1 1402 . 1 1 117 117 LYS CD C 13 27.574 0.300 . 1 . . . . 117 LYS CD . 11338 1 1403 . 1 1 117 117 LYS CE C 13 42.380 0.300 . 1 . . . . 117 LYS CE . 11338 1 1404 . 1 1 117 117 LYS CG C 13 24.629 0.300 . 1 . . . . 117 LYS CG . 11338 1 1405 . 1 1 117 117 LYS N N 15 121.612 0.300 . 1 . . . . 117 LYS N . 11338 1 1406 . 1 1 118 118 LEU H H 1 9.048 0.030 . 1 . . . . 118 LEU H . 11338 1 1407 . 1 1 118 118 LEU HA H 1 3.933 0.030 . 1 . . . . 118 LEU HA . 11338 1 1408 . 1 1 118 118 LEU HB2 H 1 1.823 0.030 . 2 . . . . 118 LEU HB2 . 11338 1 1409 . 1 1 118 118 LEU HB3 H 1 1.232 0.030 . 2 . . . . 118 LEU HB3 . 11338 1 1410 . 1 1 118 118 LEU HD11 H 1 0.757 0.030 . 1 . . . . 118 LEU HD1 . 11338 1 1411 . 1 1 118 118 LEU HD12 H 1 0.757 0.030 . 1 . . . . 118 LEU HD1 . 11338 1 1412 . 1 1 118 118 LEU HD13 H 1 0.757 0.030 . 1 . . . . 118 LEU HD1 . 11338 1 1413 . 1 1 118 118 LEU HD21 H 1 0.707 0.030 . 1 . . . . 118 LEU HD2 . 11338 1 1414 . 1 1 118 118 LEU HD22 H 1 0.707 0.030 . 1 . . . . 118 LEU HD2 . 11338 1 1415 . 1 1 118 118 LEU HD23 H 1 0.707 0.030 . 1 . . . . 118 LEU HD2 . 11338 1 1416 . 1 1 118 118 LEU HG H 1 1.971 0.030 . 1 . . . . 118 LEU HG . 11338 1 1417 . 1 1 118 118 LEU C C 13 178.420 0.300 . 1 . . . . 118 LEU C . 11338 1 1418 . 1 1 118 118 LEU CA C 13 58.251 0.300 . 1 . . . . 118 LEU CA . 11338 1 1419 . 1 1 118 118 LEU CB C 13 40.012 0.300 . 1 . . . . 118 LEU CB . 11338 1 1420 . 1 1 118 118 LEU CD1 C 13 26.530 0.300 . 2 . . . . 118 LEU CD1 . 11338 1 1421 . 1 1 118 118 LEU CD2 C 13 22.508 0.300 . 2 . . . . 118 LEU CD2 . 11338 1 1422 . 1 1 118 118 LEU CG C 13 26.307 0.300 . 1 . . . . 118 LEU CG . 11338 1 1423 . 1 1 118 118 LEU N N 15 119.083 0.300 . 1 . . . . 118 LEU N . 11338 1 1424 . 1 1 119 119 ASN H H 1 7.899 0.030 . 1 . . . . 119 ASN H . 11338 1 1425 . 1 1 119 119 ASN HA H 1 4.533 0.030 . 1 . . . . 119 ASN HA . 11338 1 1426 . 1 1 119 119 ASN HB2 H 1 3.018 0.030 . 2 . . . . 119 ASN HB2 . 11338 1 1427 . 1 1 119 119 ASN HB3 H 1 2.897 0.030 . 2 . . . . 119 ASN HB3 . 11338 1 1428 . 1 1 119 119 ASN HD21 H 1 7.608 0.030 . 2 . . . . 119 ASN HD21 . 11338 1 1429 . 1 1 119 119 ASN HD22 H 1 7.284 0.030 . 2 . . . . 119 ASN HD22 . 11338 1 1430 . 1 1 119 119 ASN C C 13 177.661 0.300 . 1 . . . . 119 ASN C . 11338 1 1431 . 1 1 119 119 ASN CA C 13 55.403 0.300 . 1 . . . . 119 ASN CA . 11338 1 1432 . 1 1 119 119 ASN CB C 13 37.230 0.300 . 1 . . . . 119 ASN CB . 11338 1 1433 . 1 1 119 119 ASN N N 15 116.976 0.300 . 1 . . . . 119 ASN N . 11338 1 1434 . 1 1 119 119 ASN ND2 N 15 110.748 0.300 . 1 . . . . 119 ASN ND2 . 11338 1 1435 . 1 1 120 120 GLU H H 1 7.803 0.030 . 1 . . . . 120 GLU H . 11338 1 1436 . 1 1 120 120 GLU HA H 1 4.171 0.030 . 1 . . . . 120 GLU HA . 11338 1 1437 . 1 1 120 120 GLU HB2 H 1 2.304 0.030 . 1 . . . . 120 GLU HB2 . 11338 1 1438 . 1 1 120 120 GLU HB3 H 1 2.304 0.030 . 1 . . . . 120 GLU HB3 . 11338 1 1439 . 1 1 120 120 GLU HG2 H 1 2.490 0.030 . 2 . . . . 120 GLU HG2 . 11338 1 1440 . 1 1 120 120 GLU HG3 H 1 2.167 0.030 . 2 . . . . 120 GLU HG3 . 11338 1 1441 . 1 1 120 120 GLU C C 13 179.160 0.300 . 1 . . . . 120 GLU C . 11338 1 1442 . 1 1 120 120 GLU CA C 13 59.262 0.300 . 1 . . . . 120 GLU CA . 11338 1 1443 . 1 1 120 120 GLU CB C 13 29.898 0.300 . 1 . . . . 120 GLU CB . 11338 1 1444 . 1 1 120 120 GLU CG C 13 36.499 0.300 . 1 . . . . 120 GLU CG . 11338 1 1445 . 1 1 120 120 GLU N N 15 122.184 0.300 . 1 . . . . 120 GLU N . 11338 1 1446 . 1 1 121 121 ILE H H 1 8.371 0.030 . 1 . . . . 121 ILE H . 11338 1 1447 . 1 1 121 121 ILE HA H 1 3.672 0.030 . 1 . . . . 121 ILE HA . 11338 1 1448 . 1 1 121 121 ILE HB H 1 1.985 0.030 . 1 . . . . 121 ILE HB . 11338 1 1449 . 1 1 121 121 ILE HD11 H 1 0.824 0.030 . 1 . . . . 121 ILE HD1 . 11338 1 1450 . 1 1 121 121 ILE HD12 H 1 0.824 0.030 . 1 . . . . 121 ILE HD1 . 11338 1 1451 . 1 1 121 121 ILE HD13 H 1 0.824 0.030 . 1 . . . . 121 ILE HD1 . 11338 1 1452 . 1 1 121 121 ILE HG12 H 1 1.888 0.030 . 2 . . . . 121 ILE HG12 . 11338 1 1453 . 1 1 121 121 ILE HG13 H 1 1.086 0.030 . 2 . . . . 121 ILE HG13 . 11338 1 1454 . 1 1 121 121 ILE HG21 H 1 0.894 0.030 . 1 . . . . 121 ILE HG2 . 11338 1 1455 . 1 1 121 121 ILE HG22 H 1 0.894 0.030 . 1 . . . . 121 ILE HG2 . 11338 1 1456 . 1 1 121 121 ILE HG23 H 1 0.894 0.030 . 1 . . . . 121 ILE HG2 . 11338 1 1457 . 1 1 121 121 ILE C C 13 179.237 0.300 . 1 . . . . 121 ILE C . 11338 1 1458 . 1 1 121 121 ILE CA C 13 65.513 0.300 . 1 . . . . 121 ILE CA . 11338 1 1459 . 1 1 121 121 ILE CB C 13 38.260 0.300 . 1 . . . . 121 ILE CB . 11338 1 1460 . 1 1 121 121 ILE CD1 C 13 15.021 0.300 . 1 . . . . 121 ILE CD1 . 11338 1 1461 . 1 1 121 121 ILE CG1 C 13 29.491 0.300 . 1 . . . . 121 ILE CG1 . 11338 1 1462 . 1 1 121 121 ILE CG2 C 13 17.432 0.300 . 1 . . . . 121 ILE CG2 . 11338 1 1463 . 1 1 121 121 ILE N N 15 121.131 0.300 . 1 . . . . 121 ILE N . 11338 1 1464 . 1 1 122 122 VAL H H 1 8.076 0.030 . 1 . . . . 122 VAL H . 11338 1 1465 . 1 1 122 122 VAL HA H 1 3.900 0.030 . 1 . . . . 122 VAL HA . 11338 1 1466 . 1 1 122 122 VAL HB H 1 2.202 0.030 . 1 . . . . 122 VAL HB . 11338 1 1467 . 1 1 122 122 VAL HG11 H 1 1.091 0.030 . 1 . . . . 122 VAL HG1 . 11338 1 1468 . 1 1 122 122 VAL HG12 H 1 1.091 0.030 . 1 . . . . 122 VAL HG1 . 11338 1 1469 . 1 1 122 122 VAL HG13 H 1 1.091 0.030 . 1 . . . . 122 VAL HG1 . 11338 1 1470 . 1 1 122 122 VAL HG21 H 1 1.143 0.030 . 1 . . . . 122 VAL HG2 . 11338 1 1471 . 1 1 122 122 VAL HG22 H 1 1.143 0.030 . 1 . . . . 122 VAL HG2 . 11338 1 1472 . 1 1 122 122 VAL HG23 H 1 1.143 0.030 . 1 . . . . 122 VAL HG2 . 11338 1 1473 . 1 1 122 122 VAL C C 13 177.176 0.300 . 1 . . . . 122 VAL C . 11338 1 1474 . 1 1 122 122 VAL CA C 13 65.471 0.300 . 1 . . . . 122 VAL CA . 11338 1 1475 . 1 1 122 122 VAL CB C 13 31.670 0.300 . 1 . . . . 122 VAL CB . 11338 1 1476 . 1 1 122 122 VAL CG1 C 13 20.783 0.300 . 2 . . . . 122 VAL CG1 . 11338 1 1477 . 1 1 122 122 VAL CG2 C 13 23.028 0.300 . 2 . . . . 122 VAL CG2 . 11338 1 1478 . 1 1 122 122 VAL N N 15 118.243 0.300 . 1 . . . . 122 VAL N . 11338 1 1479 . 1 1 123 123 ASP H H 1 7.450 0.030 . 1 . . . . 123 ASP H . 11338 1 1480 . 1 1 123 123 ASP HA H 1 4.596 0.030 . 1 . . . . 123 ASP HA . 11338 1 1481 . 1 1 123 123 ASP HB2 H 1 2.789 0.030 . 1 . . . . 123 ASP HB2 . 11338 1 1482 . 1 1 123 123 ASP HB3 H 1 2.789 0.030 . 1 . . . . 123 ASP HB3 . 11338 1 1483 . 1 1 123 123 ASP C C 13 177.560 0.300 . 1 . . . . 123 ASP C . 11338 1 1484 . 1 1 123 123 ASP CA C 13 56.360 0.300 . 1 . . . . 123 ASP CA . 11338 1 1485 . 1 1 123 123 ASP CB C 13 41.508 0.300 . 1 . . . . 123 ASP CB . 11338 1 1486 . 1 1 123 123 ASP N N 15 120.691 0.300 . 1 . . . . 123 ASP N . 11338 1 1487 . 1 1 124 124 GLN H H 1 7.860 0.030 . 1 . . . . 124 GLN H . 11338 1 1488 . 1 1 124 124 GLN HA H 1 4.290 0.030 . 1 . . . . 124 GLN HA . 11338 1 1489 . 1 1 124 124 GLN HB2 H 1 2.221 0.030 . 2 . . . . 124 GLN HB2 . 11338 1 1490 . 1 1 124 124 GLN HB3 H 1 2.175 0.030 . 2 . . . . 124 GLN HB3 . 11338 1 1491 . 1 1 124 124 GLN HE21 H 1 7.533 0.030 . 2 . . . . 124 GLN HE21 . 11338 1 1492 . 1 1 124 124 GLN HE22 H 1 6.913 0.030 . 2 . . . . 124 GLN HE22 . 11338 1 1493 . 1 1 124 124 GLN HG2 H 1 2.548 0.030 . 2 . . . . 124 GLN HG2 . 11338 1 1494 . 1 1 124 124 GLN HG3 H 1 2.468 0.030 . 2 . . . . 124 GLN HG3 . 11338 1 1495 . 1 1 124 124 GLN C C 13 177.736 0.300 . 1 . . . . 124 GLN C . 11338 1 1496 . 1 1 124 124 GLN CA C 13 56.502 0.300 . 1 . . . . 124 GLN CA . 11338 1 1497 . 1 1 124 124 GLN CB C 13 29.011 0.300 . 1 . . . . 124 GLN CB . 11338 1 1498 . 1 1 124 124 GLN CG C 13 34.016 0.300 . 1 . . . . 124 GLN CG . 11338 1 1499 . 1 1 124 124 GLN N N 15 116.870 0.300 . 1 . . . . 124 GLN N . 11338 1 1500 . 1 1 124 124 GLN NE2 N 15 112.475 0.300 . 1 . . . . 124 GLN NE2 . 11338 1 1501 . 1 1 125 125 ILE H H 1 7.822 0.030 . 1 . . . . 125 ILE H . 11338 1 1502 . 1 1 125 125 ILE HA H 1 3.874 0.030 . 1 . . . . 125 ILE HA . 11338 1 1503 . 1 1 125 125 ILE HB H 1 2.000 0.030 . 1 . . . . 125 ILE HB . 11338 1 1504 . 1 1 125 125 ILE HD11 H 1 0.876 0.030 . 1 . . . . 125 ILE HD1 . 11338 1 1505 . 1 1 125 125 ILE HD12 H 1 0.876 0.030 . 1 . . . . 125 ILE HD1 . 11338 1 1506 . 1 1 125 125 ILE HD13 H 1 0.876 0.030 . 1 . . . . 125 ILE HD1 . 11338 1 1507 . 1 1 125 125 ILE HG12 H 1 1.684 0.030 . 2 . . . . 125 ILE HG12 . 11338 1 1508 . 1 1 125 125 ILE HG13 H 1 1.247 0.030 . 2 . . . . 125 ILE HG13 . 11338 1 1509 . 1 1 125 125 ILE HG21 H 1 0.951 0.030 . 1 . . . . 125 ILE HG2 . 11338 1 1510 . 1 1 125 125 ILE HG22 H 1 0.951 0.030 . 1 . . . . 125 ILE HG2 . 11338 1 1511 . 1 1 125 125 ILE HG23 H 1 0.951 0.030 . 1 . . . . 125 ILE HG2 . 11338 1 1512 . 1 1 125 125 ILE C C 13 177.205 0.300 . 1 . . . . 125 ILE C . 11338 1 1513 . 1 1 125 125 ILE CA C 13 64.098 0.300 . 1 . . . . 125 ILE CA . 11338 1 1514 . 1 1 125 125 ILE CB C 13 38.232 0.300 . 1 . . . . 125 ILE CB . 11338 1 1515 . 1 1 125 125 ILE CD1 C 13 13.770 0.300 . 1 . . . . 125 ILE CD1 . 11338 1 1516 . 1 1 125 125 ILE CG1 C 13 28.474 0.300 . 1 . . . . 125 ILE CG1 . 11338 1 1517 . 1 1 125 125 ILE CG2 C 13 17.408 0.300 . 1 . . . . 125 ILE CG2 . 11338 1 1518 . 1 1 125 125 ILE N N 15 120.787 0.300 . 1 . . . . 125 ILE N . 11338 1 1519 . 1 1 126 126 LYS H H 1 8.066 0.030 . 1 . . . . 126 LYS H . 11338 1 1520 . 1 1 126 126 LYS HA H 1 4.357 0.030 . 1 . . . . 126 LYS HA . 11338 1 1521 . 1 1 126 126 LYS HB2 H 1 1.919 0.030 . 1 . . . . 126 LYS HB2 . 11338 1 1522 . 1 1 126 126 LYS HB3 H 1 1.919 0.030 . 1 . . . . 126 LYS HB3 . 11338 1 1523 . 1 1 126 126 LYS HD2 H 1 1.722 0.030 . 1 . . . . 126 LYS HD2 . 11338 1 1524 . 1 1 126 126 LYS HD3 H 1 1.722 0.030 . 1 . . . . 126 LYS HD3 . 11338 1 1525 . 1 1 126 126 LYS HE2 H 1 3.024 0.030 . 1 . . . . 126 LYS HE2 . 11338 1 1526 . 1 1 126 126 LYS HE3 H 1 3.024 0.030 . 1 . . . . 126 LYS HE3 . 11338 1 1527 . 1 1 126 126 LYS HG2 H 1 1.518 0.030 . 1 . . . . 126 LYS HG2 . 11338 1 1528 . 1 1 126 126 LYS HG3 H 1 1.518 0.030 . 1 . . . . 126 LYS HG3 . 11338 1 1529 . 1 1 126 126 LYS C C 13 177.176 0.300 . 1 . . . . 126 LYS C . 11338 1 1530 . 1 1 126 126 LYS CA C 13 57.251 0.300 . 1 . . . . 126 LYS CA . 11338 1 1531 . 1 1 126 126 LYS CB C 13 32.762 0.300 . 1 . . . . 126 LYS CB . 11338 1 1532 . 1 1 126 126 LYS CD C 13 29.198 0.300 . 1 . . . . 126 LYS CD . 11338 1 1533 . 1 1 126 126 LYS CE C 13 42.154 0.300 . 1 . . . . 126 LYS CE . 11338 1 1534 . 1 1 126 126 LYS CG C 13 24.749 0.300 . 1 . . . . 126 LYS CG . 11338 1 1535 . 1 1 126 126 LYS N N 15 120.779 0.300 . 1 . . . . 126 LYS N . 11338 1 1536 . 1 1 127 127 THR H H 1 7.988 0.030 . 1 . . . . 127 THR H . 11338 1 1537 . 1 1 127 127 THR HA H 1 4.411 0.030 . 1 . . . . 127 THR HA . 11338 1 1538 . 1 1 127 127 THR HB H 1 4.376 0.030 . 1 . . . . 127 THR HB . 11338 1 1539 . 1 1 127 127 THR HG21 H 1 1.222 0.030 . 1 . . . . 127 THR HG2 . 11338 1 1540 . 1 1 127 127 THR HG22 H 1 1.222 0.030 . 1 . . . . 127 THR HG2 . 11338 1 1541 . 1 1 127 127 THR HG23 H 1 1.222 0.030 . 1 . . . . 127 THR HG2 . 11338 1 1542 . 1 1 127 127 THR C C 13 174.084 0.300 . 1 . . . . 127 THR C . 11338 1 1543 . 1 1 127 127 THR CA C 13 61.825 0.300 . 1 . . . . 127 THR CA . 11338 1 1544 . 1 1 127 127 THR CB C 13 69.649 0.300 . 1 . . . . 127 THR CB . 11338 1 1545 . 1 1 127 127 THR CG2 C 13 21.736 0.300 . 1 . . . . 127 THR CG2 . 11338 1 1546 . 1 1 127 127 THR N N 15 112.201 0.300 . 1 . . . . 127 THR N . 11338 1 1547 . 1 1 128 128 ARG H H 1 7.669 0.030 . 1 . . . . 128 ARG H . 11338 1 1548 . 1 1 128 128 ARG HA H 1 4.135 0.030 . 1 . . . . 128 ARG HA . 11338 1 1549 . 1 1 128 128 ARG HB2 H 1 1.889 0.030 . 2 . . . . 128 ARG HB2 . 11338 1 1550 . 1 1 128 128 ARG HB3 H 1 1.773 0.030 . 2 . . . . 128 ARG HB3 . 11338 1 1551 . 1 1 128 128 ARG HD2 H 1 3.156 0.030 . 1 . . . . 128 ARG HD2 . 11338 1 1552 . 1 1 128 128 ARG HD3 H 1 3.156 0.030 . 1 . . . . 128 ARG HD3 . 11338 1 1553 . 1 1 128 128 ARG HG2 H 1 1.719 0.030 . 2 . . . . 128 ARG HG2 . 11338 1 1554 . 1 1 128 128 ARG HG3 H 1 1.665 0.030 . 2 . . . . 128 ARG HG3 . 11338 1 1555 . 1 1 128 128 ARG C C 13 181.236 0.300 . 1 . . . . 128 ARG C . 11338 1 1556 . 1 1 128 128 ARG CA C 13 58.299 0.300 . 1 . . . . 128 ARG CA . 11338 1 1557 . 1 1 128 128 ARG CB C 13 31.462 0.300 . 1 . . . . 128 ARG CB . 11338 1 1558 . 1 1 128 128 ARG CD C 13 44.013 0.300 . 1 . . . . 128 ARG CD . 11338 1 1559 . 1 1 128 128 ARG CG C 13 27.429 0.300 . 1 . . . . 128 ARG CG . 11338 1 1560 . 1 1 128 128 ARG N N 15 128.545 0.300 . 1 . . . . 128 ARG N . 11338 1 stop_ save_