data_11329 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11329 _Entry.Title ; Solution structure of the Bromodomain of human SWI/SNF related matrix associated actin dependent regulator of cromatin subfamily A member 2 ; _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 . . . 11329 2 T. Kigawa . . . 11329 3 K. Saito . . . 11329 4 N. Tochio . . . 11329 5 S. Koshiba . . . 11329 6 M. Inoue . . . 11329 7 S. Yokoyama . . . 11329 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)' . 11329 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11329 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 528 11329 '15N chemical shifts' 115 11329 '1H chemical shifts' 847 11329 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 . 11329 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2DAT 'BMRB Entry Tracking System' 11329 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11329 _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 Bromodomain of human SWI/SNF related matrix associated actin dependent regulator of cromatin subfamily A member 2 ; _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 . . . 11329 1 2 T. Kigawa . . . 11329 1 3 K. Saito . . . 11329 1 4 N. Tochio . . . 11329 1 5 S. Koshiba . . . 11329 1 6 M. Inoue . . . 11329 1 7 S. Yokoyama . . . 11329 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11329 _Assembly.ID 1 _Assembly.Name 'Possible global transcription activator SNF2L2' _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 Bromodomain 1 $entity_1 A . yes native no no . . . 11329 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 2dat . . . . . . 11329 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11329 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Bromodomain _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 ; GSSGSSGSPNPPKLTKQMNA IIDTVINYKDSSGRQLSEVF IQLPSRKELPEYYELIRKPV DFKKIKERIRNHKYRSLGDL EKDVMLLCHNAQTFNLEGSQ IYEDSIVLQSVFKSARQSGP SSG ; _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 123 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2DAT . "Solution Structure Of The Bromodomain Of Human SwiSNF Related Matrix Associated Actin Dependent Regulator Of Cromatin Subfamily" . . . . . 100.00 123 100.00 100.00 4.81e-83 . . . . 11329 1 2 no DBJ BAA05142 . "transcriptional activator hSNF2a [Homo sapiens]" . . . . . 89.43 1572 100.00 100.00 3.92e-66 . . . . 11329 1 3 no DBJ BAB27925 . "unnamed protein product [Mus musculus]" . . . . . 89.43 236 99.09 100.00 1.21e-73 . . . . 11329 1 4 no DBJ BAC04280 . "unnamed protein product [Homo sapiens]" . . . . . 89.43 278 100.00 100.00 2.53e-73 . . . . 11329 1 5 no DBJ BAE90149 . "unnamed protein product [Macaca fascicularis]" . . . . . 89.43 183 99.09 99.09 1.08e-73 . . . . 11329 1 6 no DBJ BAG60343 . "unnamed protein product [Homo sapiens]" . . . . . 89.43 276 100.00 100.00 2.46e-73 . . . . 11329 1 7 no EMBL CAA62832 . "BRM protein [Gallus gallus]" . . . . . 89.43 1568 100.00 100.00 3.40e-66 . . . . 11329 1 8 no EMBL CAH89596 . "hypothetical protein [Pongo abelii]" . . . . . 89.43 248 100.00 100.00 6.26e-74 . . . . 11329 1 9 no GB AAH22975 . "Smarca2 protein, partial [Mus musculus]" . . . . . 89.43 495 99.09 100.00 3.02e-70 . . . . 11329 1 10 no GB AAH56199 . "Smarca2 protein, partial [Mus musculus]" . . . . . 89.43 985 99.09 100.00 6.43e-67 . . . . 11329 1 11 no GB AAH75641 . "Smarca2 protein [Mus musculus]" . . . . . 89.43 1577 99.09 100.00 8.12e-66 . . . . 11329 1 12 no GB AAI42522 . "SMARCA2 protein [Bos taurus]" . . . . . 89.43 1554 100.00 100.00 3.86e-66 . . . . 11329 1 13 no GB AAI56186 . "SWI/SNF related, matrix associated, actin dependent regulator of chromatin, subfamily a, member 2, partial [synthetic construct" . . . . . 89.43 1572 100.00 100.00 4.24e-66 . . . . 11329 1 14 no REF NP_001092585 . "probable global transcription activator SNF2L2 [Bos taurus]" . . . . . 89.43 1554 100.00 100.00 3.86e-66 . . . . 11329 1 15 no REF NP_001124708 . "probable global transcription activator SNF2L2 [Pongo abelii]" . . . . . 89.43 248 100.00 100.00 6.26e-74 . . . . 11329 1 16 no REF NP_001276326 . "probable global transcription activator SNF2L2 isoform c [Homo sapiens]" . . . . . 89.43 1514 100.00 100.00 3.04e-66 . . . . 11329 1 17 no REF NP_001276327 . "probable global transcription activator SNF2L2 isoform d [Homo sapiens]" . . . . . 89.43 248 100.00 100.00 7.06e-74 . . . . 11329 1 18 no REF NP_001276328 . "probable global transcription activator SNF2L2 isoform e precursor [Homo sapiens]" . . . . . 89.43 276 100.00 100.00 2.46e-73 . . . . 11329 1 19 no SP Q6DIC0 . "RecName: Full=Probable global transcription activator SNF2L2; AltName: Full=ATP-dependent helicase SMARCA2; AltName: Full=BRG1-" . . . . . 89.43 1577 99.09 100.00 8.12e-66 . . . . 11329 1 20 no TPG DAA26902 . "TPA: SWI/SNF-related matrix-associated actin-dependent regulator of chromatin a2 [Bos taurus]" . . . . . 89.43 1554 100.00 100.00 3.86e-66 . . . . 11329 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID Bromodomain . 11329 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 . 11329 1 2 . SER . 11329 1 3 . SER . 11329 1 4 . GLY . 11329 1 5 . SER . 11329 1 6 . SER . 11329 1 7 . GLY . 11329 1 8 . SER . 11329 1 9 . PRO . 11329 1 10 . ASN . 11329 1 11 . PRO . 11329 1 12 . PRO . 11329 1 13 . LYS . 11329 1 14 . LEU . 11329 1 15 . THR . 11329 1 16 . LYS . 11329 1 17 . GLN . 11329 1 18 . MET . 11329 1 19 . ASN . 11329 1 20 . ALA . 11329 1 21 . ILE . 11329 1 22 . ILE . 11329 1 23 . ASP . 11329 1 24 . THR . 11329 1 25 . VAL . 11329 1 26 . ILE . 11329 1 27 . ASN . 11329 1 28 . TYR . 11329 1 29 . LYS . 11329 1 30 . ASP . 11329 1 31 . SER . 11329 1 32 . SER . 11329 1 33 . GLY . 11329 1 34 . ARG . 11329 1 35 . GLN . 11329 1 36 . LEU . 11329 1 37 . SER . 11329 1 38 . GLU . 11329 1 39 . VAL . 11329 1 40 . PHE . 11329 1 41 . ILE . 11329 1 42 . GLN . 11329 1 43 . LEU . 11329 1 44 . PRO . 11329 1 45 . SER . 11329 1 46 . ARG . 11329 1 47 . LYS . 11329 1 48 . GLU . 11329 1 49 . LEU . 11329 1 50 . PRO . 11329 1 51 . GLU . 11329 1 52 . TYR . 11329 1 53 . TYR . 11329 1 54 . GLU . 11329 1 55 . LEU . 11329 1 56 . ILE . 11329 1 57 . ARG . 11329 1 58 . LYS . 11329 1 59 . PRO . 11329 1 60 . VAL . 11329 1 61 . ASP . 11329 1 62 . PHE . 11329 1 63 . LYS . 11329 1 64 . LYS . 11329 1 65 . ILE . 11329 1 66 . LYS . 11329 1 67 . GLU . 11329 1 68 . ARG . 11329 1 69 . ILE . 11329 1 70 . ARG . 11329 1 71 . ASN . 11329 1 72 . HIS . 11329 1 73 . LYS . 11329 1 74 . TYR . 11329 1 75 . ARG . 11329 1 76 . SER . 11329 1 77 . LEU . 11329 1 78 . GLY . 11329 1 79 . ASP . 11329 1 80 . LEU . 11329 1 81 . GLU . 11329 1 82 . LYS . 11329 1 83 . ASP . 11329 1 84 . VAL . 11329 1 85 . MET . 11329 1 86 . LEU . 11329 1 87 . LEU . 11329 1 88 . CYS . 11329 1 89 . HIS . 11329 1 90 . ASN . 11329 1 91 . ALA . 11329 1 92 . GLN . 11329 1 93 . THR . 11329 1 94 . PHE . 11329 1 95 . ASN . 11329 1 96 . LEU . 11329 1 97 . GLU . 11329 1 98 . GLY . 11329 1 99 . SER . 11329 1 100 . GLN . 11329 1 101 . ILE . 11329 1 102 . TYR . 11329 1 103 . GLU . 11329 1 104 . ASP . 11329 1 105 . SER . 11329 1 106 . ILE . 11329 1 107 . VAL . 11329 1 108 . LEU . 11329 1 109 . GLN . 11329 1 110 . SER . 11329 1 111 . VAL . 11329 1 112 . PHE . 11329 1 113 . LYS . 11329 1 114 . SER . 11329 1 115 . ALA . 11329 1 116 . ARG . 11329 1 117 . GLN . 11329 1 118 . SER . 11329 1 119 . GLY . 11329 1 120 . PRO . 11329 1 121 . SER . 11329 1 122 . SER . 11329 1 123 . GLY . 11329 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 11329 1 . SER 2 2 11329 1 . SER 3 3 11329 1 . GLY 4 4 11329 1 . SER 5 5 11329 1 . SER 6 6 11329 1 . GLY 7 7 11329 1 . SER 8 8 11329 1 . PRO 9 9 11329 1 . ASN 10 10 11329 1 . PRO 11 11 11329 1 . PRO 12 12 11329 1 . LYS 13 13 11329 1 . LEU 14 14 11329 1 . THR 15 15 11329 1 . LYS 16 16 11329 1 . GLN 17 17 11329 1 . MET 18 18 11329 1 . ASN 19 19 11329 1 . ALA 20 20 11329 1 . ILE 21 21 11329 1 . ILE 22 22 11329 1 . ASP 23 23 11329 1 . THR 24 24 11329 1 . VAL 25 25 11329 1 . ILE 26 26 11329 1 . ASN 27 27 11329 1 . TYR 28 28 11329 1 . LYS 29 29 11329 1 . ASP 30 30 11329 1 . SER 31 31 11329 1 . SER 32 32 11329 1 . GLY 33 33 11329 1 . ARG 34 34 11329 1 . GLN 35 35 11329 1 . LEU 36 36 11329 1 . SER 37 37 11329 1 . GLU 38 38 11329 1 . VAL 39 39 11329 1 . PHE 40 40 11329 1 . ILE 41 41 11329 1 . GLN 42 42 11329 1 . LEU 43 43 11329 1 . PRO 44 44 11329 1 . SER 45 45 11329 1 . ARG 46 46 11329 1 . LYS 47 47 11329 1 . GLU 48 48 11329 1 . LEU 49 49 11329 1 . PRO 50 50 11329 1 . GLU 51 51 11329 1 . TYR 52 52 11329 1 . TYR 53 53 11329 1 . GLU 54 54 11329 1 . LEU 55 55 11329 1 . ILE 56 56 11329 1 . ARG 57 57 11329 1 . LYS 58 58 11329 1 . PRO 59 59 11329 1 . VAL 60 60 11329 1 . ASP 61 61 11329 1 . PHE 62 62 11329 1 . LYS 63 63 11329 1 . LYS 64 64 11329 1 . ILE 65 65 11329 1 . LYS 66 66 11329 1 . GLU 67 67 11329 1 . ARG 68 68 11329 1 . ILE 69 69 11329 1 . ARG 70 70 11329 1 . ASN 71 71 11329 1 . HIS 72 72 11329 1 . LYS 73 73 11329 1 . TYR 74 74 11329 1 . ARG 75 75 11329 1 . SER 76 76 11329 1 . LEU 77 77 11329 1 . GLY 78 78 11329 1 . ASP 79 79 11329 1 . LEU 80 80 11329 1 . GLU 81 81 11329 1 . LYS 82 82 11329 1 . ASP 83 83 11329 1 . VAL 84 84 11329 1 . MET 85 85 11329 1 . LEU 86 86 11329 1 . LEU 87 87 11329 1 . CYS 88 88 11329 1 . HIS 89 89 11329 1 . ASN 90 90 11329 1 . ALA 91 91 11329 1 . GLN 92 92 11329 1 . THR 93 93 11329 1 . PHE 94 94 11329 1 . ASN 95 95 11329 1 . LEU 96 96 11329 1 . GLU 97 97 11329 1 . GLY 98 98 11329 1 . SER 99 99 11329 1 . GLN 100 100 11329 1 . ILE 101 101 11329 1 . TYR 102 102 11329 1 . GLU 103 103 11329 1 . ASP 104 104 11329 1 . SER 105 105 11329 1 . ILE 106 106 11329 1 . VAL 107 107 11329 1 . LEU 108 108 11329 1 . GLN 109 109 11329 1 . SER 110 110 11329 1 . VAL 111 111 11329 1 . PHE 112 112 11329 1 . LYS 113 113 11329 1 . SER 114 114 11329 1 . ALA 115 115 11329 1 . ARG 116 116 11329 1 . GLN 117 117 11329 1 . SER 118 118 11329 1 . GLY 119 119 11329 1 . PRO 120 120 11329 1 . SER 121 121 11329 1 . SER 122 122 11329 1 . GLY 123 123 11329 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 11329 _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 . . . . . . . . . . . . . . . . . . . . . 11329 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 11329 _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 . . P050302-31 . . . . . . 11329 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11329 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.39mM Bromodomain U-15N, {13C;} 20mM d-Tris-HCl(pH {7.0);} 100mM {NaCl;} 1mM {d-DTT;} 0.02% {NaN3;} 75mM Guanidine {oxalate;} 10% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Bromodomain '[U-13C; U-15N]' . . 1 $entity_1 . protein 1.39 . . mM . . . . 11329 1 2 d-Tris-HCl 'natural abundance' . . . . . buffer 20 . . mM . . . . 11329 1 3 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 11329 1 4 d-DTT 'natural abundance' . . . . . salt 1 . . mM . . . . 11329 1 5 NaN3 'natural abundance' . . . . . salt 0.02 . . % . . . . 11329 1 6 'Guanidine oxalate' 'natural abundance' . . . . . salt 75 . . mM . . . . 11329 1 7 H2O . . . . . . solvent 90 . . % . . . . 11329 1 8 D2O . . . . . . solvent 10 . . % . . . . 11329 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 11329 _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' 195 0.1 mM 11329 1 pH 7.0 0.05 pH 11329 1 pressure 1 0.001 atm 11329 1 temperature 298 0.1 K 11329 1 stop_ save_ ############################ # Computer software used # ############################ save_XWINNMR _Software.Sf_category software _Software.Sf_framecode XWINNMR _Software.Entry_ID 11329 _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 . . 11329 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11329 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11329 _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.' . . 11329 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11329 2 stop_ save_ save_NMRview _Software.Sf_category software _Software.Sf_framecode NMRview _Software.Entry_ID 11329 _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.' . . 11329 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11329 3 stop_ save_ save_Kujira _Software.Sf_category software _Software.Sf_framecode Kujira _Software.Entry_ID 11329 _Software.ID 4 _Software.Name Kujira _Software.Version 0.9318 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 11329 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11329 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11329 _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.' . . 11329 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 11329 5 'structure solution' 11329 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 11329 _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 11329 _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 . . . 11329 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 11329 _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 . . . . . . . . . . . . . . . . 11329 1 2 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11329 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 11329 _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 . . . . . . . . . 11329 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11329 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11329 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 11329 _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 11329 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11329 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 . . 11329 1 2 $NMRPipe . . 11329 1 3 $NMRview . . 11329 1 4 $Kujira . . 11329 1 5 $CYANA . . 11329 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 8 8 SER HA H 1 4.668 0.030 . 1 . . . . 8 SER HA . 11329 1 2 . 1 1 8 8 SER HB2 H 1 3.859 0.030 . 2 . . . . 8 SER HB2 . 11329 1 3 . 1 1 8 8 SER HB3 H 1 3.787 0.030 . 2 . . . . 8 SER HB3 . 11329 1 4 . 1 1 8 8 SER CA C 13 56.356 0.300 . 1 . . . . 8 SER CA . 11329 1 5 . 1 1 8 8 SER CB C 13 63.081 0.300 . 1 . . . . 8 SER CB . 11329 1 6 . 1 1 9 9 PRO HA H 1 3.207 0.030 . 1 . . . . 9 PRO HA . 11329 1 7 . 1 1 9 9 PRO HB2 H 1 1.807 0.030 . 2 . . . . 9 PRO HB2 . 11329 1 8 . 1 1 9 9 PRO HB3 H 1 1.673 0.030 . 2 . . . . 9 PRO HB3 . 11329 1 9 . 1 1 9 9 PRO HD2 H 1 3.705 0.030 . 2 . . . . 9 PRO HD2 . 11329 1 10 . 1 1 9 9 PRO HD3 H 1 3.573 0.030 . 2 . . . . 9 PRO HD3 . 11329 1 11 . 1 1 9 9 PRO HG2 H 1 1.928 0.030 . 2 . . . . 9 PRO HG2 . 11329 1 12 . 1 1 9 9 PRO HG3 H 1 1.873 0.030 . 2 . . . . 9 PRO HG3 . 11329 1 13 . 1 1 9 9 PRO C C 13 177.362 0.300 . 1 . . . . 9 PRO C . 11329 1 14 . 1 1 9 9 PRO CA C 13 62.527 0.300 . 1 . . . . 9 PRO CA . 11329 1 15 . 1 1 9 9 PRO CB C 13 31.922 0.300 . 1 . . . . 9 PRO CB . 11329 1 16 . 1 1 9 9 PRO CD C 13 50.280 0.300 . 1 . . . . 9 PRO CD . 11329 1 17 . 1 1 9 9 PRO CG C 13 27.301 0.300 . 1 . . . . 9 PRO CG . 11329 1 18 . 1 1 10 10 ASN H H 1 7.171 0.030 . 1 . . . . 10 ASN H . 11329 1 19 . 1 1 10 10 ASN HA H 1 4.973 0.030 . 1 . . . . 10 ASN HA . 11329 1 20 . 1 1 10 10 ASN HB2 H 1 2.642 0.030 . 2 . . . . 10 ASN HB2 . 11329 1 21 . 1 1 10 10 ASN HB3 H 1 2.538 0.030 . 2 . . . . 10 ASN HB3 . 11329 1 22 . 1 1 10 10 ASN HD21 H 1 8.212 0.030 . 2 . . . . 10 ASN HD21 . 11329 1 23 . 1 1 10 10 ASN HD22 H 1 8.141 0.030 . 2 . . . . 10 ASN HD22 . 11329 1 24 . 1 1 10 10 ASN C C 13 173.444 0.300 . 1 . . . . 10 ASN C . 11329 1 25 . 1 1 10 10 ASN CA C 13 51.818 0.300 . 1 . . . . 10 ASN CA . 11329 1 26 . 1 1 10 10 ASN CB C 13 38.443 0.300 . 1 . . . . 10 ASN CB . 11329 1 27 . 1 1 10 10 ASN N N 15 119.915 0.300 . 1 . . . . 10 ASN N . 11329 1 28 . 1 1 10 10 ASN ND2 N 15 112.930 0.300 . 1 . . . . 10 ASN ND2 . 11329 1 29 . 1 1 11 11 PRO HA H 1 4.841 0.030 . 1 . . . . 11 PRO HA . 11329 1 30 . 1 1 11 11 PRO HB2 H 1 2.547 0.030 . 2 . . . . 11 PRO HB2 . 11329 1 31 . 1 1 11 11 PRO HB3 H 1 1.964 0.030 . 2 . . . . 11 PRO HB3 . 11329 1 32 . 1 1 11 11 PRO HD2 H 1 3.992 0.030 . 2 . . . . 11 PRO HD2 . 11329 1 33 . 1 1 11 11 PRO HD3 H 1 3.534 0.030 . 2 . . . . 11 PRO HD3 . 11329 1 34 . 1 1 11 11 PRO HG2 H 1 2.269 0.030 . 2 . . . . 11 PRO HG2 . 11329 1 35 . 1 1 11 11 PRO HG3 H 1 2.173 0.030 . 2 . . . . 11 PRO HG3 . 11329 1 36 . 1 1 11 11 PRO CA C 13 61.642 0.300 . 1 . . . . 11 PRO CA . 11329 1 37 . 1 1 11 11 PRO CB C 13 31.444 0.300 . 1 . . . . 11 PRO CB . 11329 1 38 . 1 1 11 11 PRO CD C 13 50.549 0.300 . 1 . . . . 11 PRO CD . 11329 1 39 . 1 1 11 11 PRO CG C 13 28.228 0.300 . 1 . . . . 11 PRO CG . 11329 1 40 . 1 1 12 12 PRO HA H 1 4.432 0.030 . 1 . . . . 12 PRO HA . 11329 1 41 . 1 1 12 12 PRO HB2 H 1 2.434 0.030 . 2 . . . . 12 PRO HB2 . 11329 1 42 . 1 1 12 12 PRO HB3 H 1 2.023 0.030 . 2 . . . . 12 PRO HB3 . 11329 1 43 . 1 1 12 12 PRO HD2 H 1 3.994 0.030 . 2 . . . . 12 PRO HD2 . 11329 1 44 . 1 1 12 12 PRO HD3 H 1 3.940 0.030 . 2 . . . . 12 PRO HD3 . 11329 1 45 . 1 1 12 12 PRO HG2 H 1 2.209 0.030 . 2 . . . . 12 PRO HG2 . 11329 1 46 . 1 1 12 12 PRO HG3 H 1 2.116 0.030 . 2 . . . . 12 PRO HG3 . 11329 1 47 . 1 1 12 12 PRO C C 13 178.897 0.300 . 1 . . . . 12 PRO C . 11329 1 48 . 1 1 12 12 PRO CA C 13 65.345 0.300 . 1 . . . . 12 PRO CA . 11329 1 49 . 1 1 12 12 PRO CB C 13 31.993 0.300 . 1 . . . . 12 PRO CB . 11329 1 50 . 1 1 12 12 PRO CD C 13 50.858 0.300 . 1 . . . . 12 PRO CD . 11329 1 51 . 1 1 12 12 PRO CG C 13 27.743 0.300 . 1 . . . . 12 PRO CG . 11329 1 52 . 1 1 13 13 LYS H H 1 8.733 0.030 . 1 . . . . 13 LYS H . 11329 1 53 . 1 1 13 13 LYS HA H 1 4.060 0.030 . 1 . . . . 13 LYS HA . 11329 1 54 . 1 1 13 13 LYS HB2 H 1 1.902 0.030 . 2 . . . . 13 LYS HB2 . 11329 1 55 . 1 1 13 13 LYS HB3 H 1 1.789 0.030 . 2 . . . . 13 LYS HB3 . 11329 1 56 . 1 1 13 13 LYS HD2 H 1 1.705 0.030 . 1 . . . . 13 LYS HD2 . 11329 1 57 . 1 1 13 13 LYS HD3 H 1 1.705 0.030 . 1 . . . . 13 LYS HD3 . 11329 1 58 . 1 1 13 13 LYS HE2 H 1 2.979 0.030 . 2 . . . . 13 LYS HE2 . 11329 1 59 . 1 1 13 13 LYS HE3 H 1 2.896 0.030 . 2 . . . . 13 LYS HE3 . 11329 1 60 . 1 1 13 13 LYS HG2 H 1 1.541 0.030 . 2 . . . . 13 LYS HG2 . 11329 1 61 . 1 1 13 13 LYS HG3 H 1 1.448 0.030 . 2 . . . . 13 LYS HG3 . 11329 1 62 . 1 1 13 13 LYS C C 13 178.830 0.300 . 1 . . . . 13 LYS C . 11329 1 63 . 1 1 13 13 LYS CA C 13 59.561 0.300 . 1 . . . . 13 LYS CA . 11329 1 64 . 1 1 13 13 LYS CB C 13 32.349 0.300 . 1 . . . . 13 LYS CB . 11329 1 65 . 1 1 13 13 LYS CD C 13 29.497 0.300 . 1 . . . . 13 LYS CD . 11329 1 66 . 1 1 13 13 LYS CE C 13 41.415 0.300 . 1 . . . . 13 LYS CE . 11329 1 67 . 1 1 13 13 LYS CG C 13 25.201 0.300 . 1 . . . . 13 LYS CG . 11329 1 68 . 1 1 13 13 LYS N N 15 116.509 0.300 . 1 . . . . 13 LYS N . 11329 1 69 . 1 1 14 14 LEU H H 1 7.585 0.030 . 1 . . . . 14 LEU H . 11329 1 70 . 1 1 14 14 LEU HA H 1 4.486 0.030 . 1 . . . . 14 LEU HA . 11329 1 71 . 1 1 14 14 LEU HB2 H 1 1.958 0.030 . 2 . . . . 14 LEU HB2 . 11329 1 72 . 1 1 14 14 LEU HB3 H 1 1.737 0.030 . 2 . . . . 14 LEU HB3 . 11329 1 73 . 1 1 14 14 LEU HD11 H 1 1.024 0.030 . 1 . . . . 14 LEU HD1 . 11329 1 74 . 1 1 14 14 LEU HD12 H 1 1.024 0.030 . 1 . . . . 14 LEU HD1 . 11329 1 75 . 1 1 14 14 LEU HD13 H 1 1.024 0.030 . 1 . . . . 14 LEU HD1 . 11329 1 76 . 1 1 14 14 LEU HD21 H 1 0.815 0.030 . 1 . . . . 14 LEU HD2 . 11329 1 77 . 1 1 14 14 LEU HD22 H 1 0.815 0.030 . 1 . . . . 14 LEU HD2 . 11329 1 78 . 1 1 14 14 LEU HD23 H 1 0.815 0.030 . 1 . . . . 14 LEU HD2 . 11329 1 79 . 1 1 14 14 LEU HG H 1 1.554 0.030 . 1 . . . . 14 LEU HG . 11329 1 80 . 1 1 14 14 LEU C C 13 178.488 0.300 . 1 . . . . 14 LEU C . 11329 1 81 . 1 1 14 14 LEU CA C 13 57.396 0.300 . 1 . . . . 14 LEU CA . 11329 1 82 . 1 1 14 14 LEU CB C 13 41.760 0.300 . 1 . . . . 14 LEU CB . 11329 1 83 . 1 1 14 14 LEU CD1 C 13 22.990 0.300 . 2 . . . . 14 LEU CD1 . 11329 1 84 . 1 1 14 14 LEU CD2 C 13 25.951 0.300 . 2 . . . . 14 LEU CD2 . 11329 1 85 . 1 1 14 14 LEU N N 15 121.646 0.300 . 1 . . . . 14 LEU N . 11329 1 86 . 1 1 15 15 THR H H 1 7.702 0.030 . 1 . . . . 15 THR H . 11329 1 87 . 1 1 15 15 THR HA H 1 3.711 0.030 . 1 . . . . 15 THR HA . 11329 1 88 . 1 1 15 15 THR HB H 1 4.103 0.030 . 1 . . . . 15 THR HB . 11329 1 89 . 1 1 15 15 THR HG21 H 1 1.288 0.030 . 1 . . . . 15 THR HG2 . 11329 1 90 . 1 1 15 15 THR HG22 H 1 1.288 0.030 . 1 . . . . 15 THR HG2 . 11329 1 91 . 1 1 15 15 THR HG23 H 1 1.288 0.030 . 1 . . . . 15 THR HG2 . 11329 1 92 . 1 1 15 15 THR C C 13 175.874 0.300 . 1 . . . . 15 THR C . 11329 1 93 . 1 1 15 15 THR CA C 13 68.173 0.300 . 1 . . . . 15 THR CA . 11329 1 94 . 1 1 15 15 THR CB C 13 69.160 0.300 . 1 . . . . 15 THR CB . 11329 1 95 . 1 1 15 15 THR CG2 C 13 22.297 0.300 . 1 . . . . 15 THR CG2 . 11329 1 96 . 1 1 15 15 THR N N 15 117.621 0.300 . 1 . . . . 15 THR N . 11329 1 97 . 1 1 16 16 LYS H H 1 8.285 0.030 . 1 . . . . 16 LYS H . 11329 1 98 . 1 1 16 16 LYS HA H 1 4.157 0.030 . 1 . . . . 16 LYS HA . 11329 1 99 . 1 1 16 16 LYS HB2 H 1 1.919 0.030 . 1 . . . . 16 LYS HB2 . 11329 1 100 . 1 1 16 16 LYS HB3 H 1 1.919 0.030 . 1 . . . . 16 LYS HB3 . 11329 1 101 . 1 1 16 16 LYS HD2 H 1 1.704 0.030 . 1 . . . . 16 LYS HD2 . 11329 1 102 . 1 1 16 16 LYS HD3 H 1 1.704 0.030 . 1 . . . . 16 LYS HD3 . 11329 1 103 . 1 1 16 16 LYS HE2 H 1 2.977 0.030 . 1 . . . . 16 LYS HE2 . 11329 1 104 . 1 1 16 16 LYS HE3 H 1 2.977 0.030 . 1 . . . . 16 LYS HE3 . 11329 1 105 . 1 1 16 16 LYS HG2 H 1 1.572 0.030 . 2 . . . . 16 LYS HG2 . 11329 1 106 . 1 1 16 16 LYS HG3 H 1 1.438 0.030 . 2 . . . . 16 LYS HG3 . 11329 1 107 . 1 1 16 16 LYS C C 13 179.313 0.300 . 1 . . . . 16 LYS C . 11329 1 108 . 1 1 16 16 LYS CA C 13 59.876 0.300 . 1 . . . . 16 LYS CA . 11329 1 109 . 1 1 16 16 LYS CB C 13 32.547 0.300 . 1 . . . . 16 LYS CB . 11329 1 110 . 1 1 16 16 LYS CD C 13 29.486 0.300 . 1 . . . . 16 LYS CD . 11329 1 111 . 1 1 16 16 LYS CE C 13 42.174 0.300 . 1 . . . . 16 LYS CE . 11329 1 112 . 1 1 16 16 LYS CG C 13 25.284 0.300 . 1 . . . . 16 LYS CG . 11329 1 113 . 1 1 16 16 LYS N N 15 119.610 0.300 . 1 . . . . 16 LYS N . 11329 1 114 . 1 1 17 17 GLN H H 1 7.925 0.030 . 1 . . . . 17 GLN H . 11329 1 115 . 1 1 17 17 GLN HA H 1 4.179 0.030 . 1 . . . . 17 GLN HA . 11329 1 116 . 1 1 17 17 GLN HB2 H 1 2.318 0.030 . 2 . . . . 17 GLN HB2 . 11329 1 117 . 1 1 17 17 GLN HB3 H 1 2.225 0.030 . 2 . . . . 17 GLN HB3 . 11329 1 118 . 1 1 17 17 GLN HE21 H 1 7.430 0.030 . 2 . . . . 17 GLN HE21 . 11329 1 119 . 1 1 17 17 GLN HE22 H 1 6.749 0.030 . 2 . . . . 17 GLN HE22 . 11329 1 120 . 1 1 17 17 GLN HG2 H 1 2.609 0.030 . 2 . . . . 17 GLN HG2 . 11329 1 121 . 1 1 17 17 GLN HG3 H 1 2.288 0.030 . 2 . . . . 17 GLN HG3 . 11329 1 122 . 1 1 17 17 GLN C C 13 178.560 0.300 . 1 . . . . 17 GLN C . 11329 1 123 . 1 1 17 17 GLN CA C 13 59.177 0.300 . 1 . . . . 17 GLN CA . 11329 1 124 . 1 1 17 17 GLN CB C 13 28.764 0.300 . 1 . . . . 17 GLN CB . 11329 1 125 . 1 1 17 17 GLN CG C 13 33.824 0.300 . 1 . . . . 17 GLN CG . 11329 1 126 . 1 1 17 17 GLN N N 15 120.754 0.300 . 1 . . . . 17 GLN N . 11329 1 127 . 1 1 17 17 GLN NE2 N 15 110.170 0.300 . 1 . . . . 17 GLN NE2 . 11329 1 128 . 1 1 18 18 MET H H 1 8.671 0.030 . 1 . . . . 18 MET H . 11329 1 129 . 1 1 18 18 MET HA H 1 3.742 0.030 . 1 . . . . 18 MET HA . 11329 1 130 . 1 1 18 18 MET HB2 H 1 2.417 0.030 . 2 . . . . 18 MET HB2 . 11329 1 131 . 1 1 18 18 MET HB3 H 1 1.845 0.030 . 2 . . . . 18 MET HB3 . 11329 1 132 . 1 1 18 18 MET HE1 H 1 1.950 0.030 . 1 . . . . 18 MET HE . 11329 1 133 . 1 1 18 18 MET HE2 H 1 1.950 0.030 . 1 . . . . 18 MET HE . 11329 1 134 . 1 1 18 18 MET HE3 H 1 1.950 0.030 . 1 . . . . 18 MET HE . 11329 1 135 . 1 1 18 18 MET HG2 H 1 3.096 0.030 . 2 . . . . 18 MET HG2 . 11329 1 136 . 1 1 18 18 MET HG3 H 1 2.167 0.030 . 2 . . . . 18 MET HG3 . 11329 1 137 . 1 1 18 18 MET C C 13 177.545 0.300 . 1 . . . . 18 MET C . 11329 1 138 . 1 1 18 18 MET CA C 13 61.063 0.300 . 1 . . . . 18 MET CA . 11329 1 139 . 1 1 18 18 MET CB C 13 33.866 0.300 . 1 . . . . 18 MET CB . 11329 1 140 . 1 1 18 18 MET CE C 13 17.971 0.300 . 1 . . . . 18 MET CE . 11329 1 141 . 1 1 18 18 MET CG C 13 34.563 0.300 . 1 . . . . 18 MET CG . 11329 1 142 . 1 1 18 18 MET N N 15 117.224 0.300 . 1 . . . . 18 MET N . 11329 1 143 . 1 1 19 19 ASN H H 1 8.329 0.030 . 1 . . . . 19 ASN H . 11329 1 144 . 1 1 19 19 ASN HA H 1 4.472 0.030 . 1 . . . . 19 ASN HA . 11329 1 145 . 1 1 19 19 ASN HB2 H 1 2.795 0.030 . 2 . . . . 19 ASN HB2 . 11329 1 146 . 1 1 19 19 ASN HB3 H 1 2.736 0.030 . 2 . . . . 19 ASN HB3 . 11329 1 147 . 1 1 19 19 ASN HD21 H 1 7.379 0.030 . 2 . . . . 19 ASN HD21 . 11329 1 148 . 1 1 19 19 ASN HD22 H 1 7.063 0.030 . 2 . . . . 19 ASN HD22 . 11329 1 149 . 1 1 19 19 ASN C C 13 176.468 0.300 . 1 . . . . 19 ASN C . 11329 1 150 . 1 1 19 19 ASN CA C 13 56.394 0.300 . 1 . . . . 19 ASN CA . 11329 1 151 . 1 1 19 19 ASN CB C 13 38.808 0.300 . 1 . . . . 19 ASN CB . 11329 1 152 . 1 1 19 19 ASN N N 15 115.622 0.300 . 1 . . . . 19 ASN N . 11329 1 153 . 1 1 19 19 ASN ND2 N 15 114.783 0.300 . 1 . . . . 19 ASN ND2 . 11329 1 154 . 1 1 20 20 ALA H H 1 8.307 0.030 . 1 . . . . 20 ALA H . 11329 1 155 . 1 1 20 20 ALA HA H 1 4.176 0.030 . 1 . . . . 20 ALA HA . 11329 1 156 . 1 1 20 20 ALA HB1 H 1 1.518 0.030 . 1 . . . . 20 ALA HB . 11329 1 157 . 1 1 20 20 ALA HB2 H 1 1.518 0.030 . 1 . . . . 20 ALA HB . 11329 1 158 . 1 1 20 20 ALA HB3 H 1 1.518 0.030 . 1 . . . . 20 ALA HB . 11329 1 159 . 1 1 20 20 ALA C C 13 181.210 0.300 . 1 . . . . 20 ALA C . 11329 1 160 . 1 1 20 20 ALA CA C 13 55.396 0.300 . 1 . . . . 20 ALA CA . 11329 1 161 . 1 1 20 20 ALA CB C 13 18.025 0.300 . 1 . . . . 20 ALA CB . 11329 1 162 . 1 1 20 20 ALA N N 15 122.155 0.300 . 1 . . . . 20 ALA N . 11329 1 163 . 1 1 21 21 ILE H H 1 8.181 0.030 . 1 . . . . 21 ILE H . 11329 1 164 . 1 1 21 21 ILE HA H 1 3.560 0.030 . 1 . . . . 21 ILE HA . 11329 1 165 . 1 1 21 21 ILE HB H 1 1.743 0.030 . 1 . . . . 21 ILE HB . 11329 1 166 . 1 1 21 21 ILE HD11 H 1 0.690 0.030 . 1 . . . . 21 ILE HD1 . 11329 1 167 . 1 1 21 21 ILE HD12 H 1 0.690 0.030 . 1 . . . . 21 ILE HD1 . 11329 1 168 . 1 1 21 21 ILE HD13 H 1 0.690 0.030 . 1 . . . . 21 ILE HD1 . 11329 1 169 . 1 1 21 21 ILE HG12 H 1 1.883 0.030 . 2 . . . . 21 ILE HG12 . 11329 1 170 . 1 1 21 21 ILE HG13 H 1 0.650 0.030 . 2 . . . . 21 ILE HG13 . 11329 1 171 . 1 1 21 21 ILE HG21 H 1 0.601 0.030 . 1 . . . . 21 ILE HG2 . 11329 1 172 . 1 1 21 21 ILE HG22 H 1 0.601 0.030 . 1 . . . . 21 ILE HG2 . 11329 1 173 . 1 1 21 21 ILE HG23 H 1 0.601 0.030 . 1 . . . . 21 ILE HG2 . 11329 1 174 . 1 1 21 21 ILE C C 13 177.700 0.300 . 1 . . . . 21 ILE C . 11329 1 175 . 1 1 21 21 ILE CA C 13 65.416 0.300 . 1 . . . . 21 ILE CA . 11329 1 176 . 1 1 21 21 ILE CB C 13 38.570 0.300 . 1 . . . . 21 ILE CB . 11329 1 177 . 1 1 21 21 ILE CD1 C 13 15.313 0.300 . 1 . . . . 21 ILE CD1 . 11329 1 178 . 1 1 21 21 ILE CG1 C 13 29.223 0.300 . 1 . . . . 21 ILE CG1 . 11329 1 179 . 1 1 21 21 ILE CG2 C 13 18.500 0.300 . 1 . . . . 21 ILE CG2 . 11329 1 180 . 1 1 21 21 ILE N N 15 119.052 0.300 . 1 . . . . 21 ILE N . 11329 1 181 . 1 1 22 22 ILE H H 1 8.069 0.030 . 1 . . . . 22 ILE H . 11329 1 182 . 1 1 22 22 ILE HA H 1 4.055 0.030 . 1 . . . . 22 ILE HA . 11329 1 183 . 1 1 22 22 ILE HB H 1 2.109 0.030 . 1 . . . . 22 ILE HB . 11329 1 184 . 1 1 22 22 ILE HD11 H 1 1.044 0.030 . 1 . . . . 22 ILE HD1 . 11329 1 185 . 1 1 22 22 ILE HD12 H 1 1.044 0.030 . 1 . . . . 22 ILE HD1 . 11329 1 186 . 1 1 22 22 ILE HD13 H 1 1.044 0.030 . 1 . . . . 22 ILE HD1 . 11329 1 187 . 1 1 22 22 ILE HG12 H 1 1.869 0.030 . 2 . . . . 22 ILE HG12 . 11329 1 188 . 1 1 22 22 ILE HG13 H 1 1.517 0.030 . 2 . . . . 22 ILE HG13 . 11329 1 189 . 1 1 22 22 ILE HG21 H 1 1.084 0.030 . 1 . . . . 22 ILE HG2 . 11329 1 190 . 1 1 22 22 ILE HG22 H 1 1.084 0.030 . 1 . . . . 22 ILE HG2 . 11329 1 191 . 1 1 22 22 ILE HG23 H 1 1.084 0.030 . 1 . . . . 22 ILE HG2 . 11329 1 192 . 1 1 22 22 ILE C C 13 177.471 0.300 . 1 . . . . 22 ILE C . 11329 1 193 . 1 1 22 22 ILE CA C 13 60.769 0.300 . 1 . . . . 22 ILE CA . 11329 1 194 . 1 1 22 22 ILE CB C 13 36.189 0.300 . 1 . . . . 22 ILE CB . 11329 1 195 . 1 1 22 22 ILE CD1 C 13 11.658 0.300 . 1 . . . . 22 ILE CD1 . 11329 1 196 . 1 1 22 22 ILE CG1 C 13 28.600 0.300 . 1 . . . . 22 ILE CG1 . 11329 1 197 . 1 1 22 22 ILE CG2 C 13 19.497 0.300 . 1 . . . . 22 ILE CG2 . 11329 1 198 . 1 1 22 22 ILE N N 15 118.451 0.300 . 1 . . . . 22 ILE N . 11329 1 199 . 1 1 23 23 ASP H H 1 8.977 0.030 . 1 . . . . 23 ASP H . 11329 1 200 . 1 1 23 23 ASP HA H 1 4.334 0.030 . 1 . . . . 23 ASP HA . 11329 1 201 . 1 1 23 23 ASP HB2 H 1 2.492 0.030 . 2 . . . . 23 ASP HB2 . 11329 1 202 . 1 1 23 23 ASP HB3 H 1 2.785 0.030 . 2 . . . . 23 ASP HB3 . 11329 1 203 . 1 1 23 23 ASP C C 13 178.513 0.300 . 1 . . . . 23 ASP C . 11329 1 204 . 1 1 23 23 ASP CA C 13 57.809 0.300 . 1 . . . . 23 ASP CA . 11329 1 205 . 1 1 23 23 ASP CB C 13 39.283 0.300 . 1 . . . . 23 ASP CB . 11329 1 206 . 1 1 23 23 ASP N N 15 123.360 0.300 . 1 . . . . 23 ASP N . 11329 1 207 . 1 1 24 24 THR H H 1 7.739 0.030 . 1 . . . . 24 THR H . 11329 1 208 . 1 1 24 24 THR HA H 1 3.875 0.030 . 1 . . . . 24 THR HA . 11329 1 209 . 1 1 24 24 THR HB H 1 4.449 0.030 . 1 . . . . 24 THR HB . 11329 1 210 . 1 1 24 24 THR HG21 H 1 1.169 0.030 . 1 . . . . 24 THR HG2 . 11329 1 211 . 1 1 24 24 THR HG22 H 1 1.169 0.030 . 1 . . . . 24 THR HG2 . 11329 1 212 . 1 1 24 24 THR HG23 H 1 1.169 0.030 . 1 . . . . 24 THR HG2 . 11329 1 213 . 1 1 24 24 THR C C 13 176.209 0.300 . 1 . . . . 24 THR C . 11329 1 214 . 1 1 24 24 THR CA C 13 67.090 0.300 . 1 . . . . 24 THR CA . 11329 1 215 . 1 1 24 24 THR CB C 13 68.365 0.300 . 1 . . . . 24 THR CB . 11329 1 216 . 1 1 24 24 THR CG2 C 13 21.261 0.300 . 1 . . . . 24 THR CG2 . 11329 1 217 . 1 1 24 24 THR N N 15 117.725 0.300 . 1 . . . . 24 THR N . 11329 1 218 . 1 1 25 25 VAL H H 1 7.455 0.030 . 1 . . . . 25 VAL H . 11329 1 219 . 1 1 25 25 VAL HA H 1 3.483 0.030 . 1 . . . . 25 VAL HA . 11329 1 220 . 1 1 25 25 VAL HB H 1 2.299 0.030 . 1 . . . . 25 VAL HB . 11329 1 221 . 1 1 25 25 VAL HG11 H 1 0.899 0.030 . 1 . . . . 25 VAL HG1 . 11329 1 222 . 1 1 25 25 VAL HG12 H 1 0.899 0.030 . 1 . . . . 25 VAL HG1 . 11329 1 223 . 1 1 25 25 VAL HG13 H 1 0.899 0.030 . 1 . . . . 25 VAL HG1 . 11329 1 224 . 1 1 25 25 VAL HG21 H 1 1.160 0.030 . 1 . . . . 25 VAL HG2 . 11329 1 225 . 1 1 25 25 VAL HG22 H 1 1.160 0.030 . 1 . . . . 25 VAL HG2 . 11329 1 226 . 1 1 25 25 VAL HG23 H 1 1.160 0.030 . 1 . . . . 25 VAL HG2 . 11329 1 227 . 1 1 25 25 VAL C C 13 177.219 0.300 . 1 . . . . 25 VAL C . 11329 1 228 . 1 1 25 25 VAL CA C 13 66.202 0.300 . 1 . . . . 25 VAL CA . 11329 1 229 . 1 1 25 25 VAL CB C 13 31.892 0.300 . 1 . . . . 25 VAL CB . 11329 1 230 . 1 1 25 25 VAL CG1 C 13 23.605 0.300 . 2 . . . . 25 VAL CG1 . 11329 1 231 . 1 1 25 25 VAL CG2 C 13 23.123 0.300 . 2 . . . . 25 VAL CG2 . 11329 1 232 . 1 1 25 25 VAL N N 15 120.435 0.300 . 1 . . . . 25 VAL N . 11329 1 233 . 1 1 26 26 ILE H H 1 8.782 0.030 . 1 . . . . 26 ILE H . 11329 1 234 . 1 1 26 26 ILE HA H 1 3.074 0.030 . 1 . . . . 26 ILE HA . 11329 1 235 . 1 1 26 26 ILE HB H 1 1.629 0.030 . 1 . . . . 26 ILE HB . 11329 1 236 . 1 1 26 26 ILE HD11 H 1 0.649 0.030 . 1 . . . . 26 ILE HD1 . 11329 1 237 . 1 1 26 26 ILE HD12 H 1 0.649 0.030 . 1 . . . . 26 ILE HD1 . 11329 1 238 . 1 1 26 26 ILE HD13 H 1 0.649 0.030 . 1 . . . . 26 ILE HD1 . 11329 1 239 . 1 1 26 26 ILE HG12 H 1 1.175 0.030 . 2 . . . . 26 ILE HG12 . 11329 1 240 . 1 1 26 26 ILE HG13 H 1 0.016 0.030 . 2 . . . . 26 ILE HG13 . 11329 1 241 . 1 1 26 26 ILE HG21 H 1 0.634 0.030 . 1 . . . . 26 ILE HG2 . 11329 1 242 . 1 1 26 26 ILE HG22 H 1 0.634 0.030 . 1 . . . . 26 ILE HG2 . 11329 1 243 . 1 1 26 26 ILE HG23 H 1 0.634 0.030 . 1 . . . . 26 ILE HG2 . 11329 1 244 . 1 1 26 26 ILE C C 13 177.749 0.300 . 1 . . . . 26 ILE C . 11329 1 245 . 1 1 26 26 ILE CA C 13 65.148 0.300 . 1 . . . . 26 ILE CA . 11329 1 246 . 1 1 26 26 ILE CB C 13 37.995 0.300 . 1 . . . . 26 ILE CB . 11329 1 247 . 1 1 26 26 ILE CD1 C 13 14.334 0.300 . 1 . . . . 26 ILE CD1 . 11329 1 248 . 1 1 26 26 ILE CG1 C 13 29.474 0.300 . 1 . . . . 26 ILE CG1 . 11329 1 249 . 1 1 26 26 ILE CG2 C 13 16.313 0.300 . 1 . . . . 26 ILE CG2 . 11329 1 250 . 1 1 26 26 ILE N N 15 119.111 0.300 . 1 . . . . 26 ILE N . 11329 1 251 . 1 1 27 27 ASN H H 1 8.208 0.030 . 1 . . . . 27 ASN H . 11329 1 252 . 1 1 27 27 ASN HA H 1 4.503 0.030 . 1 . . . . 27 ASN HA . 11329 1 253 . 1 1 27 27 ASN HB2 H 1 2.783 0.030 . 1 . . . . 27 ASN HB2 . 11329 1 254 . 1 1 27 27 ASN HB3 H 1 2.783 0.030 . 1 . . . . 27 ASN HB3 . 11329 1 255 . 1 1 27 27 ASN HD21 H 1 7.425 0.030 . 2 . . . . 27 ASN HD21 . 11329 1 256 . 1 1 27 27 ASN HD22 H 1 6.908 0.030 . 2 . . . . 27 ASN HD22 . 11329 1 257 . 1 1 27 27 ASN C C 13 174.975 0.300 . 1 . . . . 27 ASN C . 11329 1 258 . 1 1 27 27 ASN CA C 13 53.803 0.300 . 1 . . . . 27 ASN CA . 11329 1 259 . 1 1 27 27 ASN CB C 13 38.738 0.300 . 1 . . . . 27 ASN CB . 11329 1 260 . 1 1 27 27 ASN N N 15 113.755 0.300 . 1 . . . . 27 ASN N . 11329 1 261 . 1 1 27 27 ASN ND2 N 15 112.625 0.300 . 1 . . . . 27 ASN ND2 . 11329 1 262 . 1 1 28 28 TYR H H 1 7.070 0.030 . 1 . . . . 28 TYR H . 11329 1 263 . 1 1 28 28 TYR HA H 1 4.103 0.030 . 1 . . . . 28 TYR HA . 11329 1 264 . 1 1 28 28 TYR HB2 H 1 3.007 0.030 . 2 . . . . 28 TYR HB2 . 11329 1 265 . 1 1 28 28 TYR HB3 H 1 3.255 0.030 . 2 . . . . 28 TYR HB3 . 11329 1 266 . 1 1 28 28 TYR HD1 H 1 6.954 0.030 . 1 . . . . 28 TYR HD1 . 11329 1 267 . 1 1 28 28 TYR HD2 H 1 6.954 0.030 . 1 . . . . 28 TYR HD2 . 11329 1 268 . 1 1 28 28 TYR HE1 H 1 6.687 0.030 . 1 . . . . 28 TYR HE1 . 11329 1 269 . 1 1 28 28 TYR HE2 H 1 6.687 0.030 . 1 . . . . 28 TYR HE2 . 11329 1 270 . 1 1 28 28 TYR C C 13 174.882 0.300 . 1 . . . . 28 TYR C . 11329 1 271 . 1 1 28 28 TYR CA C 13 61.272 0.300 . 1 . . . . 28 TYR CA . 11329 1 272 . 1 1 28 28 TYR CB C 13 37.998 0.300 . 1 . . . . 28 TYR CB . 11329 1 273 . 1 1 28 28 TYR CD1 C 13 132.800 0.300 . 1 . . . . 28 TYR CD1 . 11329 1 274 . 1 1 28 28 TYR CD2 C 13 132.800 0.300 . 1 . . . . 28 TYR CD2 . 11329 1 275 . 1 1 28 28 TYR CE1 C 13 118.145 0.300 . 1 . . . . 28 TYR CE1 . 11329 1 276 . 1 1 28 28 TYR CE2 C 13 118.145 0.300 . 1 . . . . 28 TYR CE2 . 11329 1 277 . 1 1 28 28 TYR N N 15 121.444 0.300 . 1 . . . . 28 TYR N . 11329 1 278 . 1 1 29 29 LYS H H 1 7.299 0.030 . 1 . . . . 29 LYS H . 11329 1 279 . 1 1 29 29 LYS HA H 1 5.097 0.030 . 1 . . . . 29 LYS HA . 11329 1 280 . 1 1 29 29 LYS HB2 H 1 1.390 0.030 . 2 . . . . 29 LYS HB2 . 11329 1 281 . 1 1 29 29 LYS HB3 H 1 1.306 0.030 . 2 . . . . 29 LYS HB3 . 11329 1 282 . 1 1 29 29 LYS HD2 H 1 1.555 0.030 . 2 . . . . 29 LYS HD2 . 11329 1 283 . 1 1 29 29 LYS HD3 H 1 1.495 0.030 . 2 . . . . 29 LYS HD3 . 11329 1 284 . 1 1 29 29 LYS HE2 H 1 2.955 0.030 . 1 . . . . 29 LYS HE2 . 11329 1 285 . 1 1 29 29 LYS HE3 H 1 2.955 0.030 . 1 . . . . 29 LYS HE3 . 11329 1 286 . 1 1 29 29 LYS HG2 H 1 1.454 0.030 . 2 . . . . 29 LYS HG2 . 11329 1 287 . 1 1 29 29 LYS HG3 H 1 0.954 0.030 . 2 . . . . 29 LYS HG3 . 11329 1 288 . 1 1 29 29 LYS C C 13 175.372 0.300 . 1 . . . . 29 LYS C . 11329 1 289 . 1 1 29 29 LYS CA C 13 53.282 0.300 . 1 . . . . 29 LYS CA . 11329 1 290 . 1 1 29 29 LYS CB C 13 36.583 0.300 . 1 . . . . 29 LYS CB . 11329 1 291 . 1 1 29 29 LYS CD C 13 29.364 0.300 . 1 . . . . 29 LYS CD . 11329 1 292 . 1 1 29 29 LYS CE C 13 42.161 0.300 . 1 . . . . 29 LYS CE . 11329 1 293 . 1 1 29 29 LYS CG C 13 24.839 0.300 . 1 . . . . 29 LYS CG . 11329 1 294 . 1 1 29 29 LYS N N 15 127.181 0.300 . 1 . . . . 29 LYS N . 11329 1 295 . 1 1 30 30 ASP H H 1 7.953 0.030 . 1 . . . . 30 ASP H . 11329 1 296 . 1 1 30 30 ASP HA H 1 4.468 0.030 . 1 . . . . 30 ASP HA . 11329 1 297 . 1 1 30 30 ASP HB2 H 1 3.580 0.030 . 2 . . . . 30 ASP HB2 . 11329 1 298 . 1 1 30 30 ASP HB3 H 1 2.770 0.030 . 2 . . . . 30 ASP HB3 . 11329 1 299 . 1 1 30 30 ASP C C 13 178.464 0.300 . 1 . . . . 30 ASP C . 11329 1 300 . 1 1 30 30 ASP CA C 13 51.987 0.300 . 1 . . . . 30 ASP CA . 11329 1 301 . 1 1 30 30 ASP CB C 13 41.295 0.300 . 1 . . . . 30 ASP CB . 11329 1 302 . 1 1 30 30 ASP N N 15 118.670 0.300 . 1 . . . . 30 ASP N . 11329 1 303 . 1 1 31 31 SER HA H 1 4.169 0.030 . 1 . . . . 31 SER HA . 11329 1 304 . 1 1 31 31 SER HB2 H 1 4.159 0.030 . 1 . . . . 31 SER HB2 . 11329 1 305 . 1 1 31 31 SER HB3 H 1 4.159 0.030 . 1 . . . . 31 SER HB3 . 11329 1 306 . 1 1 31 31 SER C C 13 175.465 0.300 . 1 . . . . 31 SER C . 11329 1 307 . 1 1 31 31 SER CA C 13 61.278 0.300 . 1 . . . . 31 SER CA . 11329 1 308 . 1 1 31 31 SER CB C 13 62.794 0.300 . 1 . . . . 31 SER CB . 11329 1 309 . 1 1 32 32 SER H H 1 8.247 0.030 . 1 . . . . 32 SER H . 11329 1 310 . 1 1 32 32 SER HA H 1 4.607 0.030 . 1 . . . . 32 SER HA . 11329 1 311 . 1 1 32 32 SER HB2 H 1 4.090 0.030 . 2 . . . . 32 SER HB2 . 11329 1 312 . 1 1 32 32 SER HB3 H 1 3.972 0.030 . 2 . . . . 32 SER HB3 . 11329 1 313 . 1 1 32 32 SER C C 13 174.685 0.300 . 1 . . . . 32 SER C . 11329 1 314 . 1 1 32 32 SER CA C 13 58.797 0.300 . 1 . . . . 32 SER CA . 11329 1 315 . 1 1 32 32 SER CB C 13 64.499 0.300 . 1 . . . . 32 SER CB . 11329 1 316 . 1 1 32 32 SER N N 15 118.027 0.300 . 1 . . . . 32 SER N . 11329 1 317 . 1 1 33 33 GLY H H 1 8.264 0.030 . 1 . . . . 33 GLY H . 11329 1 318 . 1 1 33 33 GLY HA2 H 1 3.534 0.030 . 2 . . . . 33 GLY HA2 . 11329 1 319 . 1 1 33 33 GLY HA3 H 1 4.292 0.030 . 2 . . . . 33 GLY HA3 . 11329 1 320 . 1 1 33 33 GLY C C 13 173.018 0.300 . 1 . . . . 33 GLY C . 11329 1 321 . 1 1 33 33 GLY CA C 13 45.094 0.300 . 1 . . . . 33 GLY CA . 11329 1 322 . 1 1 33 33 GLY N N 15 110.634 0.300 . 1 . . . . 33 GLY N . 11329 1 323 . 1 1 34 34 ARG H H 1 7.926 0.030 . 1 . . . . 34 ARG H . 11329 1 324 . 1 1 34 34 ARG HA H 1 4.203 0.030 . 1 . . . . 34 ARG HA . 11329 1 325 . 1 1 34 34 ARG HB2 H 1 1.484 0.030 . 2 . . . . 34 ARG HB2 . 11329 1 326 . 1 1 34 34 ARG HB3 H 1 1.931 0.030 . 2 . . . . 34 ARG HB3 . 11329 1 327 . 1 1 34 34 ARG HD2 H 1 3.431 0.030 . 2 . . . . 34 ARG HD2 . 11329 1 328 . 1 1 34 34 ARG HD3 H 1 3.063 0.030 . 2 . . . . 34 ARG HD3 . 11329 1 329 . 1 1 34 34 ARG HE H 1 7.286 0.030 . 1 . . . . 34 ARG HE . 11329 1 330 . 1 1 34 34 ARG HG2 H 1 1.499 0.030 . 2 . . . . 34 ARG HG2 . 11329 1 331 . 1 1 34 34 ARG HG3 H 1 1.200 0.030 . 2 . . . . 34 ARG HG3 . 11329 1 332 . 1 1 34 34 ARG C C 13 175.143 0.300 . 1 . . . . 34 ARG C . 11329 1 333 . 1 1 34 34 ARG CA C 13 56.583 0.300 . 1 . . . . 34 ARG CA . 11329 1 334 . 1 1 34 34 ARG CB C 13 31.954 0.300 . 1 . . . . 34 ARG CB . 11329 1 335 . 1 1 34 34 ARG CD C 13 43.428 0.300 . 1 . . . . 34 ARG CD . 11329 1 336 . 1 1 34 34 ARG CG C 13 28.471 0.300 . 1 . . . . 34 ARG CG . 11329 1 337 . 1 1 34 34 ARG N N 15 123.469 0.300 . 1 . . . . 34 ARG N . 11329 1 338 . 1 1 34 34 ARG NE N 15 81.037 0.300 . 1 . . . . 34 ARG NE . 11329 1 339 . 1 1 35 35 GLN H H 1 8.984 0.030 . 1 . . . . 35 GLN H . 11329 1 340 . 1 1 35 35 GLN HA H 1 4.878 0.030 . 1 . . . . 35 GLN HA . 11329 1 341 . 1 1 35 35 GLN HB2 H 1 2.306 0.030 . 2 . . . . 35 GLN HB2 . 11329 1 342 . 1 1 35 35 GLN HB3 H 1 1.834 0.030 . 2 . . . . 35 GLN HB3 . 11329 1 343 . 1 1 35 35 GLN HE21 H 1 7.137 0.030 . 2 . . . . 35 GLN HE21 . 11329 1 344 . 1 1 35 35 GLN HE22 H 1 6.985 0.030 . 2 . . . . 35 GLN HE22 . 11329 1 345 . 1 1 35 35 GLN HG2 H 1 2.374 0.030 . 1 . . . . 35 GLN HG2 . 11329 1 346 . 1 1 35 35 GLN HG3 H 1 2.374 0.030 . 1 . . . . 35 GLN HG3 . 11329 1 347 . 1 1 35 35 GLN C C 13 176.135 0.300 . 1 . . . . 35 GLN C . 11329 1 348 . 1 1 35 35 GLN CA C 13 55.143 0.300 . 1 . . . . 35 GLN CA . 11329 1 349 . 1 1 35 35 GLN CB C 13 28.753 0.300 . 1 . . . . 35 GLN CB . 11329 1 350 . 1 1 35 35 GLN CG C 13 34.091 0.300 . 1 . . . . 35 GLN CG . 11329 1 351 . 1 1 35 35 GLN N N 15 127.672 0.300 . 1 . . . . 35 GLN N . 11329 1 352 . 1 1 35 35 GLN NE2 N 15 111.382 0.300 . 1 . . . . 35 GLN NE2 . 11329 1 353 . 1 1 36 36 LEU H H 1 7.171 0.030 . 1 . . . . 36 LEU H . 11329 1 354 . 1 1 36 36 LEU HA H 1 4.030 0.030 . 1 . . . . 36 LEU HA . 11329 1 355 . 1 1 36 36 LEU HB2 H 1 2.025 0.030 . 2 . . . . 36 LEU HB2 . 11329 1 356 . 1 1 36 36 LEU HB3 H 1 1.678 0.030 . 2 . . . . 36 LEU HB3 . 11329 1 357 . 1 1 36 36 LEU HD11 H 1 1.191 0.030 . 1 . . . . 36 LEU HD1 . 11329 1 358 . 1 1 36 36 LEU HD12 H 1 1.191 0.030 . 1 . . . . 36 LEU HD1 . 11329 1 359 . 1 1 36 36 LEU HD13 H 1 1.191 0.030 . 1 . . . . 36 LEU HD1 . 11329 1 360 . 1 1 36 36 LEU HD21 H 1 1.095 0.030 . 1 . . . . 36 LEU HD2 . 11329 1 361 . 1 1 36 36 LEU HD22 H 1 1.095 0.030 . 1 . . . . 36 LEU HD2 . 11329 1 362 . 1 1 36 36 LEU HD23 H 1 1.095 0.030 . 1 . . . . 36 LEU HD2 . 11329 1 363 . 1 1 36 36 LEU HG H 1 1.919 0.030 . 1 . . . . 36 LEU HG . 11329 1 364 . 1 1 36 36 LEU C C 13 178.526 0.300 . 1 . . . . 36 LEU C . 11329 1 365 . 1 1 36 36 LEU CA C 13 59.082 0.300 . 1 . . . . 36 LEU CA . 11329 1 366 . 1 1 36 36 LEU CB C 13 42.659 0.300 . 1 . . . . 36 LEU CB . 11329 1 367 . 1 1 36 36 LEU CD1 C 13 25.926 0.300 . 2 . . . . 36 LEU CD1 . 11329 1 368 . 1 1 36 36 LEU CD2 C 13 23.997 0.300 . 2 . . . . 36 LEU CD2 . 11329 1 369 . 1 1 36 36 LEU CG C 13 29.489 0.300 . 1 . . . . 36 LEU CG . 11329 1 370 . 1 1 36 36 LEU N N 15 130.644 0.300 . 1 . . . . 36 LEU N . 11329 1 371 . 1 1 37 37 SER H H 1 9.959 0.030 . 1 . . . . 37 SER H . 11329 1 372 . 1 1 37 37 SER HA H 1 4.270 0.030 . 1 . . . . 37 SER HA . 11329 1 373 . 1 1 37 37 SER HB2 H 1 3.933 0.030 . 1 . . . . 37 SER HB2 . 11329 1 374 . 1 1 37 37 SER HB3 H 1 3.933 0.030 . 1 . . . . 37 SER HB3 . 11329 1 375 . 1 1 37 37 SER C C 13 176.586 0.300 . 1 . . . . 37 SER C . 11329 1 376 . 1 1 37 37 SER CA C 13 60.548 0.300 . 1 . . . . 37 SER CA . 11329 1 377 . 1 1 37 37 SER CB C 13 63.120 0.300 . 1 . . . . 37 SER CB . 11329 1 378 . 1 1 37 37 SER N N 15 112.431 0.300 . 1 . . . . 37 SER N . 11329 1 379 . 1 1 38 38 GLU H H 1 7.422 0.030 . 1 . . . . 38 GLU H . 11329 1 380 . 1 1 38 38 GLU HA H 1 4.002 0.030 . 1 . . . . 38 GLU HA . 11329 1 381 . 1 1 38 38 GLU HB2 H 1 2.250 0.030 . 2 . . . . 38 GLU HB2 . 11329 1 382 . 1 1 38 38 GLU HB3 H 1 2.148 0.030 . 2 . . . . 38 GLU HB3 . 11329 1 383 . 1 1 38 38 GLU HG2 H 1 2.461 0.030 . 2 . . . . 38 GLU HG2 . 11329 1 384 . 1 1 38 38 GLU HG3 H 1 2.262 0.030 . 2 . . . . 38 GLU HG3 . 11329 1 385 . 1 1 38 38 GLU C C 13 178.968 0.300 . 1 . . . . 38 GLU C . 11329 1 386 . 1 1 38 38 GLU CA C 13 61.341 0.300 . 1 . . . . 38 GLU CA . 11329 1 387 . 1 1 38 38 GLU CB C 13 30.468 0.300 . 1 . . . . 38 GLU CB . 11329 1 388 . 1 1 38 38 GLU CG C 13 36.123 0.300 . 1 . . . . 38 GLU CG . 11329 1 389 . 1 1 38 38 GLU N N 15 121.490 0.300 . 1 . . . . 38 GLU N . 11329 1 390 . 1 1 39 39 VAL H H 1 8.279 0.030 . 1 . . . . 39 VAL H . 11329 1 391 . 1 1 39 39 VAL HA H 1 4.174 0.030 . 1 . . . . 39 VAL HA . 11329 1 392 . 1 1 39 39 VAL HB H 1 2.075 0.030 . 1 . . . . 39 VAL HB . 11329 1 393 . 1 1 39 39 VAL HG11 H 1 0.663 0.030 . 1 . . . . 39 VAL HG1 . 11329 1 394 . 1 1 39 39 VAL HG12 H 1 0.663 0.030 . 1 . . . . 39 VAL HG1 . 11329 1 395 . 1 1 39 39 VAL HG13 H 1 0.663 0.030 . 1 . . . . 39 VAL HG1 . 11329 1 396 . 1 1 39 39 VAL HG21 H 1 0.438 0.030 . 1 . . . . 39 VAL HG2 . 11329 1 397 . 1 1 39 39 VAL HG22 H 1 0.438 0.030 . 1 . . . . 39 VAL HG2 . 11329 1 398 . 1 1 39 39 VAL HG23 H 1 0.438 0.030 . 1 . . . . 39 VAL HG2 . 11329 1 399 . 1 1 39 39 VAL C C 13 175.779 0.300 . 1 . . . . 39 VAL C . 11329 1 400 . 1 1 39 39 VAL CA C 13 63.538 0.300 . 1 . . . . 39 VAL CA . 11329 1 401 . 1 1 39 39 VAL CB C 13 31.327 0.300 . 1 . . . . 39 VAL CB . 11329 1 402 . 1 1 39 39 VAL CG1 C 13 20.210 0.300 . 2 . . . . 39 VAL CG1 . 11329 1 403 . 1 1 39 39 VAL CG2 C 13 19.678 0.300 . 2 . . . . 39 VAL CG2 . 11329 1 404 . 1 1 39 39 VAL N N 15 112.676 0.300 . 1 . . . . 39 VAL N . 11329 1 405 . 1 1 40 40 PHE H H 1 8.280 0.030 . 1 . . . . 40 PHE H . 11329 1 406 . 1 1 40 40 PHE HA H 1 4.757 0.030 . 1 . . . . 40 PHE HA . 11329 1 407 . 1 1 40 40 PHE HB2 H 1 3.106 0.030 . 2 . . . . 40 PHE HB2 . 11329 1 408 . 1 1 40 40 PHE HB3 H 1 3.537 0.030 . 2 . . . . 40 PHE HB3 . 11329 1 409 . 1 1 40 40 PHE HD1 H 1 7.320 0.030 . 1 . . . . 40 PHE HD1 . 11329 1 410 . 1 1 40 40 PHE HD2 H 1 7.320 0.030 . 1 . . . . 40 PHE HD2 . 11329 1 411 . 1 1 40 40 PHE HE1 H 1 7.536 0.030 . 1 . . . . 40 PHE HE1 . 11329 1 412 . 1 1 40 40 PHE HE2 H 1 7.536 0.030 . 1 . . . . 40 PHE HE2 . 11329 1 413 . 1 1 40 40 PHE HZ H 1 7.230 0.030 . 1 . . . . 40 PHE HZ . 11329 1 414 . 1 1 40 40 PHE C C 13 176.142 0.300 . 1 . . . . 40 PHE C . 11329 1 415 . 1 1 40 40 PHE CA C 13 56.795 0.300 . 1 . . . . 40 PHE CA . 11329 1 416 . 1 1 40 40 PHE CB C 13 41.257 0.300 . 1 . . . . 40 PHE CB . 11329 1 417 . 1 1 40 40 PHE CD1 C 13 132.069 0.300 . 1 . . . . 40 PHE CD1 . 11329 1 418 . 1 1 40 40 PHE CD2 C 13 132.069 0.300 . 1 . . . . 40 PHE CD2 . 11329 1 419 . 1 1 40 40 PHE CE1 C 13 129.993 0.300 . 1 . . . . 40 PHE CE1 . 11329 1 420 . 1 1 40 40 PHE CE2 C 13 129.993 0.300 . 1 . . . . 40 PHE CE2 . 11329 1 421 . 1 1 40 40 PHE CZ C 13 131.361 0.300 . 1 . . . . 40 PHE CZ . 11329 1 422 . 1 1 40 40 PHE N N 15 117.998 0.300 . 1 . . . . 40 PHE N . 11329 1 423 . 1 1 41 41 ILE H H 1 7.535 0.030 . 1 . . . . 41 ILE H . 11329 1 424 . 1 1 41 41 ILE HA H 1 4.021 0.030 . 1 . . . . 41 ILE HA . 11329 1 425 . 1 1 41 41 ILE HB H 1 2.165 0.030 . 1 . . . . 41 ILE HB . 11329 1 426 . 1 1 41 41 ILE HD11 H 1 0.821 0.030 . 1 . . . . 41 ILE HD1 . 11329 1 427 . 1 1 41 41 ILE HD12 H 1 0.821 0.030 . 1 . . . . 41 ILE HD1 . 11329 1 428 . 1 1 41 41 ILE HD13 H 1 0.821 0.030 . 1 . . . . 41 ILE HD1 . 11329 1 429 . 1 1 41 41 ILE HG12 H 1 1.797 0.030 . 2 . . . . 41 ILE HG12 . 11329 1 430 . 1 1 41 41 ILE HG13 H 1 1.683 0.030 . 2 . . . . 41 ILE HG13 . 11329 1 431 . 1 1 41 41 ILE HG21 H 1 1.000 0.030 . 1 . . . . 41 ILE HG2 . 11329 1 432 . 1 1 41 41 ILE HG22 H 1 1.000 0.030 . 1 . . . . 41 ILE HG2 . 11329 1 433 . 1 1 41 41 ILE HG23 H 1 1.000 0.030 . 1 . . . . 41 ILE HG2 . 11329 1 434 . 1 1 41 41 ILE C C 13 174.522 0.300 . 1 . . . . 41 ILE C . 11329 1 435 . 1 1 41 41 ILE CA C 13 65.150 0.300 . 1 . . . . 41 ILE CA . 11329 1 436 . 1 1 41 41 ILE CB C 13 36.638 0.300 . 1 . . . . 41 ILE CB . 11329 1 437 . 1 1 41 41 ILE CD1 C 13 10.699 0.300 . 1 . . . . 41 ILE CD1 . 11329 1 438 . 1 1 41 41 ILE CG1 C 13 27.944 0.300 . 1 . . . . 41 ILE CG1 . 11329 1 439 . 1 1 41 41 ILE CG2 C 13 17.767 0.300 . 1 . . . . 41 ILE CG2 . 11329 1 440 . 1 1 41 41 ILE N N 15 122.008 0.300 . 1 . . . . 41 ILE N . 11329 1 441 . 1 1 42 42 GLN H H 1 8.194 0.030 . 1 . . . . 42 GLN H . 11329 1 442 . 1 1 42 42 GLN HA H 1 4.991 0.030 . 1 . . . . 42 GLN HA . 11329 1 443 . 1 1 42 42 GLN HB2 H 1 1.912 0.030 . 2 . . . . 42 GLN HB2 . 11329 1 444 . 1 1 42 42 GLN HB3 H 1 1.785 0.030 . 2 . . . . 42 GLN HB3 . 11329 1 445 . 1 1 42 42 GLN HE21 H 1 7.693 0.030 . 2 . . . . 42 GLN HE21 . 11329 1 446 . 1 1 42 42 GLN HE22 H 1 6.829 0.030 . 2 . . . . 42 GLN HE22 . 11329 1 447 . 1 1 42 42 GLN HG2 H 1 2.321 0.030 . 2 . . . . 42 GLN HG2 . 11329 1 448 . 1 1 42 42 GLN HG3 H 1 2.257 0.030 . 2 . . . . 42 GLN HG3 . 11329 1 449 . 1 1 42 42 GLN C C 13 175.715 0.300 . 1 . . . . 42 GLN C . 11329 1 450 . 1 1 42 42 GLN CA C 13 53.432 0.300 . 1 . . . . 42 GLN CA . 11329 1 451 . 1 1 42 42 GLN CB C 13 32.198 0.300 . 1 . . . . 42 GLN CB . 11329 1 452 . 1 1 42 42 GLN CG C 13 34.194 0.300 . 1 . . . . 42 GLN CG . 11329 1 453 . 1 1 42 42 GLN N N 15 115.873 0.300 . 1 . . . . 42 GLN N . 11329 1 454 . 1 1 42 42 GLN NE2 N 15 112.789 0.300 . 1 . . . . 42 GLN NE2 . 11329 1 455 . 1 1 43 43 LEU H H 1 10.080 0.030 . 1 . . . . 43 LEU H . 11329 1 456 . 1 1 43 43 LEU HA H 1 4.274 0.030 . 1 . . . . 43 LEU HA . 11329 1 457 . 1 1 43 43 LEU HB2 H 1 1.491 0.030 . 2 . . . . 43 LEU HB2 . 11329 1 458 . 1 1 43 43 LEU HB3 H 1 1.427 0.030 . 2 . . . . 43 LEU HB3 . 11329 1 459 . 1 1 43 43 LEU HD11 H 1 0.825 0.030 . 1 . . . . 43 LEU HD1 . 11329 1 460 . 1 1 43 43 LEU HD12 H 1 0.825 0.030 . 1 . . . . 43 LEU HD1 . 11329 1 461 . 1 1 43 43 LEU HD13 H 1 0.825 0.030 . 1 . . . . 43 LEU HD1 . 11329 1 462 . 1 1 43 43 LEU HD21 H 1 0.706 0.030 . 1 . . . . 43 LEU HD2 . 11329 1 463 . 1 1 43 43 LEU HD22 H 1 0.706 0.030 . 1 . . . . 43 LEU HD2 . 11329 1 464 . 1 1 43 43 LEU HD23 H 1 0.706 0.030 . 1 . . . . 43 LEU HD2 . 11329 1 465 . 1 1 43 43 LEU HG H 1 1.731 0.030 . 1 . . . . 43 LEU HG . 11329 1 466 . 1 1 43 43 LEU C C 13 179.232 0.300 . 1 . . . . 43 LEU C . 11329 1 467 . 1 1 43 43 LEU CA C 13 53.849 0.300 . 1 . . . . 43 LEU CA . 11329 1 468 . 1 1 43 43 LEU CB C 13 41.897 0.300 . 1 . . . . 43 LEU CB . 11329 1 469 . 1 1 43 43 LEU CD1 C 13 26.425 0.300 . 2 . . . . 43 LEU CD1 . 11329 1 470 . 1 1 43 43 LEU CD2 C 13 23.243 0.300 . 2 . . . . 43 LEU CD2 . 11329 1 471 . 1 1 43 43 LEU CG C 13 27.979 0.300 . 1 . . . . 43 LEU CG . 11329 1 472 . 1 1 43 43 LEU N N 15 130.929 0.300 . 1 . . . . 43 LEU N . 11329 1 473 . 1 1 44 44 PRO HA H 1 4.508 0.030 . 1 . . . . 44 PRO HA . 11329 1 474 . 1 1 44 44 PRO HB2 H 1 2.303 0.030 . 2 . . . . 44 PRO HB2 . 11329 1 475 . 1 1 44 44 PRO HB3 H 1 1.769 0.030 . 2 . . . . 44 PRO HB3 . 11329 1 476 . 1 1 44 44 PRO HD2 H 1 3.629 0.030 . 2 . . . . 44 PRO HD2 . 11329 1 477 . 1 1 44 44 PRO HD3 H 1 2.980 0.030 . 2 . . . . 44 PRO HD3 . 11329 1 478 . 1 1 44 44 PRO HG2 H 1 1.564 0.030 . 2 . . . . 44 PRO HG2 . 11329 1 479 . 1 1 44 44 PRO HG3 H 1 1.711 0.030 . 2 . . . . 44 PRO HG3 . 11329 1 480 . 1 1 44 44 PRO CA C 13 62.001 0.300 . 1 . . . . 44 PRO CA . 11329 1 481 . 1 1 44 44 PRO CB C 13 32.274 0.300 . 1 . . . . 44 PRO CB . 11329 1 482 . 1 1 44 44 PRO CD C 13 50.122 0.300 . 1 . . . . 44 PRO CD . 11329 1 483 . 1 1 44 44 PRO CG C 13 27.271 0.300 . 1 . . . . 44 PRO CG . 11329 1 484 . 1 1 45 45 SER H H 1 8.948 0.030 . 1 . . . . 45 SER H . 11329 1 485 . 1 1 45 45 SER HA H 1 4.367 0.030 . 1 . . . . 45 SER HA . 11329 1 486 . 1 1 45 45 SER HB2 H 1 4.253 0.030 . 2 . . . . 45 SER HB2 . 11329 1 487 . 1 1 45 45 SER HB3 H 1 3.925 0.030 . 2 . . . . 45 SER HB3 . 11329 1 488 . 1 1 45 45 SER C C 13 175.030 0.300 . 1 . . . . 45 SER C . 11329 1 489 . 1 1 45 45 SER CA C 13 57.723 0.300 . 1 . . . . 45 SER CA . 11329 1 490 . 1 1 45 45 SER CB C 13 64.661 0.300 . 1 . . . . 45 SER CB . 11329 1 491 . 1 1 45 45 SER N N 15 118.447 0.300 . 1 . . . . 45 SER N . 11329 1 492 . 1 1 46 46 ARG H H 1 8.639 0.030 . 1 . . . . 46 ARG H . 11329 1 493 . 1 1 46 46 ARG HA H 1 3.694 0.030 . 1 . . . . 46 ARG HA . 11329 1 494 . 1 1 46 46 ARG HB2 H 1 1.130 0.030 . 2 . . . . 46 ARG HB2 . 11329 1 495 . 1 1 46 46 ARG HB3 H 1 1.393 0.030 . 2 . . . . 46 ARG HB3 . 11329 1 496 . 1 1 46 46 ARG HD2 H 1 2.908 0.030 . 2 . . . . 46 ARG HD2 . 11329 1 497 . 1 1 46 46 ARG HD3 H 1 2.831 0.030 . 2 . . . . 46 ARG HD3 . 11329 1 498 . 1 1 46 46 ARG HG2 H 1 1.078 0.030 . 2 . . . . 46 ARG HG2 . 11329 1 499 . 1 1 46 46 ARG HG3 H 1 0.895 0.030 . 2 . . . . 46 ARG HG3 . 11329 1 500 . 1 1 46 46 ARG C C 13 177.515 0.300 . 1 . . . . 46 ARG C . 11329 1 501 . 1 1 46 46 ARG CA C 13 59.123 0.300 . 1 . . . . 46 ARG CA . 11329 1 502 . 1 1 46 46 ARG CB C 13 29.736 0.300 . 1 . . . . 46 ARG CB . 11329 1 503 . 1 1 46 46 ARG CD C 13 43.207 0.300 . 1 . . . . 46 ARG CD . 11329 1 504 . 1 1 46 46 ARG CG C 13 27.537 0.300 . 1 . . . . 46 ARG CG . 11329 1 505 . 1 1 46 46 ARG N N 15 122.860 0.300 . 1 . . . . 46 ARG N . 11329 1 506 . 1 1 47 47 LYS H H 1 7.651 0.030 . 1 . . . . 47 LYS H . 11329 1 507 . 1 1 47 47 LYS HA H 1 4.051 0.030 . 1 . . . . 47 LYS HA . 11329 1 508 . 1 1 47 47 LYS HB2 H 1 1.726 0.030 . 1 . . . . 47 LYS HB2 . 11329 1 509 . 1 1 47 47 LYS HB3 H 1 1.726 0.030 . 1 . . . . 47 LYS HB3 . 11329 1 510 . 1 1 47 47 LYS HD2 H 1 1.669 0.030 . 1 . . . . 47 LYS HD2 . 11329 1 511 . 1 1 47 47 LYS HD3 H 1 1.669 0.030 . 1 . . . . 47 LYS HD3 . 11329 1 512 . 1 1 47 47 LYS HE2 H 1 3.000 0.030 . 1 . . . . 47 LYS HE2 . 11329 1 513 . 1 1 47 47 LYS HE3 H 1 3.000 0.030 . 1 . . . . 47 LYS HE3 . 11329 1 514 . 1 1 47 47 LYS HG2 H 1 1.437 0.030 . 2 . . . . 47 LYS HG2 . 11329 1 515 . 1 1 47 47 LYS HG3 H 1 1.367 0.030 . 2 . . . . 47 LYS HG3 . 11329 1 516 . 1 1 47 47 LYS C C 13 178.077 0.300 . 1 . . . . 47 LYS C . 11329 1 517 . 1 1 47 47 LYS CA C 13 57.881 0.300 . 1 . . . . 47 LYS CA . 11329 1 518 . 1 1 47 47 LYS CB C 13 32.742 0.300 . 1 . . . . 47 LYS CB . 11329 1 519 . 1 1 47 47 LYS CD C 13 29.239 0.300 . 1 . . . . 47 LYS CD . 11329 1 520 . 1 1 47 47 LYS CE C 13 42.011 0.300 . 1 . . . . 47 LYS CE . 11329 1 521 . 1 1 47 47 LYS CG C 13 25.157 0.300 . 1 . . . . 47 LYS CG . 11329 1 522 . 1 1 47 47 LYS N N 15 115.359 0.300 . 1 . . . . 47 LYS N . 11329 1 523 . 1 1 48 48 GLU H H 1 7.385 0.030 . 1 . . . . 48 GLU H . 11329 1 524 . 1 1 48 48 GLU HA H 1 4.213 0.030 . 1 . . . . 48 GLU HA . 11329 1 525 . 1 1 48 48 GLU HB2 H 1 2.128 0.030 . 2 . . . . 48 GLU HB2 . 11329 1 526 . 1 1 48 48 GLU HB3 H 1 2.066 0.030 . 2 . . . . 48 GLU HB3 . 11329 1 527 . 1 1 48 48 GLU HG2 H 1 2.292 0.030 . 1 . . . . 48 GLU HG2 . 11329 1 528 . 1 1 48 48 GLU HG3 H 1 2.292 0.030 . 1 . . . . 48 GLU HG3 . 11329 1 529 . 1 1 48 48 GLU C C 13 176.668 0.300 . 1 . . . . 48 GLU C . 11329 1 530 . 1 1 48 48 GLU CA C 13 57.661 0.300 . 1 . . . . 48 GLU CA . 11329 1 531 . 1 1 48 48 GLU CB C 13 30.905 0.300 . 1 . . . . 48 GLU CB . 11329 1 532 . 1 1 48 48 GLU CG C 13 36.820 0.300 . 1 . . . . 48 GLU CG . 11329 1 533 . 1 1 48 48 GLU N N 15 117.831 0.300 . 1 . . . . 48 GLU N . 11329 1 534 . 1 1 49 49 LEU H H 1 7.903 0.030 . 1 . . . . 49 LEU H . 11329 1 535 . 1 1 49 49 LEU HA H 1 4.972 0.030 . 1 . . . . 49 LEU HA . 11329 1 536 . 1 1 49 49 LEU HB2 H 1 2.072 0.030 . 2 . . . . 49 LEU HB2 . 11329 1 537 . 1 1 49 49 LEU HB3 H 1 1.092 0.030 . 2 . . . . 49 LEU HB3 . 11329 1 538 . 1 1 49 49 LEU HD11 H 1 1.142 0.030 . 1 . . . . 49 LEU HD1 . 11329 1 539 . 1 1 49 49 LEU HD12 H 1 1.142 0.030 . 1 . . . . 49 LEU HD1 . 11329 1 540 . 1 1 49 49 LEU HD13 H 1 1.142 0.030 . 1 . . . . 49 LEU HD1 . 11329 1 541 . 1 1 49 49 LEU HD21 H 1 0.876 0.030 . 1 . . . . 49 LEU HD2 . 11329 1 542 . 1 1 49 49 LEU HD22 H 1 0.876 0.030 . 1 . . . . 49 LEU HD2 . 11329 1 543 . 1 1 49 49 LEU HD23 H 1 0.876 0.030 . 1 . . . . 49 LEU HD2 . 11329 1 544 . 1 1 49 49 LEU HG H 1 1.649 0.030 . 1 . . . . 49 LEU HG . 11329 1 545 . 1 1 49 49 LEU C C 13 172.974 0.300 . 1 . . . . 49 LEU C . 11329 1 546 . 1 1 49 49 LEU CA C 13 51.960 0.300 . 1 . . . . 49 LEU CA . 11329 1 547 . 1 1 49 49 LEU CB C 13 43.883 0.300 . 1 . . . . 49 LEU CB . 11329 1 548 . 1 1 49 49 LEU CD1 C 13 23.373 0.300 . 2 . . . . 49 LEU CD1 . 11329 1 549 . 1 1 49 49 LEU CD2 C 13 26.479 0.300 . 2 . . . . 49 LEU CD2 . 11329 1 550 . 1 1 49 49 LEU CG C 13 28.445 0.300 . 1 . . . . 49 LEU CG . 11329 1 551 . 1 1 49 49 LEU N N 15 120.514 0.300 . 1 . . . . 49 LEU N . 11329 1 552 . 1 1 50 50 PRO HA H 1 4.537 0.030 . 1 . . . . 50 PRO HA . 11329 1 553 . 1 1 50 50 PRO HB2 H 1 2.077 0.030 . 2 . . . . 50 PRO HB2 . 11329 1 554 . 1 1 50 50 PRO HB3 H 1 2.482 0.030 . 2 . . . . 50 PRO HB3 . 11329 1 555 . 1 1 50 50 PRO HD2 H 1 3.790 0.030 . 2 . . . . 50 PRO HD2 . 11329 1 556 . 1 1 50 50 PRO HD3 H 1 3.410 0.030 . 2 . . . . 50 PRO HD3 . 11329 1 557 . 1 1 50 50 PRO HG2 H 1 2.153 0.030 . 1 . . . . 50 PRO HG2 . 11329 1 558 . 1 1 50 50 PRO HG3 H 1 2.153 0.030 . 1 . . . . 50 PRO HG3 . 11329 1 559 . 1 1 50 50 PRO C C 13 180.685 0.300 . 1 . . . . 50 PRO C . 11329 1 560 . 1 1 50 50 PRO CA C 13 66.044 0.300 . 1 . . . . 50 PRO CA . 11329 1 561 . 1 1 50 50 PRO CB C 13 31.263 0.300 . 1 . . . . 50 PRO CB . 11329 1 562 . 1 1 50 50 PRO CD C 13 49.942 0.300 . 1 . . . . 50 PRO CD . 11329 1 563 . 1 1 50 50 PRO CG C 13 27.508 0.300 . 1 . . . . 50 PRO CG . 11329 1 564 . 1 1 51 51 GLU H H 1 10.059 0.030 . 1 . . . . 51 GLU H . 11329 1 565 . 1 1 51 51 GLU HA H 1 4.171 0.030 . 1 . . . . 51 GLU HA . 11329 1 566 . 1 1 51 51 GLU HB2 H 1 2.208 0.030 . 1 . . . . 51 GLU HB2 . 11329 1 567 . 1 1 51 51 GLU HB3 H 1 2.208 0.030 . 1 . . . . 51 GLU HB3 . 11329 1 568 . 1 1 51 51 GLU HG2 H 1 2.495 0.030 . 1 . . . . 51 GLU HG2 . 11329 1 569 . 1 1 51 51 GLU HG3 H 1 2.495 0.030 . 1 . . . . 51 GLU HG3 . 11329 1 570 . 1 1 51 51 GLU C C 13 179.233 0.300 . 1 . . . . 51 GLU C . 11329 1 571 . 1 1 51 51 GLU CA C 13 59.429 0.300 . 1 . . . . 51 GLU CA . 11329 1 572 . 1 1 51 51 GLU CB C 13 28.841 0.300 . 1 . . . . 51 GLU CB . 11329 1 573 . 1 1 51 51 GLU CG C 13 36.415 0.300 . 1 . . . . 51 GLU CG . 11329 1 574 . 1 1 51 51 GLU N N 15 118.312 0.300 . 1 . . . . 51 GLU N . 11329 1 575 . 1 1 52 52 TYR H H 1 7.698 0.030 . 1 . . . . 52 TYR H . 11329 1 576 . 1 1 52 52 TYR HA H 1 3.542 0.030 . 1 . . . . 52 TYR HA . 11329 1 577 . 1 1 52 52 TYR HB2 H 1 2.286 0.030 . 2 . . . . 52 TYR HB2 . 11329 1 578 . 1 1 52 52 TYR HB3 H 1 2.780 0.030 . 2 . . . . 52 TYR HB3 . 11329 1 579 . 1 1 52 52 TYR HD1 H 1 4.974 0.030 . 1 . . . . 52 TYR HD1 . 11329 1 580 . 1 1 52 52 TYR HD2 H 1 4.974 0.030 . 1 . . . . 52 TYR HD2 . 11329 1 581 . 1 1 52 52 TYR HE1 H 1 6.061 0.030 . 1 . . . . 52 TYR HE1 . 11329 1 582 . 1 1 52 52 TYR HE2 H 1 6.061 0.030 . 1 . . . . 52 TYR HE2 . 11329 1 583 . 1 1 52 52 TYR C C 13 175.757 0.300 . 1 . . . . 52 TYR C . 11329 1 584 . 1 1 52 52 TYR CA C 13 61.880 0.300 . 1 . . . . 52 TYR CA . 11329 1 585 . 1 1 52 52 TYR CB C 13 38.784 0.300 . 1 . . . . 52 TYR CB . 11329 1 586 . 1 1 52 52 TYR CD1 C 13 132.069 0.300 . 1 . . . . 52 TYR CD1 . 11329 1 587 . 1 1 52 52 TYR CD2 C 13 132.069 0.300 . 1 . . . . 52 TYR CD2 . 11329 1 588 . 1 1 52 52 TYR CE1 C 13 117.145 0.300 . 1 . . . . 52 TYR CE1 . 11329 1 589 . 1 1 52 52 TYR CE2 C 13 117.145 0.300 . 1 . . . . 52 TYR CE2 . 11329 1 590 . 1 1 52 52 TYR N N 15 120.550 0.300 . 1 . . . . 52 TYR N . 11329 1 591 . 1 1 53 53 TYR H H 1 6.891 0.030 . 1 . . . . 53 TYR H . 11329 1 592 . 1 1 53 53 TYR HA H 1 4.073 0.030 . 1 . . . . 53 TYR HA . 11329 1 593 . 1 1 53 53 TYR HB2 H 1 2.835 0.030 . 2 . . . . 53 TYR HB2 . 11329 1 594 . 1 1 53 53 TYR HB3 H 1 3.259 0.030 . 2 . . . . 53 TYR HB3 . 11329 1 595 . 1 1 53 53 TYR HD1 H 1 7.414 0.030 . 1 . . . . 53 TYR HD1 . 11329 1 596 . 1 1 53 53 TYR HD2 H 1 7.414 0.030 . 1 . . . . 53 TYR HD2 . 11329 1 597 . 1 1 53 53 TYR HE1 H 1 6.601 0.030 . 1 . . . . 53 TYR HE1 . 11329 1 598 . 1 1 53 53 TYR HE2 H 1 6.601 0.030 . 1 . . . . 53 TYR HE2 . 11329 1 599 . 1 1 53 53 TYR C C 13 176.682 0.300 . 1 . . . . 53 TYR C . 11329 1 600 . 1 1 53 53 TYR CA C 13 59.911 0.300 . 1 . . . . 53 TYR CA . 11329 1 601 . 1 1 53 53 TYR CB C 13 38.278 0.300 . 1 . . . . 53 TYR CB . 11329 1 602 . 1 1 53 53 TYR CD1 C 13 133.634 0.300 . 1 . . . . 53 TYR CD1 . 11329 1 603 . 1 1 53 53 TYR CD2 C 13 133.634 0.300 . 1 . . . . 53 TYR CD2 . 11329 1 604 . 1 1 53 53 TYR CE1 C 13 117.415 0.300 . 1 . . . . 53 TYR CE1 . 11329 1 605 . 1 1 53 53 TYR CE2 C 13 117.415 0.300 . 1 . . . . 53 TYR CE2 . 11329 1 606 . 1 1 53 53 TYR N N 15 114.384 0.300 . 1 . . . . 53 TYR N . 11329 1 607 . 1 1 54 54 GLU H H 1 7.357 0.030 . 1 . . . . 54 GLU H . 11329 1 608 . 1 1 54 54 GLU HA H 1 4.213 0.030 . 1 . . . . 54 GLU HA . 11329 1 609 . 1 1 54 54 GLU HB2 H 1 2.090 0.030 . 1 . . . . 54 GLU HB2 . 11329 1 610 . 1 1 54 54 GLU HB3 H 1 2.090 0.030 . 1 . . . . 54 GLU HB3 . 11329 1 611 . 1 1 54 54 GLU HG2 H 1 2.399 0.030 . 2 . . . . 54 GLU HG2 . 11329 1 612 . 1 1 54 54 GLU HG3 H 1 2.276 0.030 . 2 . . . . 54 GLU HG3 . 11329 1 613 . 1 1 54 54 GLU C C 13 177.157 0.300 . 1 . . . . 54 GLU C . 11329 1 614 . 1 1 54 54 GLU CA C 13 57.664 0.300 . 1 . . . . 54 GLU CA . 11329 1 615 . 1 1 54 54 GLU CB C 13 29.898 0.300 . 1 . . . . 54 GLU CB . 11329 1 616 . 1 1 54 54 GLU CG C 13 36.042 0.300 . 1 . . . . 54 GLU CG . 11329 1 617 . 1 1 54 54 GLU N N 15 117.899 0.300 . 1 . . . . 54 GLU N . 11329 1 618 . 1 1 55 55 LEU H H 1 6.931 0.030 . 1 . . . . 55 LEU H . 11329 1 619 . 1 1 55 55 LEU HA H 1 4.293 0.030 . 1 . . . . 55 LEU HA . 11329 1 620 . 1 1 55 55 LEU HB2 H 1 1.675 0.030 . 2 . . . . 55 LEU HB2 . 11329 1 621 . 1 1 55 55 LEU HB3 H 1 1.533 0.030 . 2 . . . . 55 LEU HB3 . 11329 1 622 . 1 1 55 55 LEU HD11 H 1 0.930 0.030 . 1 . . . . 55 LEU HD1 . 11329 1 623 . 1 1 55 55 LEU HD12 H 1 0.930 0.030 . 1 . . . . 55 LEU HD1 . 11329 1 624 . 1 1 55 55 LEU HD13 H 1 0.930 0.030 . 1 . . . . 55 LEU HD1 . 11329 1 625 . 1 1 55 55 LEU HD21 H 1 0.975 0.030 . 1 . . . . 55 LEU HD2 . 11329 1 626 . 1 1 55 55 LEU HD22 H 1 0.975 0.030 . 1 . . . . 55 LEU HD2 . 11329 1 627 . 1 1 55 55 LEU HD23 H 1 0.975 0.030 . 1 . . . . 55 LEU HD2 . 11329 1 628 . 1 1 55 55 LEU HG H 1 1.655 0.030 . 1 . . . . 55 LEU HG . 11329 1 629 . 1 1 55 55 LEU C C 13 176.392 0.300 . 1 . . . . 55 LEU C . 11329 1 630 . 1 1 55 55 LEU CA C 13 56.254 0.300 . 1 . . . . 55 LEU CA . 11329 1 631 . 1 1 55 55 LEU CB C 13 44.340 0.300 . 1 . . . . 55 LEU CB . 11329 1 632 . 1 1 55 55 LEU CD1 C 13 24.810 0.300 . 2 . . . . 55 LEU CD1 . 11329 1 633 . 1 1 55 55 LEU CD2 C 13 24.132 0.300 . 2 . . . . 55 LEU CD2 . 11329 1 634 . 1 1 55 55 LEU CG C 13 27.344 0.300 . 1 . . . . 55 LEU CG . 11329 1 635 . 1 1 55 55 LEU N N 15 118.151 0.300 . 1 . . . . 55 LEU N . 11329 1 636 . 1 1 56 56 ILE H H 1 7.993 0.030 . 1 . . . . 56 ILE H . 11329 1 637 . 1 1 56 56 ILE HA H 1 3.917 0.030 . 1 . . . . 56 ILE HA . 11329 1 638 . 1 1 56 56 ILE HB H 1 1.412 0.030 . 1 . . . . 56 ILE HB . 11329 1 639 . 1 1 56 56 ILE HD11 H 1 0.512 0.030 . 1 . . . . 56 ILE HD1 . 11329 1 640 . 1 1 56 56 ILE HD12 H 1 0.512 0.030 . 1 . . . . 56 ILE HD1 . 11329 1 641 . 1 1 56 56 ILE HD13 H 1 0.512 0.030 . 1 . . . . 56 ILE HD1 . 11329 1 642 . 1 1 56 56 ILE HG12 H 1 0.879 0.030 . 2 . . . . 56 ILE HG12 . 11329 1 643 . 1 1 56 56 ILE HG13 H 1 0.157 0.030 . 2 . . . . 56 ILE HG13 . 11329 1 644 . 1 1 56 56 ILE HG21 H 1 0.408 0.030 . 1 . . . . 56 ILE HG2 . 11329 1 645 . 1 1 56 56 ILE HG22 H 1 0.408 0.030 . 1 . . . . 56 ILE HG2 . 11329 1 646 . 1 1 56 56 ILE HG23 H 1 0.408 0.030 . 1 . . . . 56 ILE HG2 . 11329 1 647 . 1 1 56 56 ILE C C 13 174.575 0.300 . 1 . . . . 56 ILE C . 11329 1 648 . 1 1 56 56 ILE CA C 13 57.355 0.300 . 1 . . . . 56 ILE CA . 11329 1 649 . 1 1 56 56 ILE CB C 13 34.111 0.300 . 1 . . . . 56 ILE CB . 11329 1 650 . 1 1 56 56 ILE CD1 C 13 9.215 0.300 . 1 . . . . 56 ILE CD1 . 11329 1 651 . 1 1 56 56 ILE CG1 C 13 24.546 0.300 . 1 . . . . 56 ILE CG1 . 11329 1 652 . 1 1 56 56 ILE CG2 C 13 16.536 0.300 . 1 . . . . 56 ILE CG2 . 11329 1 653 . 1 1 56 56 ILE N N 15 120.342 0.300 . 1 . . . . 56 ILE N . 11329 1 654 . 1 1 57 57 ARG H H 1 8.092 0.030 . 1 . . . . 57 ARG H . 11329 1 655 . 1 1 57 57 ARG HA H 1 4.149 0.030 . 1 . . . . 57 ARG HA . 11329 1 656 . 1 1 57 57 ARG HB2 H 1 1.913 0.030 . 2 . . . . 57 ARG HB2 . 11329 1 657 . 1 1 57 57 ARG HB3 H 1 1.775 0.030 . 2 . . . . 57 ARG HB3 . 11329 1 658 . 1 1 57 57 ARG HD2 H 1 3.199 0.030 . 1 . . . . 57 ARG HD2 . 11329 1 659 . 1 1 57 57 ARG HD3 H 1 3.199 0.030 . 1 . . . . 57 ARG HD3 . 11329 1 660 . 1 1 57 57 ARG HG2 H 1 1.744 0.030 . 2 . . . . 57 ARG HG2 . 11329 1 661 . 1 1 57 57 ARG HG3 H 1 1.674 0.030 . 2 . . . . 57 ARG HG3 . 11329 1 662 . 1 1 57 57 ARG C C 13 177.171 0.300 . 1 . . . . 57 ARG C . 11329 1 663 . 1 1 57 57 ARG CA C 13 57.455 0.300 . 1 . . . . 57 ARG CA . 11329 1 664 . 1 1 57 57 ARG CB C 13 30.468 0.300 . 1 . . . . 57 ARG CB . 11329 1 665 . 1 1 57 57 ARG CD C 13 42.753 0.300 . 1 . . . . 57 ARG CD . 11329 1 666 . 1 1 57 57 ARG CG C 13 27.160 0.300 . 1 . . . . 57 ARG CG . 11329 1 667 . 1 1 57 57 ARG N N 15 125.121 0.300 . 1 . . . . 57 ARG N . 11329 1 668 . 1 1 58 58 LYS H H 1 8.252 0.030 . 1 . . . . 58 LYS H . 11329 1 669 . 1 1 58 58 LYS HA H 1 4.762 0.030 . 1 . . . . 58 LYS HA . 11329 1 670 . 1 1 58 58 LYS HB2 H 1 1.811 0.030 . 1 . . . . 58 LYS HB2 . 11329 1 671 . 1 1 58 58 LYS HB3 H 1 1.811 0.030 . 1 . . . . 58 LYS HB3 . 11329 1 672 . 1 1 58 58 LYS HD2 H 1 1.720 0.030 . 1 . . . . 58 LYS HD2 . 11329 1 673 . 1 1 58 58 LYS HD3 H 1 1.720 0.030 . 1 . . . . 58 LYS HD3 . 11329 1 674 . 1 1 58 58 LYS HE2 H 1 2.965 0.030 . 1 . . . . 58 LYS HE2 . 11329 1 675 . 1 1 58 58 LYS HE3 H 1 2.965 0.030 . 1 . . . . 58 LYS HE3 . 11329 1 676 . 1 1 58 58 LYS HG2 H 1 1.297 0.030 . 1 . . . . 58 LYS HG2 . 11329 1 677 . 1 1 58 58 LYS HG3 H 1 1.297 0.030 . 1 . . . . 58 LYS HG3 . 11329 1 678 . 1 1 58 58 LYS C C 13 171.670 0.300 . 1 . . . . 58 LYS C . 11329 1 679 . 1 1 58 58 LYS CA C 13 53.120 0.300 . 1 . . . . 58 LYS CA . 11329 1 680 . 1 1 58 58 LYS CB C 13 33.257 0.300 . 1 . . . . 58 LYS CB . 11329 1 681 . 1 1 58 58 LYS CD C 13 29.513 0.300 . 1 . . . . 58 LYS CD . 11329 1 682 . 1 1 58 58 LYS CE C 13 42.147 0.300 . 1 . . . . 58 LYS CE . 11329 1 683 . 1 1 58 58 LYS CG C 13 24.523 0.300 . 1 . . . . 58 LYS CG . 11329 1 684 . 1 1 58 58 LYS N N 15 118.748 0.300 . 1 . . . . 58 LYS N . 11329 1 685 . 1 1 59 59 PRO HA H 1 4.140 0.030 . 1 . . . . 59 PRO HA . 11329 1 686 . 1 1 59 59 PRO HB2 H 1 2.105 0.030 . 2 . . . . 59 PRO HB2 . 11329 1 687 . 1 1 59 59 PRO HB3 H 1 2.048 0.030 . 2 . . . . 59 PRO HB3 . 11329 1 688 . 1 1 59 59 PRO HD2 H 1 3.623 0.030 . 2 . . . . 59 PRO HD2 . 11329 1 689 . 1 1 59 59 PRO HD3 H 1 3.499 0.030 . 2 . . . . 59 PRO HD3 . 11329 1 690 . 1 1 59 59 PRO HG2 H 1 2.277 0.030 . 2 . . . . 59 PRO HG2 . 11329 1 691 . 1 1 59 59 PRO HG3 H 1 1.867 0.030 . 2 . . . . 59 PRO HG3 . 11329 1 692 . 1 1 59 59 PRO C C 13 176.572 0.300 . 1 . . . . 59 PRO C . 11329 1 693 . 1 1 59 59 PRO CA C 13 62.869 0.300 . 1 . . . . 59 PRO CA . 11329 1 694 . 1 1 59 59 PRO CB C 13 33.093 0.300 . 1 . . . . 59 PRO CB . 11329 1 695 . 1 1 59 59 PRO CD C 13 50.032 0.300 . 1 . . . . 59 PRO CD . 11329 1 696 . 1 1 59 59 PRO CG C 13 27.756 0.300 . 1 . . . . 59 PRO CG . 11329 1 697 . 1 1 60 60 VAL H H 1 8.842 0.030 . 1 . . . . 60 VAL H . 11329 1 698 . 1 1 60 60 VAL HA H 1 4.196 0.030 . 1 . . . . 60 VAL HA . 11329 1 699 . 1 1 60 60 VAL HB H 1 1.963 0.030 . 1 . . . . 60 VAL HB . 11329 1 700 . 1 1 60 60 VAL HG11 H 1 0.764 0.030 . 1 . . . . 60 VAL HG1 . 11329 1 701 . 1 1 60 60 VAL HG12 H 1 0.764 0.030 . 1 . . . . 60 VAL HG1 . 11329 1 702 . 1 1 60 60 VAL HG13 H 1 0.764 0.030 . 1 . . . . 60 VAL HG1 . 11329 1 703 . 1 1 60 60 VAL HG21 H 1 0.915 0.030 . 1 . . . . 60 VAL HG2 . 11329 1 704 . 1 1 60 60 VAL HG22 H 1 0.915 0.030 . 1 . . . . 60 VAL HG2 . 11329 1 705 . 1 1 60 60 VAL HG23 H 1 0.915 0.030 . 1 . . . . 60 VAL HG2 . 11329 1 706 . 1 1 60 60 VAL C C 13 170.853 0.300 . 1 . . . . 60 VAL C . 11329 1 707 . 1 1 60 60 VAL CA C 13 62.678 0.300 . 1 . . . . 60 VAL CA . 11329 1 708 . 1 1 60 60 VAL CB C 13 34.823 0.300 . 1 . . . . 60 VAL CB . 11329 1 709 . 1 1 60 60 VAL CG1 C 13 19.721 0.300 . 2 . . . . 60 VAL CG1 . 11329 1 710 . 1 1 60 60 VAL CG2 C 13 22.147 0.300 . 2 . . . . 60 VAL CG2 . 11329 1 711 . 1 1 60 60 VAL N N 15 121.557 0.300 . 1 . . . . 60 VAL N . 11329 1 712 . 1 1 61 61 ASP H H 1 6.880 0.030 . 1 . . . . 61 ASP H . 11329 1 713 . 1 1 61 61 ASP HA H 1 4.674 0.030 . 1 . . . . 61 ASP HA . 11329 1 714 . 1 1 61 61 ASP HB2 H 1 3.220 0.030 . 2 . . . . 61 ASP HB2 . 11329 1 715 . 1 1 61 61 ASP HB3 H 1 2.609 0.030 . 2 . . . . 61 ASP HB3 . 11329 1 716 . 1 1 61 61 ASP C C 13 175.770 0.300 . 1 . . . . 61 ASP C . 11329 1 717 . 1 1 61 61 ASP CA C 13 52.342 0.300 . 1 . . . . 61 ASP CA . 11329 1 718 . 1 1 61 61 ASP CB C 13 42.678 0.300 . 1 . . . . 61 ASP CB . 11329 1 719 . 1 1 61 61 ASP N N 15 123.003 0.300 . 1 . . . . 61 ASP N . 11329 1 720 . 1 1 62 62 PHE H H 1 8.517 0.030 . 1 . . . . 62 PHE H . 11329 1 721 . 1 1 62 62 PHE HA H 1 4.431 0.030 . 1 . . . . 62 PHE HA . 11329 1 722 . 1 1 62 62 PHE HB2 H 1 3.044 0.030 . 2 . . . . 62 PHE HB2 . 11329 1 723 . 1 1 62 62 PHE HB3 H 1 3.202 0.030 . 2 . . . . 62 PHE HB3 . 11329 1 724 . 1 1 62 62 PHE HD1 H 1 7.123 0.030 . 1 . . . . 62 PHE HD1 . 11329 1 725 . 1 1 62 62 PHE HD2 H 1 7.123 0.030 . 1 . . . . 62 PHE HD2 . 11329 1 726 . 1 1 62 62 PHE HE1 H 1 7.028 0.030 . 1 . . . . 62 PHE HE1 . 11329 1 727 . 1 1 62 62 PHE HE2 H 1 7.028 0.030 . 1 . . . . 62 PHE HE2 . 11329 1 728 . 1 1 62 62 PHE HZ H 1 6.819 0.030 . 1 . . . . 62 PHE HZ . 11329 1 729 . 1 1 62 62 PHE C C 13 177.755 0.300 . 1 . . . . 62 PHE C . 11329 1 730 . 1 1 62 62 PHE CA C 13 63.573 0.300 . 1 . . . . 62 PHE CA . 11329 1 731 . 1 1 62 62 PHE CB C 13 39.095 0.300 . 1 . . . . 62 PHE CB . 11329 1 732 . 1 1 62 62 PHE CD1 C 13 131.602 0.300 . 1 . . . . 62 PHE CD1 . 11329 1 733 . 1 1 62 62 PHE CD2 C 13 131.602 0.300 . 1 . . . . 62 PHE CD2 . 11329 1 734 . 1 1 62 62 PHE CE1 C 13 130.386 0.300 . 1 . . . . 62 PHE CE1 . 11329 1 735 . 1 1 62 62 PHE CE2 C 13 130.386 0.300 . 1 . . . . 62 PHE CE2 . 11329 1 736 . 1 1 62 62 PHE CZ C 13 129.206 0.300 . 1 . . . . 62 PHE CZ . 11329 1 737 . 1 1 62 62 PHE N N 15 115.183 0.300 . 1 . . . . 62 PHE N . 11329 1 738 . 1 1 63 63 LYS H H 1 8.785 0.030 . 1 . . . . 63 LYS H . 11329 1 739 . 1 1 63 63 LYS HA H 1 4.062 0.030 . 1 . . . . 63 LYS HA . 11329 1 740 . 1 1 63 63 LYS HB2 H 1 1.993 0.030 . 2 . . . . 63 LYS HB2 . 11329 1 741 . 1 1 63 63 LYS HB3 H 1 1.955 0.030 . 2 . . . . 63 LYS HB3 . 11329 1 742 . 1 1 63 63 LYS HD2 H 1 1.696 0.030 . 1 . . . . 63 LYS HD2 . 11329 1 743 . 1 1 63 63 LYS HD3 H 1 1.696 0.030 . 1 . . . . 63 LYS HD3 . 11329 1 744 . 1 1 63 63 LYS HE2 H 1 2.975 0.030 . 1 . . . . 63 LYS HE2 . 11329 1 745 . 1 1 63 63 LYS HE3 H 1 2.975 0.030 . 1 . . . . 63 LYS HE3 . 11329 1 746 . 1 1 63 63 LYS HG2 H 1 1.622 0.030 . 2 . . . . 63 LYS HG2 . 11329 1 747 . 1 1 63 63 LYS HG3 H 1 1.399 0.030 . 2 . . . . 63 LYS HG3 . 11329 1 748 . 1 1 63 63 LYS C C 13 179.715 0.300 . 1 . . . . 63 LYS C . 11329 1 749 . 1 1 63 63 LYS CA C 13 60.931 0.300 . 1 . . . . 63 LYS CA . 11329 1 750 . 1 1 63 63 LYS CB C 13 32.054 0.300 . 1 . . . . 63 LYS CB . 11329 1 751 . 1 1 63 63 LYS CD C 13 29.671 0.300 . 1 . . . . 63 LYS CD . 11329 1 752 . 1 1 63 63 LYS CE C 13 42.059 0.300 . 1 . . . . 63 LYS CE . 11329 1 753 . 1 1 63 63 LYS CG C 13 25.696 0.300 . 1 . . . . 63 LYS CG . 11329 1 754 . 1 1 63 63 LYS N N 15 122.392 0.300 . 1 . . . . 63 LYS N . 11329 1 755 . 1 1 64 64 LYS H H 1 8.952 0.030 . 1 . . . . 64 LYS H . 11329 1 756 . 1 1 64 64 LYS HA H 1 4.186 0.030 . 1 . . . . 64 LYS HA . 11329 1 757 . 1 1 64 64 LYS HB2 H 1 1.902 0.030 . 2 . . . . 64 LYS HB2 . 11329 1 758 . 1 1 64 64 LYS HB3 H 1 2.114 0.030 . 2 . . . . 64 LYS HB3 . 11329 1 759 . 1 1 64 64 LYS HD2 H 1 1.816 0.030 . 2 . . . . 64 LYS HD2 . 11329 1 760 . 1 1 64 64 LYS HD3 H 1 1.674 0.030 . 2 . . . . 64 LYS HD3 . 11329 1 761 . 1 1 64 64 LYS HE2 H 1 3.043 0.030 . 2 . . . . 64 LYS HE2 . 11329 1 762 . 1 1 64 64 LYS HE3 H 1 2.975 0.030 . 2 . . . . 64 LYS HE3 . 11329 1 763 . 1 1 64 64 LYS HG2 H 1 1.623 0.030 . 2 . . . . 64 LYS HG2 . 11329 1 764 . 1 1 64 64 LYS HG3 H 1 1.537 0.030 . 2 . . . . 64 LYS HG3 . 11329 1 765 . 1 1 64 64 LYS C C 13 178.794 0.300 . 1 . . . . 64 LYS C . 11329 1 766 . 1 1 64 64 LYS CA C 13 58.290 0.300 . 1 . . . . 64 LYS CA . 11329 1 767 . 1 1 64 64 LYS CB C 13 31.819 0.300 . 1 . . . . 64 LYS CB . 11329 1 768 . 1 1 64 64 LYS CD C 13 28.377 0.300 . 1 . . . . 64 LYS CD . 11329 1 769 . 1 1 64 64 LYS CE C 13 41.675 0.300 . 1 . . . . 64 LYS CE . 11329 1 770 . 1 1 64 64 LYS CG C 13 24.295 0.300 . 1 . . . . 64 LYS CG . 11329 1 771 . 1 1 64 64 LYS N N 15 121.886 0.300 . 1 . . . . 64 LYS N . 11329 1 772 . 1 1 65 65 ILE H H 1 7.917 0.030 . 1 . . . . 65 ILE H . 11329 1 773 . 1 1 65 65 ILE HA H 1 4.396 0.030 . 1 . . . . 65 ILE HA . 11329 1 774 . 1 1 65 65 ILE HB H 1 2.065 0.030 . 1 . . . . 65 ILE HB . 11329 1 775 . 1 1 65 65 ILE HD11 H 1 0.495 0.030 . 1 . . . . 65 ILE HD1 . 11329 1 776 . 1 1 65 65 ILE HD12 H 1 0.495 0.030 . 1 . . . . 65 ILE HD1 . 11329 1 777 . 1 1 65 65 ILE HD13 H 1 0.495 0.030 . 1 . . . . 65 ILE HD1 . 11329 1 778 . 1 1 65 65 ILE HG12 H 1 1.816 0.030 . 2 . . . . 65 ILE HG12 . 11329 1 779 . 1 1 65 65 ILE HG13 H 1 1.304 0.030 . 2 . . . . 65 ILE HG13 . 11329 1 780 . 1 1 65 65 ILE HG21 H 1 1.151 0.030 . 1 . . . . 65 ILE HG2 . 11329 1 781 . 1 1 65 65 ILE HG22 H 1 1.151 0.030 . 1 . . . . 65 ILE HG2 . 11329 1 782 . 1 1 65 65 ILE HG23 H 1 1.151 0.030 . 1 . . . . 65 ILE HG2 . 11329 1 783 . 1 1 65 65 ILE C C 13 178.701 0.300 . 1 . . . . 65 ILE C . 11329 1 784 . 1 1 65 65 ILE CA C 13 65.129 0.300 . 1 . . . . 65 ILE CA . 11329 1 785 . 1 1 65 65 ILE CB C 13 38.466 0.300 . 1 . . . . 65 ILE CB . 11329 1 786 . 1 1 65 65 ILE CD1 C 13 14.090 0.300 . 1 . . . . 65 ILE CD1 . 11329 1 787 . 1 1 65 65 ILE CG1 C 13 28.332 0.300 . 1 . . . . 65 ILE CG1 . 11329 1 788 . 1 1 65 65 ILE CG2 C 13 17.032 0.300 . 1 . . . . 65 ILE CG2 . 11329 1 789 . 1 1 65 65 ILE N N 15 120.077 0.300 . 1 . . . . 65 ILE N . 11329 1 790 . 1 1 66 66 LYS H H 1 8.648 0.030 . 1 . . . . 66 LYS H . 11329 1 791 . 1 1 66 66 LYS HA H 1 4.057 0.030 . 1 . . . . 66 LYS HA . 11329 1 792 . 1 1 66 66 LYS HB2 H 1 2.154 0.030 . 2 . . . . 66 LYS HB2 . 11329 1 793 . 1 1 66 66 LYS HB3 H 1 1.887 0.030 . 2 . . . . 66 LYS HB3 . 11329 1 794 . 1 1 66 66 LYS HD2 H 1 1.697 0.030 . 1 . . . . 66 LYS HD2 . 11329 1 795 . 1 1 66 66 LYS HD3 H 1 1.697 0.030 . 1 . . . . 66 LYS HD3 . 11329 1 796 . 1 1 66 66 LYS HE2 H 1 2.988 0.030 . 2 . . . . 66 LYS HE2 . 11329 1 797 . 1 1 66 66 LYS HE3 H 1 2.899 0.030 . 2 . . . . 66 LYS HE3 . 11329 1 798 . 1 1 66 66 LYS HG2 H 1 1.803 0.030 . 2 . . . . 66 LYS HG2 . 11329 1 799 . 1 1 66 66 LYS HG3 H 1 1.523 0.030 . 2 . . . . 66 LYS HG3 . 11329 1 800 . 1 1 66 66 LYS C C 13 180.030 0.300 . 1 . . . . 66 LYS C . 11329 1 801 . 1 1 66 66 LYS CA C 13 60.503 0.300 . 1 . . . . 66 LYS CA . 11329 1 802 . 1 1 66 66 LYS CB C 13 31.162 0.300 . 1 . . . . 66 LYS CB . 11329 1 803 . 1 1 66 66 LYS CD C 13 28.981 0.300 . 1 . . . . 66 LYS CD . 11329 1 804 . 1 1 66 66 LYS CE C 13 41.467 0.300 . 1 . . . . 66 LYS CE . 11329 1 805 . 1 1 66 66 LYS CG C 13 26.172 0.300 . 1 . . . . 66 LYS CG . 11329 1 806 . 1 1 66 66 LYS N N 15 118.426 0.300 . 1 . . . . 66 LYS N . 11329 1 807 . 1 1 67 67 GLU H H 1 8.061 0.030 . 1 . . . . 67 GLU H . 11329 1 808 . 1 1 67 67 GLU HA H 1 3.964 0.030 . 1 . . . . 67 GLU HA . 11329 1 809 . 1 1 67 67 GLU HB2 H 1 2.281 0.030 . 2 . . . . 67 GLU HB2 . 11329 1 810 . 1 1 67 67 GLU HB3 H 1 2.211 0.030 . 2 . . . . 67 GLU HB3 . 11329 1 811 . 1 1 67 67 GLU HG2 H 1 2.341 0.030 . 2 . . . . 67 GLU HG2 . 11329 1 812 . 1 1 67 67 GLU HG3 H 1 2.192 0.030 . 2 . . . . 67 GLU HG3 . 11329 1 813 . 1 1 67 67 GLU C C 13 177.962 0.300 . 1 . . . . 67 GLU C . 11329 1 814 . 1 1 67 67 GLU CA C 13 59.548 0.300 . 1 . . . . 67 GLU CA . 11329 1 815 . 1 1 67 67 GLU CB C 13 29.715 0.300 . 1 . . . . 67 GLU CB . 11329 1 816 . 1 1 67 67 GLU CG C 13 36.122 0.300 . 1 . . . . 67 GLU CG . 11329 1 817 . 1 1 67 67 GLU N N 15 122.376 0.300 . 1 . . . . 67 GLU N . 11329 1 818 . 1 1 68 68 ARG H H 1 8.471 0.030 . 1 . . . . 68 ARG H . 11329 1 819 . 1 1 68 68 ARG HA H 1 3.744 0.030 . 1 . . . . 68 ARG HA . 11329 1 820 . 1 1 68 68 ARG HB2 H 1 1.998 0.030 . 2 . . . . 68 ARG HB2 . 11329 1 821 . 1 1 68 68 ARG HB3 H 1 0.558 0.030 . 2 . . . . 68 ARG HB3 . 11329 1 822 . 1 1 68 68 ARG HD2 H 1 2.962 0.030 . 2 . . . . 68 ARG HD2 . 11329 1 823 . 1 1 68 68 ARG HD3 H 1 2.890 0.030 . 2 . . . . 68 ARG HD3 . 11329 1 824 . 1 1 68 68 ARG HG2 H 1 1.895 0.030 . 2 . . . . 68 ARG HG2 . 11329 1 825 . 1 1 68 68 ARG HG3 H 1 1.332 0.030 . 2 . . . . 68 ARG HG3 . 11329 1 826 . 1 1 68 68 ARG C C 13 179.088 0.300 . 1 . . . . 68 ARG C . 11329 1 827 . 1 1 68 68 ARG CA C 13 60.036 0.300 . 1 . . . . 68 ARG CA . 11329 1 828 . 1 1 68 68 ARG CB C 13 29.904 0.300 . 1 . . . . 68 ARG CB . 11329 1 829 . 1 1 68 68 ARG CD C 13 43.890 0.300 . 1 . . . . 68 ARG CD . 11329 1 830 . 1 1 68 68 ARG CG C 13 29.744 0.300 . 1 . . . . 68 ARG CG . 11329 1 831 . 1 1 68 68 ARG N N 15 121.039 0.300 . 1 . . . . 68 ARG N . 11329 1 832 . 1 1 69 69 ILE H H 1 8.181 0.030 . 1 . . . . 69 ILE H . 11329 1 833 . 1 1 69 69 ILE HA H 1 3.835 0.030 . 1 . . . . 69 ILE HA . 11329 1 834 . 1 1 69 69 ILE HB H 1 2.041 0.030 . 1 . . . . 69 ILE HB . 11329 1 835 . 1 1 69 69 ILE HD11 H 1 0.920 0.030 . 1 . . . . 69 ILE HD1 . 11329 1 836 . 1 1 69 69 ILE HD12 H 1 0.920 0.030 . 1 . . . . 69 ILE HD1 . 11329 1 837 . 1 1 69 69 ILE HD13 H 1 0.920 0.030 . 1 . . . . 69 ILE HD1 . 11329 1 838 . 1 1 69 69 ILE HG12 H 1 2.501 0.030 . 2 . . . . 69 ILE HG12 . 11329 1 839 . 1 1 69 69 ILE HG13 H 1 1.324 0.030 . 2 . . . . 69 ILE HG13 . 11329 1 840 . 1 1 69 69 ILE HG21 H 1 1.018 0.030 . 1 . . . . 69 ILE HG2 . 11329 1 841 . 1 1 69 69 ILE HG22 H 1 1.018 0.030 . 1 . . . . 69 ILE HG2 . 11329 1 842 . 1 1 69 69 ILE HG23 H 1 1.018 0.030 . 1 . . . . 69 ILE HG2 . 11329 1 843 . 1 1 69 69 ILE C C 13 179.112 0.300 . 1 . . . . 69 ILE C . 11329 1 844 . 1 1 69 69 ILE CA C 13 66.287 0.300 . 1 . . . . 69 ILE CA . 11329 1 845 . 1 1 69 69 ILE CB C 13 39.281 0.300 . 1 . . . . 69 ILE CB . 11329 1 846 . 1 1 69 69 ILE CD1 C 13 14.975 0.300 . 1 . . . . 69 ILE CD1 . 11329 1 847 . 1 1 69 69 ILE CG1 C 13 28.309 0.300 . 1 . . . . 69 ILE CG1 . 11329 1 848 . 1 1 69 69 ILE CG2 C 13 18.437 0.300 . 1 . . . . 69 ILE CG2 . 11329 1 849 . 1 1 69 69 ILE N N 15 119.652 0.300 . 1 . . . . 69 ILE N . 11329 1 850 . 1 1 70 70 ARG H H 1 7.906 0.030 . 1 . . . . 70 ARG H . 11329 1 851 . 1 1 70 70 ARG HA H 1 3.861 0.030 . 1 . . . . 70 ARG HA . 11329 1 852 . 1 1 70 70 ARG HB2 H 1 1.903 0.030 . 1 . . . . 70 ARG HB2 . 11329 1 853 . 1 1 70 70 ARG HB3 H 1 1.903 0.030 . 1 . . . . 70 ARG HB3 . 11329 1 854 . 1 1 70 70 ARG HD2 H 1 3.218 0.030 . 1 . . . . 70 ARG HD2 . 11329 1 855 . 1 1 70 70 ARG HD3 H 1 3.218 0.030 . 1 . . . . 70 ARG HD3 . 11329 1 856 . 1 1 70 70 ARG HG2 H 1 1.665 0.030 . 2 . . . . 70 ARG HG2 . 11329 1 857 . 1 1 70 70 ARG HG3 H 1 1.618 0.030 . 2 . . . . 70 ARG HG3 . 11329 1 858 . 1 1 70 70 ARG C C 13 176.856 0.300 . 1 . . . . 70 ARG C . 11329 1 859 . 1 1 70 70 ARG CA C 13 59.086 0.300 . 1 . . . . 70 ARG CA . 11329 1 860 . 1 1 70 70 ARG CB C 13 30.151 0.300 . 1 . . . . 70 ARG CB . 11329 1 861 . 1 1 70 70 ARG CD C 13 43.575 0.300 . 1 . . . . 70 ARG CD . 11329 1 862 . 1 1 70 70 ARG CG C 13 27.179 0.300 . 1 . . . . 70 ARG CG . 11329 1 863 . 1 1 70 70 ARG N N 15 121.361 0.300 . 1 . . . . 70 ARG N . 11329 1 864 . 1 1 71 71 ASN H H 1 8.001 0.030 . 1 . . . . 71 ASN H . 11329 1 865 . 1 1 71 71 ASN HA H 1 4.611 0.030 . 1 . . . . 71 ASN HA . 11329 1 866 . 1 1 71 71 ASN HB2 H 1 2.940 0.030 . 2 . . . . 71 ASN HB2 . 11329 1 867 . 1 1 71 71 ASN HB3 H 1 2.597 0.030 . 2 . . . . 71 ASN HB3 . 11329 1 868 . 1 1 71 71 ASN HD21 H 1 7.569 0.030 . 2 . . . . 71 ASN HD21 . 11329 1 869 . 1 1 71 71 ASN HD22 H 1 6.848 0.030 . 2 . . . . 71 ASN HD22 . 11329 1 870 . 1 1 71 71 ASN C C 13 174.437 0.300 . 1 . . . . 71 ASN C . 11329 1 871 . 1 1 71 71 ASN CA C 13 52.300 0.300 . 1 . . . . 71 ASN CA . 11329 1 872 . 1 1 71 71 ASN CB C 13 38.127 0.300 . 1 . . . . 71 ASN CB . 11329 1 873 . 1 1 71 71 ASN N N 15 113.012 0.300 . 1 . . . . 71 ASN N . 11329 1 874 . 1 1 71 71 ASN ND2 N 15 112.152 0.300 . 1 . . . . 71 ASN ND2 . 11329 1 875 . 1 1 72 72 HIS H H 1 7.441 0.030 . 1 . . . . 72 HIS H . 11329 1 876 . 1 1 72 72 HIS HA H 1 4.203 0.030 . 1 . . . . 72 HIS HA . 11329 1 877 . 1 1 72 72 HIS HB2 H 1 3.405 0.030 . 2 . . . . 72 HIS HB2 . 11329 1 878 . 1 1 72 72 HIS HB3 H 1 2.999 0.030 . 2 . . . . 72 HIS HB3 . 11329 1 879 . 1 1 72 72 HIS HD2 H 1 7.006 0.030 . 1 . . . . 72 HIS HD2 . 11329 1 880 . 1 1 72 72 HIS HE1 H 1 8.088 0.030 . 1 . . . . 72 HIS HE1 . 11329 1 881 . 1 1 72 72 HIS C C 13 174.967 0.300 . 1 . . . . 72 HIS C . 11329 1 882 . 1 1 72 72 HIS CA C 13 56.835 0.300 . 1 . . . . 72 HIS CA . 11329 1 883 . 1 1 72 72 HIS CB C 13 27.889 0.300 . 1 . . . . 72 HIS CB . 11329 1 884 . 1 1 72 72 HIS CD2 C 13 119.895 0.300 . 1 . . . . 72 HIS CD2 . 11329 1 885 . 1 1 72 72 HIS CE1 C 13 140.235 0.300 . 1 . . . . 72 HIS CE1 . 11329 1 886 . 1 1 72 72 HIS N N 15 113.753 0.300 . 1 . . . . 72 HIS N . 11329 1 887 . 1 1 73 73 LYS H H 1 8.487 0.030 . 1 . . . . 73 LYS H . 11329 1 888 . 1 1 73 73 LYS HA H 1 4.099 0.030 . 1 . . . . 73 LYS HA . 11329 1 889 . 1 1 73 73 LYS HB2 H 1 1.514 0.030 . 2 . . . . 73 LYS HB2 . 11329 1 890 . 1 1 73 73 LYS HB3 H 1 1.446 0.030 . 2 . . . . 73 LYS HB3 . 11329 1 891 . 1 1 73 73 LYS HD2 H 1 1.562 0.030 . 1 . . . . 73 LYS HD2 . 11329 1 892 . 1 1 73 73 LYS HD3 H 1 1.562 0.030 . 1 . . . . 73 LYS HD3 . 11329 1 893 . 1 1 73 73 LYS HE2 H 1 2.939 0.030 . 1 . . . . 73 LYS HE2 . 11329 1 894 . 1 1 73 73 LYS HE3 H 1 2.939 0.030 . 1 . . . . 73 LYS HE3 . 11329 1 895 . 1 1 73 73 LYS HG2 H 1 1.378 0.030 . 2 . . . . 73 LYS HG2 . 11329 1 896 . 1 1 73 73 LYS HG3 H 1 1.192 0.030 . 2 . . . . 73 LYS HG3 . 11329 1 897 . 1 1 73 73 LYS C C 13 178.224 0.300 . 1 . . . . 73 LYS C . 11329 1 898 . 1 1 73 73 LYS CA C 13 56.835 0.300 . 1 . . . . 73 LYS CA . 11329 1 899 . 1 1 73 73 LYS CB C 13 31.710 0.300 . 1 . . . . 73 LYS CB . 11329 1 900 . 1 1 73 73 LYS CD C 13 28.086 0.300 . 1 . . . . 73 LYS CD . 11329 1 901 . 1 1 73 73 LYS CE C 13 42.176 0.300 . 1 . . . . 73 LYS CE . 11329 1 902 . 1 1 73 73 LYS CG C 13 24.828 0.300 . 1 . . . . 73 LYS CG . 11329 1 903 . 1 1 73 73 LYS N N 15 116.974 0.300 . 1 . . . . 73 LYS N . 11329 1 904 . 1 1 74 74 TYR H H 1 6.598 0.030 . 1 . . . . 74 TYR H . 11329 1 905 . 1 1 74 74 TYR HA H 1 4.913 0.030 . 1 . . . . 74 TYR HA . 11329 1 906 . 1 1 74 74 TYR HB2 H 1 3.264 0.030 . 2 . . . . 74 TYR HB2 . 11329 1 907 . 1 1 74 74 TYR HB3 H 1 2.768 0.030 . 2 . . . . 74 TYR HB3 . 11329 1 908 . 1 1 74 74 TYR HD1 H 1 6.903 0.030 . 3 . . . . 74 TYR HD1 . 11329 1 909 . 1 1 74 74 TYR HD2 H 1 6.903 0.030 . 3 . . . . 74 TYR HD2 . 11329 1 910 . 1 1 74 74 TYR HE1 H 1 6.810 0.030 . 1 . . . . 74 TYR HE1 . 11329 1 911 . 1 1 74 74 TYR HE2 H 1 6.810 0.030 . 1 . . . . 74 TYR HE2 . 11329 1 912 . 1 1 74 74 TYR C C 13 175.803 0.300 . 1 . . . . 74 TYR C . 11329 1 913 . 1 1 74 74 TYR CA C 13 54.917 0.300 . 1 . . . . 74 TYR CA . 11329 1 914 . 1 1 74 74 TYR CB C 13 39.322 0.300 . 1 . . . . 74 TYR CB . 11329 1 915 . 1 1 74 74 TYR CD1 C 13 129.382 0.300 . 3 . . . . 74 TYR CD1 . 11329 1 916 . 1 1 74 74 TYR CD2 C 13 132.651 0.300 . 3 . . . . 74 TYR CD2 . 11329 1 917 . 1 1 74 74 TYR CE1 C 13 118.249 0.300 . 1 . . . . 74 TYR CE1 . 11329 1 918 . 1 1 74 74 TYR CE2 C 13 118.249 0.300 . 1 . . . . 74 TYR CE2 . 11329 1 919 . 1 1 74 74 TYR N N 15 115.686 0.300 . 1 . . . . 74 TYR N . 11329 1 920 . 1 1 75 75 ARG H H 1 9.869 0.030 . 1 . . . . 75 ARG H . 11329 1 921 . 1 1 75 75 ARG HA H 1 4.796 0.030 . 1 . . . . 75 ARG HA . 11329 1 922 . 1 1 75 75 ARG HB2 H 1 1.914 0.030 . 2 . . . . 75 ARG HB2 . 11329 1 923 . 1 1 75 75 ARG HB3 H 1 2.242 0.030 . 2 . . . . 75 ARG HB3 . 11329 1 924 . 1 1 75 75 ARG HD2 H 1 3.279 0.030 . 2 . . . . 75 ARG HD2 . 11329 1 925 . 1 1 75 75 ARG HD3 H 1 3.055 0.030 . 2 . . . . 75 ARG HD3 . 11329 1 926 . 1 1 75 75 ARG HG2 H 1 1.875 0.030 . 2 . . . . 75 ARG HG2 . 11329 1 927 . 1 1 75 75 ARG HG3 H 1 1.819 0.030 . 2 . . . . 75 ARG HG3 . 11329 1 928 . 1 1 75 75 ARG C C 13 175.308 0.300 . 1 . . . . 75 ARG C . 11329 1 929 . 1 1 75 75 ARG CA C 13 53.742 0.300 . 1 . . . . 75 ARG CA . 11329 1 930 . 1 1 75 75 ARG CB C 13 29.443 0.300 . 1 . . . . 75 ARG CB . 11329 1 931 . 1 1 75 75 ARG CD C 13 41.965 0.300 . 1 . . . . 75 ARG CD . 11329 1 932 . 1 1 75 75 ARG CG C 13 25.342 0.300 . 1 . . . . 75 ARG CG . 11329 1 933 . 1 1 75 75 ARG N N 15 121.151 0.300 . 1 . . . . 75 ARG N . 11329 1 934 . 1 1 76 76 SER H H 1 7.820 0.030 . 1 . . . . 76 SER H . 11329 1 935 . 1 1 76 76 SER HA H 1 4.629 0.030 . 1 . . . . 76 SER HA . 11329 1 936 . 1 1 76 76 SER HB2 H 1 4.223 0.030 . 2 . . . . 76 SER HB2 . 11329 1 937 . 1 1 76 76 SER HB3 H 1 4.006 0.030 . 2 . . . . 76 SER HB3 . 11329 1 938 . 1 1 76 76 SER C C 13 174.566 0.300 . 1 . . . . 76 SER C . 11329 1 939 . 1 1 76 76 SER CA C 13 56.367 0.300 . 1 . . . . 76 SER CA . 11329 1 940 . 1 1 76 76 SER CB C 13 66.228 0.300 . 1 . . . . 76 SER CB . 11329 1 941 . 1 1 76 76 SER N N 15 110.592 0.300 . 1 . . . . 76 SER N . 11329 1 942 . 1 1 77 77 LEU HA H 1 4.078 0.030 . 1 . . . . 77 LEU HA . 11329 1 943 . 1 1 77 77 LEU HB2 H 1 1.898 0.030 . 2 . . . . 77 LEU HB2 . 11329 1 944 . 1 1 77 77 LEU HB3 H 1 1.304 0.030 . 2 . . . . 77 LEU HB3 . 11329 1 945 . 1 1 77 77 LEU HD11 H 1 0.755 0.030 . 1 . . . . 77 LEU HD1 . 11329 1 946 . 1 1 77 77 LEU HD12 H 1 0.755 0.030 . 1 . . . . 77 LEU HD1 . 11329 1 947 . 1 1 77 77 LEU HD13 H 1 0.755 0.030 . 1 . . . . 77 LEU HD1 . 11329 1 948 . 1 1 77 77 LEU HD21 H 1 0.915 0.030 . 1 . . . . 77 LEU HD2 . 11329 1 949 . 1 1 77 77 LEU HD22 H 1 0.915 0.030 . 1 . . . . 77 LEU HD2 . 11329 1 950 . 1 1 77 77 LEU HD23 H 1 0.915 0.030 . 1 . . . . 77 LEU HD2 . 11329 1 951 . 1 1 77 77 LEU HG H 1 1.784 0.030 . 1 . . . . 77 LEU HG . 11329 1 952 . 1 1 77 77 LEU CA C 13 57.713 0.300 . 1 . . . . 77 LEU CA . 11329 1 953 . 1 1 77 77 LEU CB C 13 40.814 0.300 . 1 . . . . 77 LEU CB . 11329 1 954 . 1 1 77 77 LEU CD1 C 13 23.844 0.300 . 2 . . . . 77 LEU CD1 . 11329 1 955 . 1 1 77 77 LEU CD2 C 13 25.519 0.300 . 2 . . . . 77 LEU CD2 . 11329 1 956 . 1 1 77 77 LEU CG C 13 27.334 0.300 . 1 . . . . 77 LEU CG . 11329 1 957 . 1 1 78 78 GLY HA2 H 1 3.955 0.030 . 2 . . . . 78 GLY HA2 . 11329 1 958 . 1 1 78 78 GLY HA3 H 1 3.834 0.030 . 2 . . . . 78 GLY HA3 . 11329 1 959 . 1 1 78 78 GLY C C 13 176.461 0.300 . 1 . . . . 78 GLY C . 11329 1 960 . 1 1 78 78 GLY CA C 13 47.234 0.300 . 1 . . . . 78 GLY CA . 11329 1 961 . 1 1 79 79 ASP H H 1 7.694 0.030 . 1 . . . . 79 ASP H . 11329 1 962 . 1 1 79 79 ASP HA H 1 4.351 0.030 . 1 . . . . 79 ASP HA . 11329 1 963 . 1 1 79 79 ASP HB2 H 1 3.137 0.030 . 2 . . . . 79 ASP HB2 . 11329 1 964 . 1 1 79 79 ASP HB3 H 1 2.958 0.030 . 2 . . . . 79 ASP HB3 . 11329 1 965 . 1 1 79 79 ASP C C 13 177.891 0.300 . 1 . . . . 79 ASP C . 11329 1 966 . 1 1 79 79 ASP CA C 13 57.306 0.300 . 1 . . . . 79 ASP CA . 11329 1 967 . 1 1 79 79 ASP CB C 13 41.087 0.300 . 1 . . . . 79 ASP CB . 11329 1 968 . 1 1 79 79 ASP N N 15 122.920 0.300 . 1 . . . . 79 ASP N . 11329 1 969 . 1 1 80 80 LEU H H 1 6.742 0.030 . 1 . . . . 80 LEU H . 11329 1 970 . 1 1 80 80 LEU HA H 1 2.877 0.030 . 1 . . . . 80 LEU HA . 11329 1 971 . 1 1 80 80 LEU HB2 H 1 2.065 0.030 . 2 . . . . 80 LEU HB2 . 11329 1 972 . 1 1 80 80 LEU HB3 H 1 1.091 0.030 . 2 . . . . 80 LEU HB3 . 11329 1 973 . 1 1 80 80 LEU HD11 H 1 0.752 0.030 . 1 . . . . 80 LEU HD1 . 11329 1 974 . 1 1 80 80 LEU HD12 H 1 0.752 0.030 . 1 . . . . 80 LEU HD1 . 11329 1 975 . 1 1 80 80 LEU HD13 H 1 0.752 0.030 . 1 . . . . 80 LEU HD1 . 11329 1 976 . 1 1 80 80 LEU HD21 H 1 1.003 0.030 . 1 . . . . 80 LEU HD2 . 11329 1 977 . 1 1 80 80 LEU HD22 H 1 1.003 0.030 . 1 . . . . 80 LEU HD2 . 11329 1 978 . 1 1 80 80 LEU HD23 H 1 1.003 0.030 . 1 . . . . 80 LEU HD2 . 11329 1 979 . 1 1 80 80 LEU HG H 1 1.460 0.030 . 1 . . . . 80 LEU HG . 11329 1 980 . 1 1 80 80 LEU C C 13 177.445 0.300 . 1 . . . . 80 LEU C . 11329 1 981 . 1 1 80 80 LEU CA C 13 57.307 0.300 . 1 . . . . 80 LEU CA . 11329 1 982 . 1 1 80 80 LEU CB C 13 41.724 0.300 . 1 . . . . 80 LEU CB . 11329 1 983 . 1 1 80 80 LEU CD1 C 13 24.807 0.300 . 2 . . . . 80 LEU CD1 . 11329 1 984 . 1 1 80 80 LEU CD2 C 13 26.519 0.300 . 2 . . . . 80 LEU CD2 . 11329 1 985 . 1 1 80 80 LEU CG C 13 27.357 0.300 . 1 . . . . 80 LEU CG . 11329 1 986 . 1 1 80 80 LEU N N 15 121.100 0.300 . 1 . . . . 80 LEU N . 11329 1 987 . 1 1 81 81 GLU H H 1 8.503 0.030 . 1 . . . . 81 GLU H . 11329 1 988 . 1 1 81 81 GLU HA H 1 3.167 0.030 . 1 . . . . 81 GLU HA . 11329 1 989 . 1 1 81 81 GLU HB2 H 1 2.260 0.030 . 1 . . . . 81 GLU HB2 . 11329 1 990 . 1 1 81 81 GLU HB3 H 1 2.260 0.030 . 1 . . . . 81 GLU HB3 . 11329 1 991 . 1 1 81 81 GLU HG2 H 1 2.085 0.030 . 2 . . . . 81 GLU HG2 . 11329 1 992 . 1 1 81 81 GLU HG3 H 1 2.001 0.030 . 2 . . . . 81 GLU HG3 . 11329 1 993 . 1 1 81 81 GLU C C 13 177.381 0.300 . 1 . . . . 81 GLU C . 11329 1 994 . 1 1 81 81 GLU CA C 13 59.530 0.300 . 1 . . . . 81 GLU CA . 11329 1 995 . 1 1 81 81 GLU CB C 13 29.799 0.300 . 1 . . . . 81 GLU CB . 11329 1 996 . 1 1 81 81 GLU CG C 13 36.715 0.300 . 1 . . . . 81 GLU CG . 11329 1 997 . 1 1 81 81 GLU N N 15 118.425 0.300 . 1 . . . . 81 GLU N . 11329 1 998 . 1 1 82 82 LYS H H 1 7.663 0.030 . 1 . . . . 82 LYS H . 11329 1 999 . 1 1 82 82 LYS HA H 1 3.844 0.030 . 1 . . . . 82 LYS HA . 11329 1 1000 . 1 1 82 82 LYS HB2 H 1 1.915 0.030 . 1 . . . . 82 LYS HB2 . 11329 1 1001 . 1 1 82 82 LYS HB3 H 1 1.915 0.030 . 1 . . . . 82 LYS HB3 . 11329 1 1002 . 1 1 82 82 LYS HD2 H 1 1.694 0.030 . 1 . . . . 82 LYS HD2 . 11329 1 1003 . 1 1 82 82 LYS HD3 H 1 1.694 0.030 . 1 . . . . 82 LYS HD3 . 11329 1 1004 . 1 1 82 82 LYS HE2 H 1 3.000 0.030 . 1 . . . . 82 LYS HE2 . 11329 1 1005 . 1 1 82 82 LYS HE3 H 1 3.000 0.030 . 1 . . . . 82 LYS HE3 . 11329 1 1006 . 1 1 82 82 LYS HG2 H 1 1.666 0.030 . 2 . . . . 82 LYS HG2 . 11329 1 1007 . 1 1 82 82 LYS HG3 H 1 1.444 0.030 . 2 . . . . 82 LYS HG3 . 11329 1 1008 . 1 1 82 82 LYS C C 13 179.681 0.300 . 1 . . . . 82 LYS C . 11329 1 1009 . 1 1 82 82 LYS CA C 13 60.198 0.300 . 1 . . . . 82 LYS CA . 11329 1 1010 . 1 1 82 82 LYS CB C 13 32.268 0.300 . 1 . . . . 82 LYS CB . 11329 1 1011 . 1 1 82 82 LYS CD C 13 29.651 0.300 . 1 . . . . 82 LYS CD . 11329 1 1012 . 1 1 82 82 LYS CE C 13 42.341 0.300 . 1 . . . . 82 LYS CE . 11329 1 1013 . 1 1 82 82 LYS CG C 13 25.531 0.300 . 1 . . . . 82 LYS CG . 11329 1 1014 . 1 1 82 82 LYS N N 15 116.830 0.300 . 1 . . . . 82 LYS N . 11329 1 1015 . 1 1 83 83 ASP H H 1 6.878 0.030 . 1 . . . . 83 ASP H . 11329 1 1016 . 1 1 83 83 ASP HA H 1 4.931 0.030 . 1 . . . . 83 ASP HA . 11329 1 1017 . 1 1 83 83 ASP HB2 H 1 2.689 0.030 . 2 . . . . 83 ASP HB2 . 11329 1 1018 . 1 1 83 83 ASP HB3 H 1 2.475 0.030 . 2 . . . . 83 ASP HB3 . 11329 1 1019 . 1 1 83 83 ASP C C 13 178.318 0.300 . 1 . . . . 83 ASP C . 11329 1 1020 . 1 1 83 83 ASP CA C 13 56.331 0.300 . 1 . . . . 83 ASP CA . 11329 1 1021 . 1 1 83 83 ASP CB C 13 40.257 0.300 . 1 . . . . 83 ASP CB . 11329 1 1022 . 1 1 83 83 ASP N N 15 119.518 0.300 . 1 . . . . 83 ASP N . 11329 1 1023 . 1 1 84 84 VAL H H 1 7.657 0.030 . 1 . . . . 84 VAL H . 11329 1 1024 . 1 1 84 84 VAL HA H 1 3.196 0.030 . 1 . . . . 84 VAL HA . 11329 1 1025 . 1 1 84 84 VAL HB H 1 1.115 0.030 . 1 . . . . 84 VAL HB . 11329 1 1026 . 1 1 84 84 VAL HG11 H 1 0.443 0.030 . 1 . . . . 84 VAL HG1 . 11329 1 1027 . 1 1 84 84 VAL HG12 H 1 0.443 0.030 . 1 . . . . 84 VAL HG1 . 11329 1 1028 . 1 1 84 84 VAL HG13 H 1 0.443 0.030 . 1 . . . . 84 VAL HG1 . 11329 1 1029 . 1 1 84 84 VAL HG21 H 1 0.687 0.030 . 1 . . . . 84 VAL HG2 . 11329 1 1030 . 1 1 84 84 VAL HG22 H 1 0.687 0.030 . 1 . . . . 84 VAL HG2 . 11329 1 1031 . 1 1 84 84 VAL HG23 H 1 0.687 0.030 . 1 . . . . 84 VAL HG2 . 11329 1 1032 . 1 1 84 84 VAL C C 13 177.726 0.300 . 1 . . . . 84 VAL C . 11329 1 1033 . 1 1 84 84 VAL CA C 13 66.736 0.300 . 1 . . . . 84 VAL CA . 11329 1 1034 . 1 1 84 84 VAL CB C 13 31.020 0.300 . 1 . . . . 84 VAL CB . 11329 1 1035 . 1 1 84 84 VAL CG1 C 13 20.249 0.300 . 2 . . . . 84 VAL CG1 . 11329 1 1036 . 1 1 84 84 VAL CG2 C 13 23.849 0.300 . 2 . . . . 84 VAL CG2 . 11329 1 1037 . 1 1 84 84 VAL N N 15 120.801 0.300 . 1 . . . . 84 VAL N . 11329 1 1038 . 1 1 85 85 MET H H 1 8.705 0.030 . 1 . . . . 85 MET H . 11329 1 1039 . 1 1 85 85 MET HA H 1 4.061 0.030 . 1 . . . . 85 MET HA . 11329 1 1040 . 1 1 85 85 MET HB2 H 1 1.740 0.030 . 2 . . . . 85 MET HB2 . 11329 1 1041 . 1 1 85 85 MET HB3 H 1 2.037 0.030 . 2 . . . . 85 MET HB3 . 11329 1 1042 . 1 1 85 85 MET HE1 H 1 1.998 0.030 . 1 . . . . 85 MET HE . 11329 1 1043 . 1 1 85 85 MET HE2 H 1 1.998 0.030 . 1 . . . . 85 MET HE . 11329 1 1044 . 1 1 85 85 MET HE3 H 1 1.998 0.030 . 1 . . . . 85 MET HE . 11329 1 1045 . 1 1 85 85 MET HG2 H 1 2.876 0.030 . 2 . . . . 85 MET HG2 . 11329 1 1046 . 1 1 85 85 MET HG3 H 1 2.538 0.030 . 2 . . . . 85 MET HG3 . 11329 1 1047 . 1 1 85 85 MET C C 13 178.788 0.300 . 1 . . . . 85 MET C . 11329 1 1048 . 1 1 85 85 MET CA C 13 57.146 0.300 . 1 . . . . 85 MET CA . 11329 1 1049 . 1 1 85 85 MET CB C 13 30.695 0.300 . 1 . . . . 85 MET CB . 11329 1 1050 . 1 1 85 85 MET CE C 13 18.460 0.300 . 1 . . . . 85 MET CE . 11329 1 1051 . 1 1 85 85 MET CG C 13 33.397 0.300 . 1 . . . . 85 MET CG . 11329 1 1052 . 1 1 85 85 MET N N 15 117.236 0.300 . 1 . . . . 85 MET N . 11329 1 1053 . 1 1 86 86 LEU H H 1 7.701 0.030 . 1 . . . . 86 LEU H . 11329 1 1054 . 1 1 86 86 LEU HA H 1 4.150 0.030 . 1 . . . . 86 LEU HA . 11329 1 1055 . 1 1 86 86 LEU HB2 H 1 1.608 0.030 . 2 . . . . 86 LEU HB2 . 11329 1 1056 . 1 1 86 86 LEU HB3 H 1 2.068 0.030 . 2 . . . . 86 LEU HB3 . 11329 1 1057 . 1 1 86 86 LEU HD11 H 1 1.009 0.030 . 1 . . . . 86 LEU HD1 . 11329 1 1058 . 1 1 86 86 LEU HD12 H 1 1.009 0.030 . 1 . . . . 86 LEU HD1 . 11329 1 1059 . 1 1 86 86 LEU HD13 H 1 1.009 0.030 . 1 . . . . 86 LEU HD1 . 11329 1 1060 . 1 1 86 86 LEU HD21 H 1 0.975 0.030 . 1 . . . . 86 LEU HD2 . 11329 1 1061 . 1 1 86 86 LEU HD22 H 1 0.975 0.030 . 1 . . . . 86 LEU HD2 . 11329 1 1062 . 1 1 86 86 LEU HD23 H 1 0.975 0.030 . 1 . . . . 86 LEU HD2 . 11329 1 1063 . 1 1 86 86 LEU HG H 1 1.541 0.030 . 1 . . . . 86 LEU HG . 11329 1 1064 . 1 1 86 86 LEU C C 13 177.056 0.300 . 1 . . . . 86 LEU C . 11329 1 1065 . 1 1 86 86 LEU CA C 13 58.131 0.300 . 1 . . . . 86 LEU CA . 11329 1 1066 . 1 1 86 86 LEU CB C 13 42.192 0.300 . 1 . . . . 86 LEU CB . 11329 1 1067 . 1 1 86 86 LEU CD1 C 13 23.233 0.300 . 2 . . . . 86 LEU CD1 . 11329 1 1068 . 1 1 86 86 LEU CD2 C 13 25.971 0.300 . 2 . . . . 86 LEU CD2 . 11329 1 1069 . 1 1 86 86 LEU CG C 13 27.268 0.300 . 1 . . . . 86 LEU CG . 11329 1 1070 . 1 1 86 86 LEU N N 15 123.127 0.300 . 1 . . . . 86 LEU N . 11329 1 1071 . 1 1 87 87 LEU H H 1 7.826 0.030 . 1 . . . . 87 LEU H . 11329 1 1072 . 1 1 87 87 LEU HA H 1 3.597 0.030 . 1 . . . . 87 LEU HA . 11329 1 1073 . 1 1 87 87 LEU HB2 H 1 1.435 0.030 . 2 . . . . 87 LEU HB2 . 11329 1 1074 . 1 1 87 87 LEU HB3 H 1 1.857 0.030 . 2 . . . . 87 LEU HB3 . 11329 1 1075 . 1 1 87 87 LEU HD11 H 1 -0.154 0.030 . 1 . . . . 87 LEU HD1 . 11329 1 1076 . 1 1 87 87 LEU HD12 H 1 -0.154 0.030 . 1 . . . . 87 LEU HD1 . 11329 1 1077 . 1 1 87 87 LEU HD13 H 1 -0.154 0.030 . 1 . . . . 87 LEU HD1 . 11329 1 1078 . 1 1 87 87 LEU HD21 H 1 0.214 0.030 . 1 . . . . 87 LEU HD2 . 11329 1 1079 . 1 1 87 87 LEU HD22 H 1 0.214 0.030 . 1 . . . . 87 LEU HD2 . 11329 1 1080 . 1 1 87 87 LEU HD23 H 1 0.214 0.030 . 1 . . . . 87 LEU HD2 . 11329 1 1081 . 1 1 87 87 LEU HG H 1 1.457 0.030 . 1 . . . . 87 LEU HG . 11329 1 1082 . 1 1 87 87 LEU C C 13 180.937 0.300 . 1 . . . . 87 LEU C . 11329 1 1083 . 1 1 87 87 LEU CA C 13 60.421 0.300 . 1 . . . . 87 LEU CA . 11329 1 1084 . 1 1 87 87 LEU CB C 13 42.026 0.300 . 1 . . . . 87 LEU CB . 11329 1 1085 . 1 1 87 87 LEU CD1 C 13 27.417 0.300 . 2 . . . . 87 LEU CD1 . 11329 1 1086 . 1 1 87 87 LEU CD2 C 13 24.463 0.300 . 2 . . . . 87 LEU CD2 . 11329 1 1087 . 1 1 87 87 LEU CG C 13 27.038 0.300 . 1 . . . . 87 LEU CG . 11329 1 1088 . 1 1 87 87 LEU N N 15 121.438 0.300 . 1 . . . . 87 LEU N . 11329 1 1089 . 1 1 88 88 CYS H H 1 7.825 0.030 . 1 . . . . 88 CYS H . 11329 1 1090 . 1 1 88 88 CYS HA H 1 3.757 0.030 . 1 . . . . 88 CYS HA . 11329 1 1091 . 1 1 88 88 CYS HB2 H 1 2.809 0.030 . 2 . . . . 88 CYS HB2 . 11329 1 1092 . 1 1 88 88 CYS HB3 H 1 2.477 0.030 . 2 . . . . 88 CYS HB3 . 11329 1 1093 . 1 1 88 88 CYS C C 13 175.546 0.300 . 1 . . . . 88 CYS C . 11329 1 1094 . 1 1 88 88 CYS CA C 13 64.526 0.300 . 1 . . . . 88 CYS CA . 11329 1 1095 . 1 1 88 88 CYS CB C 13 26.519 0.300 . 1 . . . . 88 CYS CB . 11329 1 1096 . 1 1 88 88 CYS N N 15 119.140 0.300 . 1 . . . . 88 CYS N . 11329 1 1097 . 1 1 89 89 HIS H H 1 9.059 0.030 . 1 . . . . 89 HIS H . 11329 1 1098 . 1 1 89 89 HIS HA H 1 4.054 0.030 . 1 . . . . 89 HIS HA . 11329 1 1099 . 1 1 89 89 HIS HB2 H 1 3.182 0.030 . 1 . . . . 89 HIS HB2 . 11329 1 1100 . 1 1 89 89 HIS HB3 H 1 3.182 0.030 . 1 . . . . 89 HIS HB3 . 11329 1 1101 . 1 1 89 89 HIS HD2 H 1 6.961 0.030 . 1 . . . . 89 HIS HD2 . 11329 1 1102 . 1 1 89 89 HIS HE1 H 1 7.871 0.030 . 1 . . . . 89 HIS HE1 . 11329 1 1103 . 1 1 89 89 HIS C C 13 179.245 0.300 . 1 . . . . 89 HIS C . 11329 1 1104 . 1 1 89 89 HIS CA C 13 59.511 0.300 . 1 . . . . 89 HIS CA . 11329 1 1105 . 1 1 89 89 HIS CB C 13 29.756 0.300 . 1 . . . . 89 HIS CB . 11329 1 1106 . 1 1 89 89 HIS CD2 C 13 119.983 0.300 . 1 . . . . 89 HIS CD2 . 11329 1 1107 . 1 1 89 89 HIS CE1 C 13 137.861 0.300 . 1 . . . . 89 HIS CE1 . 11329 1 1108 . 1 1 89 89 HIS N N 15 121.642 0.300 . 1 . . . . 89 HIS N . 11329 1 1109 . 1 1 90 90 ASN H H 1 9.418 0.030 . 1 . . . . 90 ASN H . 11329 1 1110 . 1 1 90 90 ASN HA H 1 4.278 0.030 . 1 . . . . 90 ASN HA . 11329 1 1111 . 1 1 90 90 ASN HB2 H 1 2.632 0.030 . 2 . . . . 90 ASN HB2 . 11329 1 1112 . 1 1 90 90 ASN HB3 H 1 3.117 0.030 . 2 . . . . 90 ASN HB3 . 11329 1 1113 . 1 1 90 90 ASN HD21 H 1 7.991 0.030 . 2 . . . . 90 ASN HD21 . 11329 1 1114 . 1 1 90 90 ASN HD22 H 1 6.644 0.030 . 2 . . . . 90 ASN HD22 . 11329 1 1115 . 1 1 90 90 ASN C C 13 178.015 0.300 . 1 . . . . 90 ASN C . 11329 1 1116 . 1 1 90 90 ASN CA C 13 55.460 0.300 . 1 . . . . 90 ASN CA . 11329 1 1117 . 1 1 90 90 ASN CB C 13 37.392 0.300 . 1 . . . . 90 ASN CB . 11329 1 1118 . 1 1 90 90 ASN N N 15 121.162 0.300 . 1 . . . . 90 ASN N . 11329 1 1119 . 1 1 90 90 ASN ND2 N 15 112.625 0.300 . 1 . . . . 90 ASN ND2 . 11329 1 1120 . 1 1 91 91 ALA H H 1 7.496 0.030 . 1 . . . . 91 ALA H . 11329 1 1121 . 1 1 91 91 ALA HA H 1 4.461 0.030 . 1 . . . . 91 ALA HA . 11329 1 1122 . 1 1 91 91 ALA HB1 H 1 1.772 0.030 . 1 . . . . 91 ALA HB . 11329 1 1123 . 1 1 91 91 ALA HB2 H 1 1.772 0.030 . 1 . . . . 91 ALA HB . 11329 1 1124 . 1 1 91 91 ALA HB3 H 1 1.772 0.030 . 1 . . . . 91 ALA HB . 11329 1 1125 . 1 1 91 91 ALA C C 13 180.829 0.300 . 1 . . . . 91 ALA C . 11329 1 1126 . 1 1 91 91 ALA CA C 13 55.440 0.300 . 1 . . . . 91 ALA CA . 11329 1 1127 . 1 1 91 91 ALA CB C 13 18.948 0.300 . 1 . . . . 91 ALA CB . 11329 1 1128 . 1 1 91 91 ALA N N 15 123.030 0.300 . 1 . . . . 91 ALA N . 11329 1 1129 . 1 1 92 92 GLN H H 1 7.742 0.030 . 1 . . . . 92 GLN H . 11329 1 1130 . 1 1 92 92 GLN HA H 1 4.140 0.030 . 1 . . . . 92 GLN HA . 11329 1 1131 . 1 1 92 92 GLN HB2 H 1 2.008 0.030 . 2 . . . . 92 GLN HB2 . 11329 1 1132 . 1 1 92 92 GLN HB3 H 1 1.852 0.030 . 2 . . . . 92 GLN HB3 . 11329 1 1133 . 1 1 92 92 GLN HE21 H 1 6.792 0.030 . 2 . . . . 92 GLN HE21 . 11329 1 1134 . 1 1 92 92 GLN HE22 H 1 6.603 0.030 . 2 . . . . 92 GLN HE22 . 11329 1 1135 . 1 1 92 92 GLN HG2 H 1 2.376 0.030 . 2 . . . . 92 GLN HG2 . 11329 1 1136 . 1 1 92 92 GLN HG3 H 1 0.955 0.030 . 2 . . . . 92 GLN HG3 . 11329 1 1137 . 1 1 92 92 GLN C C 13 175.239 0.300 . 1 . . . . 92 GLN C . 11329 1 1138 . 1 1 92 92 GLN CA C 13 56.926 0.300 . 1 . . . . 92 GLN CA . 11329 1 1139 . 1 1 92 92 GLN CB C 13 27.630 0.300 . 1 . . . . 92 GLN CB . 11329 1 1140 . 1 1 92 92 GLN CG C 13 32.452 0.300 . 1 . . . . 92 GLN CG . 11329 1 1141 . 1 1 92 92 GLN N N 15 116.992 0.300 . 1 . . . . 92 GLN N . 11329 1 1142 . 1 1 92 92 GLN NE2 N 15 109.340 0.300 . 1 . . . . 92 GLN NE2 . 11329 1 1143 . 1 1 93 93 THR H H 1 7.814 0.030 . 1 . . . . 93 THR H . 11329 1 1144 . 1 1 93 93 THR HA H 1 4.201 0.030 . 1 . . . . 93 THR HA . 11329 1 1145 . 1 1 93 93 THR HB H 1 4.203 0.030 . 1 . . . . 93 THR HB . 11329 1 1146 . 1 1 93 93 THR HG21 H 1 1.141 0.030 . 1 . . . . 93 THR HG2 . 11329 1 1147 . 1 1 93 93 THR HG22 H 1 1.141 0.030 . 1 . . . . 93 THR HG2 . 11329 1 1148 . 1 1 93 93 THR HG23 H 1 1.141 0.030 . 1 . . . . 93 THR HG2 . 11329 1 1149 . 1 1 93 93 THR C C 13 175.165 0.300 . 1 . . . . 93 THR C . 11329 1 1150 . 1 1 93 93 THR CA C 13 64.813 0.300 . 1 . . . . 93 THR CA . 11329 1 1151 . 1 1 93 93 THR CB C 13 69.056 0.300 . 1 . . . . 93 THR CB . 11329 1 1152 . 1 1 93 93 THR CG2 C 13 20.860 0.300 . 1 . . . . 93 THR CG2 . 11329 1 1153 . 1 1 93 93 THR N N 15 115.536 0.300 . 1 . . . . 93 THR N . 11329 1 1154 . 1 1 94 94 PHE H H 1 8.107 0.030 . 1 . . . . 94 PHE H . 11329 1 1155 . 1 1 94 94 PHE HA H 1 4.194 0.030 . 1 . . . . 94 PHE HA . 11329 1 1156 . 1 1 94 94 PHE HB2 H 1 2.924 0.030 . 1 . . . . 94 PHE HB2 . 11329 1 1157 . 1 1 94 94 PHE HB3 H 1 2.924 0.030 . 1 . . . . 94 PHE HB3 . 11329 1 1158 . 1 1 94 94 PHE HD1 H 1 7.148 0.030 . 1 . . . . 94 PHE HD1 . 11329 1 1159 . 1 1 94 94 PHE HD2 H 1 7.148 0.030 . 1 . . . . 94 PHE HD2 . 11329 1 1160 . 1 1 94 94 PHE HE1 H 1 7.341 0.030 . 1 . . . . 94 PHE HE1 . 11329 1 1161 . 1 1 94 94 PHE HE2 H 1 7.341 0.030 . 1 . . . . 94 PHE HE2 . 11329 1 1162 . 1 1 94 94 PHE HZ H 1 7.391 0.030 . 1 . . . . 94 PHE HZ . 11329 1 1163 . 1 1 94 94 PHE C C 13 174.430 0.300 . 1 . . . . 94 PHE C . 11329 1 1164 . 1 1 94 94 PHE CA C 13 60.765 0.300 . 1 . . . . 94 PHE CA . 11329 1 1165 . 1 1 94 94 PHE CB C 13 41.112 0.300 . 1 . . . . 94 PHE CB . 11329 1 1166 . 1 1 94 94 PHE CD1 C 13 132.069 0.300 . 1 . . . . 94 PHE CD1 . 11329 1 1167 . 1 1 94 94 PHE CD2 C 13 132.069 0.300 . 1 . . . . 94 PHE CD2 . 11329 1 1168 . 1 1 94 94 PHE CE1 C 13 131.803 0.300 . 1 . . . . 94 PHE CE1 . 11329 1 1169 . 1 1 94 94 PHE CE2 C 13 131.803 0.300 . 1 . . . . 94 PHE CE2 . 11329 1 1170 . 1 1 94 94 PHE CZ C 13 129.870 0.300 . 1 . . . . 94 PHE CZ . 11329 1 1171 . 1 1 94 94 PHE N N 15 118.682 0.300 . 1 . . . . 94 PHE N . 11329 1 1172 . 1 1 95 95 ASN H H 1 7.475 0.030 . 1 . . . . 95 ASN H . 11329 1 1173 . 1 1 95 95 ASN HA H 1 4.717 0.030 . 1 . . . . 95 ASN HA . 11329 1 1174 . 1 1 95 95 ASN HB2 H 1 2.886 0.030 . 1 . . . . 95 ASN HB2 . 11329 1 1175 . 1 1 95 95 ASN HB3 H 1 2.886 0.030 . 1 . . . . 95 ASN HB3 . 11329 1 1176 . 1 1 95 95 ASN HD21 H 1 8.835 0.030 . 2 . . . . 95 ASN HD21 . 11329 1 1177 . 1 1 95 95 ASN HD22 H 1 7.871 0.030 . 2 . . . . 95 ASN HD22 . 11329 1 1178 . 1 1 95 95 ASN C C 13 173.264 0.300 . 1 . . . . 95 ASN C . 11329 1 1179 . 1 1 95 95 ASN CA C 13 52.317 0.300 . 1 . . . . 95 ASN CA . 11329 1 1180 . 1 1 95 95 ASN CB C 13 41.164 0.300 . 1 . . . . 95 ASN CB . 11329 1 1181 . 1 1 95 95 ASN N N 15 113.434 0.300 . 1 . . . . 95 ASN N . 11329 1 1182 . 1 1 95 95 ASN ND2 N 15 117.857 0.300 . 1 . . . . 95 ASN ND2 . 11329 1 1183 . 1 1 96 96 LEU H H 1 8.432 0.030 . 1 . . . . 96 LEU H . 11329 1 1184 . 1 1 96 96 LEU HA H 1 4.161 0.030 . 1 . . . . 96 LEU HA . 11329 1 1185 . 1 1 96 96 LEU HB2 H 1 1.610 0.030 . 2 . . . . 96 LEU HB2 . 11329 1 1186 . 1 1 96 96 LEU HB3 H 1 1.455 0.030 . 2 . . . . 96 LEU HB3 . 11329 1 1187 . 1 1 96 96 LEU HD11 H 1 0.900 0.030 . 1 . . . . 96 LEU HD1 . 11329 1 1188 . 1 1 96 96 LEU HD12 H 1 0.900 0.030 . 1 . . . . 96 LEU HD1 . 11329 1 1189 . 1 1 96 96 LEU HD13 H 1 0.900 0.030 . 1 . . . . 96 LEU HD1 . 11329 1 1190 . 1 1 96 96 LEU HD21 H 1 0.847 0.030 . 1 . . . . 96 LEU HD2 . 11329 1 1191 . 1 1 96 96 LEU HD22 H 1 0.847 0.030 . 1 . . . . 96 LEU HD2 . 11329 1 1192 . 1 1 96 96 LEU HD23 H 1 0.847 0.030 . 1 . . . . 96 LEU HD2 . 11329 1 1193 . 1 1 96 96 LEU HG H 1 1.688 0.030 . 1 . . . . 96 LEU HG . 11329 1 1194 . 1 1 96 96 LEU C C 13 178.136 0.300 . 1 . . . . 96 LEU C . 11329 1 1195 . 1 1 96 96 LEU CA C 13 54.724 0.300 . 1 . . . . 96 LEU CA . 11329 1 1196 . 1 1 96 96 LEU CB C 13 42.901 0.300 . 1 . . . . 96 LEU CB . 11329 1 1197 . 1 1 96 96 LEU CD1 C 13 24.951 0.300 . 2 . . . . 96 LEU CD1 . 11329 1 1198 . 1 1 96 96 LEU CD2 C 13 23.180 0.300 . 2 . . . . 96 LEU CD2 . 11329 1 1199 . 1 1 96 96 LEU CG C 13 26.932 0.300 . 1 . . . . 96 LEU CG . 11329 1 1200 . 1 1 96 96 LEU N N 15 118.160 0.300 . 1 . . . . 96 LEU N . 11329 1 1201 . 1 1 97 97 GLU H H 1 8.634 0.030 . 1 . . . . 97 GLU H . 11329 1 1202 . 1 1 97 97 GLU HA H 1 1.906 0.030 . 1 . . . . 97 GLU HA . 11329 1 1203 . 1 1 97 97 GLU HB2 H 1 1.591 0.030 . 1 . . . . 97 GLU HB2 . 11329 1 1204 . 1 1 97 97 GLU HB3 H 1 1.591 0.030 . 1 . . . . 97 GLU HB3 . 11329 1 1205 . 1 1 97 97 GLU HG2 H 1 1.952 0.030 . 1 . . . . 97 GLU HG2 . 11329 1 1206 . 1 1 97 97 GLU HG3 H 1 1.952 0.030 . 1 . . . . 97 GLU HG3 . 11329 1 1207 . 1 1 97 97 GLU C C 13 176.898 0.300 . 1 . . . . 97 GLU C . 11329 1 1208 . 1 1 97 97 GLU CA C 13 57.714 0.300 . 1 . . . . 97 GLU CA . 11329 1 1209 . 1 1 97 97 GLU CB C 13 28.859 0.300 . 1 . . . . 97 GLU CB . 11329 1 1210 . 1 1 97 97 GLU CG C 13 35.845 0.300 . 1 . . . . 97 GLU CG . 11329 1 1211 . 1 1 97 97 GLU N N 15 125.066 0.300 . 1 . . . . 97 GLU N . 11329 1 1212 . 1 1 98 98 GLY H H 1 7.442 0.030 . 1 . . . . 98 GLY H . 11329 1 1213 . 1 1 98 98 GLY HA2 H 1 4.213 0.030 . 2 . . . . 98 GLY HA2 . 11329 1 1214 . 1 1 98 98 GLY HA3 H 1 3.804 0.030 . 2 . . . . 98 GLY HA3 . 11329 1 1215 . 1 1 98 98 GLY C C 13 174.496 0.300 . 1 . . . . 98 GLY C . 11329 1 1216 . 1 1 98 98 GLY CA C 13 45.198 0.300 . 1 . . . . 98 GLY CA . 11329 1 1217 . 1 1 98 98 GLY N N 15 113.454 0.300 . 1 . . . . 98 GLY N . 11329 1 1218 . 1 1 99 99 SER H H 1 8.066 0.030 . 1 . . . . 99 SER H . 11329 1 1219 . 1 1 99 99 SER HA H 1 4.494 0.030 . 1 . . . . 99 SER HA . 11329 1 1220 . 1 1 99 99 SER HB2 H 1 4.372 0.030 . 2 . . . . 99 SER HB2 . 11329 1 1221 . 1 1 99 99 SER HB3 H 1 4.063 0.030 . 2 . . . . 99 SER HB3 . 11329 1 1222 . 1 1 99 99 SER CA C 13 58.396 0.300 . 1 . . . . 99 SER CA . 11329 1 1223 . 1 1 99 99 SER CB C 13 65.153 0.300 . 1 . . . . 99 SER CB . 11329 1 1224 . 1 1 99 99 SER N N 15 116.403 0.300 . 1 . . . . 99 SER N . 11329 1 1225 . 1 1 100 100 GLN H H 1 8.980 0.030 . 1 . . . . 100 GLN H . 11329 1 1226 . 1 1 100 100 GLN HA H 1 4.071 0.030 . 1 . . . . 100 GLN HA . 11329 1 1227 . 1 1 100 100 GLN HB2 H 1 2.252 0.030 . 2 . . . . 100 GLN HB2 . 11329 1 1228 . 1 1 100 100 GLN HB3 H 1 2.124 0.030 . 2 . . . . 100 GLN HB3 . 11329 1 1229 . 1 1 100 100 GLN HE21 H 1 7.884 0.030 . 2 . . . . 100 GLN HE21 . 11329 1 1230 . 1 1 100 100 GLN HE22 H 1 7.098 0.030 . 2 . . . . 100 GLN HE22 . 11329 1 1231 . 1 1 100 100 GLN HG2 H 1 2.527 0.030 . 2 . . . . 100 GLN HG2 . 11329 1 1232 . 1 1 100 100 GLN HG3 H 1 2.405 0.030 . 2 . . . . 100 GLN HG3 . 11329 1 1233 . 1 1 100 100 GLN C C 13 177.805 0.300 . 1 . . . . 100 GLN C . 11329 1 1234 . 1 1 100 100 GLN CA C 13 59.488 0.300 . 1 . . . . 100 GLN CA . 11329 1 1235 . 1 1 100 100 GLN CB C 13 29.939 0.300 . 1 . . . . 100 GLN CB . 11329 1 1236 . 1 1 100 100 GLN CG C 13 34.175 0.300 . 1 . . . . 100 GLN CG . 11329 1 1237 . 1 1 100 100 GLN N N 15 123.895 0.300 . 1 . . . . 100 GLN N . 11329 1 1238 . 1 1 100 100 GLN NE2 N 15 116.397 0.300 . 1 . . . . 100 GLN NE2 . 11329 1 1239 . 1 1 101 101 ILE H H 1 8.449 0.030 . 1 . . . . 101 ILE H . 11329 1 1240 . 1 1 101 101 ILE HA H 1 3.985 0.030 . 1 . . . . 101 ILE HA . 11329 1 1241 . 1 1 101 101 ILE HB H 1 1.543 0.030 . 1 . . . . 101 ILE HB . 11329 1 1242 . 1 1 101 101 ILE HD11 H 1 0.923 0.030 . 1 . . . . 101 ILE HD1 . 11329 1 1243 . 1 1 101 101 ILE HD12 H 1 0.923 0.030 . 1 . . . . 101 ILE HD1 . 11329 1 1244 . 1 1 101 101 ILE HD13 H 1 0.923 0.030 . 1 . . . . 101 ILE HD1 . 11329 1 1245 . 1 1 101 101 ILE HG12 H 1 1.819 0.030 . 2 . . . . 101 ILE HG12 . 11329 1 1246 . 1 1 101 101 ILE HG13 H 1 1.144 0.030 . 2 . . . . 101 ILE HG13 . 11329 1 1247 . 1 1 101 101 ILE HG21 H 1 1.058 0.030 . 1 . . . . 101 ILE HG2 . 11329 1 1248 . 1 1 101 101 ILE HG22 H 1 1.058 0.030 . 1 . . . . 101 ILE HG2 . 11329 1 1249 . 1 1 101 101 ILE HG23 H 1 1.058 0.030 . 1 . . . . 101 ILE HG2 . 11329 1 1250 . 1 1 101 101 ILE C C 13 177.963 0.300 . 1 . . . . 101 ILE C . 11329 1 1251 . 1 1 101 101 ILE CA C 13 65.747 0.300 . 1 . . . . 101 ILE CA . 11329 1 1252 . 1 1 101 101 ILE CB C 13 38.690 0.300 . 1 . . . . 101 ILE CB . 11329 1 1253 . 1 1 101 101 ILE CD1 C 13 13.554 0.300 . 1 . . . . 101 ILE CD1 . 11329 1 1254 . 1 1 101 101 ILE CG1 C 13 29.877 0.300 . 1 . . . . 101 ILE CG1 . 11329 1 1255 . 1 1 101 101 ILE CG2 C 13 19.131 0.300 . 1 . . . . 101 ILE CG2 . 11329 1 1256 . 1 1 101 101 ILE N N 15 116.506 0.300 . 1 . . . . 101 ILE N . 11329 1 1257 . 1 1 102 102 TYR H H 1 7.173 0.030 . 1 . . . . 102 TYR H . 11329 1 1258 . 1 1 102 102 TYR HA H 1 3.740 0.030 . 1 . . . . 102 TYR HA . 11329 1 1259 . 1 1 102 102 TYR HB2 H 1 3.503 0.030 . 2 . . . . 102 TYR HB2 . 11329 1 1260 . 1 1 102 102 TYR HB3 H 1 2.519 0.030 . 2 . . . . 102 TYR HB3 . 11329 1 1261 . 1 1 102 102 TYR HD1 H 1 7.083 0.030 . 1 . . . . 102 TYR HD1 . 11329 1 1262 . 1 1 102 102 TYR HD2 H 1 7.083 0.030 . 1 . . . . 102 TYR HD2 . 11329 1 1263 . 1 1 102 102 TYR HE1 H 1 7.039 0.030 . 1 . . . . 102 TYR HE1 . 11329 1 1264 . 1 1 102 102 TYR HE2 H 1 7.039 0.030 . 1 . . . . 102 TYR HE2 . 11329 1 1265 . 1 1 102 102 TYR C C 13 179.367 0.300 . 1 . . . . 102 TYR C . 11329 1 1266 . 1 1 102 102 TYR CA C 13 62.054 0.300 . 1 . . . . 102 TYR CA . 11329 1 1267 . 1 1 102 102 TYR CB C 13 40.375 0.300 . 1 . . . . 102 TYR CB . 11329 1 1268 . 1 1 102 102 TYR CD1 C 13 133.924 0.300 . 1 . . . . 102 TYR CD1 . 11329 1 1269 . 1 1 102 102 TYR CD2 C 13 133.924 0.300 . 1 . . . . 102 TYR CD2 . 11329 1 1270 . 1 1 102 102 TYR CE1 C 13 118.930 0.300 . 1 . . . . 102 TYR CE1 . 11329 1 1271 . 1 1 102 102 TYR CE2 C 13 118.930 0.300 . 1 . . . . 102 TYR CE2 . 11329 1 1272 . 1 1 102 102 TYR N N 15 120.045 0.300 . 1 . . . . 102 TYR N . 11329 1 1273 . 1 1 103 103 GLU H H 1 8.790 0.030 . 1 . . . . 103 GLU H . 11329 1 1274 . 1 1 103 103 GLU HA H 1 4.157 0.030 . 1 . . . . 103 GLU HA . 11329 1 1275 . 1 1 103 103 GLU HB2 H 1 2.292 0.030 . 2 . . . . 103 GLU HB2 . 11329 1 1276 . 1 1 103 103 GLU HB3 H 1 2.200 0.030 . 2 . . . . 103 GLU HB3 . 11329 1 1277 . 1 1 103 103 GLU HG2 H 1 2.484 0.030 . 1 . . . . 103 GLU HG2 . 11329 1 1278 . 1 1 103 103 GLU HG3 H 1 2.484 0.030 . 1 . . . . 103 GLU HG3 . 11329 1 1279 . 1 1 103 103 GLU C C 13 179.936 0.300 . 1 . . . . 103 GLU C . 11329 1 1280 . 1 1 103 103 GLU CA C 13 59.596 0.300 . 1 . . . . 103 GLU CA . 11329 1 1281 . 1 1 103 103 GLU CB C 13 28.961 0.300 . 1 . . . . 103 GLU CB . 11329 1 1282 . 1 1 103 103 GLU CG C 13 36.610 0.300 . 1 . . . . 103 GLU CG . 11329 1 1283 . 1 1 103 103 GLU N N 15 119.878 0.300 . 1 . . . . 103 GLU N . 11329 1 1284 . 1 1 104 104 ASP H H 1 9.429 0.030 . 1 . . . . 104 ASP H . 11329 1 1285 . 1 1 104 104 ASP HA H 1 4.560 0.030 . 1 . . . . 104 ASP HA . 11329 1 1286 . 1 1 104 104 ASP HB2 H 1 2.699 0.030 . 2 . . . . 104 ASP HB2 . 11329 1 1287 . 1 1 104 104 ASP HB3 H 1 3.255 0.030 . 2 . . . . 104 ASP HB3 . 11329 1 1288 . 1 1 104 104 ASP C C 13 178.838 0.300 . 1 . . . . 104 ASP C . 11329 1 1289 . 1 1 104 104 ASP CA C 13 57.596 0.300 . 1 . . . . 104 ASP CA . 11329 1 1290 . 1 1 104 104 ASP CB C 13 40.257 0.300 . 1 . . . . 104 ASP CB . 11329 1 1291 . 1 1 104 104 ASP N N 15 122.070 0.300 . 1 . . . . 104 ASP N . 11329 1 1292 . 1 1 105 105 SER H H 1 8.279 0.030 . 1 . . . . 105 SER H . 11329 1 1293 . 1 1 105 105 SER HA H 1 3.786 0.030 . 1 . . . . 105 SER HA . 11329 1 1294 . 1 1 105 105 SER HB2 H 1 4.112 0.030 . 2 . . . . 105 SER HB2 . 11329 1 1295 . 1 1 105 105 SER HB3 H 1 3.659 0.030 . 2 . . . . 105 SER HB3 . 11329 1 1296 . 1 1 105 105 SER C C 13 175.113 0.300 . 1 . . . . 105 SER C . 11329 1 1297 . 1 1 105 105 SER CA C 13 62.472 0.300 . 1 . . . . 105 SER CA . 11329 1 1298 . 1 1 105 105 SER CB C 13 63.011 0.300 . 1 . . . . 105 SER CB . 11329 1 1299 . 1 1 105 105 SER N N 15 116.195 0.300 . 1 . . . . 105 SER N . 11329 1 1300 . 1 1 106 106 ILE H H 1 7.219 0.030 . 1 . . . . 106 ILE H . 11329 1 1301 . 1 1 106 106 ILE HA H 1 3.788 0.030 . 1 . . . . 106 ILE HA . 11329 1 1302 . 1 1 106 106 ILE HB H 1 2.260 0.030 . 1 . . . . 106 ILE HB . 11329 1 1303 . 1 1 106 106 ILE HD11 H 1 0.805 0.030 . 1 . . . . 106 ILE HD1 . 11329 1 1304 . 1 1 106 106 ILE HD12 H 1 0.805 0.030 . 1 . . . . 106 ILE HD1 . 11329 1 1305 . 1 1 106 106 ILE HD13 H 1 0.805 0.030 . 1 . . . . 106 ILE HD1 . 11329 1 1306 . 1 1 106 106 ILE HG12 H 1 1.601 0.030 . 2 . . . . 106 ILE HG12 . 11329 1 1307 . 1 1 106 106 ILE HG13 H 1 1.071 0.030 . 2 . . . . 106 ILE HG13 . 11329 1 1308 . 1 1 106 106 ILE HG21 H 1 0.928 0.030 . 1 . . . . 106 ILE HG2 . 11329 1 1309 . 1 1 106 106 ILE HG22 H 1 0.928 0.030 . 1 . . . . 106 ILE HG2 . 11329 1 1310 . 1 1 106 106 ILE HG23 H 1 0.928 0.030 . 1 . . . . 106 ILE HG2 . 11329 1 1311 . 1 1 106 106 ILE C C 13 179.674 0.300 . 1 . . . . 106 ILE C . 11329 1 1312 . 1 1 106 106 ILE CA C 13 63.785 0.300 . 1 . . . . 106 ILE CA . 11329 1 1313 . 1 1 106 106 ILE CB C 13 37.286 0.300 . 1 . . . . 106 ILE CB . 11329 1 1314 . 1 1 106 106 ILE CD1 C 13 12.403 0.300 . 1 . . . . 106 ILE CD1 . 11329 1 1315 . 1 1 106 106 ILE CG1 C 13 28.276 0.300 . 1 . . . . 106 ILE CG1 . 11329 1 1316 . 1 1 106 106 ILE CG2 C 13 17.015 0.300 . 1 . . . . 106 ILE CG2 . 11329 1 1317 . 1 1 106 106 ILE N N 15 125.094 0.300 . 1 . . . . 106 ILE N . 11329 1 1318 . 1 1 107 107 VAL H H 1 7.603 0.030 . 1 . . . . 107 VAL H . 11329 1 1319 . 1 1 107 107 VAL HA H 1 3.697 0.030 . 1 . . . . 107 VAL HA . 11329 1 1320 . 1 1 107 107 VAL HB H 1 2.243 0.030 . 1 . . . . 107 VAL HB . 11329 1 1321 . 1 1 107 107 VAL HG11 H 1 0.832 0.030 . 1 . . . . 107 VAL HG1 . 11329 1 1322 . 1 1 107 107 VAL HG12 H 1 0.832 0.030 . 1 . . . . 107 VAL HG1 . 11329 1 1323 . 1 1 107 107 VAL HG13 H 1 0.832 0.030 . 1 . . . . 107 VAL HG1 . 11329 1 1324 . 1 1 107 107 VAL HG21 H 1 1.188 0.030 . 1 . . . . 107 VAL HG2 . 11329 1 1325 . 1 1 107 107 VAL HG22 H 1 1.188 0.030 . 1 . . . . 107 VAL HG2 . 11329 1 1326 . 1 1 107 107 VAL HG23 H 1 1.188 0.030 . 1 . . . . 107 VAL HG2 . 11329 1 1327 . 1 1 107 107 VAL C C 13 179.464 0.300 . 1 . . . . 107 VAL C . 11329 1 1328 . 1 1 107 107 VAL CA C 13 66.596 0.300 . 1 . . . . 107 VAL CA . 11329 1 1329 . 1 1 107 107 VAL CB C 13 31.466 0.300 . 1 . . . . 107 VAL CB . 11329 1 1330 . 1 1 107 107 VAL CG1 C 13 22.388 0.300 . 2 . . . . 107 VAL CG1 . 11329 1 1331 . 1 1 107 107 VAL CG2 C 13 22.529 0.300 . 2 . . . . 107 VAL CG2 . 11329 1 1332 . 1 1 107 107 VAL N N 15 121.789 0.300 . 1 . . . . 107 VAL N . 11329 1 1333 . 1 1 108 108 LEU H H 1 8.477 0.030 . 1 . . . . 108 LEU H . 11329 1 1334 . 1 1 108 108 LEU HA H 1 3.791 0.030 . 1 . . . . 108 LEU HA . 11329 1 1335 . 1 1 108 108 LEU HB2 H 1 1.803 0.030 . 2 . . . . 108 LEU HB2 . 11329 1 1336 . 1 1 108 108 LEU HB3 H 1 1.001 0.030 . 2 . . . . 108 LEU HB3 . 11329 1 1337 . 1 1 108 108 LEU HD11 H 1 0.520 0.030 . 1 . . . . 108 LEU HD1 . 11329 1 1338 . 1 1 108 108 LEU HD12 H 1 0.520 0.030 . 1 . . . . 108 LEU HD1 . 11329 1 1339 . 1 1 108 108 LEU HD13 H 1 0.520 0.030 . 1 . . . . 108 LEU HD1 . 11329 1 1340 . 1 1 108 108 LEU HD21 H 1 0.833 0.030 . 1 . . . . 108 LEU HD2 . 11329 1 1341 . 1 1 108 108 LEU HD22 H 1 0.833 0.030 . 1 . . . . 108 LEU HD2 . 11329 1 1342 . 1 1 108 108 LEU HD23 H 1 0.833 0.030 . 1 . . . . 108 LEU HD2 . 11329 1 1343 . 1 1 108 108 LEU HG H 1 1.838 0.030 . 1 . . . . 108 LEU HG . 11329 1 1344 . 1 1 108 108 LEU C C 13 178.537 0.300 . 1 . . . . 108 LEU C . 11329 1 1345 . 1 1 108 108 LEU CA C 13 58.309 0.300 . 1 . . . . 108 LEU CA . 11329 1 1346 . 1 1 108 108 LEU CB C 13 41.174 0.300 . 1 . . . . 108 LEU CB . 11329 1 1347 . 1 1 108 108 LEU CD1 C 13 26.071 0.300 . 2 . . . . 108 LEU CD1 . 11329 1 1348 . 1 1 108 108 LEU CD2 C 13 22.391 0.300 . 2 . . . . 108 LEU CD2 . 11329 1 1349 . 1 1 108 108 LEU CG C 13 26.032 0.300 . 1 . . . . 108 LEU CG . 11329 1 1350 . 1 1 108 108 LEU N N 15 118.207 0.300 . 1 . . . . 108 LEU N . 11329 1 1351 . 1 1 109 109 GLN H H 1 7.742 0.030 . 1 . . . . 109 GLN H . 11329 1 1352 . 1 1 109 109 GLN HA H 1 3.748 0.030 . 1 . . . . 109 GLN HA . 11329 1 1353 . 1 1 109 109 GLN HB2 H 1 2.187 0.030 . 2 . . . . 109 GLN HB2 . 11329 1 1354 . 1 1 109 109 GLN HB3 H 1 2.493 0.030 . 2 . . . . 109 GLN HB3 . 11329 1 1355 . 1 1 109 109 GLN HE21 H 1 7.013 0.030 . 1 . . . . 109 GLN HE21 . 11329 1 1356 . 1 1 109 109 GLN HE22 H 1 7.013 0.030 . 1 . . . . 109 GLN HE22 . 11329 1 1357 . 1 1 109 109 GLN HG2 H 1 2.574 0.030 . 2 . . . . 109 GLN HG2 . 11329 1 1358 . 1 1 109 109 GLN HG3 H 1 2.369 0.030 . 2 . . . . 109 GLN HG3 . 11329 1 1359 . 1 1 109 109 GLN C C 13 178.184 0.300 . 1 . . . . 109 GLN C . 11329 1 1360 . 1 1 109 109 GLN CA C 13 60.307 0.300 . 1 . . . . 109 GLN CA . 11329 1 1361 . 1 1 109 109 GLN CB C 13 29.089 0.300 . 1 . . . . 109 GLN CB . 11329 1 1362 . 1 1 109 109 GLN CG C 13 35.427 0.300 . 1 . . . . 109 GLN CG . 11329 1 1363 . 1 1 109 109 GLN N N 15 118.146 0.300 . 1 . . . . 109 GLN N . 11329 1 1364 . 1 1 109 109 GLN NE2 N 15 110.817 0.300 . 1 . . . . 109 GLN NE2 . 11329 1 1365 . 1 1 110 110 SER H H 1 7.430 0.030 . 1 . . . . 110 SER H . 11329 1 1366 . 1 1 110 110 SER HA H 1 4.271 0.030 . 1 . . . . 110 SER HA . 11329 1 1367 . 1 1 110 110 SER HB2 H 1 4.087 0.030 . 1 . . . . 110 SER HB2 . 11329 1 1368 . 1 1 110 110 SER HB3 H 1 4.087 0.030 . 1 . . . . 110 SER HB3 . 11329 1 1369 . 1 1 110 110 SER C C 13 177.166 0.300 . 1 . . . . 110 SER C . 11329 1 1370 . 1 1 110 110 SER CA C 13 61.619 0.300 . 1 . . . . 110 SER CA . 11329 1 1371 . 1 1 110 110 SER CB C 13 62.949 0.300 . 1 . . . . 110 SER CB . 11329 1 1372 . 1 1 110 110 SER N N 15 115.260 0.300 . 1 . . . . 110 SER N . 11329 1 1373 . 1 1 111 111 VAL H H 1 8.555 0.030 . 1 . . . . 111 VAL H . 11329 1 1374 . 1 1 111 111 VAL HA H 1 3.499 0.030 . 1 . . . . 111 VAL HA . 11329 1 1375 . 1 1 111 111 VAL HB H 1 1.902 0.030 . 1 . . . . 111 VAL HB . 11329 1 1376 . 1 1 111 111 VAL HG11 H 1 0.714 0.030 . 1 . . . . 111 VAL HG1 . 11329 1 1377 . 1 1 111 111 VAL HG12 H 1 0.714 0.030 . 1 . . . . 111 VAL HG1 . 11329 1 1378 . 1 1 111 111 VAL HG13 H 1 0.714 0.030 . 1 . . . . 111 VAL HG1 . 11329 1 1379 . 1 1 111 111 VAL HG21 H 1 0.190 0.030 . 1 . . . . 111 VAL HG2 . 11329 1 1380 . 1 1 111 111 VAL HG22 H 1 0.190 0.030 . 1 . . . . 111 VAL HG2 . 11329 1 1381 . 1 1 111 111 VAL HG23 H 1 0.190 0.030 . 1 . . . . 111 VAL HG2 . 11329 1 1382 . 1 1 111 111 VAL C C 13 178.558 0.300 . 1 . . . . 111 VAL C . 11329 1 1383 . 1 1 111 111 VAL CA C 13 66.165 0.300 . 1 . . . . 111 VAL CA . 11329 1 1384 . 1 1 111 111 VAL CB C 13 31.445 0.300 . 1 . . . . 111 VAL CB . 11329 1 1385 . 1 1 111 111 VAL CG1 C 13 21.511 0.300 . 2 . . . . 111 VAL CG1 . 11329 1 1386 . 1 1 111 111 VAL CG2 C 13 21.285 0.300 . 2 . . . . 111 VAL CG2 . 11329 1 1387 . 1 1 111 111 VAL N N 15 125.425 0.300 . 1 . . . . 111 VAL N . 11329 1 1388 . 1 1 112 112 PHE H H 1 8.492 0.030 . 1 . . . . 112 PHE H . 11329 1 1389 . 1 1 112 112 PHE HA H 1 3.617 0.030 . 1 . . . . 112 PHE HA . 11329 1 1390 . 1 1 112 112 PHE HB2 H 1 3.231 0.030 . 2 . . . . 112 PHE HB2 . 11329 1 1391 . 1 1 112 112 PHE HB3 H 1 2.900 0.030 . 2 . . . . 112 PHE HB3 . 11329 1 1392 . 1 1 112 112 PHE HD1 H 1 6.983 0.030 . 1 . . . . 112 PHE HD1 . 11329 1 1393 . 1 1 112 112 PHE HD2 H 1 6.983 0.030 . 1 . . . . 112 PHE HD2 . 11329 1 1394 . 1 1 112 112 PHE HE1 H 1 7.264 0.030 . 1 . . . . 112 PHE HE1 . 11329 1 1395 . 1 1 112 112 PHE HE2 H 1 7.264 0.030 . 1 . . . . 112 PHE HE2 . 11329 1 1396 . 1 1 112 112 PHE HZ H 1 6.922 0.030 . 1 . . . . 112 PHE HZ . 11329 1 1397 . 1 1 112 112 PHE C C 13 175.884 0.300 . 1 . . . . 112 PHE C . 11329 1 1398 . 1 1 112 112 PHE CA C 13 62.596 0.300 . 1 . . . . 112 PHE CA . 11329 1 1399 . 1 1 112 112 PHE CB C 13 38.528 0.300 . 1 . . . . 112 PHE CB . 11329 1 1400 . 1 1 112 112 PHE CD1 C 13 131.921 0.300 . 1 . . . . 112 PHE CD1 . 11329 1 1401 . 1 1 112 112 PHE CD2 C 13 131.921 0.300 . 1 . . . . 112 PHE CD2 . 11329 1 1402 . 1 1 112 112 PHE CE1 C 13 131.336 0.300 . 1 . . . . 112 PHE CE1 . 11329 1 1403 . 1 1 112 112 PHE CE2 C 13 131.336 0.300 . 1 . . . . 112 PHE CE2 . 11329 1 1404 . 1 1 112 112 PHE CZ C 13 127.184 0.300 . 1 . . . . 112 PHE CZ . 11329 1 1405 . 1 1 112 112 PHE N N 15 119.652 0.300 . 1 . . . . 112 PHE N . 11329 1 1406 . 1 1 113 113 LYS H H 1 7.958 0.030 . 1 . . . . 113 LYS H . 11329 1 1407 . 1 1 113 113 LYS HA H 1 3.730 0.030 . 1 . . . . 113 LYS HA . 11329 1 1408 . 1 1 113 113 LYS HB2 H 1 1.994 0.030 . 2 . . . . 113 LYS HB2 . 11329 1 1409 . 1 1 113 113 LYS HB3 H 1 1.926 0.030 . 2 . . . . 113 LYS HB3 . 11329 1 1410 . 1 1 113 113 LYS HD2 H 1 1.719 0.030 . 1 . . . . 113 LYS HD2 . 11329 1 1411 . 1 1 113 113 LYS HD3 H 1 1.719 0.030 . 1 . . . . 113 LYS HD3 . 11329 1 1412 . 1 1 113 113 LYS HE2 H 1 2.972 0.030 . 1 . . . . 113 LYS HE2 . 11329 1 1413 . 1 1 113 113 LYS HE3 H 1 2.972 0.030 . 1 . . . . 113 LYS HE3 . 11329 1 1414 . 1 1 113 113 LYS HG2 H 1 1.737 0.030 . 2 . . . . 113 LYS HG2 . 11329 1 1415 . 1 1 113 113 LYS HG3 H 1 1.514 0.030 . 2 . . . . 113 LYS HG3 . 11329 1 1416 . 1 1 113 113 LYS C C 13 179.228 0.300 . 1 . . . . 113 LYS C . 11329 1 1417 . 1 1 113 113 LYS CA C 13 60.077 0.300 . 1 . . . . 113 LYS CA . 11329 1 1418 . 1 1 113 113 LYS CB C 13 32.146 0.300 . 1 . . . . 113 LYS CB . 11329 1 1419 . 1 1 113 113 LYS CD C 13 29.289 0.300 . 1 . . . . 113 LYS CD . 11329 1 1420 . 1 1 113 113 LYS CE C 13 42.130 0.300 . 1 . . . . 113 LYS CE . 11329 1 1421 . 1 1 113 113 LYS CG C 13 25.582 0.300 . 1 . . . . 113 LYS CG . 11329 1 1422 . 1 1 113 113 LYS N N 15 118.242 0.300 . 1 . . . . 113 LYS N . 11329 1 1423 . 1 1 114 114 SER H H 1 8.120 0.030 . 1 . . . . 114 SER H . 11329 1 1424 . 1 1 114 114 SER HA H 1 4.196 0.030 . 1 . . . . 114 SER HA . 11329 1 1425 . 1 1 114 114 SER HB2 H 1 3.917 0.030 . 1 . . . . 114 SER HB2 . 11329 1 1426 . 1 1 114 114 SER HB3 H 1 3.917 0.030 . 1 . . . . 114 SER HB3 . 11329 1 1427 . 1 1 114 114 SER C C 13 176.577 0.300 . 1 . . . . 114 SER C . 11329 1 1428 . 1 1 114 114 SER CA C 13 61.269 0.300 . 1 . . . . 114 SER CA . 11329 1 1429 . 1 1 114 114 SER CB C 13 62.836 0.300 . 1 . . . . 114 SER CB . 11329 1 1430 . 1 1 114 114 SER N N 15 113.962 0.300 . 1 . . . . 114 SER N . 11329 1 1431 . 1 1 115 115 ALA H H 1 8.150 0.030 . 1 . . . . 115 ALA H . 11329 1 1432 . 1 1 115 115 ALA HA H 1 4.152 0.030 . 1 . . . . 115 ALA HA . 11329 1 1433 . 1 1 115 115 ALA HB1 H 1 1.353 0.030 . 1 . . . . 115 ALA HB . 11329 1 1434 . 1 1 115 115 ALA HB2 H 1 1.353 0.030 . 1 . . . . 115 ALA HB . 11329 1 1435 . 1 1 115 115 ALA HB3 H 1 1.353 0.030 . 1 . . . . 115 ALA HB . 11329 1 1436 . 1 1 115 115 ALA C C 13 179.401 0.300 . 1 . . . . 115 ALA C . 11329 1 1437 . 1 1 115 115 ALA CA C 13 54.164 0.300 . 1 . . . . 115 ALA CA . 11329 1 1438 . 1 1 115 115 ALA CB C 13 18.460 0.300 . 1 . . . . 115 ALA CB . 11329 1 1439 . 1 1 115 115 ALA N N 15 124.718 0.300 . 1 . . . . 115 ALA N . 11329 1 1440 . 1 1 116 116 ARG H H 1 8.038 0.030 . 1 . . . . 116 ARG H . 11329 1 1441 . 1 1 116 116 ARG HA H 1 3.796 0.030 . 1 . . . . 116 ARG HA . 11329 1 1442 . 1 1 116 116 ARG HB2 H 1 1.361 0.030 . 2 . . . . 116 ARG HB2 . 11329 1 1443 . 1 1 116 116 ARG HB3 H 1 1.601 0.030 . 2 . . . . 116 ARG HB3 . 11329 1 1444 . 1 1 116 116 ARG HD2 H 1 3.049 0.030 . 1 . . . . 116 ARG HD2 . 11329 1 1445 . 1 1 116 116 ARG HD3 H 1 3.049 0.030 . 1 . . . . 116 ARG HD3 . 11329 1 1446 . 1 1 116 116 ARG HG2 H 1 1.490 0.030 . 1 . . . . 116 ARG HG2 . 11329 1 1447 . 1 1 116 116 ARG HG3 H 1 1.490 0.030 . 1 . . . . 116 ARG HG3 . 11329 1 1448 . 1 1 116 116 ARG C C 13 177.076 0.300 . 1 . . . . 116 ARG C . 11329 1 1449 . 1 1 116 116 ARG CA C 13 57.984 0.300 . 1 . . . . 116 ARG CA . 11329 1 1450 . 1 1 116 116 ARG CB C 13 29.368 0.300 . 1 . . . . 116 ARG CB . 11329 1 1451 . 1 1 116 116 ARG CD C 13 43.554 0.300 . 1 . . . . 116 ARG CD . 11329 1 1452 . 1 1 116 116 ARG CG C 13 27.241 0.300 . 1 . . . . 116 ARG CG . 11329 1 1453 . 1 1 116 116 ARG N N 15 117.089 0.300 . 1 . . . . 116 ARG N . 11329 1 1454 . 1 1 117 117 GLN H H 1 7.640 0.030 . 1 . . . . 117 GLN H . 11329 1 1455 . 1 1 117 117 GLN HA H 1 4.249 0.030 . 1 . . . . 117 GLN HA . 11329 1 1456 . 1 1 117 117 GLN HB2 H 1 2.172 0.030 . 2 . . . . 117 GLN HB2 . 11329 1 1457 . 1 1 117 117 GLN HB3 H 1 2.092 0.030 . 2 . . . . 117 GLN HB3 . 11329 1 1458 . 1 1 117 117 GLN HG2 H 1 2.467 0.030 . 2 . . . . 117 GLN HG2 . 11329 1 1459 . 1 1 117 117 GLN HG3 H 1 2.414 0.030 . 2 . . . . 117 GLN HG3 . 11329 1 1460 . 1 1 117 117 GLN C C 13 176.253 0.300 . 1 . . . . 117 GLN C . 11329 1 1461 . 1 1 117 117 GLN CA C 13 56.628 0.300 . 1 . . . . 117 GLN CA . 11329 1 1462 . 1 1 117 117 GLN CB C 13 29.002 0.300 . 1 . . . . 117 GLN CB . 11329 1 1463 . 1 1 117 117 GLN CG C 13 33.896 0.300 . 1 . . . . 117 GLN CG . 11329 1 1464 . 1 1 117 117 GLN N N 15 117.685 0.300 . 1 . . . . 117 GLN N . 11329 1 1465 . 1 1 118 118 SER H H 1 7.889 0.030 . 1 . . . . 118 SER H . 11329 1 1466 . 1 1 118 118 SER HA H 1 4.456 0.030 . 1 . . . . 118 SER HA . 11329 1 1467 . 1 1 118 118 SER HB2 H 1 3.911 0.030 . 1 . . . . 118 SER HB2 . 11329 1 1468 . 1 1 118 118 SER HB3 H 1 3.911 0.030 . 1 . . . . 118 SER HB3 . 11329 1 1469 . 1 1 118 118 SER C C 13 174.642 0.300 . 1 . . . . 118 SER C . 11329 1 1470 . 1 1 118 118 SER CA C 13 58.957 0.300 . 1 . . . . 118 SER CA . 11329 1 1471 . 1 1 118 118 SER CB C 13 64.029 0.300 . 1 . . . . 118 SER CB . 11329 1 1472 . 1 1 118 118 SER N N 15 114.899 0.300 . 1 . . . . 118 SER N . 11329 1 1473 . 1 1 119 119 GLY H H 1 8.038 0.030 . 1 . . . . 119 GLY H . 11329 1 1474 . 1 1 119 119 GLY HA2 H 1 4.166 0.030 . 2 . . . . 119 GLY HA2 . 11329 1 1475 . 1 1 119 119 GLY HA3 H 1 4.072 0.030 . 2 . . . . 119 GLY HA3 . 11329 1 1476 . 1 1 119 119 GLY C C 13 171.899 0.300 . 1 . . . . 119 GLY C . 11329 1 1477 . 1 1 119 119 GLY CA C 13 44.904 0.300 . 1 . . . . 119 GLY CA . 11329 1 1478 . 1 1 119 119 GLY N N 15 110.452 0.300 . 1 . . . . 119 GLY N . 11329 1 1479 . 1 1 120 120 PRO HA H 1 4.465 0.030 . 1 . . . . 120 PRO HA . 11329 1 1480 . 1 1 120 120 PRO HB2 H 1 2.284 0.030 . 2 . . . . 120 PRO HB2 . 11329 1 1481 . 1 1 120 120 PRO HB3 H 1 1.980 0.030 . 2 . . . . 120 PRO HB3 . 11329 1 1482 . 1 1 120 120 PRO HD2 H 1 3.630 0.030 . 1 . . . . 120 PRO HD2 . 11329 1 1483 . 1 1 120 120 PRO HD3 H 1 3.630 0.030 . 1 . . . . 120 PRO HD3 . 11329 1 1484 . 1 1 120 120 PRO HG2 H 1 2.004 0.030 . 1 . . . . 120 PRO HG2 . 11329 1 1485 . 1 1 120 120 PRO HG3 H 1 2.004 0.030 . 1 . . . . 120 PRO HG3 . 11329 1 1486 . 1 1 120 120 PRO C C 13 175.904 0.300 . 1 . . . . 120 PRO C . 11329 1 1487 . 1 1 120 120 PRO CA C 13 63.194 0.300 . 1 . . . . 120 PRO CA . 11329 1 1488 . 1 1 120 120 PRO CB C 13 32.185 0.300 . 1 . . . . 120 PRO CB . 11329 1 1489 . 1 1 120 120 PRO CD C 13 49.913 0.300 . 1 . . . . 120 PRO CD . 11329 1 1490 . 1 1 120 120 PRO CG C 13 27.292 0.300 . 1 . . . . 120 PRO CG . 11329 1 stop_ save_