data_7257 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 7257 _Entry.Title ; Solution structure of the RRM domain of SR rich factor 9G8 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-08-10 _Entry.Accession_date 2006-08-17 _Entry.Last_release_date 2006-12-20 _Entry.Original_release_date 2006-12-20 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _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 A. Tintaru . M. . 7257 2 G. Hautbergue . M. . 7257 3 A. Golovanov . P. . 7257 4 L. Lian . Y. . 7257 5 S. Wilson . A. . 7257 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 7257 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 444 7257 '15N chemical shifts' 109 7257 '1H chemical shifts' 697 7257 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 . . 2006-12-20 2006-08-10 original author . 7257 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2HVZ 'BMRB Entry Tracking System' 7257 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 7257 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 17036044 _Citation.Full_citation . _Citation.Title ; Molecular basis of RNA recognition and TAP binding by the SR proteins SRp20 and 9G8 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'EMBO J.' _Citation.Journal_name_full . _Citation.Journal_volume 25 _Citation.Journal_issue 21 _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 5126 _Citation.Page_last 5137 _Citation.Year 2006 _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 Y. Hargous . . . 7257 1 2 G. Hautbergue . M. . 7257 1 3 A. Tintaru . M. . 7257 1 4 L. Skrisovska . . . 7257 1 5 A. Golovanov . P. . 7257 1 6 J. Stevenin . . . 7257 1 7 L. Lian . Y. . 7257 1 8 S. Wilson . A. . 7257 1 9 F. Allain . H.T. . 7257 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID RRM 7257 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_9G8_RRM _Assembly.Sf_category assembly _Assembly.Sf_framecode system_9G8_RRM _Assembly.Entry_ID 7257 _Assembly.ID 1 _Assembly.Name 'RRM domain of SR rich factor 9G8' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 7257 1 stop_ 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 'RRM domain of SR rich factor 9G8' 1 $9G8_RRM . . . native . . . . . 7257 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 2HVZ . . . . . . 7257 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'RRM domain of SR rich factor 9G8' abbreviation 7257 1 'RRM domain of SR rich factor 9G8' system 7257 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_9G8_RRM _Entity.Sf_category entity _Entity.Sf_framecode 9G8_RRM _Entity.Entry_ID 7257 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'RRM domain of SR rich factor 9G8' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MKVYVGNLGTGAGKGELERA FSYYGPLRTVWIARNPPGFA FVEFEDPRDAEDAVRGLDGK VICGSRVRVELSTGMPRRSR FDRPPARRKLLEVLFNGPLE H ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 101 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _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 2015-01-28 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 2HVZ . "Solution Structure Of The Rrm Domain Of Sr Rich Factor 9g8" . . . . . 100.00 101 100.00 100.00 2.57e-65 . . . . 7257 1 2 no DBJ BAC03661 . "unnamed protein product [Homo sapiens]" . . . . . 87.13 137 97.73 97.73 2.35e-52 . . . . 7257 1 3 no DBJ BAC28058 . "unnamed protein product [Mus musculus]" . . . . . 87.13 157 98.86 98.86 7.25e-54 . . . . 7257 1 4 no DBJ BAC32521 . "unnamed protein product [Mus musculus]" . . . . . 87.13 267 98.86 98.86 9.29e-54 . . . . 7257 1 5 no DBJ BAC38650 . "unnamed protein product [Mus musculus]" . . . . . 87.13 235 98.86 98.86 1.10e-54 . . . . 7257 1 6 no DBJ BAE01828 . "unnamed protein product [Macaca fascicularis]" . . . . . 87.13 238 98.86 98.86 1.45e-54 . . . . 7257 1 7 no GB AAA35495 . "9G8 splicing factor [Homo sapiens]" . . . . . 87.13 238 98.86 98.86 1.45e-54 . . . . 7257 1 8 no GB AAA88098 . "splicing factor, arginine/serine-rich 7 [Homo sapiens]" . . . . . 87.13 238 98.86 98.86 1.45e-54 . . . . 7257 1 9 no GB AAH00997 . "Splicing factor, arginine/serine-rich 7, 35kDa [Homo sapiens]" . . . . . 87.13 238 98.86 98.86 1.45e-54 . . . . 7257 1 10 no GB AAH14857 . "Sfrs7 protein [Mus musculus]" . . . . . 87.13 226 98.86 98.86 7.47e-54 . . . . 7257 1 11 no GB AAH17369 . "Splicing factor, arginine/serine-rich 7, 35kDa [Homo sapiens]" . . . . . 87.13 238 98.86 98.86 1.45e-54 . . . . 7257 1 12 no REF NP_001026854 . "serine/arginine-rich splicing factor 7 isoform 1 [Homo sapiens]" . . . . . 87.13 238 98.86 98.86 1.45e-54 . . . . 7257 1 13 no REF NP_001029449 . "serine/arginine-rich splicing factor 7 [Bos taurus]" . . . . . 87.13 235 98.86 98.86 8.57e-55 . . . . 7257 1 14 no REF NP_001034124 . "serine/arginine-rich splicing factor 7 [Rattus norvegicus]" . . . . . 87.13 238 98.86 98.86 1.47e-54 . . . . 7257 1 15 no REF NP_001086749 . "serine/arginine-rich splicing factor 7 [Xenopus laevis]" . . . . . 86.14 234 97.70 98.85 1.91e-53 . . . . 7257 1 16 no REF NP_001182375 . "serine/arginine-rich splicing factor 7 isoform 2 [Homo sapiens]" . . . . . 87.13 226 98.86 98.86 2.27e-54 . . . . 7257 1 17 no SP Q16629 . "RecName: Full=Serine/arginine-rich splicing factor 7; AltName: Full=Splicing factor 9G8; AltName: Full=Splicing factor, arginin" . . . . . 87.13 238 98.86 98.86 1.45e-54 . . . . 7257 1 18 no SP Q3T106 . "RecName: Full=Serine/arginine-rich splicing factor 7; AltName: Full=Splicing factor, arginine/serine-rich 7 [Bos taurus]" . . . . . 87.13 235 98.86 98.86 8.57e-55 . . . . 7257 1 19 no SP Q8BL97 . "RecName: Full=Serine/arginine-rich splicing factor 7; AltName: Full=Splicing factor, arginine/serine-rich 7 [Mus musculus]" . . . . . 87.13 267 98.86 98.86 9.29e-54 . . . . 7257 1 20 no TPG DAA24684 . "TPA: splicing factor, arginine/serine-rich 7 [Bos taurus]" . . . . . 87.13 235 98.86 98.86 8.57e-55 . . . . 7257 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'RRM domain of SR rich factor 9G8' abbreviation 7257 1 'RRM domain of SR rich factor 9G8' common 7257 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 11 MET . 7257 1 2 12 LYS . 7257 1 3 13 VAL . 7257 1 4 14 TYR . 7257 1 5 15 VAL . 7257 1 6 16 GLY . 7257 1 7 17 ASN . 7257 1 8 18 LEU . 7257 1 9 19 GLY . 7257 1 10 20 THR . 7257 1 11 21 GLY . 7257 1 12 22 ALA . 7257 1 13 23 GLY . 7257 1 14 24 LYS . 7257 1 15 25 GLY . 7257 1 16 26 GLU . 7257 1 17 27 LEU . 7257 1 18 28 GLU . 7257 1 19 29 ARG . 7257 1 20 30 ALA . 7257 1 21 31 PHE . 7257 1 22 32 SER . 7257 1 23 33 TYR . 7257 1 24 34 TYR . 7257 1 25 35 GLY . 7257 1 26 36 PRO . 7257 1 27 37 LEU . 7257 1 28 38 ARG . 7257 1 29 39 THR . 7257 1 30 40 VAL . 7257 1 31 41 TRP . 7257 1 32 42 ILE . 7257 1 33 43 ALA . 7257 1 34 44 ARG . 7257 1 35 45 ASN . 7257 1 36 46 PRO . 7257 1 37 47 PRO . 7257 1 38 48 GLY . 7257 1 39 49 PHE . 7257 1 40 50 ALA . 7257 1 41 51 PHE . 7257 1 42 52 VAL . 7257 1 43 53 GLU . 7257 1 44 54 PHE . 7257 1 45 55 GLU . 7257 1 46 56 ASP . 7257 1 47 57 PRO . 7257 1 48 58 ARG . 7257 1 49 59 ASP . 7257 1 50 60 ALA . 7257 1 51 61 GLU . 7257 1 52 62 ASP . 7257 1 53 63 ALA . 7257 1 54 64 VAL . 7257 1 55 65 ARG . 7257 1 56 66 GLY . 7257 1 57 67 LEU . 7257 1 58 68 ASP . 7257 1 59 69 GLY . 7257 1 60 70 LYS . 7257 1 61 71 VAL . 7257 1 62 72 ILE . 7257 1 63 73 CYS . 7257 1 64 74 GLY . 7257 1 65 75 SER . 7257 1 66 76 ARG . 7257 1 67 77 VAL . 7257 1 68 78 ARG . 7257 1 69 79 VAL . 7257 1 70 80 GLU . 7257 1 71 81 LEU . 7257 1 72 82 SER . 7257 1 73 83 THR . 7257 1 74 84 GLY . 7257 1 75 85 MET . 7257 1 76 86 PRO . 7257 1 77 87 ARG . 7257 1 78 88 ARG . 7257 1 79 89 SER . 7257 1 80 90 ARG . 7257 1 81 91 PHE . 7257 1 82 92 ASP . 7257 1 83 93 ARG . 7257 1 84 94 PRO . 7257 1 85 95 PRO . 7257 1 86 96 ALA . 7257 1 87 97 ARG . 7257 1 88 98 ARG . 7257 1 89 99 LYS . 7257 1 90 100 LEU . 7257 1 91 101 LEU . 7257 1 92 102 GLU . 7257 1 93 103 VAL . 7257 1 94 104 LEU . 7257 1 95 105 PHE . 7257 1 96 106 ASN . 7257 1 97 107 GLY . 7257 1 98 108 PRO . 7257 1 99 109 LEU . 7257 1 100 110 GLU . 7257 1 101 111 HIS . 7257 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 . MET 1 1 7257 1 . LYS 2 2 7257 1 . VAL 3 3 7257 1 . TYR 4 4 7257 1 . VAL 5 5 7257 1 . GLY 6 6 7257 1 . ASN 7 7 7257 1 . LEU 8 8 7257 1 . GLY 9 9 7257 1 . THR 10 10 7257 1 . GLY 11 11 7257 1 . ALA 12 12 7257 1 . GLY 13 13 7257 1 . LYS 14 14 7257 1 . GLY 15 15 7257 1 . GLU 16 16 7257 1 . LEU 17 17 7257 1 . GLU 18 18 7257 1 . ARG 19 19 7257 1 . ALA 20 20 7257 1 . PHE 21 21 7257 1 . SER 22 22 7257 1 . TYR 23 23 7257 1 . TYR 24 24 7257 1 . GLY 25 25 7257 1 . PRO 26 26 7257 1 . LEU 27 27 7257 1 . ARG 28 28 7257 1 . THR 29 29 7257 1 . VAL 30 30 7257 1 . TRP 31 31 7257 1 . ILE 32 32 7257 1 . ALA 33 33 7257 1 . ARG 34 34 7257 1 . ASN 35 35 7257 1 . PRO 36 36 7257 1 . PRO 37 37 7257 1 . GLY 38 38 7257 1 . PHE 39 39 7257 1 . ALA 40 40 7257 1 . PHE 41 41 7257 1 . VAL 42 42 7257 1 . GLU 43 43 7257 1 . PHE 44 44 7257 1 . GLU 45 45 7257 1 . ASP 46 46 7257 1 . PRO 47 47 7257 1 . ARG 48 48 7257 1 . ASP 49 49 7257 1 . ALA 50 50 7257 1 . GLU 51 51 7257 1 . ASP 52 52 7257 1 . ALA 53 53 7257 1 . VAL 54 54 7257 1 . ARG 55 55 7257 1 . GLY 56 56 7257 1 . LEU 57 57 7257 1 . ASP 58 58 7257 1 . GLY 59 59 7257 1 . LYS 60 60 7257 1 . VAL 61 61 7257 1 . ILE 62 62 7257 1 . CYS 63 63 7257 1 . GLY 64 64 7257 1 . SER 65 65 7257 1 . ARG 66 66 7257 1 . VAL 67 67 7257 1 . ARG 68 68 7257 1 . VAL 69 69 7257 1 . GLU 70 70 7257 1 . LEU 71 71 7257 1 . SER 72 72 7257 1 . THR 73 73 7257 1 . GLY 74 74 7257 1 . MET 75 75 7257 1 . PRO 76 76 7257 1 . ARG 77 77 7257 1 . ARG 78 78 7257 1 . SER 79 79 7257 1 . ARG 80 80 7257 1 . PHE 81 81 7257 1 . ASP 82 82 7257 1 . ARG 83 83 7257 1 . PRO 84 84 7257 1 . PRO 85 85 7257 1 . ALA 86 86 7257 1 . ARG 87 87 7257 1 . ARG 88 88 7257 1 . LYS 89 89 7257 1 . LEU 90 90 7257 1 . LEU 91 91 7257 1 . GLU 92 92 7257 1 . VAL 93 93 7257 1 . LEU 94 94 7257 1 . PHE 95 95 7257 1 . ASN 96 96 7257 1 . GLY 97 97 7257 1 . PRO 98 98 7257 1 . LEU 99 99 7257 1 . GLU 100 100 7257 1 . HIS 101 101 7257 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 7257 _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 $9G8_RRM . 9606 . . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 7257 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 7257 _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 $9G8_RRM . 'recombinant technology' 'Escherichia coli' 'E. coli' . . Escherichia coli . . . . . . . . . . . . . . . . . . . . . . . 7257 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 7257 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'RRM domain of SR rich factor 9G8' '[U-13C; U-15N]' . . 1 $9G8_RRM . . 0.6 . . mM . . . . 7257 1 2 CH3COONa . . . . . . . 20 . . mM . . . . 7257 1 3 L-ARG . . . . . . . 25 . . mM . . . . 7257 1 4 L-Glu . . . . . . . 50 . . mM . . . . 7257 1 5 EDTA . . . . . . . 5 . . mM . . . . 7257 1 6 DTT . . . . . . . 10 . . mM . . . . 7257 1 7 H2O . . . . . . . 90 . . % . . . . 7257 1 8 D2O . . . . . . . 10 . . % . . . . 7257 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_cond_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_cond_1 _Sample_condition_list.Entry_ID 7257 _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 pH 5.5 . pH 7257 1 pressure 1 . atm 7257 1 temperature 293 . K 7257 1 stop_ save_ ############################ # Computer software used # ############################ save_XWINNMR _Software.Sf_category software _Software.Sf_framecode XWINNMR _Software.Entry_ID 7257 _Software.ID 1 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 7257 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 7257 _Software.ID 2 _Software.Name NMRPipe _Software.Version 1.0 _Software.Details 'F. Delaglio, S. Grzesiek, G. W. Vuister, G. Zhu, J. Pfeifer and A. Bax.' loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 7257 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 7257 _Software.ID 3 _Software.Name NMRView _Software.Version 5.01 _Software.Details 'B.A.Johnson and R.A.Blevins' loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 7257 3 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 7257 _Software.ID 4 _Software.Name CYANA _Software.Version 2.1 _Software.Details 'P.Guntert, C.Mumenthaler and K. Wuthrich,' loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 7257 4 stop_ save_ save_AMBER _Software.Sf_category software _Software.Sf_framecode AMBER _Software.Entry_ID 7257 _Software.ID 5 _Software.Name AMBER _Software.Version 7.0 _Software.Details ; Case DA, Cheatham TE 3rd, Darden T, Gohlke H, Luo R, Merz KM Jr, Onufriev A, Simmerling C, Wang B, Woods RJ. ; loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 7257 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer _NMR_spectrometer.Entry_ID 7257 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 7257 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer Bruker DRX . 600 . . . 7257 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 7257 _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 13C-separated NOESY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7257 1 2 '3D 15N-separated NOESY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7257 1 3 '2D TOCSY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7257 1 stop_ save_ save_NMR_spec_expt__0_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_1 _NMR_spec_expt.Entry_ID 7257 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '3D 13C-separated NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_2 _NMR_spec_expt.Entry_ID 7257 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '3D 15N-separated NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_3 _NMR_spec_expt.Entry_ID 7257 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name '2D TOCSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 7257 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.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 . . . . . . . . . 7257 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . . . . . 7257 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 7257 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_set_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_set_1 _Assigned_chem_shift_list.Entry_ID 7257 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _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 $sample_1 . 7257 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 1 1 MET HA H 1 4.241 0.010 . 1 . . . . 11 . . . 7257 1 2 . 1 1 1 1 MET HB2 H 1 2.206 0.010 . 2 . . . . 11 . . . 7257 1 3 . 1 1 1 1 MET HB3 H 1 1.873 0.010 . 2 . . . . 11 . . . 7257 1 4 . 1 1 1 1 MET HG2 H 1 2.412 0.010 . 2 . . . . 11 . . . 7257 1 5 . 1 1 1 1 MET HG3 H 1 2.617 0.010 . 2 . . . . 11 . . . 7257 1 6 . 1 1 1 1 MET HE1 H 1 0.898 0.010 . 1 . . . . 11 . . . 7257 1 7 . 1 1 1 1 MET HE2 H 1 0.898 0.010 . 1 . . . . 11 . . . 7257 1 8 . 1 1 1 1 MET HE3 H 1 0.898 0.010 . 1 . . . . 11 . . . 7257 1 9 . 1 1 1 1 MET C C 13 172.518 0.100 . 1 . . . . 11 . . . 7257 1 10 . 1 1 1 1 MET CA C 13 54.878 0.100 . 1 . . . . 11 . . . 7257 1 11 . 1 1 1 1 MET CB C 13 32.885 0.100 . 1 . . . . 11 . . . 7257 1 12 . 1 1 1 1 MET CG C 13 32.013 0.100 . 1 . . . . 11 . . . 7257 1 13 . 1 1 1 1 MET CE C 13 17.424 0.100 . 1 . . . . 11 . . . 7257 1 14 . 1 1 2 2 LYS H H 1 9.151 0.010 . 1 . . . . 12 . . . 7257 1 15 . 1 1 2 2 LYS HA H 1 4.855 0.010 . 1 . . . . 12 . . . 7257 1 16 . 1 1 2 2 LYS HB2 H 1 1.762 0.010 . 1 . . . . 12 . . . 7257 1 17 . 1 1 2 2 LYS HB3 H 1 1.762 0.010 . 1 . . . . 12 . . . 7257 1 18 . 1 1 2 2 LYS HG2 H 1 1.449 0.010 . 1 . . . . 12 . . . 7257 1 19 . 1 1 2 2 LYS HG3 H 1 1.449 0.010 . 1 . . . . 12 . . . 7257 1 20 . 1 1 2 2 LYS HD2 H 1 1.321 0.010 . 1 . . . . 12 . . . 7257 1 21 . 1 1 2 2 LYS HD3 H 1 1.321 0.010 . 1 . . . . 12 . . . 7257 1 22 . 1 1 2 2 LYS HE2 H 1 2.993 0.010 . 1 . . . . 12 . . . 7257 1 23 . 1 1 2 2 LYS HE3 H 1 2.993 0.010 . 1 . . . . 12 . . . 7257 1 24 . 1 1 2 2 LYS C C 13 174.408 0.100 . 1 . . . . 12 . . . 7257 1 25 . 1 1 2 2 LYS CA C 13 56.954 0.100 . 1 . . . . 12 . . . 7257 1 26 . 1 1 2 2 LYS CB C 13 34.622 0.100 . 1 . . . . 12 . . . 7257 1 27 . 1 1 2 2 LYS CG C 13 25.190 0.100 . 1 . . . . 12 . . . 7257 1 28 . 1 1 2 2 LYS CD C 13 25.729 0.100 . 1 . . . . 12 . . . 7257 1 29 . 1 1 2 2 LYS CE C 13 42.087 0.100 . 1 . . . . 12 . . . 7257 1 30 . 1 1 2 2 LYS N N 15 128.932 0.100 . 1 . . . . 12 . . . 7257 1 31 . 1 1 3 3 VAL H H 1 9.193 0.010 . 1 . . . . 13 . . . 7257 1 32 . 1 1 3 3 VAL HA H 1 4.558 0.010 . 1 . . . . 13 . . . 7257 1 33 . 1 1 3 3 VAL HB H 1 2.134 0.010 . 1 . . . . 13 . . . 7257 1 34 . 1 1 3 3 VAL HG11 H 1 0.909 0.010 . 2 . . . . 13 . . . 7257 1 35 . 1 1 3 3 VAL HG12 H 1 0.909 0.010 . 2 . . . . 13 . . . 7257 1 36 . 1 1 3 3 VAL HG13 H 1 0.909 0.010 . 2 . . . . 13 . . . 7257 1 37 . 1 1 3 3 VAL HG21 H 1 1.092 0.010 . 2 . . . . 13 . . . 7257 1 38 . 1 1 3 3 VAL HG22 H 1 1.092 0.010 . 2 . . . . 13 . . . 7257 1 39 . 1 1 3 3 VAL HG23 H 1 1.092 0.010 . 2 . . . . 13 . . . 7257 1 40 . 1 1 3 3 VAL C C 13 174.754 0.100 . 1 . . . . 13 . . . 7257 1 41 . 1 1 3 3 VAL CA C 13 61.419 0.100 . 1 . . . . 13 . . . 7257 1 42 . 1 1 3 3 VAL CB C 13 33.804 0.100 . 1 . . . . 13 . . . 7257 1 43 . 1 1 3 3 VAL CG1 C 13 23.342 0.100 . 1 . . . . 13 . . . 7257 1 44 . 1 1 3 3 VAL CG2 C 13 23.342 0.100 . 1 . . . . 13 . . . 7257 1 45 . 1 1 3 3 VAL N N 15 121.712 0.100 . 1 . . . . 13 . . . 7257 1 46 . 1 1 4 4 TYR H H 1 9.383 0.010 . 1 . . . . 14 . . . 7257 1 47 . 1 1 4 4 TYR HA H 1 4.885 0.010 . 1 . . . . 14 . . . 7257 1 48 . 1 1 4 4 TYR HB2 H 1 2.955 0.010 . 1 . . . . 14 . . . 7257 1 49 . 1 1 4 4 TYR HB3 H 1 2.955 0.010 . 1 . . . . 14 . . . 7257 1 50 . 1 1 4 4 TYR HD1 H 1 6.860 0.010 . 1 . . . . 14 . . . 7257 1 51 . 1 1 4 4 TYR HD2 H 1 6.860 0.010 . 1 . . . . 14 . . . 7257 1 52 . 1 1 4 4 TYR HE1 H 1 6.450 0.010 . 1 . . . . 14 . . . 7257 1 53 . 1 1 4 4 TYR HE2 H 1 6.450 0.010 . 1 . . . . 14 . . . 7257 1 54 . 1 1 4 4 TYR C C 13 173.745 0.100 . 1 . . . . 14 . . . 7257 1 55 . 1 1 4 4 TYR CA C 13 57.210 0.100 . 1 . . . . 14 . . . 7257 1 56 . 1 1 4 4 TYR CB C 13 40.153 0.100 . 1 . . . . 14 . . . 7257 1 57 . 1 1 4 4 TYR CD1 C 13 133.000 0.100 . 1 . . . . 14 . . . 7257 1 58 . 1 1 4 4 TYR CD2 C 13 133.000 0.100 . 1 . . . . 14 . . . 7257 1 59 . 1 1 4 4 TYR CE1 C 13 117.790 0.100 . 1 . . . . 14 . . . 7257 1 60 . 1 1 4 4 TYR CE2 C 13 117.790 0.100 . 1 . . . . 14 . . . 7257 1 61 . 1 1 4 4 TYR N N 15 127.616 0.100 . 1 . . . . 14 . . . 7257 1 62 . 1 1 5 5 VAL H H 1 8.465 0.010 . 1 . . . . 15 . . . 7257 1 63 . 1 1 5 5 VAL HA H 1 4.929 0.010 . 1 . . . . 15 . . . 7257 1 64 . 1 1 5 5 VAL HB H 1 1.859 0.010 . 1 . . . . 15 . . . 7257 1 65 . 1 1 5 5 VAL HG11 H 1 0.781 0.010 . 2 . . . . 15 . . . 7257 1 66 . 1 1 5 5 VAL HG12 H 1 0.781 0.010 . 2 . . . . 15 . . . 7257 1 67 . 1 1 5 5 VAL HG13 H 1 0.781 0.010 . 2 . . . . 15 . . . 7257 1 68 . 1 1 5 5 VAL HG21 H 1 0.964 0.010 . 2 . . . . 15 . . . 7257 1 69 . 1 1 5 5 VAL HG22 H 1 0.964 0.010 . 2 . . . . 15 . . . 7257 1 70 . 1 1 5 5 VAL HG23 H 1 0.964 0.010 . 2 . . . . 15 . . . 7257 1 71 . 1 1 5 5 VAL C C 13 174.355 0.100 . 1 . . . . 15 . . . 7257 1 72 . 1 1 5 5 VAL CA C 13 60.284 0.100 . 1 . . . . 15 . . . 7257 1 73 . 1 1 5 5 VAL CB C 13 33.036 0.100 . 1 . . . . 15 . . . 7257 1 74 . 1 1 5 5 VAL CG1 C 13 21.753 0.100 . 1 . . . . 15 . . . 7257 1 75 . 1 1 5 5 VAL CG2 C 13 21.753 0.100 . 1 . . . . 15 . . . 7257 1 76 . 1 1 5 5 VAL N N 15 125.939 0.100 . 1 . . . . 15 . . . 7257 1 77 . 1 1 6 6 GLY H H 1 9.434 0.010 . 1 . . . . 16 . . . 7257 1 78 . 1 1 6 6 GLY HA2 H 1 3.623 0.010 . 2 . . . . 16 . . . 7257 1 79 . 1 1 6 6 GLY HA3 H 1 4.810 0.010 . 2 . . . . 16 . . . 7257 1 80 . 1 1 6 6 GLY C C 13 173.645 0.100 . 1 . . . . 16 . . . 7257 1 81 . 1 1 6 6 GLY CA C 13 43.563 0.100 . 1 . . . . 16 . . . 7257 1 82 . 1 1 6 6 GLY N N 15 112.366 0.100 . 1 . . . . 16 . . . 7257 1 83 . 1 1 7 7 ASN H H 1 8.526 0.010 . 1 . . . . 17 . . . 7257 1 84 . 1 1 7 7 ASN HA H 1 4.395 0.010 . 1 . . . . 17 . . . 7257 1 85 . 1 1 7 7 ASN HB2 H 1 2.640 0.010 . 1 . . . . 17 . . . 7257 1 86 . 1 1 7 7 ASN HB3 H 1 2.640 0.010 . 1 . . . . 17 . . . 7257 1 87 . 1 1 7 7 ASN HD21 H 1 7.527 0.010 . 2 . . . . 17 . . . 7257 1 88 . 1 1 7 7 ASN HD22 H 1 6.844 0.010 . 2 . . . . 17 . . . 7257 1 89 . 1 1 7 7 ASN C C 13 175.050 0.100 . 1 . . . . 17 . . . 7257 1 90 . 1 1 7 7 ASN CA C 13 54.372 0.100 . 1 . . . . 17 . . . 7257 1 91 . 1 1 7 7 ASN CB C 13 38.308 0.100 . 1 . . . . 17 . . . 7257 1 92 . 1 1 7 7 ASN N N 15 114.759 0.100 . 1 . . . . 17 . . . 7257 1 93 . 1 1 7 7 ASN ND2 N 15 112.529 0.100 . 1 . . . . 17 . . . 7257 1 94 . 1 1 8 8 LEU H H 1 7.873 0.010 . 1 . . . . 18 . . . 7257 1 95 . 1 1 8 8 LEU HA H 1 4.009 0.010 . 1 . . . . 18 . . . 7257 1 96 . 1 1 8 8 LEU HB2 H 1 1.380 0.010 . 1 . . . . 18 . . . 7257 1 97 . 1 1 8 8 LEU HB3 H 1 1.380 0.010 . 1 . . . . 18 . . . 7257 1 98 . 1 1 8 8 LEU HG H 1 1.421 0.010 . 1 . . . . 18 . . . 7257 1 99 . 1 1 8 8 LEU HD11 H 1 0.653 0.010 . 1 . . . . 18 . . . 7257 1 100 . 1 1 8 8 LEU HD12 H 1 0.653 0.010 . 1 . . . . 18 . . . 7257 1 101 . 1 1 8 8 LEU HD13 H 1 0.653 0.010 . 1 . . . . 18 . . . 7257 1 102 . 1 1 8 8 LEU HD21 H 1 0.653 0.010 . 1 . . . . 18 . . . 7257 1 103 . 1 1 8 8 LEU HD22 H 1 0.653 0.010 . 1 . . . . 18 . . . 7257 1 104 . 1 1 8 8 LEU HD23 H 1 0.653 0.010 . 1 . . . . 18 . . . 7257 1 105 . 1 1 8 8 LEU C C 13 177.545 0.100 . 1 . . . . 18 . . . 7257 1 106 . 1 1 8 8 LEU CA C 13 54.996 0.100 . 1 . . . . 18 . . . 7257 1 107 . 1 1 8 8 LEU CB C 13 43.338 0.100 . 1 . . . . 18 . . . 7257 1 108 . 1 1 8 8 LEU CG C 13 26.519 0.100 . 1 . . . . 18 . . . 7257 1 109 . 1 1 8 8 LEU CD1 C 13 24.930 0.100 . 1 . . . . 18 . . . 7257 1 110 . 1 1 8 8 LEU CD2 C 13 24.930 0.100 . 1 . . . . 18 . . . 7257 1 111 . 1 1 8 8 LEU N N 15 117.147 0.100 . 1 . . . . 18 . . . 7257 1 112 . 1 1 9 9 GLY H H 1 8.264 0.010 . 1 . . . . 19 . . . 7257 1 113 . 1 1 9 9 GLY HA2 H 1 3.860 0.010 . 2 . . . . 19 . . . 7257 1 114 . 1 1 9 9 GLY HA3 H 1 4.157 0.010 . 2 . . . . 19 . . . 7257 1 115 . 1 1 9 9 GLY C C 13 174.907 0.100 . 1 . . . . 19 . . . 7257 1 116 . 1 1 9 9 GLY CA C 13 44.592 0.100 . 1 . . . . 19 . . . 7257 1 117 . 1 1 9 9 GLY N N 15 109.546 0.100 . 1 . . . . 19 . . . 7257 1 118 . 1 1 10 10 THR H H 1 8.443 0.010 . 1 . . . . 20 . . . 7257 1 119 . 1 1 10 10 THR HA H 1 4.015 0.010 . 1 . . . . 20 . . . 7257 1 120 . 1 1 10 10 THR HB H 1 4.250 0.010 . 1 . . . . 20 . . . 7257 1 121 . 1 1 10 10 THR HG21 H 1 1.245 0.010 . 1 . . . . 20 . . . 7257 1 122 . 1 1 10 10 THR HG22 H 1 1.245 0.010 . 1 . . . . 20 . . . 7257 1 123 . 1 1 10 10 THR HG23 H 1 1.245 0.010 . 1 . . . . 20 . . . 7257 1 124 . 1 1 10 10 THR C C 13 175.881 0.100 . 1 . . . . 20 . . . 7257 1 125 . 1 1 10 10 THR CA C 13 63.810 0.100 . 1 . . . . 20 . . . 7257 1 126 . 1 1 10 10 THR CB C 13 69.040 0.100 . 1 . . . . 20 . . . 7257 1 127 . 1 1 10 10 THR CG2 C 13 21.777 0.100 . 1 . . . . 20 . . . 7257 1 128 . 1 1 10 10 THR N N 15 113.560 0.100 . 1 . . . . 20 . . . 7257 1 129 . 1 1 11 11 GLY H H 1 8.717 0.010 . 1 . . . . 21 . . . 7257 1 130 . 1 1 11 11 GLY HA2 H 1 3.786 0.010 . 2 . . . . 21 . . . 7257 1 131 . 1 1 11 11 GLY HA3 H 1 4.023 0.010 . 2 . . . . 21 . . . 7257 1 132 . 1 1 11 11 GLY C C 13 174.229 0.100 . 1 . . . . 21 . . . 7257 1 133 . 1 1 11 11 GLY CA C 13 45.308 0.100 . 1 . . . . 21 . . . 7257 1 134 . 1 1 11 11 GLY N N 15 110.935 0.100 . 1 . . . . 21 . . . 7257 1 135 . 1 1 12 12 ALA H H 1 7.410 0.010 . 1 . . . . 22 . . . 7257 1 136 . 1 1 12 12 ALA HA H 1 4.276 0.010 . 1 . . . . 22 . . . 7257 1 137 . 1 1 12 12 ALA HB1 H 1 1.322 0.010 . 1 . . . . 22 . . . 7257 1 138 . 1 1 12 12 ALA HB2 H 1 1.322 0.010 . 1 . . . . 22 . . . 7257 1 139 . 1 1 12 12 ALA HB3 H 1 1.322 0.010 . 1 . . . . 22 . . . 7257 1 140 . 1 1 12 12 ALA C C 13 176.474 0.100 . 1 . . . . 22 . . . 7257 1 141 . 1 1 12 12 ALA CA C 13 52.782 0.100 . 1 . . . . 22 . . . 7257 1 142 . 1 1 12 12 ALA CB C 13 19.498 0.100 . 1 . . . . 22 . . . 7257 1 143 . 1 1 12 12 ALA N N 15 122.834 0.100 . 1 . . . . 22 . . . 7257 1 144 . 1 1 13 13 GLY H H 1 8.023 0.010 . 1 . . . . 23 . . . 7257 1 145 . 1 1 13 13 GLY HA2 H 1 3.786 0.010 . 2 . . . . 23 . . . 7257 1 146 . 1 1 13 13 GLY HA3 H 1 4.320 0.010 . 2 . . . . 23 . . . 7257 1 147 . 1 1 13 13 GLY C C 13 173.437 0.100 . 1 . . . . 23 . . . 7257 1 148 . 1 1 13 13 GLY CA C 13 44.163 0.100 . 1 . . . . 23 . . . 7257 1 149 . 1 1 13 13 GLY N N 15 110.282 0.100 . 1 . . . . 23 . . . 7257 1 150 . 1 1 14 14 LYS H H 1 8.759 0.010 . 1 . . . . 24 . . . 7257 1 151 . 1 1 14 14 LYS HA H 1 3.652 0.010 . 1 . . . . 24 . . . 7257 1 152 . 1 1 14 14 LYS HB2 H 1 1.722 0.010 . 1 . . . . 24 . . . 7257 1 153 . 1 1 14 14 LYS HB3 H 1 1.722 0.010 . 1 . . . . 24 . . . 7257 1 154 . 1 1 14 14 LYS HG2 H 1 1.311 0.010 . 1 . . . . 24 . . . 7257 1 155 . 1 1 14 14 LYS HG3 H 1 1.311 0.010 . 1 . . . . 24 . . . 7257 1 156 . 1 1 14 14 LYS HD2 H 1 1.675 0.010 . 1 . . . . 24 . . . 7257 1 157 . 1 1 14 14 LYS HD3 H 1 1.675 0.010 . 1 . . . . 24 . . . 7257 1 158 . 1 1 14 14 LYS HE2 H 1 3.002 0.010 . 1 . . . . 24 . . . 7257 1 159 . 1 1 14 14 LYS HE3 H 1 3.002 0.010 . 1 . . . . 24 . . . 7257 1 160 . 1 1 14 14 LYS C C 13 178.082 0.100 . 1 . . . . 24 . . . 7257 1 161 . 1 1 14 14 LYS CA C 13 60.629 0.100 . 1 . . . . 24 . . . 7257 1 162 . 1 1 14 14 LYS CB C 13 32.703 0.100 . 1 . . . . 24 . . . 7257 1 163 . 1 1 14 14 LYS CG C 13 25.046 0.100 . 1 . . . . 24 . . . 7257 1 164 . 1 1 14 14 LYS CD C 13 29.300 0.100 . 1 . . . . 24 . . . 7257 1 165 . 1 1 14 14 LYS CE C 13 42.128 0.100 . 1 . . . . 24 . . . 7257 1 166 . 1 1 14 14 LYS N N 15 122.493 0.100 . 1 . . . . 24 . . . 7257 1 167 . 1 1 15 15 GLY H H 1 8.822 0.010 . 1 . . . . 25 . . . 7257 1 168 . 1 1 15 15 GLY HA2 H 1 3.860 0.010 . 2 . . . . 25 . . . 7257 1 169 . 1 1 15 15 GLY HA3 H 1 4.053 0.010 . 2 . . . . 25 . . . 7257 1 170 . 1 1 15 15 GLY C C 13 176.581 0.100 . 1 . . . . 25 . . . 7257 1 171 . 1 1 15 15 GLY CA C 13 47.153 0.100 . 1 . . . . 25 . . . 7257 1 172 . 1 1 15 15 GLY N N 15 106.364 0.100 . 1 . . . . 25 . . . 7257 1 173 . 1 1 16 16 GLU H H 1 8.026 0.010 . 1 . . . . 26 . . . 7257 1 174 . 1 1 16 16 GLU HA H 1 4.053 0.010 . 1 . . . . 26 . . . 7257 1 175 . 1 1 16 16 GLU HB2 H 1 1.980 0.010 . 1 . . . . 26 . . . 7257 1 176 . 1 1 16 16 GLU HB3 H 1 1.980 0.010 . 1 . . . . 26 . . . 7257 1 177 . 1 1 16 16 GLU HG2 H 1 2.445 0.010 . 1 . . . . 26 . . . 7257 1 178 . 1 1 16 16 GLU HG3 H 1 2.445 0.010 . 1 . . . . 26 . . . 7257 1 179 . 1 1 16 16 GLU C C 13 179.678 0.100 . 1 . . . . 26 . . . 7257 1 180 . 1 1 16 16 GLU CA C 13 59.888 0.100 . 1 . . . . 26 . . . 7257 1 181 . 1 1 16 16 GLU CB C 13 29.301 0.100 . 1 . . . . 26 . . . 7257 1 182 . 1 1 16 16 GLU CG C 13 37.286 0.100 . 1 . . . . 26 . . . 7257 1 183 . 1 1 16 16 GLU N N 15 121.800 0.100 . 1 . . . . 26 . . . 7257 1 184 . 1 1 17 17 LEU H H 1 7.837 0.010 . 1 . . . . 27 . . . 7257 1 185 . 1 1 17 17 LEU HA H 1 4.216 0.010 . 1 . . . . 27 . . . 7257 1 186 . 1 1 17 17 LEU HB2 H 1 1.826 0.010 . 2 . . . . 27 . . . 7257 1 187 . 1 1 17 17 LEU HB3 H 1 1.411 0.010 . 2 . . . . 27 . . . 7257 1 188 . 1 1 17 17 LEU HG H 1 1.695 0.010 . 1 . . . . 27 . . . 7257 1 189 . 1 1 17 17 LEU HD11 H 1 0.708 0.010 . 1 . . . . 27 . . . 7257 1 190 . 1 1 17 17 LEU HD12 H 1 0.708 0.010 . 1 . . . . 27 . . . 7257 1 191 . 1 1 17 17 LEU HD13 H 1 0.708 0.010 . 1 . . . . 27 . . . 7257 1 192 . 1 1 17 17 LEU HD21 H 1 0.708 0.010 . 1 . . . . 27 . . . 7257 1 193 . 1 1 17 17 LEU HD22 H 1 0.708 0.010 . 1 . . . . 27 . . . 7257 1 194 . 1 1 17 17 LEU HD23 H 1 0.708 0.010 . 1 . . . . 27 . . . 7257 1 195 . 1 1 17 17 LEU C C 13 178.972 0.100 . 1 . . . . 27 . . . 7257 1 196 . 1 1 17 17 LEU CA C 13 58.550 0.100 . 1 . . . . 27 . . . 7257 1 197 . 1 1 17 17 LEU CB C 13 42.197 0.100 . 1 . . . . 27 . . . 7257 1 198 . 1 1 17 17 LEU CG C 13 27.750 0.100 . 1 . . . . 27 . . . 7257 1 199 . 1 1 17 17 LEU CD1 C 13 24.577 0.100 . 1 . . . . 27 . . . 7257 1 200 . 1 1 17 17 LEU CD2 C 13 24.577 0.100 . 1 . . . . 27 . . . 7257 1 201 . 1 1 17 17 LEU N N 15 120.320 0.100 . 1 . . . . 27 . . . 7257 1 202 . 1 1 18 18 GLU H H 1 9.048 0.010 . 1 . . . . 28 . . . 7257 1 203 . 1 1 18 18 GLU HA H 1 4.172 0.010 . 1 . . . . 28 . . . 7257 1 204 . 1 1 18 18 GLU HB2 H 1 2.079 0.010 . 1 . . . . 28 . . . 7257 1 205 . 1 1 18 18 GLU HB3 H 1 2.079 0.010 . 1 . . . . 28 . . . 7257 1 206 . 1 1 18 18 GLU HG2 H 1 2.189 0.010 . 1 . . . . 28 . . . 7257 1 207 . 1 1 18 18 GLU HG3 H 1 2.189 0.010 . 1 . . . . 28 . . . 7257 1 208 . 1 1 18 18 GLU C C 13 179.678 0.100 . 1 . . . . 28 . . . 7257 1 209 . 1 1 18 18 GLU CA C 13 60.015 0.100 . 1 . . . . 28 . . . 7257 1 210 . 1 1 18 18 GLU CB C 13 29.371 0.100 . 1 . . . . 28 . . . 7257 1 211 . 1 1 18 18 GLU CG C 13 36.227 0.100 . 1 . . . . 28 . . . 7257 1 212 . 1 1 18 18 GLU N N 15 119.072 0.100 . 1 . . . . 28 . . . 7257 1 213 . 1 1 19 19 ARG H H 1 8.195 0.010 . 1 . . . . 29 . . . 7257 1 214 . 1 1 19 19 ARG HA H 1 3.994 0.010 . 1 . . . . 29 . . . 7257 1 215 . 1 1 19 19 ARG HB2 H 1 1.900 0.010 . 1 . . . . 29 . . . 7257 1 216 . 1 1 19 19 ARG HB3 H 1 1.900 0.010 . 1 . . . . 29 . . . 7257 1 217 . 1 1 19 19 ARG HG2 H 1 1.549 0.010 . 1 . . . . 29 . . . 7257 1 218 . 1 1 19 19 ARG HG3 H 1 1.549 0.010 . 1 . . . . 29 . . . 7257 1 219 . 1 1 19 19 ARG HD2 H 1 3.267 0.010 . 1 . . . . 29 . . . 7257 1 220 . 1 1 19 19 ARG HD3 H 1 3.267 0.010 . 1 . . . . 29 . . . 7257 1 221 . 1 1 19 19 ARG HE H 1 7.383 0.010 . 1 . . . . 29 . . . 7257 1 222 . 1 1 19 19 ARG C C 13 178.345 0.100 . 1 . . . . 29 . . . 7257 1 223 . 1 1 19 19 ARG CA C 13 59.892 0.100 . 1 . . . . 29 . . . 7257 1 224 . 1 1 19 19 ARG CB C 13 30.290 0.100 . 1 . . . . 29 . . . 7257 1 225 . 1 1 19 19 ARG CG C 13 27.048 0.100 . 1 . . . . 29 . . . 7257 1 226 . 1 1 19 19 ARG CD C 13 43.464 0.100 . 1 . . . . 29 . . . 7257 1 227 . 1 1 19 19 ARG N N 15 120.083 0.100 . 1 . . . . 29 . . . 7257 1 228 . 1 1 19 19 ARG NE N 15 83.957 0.100 . 1 . . . . 29 . . . 7257 1 229 . 1 1 20 20 ALA H H 1 7.756 0.010 . 1 . . . . 30 . . . 7257 1 230 . 1 1 20 20 ALA HA H 1 4.202 0.010 . 1 . . . . 30 . . . 7257 1 231 . 1 1 20 20 ALA HB1 H 1 1.500 0.010 . 1 . . . . 30 . . . 7257 1 232 . 1 1 20 20 ALA HB2 H 1 1.500 0.010 . 1 . . . . 30 . . . 7257 1 233 . 1 1 20 20 ALA HB3 H 1 1.500 0.010 . 1 . . . . 30 . . . 7257 1 234 . 1 1 20 20 ALA C C 13 179.965 0.100 . 1 . . . . 30 . . . 7257 1 235 . 1 1 20 20 ALA CA C 13 54.793 0.100 . 1 . . . . 30 . . . 7257 1 236 . 1 1 20 20 ALA CB C 13 18.278 0.100 . 1 . . . . 30 . . . 7257 1 237 . 1 1 20 20 ALA N N 15 119.056 0.100 . 1 . . . . 30 . . . 7257 1 238 . 1 1 21 21 PHE H H 1 8.454 0.010 . 1 . . . . 31 . . . 7257 1 239 . 1 1 21 21 PHE HA H 1 4.513 0.010 . 1 . . . . 31 . . . 7257 1 240 . 1 1 21 21 PHE HB2 H 1 3.133 0.010 . 1 . . . . 31 . . . 7257 1 241 . 1 1 21 21 PHE HB3 H 1 3.133 0.010 . 1 . . . . 31 . . . 7257 1 242 . 1 1 21 21 PHE HD1 H 1 7.740 0.010 . 1 . . . . 31 . . . 7257 1 243 . 1 1 21 21 PHE HD2 H 1 7.740 0.010 . 1 . . . . 31 . . . 7257 1 244 . 1 1 21 21 PHE HE1 H 1 7.080 0.010 . 1 . . . . 31 . . . 7257 1 245 . 1 1 21 21 PHE HE2 H 1 7.080 0.010 . 1 . . . . 31 . . . 7257 1 246 . 1 1 21 21 PHE HZ H 1 7.220 0.010 . 1 . . . . 31 . . . 7257 1 247 . 1 1 21 21 PHE C C 13 178.116 0.100 . 1 . . . . 31 . . . 7257 1 248 . 1 1 21 21 PHE CA C 13 62.664 0.100 . 1 . . . . 31 . . . 7257 1 249 . 1 1 21 21 PHE CB C 13 39.163 0.100 . 1 . . . . 31 . . . 7257 1 250 . 1 1 21 21 PHE CD1 C 13 131.720 0.100 . 1 . . . . 31 . . . 7257 1 251 . 1 1 21 21 PHE CD2 C 13 131.720 0.100 . 1 . . . . 31 . . . 7257 1 252 . 1 1 21 21 PHE CE1 C 13 130.560 0.100 . 1 . . . . 31 . . . 7257 1 253 . 1 1 21 21 PHE CE2 C 13 130.560 0.100 . 1 . . . . 31 . . . 7257 1 254 . 1 1 21 21 PHE CZ C 13 130.010 0.100 . 1 . . . . 31 . . . 7257 1 255 . 1 1 21 21 PHE N N 15 112.618 0.100 . 1 . . . . 31 . . . 7257 1 256 . 1 1 22 22 SER H H 1 8.793 0.010 . 1 . . . . 32 . . . 7257 1 257 . 1 1 22 22 SER HA H 1 5.033 0.010 . 1 . . . . 32 . . . 7257 1 258 . 1 1 22 22 SER HB2 H 1 4.068 0.010 . 1 . . . . 32 . . . 7257 1 259 . 1 1 22 22 SER HB3 H 1 4.068 0.010 . 1 . . . . 32 . . . 7257 1 260 . 1 1 22 22 SER C C 13 175.708 0.100 . 1 . . . . 32 . . . 7257 1 261 . 1 1 22 22 SER CA C 13 61.110 0.100 . 1 . . . . 32 . . . 7257 1 262 . 1 1 22 22 SER CB C 13 63.027 0.100 . 1 . . . . 32 . . . 7257 1 263 . 1 1 22 22 SER N N 15 115.160 0.100 . 1 . . . . 32 . . . 7257 1 264 . 1 1 23 23 TYR H H 1 6.889 0.010 . 1 . . . . 33 . . . 7257 1 265 . 1 1 23 23 TYR HA H 1 4.009 0.010 . 1 . . . . 33 . . . 7257 1 266 . 1 1 23 23 TYR HB2 H 1 3.058 0.010 . 2 . . . . 33 . . . 7257 1 267 . 1 1 23 23 TYR HB3 H 1 2.479 0.010 . 2 . . . . 33 . . . 7257 1 268 . 1 1 23 23 TYR HD1 H 1 7.430 0.010 . 1 . . . . 33 . . . 7257 1 269 . 1 1 23 23 TYR HD2 H 1 7.430 0.010 . 1 . . . . 33 . . . 7257 1 270 . 1 1 23 23 TYR HE1 H 1 6.800 0.010 . 1 . . . . 33 . . . 7257 1 271 . 1 1 23 23 TYR HE2 H 1 6.800 0.010 . 1 . . . . 33 . . . 7257 1 272 . 1 1 23 23 TYR C C 13 176.237 0.100 . 1 . . . . 33 . . . 7257 1 273 . 1 1 23 23 TYR CA C 13 61.017 0.100 . 1 . . . . 33 . . . 7257 1 274 . 1 1 23 23 TYR CB C 13 39.368 0.100 . 1 . . . . 33 . . . 7257 1 275 . 1 1 23 23 TYR CD1 C 13 131.720 0.100 . 1 . . . . 33 . . . 7257 1 276 . 1 1 23 23 TYR CD2 C 13 131.720 0.100 . 1 . . . . 33 . . . 7257 1 277 . 1 1 23 23 TYR CE1 C 13 118.800 0.100 . 1 . . . . 33 . . . 7257 1 278 . 1 1 23 23 TYR CE2 C 13 118.800 0.100 . 1 . . . . 33 . . . 7257 1 279 . 1 1 23 23 TYR N N 15 121.907 0.100 . 1 . . . . 33 . . . 7257 1 280 . 1 1 24 24 TYR H H 1 7.858 0.010 . 1 . . . . 34 . . . 7257 1 281 . 1 1 24 24 TYR HA H 1 4.023 0.010 . 1 . . . . 34 . . . 7257 1 282 . 1 1 24 24 TYR HB2 H 1 3.370 0.010 . 2 . . . . 34 . . . 7257 1 283 . 1 1 24 24 TYR HB3 H 1 3.103 0.010 . 2 . . . . 34 . . . 7257 1 284 . 1 1 24 24 TYR HD1 H 1 6.138 0.010 . 1 . . . . 34 . . . 7257 1 285 . 1 1 24 24 TYR HD2 H 1 6.138 0.010 . 1 . . . . 34 . . . 7257 1 286 . 1 1 24 24 TYR HE1 H 1 6.530 0.010 . 1 . . . . 34 . . . 7257 1 287 . 1 1 24 24 TYR HE2 H 1 6.530 0.010 . 1 . . . . 34 . . . 7257 1 288 . 1 1 24 24 TYR C C 13 174.593 0.100 . 1 . . . . 34 . . . 7257 1 289 . 1 1 24 24 TYR CA C 13 60.480 0.100 . 1 . . . . 34 . . . 7257 1 290 . 1 1 24 24 TYR CB C 13 38.952 0.100 . 1 . . . . 34 . . . 7257 1 291 . 1 1 24 24 TYR CD1 C 13 133.870 0.100 . 1 . . . . 34 . . . 7257 1 292 . 1 1 24 24 TYR CD2 C 13 133.870 0.100 . 1 . . . . 34 . . . 7257 1 293 . 1 1 24 24 TYR CE1 C 13 117.730 0.100 . 1 . . . . 34 . . . 7257 1 294 . 1 1 24 24 TYR CE2 C 13 117.730 0.100 . 1 . . . . 34 . . . 7257 1 295 . 1 1 24 24 TYR N N 15 113.736 0.100 . 1 . . . . 34 . . . 7257 1 296 . 1 1 25 25 GLY H H 1 7.399 0.010 . 1 . . . . 35 . . . 7257 1 297 . 1 1 25 25 GLY HA2 H 1 3.829 0.010 . 2 . . . . 35 . . . 7257 1 298 . 1 1 25 25 GLY HA3 H 1 4.127 0.010 . 2 . . . . 35 . . . 7257 1 299 . 1 1 25 25 GLY C C 13 169.778 0.100 . 1 . . . . 35 . . . 7257 1 300 . 1 1 25 25 GLY CA C 13 44.764 0.100 . 1 . . . . 35 . . . 7257 1 301 . 1 1 25 25 GLY N N 15 107.307 0.100 . 1 . . . . 35 . . . 7257 1 302 . 1 1 26 26 PRO HA H 1 4.409 0.010 . 1 . . . . 36 . . . 7257 1 303 . 1 1 26 26 PRO HB2 H 1 2.220 0.010 . 2 . . . . 36 . . . 7257 1 304 . 1 1 26 26 PRO HB3 H 1 1.886 0.010 . 2 . . . . 36 . . . 7257 1 305 . 1 1 26 26 PRO HG2 H 1 2.040 0.010 . 1 . . . . 36 . . . 7257 1 306 . 1 1 26 26 PRO HG3 H 1 2.040 0.010 . 1 . . . . 36 . . . 7257 1 307 . 1 1 26 26 PRO C C 13 177.938 0.100 . 1 . . . . 36 . . . 7257 1 308 . 1 1 26 26 PRO CA C 13 63.163 0.100 . 1 . . . . 36 . . . 7257 1 309 . 1 1 26 26 PRO CB C 13 32.191 0.100 . 1 . . . . 36 . . . 7257 1 310 . 1 1 26 26 PRO CG C 13 27.261 0.100 . 1 . . . . 36 . . . 7257 1 311 . 1 1 26 26 PRO CD C 13 50.171 0.100 . 1 . . . . 36 . . . 7257 1 312 . 1 1 27 27 LEU H H 1 8.723 0.010 . 1 . . . . 37 . . . 7257 1 313 . 1 1 27 27 LEU HA H 1 4.513 0.010 . 1 . . . . 37 . . . 7257 1 314 . 1 1 27 27 LEU HB2 H 1 1.585 0.010 . 1 . . . . 37 . . . 7257 1 315 . 1 1 27 27 LEU HB3 H 1 1.585 0.010 . 1 . . . . 37 . . . 7257 1 316 . 1 1 27 27 LEU HG H 1 1.622 0.010 . 1 . . . . 37 . . . 7257 1 317 . 1 1 27 27 LEU HD11 H 1 0.764 0.010 . 2 . . . . 37 . . . 7257 1 318 . 1 1 27 27 LEU HD12 H 1 0.764 0.010 . 2 . . . . 37 . . . 7257 1 319 . 1 1 27 27 LEU HD13 H 1 0.764 0.010 . 2 . . . . 37 . . . 7257 1 320 . 1 1 27 27 LEU HD21 H 1 -0.192 0.010 . 2 . . . . 37 . . . 7257 1 321 . 1 1 27 27 LEU HD22 H 1 -0.192 0.010 . 2 . . . . 37 . . . 7257 1 322 . 1 1 27 27 LEU HD23 H 1 -0.192 0.010 . 2 . . . . 37 . . . 7257 1 323 . 1 1 27 27 LEU C C 13 177.474 0.100 . 1 . . . . 37 . . . 7257 1 324 . 1 1 27 27 LEU CA C 13 53.250 0.100 . 1 . . . . 37 . . . 7257 1 325 . 1 1 27 27 LEU CB C 13 43.059 0.100 . 1 . . . . 37 . . . 7257 1 326 . 1 1 27 27 LEU CG C 13 26.260 0.100 . 1 . . . . 37 . . . 7257 1 327 . 1 1 27 27 LEU CD1 C 13 22.930 0.100 . 1 . . . . 37 . . . 7257 1 328 . 1 1 27 27 LEU CD2 C 13 22.591 0.100 . 1 . . . . 37 . . . 7257 1 329 . 1 1 27 27 LEU N N 15 121.365 0.100 . 1 . . . . 37 . . . 7257 1 330 . 1 1 28 28 ARG H H 1 9.099 0.010 . 1 . . . . 38 . . . 7257 1 331 . 1 1 28 28 ARG HA H 1 4.395 0.010 . 1 . . . . 38 . . . 7257 1 332 . 1 1 28 28 ARG HB2 H 1 1.618 0.010 . 1 . . . . 38 . . . 7257 1 333 . 1 1 28 28 ARG HB3 H 1 1.618 0.010 . 1 . . . . 38 . . . 7257 1 334 . 1 1 28 28 ARG HG2 H 1 1.476 0.010 . 1 . . . . 38 . . . 7257 1 335 . 1 1 28 28 ARG HG3 H 1 1.476 0.010 . 1 . . . . 38 . . . 7257 1 336 . 1 1 28 28 ARG HD2 H 1 3.176 0.010 . 1 . . . . 38 . . . 7257 1 337 . 1 1 28 28 ARG HD3 H 1 3.176 0.010 . 1 . . . . 38 . . . 7257 1 338 . 1 1 28 28 ARG HE H 1 7.147 0.010 . 1 . . . . 38 . . . 7257 1 339 . 1 1 28 28 ARG C C 13 176.415 0.100 . 1 . . . . 38 . . . 7257 1 340 . 1 1 28 28 ARG CA C 13 57.583 0.100 . 1 . . . . 38 . . . 7257 1 341 . 1 1 28 28 ARG CB C 13 31.950 0.100 . 1 . . . . 38 . . . 7257 1 342 . 1 1 28 28 ARG CG C 13 26.872 0.100 . 1 . . . . 38 . . . 7257 1 343 . 1 1 28 28 ARG CD C 13 43.288 0.100 . 1 . . . . 38 . . . 7257 1 344 . 1 1 28 28 ARG N N 15 121.333 0.100 . 1 . . . . 38 . . . 7257 1 345 . 1 1 28 28 ARG NE N 15 84.645 0.100 . 1 . . . . 38 . . . 7257 1 346 . 1 1 29 29 THR H H 1 7.209 0.010 . 1 . . . . 39 . . . 7257 1 347 . 1 1 29 29 THR HA H 1 4.588 0.010 . 1 . . . . 39 . . . 7257 1 348 . 1 1 29 29 THR HB H 1 4.076 0.010 . 1 . . . . 39 . . . 7257 1 349 . 1 1 29 29 THR HG21 H 1 1.147 0.010 . 1 . . . . 39 . . . 7257 1 350 . 1 1 29 29 THR HG22 H 1 1.147 0.010 . 1 . . . . 39 . . . 7257 1 351 . 1 1 29 29 THR HG23 H 1 1.147 0.010 . 1 . . . . 39 . . . 7257 1 352 . 1 1 29 29 THR C C 13 172.084 0.100 . 1 . . . . 39 . . . 7257 1 353 . 1 1 29 29 THR CA C 13 61.482 0.100 . 1 . . . . 39 . . . 7257 1 354 . 1 1 29 29 THR CB C 13 71.689 0.100 . 1 . . . . 39 . . . 7257 1 355 . 1 1 29 29 THR CG2 C 13 21.223 0.100 . 1 . . . . 39 . . . 7257 1 356 . 1 1 29 29 THR N N 15 108.580 0.100 . 1 . . . . 39 . . . 7257 1 357 . 1 1 30 30 VAL H H 1 8.181 0.010 . 1 . . . . 40 . . . 7257 1 358 . 1 1 30 30 VAL HA H 1 4.454 0.010 . 1 . . . . 40 . . . 7257 1 359 . 1 1 30 30 VAL HB H 1 1.494 0.010 . 1 . . . . 40 . . . 7257 1 360 . 1 1 30 30 VAL HG11 H 1 0.397 0.010 . 1 . . . . 40 . . . 7257 1 361 . 1 1 30 30 VAL HG12 H 1 0.397 0.010 . 1 . . . . 40 . . . 7257 1 362 . 1 1 30 30 VAL HG13 H 1 0.397 0.010 . 1 . . . . 40 . . . 7257 1 363 . 1 1 30 30 VAL HG21 H 1 0.397 0.010 . 1 . . . . 40 . . . 7257 1 364 . 1 1 30 30 VAL HG22 H 1 0.397 0.010 . 1 . . . . 40 . . . 7257 1 365 . 1 1 30 30 VAL HG23 H 1 0.397 0.010 . 1 . . . . 40 . . . 7257 1 366 . 1 1 30 30 VAL C C 13 173.330 0.100 . 1 . . . . 40 . . . 7257 1 367 . 1 1 30 30 VAL CA C 13 62.106 0.100 . 1 . . . . 40 . . . 7257 1 368 . 1 1 30 30 VAL CB C 13 35.129 0.100 . 1 . . . . 40 . . . 7257 1 369 . 1 1 30 30 VAL CG1 C 13 22.571 0.100 . 1 . . . . 40 . . . 7257 1 370 . 1 1 30 30 VAL CG2 C 13 22.571 0.100 . 1 . . . . 40 . . . 7257 1 371 . 1 1 30 30 VAL N N 15 122.546 0.100 . 1 . . . . 40 . . . 7257 1 372 . 1 1 31 31 TRP H H 1 8.943 0.010 . 1 . . . . 41 . . . 7257 1 373 . 1 1 31 31 TRP HA H 1 4.647 0.010 . 1 . . . . 41 . . . 7257 1 374 . 1 1 31 31 TRP HB2 H 1 2.806 0.010 . 2 . . . . 41 . . . 7257 1 375 . 1 1 31 31 TRP HB3 H 1 2.717 0.010 . 2 . . . . 41 . . . 7257 1 376 . 1 1 31 31 TRP HD1 H 1 7.370 0.010 . 1 . . . . 41 . . . 7257 1 377 . 1 1 31 31 TRP HE1 H 1 10.145 0.010 . 1 . . . . 41 . . . 7257 1 378 . 1 1 31 31 TRP HE3 H 1 7.070 0.010 . 1 . . . . 41 . . . 7257 1 379 . 1 1 31 31 TRP HZ2 H 1 7.480 0.010 . 1 . . . . 41 . . . 7257 1 380 . 1 1 31 31 TRP HZ3 H 1 6.870 0.010 . 1 . . . . 41 . . . 7257 1 381 . 1 1 31 31 TRP HH2 H 1 7.200 0.010 . 1 . . . . 41 . . . 7257 1 382 . 1 1 31 31 TRP C C 13 173.804 0.100 . 1 . . . . 41 . . . 7257 1 383 . 1 1 31 31 TRP CA C 13 57.541 0.100 . 1 . . . . 41 . . . 7257 1 384 . 1 1 31 31 TRP CB C 13 31.950 0.100 . 1 . . . . 41 . . . 7257 1 385 . 1 1 31 31 TRP CD1 C 13 130.010 0.100 . 1 . . . . 41 . . . 7257 1 386 . 1 1 31 31 TRP CE3 C 13 119.520 0.100 . 1 . . . . 41 . . . 7257 1 387 . 1 1 31 31 TRP CZ2 C 13 114.610 0.100 . 1 . . . . 41 . . . 7257 1 388 . 1 1 31 31 TRP CZ3 C 13 118.700 0.100 . 1 . . . . 41 . . . 7257 1 389 . 1 1 31 31 TRP CH2 C 13 120.130 0.100 . 1 . . . . 41 . . . 7257 1 390 . 1 1 31 31 TRP N N 15 129.172 0.100 . 1 . . . . 41 . . . 7257 1 391 . 1 1 31 31 TRP NE1 N 15 129.930 0.100 . 1 . . . . 41 . . . 7257 1 392 . 1 1 32 32 ILE H H 1 7.757 0.010 . 1 . . . . 42 . . . 7257 1 393 . 1 1 32 32 ILE HA H 1 3.801 0.010 . 1 . . . . 42 . . . 7257 1 394 . 1 1 32 32 ILE HB H 1 1.329 0.010 . 1 . . . . 42 . . . 7257 1 395 . 1 1 32 32 ILE HG12 H 1 1.220 0.010 . 1 . . . . 42 . . . 7257 1 396 . 1 1 32 32 ILE HG13 H 1 1.220 0.010 . 1 . . . . 42 . . . 7257 1 397 . 1 1 32 32 ILE HG21 H 1 0.671 0.010 . 1 . . . . 42 . . . 7257 1 398 . 1 1 32 32 ILE HG22 H 1 0.671 0.010 . 1 . . . . 42 . . . 7257 1 399 . 1 1 32 32 ILE HG23 H 1 0.671 0.010 . 1 . . . . 42 . . . 7257 1 400 . 1 1 32 32 ILE HD11 H 1 0.553 0.010 . 1 . . . . 42 . . . 7257 1 401 . 1 1 32 32 ILE HD12 H 1 0.553 0.010 . 1 . . . . 42 . . . 7257 1 402 . 1 1 32 32 ILE HD13 H 1 0.553 0.010 . 1 . . . . 42 . . . 7257 1 403 . 1 1 32 32 ILE C C 13 173.508 0.100 . 1 . . . . 42 . . . 7257 1 404 . 1 1 32 32 ILE CA C 13 59.767 0.100 . 1 . . . . 42 . . . 7257 1 405 . 1 1 32 32 ILE CB C 13 39.898 0.100 . 1 . . . . 42 . . . 7257 1 406 . 1 1 32 32 ILE CG1 C 13 27.930 0.100 . 1 . . . . 42 . . . 7257 1 407 . 1 1 32 32 ILE CG2 C 13 17.164 0.100 . 1 . . . . 42 . . . 7257 1 408 . 1 1 32 32 ILE CD1 C 13 13.272 0.100 . 1 . . . . 42 . . . 7257 1 409 . 1 1 32 32 ILE N N 15 125.919 0.100 . 1 . . . . 42 . . . 7257 1 410 . 1 1 33 33 ALA H H 1 7.491 0.010 . 1 . . . . 43 . . . 7257 1 411 . 1 1 33 33 ALA HA H 1 3.237 0.010 . 1 . . . . 43 . . . 7257 1 412 . 1 1 33 33 ALA HB1 H 1 0.846 0.010 . 1 . . . . 43 . . . 7257 1 413 . 1 1 33 33 ALA HB2 H 1 0.846 0.010 . 1 . . . . 43 . . . 7257 1 414 . 1 1 33 33 ALA HB3 H 1 0.846 0.010 . 1 . . . . 43 . . . 7257 1 415 . 1 1 33 33 ALA C C 13 177.545 0.100 . 1 . . . . 43 . . . 7257 1 416 . 1 1 33 33 ALA CA C 13 53.063 0.100 . 1 . . . . 43 . . . 7257 1 417 . 1 1 33 33 ALA CB C 13 19.786 0.100 . 1 . . . . 43 . . . 7257 1 418 . 1 1 33 33 ALA N N 15 129.206 0.100 . 1 . . . . 43 . . . 7257 1 419 . 1 1 34 34 ARG H H 1 8.176 0.010 . 1 . . . . 44 . . . 7257 1 420 . 1 1 34 34 ARG HA H 1 4.246 0.010 . 1 . . . . 44 . . . 7257 1 421 . 1 1 34 34 ARG HB2 H 1 1.750 0.010 . 2 . . . . 44 . . . 7257 1 422 . 1 1 34 34 ARG HB3 H 1 1.658 0.010 . 2 . . . . 44 . . . 7257 1 423 . 1 1 34 34 ARG HG2 H 1 1.384 0.010 . 1 . . . . 44 . . . 7257 1 424 . 1 1 34 34 ARG HG3 H 1 1.384 0.010 . 1 . . . . 44 . . . 7257 1 425 . 1 1 34 34 ARG HD2 H 1 3.176 0.010 . 1 . . . . 44 . . . 7257 1 426 . 1 1 34 34 ARG HD3 H 1 3.176 0.010 . 1 . . . . 44 . . . 7257 1 427 . 1 1 34 34 ARG HE H 1 7.259 0.010 . 1 . . . . 44 . . . 7257 1 428 . 1 1 34 34 ARG C C 13 175.370 0.100 . 1 . . . . 44 . . . 7257 1 429 . 1 1 34 34 ARG CA C 13 55.477 0.100 . 1 . . . . 44 . . . 7257 1 430 . 1 1 34 34 ARG CB C 13 32.728 0.100 . 1 . . . . 44 . . . 7257 1 431 . 1 1 34 34 ARG CG C 13 27.225 0.100 . 1 . . . . 44 . . . 7257 1 432 . 1 1 34 34 ARG CD C 13 43.288 0.100 . 1 . . . . 44 . . . 7257 1 433 . 1 1 34 34 ARG N N 15 118.323 0.100 . 1 . . . . 44 . . . 7257 1 434 . 1 1 34 34 ARG NE N 15 84.527 0.100 . 1 . . . . 44 . . . 7257 1 435 . 1 1 35 35 ASN H H 1 8.205 0.010 . 1 . . . . 45 . . . 7257 1 436 . 1 1 35 35 ASN HA H 1 4.870 0.010 . 1 . . . . 45 . . . 7257 1 437 . 1 1 35 35 ASN HB2 H 1 2.618 0.010 . 2 . . . . 45 . . . 7257 1 438 . 1 1 35 35 ASN HB3 H 1 2.859 0.010 . 2 . . . . 45 . . . 7257 1 439 . 1 1 35 35 ASN HD21 H 1 7.662 0.010 . 1 . . . . 45 . . . 7257 1 440 . 1 1 35 35 ASN HD22 H 1 6.931 0.010 . 1 . . . . 45 . . . 7257 1 441 . 1 1 35 35 ASN C C 13 171.983 0.100 . 1 . . . . 45 . . . 7257 1 442 . 1 1 35 35 ASN CA C 13 51.527 0.100 . 1 . . . . 45 . . . 7257 1 443 . 1 1 35 35 ASN CB C 13 39.988 0.100 . 1 . . . . 45 . . . 7257 1 444 . 1 1 35 35 ASN N N 15 116.362 0.100 . 1 . . . . 45 . . . 7257 1 445 . 1 1 35 35 ASN ND2 N 15 112.855 0.100 . 1 . . . . 45 . . . 7257 1 446 . 1 1 37 37 PRO HA H 1 4.380 0.010 . 1 . . . . 47 . . . 7257 1 447 . 1 1 37 37 PRO HB2 H 1 2.153 0.010 . 2 . . . . 47 . . . 7257 1 448 . 1 1 37 37 PRO HB3 H 1 1.915 0.010 . 2 . . . . 47 . . . 7257 1 449 . 1 1 37 37 PRO HG2 H 1 2.011 0.010 . 1 . . . . 47 . . . 7257 1 450 . 1 1 37 37 PRO HG3 H 1 2.011 0.010 . 1 . . . . 47 . . . 7257 1 451 . 1 1 37 37 PRO HD2 H 1 3.643 0.010 . 1 . . . . 47 . . . 7257 1 452 . 1 1 37 37 PRO HD3 H 1 3.643 0.010 . 1 . . . . 47 . . . 7257 1 453 . 1 1 37 37 PRO C C 13 177.260 0.100 . 1 . . . . 47 . . . 7257 1 454 . 1 1 37 37 PRO CA C 13 63.005 0.100 . 1 . . . . 47 . . . 7257 1 455 . 1 1 37 37 PRO CB C 13 32.096 0.100 . 1 . . . . 47 . . . 7257 1 456 . 1 1 37 37 PRO CG C 13 27.308 0.100 . 1 . . . . 47 . . . 7257 1 457 . 1 1 37 37 PRO CD C 13 50.415 0.100 . 1 . . . . 47 . . . 7257 1 458 . 1 1 38 38 GLY H H 1 8.945 0.010 . 1 . . . . 48 . . . 7257 1 459 . 1 1 38 38 GLY HA2 H 1 3.934 0.010 . 2 . . . . 48 . . . 7257 1 460 . 1 1 38 38 GLY HA3 H 1 4.543 0.010 . 2 . . . . 48 . . . 7257 1 461 . 1 1 38 38 GLY C C 13 173.017 0.100 . 1 . . . . 48 . . . 7257 1 462 . 1 1 38 38 GLY CA C 13 46.259 0.100 . 1 . . . . 48 . . . 7257 1 463 . 1 1 38 38 GLY N N 15 106.284 0.100 . 1 . . . . 48 . . . 7257 1 464 . 1 1 39 39 PHE H H 1 7.245 0.010 . 1 . . . . 49 . . . 7257 1 465 . 1 1 39 39 PHE HA H 1 5.567 0.010 . 1 . . . . 49 . . . 7257 1 466 . 1 1 39 39 PHE HB2 H 1 3.207 0.010 . 2 . . . . 49 . . . 7257 1 467 . 1 1 39 39 PHE HB3 H 1 3.014 0.010 . 2 . . . . 49 . . . 7257 1 468 . 1 1 39 39 PHE HD1 H 1 7.070 0.010 . 1 . . . . 49 . . . 7257 1 469 . 1 1 39 39 PHE HD2 H 1 7.070 0.010 . 1 . . . . 49 . . . 7257 1 470 . 1 1 39 39 PHE HE1 H 1 7.370 0.010 . 1 . . . . 49 . . . 7257 1 471 . 1 1 39 39 PHE HE2 H 1 7.370 0.010 . 1 . . . . 49 . . . 7257 1 472 . 1 1 39 39 PHE HZ H 1 7.230 0.010 . 1 . . . . 49 . . . 7257 1 473 . 1 1 39 39 PHE C C 13 172.855 0.100 . 1 . . . . 49 . . . 7257 1 474 . 1 1 39 39 PHE CA C 13 55.741 0.100 . 1 . . . . 49 . . . 7257 1 475 . 1 1 39 39 PHE CB C 13 41.487 0.100 . 1 . . . . 49 . . . 7257 1 476 . 1 1 39 39 PHE CD1 C 13 132.050 0.100 . 1 . . . . 49 . . . 7257 1 477 . 1 1 39 39 PHE CD2 C 13 132.050 0.100 . 1 . . . . 49 . . . 7257 1 478 . 1 1 39 39 PHE CE1 C 13 131.610 0.100 . 1 . . . . 49 . . . 7257 1 479 . 1 1 39 39 PHE CE2 C 13 131.610 0.100 . 1 . . . . 49 . . . 7257 1 480 . 1 1 39 39 PHE CZ C 13 131.700 0.100 . 1 . . . . 49 . . . 7257 1 481 . 1 1 39 39 PHE N N 15 117.153 0.100 . 1 . . . . 49 . . . 7257 1 482 . 1 1 40 40 ALA H H 1 8.967 0.010 . 1 . . . . 50 . . . 7257 1 483 . 1 1 40 40 ALA HA H 1 4.870 0.010 . 1 . . . . 50 . . . 7257 1 484 . 1 1 40 40 ALA HB1 H 1 1.129 0.010 . 1 . . . . 50 . . . 7257 1 485 . 1 1 40 40 ALA HB2 H 1 1.129 0.010 . 1 . . . . 50 . . . 7257 1 486 . 1 1 40 40 ALA HB3 H 1 1.129 0.010 . 1 . . . . 50 . . . 7257 1 487 . 1 1 40 40 ALA C C 13 175.115 0.100 . 1 . . . . 50 . . . 7257 1 488 . 1 1 40 40 ALA CA C 13 50.754 0.100 . 1 . . . . 50 . . . 7257 1 489 . 1 1 40 40 ALA CB C 13 24.374 0.100 . 1 . . . . 50 . . . 7257 1 490 . 1 1 40 40 ALA N N 15 122.620 0.100 . 1 . . . . 50 . . . 7257 1 491 . 1 1 41 41 PHE H H 1 9.258 0.010 . 1 . . . . 51 . . . 7257 1 492 . 1 1 41 41 PHE HA H 1 4.885 0.010 . 1 . . . . 51 . . . 7257 1 493 . 1 1 41 41 PHE HB2 H 1 2.895 0.010 . 2 . . . . 51 . . . 7257 1 494 . 1 1 41 41 PHE HB3 H 1 2.717 0.010 . 2 . . . . 51 . . . 7257 1 495 . 1 1 41 41 PHE HD1 H 1 7.160 0.010 . 1 . . . . 51 . . . 7257 1 496 . 1 1 41 41 PHE HD2 H 1 7.160 0.010 . 1 . . . . 51 . . . 7257 1 497 . 1 1 41 41 PHE HE1 H 1 6.800 0.010 . 1 . . . . 51 . . . 7257 1 498 . 1 1 41 41 PHE HE2 H 1 6.800 0.010 . 1 . . . . 51 . . . 7257 1 499 . 1 1 41 41 PHE HZ H 1 7.250 0.010 . 1 . . . . 51 . . . 7257 1 500 . 1 1 41 41 PHE C C 13 174.640 0.100 . 1 . . . . 51 . . . 7257 1 501 . 1 1 41 41 PHE CA C 13 56.857 0.100 . 1 . . . . 51 . . . 7257 1 502 . 1 1 41 41 PHE CB C 13 43.600 0.100 . 1 . . . . 51 . . . 7257 1 503 . 1 1 41 41 PHE CD1 C 13 131.330 0.100 . 1 . . . . 51 . . . 7257 1 504 . 1 1 41 41 PHE CD2 C 13 131.330 0.100 . 1 . . . . 51 . . . 7257 1 505 . 1 1 41 41 PHE CE1 C 13 133.020 0.100 . 1 . . . . 51 . . . 7257 1 506 . 1 1 41 41 PHE CE2 C 13 133.020 0.100 . 1 . . . . 51 . . . 7257 1 507 . 1 1 41 41 PHE CZ C 13 129.750 0.100 . 1 . . . . 51 . . . 7257 1 508 . 1 1 41 41 PHE N N 15 113.914 0.100 . 1 . . . . 51 . . . 7257 1 509 . 1 1 42 42 VAL H H 1 9.209 0.010 . 1 . . . . 52 . . . 7257 1 510 . 1 1 42 42 VAL HA H 1 4.439 0.010 . 1 . . . . 52 . . . 7257 1 511 . 1 1 42 42 VAL HB H 1 1.468 0.010 . 1 . . . . 52 . . . 7257 1 512 . 1 1 42 42 VAL HG11 H 1 0.383 0.010 . 1 . . . . 52 . . . 7257 1 513 . 1 1 42 42 VAL HG12 H 1 0.383 0.010 . 1 . . . . 52 . . . 7257 1 514 . 1 1 42 42 VAL HG13 H 1 0.383 0.010 . 1 . . . . 52 . . . 7257 1 515 . 1 1 42 42 VAL HG21 H 1 0.383 0.010 . 1 . . . . 52 . . . 7257 1 516 . 1 1 42 42 VAL HG22 H 1 0.383 0.010 . 1 . . . . 52 . . . 7257 1 517 . 1 1 42 42 VAL HG23 H 1 0.383 0.010 . 1 . . . . 52 . . . 7257 1 518 . 1 1 42 42 VAL C C 13 174.023 0.100 . 1 . . . . 52 . . . 7257 1 519 . 1 1 42 42 VAL CA C 13 60.676 0.100 . 1 . . . . 52 . . . 7257 1 520 . 1 1 42 42 VAL CB C 13 34.515 0.100 . 1 . . . . 52 . . . 7257 1 521 . 1 1 42 42 VAL CG1 C 13 22.597 0.100 . 1 . . . . 52 . . . 7257 1 522 . 1 1 42 42 VAL CG2 C 13 22.597 0.100 . 1 . . . . 52 . . . 7257 1 523 . 1 1 42 42 VAL N N 15 121.009 0.100 . 1 . . . . 52 . . . 7257 1 524 . 1 1 43 43 GLU H H 1 8.825 0.010 . 1 . . . . 53 . . . 7257 1 525 . 1 1 43 43 GLU HA H 1 5.063 0.010 . 1 . . . . 53 . . . 7257 1 526 . 1 1 43 43 GLU HB2 H 1 2.074 0.010 . 1 . . . . 53 . . . 7257 1 527 . 1 1 43 43 GLU HB3 H 1 2.074 0.010 . 1 . . . . 53 . . . 7257 1 528 . 1 1 43 43 GLU HG2 H 1 2.203 0.010 . 1 . . . . 53 . . . 7257 1 529 . 1 1 43 43 GLU HG3 H 1 2.203 0.010 . 1 . . . . 53 . . . 7257 1 530 . 1 1 43 43 GLU C C 13 175.442 0.100 . 1 . . . . 53 . . . 7257 1 531 . 1 1 43 43 GLU CA C 13 54.599 0.100 . 1 . . . . 53 . . . 7257 1 532 . 1 1 43 43 GLU CB C 13 32.412 0.100 . 1 . . . . 53 . . . 7257 1 533 . 1 1 43 43 GLU CG C 13 35.975 0.100 . 1 . . . . 53 . . . 7257 1 534 . 1 1 43 43 GLU N N 15 126.692 0.100 . 1 . . . . 53 . . . 7257 1 535 . 1 1 44 44 PHE H H 1 9.051 0.010 . 1 . . . . 54 . . . 7257 1 536 . 1 1 44 44 PHE HA H 1 4.558 0.010 . 1 . . . . 54 . . . 7257 1 537 . 1 1 44 44 PHE HB2 H 1 2.659 0.010 . 1 . . . . 54 . . . 7257 1 538 . 1 1 44 44 PHE HB3 H 1 2.659 0.010 . 1 . . . . 54 . . . 7257 1 539 . 1 1 44 44 PHE HD1 H 1 7.800 0.010 . 1 . . . . 54 . . . 7257 1 540 . 1 1 44 44 PHE HD2 H 1 7.800 0.010 . 1 . . . . 54 . . . 7257 1 541 . 1 1 44 44 PHE HE1 H 1 7.200 0.010 . 1 . . . . 54 . . . 7257 1 542 . 1 1 44 44 PHE HE2 H 1 7.200 0.010 . 1 . . . . 54 . . . 7257 1 543 . 1 1 44 44 PHE HZ H 1 6.700 0.010 . 1 . . . . 54 . . . 7257 1 544 . 1 1 44 44 PHE C C 13 176.474 0.100 . 1 . . . . 54 . . . 7257 1 545 . 1 1 44 44 PHE CA C 13 58.558 0.100 . 1 . . . . 54 . . . 7257 1 546 . 1 1 44 44 PHE CB C 13 41.426 0.100 . 1 . . . . 54 . . . 7257 1 547 . 1 1 44 44 PHE CD1 C 13 130.520 0.100 . 1 . . . . 54 . . . 7257 1 548 . 1 1 44 44 PHE CD2 C 13 130.520 0.100 . 1 . . . . 54 . . . 7257 1 549 . 1 1 44 44 PHE CE1 C 13 130.140 0.100 . 1 . . . . 54 . . . 7257 1 550 . 1 1 44 44 PHE CE2 C 13 130.140 0.100 . 1 . . . . 54 . . . 7257 1 551 . 1 1 44 44 PHE CZ C 13 127.780 0.100 . 1 . . . . 54 . . . 7257 1 552 . 1 1 44 44 PHE N N 15 127.206 0.100 . 1 . . . . 54 . . . 7257 1 553 . 1 1 45 45 GLU H H 1 8.115 0.010 . 1 . . . . 55 . . . 7257 1 554 . 1 1 45 45 GLU HA H 1 4.068 0.010 . 1 . . . . 55 . . . 7257 1 555 . 1 1 45 45 GLU HB2 H 1 2.151 0.010 . 1 . . . . 55 . . . 7257 1 556 . 1 1 45 45 GLU HB3 H 1 2.151 0.010 . 1 . . . . 55 . . . 7257 1 557 . 1 1 45 45 GLU HG2 H 1 2.446 0.010 . 1 . . . . 55 . . . 7257 1 558 . 1 1 45 45 GLU HG3 H 1 2.446 0.010 . 1 . . . . 55 . . . 7257 1 559 . 1 1 45 45 GLU C C 13 176.493 0.100 . 1 . . . . 55 . . . 7257 1 560 . 1 1 45 45 GLU CA C 13 59.403 0.100 . 1 . . . . 55 . . . 7257 1 561 . 1 1 45 45 GLU CB C 13 29.867 0.100 . 1 . . . . 55 . . . 7257 1 562 . 1 1 45 45 GLU CG C 13 37.154 0.100 . 1 . . . . 55 . . . 7257 1 563 . 1 1 45 45 GLU N N 15 120.806 0.100 . 1 . . . . 55 . . . 7257 1 564 . 1 1 46 46 ASP H H 1 9.609 0.010 . 1 . . . . 56 . . . 7257 1 565 . 1 1 46 46 ASP HA H 1 5.299 0.010 . 1 . . . . 56 . . . 7257 1 566 . 1 1 46 46 ASP HB2 H 1 2.552 0.010 . 1 . . . . 56 . . . 7257 1 567 . 1 1 46 46 ASP HB3 H 1 2.552 0.010 . 1 . . . . 56 . . . 7257 1 568 . 1 1 46 46 ASP C C 13 175.377 0.100 . 1 . . . . 56 . . . 7257 1 569 . 1 1 46 46 ASP CA C 13 50.363 0.100 . 1 . . . . 56 . . . 7257 1 570 . 1 1 46 46 ASP CB C 13 44.234 0.100 . 1 . . . . 56 . . . 7257 1 571 . 1 1 46 46 ASP N N 15 121.308 0.100 . 1 . . . . 56 . . . 7257 1 572 . 1 1 47 47 PRO HA H 1 4.115 0.010 . 1 . . . . 57 . . . 7257 1 573 . 1 1 47 47 PRO HB2 H 1 2.353 0.010 . 2 . . . . 57 . . . 7257 1 574 . 1 1 47 47 PRO HB3 H 1 2.082 0.010 . 2 . . . . 57 . . . 7257 1 575 . 1 1 47 47 PRO HG2 H 1 1.668 0.010 . 1 . . . . 57 . . . 7257 1 576 . 1 1 47 47 PRO HG3 H 1 1.668 0.010 . 1 . . . . 57 . . . 7257 1 577 . 1 1 47 47 PRO HD2 H 1 3.217 0.010 . 1 . . . . 57 . . . 7257 1 578 . 1 1 47 47 PRO HD3 H 1 3.217 0.010 . 1 . . . . 57 . . . 7257 1 579 . 1 1 47 47 PRO C C 13 178.365 0.100 . 1 . . . . 57 . . . 7257 1 580 . 1 1 47 47 PRO CA C 13 58.860 0.100 . 1 . . . . 57 . . . 7257 1 581 . 1 1 47 47 PRO CB C 13 32.570 0.100 . 1 . . . . 57 . . . 7257 1 582 . 1 1 47 47 PRO CG C 13 27.017 0.100 . 1 . . . . 57 . . . 7257 1 583 . 1 1 47 47 PRO CD C 13 43.347 0.100 . 1 . . . . 57 . . . 7257 1 584 . 1 1 48 48 ARG H H 1 8.656 0.010 . 1 . . . . 58 . . . 7257 1 585 . 1 1 48 48 ARG HA H 1 4.048 0.010 . 1 . . . . 58 . . . 7257 1 586 . 1 1 48 48 ARG HB2 H 1 1.811 0.010 . 1 . . . . 58 . . . 7257 1 587 . 1 1 48 48 ARG HB3 H 1 1.811 0.010 . 1 . . . . 58 . . . 7257 1 588 . 1 1 48 48 ARG HG2 H 1 1.680 0.010 . 1 . . . . 58 . . . 7257 1 589 . 1 1 48 48 ARG HG3 H 1 1.680 0.010 . 1 . . . . 58 . . . 7257 1 590 . 1 1 48 48 ARG HD2 H 1 3.250 0.010 . 1 . . . . 58 . . . 7257 1 591 . 1 1 48 48 ARG HD3 H 1 3.250 0.010 . 1 . . . . 58 . . . 7257 1 592 . 1 1 48 48 ARG HE H 1 7.688 0.010 . 1 . . . . 58 . . . 7257 1 593 . 1 1 48 48 ARG C C 13 178.972 0.100 . 1 . . . . 58 . . . 7257 1 594 . 1 1 48 48 ARG CA C 13 58.916 0.100 . 1 . . . . 58 . . . 7257 1 595 . 1 1 48 48 ARG CB C 13 29.413 0.100 . 1 . . . . 58 . . . 7257 1 596 . 1 1 48 48 ARG CG C 13 27.347 0.100 . 1 . . . . 58 . . . 7257 1 597 . 1 1 48 48 ARG CD C 13 43.165 0.100 . 1 . . . . 58 . . . 7257 1 598 . 1 1 48 48 ARG N N 15 119.317 0.100 . 1 . . . . 58 . . . 7257 1 599 . 1 1 48 48 ARG NE N 15 84.740 0.100 . 1 . . . . 58 . . . 7257 1 600 . 1 1 49 49 ASP H H 1 7.248 0.010 . 1 . . . . 59 . . . 7257 1 601 . 1 1 49 49 ASP HA H 1 4.160 0.010 . 1 . . . . 59 . . . 7257 1 602 . 1 1 49 49 ASP HB2 H 1 2.941 0.010 . 2 . . . . 59 . . . 7257 1 603 . 1 1 49 49 ASP HB3 H 1 2.534 0.010 . 2 . . . . 59 . . . 7257 1 604 . 1 1 49 49 ASP C C 13 176.968 0.100 . 1 . . . . 59 . . . 7257 1 605 . 1 1 49 49 ASP CA C 13 56.954 0.100 . 1 . . . . 59 . . . 7257 1 606 . 1 1 49 49 ASP CB C 13 40.431 0.100 . 1 . . . . 59 . . . 7257 1 607 . 1 1 49 49 ASP N N 15 121.048 0.100 . 1 . . . . 59 . . . 7257 1 608 . 1 1 50 50 ALA H H 1 6.645 0.010 . 1 . . . . 60 . . . 7257 1 609 . 1 1 50 50 ALA HA H 1 2.760 0.010 . 1 . . . . 60 . . . 7257 1 610 . 1 1 50 50 ALA HB1 H 1 1.201 0.010 . 1 . . . . 60 . . . 7257 1 611 . 1 1 50 50 ALA HB2 H 1 1.201 0.010 . 1 . . . . 60 . . . 7257 1 612 . 1 1 50 50 ALA HB3 H 1 1.201 0.010 . 1 . . . . 60 . . . 7257 1 613 . 1 1 50 50 ALA C C 13 178.439 0.100 . 1 . . . . 60 . . . 7257 1 614 . 1 1 50 50 ALA CA C 13 54.280 0.100 . 1 . . . . 60 . . . 7257 1 615 . 1 1 50 50 ALA CB C 13 18.459 0.100 . 1 . . . . 60 . . . 7257 1 616 . 1 1 50 50 ALA N N 15 119.455 0.100 . 1 . . . . 60 . . . 7257 1 617 . 1 1 51 51 GLU H H 1 7.488 0.010 . 1 . . . . 61 . . . 7257 1 618 . 1 1 51 51 GLU HA H 1 3.709 0.010 . 1 . . . . 61 . . . 7257 1 619 . 1 1 51 51 GLU HB2 H 1 2.270 0.010 . 1 . . . . 61 . . . 7257 1 620 . 1 1 51 51 GLU HB3 H 1 2.270 0.010 . 1 . . . . 61 . . . 7257 1 621 . 1 1 51 51 GLU HG2 H 1 2.470 0.010 . 1 . . . . 61 . . . 7257 1 622 . 1 1 51 51 GLU HG3 H 1 2.470 0.010 . 1 . . . . 61 . . . 7257 1 623 . 1 1 51 51 GLU C C 13 179.293 0.100 . 1 . . . . 61 . . . 7257 1 624 . 1 1 51 51 GLU CA C 13 59.793 0.100 . 1 . . . . 61 . . . 7257 1 625 . 1 1 51 51 GLU CB C 13 29.413 0.100 . 1 . . . . 61 . . . 7257 1 626 . 1 1 51 51 GLU CG C 13 36.514 0.100 . 1 . . . . 61 . . . 7257 1 627 . 1 1 51 51 GLU N N 15 115.866 0.100 . 1 . . . . 61 . . . 7257 1 628 . 1 1 52 52 ASP H H 1 7.760 0.010 . 1 . . . . 62 . . . 7257 1 629 . 1 1 52 52 ASP HA H 1 4.296 0.010 . 1 . . . . 62 . . . 7257 1 630 . 1 1 52 52 ASP HB2 H 1 3.008 0.010 . 2 . . . . 62 . . . 7257 1 631 . 1 1 52 52 ASP HB3 H 1 2.760 0.010 . 2 . . . . 62 . . . 7257 1 632 . 1 1 52 52 ASP C C 13 178.280 0.100 . 1 . . . . 62 . . . 7257 1 633 . 1 1 52 52 ASP CA C 13 57.139 0.100 . 1 . . . . 62 . . . 7257 1 634 . 1 1 52 52 ASP CB C 13 40.190 0.100 . 1 . . . . 62 . . . 7257 1 635 . 1 1 52 52 ASP N N 15 119.935 0.100 . 1 . . . . 62 . . . 7257 1 636 . 1 1 53 53 ALA H H 1 7.847 0.010 . 1 . . . . 63 . . . 7257 1 637 . 1 1 53 53 ALA HA H 1 2.286 0.010 . 1 . . . . 63 . . . 7257 1 638 . 1 1 53 53 ALA HB1 H 1 1.292 0.010 . 1 . . . . 63 . . . 7257 1 639 . 1 1 53 53 ALA HB2 H 1 1.292 0.010 . 1 . . . . 63 . . . 7257 1 640 . 1 1 53 53 ALA HB3 H 1 1.292 0.010 . 1 . . . . 63 . . . 7257 1 641 . 1 1 53 53 ALA C C 13 178.810 0.100 . 1 . . . . 63 . . . 7257 1 642 . 1 1 53 53 ALA CA C 13 54.280 0.100 . 1 . . . . 63 . . . 7257 1 643 . 1 1 53 53 ALA CB C 13 19.666 0.100 . 1 . . . . 63 . . . 7257 1 644 . 1 1 53 53 ALA N N 15 124.442 0.100 . 1 . . . . 63 . . . 7257 1 645 . 1 1 54 54 VAL H H 1 7.798 0.010 . 1 . . . . 64 . . . 7257 1 646 . 1 1 54 54 VAL HA H 1 3.392 0.010 . 1 . . . . 64 . . . 7257 1 647 . 1 1 54 54 VAL HB H 1 2.148 0.010 . 1 . . . . 64 . . . 7257 1 648 . 1 1 54 54 VAL HG11 H 1 1.027 0.010 . 1 . . . . 64 . . . 7257 1 649 . 1 1 54 54 VAL HG12 H 1 1.027 0.010 . 1 . . . . 64 . . . 7257 1 650 . 1 1 54 54 VAL HG13 H 1 1.027 0.010 . 1 . . . . 64 . . . 7257 1 651 . 1 1 54 54 VAL HG21 H 1 1.027 0.010 . 1 . . . . 64 . . . 7257 1 652 . 1 1 54 54 VAL HG22 H 1 1.027 0.010 . 1 . . . . 64 . . . 7257 1 653 . 1 1 54 54 VAL HG23 H 1 1.027 0.010 . 1 . . . . 64 . . . 7257 1 654 . 1 1 54 54 VAL C C 13 178.068 0.100 . 1 . . . . 64 . . . 7257 1 655 . 1 1 54 54 VAL CA C 13 66.788 0.100 . 1 . . . . 64 . . . 7257 1 656 . 1 1 54 54 VAL CB C 13 31.461 0.100 . 1 . . . . 64 . . . 7257 1 657 . 1 1 54 54 VAL CG1 C 13 21.235 0.100 . 1 . . . . 64 . . . 7257 1 658 . 1 1 54 54 VAL CG2 C 13 23.653 0.100 . 1 . . . . 64 . . . 7257 1 659 . 1 1 54 54 VAL N N 15 117.753 0.100 . 1 . . . . 64 . . . 7257 1 660 . 1 1 55 55 ARG H H 1 7.364 0.010 . 1 . . . . 65 . . . 7257 1 661 . 1 1 55 55 ARG HA H 1 4.048 0.010 . 1 . . . . 65 . . . 7257 1 662 . 1 1 55 55 ARG HB2 H 1 1.856 0.010 . 1 . . . . 65 . . . 7257 1 663 . 1 1 55 55 ARG HB3 H 1 1.856 0.010 . 1 . . . . 65 . . . 7257 1 664 . 1 1 55 55 ARG HG2 H 1 1.651 0.010 . 1 . . . . 65 . . . 7257 1 665 . 1 1 55 55 ARG HG3 H 1 1.651 0.010 . 1 . . . . 65 . . . 7257 1 666 . 1 1 55 55 ARG HD2 H 1 3.250 0.010 . 1 . . . . 65 . . . 7257 1 667 . 1 1 55 55 ARG HD3 H 1 3.250 0.010 . 1 . . . . 65 . . . 7257 1 668 . 1 1 55 55 ARG HE H 1 7.413 0.010 . 1 . . . . 65 . . . 7257 1 669 . 1 1 55 55 ARG C C 13 179.606 0.100 . 1 . . . . 65 . . . 7257 1 670 . 1 1 55 55 ARG CA C 13 58.834 0.100 . 1 . . . . 65 . . . 7257 1 671 . 1 1 55 55 ARG CB C 13 30.518 0.100 . 1 . . . . 65 . . . 7257 1 672 . 1 1 55 55 ARG CG C 13 28.066 0.100 . 1 . . . . 65 . . . 7257 1 673 . 1 1 55 55 ARG CD C 13 43.165 0.100 . 1 . . . . 65 . . . 7257 1 674 . 1 1 55 55 ARG N N 15 116.315 0.100 . 1 . . . . 65 . . . 7257 1 675 . 1 1 55 55 ARG NE N 15 84.076 0.100 . 1 . . . . 65 . . . 7257 1 676 . 1 1 56 56 GLY H H 1 8.152 0.010 . 1 . . . . 66 . . . 7257 1 677 . 1 1 56 56 GLY HA2 H 1 3.776 0.010 . 2 . . . . 66 . . . 7257 1 678 . 1 1 56 56 GLY HA3 H 1 4.025 0.010 . 2 . . . . 66 . . . 7257 1 679 . 1 1 56 56 GLY C C 13 175.442 0.100 . 1 . . . . 66 . . . 7257 1 680 . 1 1 56 56 GLY CA C 13 46.259 0.100 . 1 . . . . 66 . . . 7257 1 681 . 1 1 56 56 GLY N N 15 105.400 0.100 . 1 . . . . 66 . . . 7257 1 682 . 1 1 57 57 LEU H H 1 8.069 0.010 . 1 . . . . 67 . . . 7257 1 683 . 1 1 57 57 LEU HA H 1 4.499 0.010 . 1 . . . . 67 . . . 7257 1 684 . 1 1 57 57 LEU HB2 H 1 1.608 0.010 . 1 . . . . 67 . . . 7257 1 685 . 1 1 57 57 LEU HB3 H 1 1.608 0.010 . 1 . . . . 67 . . . 7257 1 686 . 1 1 57 57 LEU HG H 1 1.396 0.010 . 1 . . . . 67 . . . 7257 1 687 . 1 1 57 57 LEU HD11 H 1 -0.070 0.010 . 2 . . . . 67 . . . 7257 1 688 . 1 1 57 57 LEU HD12 H 1 -0.070 0.010 . 2 . . . . 67 . . . 7257 1 689 . 1 1 57 57 LEU HD13 H 1 -0.070 0.010 . 2 . . . . 67 . . . 7257 1 690 . 1 1 57 57 LEU HD21 H 1 0.751 0.010 . 2 . . . . 67 . . . 7257 1 691 . 1 1 57 57 LEU HD22 H 1 0.751 0.010 . 2 . . . . 67 . . . 7257 1 692 . 1 1 57 57 LEU HD23 H 1 0.751 0.010 . 2 . . . . 67 . . . 7257 1 693 . 1 1 57 57 LEU C C 13 177.013 0.100 . 1 . . . . 67 . . . 7257 1 694 . 1 1 57 57 LEU CA C 13 55.136 0.100 . 1 . . . . 67 . . . 7257 1 695 . 1 1 57 57 LEU CB C 13 44.169 0.100 . 1 . . . . 67 . . . 7257 1 696 . 1 1 57 57 LEU CG C 13 27.173 0.100 . 1 . . . . 67 . . . 7257 1 697 . 1 1 57 57 LEU CD1 C 13 24.662 0.100 . 1 . . . . 67 . . . 7257 1 698 . 1 1 57 57 LEU CD2 C 13 22.930 0.100 . 1 . . . . 67 . . . 7257 1 699 . 1 1 57 57 LEU N N 15 117.261 0.100 . 1 . . . . 67 . . . 7257 1 700 . 1 1 58 58 ASP H H 1 7.630 0.010 . 1 . . . . 68 . . . 7257 1 701 . 1 1 58 58 ASP HA H 1 4.319 0.010 . 1 . . . . 68 . . . 7257 1 702 . 1 1 58 58 ASP HB2 H 1 3.234 0.010 . 2 . . . . 68 . . . 7257 1 703 . 1 1 58 58 ASP HB3 H 1 2.624 0.010 . 2 . . . . 68 . . . 7257 1 704 . 1 1 58 58 ASP C C 13 178.280 0.100 . 1 . . . . 68 . . . 7257 1 705 . 1 1 58 58 ASP CA C 13 58.219 0.100 . 1 . . . . 68 . . . 7257 1 706 . 1 1 58 58 ASP CB C 13 41.605 0.100 . 1 . . . . 68 . . . 7257 1 707 . 1 1 58 58 ASP N N 15 117.146 0.100 . 1 . . . . 68 . . . 7257 1 708 . 1 1 59 59 GLY H H 1 8.697 0.010 . 1 . . . . 69 . . . 7257 1 709 . 1 1 59 59 GLY HA2 H 1 3.731 0.010 . 2 . . . . 69 . . . 7257 1 710 . 1 1 59 59 GLY HA3 H 1 4.183 0.010 . 2 . . . . 69 . . . 7257 1 711 . 1 1 59 59 GLY C C 13 174.036 0.100 . 1 . . . . 69 . . . 7257 1 712 . 1 1 59 59 GLY CA C 13 46.167 0.100 . 1 . . . . 69 . . . 7257 1 713 . 1 1 59 59 GLY N N 15 115.277 0.100 . 1 . . . . 69 . . . 7257 1 714 . 1 1 60 60 LYS H H 1 7.924 0.010 . 1 . . . . 70 . . . 7257 1 715 . 1 1 60 60 LYS HA H 1 4.469 0.010 . 1 . . . . 70 . . . 7257 1 716 . 1 1 60 60 LYS HB2 H 1 1.680 0.010 . 1 . . . . 70 . . . 7257 1 717 . 1 1 60 60 LYS HB3 H 1 1.680 0.010 . 1 . . . . 70 . . . 7257 1 718 . 1 1 60 60 LYS HG2 H 1 1.283 0.010 . 1 . . . . 70 . . . 7257 1 719 . 1 1 60 60 LYS HG3 H 1 1.283 0.010 . 1 . . . . 70 . . . 7257 1 720 . 1 1 60 60 LYS HD2 H 1 1.643 0.010 . 1 . . . . 70 . . . 7257 1 721 . 1 1 60 60 LYS HD3 H 1 1.643 0.010 . 1 . . . . 70 . . . 7257 1 722 . 1 1 60 60 LYS HE2 H 1 3.143 0.010 . 1 . . . . 70 . . . 7257 1 723 . 1 1 60 60 LYS HE3 H 1 3.143 0.010 . 1 . . . . 70 . . . 7257 1 724 . 1 1 60 60 LYS C C 13 174.779 0.100 . 1 . . . . 70 . . . 7257 1 725 . 1 1 60 60 LYS CA C 13 54.004 0.100 . 1 . . . . 70 . . . 7257 1 726 . 1 1 60 60 LYS CB C 13 32.169 0.100 . 1 . . . . 70 . . . 7257 1 727 . 1 1 60 60 LYS CG C 13 25.861 0.100 . 1 . . . . 70 . . . 7257 1 728 . 1 1 60 60 LYS CD C 13 32.257 0.100 . 1 . . . . 70 . . . 7257 1 729 . 1 1 60 60 LYS CE C 13 43.220 0.100 . 1 . . . . 70 . . . 7257 1 730 . 1 1 60 60 LYS N N 15 120.570 0.100 . 1 . . . . 70 . . . 7257 1 731 . 1 1 61 61 VAL H H 1 8.128 0.010 . 1 . . . . 71 . . . 7257 1 732 . 1 1 61 61 VAL HA H 1 4.522 0.010 . 1 . . . . 71 . . . 7257 1 733 . 1 1 61 61 VAL HB H 1 1.909 0.010 . 1 . . . . 71 . . . 7257 1 734 . 1 1 61 61 VAL HG11 H 1 0.680 0.010 . 2 . . . . 71 . . . 7257 1 735 . 1 1 61 61 VAL HG12 H 1 0.680 0.010 . 2 . . . . 71 . . . 7257 1 736 . 1 1 61 61 VAL HG13 H 1 0.680 0.010 . 2 . . . . 71 . . . 7257 1 737 . 1 1 61 61 VAL HG21 H 1 0.843 0.010 . 2 . . . . 71 . . . 7257 1 738 . 1 1 61 61 VAL HG22 H 1 0.843 0.010 . 2 . . . . 71 . . . 7257 1 739 . 1 1 61 61 VAL HG23 H 1 0.843 0.010 . 2 . . . . 71 . . . 7257 1 740 . 1 1 61 61 VAL C C 13 176.742 0.100 . 1 . . . . 71 . . . 7257 1 741 . 1 1 61 61 VAL CA C 13 62.159 0.100 . 1 . . . . 71 . . . 7257 1 742 . 1 1 61 61 VAL CB C 13 31.225 0.100 . 1 . . . . 71 . . . 7257 1 743 . 1 1 61 61 VAL CG1 C 13 19.900 0.100 . 1 . . . . 71 . . . 7257 1 744 . 1 1 61 61 VAL CG2 C 13 21.595 0.100 . 1 . . . . 71 . . . 7257 1 745 . 1 1 61 61 VAL N N 15 119.008 0.100 . 1 . . . . 71 . . . 7257 1 746 . 1 1 62 62 ILE H H 1 8.789 0.010 . 1 . . . . 72 . . . 7257 1 747 . 1 1 62 62 ILE HA H 1 4.296 0.010 . 1 . . . . 72 . . . 7257 1 748 . 1 1 62 62 ILE HB H 1 1.670 0.010 . 1 . . . . 72 . . . 7257 1 749 . 1 1 62 62 ILE HG12 H 1 0.916 0.010 . 2 . . . . 72 . . . 7257 1 750 . 1 1 62 62 ILE HG13 H 1 1.082 0.010 . 2 . . . . 72 . . . 7257 1 751 . 1 1 62 62 ILE HG21 H 1 0.930 0.010 . 1 . . . . 72 . . . 7257 1 752 . 1 1 62 62 ILE HG22 H 1 0.930 0.010 . 1 . . . . 72 . . . 7257 1 753 . 1 1 62 62 ILE HG23 H 1 0.930 0.010 . 1 . . . . 72 . . . 7257 1 754 . 1 1 62 62 ILE HD11 H 1 0.847 0.010 . 1 . . . . 72 . . . 7257 1 755 . 1 1 62 62 ILE HD12 H 1 0.847 0.010 . 1 . . . . 72 . . . 7257 1 756 . 1 1 62 62 ILE HD13 H 1 0.847 0.010 . 1 . . . . 72 . . . 7257 1 757 . 1 1 62 62 ILE C C 13 175.203 0.100 . 1 . . . . 72 . . . 7257 1 758 . 1 1 62 62 ILE CA C 13 60.532 0.100 . 1 . . . . 72 . . . 7257 1 759 . 1 1 62 62 ILE CB C 13 41.133 0.100 . 1 . . . . 72 . . . 7257 1 760 . 1 1 62 62 ILE CG1 C 13 24.830 0.100 . 1 . . . . 72 . . . 7257 1 761 . 1 1 62 62 ILE CG2 C 13 17.280 0.100 . 1 . . . . 72 . . . 7257 1 762 . 1 1 62 62 ILE CD1 C 13 13.865 0.100 . 1 . . . . 72 . . . 7257 1 763 . 1 1 62 62 ILE N N 15 127.846 0.100 . 1 . . . . 72 . . . 7257 1 764 . 1 1 63 63 CYS H H 1 9.473 0.010 . 1 . . . . 73 . . . 7257 1 765 . 1 1 63 63 CYS HA H 1 3.912 0.010 . 1 . . . . 73 . . . 7257 1 766 . 1 1 63 63 CYS HB2 H 1 3.144 0.010 . 2 . . . . 73 . . . 7257 1 767 . 1 1 63 63 CYS HB3 H 1 2.828 0.010 . 2 . . . . 73 . . . 7257 1 768 . 1 1 63 63 CYS C C 13 175.890 0.100 . 1 . . . . 73 . . . 7257 1 769 . 1 1 63 63 CYS CA C 13 60.321 0.100 . 1 . . . . 73 . . . 7257 1 770 . 1 1 63 63 CYS CB C 13 25.675 0.100 . 1 . . . . 73 . . . 7257 1 771 . 1 1 63 63 CYS N N 15 122.140 0.100 . 1 . . . . 73 . . . 7257 1 772 . 1 1 64 64 GLY H H 1 8.392 0.010 . 1 . . . . 74 . . . 7257 1 773 . 1 1 64 64 GLY HA2 H 1 3.505 0.010 . 2 . . . . 74 . . . 7257 1 774 . 1 1 64 64 GLY HA3 H 1 4.093 0.010 . 2 . . . . 74 . . . 7257 1 775 . 1 1 64 64 GLY C C 13 173.894 0.100 . 1 . . . . 74 . . . 7257 1 776 . 1 1 64 64 GLY CA C 13 45.707 0.100 . 1 . . . . 74 . . . 7257 1 777 . 1 1 64 64 GLY N N 15 103.452 0.100 . 1 . . . . 74 . . . 7257 1 778 . 1 1 65 65 SER H H 1 7.695 0.010 . 1 . . . . 75 . . . 7257 1 779 . 1 1 65 65 SER HA H 1 4.725 0.010 . 1 . . . . 75 . . . 7257 1 780 . 1 1 65 65 SER HB2 H 1 3.889 0.010 . 2 . . . . 75 . . . 7257 1 781 . 1 1 65 65 SER HB3 H 1 3.641 0.010 . 2 . . . . 75 . . . 7257 1 782 . 1 1 65 65 SER C C 13 171.607 0.100 . 1 . . . . 75 . . . 7257 1 783 . 1 1 65 65 SER CA C 13 57.007 0.100 . 1 . . . . 75 . . . 7257 1 784 . 1 1 65 65 SER CB C 13 65.806 0.100 . 1 . . . . 75 . . . 7257 1 785 . 1 1 65 65 SER N N 15 116.129 0.100 . 1 . . . . 75 . . . 7257 1 786 . 1 1 66 66 ARG H H 1 8.684 0.010 . 1 . . . . 76 . . . 7257 1 787 . 1 1 66 66 ARG HA H 1 4.499 0.010 . 1 . . . . 76 . . . 7257 1 788 . 1 1 66 66 ARG HB2 H 1 1.743 0.010 . 1 . . . . 76 . . . 7257 1 789 . 1 1 66 66 ARG HB3 H 1 1.743 0.010 . 1 . . . . 76 . . . 7257 1 790 . 1 1 66 66 ARG HG2 H 1 1.486 0.010 . 1 . . . . 76 . . . 7257 1 791 . 1 1 66 66 ARG HG3 H 1 1.486 0.010 . 1 . . . . 76 . . . 7257 1 792 . 1 1 66 66 ARG HD2 H 1 3.177 0.010 . 1 . . . . 76 . . . 7257 1 793 . 1 1 66 66 ARG HD3 H 1 3.177 0.010 . 1 . . . . 76 . . . 7257 1 794 . 1 1 66 66 ARG HE H 1 7.812 0.010 . 1 . . . . 76 . . . 7257 1 795 . 1 1 66 66 ARG C C 13 176.398 0.100 . 1 . . . . 76 . . . 7257 1 796 . 1 1 66 66 ARG CA C 13 55.975 0.100 . 1 . . . . 76 . . . 7257 1 797 . 1 1 66 66 ARG CB C 13 29.233 0.100 . 1 . . . . 76 . . . 7257 1 798 . 1 1 66 66 ARG CG C 13 27.167 0.100 . 1 . . . . 76 . . . 7257 1 799 . 1 1 66 66 ARG CD C 13 43.345 0.100 . 1 . . . . 76 . . . 7257 1 800 . 1 1 66 66 ARG N N 15 125.417 0.100 . 1 . . . . 76 . . . 7257 1 801 . 1 1 66 66 ARG NE N 15 84.574 0.100 . 1 . . . . 76 . . . 7257 1 802 . 1 1 67 67 VAL H H 1 8.491 0.010 . 1 . . . . 77 . . . 7257 1 803 . 1 1 67 67 VAL HA H 1 4.725 0.010 . 1 . . . . 77 . . . 7257 1 804 . 1 1 67 67 VAL HB H 1 1.909 0.010 . 1 . . . . 77 . . . 7257 1 805 . 1 1 67 67 VAL HG11 H 1 0.930 0.010 . 2 . . . . 77 . . . 7257 1 806 . 1 1 67 67 VAL HG12 H 1 0.930 0.010 . 2 . . . . 77 . . . 7257 1 807 . 1 1 67 67 VAL HG13 H 1 0.930 0.010 . 2 . . . . 77 . . . 7257 1 808 . 1 1 67 67 VAL HG21 H 1 0.760 0.010 . 2 . . . . 77 . . . 7257 1 809 . 1 1 67 67 VAL HG22 H 1 0.760 0.010 . 2 . . . . 77 . . . 7257 1 810 . 1 1 67 67 VAL HG23 H 1 0.760 0.010 . 2 . . . . 77 . . . 7257 1 811 . 1 1 67 67 VAL C C 13 175.923 0.100 . 1 . . . . 77 . . . 7257 1 812 . 1 1 67 67 VAL CA C 13 61.263 0.100 . 1 . . . . 77 . . . 7257 1 813 . 1 1 67 67 VAL CB C 13 33.459 0.100 . 1 . . . . 77 . . . 7257 1 814 . 1 1 67 67 VAL CG1 C 13 20.500 0.100 . 1 . . . . 77 . . . 7257 1 815 . 1 1 67 67 VAL CG2 C 13 21.720 0.100 . 1 . . . . 77 . . . 7257 1 816 . 1 1 67 67 VAL N N 15 122.600 0.100 . 1 . . . . 77 . . . 7257 1 817 . 1 1 68 68 ARG H H 1 7.785 0.010 . 1 . . . . 78 . . . 7257 1 818 . 1 1 68 68 ARG HA H 1 5.087 0.010 . 1 . . . . 78 . . . 7257 1 819 . 1 1 68 68 ARG HB2 H 1 1.730 0.010 . 1 . . . . 78 . . . 7257 1 820 . 1 1 68 68 ARG HB3 H 1 1.730 0.010 . 1 . . . . 78 . . . 7257 1 821 . 1 1 68 68 ARG HG2 H 1 1.541 0.010 . 1 . . . . 78 . . . 7257 1 822 . 1 1 68 68 ARG HG3 H 1 1.541 0.010 . 1 . . . . 78 . . . 7257 1 823 . 1 1 68 68 ARG HD2 H 1 3.342 0.010 . 1 . . . . 78 . . . 7257 1 824 . 1 1 68 68 ARG HD3 H 1 3.342 0.010 . 1 . . . . 78 . . . 7257 1 825 . 1 1 68 68 ARG HE H 1 7.812 0.010 . 1 . . . . 78 . . . 7257 1 826 . 1 1 68 68 ARG C C 13 175.424 0.100 . 1 . . . . 78 . . . 7257 1 827 . 1 1 68 68 ARG CA C 13 53.390 0.100 . 1 . . . . 78 . . . 7257 1 828 . 1 1 68 68 ARG CB C 13 32.191 0.100 . 1 . . . . 78 . . . 7257 1 829 . 1 1 68 68 ARG CG C 13 32.200 0.100 . 1 . . . . 78 . . . 7257 1 830 . 1 1 68 68 ARG CD C 13 43.165 0.100 . 1 . . . . 78 . . . 7257 1 831 . 1 1 68 68 ARG N N 15 121.451 0.100 . 1 . . . . 78 . . . 7257 1 832 . 1 1 68 68 ARG NE N 15 84.574 0.100 . 1 . . . . 78 . . . 7257 1 833 . 1 1 69 69 VAL H H 1 9.464 0.010 . 1 . . . . 79 . . . 7257 1 834 . 1 1 69 69 VAL HA H 1 5.413 0.010 . 1 . . . . 79 . . . 7257 1 835 . 1 1 69 69 VAL HB H 1 1.964 0.010 . 1 . . . . 79 . . . 7257 1 836 . 1 1 69 69 VAL HG11 H 1 1.090 0.010 . 2 . . . . 79 . . . 7257 1 837 . 1 1 69 69 VAL HG12 H 1 1.090 0.010 . 2 . . . . 79 . . . 7257 1 838 . 1 1 69 69 VAL HG13 H 1 1.090 0.010 . 2 . . . . 79 . . . 7257 1 839 . 1 1 69 69 VAL HG21 H 1 0.930 0.010 . 2 . . . . 79 . . . 7257 1 840 . 1 1 69 69 VAL HG22 H 1 0.930 0.010 . 2 . . . . 79 . . . 7257 1 841 . 1 1 69 69 VAL HG23 H 1 0.930 0.010 . 2 . . . . 79 . . . 7257 1 842 . 1 1 69 69 VAL C C 13 174.408 0.100 . 1 . . . . 79 . . . 7257 1 843 . 1 1 69 69 VAL CA C 13 60.964 0.100 . 1 . . . . 79 . . . 7257 1 844 . 1 1 69 69 VAL CB C 13 34.367 0.100 . 1 . . . . 79 . . . 7257 1 845 . 1 1 69 69 VAL CG1 C 13 23.822 0.100 . 1 . . . . 79 . . . 7257 1 846 . 1 1 69 69 VAL CG2 C 13 23.822 0.100 . 1 . . . . 79 . . . 7257 1 847 . 1 1 69 69 VAL N N 15 126.293 0.100 . 1 . . . . 79 . . . 7257 1 848 . 1 1 70 70 GLU H H 1 9.047 0.010 . 1 . . . . 80 . . . 7257 1 849 . 1 1 70 70 GLU HA H 1 4.843 0.010 . 1 . . . . 80 . . . 7257 1 850 . 1 1 70 70 GLU HB2 H 1 2.167 0.010 . 1 . . . . 80 . . . 7257 1 851 . 1 1 70 70 GLU HB3 H 1 2.167 0.010 . 1 . . . . 80 . . . 7257 1 852 . 1 1 70 70 GLU HG2 H 1 2.354 0.010 . 1 . . . . 80 . . . 7257 1 853 . 1 1 70 70 GLU HG3 H 1 2.354 0.010 . 1 . . . . 80 . . . 7257 1 854 . 1 1 70 70 GLU C C 13 175.020 0.100 . 1 . . . . 80 . . . 7257 1 855 . 1 1 70 70 GLU CA C 13 54.536 0.100 . 1 . . . . 80 . . . 7257 1 856 . 1 1 70 70 GLU CB C 13 34.515 0.100 . 1 . . . . 80 . . . 7257 1 857 . 1 1 70 70 GLU CG C 13 36.085 0.100 . 1 . . . . 80 . . . 7257 1 858 . 1 1 70 70 GLU N N 15 122.174 0.100 . 1 . . . . 80 . . . 7257 1 859 . 1 1 71 71 LEU H H 1 9.039 0.010 . 1 . . . . 81 . . . 7257 1 860 . 1 1 71 71 LEU HA H 1 4.501 0.010 . 1 . . . . 81 . . . 7257 1 861 . 1 1 71 71 LEU HB2 H 1 1.743 0.010 . 1 . . . . 81 . . . 7257 1 862 . 1 1 71 71 LEU HB3 H 1 1.743 0.010 . 1 . . . . 81 . . . 7257 1 863 . 1 1 71 71 LEU HG H 1 1.450 0.010 . 1 . . . . 81 . . . 7257 1 864 . 1 1 71 71 LEU HD11 H 1 0.870 0.010 . 2 . . . . 81 . . . 7257 1 865 . 1 1 71 71 LEU HD12 H 1 0.870 0.010 . 2 . . . . 81 . . . 7257 1 866 . 1 1 71 71 LEU HD13 H 1 0.870 0.010 . 2 . . . . 81 . . . 7257 1 867 . 1 1 71 71 LEU HD21 H 1 1.060 0.010 . 2 . . . . 81 . . . 7257 1 868 . 1 1 71 71 LEU HD22 H 1 1.060 0.010 . 2 . . . . 81 . . . 7257 1 869 . 1 1 71 71 LEU HD23 H 1 1.060 0.010 . 2 . . . . 81 . . . 7257 1 870 . 1 1 71 71 LEU C C 13 177.775 0.100 . 1 . . . . 81 . . . 7257 1 871 . 1 1 71 71 LEU CA C 13 55.623 0.100 . 1 . . . . 81 . . . 7257 1 872 . 1 1 71 71 LEU CB C 13 42.671 0.100 . 1 . . . . 81 . . . 7257 1 873 . 1 1 71 71 LEU CG C 13 26.807 0.100 . 1 . . . . 81 . . . 7257 1 874 . 1 1 71 71 LEU CD1 C 13 23.530 0.100 . 1 . . . . 81 . . . 7257 1 875 . 1 1 71 71 LEU CD2 C 13 25.960 0.100 . 1 . . . . 81 . . . 7257 1 876 . 1 1 71 71 LEU N N 15 122.682 0.100 . 1 . . . . 81 . . . 7257 1 877 . 1 1 72 72 SER H H 1 8.455 0.010 . 1 . . . . 82 . . . 7257 1 878 . 1 1 72 72 SER HA H 1 4.503 0.010 . 1 . . . . 82 . . . 7257 1 879 . 1 1 72 72 SER HB2 H 1 3.844 0.010 . 2 . . . . 82 . . . 7257 1 880 . 1 1 72 72 SER HB3 H 1 3.709 0.010 . 2 . . . . 82 . . . 7257 1 881 . 1 1 72 72 SER C C 13 174.593 0.100 . 1 . . . . 82 . . . 7257 1 882 . 1 1 72 72 SER CA C 13 58.521 0.100 . 1 . . . . 82 . . . 7257 1 883 . 1 1 72 72 SER CB C 13 64.093 0.100 . 1 . . . . 82 . . . 7257 1 884 . 1 1 72 72 SER N N 15 116.853 0.100 . 1 . . . . 82 . . . 7257 1 885 . 1 1 73 73 THR H H 1 8.108 0.010 . 1 . . . . 83 . . . 7257 1 886 . 1 1 73 73 THR HA H 1 4.341 0.010 . 1 . . . . 83 . . . 7257 1 887 . 1 1 73 73 THR HB H 1 4.306 0.010 . 1 . . . . 83 . . . 7257 1 888 . 1 1 73 73 THR HG21 H 1 1.207 0.010 . 1 . . . . 83 . . . 7257 1 889 . 1 1 73 73 THR HG22 H 1 1.207 0.010 . 1 . . . . 83 . . . 7257 1 890 . 1 1 73 73 THR HG23 H 1 1.207 0.010 . 1 . . . . 83 . . . 7257 1 891 . 1 1 73 73 THR C C 13 175.049 0.100 . 1 . . . . 83 . . . 7257 1 892 . 1 1 73 73 THR CA C 13 61.769 0.100 . 1 . . . . 83 . . . 7257 1 893 . 1 1 73 73 THR CB C 13 69.818 0.100 . 1 . . . . 83 . . . 7257 1 894 . 1 1 73 73 THR CG2 C 13 21.650 0.100 . 1 . . . . 83 . . . 7257 1 895 . 1 1 73 73 THR N N 15 114.806 0.100 . 1 . . . . 83 . . . 7257 1 896 . 1 1 74 74 GLY H H 1 8.294 0.010 . 1 . . . . 84 . . . 7257 1 897 . 1 1 74 74 GLY HA2 H 1 3.799 0.010 . 2 . . . . 84 . . . 7257 1 898 . 1 1 74 74 GLY HA3 H 1 3.980 0.010 . 2 . . . . 84 . . . 7257 1 899 . 1 1 74 74 GLY C C 13 173.552 0.100 . 1 . . . . 84 . . . 7257 1 900 . 1 1 74 74 GLY CA C 13 45.021 0.100 . 1 . . . . 84 . . . 7257 1 901 . 1 1 74 74 GLY N N 15 110.082 0.100 . 1 . . . . 84 . . . 7257 1 902 . 1 1 75 75 MET H H 1 8.129 0.010 . 1 . . . . 85 . . . 7257 1 903 . 1 1 75 75 MET HA H 1 4.717 0.010 . 1 . . . . 85 . . . 7257 1 904 . 1 1 75 75 MET HB2 H 1 1.818 0.010 . 1 . . . . 85 . . . 7257 1 905 . 1 1 75 75 MET HB3 H 1 1.818 0.010 . 1 . . . . 85 . . . 7257 1 906 . 1 1 75 75 MET HG2 H 1 2.552 0.010 . 1 . . . . 85 . . . 7257 1 907 . 1 1 75 75 MET HG3 H 1 2.552 0.010 . 1 . . . . 85 . . . 7257 1 908 . 1 1 75 75 MET C C 13 176.556 0.100 . 1 . . . . 85 . . . 7257 1 909 . 1 1 75 75 MET CA C 13 53.292 0.100 . 1 . . . . 85 . . . 7257 1 910 . 1 1 75 75 MET CB C 13 32.518 0.100 . 1 . . . . 85 . . . 7257 1 911 . 1 1 75 75 MET CG C 13 32.020 0.100 . 1 . . . . 85 . . . 7257 1 912 . 1 1 75 75 MET N N 15 120.719 0.100 . 1 . . . . 85 . . . 7257 1 913 . 1 1 76 76 PRO HA H 1 4.582 0.010 . 1 . . . . 86 . . . 7257 1 914 . 1 1 76 76 PRO HB2 H 1 2.396 0.010 . 2 . . . . 86 . . . 7257 1 915 . 1 1 76 76 PRO HB3 H 1 2.090 0.010 . 2 . . . . 86 . . . 7257 1 916 . 1 1 76 76 PRO HG2 H 1 1.994 0.010 . 1 . . . . 86 . . . 7257 1 917 . 1 1 76 76 PRO HG3 H 1 1.994 0.010 . 1 . . . . 86 . . . 7257 1 918 . 1 1 76 76 PRO HD2 H 1 3.579 0.010 . 1 . . . . 86 . . . 7257 1 919 . 1 1 76 76 PRO HD3 H 1 3.579 0.010 . 1 . . . . 86 . . . 7257 1 920 . 1 1 76 76 PRO C C 13 176.431 0.100 . 1 . . . . 86 . . . 7257 1 921 . 1 1 76 76 PRO CA C 13 62.412 0.100 . 1 . . . . 86 . . . 7257 1 922 . 1 1 76 76 PRO CB C 13 34.737 0.100 . 1 . . . . 86 . . . 7257 1 923 . 1 1 76 76 PRO CG C 13 24.332 0.100 . 1 . . . . 86 . . . 7257 1 924 . 1 1 76 76 PRO CD C 13 50.415 0.100 . 1 . . . . 86 . . . 7257 1 925 . 1 1 77 77 ARG H H 1 8.618 0.010 . 1 . . . . 87 . . . 7257 1 926 . 1 1 77 77 ARG HA H 1 4.375 0.010 . 1 . . . . 87 . . . 7257 1 927 . 1 1 77 77 ARG HB2 H 1 1.550 0.010 . 1 . . . . 87 . . . 7257 1 928 . 1 1 77 77 ARG HB3 H 1 1.550 0.010 . 1 . . . . 87 . . . 7257 1 929 . 1 1 77 77 ARG HG2 H 1 1.541 0.010 . 1 . . . . 87 . . . 7257 1 930 . 1 1 77 77 ARG HG3 H 1 1.541 0.010 . 1 . . . . 87 . . . 7257 1 931 . 1 1 77 77 ARG HD2 H 1 3.195 0.010 . 1 . . . . 87 . . . 7257 1 932 . 1 1 77 77 ARG HD3 H 1 3.195 0.010 . 1 . . . . 87 . . . 7257 1 933 . 1 1 77 77 ARG HE H 1 7.413 0.010 . 1 . . . . 87 . . . 7257 1 934 . 1 1 77 77 ARG C C 13 177.013 0.100 . 1 . . . . 87 . . . 7257 1 935 . 1 1 77 77 ARG CA C 13 55.308 0.100 . 1 . . . . 87 . . . 7257 1 936 . 1 1 77 77 ARG CB C 13 42.504 0.100 . 1 . . . . 87 . . . 7257 1 937 . 1 1 77 77 ARG CG C 13 26.807 0.100 . 1 . . . . 87 . . . 7257 1 938 . 1 1 77 77 ARG CD C 13 43.165 0.100 . 1 . . . . 87 . . . 7257 1 939 . 1 1 77 77 ARG N N 15 122.950 0.100 . 1 . . . . 87 . . . 7257 1 940 . 1 1 77 77 ARG NE N 15 84.076 0.100 . 1 . . . . 87 . . . 7257 1 941 . 1 1 78 78 ARG H H 1 8.468 0.010 . 1 . . . . 88 . . . 7257 1 942 . 1 1 78 78 ARG HA H 1 4.251 0.010 . 1 . . . . 88 . . . 7257 1 943 . 1 1 78 78 ARG HB2 H 1 1.927 0.010 . 1 . . . . 88 . . . 7257 1 944 . 1 1 78 78 ARG HB3 H 1 1.927 0.010 . 1 . . . . 88 . . . 7257 1 945 . 1 1 78 78 ARG HG2 H 1 1.762 0.010 . 1 . . . . 88 . . . 7257 1 946 . 1 1 78 78 ARG HG3 H 1 1.762 0.010 . 1 . . . . 88 . . . 7257 1 947 . 1 1 78 78 ARG HD2 H 1 3.158 0.010 . 1 . . . . 88 . . . 7257 1 948 . 1 1 78 78 ARG HD3 H 1 3.158 0.010 . 1 . . . . 88 . . . 7257 1 949 . 1 1 78 78 ARG HE H 1 7.688 0.010 . 1 . . . . 88 . . . 7257 1 950 . 1 1 78 78 ARG C C 13 176.255 0.100 . 1 . . . . 88 . . . 7257 1 951 . 1 1 78 78 ARG CA C 13 56.171 0.100 . 1 . . . . 88 . . . 7257 1 952 . 1 1 78 78 ARG CB C 13 30.924 0.100 . 1 . . . . 88 . . . 7257 1 953 . 1 1 78 78 ARG CG C 13 27.167 0.100 . 1 . . . . 88 . . . 7257 1 954 . 1 1 78 78 ARG CD C 13 42.985 0.100 . 1 . . . . 88 . . . 7257 1 955 . 1 1 78 78 ARG N N 15 121.793 0.100 . 1 . . . . 88 . . . 7257 1 956 . 1 1 78 78 ARG NE N 15 84.740 0.100 . 1 . . . . 88 . . . 7257 1 957 . 1 1 79 79 SER H H 1 8.431 0.010 . 1 . . . . 89 . . . 7257 1 958 . 1 1 79 79 SER HA H 1 4.432 0.010 . 1 . . . . 89 . . . 7257 1 959 . 1 1 79 79 SER HB2 H 1 3.818 0.010 . 1 . . . . 89 . . . 7257 1 960 . 1 1 79 79 SER HB3 H 1 3.818 0.010 . 1 . . . . 89 . . . 7257 1 961 . 1 1 79 79 SER C C 13 174.714 0.100 . 1 . . . . 89 . . . 7257 1 962 . 1 1 79 79 SER CA C 13 58.228 0.100 . 1 . . . . 89 . . . 7257 1 963 . 1 1 79 79 SER CB C 13 64.142 0.100 . 1 . . . . 89 . . . 7257 1 964 . 1 1 79 79 SER N N 15 117.188 0.100 . 1 . . . . 89 . . . 7257 1 965 . 1 1 80 80 ARG H H 1 8.395 0.010 . 1 . . . . 90 . . . 7257 1 966 . 1 1 80 80 ARG HA H 1 4.195 0.010 . 1 . . . . 90 . . . 7257 1 967 . 1 1 80 80 ARG HB2 H 1 1.670 0.010 . 1 . . . . 90 . . . 7257 1 968 . 1 1 80 80 ARG HB3 H 1 1.670 0.010 . 1 . . . . 90 . . . 7257 1 969 . 1 1 80 80 ARG HG2 H 1 1.357 0.010 . 1 . . . . 90 . . . 7257 1 970 . 1 1 80 80 ARG HG3 H 1 1.357 0.010 . 1 . . . . 90 . . . 7257 1 971 . 1 1 80 80 ARG HD2 H 1 3.269 0.010 . 1 . . . . 90 . . . 7257 1 972 . 1 1 80 80 ARG HD3 H 1 3.269 0.010 . 1 . . . . 90 . . . 7257 1 973 . 1 1 80 80 ARG HE H 1 7.259 0.010 . 1 . . . . 90 . . . 7257 1 974 . 1 1 80 80 ARG C C 13 176.018 0.100 . 1 . . . . 90 . . . 7257 1 975 . 1 1 80 80 ARG CA C 13 56.465 0.100 . 1 . . . . 90 . . . 7257 1 976 . 1 1 80 80 ARG CB C 13 30.501 0.100 . 1 . . . . 90 . . . 7257 1 977 . 1 1 80 80 ARG CG C 13 26.448 0.100 . 1 . . . . 90 . . . 7257 1 978 . 1 1 80 80 ARG CD C 13 43.345 0.100 . 1 . . . . 90 . . . 7257 1 979 . 1 1 80 80 ARG N N 15 122.801 0.100 . 1 . . . . 90 . . . 7257 1 980 . 1 1 80 80 ARG NE N 15 84.574 0.100 . 1 . . . . 90 . . . 7257 1 981 . 1 1 81 81 PHE H H 1 8.190 0.010 . 1 . . . . 91 . . . 7257 1 982 . 1 1 81 81 PHE HA H 1 4.627 0.010 . 1 . . . . 91 . . . 7257 1 983 . 1 1 81 81 PHE HB2 H 1 3.224 0.010 . 2 . . . . 91 . . . 7257 1 984 . 1 1 81 81 PHE HB3 H 1 2.882 0.010 . 2 . . . . 91 . . . 7257 1 985 . 1 1 81 81 PHE HD1 H 1 7.217 0.010 . 1 . . . . 91 . . . 7257 1 986 . 1 1 81 81 PHE HD2 H 1 7.217 0.010 . 1 . . . . 91 . . . 7257 1 987 . 1 1 81 81 PHE C C 13 175.329 0.100 . 1 . . . . 91 . . . 7257 1 988 . 1 1 81 81 PHE CA C 13 57.444 0.100 . 1 . . . . 91 . . . 7257 1 989 . 1 1 81 81 PHE CB C 13 39.374 0.100 . 1 . . . . 91 . . . 7257 1 990 . 1 1 81 81 PHE CD1 C 13 131.350 0.100 . 1 . . . . 91 . . . 7257 1 991 . 1 1 81 81 PHE CD2 C 13 131.350 0.100 . 1 . . . . 91 . . . 7257 1 992 . 1 1 81 81 PHE N N 15 119.688 0.100 . 1 . . . . 91 . . . 7257 1 993 . 1 1 82 82 ASP H H 1 8.155 0.010 . 1 . . . . 92 . . . 7257 1 994 . 1 1 82 82 ASP HA H 1 4.566 0.010 . 1 . . . . 92 . . . 7257 1 995 . 1 1 82 82 ASP HB2 H 1 2.586 0.010 . 2 . . . . 92 . . . 7257 1 996 . 1 1 82 82 ASP HB3 H 1 2.612 0.010 . 2 . . . . 92 . . . 7257 1 997 . 1 1 82 82 ASP C C 13 176.350 0.100 . 1 . . . . 92 . . . 7257 1 998 . 1 1 82 82 ASP CA C 13 54.017 0.100 . 1 . . . . 92 . . . 7257 1 999 . 1 1 82 82 ASP CB C 13 41.276 0.100 . 1 . . . . 92 . . . 7257 1 1000 . 1 1 82 82 ASP N N 15 121.677 0.100 . 1 . . . . 92 . . . 7257 1 1001 . 1 1 83 83 ARG H H 1 8.070 0.010 . 1 . . . . 93 . . . 7257 1 1002 . 1 1 83 83 ARG HA H 1 4.049 0.010 . 1 . . . . 93 . . . 7257 1 1003 . 1 1 83 83 ARG HB2 H 1 1.872 0.010 . 1 . . . . 93 . . . 7257 1 1004 . 1 1 83 83 ARG HB3 H 1 1.872 0.010 . 1 . . . . 93 . . . 7257 1 1005 . 1 1 83 83 ARG HG2 H 1 1.559 0.010 . 1 . . . . 93 . . . 7257 1 1006 . 1 1 83 83 ARG HG3 H 1 1.559 0.010 . 1 . . . . 93 . . . 7257 1 1007 . 1 1 83 83 ARG HD2 H 1 3.140 0.010 . 1 . . . . 93 . . . 7257 1 1008 . 1 1 83 83 ARG HD3 H 1 3.140 0.010 . 1 . . . . 93 . . . 7257 1 1009 . 1 1 83 83 ARG HE H 1 7.247 0.010 . 1 . . . . 93 . . . 7257 1 1010 . 1 1 83 83 ARG C C 13 176.920 0.100 . 1 . . . . 93 . . . 7257 1 1011 . 1 1 83 83 ARG CA C 13 56.801 0.100 . 1 . . . . 93 . . . 7257 1 1012 . 1 1 83 83 ARG CB C 13 32.614 0.100 . 1 . . . . 93 . . . 7257 1 1013 . 1 1 83 83 ARG CG C 13 27.706 0.100 . 1 . . . . 93 . . . 7257 1 1014 . 1 1 83 83 ARG CD C 13 43.165 0.100 . 1 . . . . 93 . . . 7257 1 1015 . 1 1 83 83 ARG N N 15 121.148 0.100 . 1 . . . . 93 . . . 7257 1 1016 . 1 1 83 83 ARG NE N 15 83.744 0.100 . 1 . . . . 93 . . . 7257 1 1017 . 1 1 85 85 PRO HA H 1 4.413 0.010 . 1 . . . . 95 . . . 7257 1 1018 . 1 1 85 85 PRO HB2 H 1 2.263 0.010 . 2 . . . . 95 . . . 7257 1 1019 . 1 1 85 85 PRO HB3 H 1 1.879 0.010 . 2 . . . . 95 . . . 7257 1 1020 . 1 1 85 85 PRO HG2 H 1 2.015 0.010 . 1 . . . . 95 . . . 7257 1 1021 . 1 1 85 85 PRO HG3 H 1 2.015 0.010 . 1 . . . . 95 . . . 7257 1 1022 . 1 1 85 85 PRO HD2 H 1 3.669 0.010 . 1 . . . . 95 . . . 7257 1 1023 . 1 1 85 85 PRO HD3 H 1 3.669 0.010 . 1 . . . . 95 . . . 7257 1 1024 . 1 1 85 85 PRO C C 13 176.597 0.100 . 1 . . . . 95 . . . 7257 1 1025 . 1 1 85 85 PRO CA C 13 63.014 0.100 . 1 . . . . 95 . . . 7257 1 1026 . 1 1 85 85 PRO CB C 13 31.963 0.100 . 1 . . . . 95 . . . 7257 1 1027 . 1 1 85 85 PRO CG C 13 27.039 0.100 . 1 . . . . 95 . . . 7257 1 1028 . 1 1 85 85 PRO CD C 13 50.049 0.100 . 1 . . . . 95 . . . 7257 1 1029 . 1 1 86 86 ALA H H 1 8.415 0.010 . 1 . . . . 96 . . . 7257 1 1030 . 1 1 86 86 ALA HA H 1 4.249 0.010 . 1 . . . . 96 . . . 7257 1 1031 . 1 1 86 86 ALA HB1 H 1 1.337 0.010 . 1 . . . . 96 . . . 7257 1 1032 . 1 1 86 86 ALA HB2 H 1 1.337 0.010 . 1 . . . . 96 . . . 7257 1 1033 . 1 1 86 86 ALA HB3 H 1 1.337 0.010 . 1 . . . . 96 . . . 7257 1 1034 . 1 1 86 86 ALA C C 13 177.870 0.100 . 1 . . . . 96 . . . 7257 1 1035 . 1 1 86 86 ALA CA C 13 52.548 0.100 . 1 . . . . 96 . . . 7257 1 1036 . 1 1 86 86 ALA CB C 13 19.092 0.100 . 1 . . . . 96 . . . 7257 1 1037 . 1 1 86 86 ALA N N 15 124.129 0.100 . 1 . . . . 96 . . . 7257 1 1038 . 1 1 87 87 ARG H H 1 8.354 0.010 . 1 . . . . 97 . . . 7257 1 1039 . 1 1 87 87 ARG HA H 1 4.273 0.010 . 1 . . . . 97 . . . 7257 1 1040 . 1 1 87 87 ARG HB2 H 1 1.811 0.010 . 1 . . . . 97 . . . 7257 1 1041 . 1 1 87 87 ARG HB3 H 1 1.811 0.010 . 1 . . . . 97 . . . 7257 1 1042 . 1 1 87 87 ARG HG2 H 1 1.651 0.010 . 1 . . . . 97 . . . 7257 1 1043 . 1 1 87 87 ARG HG3 H 1 1.651 0.010 . 1 . . . . 97 . . . 7257 1 1044 . 1 1 87 87 ARG HD2 H 1 3.177 0.010 . 1 . . . . 97 . . . 7257 1 1045 . 1 1 87 87 ARG HD3 H 1 3.177 0.010 . 1 . . . . 97 . . . 7257 1 1046 . 1 1 87 87 ARG HE H 1 7.293 0.010 . 1 . . . . 97 . . . 7257 1 1047 . 1 1 87 87 ARG C C 13 176.348 0.100 . 1 . . . . 97 . . . 7257 1 1048 . 1 1 87 87 ARG CA C 13 56.165 0.100 . 1 . . . . 97 . . . 7257 1 1049 . 1 1 87 87 ARG CB C 13 30.853 0.100 . 1 . . . . 97 . . . 7257 1 1050 . 1 1 87 87 ARG CG C 13 27.167 0.100 . 1 . . . . 97 . . . 7257 1 1051 . 1 1 87 87 ARG CD C 13 43.345 0.100 . 1 . . . . 97 . . . 7257 1 1052 . 1 1 87 87 ARG N N 15 120.467 0.100 . 1 . . . . 97 . . . 7257 1 1053 . 1 1 87 87 ARG NE N 15 84.527 0.100 . 1 . . . . 97 . . . 7257 1 1054 . 1 1 88 88 ARG H H 1 8.373 0.010 . 1 . . . . 98 . . . 7257 1 1055 . 1 1 88 88 ARG HA H 1 4.267 0.010 . 1 . . . . 98 . . . 7257 1 1056 . 1 1 88 88 ARG HB2 H 1 1.743 0.010 . 1 . . . . 98 . . . 7257 1 1057 . 1 1 88 88 ARG HB3 H 1 1.743 0.010 . 1 . . . . 98 . . . 7257 1 1058 . 1 1 88 88 ARG HG2 H 1 1.615 0.010 . 1 . . . . 98 . . . 7257 1 1059 . 1 1 88 88 ARG HG3 H 1 1.615 0.010 . 1 . . . . 98 . . . 7257 1 1060 . 1 1 88 88 ARG HD2 H 1 3.177 0.010 . 1 . . . . 98 . . . 7257 1 1061 . 1 1 88 88 ARG HD3 H 1 3.177 0.010 . 1 . . . . 98 . . . 7257 1 1062 . 1 1 88 88 ARG HE H 1 7.259 0.010 . 1 . . . . 98 . . . 7257 1 1063 . 1 1 88 88 ARG C C 13 176.398 0.100 . 1 . . . . 98 . . . 7257 1 1064 . 1 1 88 88 ARG CA C 13 56.465 0.100 . 1 . . . . 98 . . . 7257 1 1065 . 1 1 88 88 ARG CB C 13 30.501 0.100 . 1 . . . . 98 . . . 7257 1 1066 . 1 1 88 88 ARG CG C 13 27.167 0.100 . 1 . . . . 98 . . . 7257 1 1067 . 1 1 88 88 ARG CD C 13 43.345 0.100 . 1 . . . . 98 . . . 7257 1 1068 . 1 1 88 88 ARG N N 15 122.471 0.100 . 1 . . . . 98 . . . 7257 1 1069 . 1 1 88 88 ARG NE N 15 84.574 0.100 . 1 . . . . 98 . . . 7257 1 1070 . 1 1 89 89 LYS H H 1 8.501 0.010 . 1 . . . . 99 . . . 7257 1 1071 . 1 1 89 89 LYS HA H 1 4.375 0.010 . 1 . . . . 99 . . . 7257 1 1072 . 1 1 89 89 LYS HB2 H 1 1.784 0.010 . 2 . . . . 99 . . . 7257 1 1073 . 1 1 89 89 LYS HB3 H 1 1.796 0.010 . 2 . . . . 99 . . . 7257 1 1074 . 1 1 89 89 LYS HG2 H 1 1.449 0.010 . 1 . . . . 99 . . . 7257 1 1075 . 1 1 89 89 LYS HG3 H 1 1.449 0.010 . 1 . . . . 99 . . . 7257 1 1076 . 1 1 89 89 LYS HD2 H 1 1.762 0.010 . 1 . . . . 99 . . . 7257 1 1077 . 1 1 89 89 LYS HD3 H 1 1.762 0.010 . 1 . . . . 99 . . . 7257 1 1078 . 1 1 89 89 LYS HE2 H 1 3.030 0.010 . 1 . . . . 99 . . . 7257 1 1079 . 1 1 89 89 LYS HE3 H 1 3.030 0.010 . 1 . . . . 99 . . . 7257 1 1080 . 1 1 89 89 LYS C C 13 176.255 0.100 . 1 . . . . 99 . . . 7257 1 1081 . 1 1 89 89 LYS CA C 13 58.130 0.100 . 1 . . . . 99 . . . 7257 1 1082 . 1 1 89 89 LYS CB C 13 30.924 0.100 . 1 . . . . 99 . . . 7257 1 1083 . 1 1 89 89 LYS CG C 13 24.830 0.100 . 1 . . . . 99 . . . 7257 1 1084 . 1 1 89 89 LYS CD C 13 28.605 0.100 . 1 . . . . 99 . . . 7257 1 1085 . 1 1 89 89 LYS CE C 13 41.907 0.100 . 1 . . . . 99 . . . 7257 1 1086 . 1 1 89 89 LYS N N 15 123.029 0.100 . 1 . . . . 99 . . . 7257 1 1087 . 1 1 90 90 LEU H H 1 8.407 0.010 . 1 . . . . 100 . . . 7257 1 1088 . 1 1 90 90 LEU HA H 1 4.243 0.010 . 1 . . . . 100 . . . 7257 1 1089 . 1 1 90 90 LEU HB2 H 1 1.798 0.010 . 1 . . . . 100 . . . 7257 1 1090 . 1 1 90 90 LEU HB3 H 1 1.798 0.010 . 1 . . . . 100 . . . 7257 1 1091 . 1 1 90 90 LEU HG H 1 1.559 0.010 . 1 . . . . 100 . . . 7257 1 1092 . 1 1 90 90 LEU HD11 H 1 0.751 0.010 . 2 . . . . 100 . . . 7257 1 1093 . 1 1 90 90 LEU HD12 H 1 0.751 0.010 . 2 . . . . 100 . . . 7257 1 1094 . 1 1 90 90 LEU HD13 H 1 0.751 0.010 . 2 . . . . 100 . . . 7257 1 1095 . 1 1 90 90 LEU HD21 H 1 0.898 0.010 . 2 . . . . 100 . . . 7257 1 1096 . 1 1 90 90 LEU HD22 H 1 0.898 0.010 . 2 . . . . 100 . . . 7257 1 1097 . 1 1 90 90 LEU HD23 H 1 0.898 0.010 . 2 . . . . 100 . . . 7257 1 1098 . 1 1 90 90 LEU C C 13 176.493 0.100 . 1 . . . . 100 . . . 7257 1 1099 . 1 1 90 90 LEU CA C 13 56.563 0.100 . 1 . . . . 100 . . . 7257 1 1100 . 1 1 90 90 LEU CB C 13 33.073 0.100 . 1 . . . . 100 . . . 7257 1 1101 . 1 1 90 90 LEU CG C 13 26.987 0.100 . 1 . . . . 100 . . . 7257 1 1102 . 1 1 90 90 LEU CD1 C 13 25.010 0.100 . 1 . . . . 100 . . . 7257 1 1103 . 1 1 90 90 LEU CD2 C 13 25.010 0.100 . 1 . . . . 100 . . . 7257 1 1104 . 1 1 90 90 LEU N N 15 123.090 0.100 . 1 . . . . 100 . . . 7257 1 1105 . 1 1 91 91 LEU H H 1 8.271 0.010 . 1 . . . . 101 . . . 7257 1 1106 . 1 1 91 91 LEU HA H 1 4.311 0.010 . 1 . . . . 101 . . . 7257 1 1107 . 1 1 91 91 LEU HB2 H 1 1.640 0.010 . 1 . . . . 101 . . . 7257 1 1108 . 1 1 91 91 LEU HB3 H 1 1.640 0.010 . 1 . . . . 101 . . . 7257 1 1109 . 1 1 91 91 LEU HG H 1 1.468 0.010 . 1 . . . . 101 . . . 7257 1 1110 . 1 1 91 91 LEU HD11 H 1 0.879 0.010 . 1 . . . . 101 . . . 7257 1 1111 . 1 1 91 91 LEU HD12 H 1 0.879 0.010 . 1 . . . . 101 . . . 7257 1 1112 . 1 1 91 91 LEU HD13 H 1 0.879 0.010 . 1 . . . . 101 . . . 7257 1 1113 . 1 1 91 91 LEU HD21 H 1 0.879 0.010 . 1 . . . . 101 . . . 7257 1 1114 . 1 1 91 91 LEU HD22 H 1 0.879 0.010 . 1 . . . . 101 . . . 7257 1 1115 . 1 1 91 91 LEU HD23 H 1 0.879 0.010 . 1 . . . . 101 . . . 7257 1 1116 . 1 1 91 91 LEU C C 13 177.205 0.100 . 1 . . . . 101 . . . 7257 1 1117 . 1 1 91 91 LEU CA C 13 55.485 0.100 . 1 . . . . 101 . . . 7257 1 1118 . 1 1 91 91 LEU CB C 13 42.332 0.100 . 1 . . . . 101 . . . 7257 1 1119 . 1 1 91 91 LEU CG C 13 27.167 0.100 . 1 . . . . 101 . . . 7257 1 1120 . 1 1 91 91 LEU CD1 C 13 24.650 0.100 . 1 . . . . 101 . . . 7257 1 1121 . 1 1 91 91 LEU CD2 C 13 24.650 0.100 . 1 . . . . 101 . . . 7257 1 1122 . 1 1 91 91 LEU N N 15 123.676 0.100 . 1 . . . . 101 . . . 7257 1 1123 . 1 1 92 92 GLU H H 1 8.275 0.010 . 1 . . . . 102 . . . 7257 1 1124 . 1 1 92 92 GLU HA H 1 4.243 0.010 . 1 . . . . 102 . . . 7257 1 1125 . 1 1 92 92 GLU HB2 H 1 1.960 0.010 . 1 . . . . 102 . . . 7257 1 1126 . 1 1 92 92 GLU HB3 H 1 1.960 0.010 . 1 . . . . 102 . . . 7257 1 1127 . 1 1 92 92 GLU HG2 H 1 2.190 0.010 . 1 . . . . 102 . . . 7257 1 1128 . 1 1 92 92 GLU HG3 H 1 2.190 0.010 . 1 . . . . 102 . . . 7257 1 1129 . 1 1 92 92 GLU C C 13 176.440 0.100 . 1 . . . . 102 . . . 7257 1 1130 . 1 1 92 92 GLU CA C 13 56.794 0.100 . 1 . . . . 102 . . . 7257 1 1131 . 1 1 92 92 GLU CB C 13 30.360 0.100 . 1 . . . . 102 . . . 7257 1 1132 . 1 1 92 92 GLU CG C 13 36.250 0.100 . 1 . . . . 102 . . . 7257 1 1133 . 1 1 92 92 GLU N N 15 121.686 0.100 . 1 . . . . 102 . . . 7257 1 1134 . 1 1 93 93 VAL H H 1 8.079 0.010 . 1 . . . . 103 . . . 7257 1 1135 . 1 1 93 93 VAL HA H 1 4.025 0.010 . 1 . . . . 103 . . . 7257 1 1136 . 1 1 93 93 VAL HB H 1 2.036 0.010 . 1 . . . . 103 . . . 7257 1 1137 . 1 1 93 93 VAL HG11 H 1 0.900 0.010 . 1 . . . . 103 . . . 7257 1 1138 . 1 1 93 93 VAL HG12 H 1 0.900 0.010 . 1 . . . . 103 . . . 7257 1 1139 . 1 1 93 93 VAL HG13 H 1 0.900 0.010 . 1 . . . . 103 . . . 7257 1 1140 . 1 1 93 93 VAL HG21 H 1 0.900 0.010 . 1 . . . . 103 . . . 7257 1 1141 . 1 1 93 93 VAL HG22 H 1 0.900 0.010 . 1 . . . . 103 . . . 7257 1 1142 . 1 1 93 93 VAL HG23 H 1 0.900 0.010 . 1 . . . . 103 . . . 7257 1 1143 . 1 1 93 93 VAL C C 13 176.015 0.100 . 1 . . . . 103 . . . 7257 1 1144 . 1 1 93 93 VAL CA C 13 62.680 0.100 . 1 . . . . 103 . . . 7257 1 1145 . 1 1 93 93 VAL CB C 13 32.518 0.100 . 1 . . . . 103 . . . 7257 1 1146 . 1 1 93 93 VAL CG1 C 13 20.750 0.100 . 1 . . . . 103 . . . 7257 1 1147 . 1 1 93 93 VAL CG2 C 13 20.750 0.100 . 1 . . . . 103 . . . 7257 1 1148 . 1 1 93 93 VAL N N 15 120.981 0.100 . 1 . . . . 103 . . . 7257 1 1149 . 1 1 94 94 LEU H H 1 8.196 0.010 . 1 . . . . 104 . . . 7257 1 1150 . 1 1 94 94 LEU HA H 1 4.291 0.010 . 1 . . . . 104 . . . 7257 1 1151 . 1 1 94 94 LEU HB2 H 1 1.392 0.010 . 2 . . . . 104 . . . 7257 1 1152 . 1 1 94 94 LEU HB3 H 1 1.532 0.010 . 2 . . . . 104 . . . 7257 1 1153 . 1 1 94 94 LEU HG H 1 1.540 0.010 . 1 . . . . 104 . . . 7257 1 1154 . 1 1 94 94 LEU HD11 H 1 0.870 0.010 . 1 . . . . 104 . . . 7257 1 1155 . 1 1 94 94 LEU HD12 H 1 0.870 0.010 . 1 . . . . 104 . . . 7257 1 1156 . 1 1 94 94 LEU HD13 H 1 0.870 0.010 . 1 . . . . 104 . . . 7257 1 1157 . 1 1 94 94 LEU HD21 H 1 0.870 0.010 . 1 . . . . 104 . . . 7257 1 1158 . 1 1 94 94 LEU HD22 H 1 0.870 0.010 . 1 . . . . 104 . . . 7257 1 1159 . 1 1 94 94 LEU HD23 H 1 0.870 0.010 . 1 . . . . 104 . . . 7257 1 1160 . 1 1 94 94 LEU C C 13 176.920 0.100 . 1 . . . . 104 . . . 7257 1 1161 . 1 1 94 94 LEU CA C 13 55.192 0.100 . 1 . . . . 104 . . . 7257 1 1162 . 1 1 94 94 LEU CB C 13 42.332 0.100 . 1 . . . . 104 . . . 7257 1 1163 . 1 1 94 94 LEU CG C 13 27.000 0.100 . 1 . . . . 104 . . . 7257 1 1164 . 1 1 94 94 LEU CD1 C 13 24.950 0.100 . 1 . . . . 104 . . . 7257 1 1165 . 1 1 94 94 LEU CD2 C 13 24.950 0.100 . 1 . . . . 104 . . . 7257 1 1166 . 1 1 94 94 LEU N N 15 125.259 0.100 . 1 . . . . 104 . . . 7257 1 1167 . 1 1 95 95 PHE H H 1 8.214 0.010 . 1 . . . . 105 . . . 7257 1 1168 . 1 1 95 95 PHE HA H 1 4.582 0.010 . 1 . . . . 105 . . . 7257 1 1169 . 1 1 95 95 PHE HB2 H 1 3.020 0.010 . 1 . . . . 105 . . . 7257 1 1170 . 1 1 95 95 PHE HB3 H 1 3.020 0.010 . 1 . . . . 105 . . . 7257 1 1171 . 1 1 95 95 PHE HD1 H 1 6.790 0.010 . 1 . . . . 105 . . . 7257 1 1172 . 1 1 95 95 PHE HD2 H 1 6.790 0.010 . 1 . . . . 105 . . . 7257 1 1173 . 1 1 95 95 PHE HE1 H 1 6.140 0.010 . 1 . . . . 105 . . . 7257 1 1174 . 1 1 95 95 PHE HE2 H 1 6.140 0.010 . 1 . . . . 105 . . . 7257 1 1175 . 1 1 95 95 PHE HZ H 1 7.445 0.010 . 1 . . . . 105 . . . 7257 1 1176 . 1 1 95 95 PHE C C 13 175.400 0.100 . 1 . . . . 105 . . . 7257 1 1177 . 1 1 95 95 PHE CA C 13 57.934 0.100 . 1 . . . . 105 . . . 7257 1 1178 . 1 1 95 95 PHE CB C 13 39.586 0.100 . 1 . . . . 105 . . . 7257 1 1179 . 1 1 95 95 PHE CD1 C 13 132.970 0.100 . 1 . . . . 105 . . . 7257 1 1180 . 1 1 95 95 PHE CD2 C 13 132.970 0.100 . 1 . . . . 105 . . . 7257 1 1181 . 1 1 95 95 PHE CE1 C 13 133.106 0.100 . 1 . . . . 105 . . . 7257 1 1182 . 1 1 95 95 PHE CE2 C 13 133.106 0.100 . 1 . . . . 105 . . . 7257 1 1183 . 1 1 95 95 PHE CZ C 13 131.640 0.100 . 1 . . . . 105 . . . 7257 1 1184 . 1 1 95 95 PHE N N 15 121.289 0.100 . 1 . . . . 105 . . . 7257 1 1185 . 1 1 96 96 ASN H H 1 8.233 0.010 . 1 . . . . 106 . . . 7257 1 1186 . 1 1 96 96 ASN HA H 1 4.340 0.010 . 1 . . . . 106 . . . 7257 1 1187 . 1 1 96 96 ASN HB2 H 1 2.673 0.010 . 2 . . . . 106 . . . 7257 1 1188 . 1 1 96 96 ASN HB3 H 1 2.822 0.010 . 2 . . . . 106 . . . 7257 1 1189 . 1 1 96 96 ASN HD21 H 1 8.007 0.010 . 2 . . . . 106 . . . 7257 1 1190 . 1 1 96 96 ASN HD22 H 1 6.843 0.010 . 2 . . . . 106 . . . 7257 1 1191 . 1 1 96 96 ASN C C 13 175.543 0.100 . 1 . . . . 106 . . . 7257 1 1192 . 1 1 96 96 ASN CA C 13 55.479 0.100 . 1 . . . . 106 . . . 7257 1 1193 . 1 1 96 96 ASN CB C 13 29.929 0.100 . 1 . . . . 106 . . . 7257 1 1194 . 1 1 96 96 ASN N N 15 122.648 0.100 . 1 . . . . 106 . . . 7257 1 1195 . 1 1 96 96 ASN ND2 N 15 112.504 0.100 . 1 . . . . 106 . . . 7257 1 1196 . 1 1 97 97 GLY H H 1 7.947 0.010 . 1 . . . . 107 . . . 7257 1 1197 . 1 1 97 97 GLY HA2 H 1 4.015 0.010 . 2 . . . . 107 . . . 7257 1 1198 . 1 1 97 97 GLY HA3 H 1 4.033 0.010 . 2 . . . . 107 . . . 7257 1 1199 . 1 1 97 97 GLY C C 13 171.805 0.100 . 1 . . . . 107 . . . 7257 1 1200 . 1 1 97 97 GLY CA C 13 44.796 0.100 . 1 . . . . 107 . . . 7257 1 1201 . 1 1 97 97 GLY N N 15 110.220 0.100 . 1 . . . . 107 . . . 7257 1 1202 . 1 1 98 98 PRO HA H 1 4.364 0.010 . 1 . . . . 108 . . . 7257 1 1203 . 1 1 98 98 PRO HB2 H 1 2.192 0.010 . 2 . . . . 108 . . . 7257 1 1204 . 1 1 98 98 PRO HB3 H 1 1.807 0.010 . 2 . . . . 108 . . . 7257 1 1205 . 1 1 98 98 PRO HG2 H 1 2.017 0.010 . 1 . . . . 108 . . . 7257 1 1206 . 1 1 98 98 PRO HG3 H 1 2.017 0.010 . 1 . . . . 108 . . . 7257 1 1207 . 1 1 98 98 PRO HD2 H 1 3.605 0.010 . 1 . . . . 108 . . . 7257 1 1208 . 1 1 98 98 PRO HD3 H 1 3.605 0.010 . 1 . . . . 108 . . . 7257 1 1209 . 1 1 98 98 PRO C C 13 176.540 0.100 . 1 . . . . 108 . . . 7257 1 1210 . 1 1 98 98 PRO CA C 13 63.173 0.100 . 1 . . . . 108 . . . 7257 1 1211 . 1 1 98 98 PRO CB C 13 31.983 0.100 . 1 . . . . 108 . . . 7257 1 1212 . 1 1 98 98 PRO CG C 13 27.290 0.100 . 1 . . . . 108 . . . 7257 1 1213 . 1 1 98 98 PRO CD C 13 50.170 0.100 . 1 . . . . 108 . . . 7257 1 1214 . 1 1 99 99 LEU H H 1 8.463 0.010 . 1 . . . . 109 . . . 7257 1 1215 . 1 1 99 99 LEU HA H 1 4.235 0.010 . 1 . . . . 109 . . . 7257 1 1216 . 1 1 99 99 LEU HB2 H 1 1.720 0.010 . 1 . . . . 109 . . . 7257 1 1217 . 1 1 99 99 LEU HB3 H 1 1.720 0.010 . 1 . . . . 109 . . . 7257 1 1218 . 1 1 99 99 LEU HG H 1 1.368 0.010 . 1 . . . . 109 . . . 7257 1 1219 . 1 1 99 99 LEU HD11 H 1 0.930 0.010 . 1 . . . . 109 . . . 7257 1 1220 . 1 1 99 99 LEU HD12 H 1 0.930 0.010 . 1 . . . . 109 . . . 7257 1 1221 . 1 1 99 99 LEU HD13 H 1 0.930 0.010 . 1 . . . . 109 . . . 7257 1 1222 . 1 1 99 99 LEU HD21 H 1 0.930 0.010 . 1 . . . . 109 . . . 7257 1 1223 . 1 1 99 99 LEU HD22 H 1 0.930 0.010 . 1 . . . . 109 . . . 7257 1 1224 . 1 1 99 99 LEU HD23 H 1 0.930 0.010 . 1 . . . . 109 . . . 7257 1 1225 . 1 1 99 99 LEU C C 13 176.920 0.100 . 1 . . . . 109 . . . 7257 1 1226 . 1 1 99 99 LEU CA C 13 55.210 0.100 . 1 . . . . 109 . . . 7257 1 1227 . 1 1 99 99 LEU CB C 13 42.351 0.100 . 1 . . . . 109 . . . 7257 1 1228 . 1 1 99 99 LEU CG C 13 26.870 0.100 . 1 . . . . 109 . . . 7257 1 1229 . 1 1 99 99 LEU CD1 C 13 23.000 0.100 . 1 . . . . 109 . . . 7257 1 1230 . 1 1 99 99 LEU CD2 C 13 23.000 0.100 . 1 . . . . 109 . . . 7257 1 1231 . 1 1 99 99 LEU N N 15 121.693 0.100 . 1 . . . . 109 . . . 7257 1 1232 . 1 1 100 100 GLU H H 1 8.215 0.010 . 1 . . . . 110 . . . 7257 1 1233 . 1 1 100 100 GLU HA H 1 4.177 0.010 . 1 . . . . 110 . . . 7257 1 1234 . 1 1 100 100 GLU HB2 H 1 1.860 0.010 . 1 . . . . 110 . . . 7257 1 1235 . 1 1 100 100 GLU HB3 H 1 1.860 0.010 . 1 . . . . 110 . . . 7257 1 1236 . 1 1 100 100 GLU HG2 H 1 2.207 0.010 . 1 . . . . 110 . . . 7257 1 1237 . 1 1 100 100 GLU HG3 H 1 2.207 0.010 . 1 . . . . 110 . . . 7257 1 1238 . 1 1 100 100 GLU C C 13 176.160 0.100 . 1 . . . . 110 . . . 7257 1 1239 . 1 1 100 100 GLU CA C 13 56.465 0.100 . 1 . . . . 110 . . . 7257 1 1240 . 1 1 100 100 GLU CB C 13 30.290 0.100 . 1 . . . . 110 . . . 7257 1 1241 . 1 1 100 100 GLU CG C 13 35.690 0.100 . 1 . . . . 110 . . . 7257 1 1242 . 1 1 100 100 GLU N N 15 120.923 0.100 . 1 . . . . 110 . . . 7257 1 1243 . 1 1 101 101 HIS H H 1 8.448 0.010 . 1 . . . . 111 . . . 7257 1 1244 . 1 1 101 101 HIS HA H 1 4.800 0.010 . 1 . . . . 111 . . . 7257 1 1245 . 1 1 101 101 HIS HB2 H 1 3.055 0.010 . 2 . . . . 111 . . . 7257 1 1246 . 1 1 101 101 HIS HB3 H 1 3.143 0.010 . 2 . . . . 111 . . . 7257 1 1247 . 1 1 101 101 HIS C C 13 174.477 0.100 . 1 . . . . 111 . . . 7257 1 1248 . 1 1 101 101 HIS CA C 13 55.479 0.100 . 1 . . . . 111 . . . 7257 1 1249 . 1 1 101 101 HIS CB C 13 29.233 0.100 . 1 . . . . 111 . . . 7257 1 1250 . 1 1 101 101 HIS N N 15 119.493 0.100 . 1 . . . . 111 . . . 7257 1 stop_ save_