data_53627 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 53627 _Entry.Title ; 1H, 15N, and 13C chemical shift assignments for the N-terminal region (residues 1-168) of the human DEAD-box RNA helicase DDX3X ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2026-03-15 _Entry.Accession_date 2026-03-15 _Entry.Last_release_date 2026-03-16 _Entry.Original_release_date 2026-03-16 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Yuki Toyama . . . 0000-0003-0457-678X 53627 2 Koh Takeuchi . . . 0000-0002-6227-4627 53627 3 Ichio Shimada . . . 0000-0001-5168-8894 53627 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 53627 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 472 53627 '15N chemical shifts' 159 53627 '1H chemical shifts' 159 53627 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 . . 2026-06-06 . original BMRB . 53627 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 52738 '1H, 15N, and 13C chemical shift assignments for the N-terminal region (residues 1-132) of the human DEAD-box RNA helicase DDX3X' 53627 BMRB 52739 ; 1H, 15N, and 13C chemical shift assignments for the N-terminal region (residues 1-132) of the human DEAD-box RNA helicase DDX3X RtoK variant ; 53627 BMRB 52740 ; 1H, 15N, and 13C chemical shift assignments for the N-terminal region (residues 1-132) of the human DEAD-box RNA helicase DDX3X FYtoA variant ; 53627 BMRB 52741 ; 1H, 15N, and 13C chemical shift assignments for the N-terminal region (residues 1-132) of the human DEAD-box RNA helicase DDX3X RKtoA-1 variant ; 53627 BMRB 52742 ; 1H, 15N, and 13C chemical shift assignments for the N-terminal region (residues 1-132) of the human DEAD-box RNA helicase DDX3X RKtoA-2 variant ; 53627 BMRB 52743 ; 1H, 15N, and 13C chemical shift assignments for the N-terminal region (residues 1-132) of the human DEAD-box RNA helicase DDX3X RKtoA-3 variant ; 53627 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 53627 _Citation.ID 1 _Citation.Name . _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 40877262 _Citation.DOI 10.1038/s41467-025-62806-7 _Citation.Full_citation . _Citation.Title ; Regulatory role of the N-terminal intrinsically disordered region of the DEAD-box RNA helicase DDX3X in selective RNA recognition. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Commun.' _Citation.Journal_name_full 'Nature communications' _Citation.Journal_volume 16 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2041-1723 _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 7762 _Citation.Page_last 7762 _Citation.Year 2025 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Yuki Toyama Y. . . . 53627 1 2 Koh Takeuchi K. . . . 53627 1 3 Ichio Shimada I. . . . 53627 1 stop_ save_ save_citations_2 _Citation.Sf_category citations _Citation.Sf_framecode citations_2 _Citation.Entry_ID 53627 _Citation.ID 2 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 42159288 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Phase Separation Driven by Dynamic Interactions in the N-Terminal Intrinsically Disordered Region of the DEAD-Box RNA Helicase DDX3X ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Am. Chem. Soc.' _Citation.Journal_name_full 'Journal of the American Chemical Society' _Citation.Journal_volume 148 _Citation.Journal_issue 21 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1520-5126 _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 21313 _Citation.Page_last 21331 _Citation.Year 2026 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Yuki Toyama Y. . . . 53627 2 2 Shinichiro Inakami S. . . . 53627 2 3 Masaharu Takarada M. . . . 53627 2 4 Kohki Okabe K. . . . 53627 2 5 Koh Takeuchi K. . . . 53627 2 6 Ichio Shimada I. . . . 53627 2 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 53627 _Assembly.ID 1 _Assembly.Name N-IDR _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 N-IDR 1 $entity_1 . . yes native no no . . . 53627 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 53627 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MSHVAVENALGLDQQFAGLD LNSSDNQSGGSTASKGRYIP PHLRNREATKGFYDKDSSGW SSSKDKDAYSSFGSRSDSRG KSSFFSDRGSGSRGRFDDRG RSDYDGIGSRGDRSGFGKFE RGGNSRWCDKSDEDDWSKPL PPSERLEQELFSGGNTGINF EKYDDIPV ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 168 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _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 . 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 yes UNP O00571 . 'ATP-dependent RNA helicase DDX3X' . . . . . . . . . . . . . . 53627 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 . MET . 53627 1 2 . SER . 53627 1 3 . HIS . 53627 1 4 . VAL . 53627 1 5 . ALA . 53627 1 6 . VAL . 53627 1 7 . GLU . 53627 1 8 . ASN . 53627 1 9 . ALA . 53627 1 10 . LEU . 53627 1 11 . GLY . 53627 1 12 . LEU . 53627 1 13 . ASP . 53627 1 14 . GLN . 53627 1 15 . GLN . 53627 1 16 . PHE . 53627 1 17 . ALA . 53627 1 18 . GLY . 53627 1 19 . LEU . 53627 1 20 . ASP . 53627 1 21 . LEU . 53627 1 22 . ASN . 53627 1 23 . SER . 53627 1 24 . SER . 53627 1 25 . ASP . 53627 1 26 . ASN . 53627 1 27 . GLN . 53627 1 28 . SER . 53627 1 29 . GLY . 53627 1 30 . GLY . 53627 1 31 . SER . 53627 1 32 . THR . 53627 1 33 . ALA . 53627 1 34 . SER . 53627 1 35 . LYS . 53627 1 36 . GLY . 53627 1 37 . ARG . 53627 1 38 . TYR . 53627 1 39 . ILE . 53627 1 40 . PRO . 53627 1 41 . PRO . 53627 1 42 . HIS . 53627 1 43 . LEU . 53627 1 44 . ARG . 53627 1 45 . ASN . 53627 1 46 . ARG . 53627 1 47 . GLU . 53627 1 48 . ALA . 53627 1 49 . THR . 53627 1 50 . LYS . 53627 1 51 . GLY . 53627 1 52 . PHE . 53627 1 53 . TYR . 53627 1 54 . ASP . 53627 1 55 . LYS . 53627 1 56 . ASP . 53627 1 57 . SER . 53627 1 58 . SER . 53627 1 59 . GLY . 53627 1 60 . TRP . 53627 1 61 . SER . 53627 1 62 . SER . 53627 1 63 . SER . 53627 1 64 . LYS . 53627 1 65 . ASP . 53627 1 66 . LYS . 53627 1 67 . ASP . 53627 1 68 . ALA . 53627 1 69 . TYR . 53627 1 70 . SER . 53627 1 71 . SER . 53627 1 72 . PHE . 53627 1 73 . GLY . 53627 1 74 . SER . 53627 1 75 . ARG . 53627 1 76 . SER . 53627 1 77 . ASP . 53627 1 78 . SER . 53627 1 79 . ARG . 53627 1 80 . GLY . 53627 1 81 . LYS . 53627 1 82 . SER . 53627 1 83 . SER . 53627 1 84 . PHE . 53627 1 85 . PHE . 53627 1 86 . SER . 53627 1 87 . ASP . 53627 1 88 . ARG . 53627 1 89 . GLY . 53627 1 90 . SER . 53627 1 91 . GLY . 53627 1 92 . SER . 53627 1 93 . ARG . 53627 1 94 . GLY . 53627 1 95 . ARG . 53627 1 96 . PHE . 53627 1 97 . ASP . 53627 1 98 . ASP . 53627 1 99 . ARG . 53627 1 100 . GLY . 53627 1 101 . ARG . 53627 1 102 . SER . 53627 1 103 . ASP . 53627 1 104 . TYR . 53627 1 105 . ASP . 53627 1 106 . GLY . 53627 1 107 . ILE . 53627 1 108 . GLY . 53627 1 109 . SER . 53627 1 110 . ARG . 53627 1 111 . GLY . 53627 1 112 . ASP . 53627 1 113 . ARG . 53627 1 114 . SER . 53627 1 115 . GLY . 53627 1 116 . PHE . 53627 1 117 . GLY . 53627 1 118 . LYS . 53627 1 119 . PHE . 53627 1 120 . GLU . 53627 1 121 . ARG . 53627 1 122 . GLY . 53627 1 123 . GLY . 53627 1 124 . ASN . 53627 1 125 . SER . 53627 1 126 . ARG . 53627 1 127 . TRP . 53627 1 128 . CYS . 53627 1 129 . ASP . 53627 1 130 . LYS . 53627 1 131 . SER . 53627 1 132 . ASP . 53627 1 133 . GLU . 53627 1 134 . ASP . 53627 1 135 . ASP . 53627 1 136 . TRP . 53627 1 137 . SER . 53627 1 138 . LYS . 53627 1 139 . PRO . 53627 1 140 . LEU . 53627 1 141 . PRO . 53627 1 142 . PRO . 53627 1 143 . SER . 53627 1 144 . GLU . 53627 1 145 . ARG . 53627 1 146 . LEU . 53627 1 147 . GLU . 53627 1 148 . GLN . 53627 1 149 . GLU . 53627 1 150 . LEU . 53627 1 151 . PHE . 53627 1 152 . SER . 53627 1 153 . GLY . 53627 1 154 . GLY . 53627 1 155 . ASN . 53627 1 156 . THR . 53627 1 157 . GLY . 53627 1 158 . ILE . 53627 1 159 . ASN . 53627 1 160 . PHE . 53627 1 161 . GLU . 53627 1 162 . LYS . 53627 1 163 . TYR . 53627 1 164 . ASP . 53627 1 165 . ASP . 53627 1 166 . ILE . 53627 1 167 . PRO . 53627 1 168 . VAL . 53627 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 53627 1 . SER 2 2 53627 1 . HIS 3 3 53627 1 . VAL 4 4 53627 1 . ALA 5 5 53627 1 . VAL 6 6 53627 1 . GLU 7 7 53627 1 . ASN 8 8 53627 1 . ALA 9 9 53627 1 . LEU 10 10 53627 1 . GLY 11 11 53627 1 . LEU 12 12 53627 1 . ASP 13 13 53627 1 . GLN 14 14 53627 1 . GLN 15 15 53627 1 . PHE 16 16 53627 1 . ALA 17 17 53627 1 . GLY 18 18 53627 1 . LEU 19 19 53627 1 . ASP 20 20 53627 1 . LEU 21 21 53627 1 . ASN 22 22 53627 1 . SER 23 23 53627 1 . SER 24 24 53627 1 . ASP 25 25 53627 1 . ASN 26 26 53627 1 . GLN 27 27 53627 1 . SER 28 28 53627 1 . GLY 29 29 53627 1 . GLY 30 30 53627 1 . SER 31 31 53627 1 . THR 32 32 53627 1 . ALA 33 33 53627 1 . SER 34 34 53627 1 . LYS 35 35 53627 1 . GLY 36 36 53627 1 . ARG 37 37 53627 1 . TYR 38 38 53627 1 . ILE 39 39 53627 1 . PRO 40 40 53627 1 . PRO 41 41 53627 1 . HIS 42 42 53627 1 . LEU 43 43 53627 1 . ARG 44 44 53627 1 . ASN 45 45 53627 1 . ARG 46 46 53627 1 . GLU 47 47 53627 1 . ALA 48 48 53627 1 . THR 49 49 53627 1 . LYS 50 50 53627 1 . GLY 51 51 53627 1 . PHE 52 52 53627 1 . TYR 53 53 53627 1 . ASP 54 54 53627 1 . LYS 55 55 53627 1 . ASP 56 56 53627 1 . SER 57 57 53627 1 . SER 58 58 53627 1 . GLY 59 59 53627 1 . TRP 60 60 53627 1 . SER 61 61 53627 1 . SER 62 62 53627 1 . SER 63 63 53627 1 . LYS 64 64 53627 1 . ASP 65 65 53627 1 . LYS 66 66 53627 1 . ASP 67 67 53627 1 . ALA 68 68 53627 1 . TYR 69 69 53627 1 . SER 70 70 53627 1 . SER 71 71 53627 1 . PHE 72 72 53627 1 . GLY 73 73 53627 1 . SER 74 74 53627 1 . ARG 75 75 53627 1 . SER 76 76 53627 1 . ASP 77 77 53627 1 . SER 78 78 53627 1 . ARG 79 79 53627 1 . GLY 80 80 53627 1 . LYS 81 81 53627 1 . SER 82 82 53627 1 . SER 83 83 53627 1 . PHE 84 84 53627 1 . PHE 85 85 53627 1 . SER 86 86 53627 1 . ASP 87 87 53627 1 . ARG 88 88 53627 1 . GLY 89 89 53627 1 . SER 90 90 53627 1 . GLY 91 91 53627 1 . SER 92 92 53627 1 . ARG 93 93 53627 1 . GLY 94 94 53627 1 . ARG 95 95 53627 1 . PHE 96 96 53627 1 . ASP 97 97 53627 1 . ASP 98 98 53627 1 . ARG 99 99 53627 1 . GLY 100 100 53627 1 . ARG 101 101 53627 1 . SER 102 102 53627 1 . ASP 103 103 53627 1 . TYR 104 104 53627 1 . ASP 105 105 53627 1 . GLY 106 106 53627 1 . ILE 107 107 53627 1 . GLY 108 108 53627 1 . SER 109 109 53627 1 . ARG 110 110 53627 1 . GLY 111 111 53627 1 . ASP 112 112 53627 1 . ARG 113 113 53627 1 . SER 114 114 53627 1 . GLY 115 115 53627 1 . PHE 116 116 53627 1 . GLY 117 117 53627 1 . LYS 118 118 53627 1 . PHE 119 119 53627 1 . GLU 120 120 53627 1 . ARG 121 121 53627 1 . GLY 122 122 53627 1 . GLY 123 123 53627 1 . ASN 124 124 53627 1 . SER 125 125 53627 1 . ARG 126 126 53627 1 . TRP 127 127 53627 1 . CYS 128 128 53627 1 . ASP 129 129 53627 1 . LYS 130 130 53627 1 . SER 131 131 53627 1 . ASP 132 132 53627 1 . GLU 133 133 53627 1 . ASP 134 134 53627 1 . ASP 135 135 53627 1 . TRP 136 136 53627 1 . SER 137 137 53627 1 . LYS 138 138 53627 1 . PRO 139 139 53627 1 . LEU 140 140 53627 1 . PRO 141 141 53627 1 . PRO 142 142 53627 1 . SER 143 143 53627 1 . GLU 144 144 53627 1 . ARG 145 145 53627 1 . LEU 146 146 53627 1 . GLU 147 147 53627 1 . GLN 148 148 53627 1 . GLU 149 149 53627 1 . LEU 150 150 53627 1 . PHE 151 151 53627 1 . SER 152 152 53627 1 . GLY 153 153 53627 1 . GLY 154 154 53627 1 . ASN 155 155 53627 1 . THR 156 156 53627 1 . GLY 157 157 53627 1 . ILE 158 158 53627 1 . ASN 159 159 53627 1 . PHE 160 160 53627 1 . GLU 161 161 53627 1 . LYS 162 162 53627 1 . TYR 163 163 53627 1 . ASP 164 164 53627 1 . ASP 165 165 53627 1 . ILE 166 166 53627 1 . PRO 167 167 53627 1 . VAL 168 168 53627 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 53627 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 53627 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 53627 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . pET-SUMO . . . 53627 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 53627 _Sample.ID 1 _Sample.Name N-IDR _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 N-IDR '[U-13C; U-15N]' . . 1 $entity_1 . . 270 . . uM . . . . 53627 1 2 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 53627 1 3 'potassium chloride' 'natural abundance' . . . . . . 200 . . mM . . . . 53627 1 4 DTT 'natural abundance' . . . . . . 5 . . mM . . . . 53627 1 5 EDTA 'natural abundance' . . . . . . 1 . . mM . . . . 53627 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 53627 _Sample_condition_list.ID 1 _Sample_condition_list.Name N-IDR _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 6.0 . pH 53627 1 pressure 1 . atm 53627 1 temperature 283.15 . K 53627 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 53627 _Software.ID 1 _Software.Type . _Software.Name NMRFAM-SPARKY _Software.Version 1.470 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 53627 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 53627 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version 11.1 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 53627 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 53627 _Software.ID 3 _Software.Type . _Software.Name TOPSPIN _Software.Version 3.5pl7 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 53627 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 53627 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 800 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III HD' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 53627 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no no . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53627 1 2 '3D HNCO' no yes . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53627 1 3 '3D HNCACB' no yes . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53627 1 4 '3D CBCACONH' no yes . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53627 1 5 '3D HNN' no yes . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53627 1 6 '3D HNCACO' no yes . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53627 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 53627 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name Reference _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 water protons . . . . ppm 4.916201 internal indirect 0.251449530 . . . . . 53627 1 H 1 water protons . . . . ppm 4.916201 internal direct 1 . . . . . 53627 1 N 15 water protons . . . . ppm 4.916201 internal indirect 0.101329118 . . . . . 53627 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 53627 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name N-IDR _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 53627 1 2 '3D HNCO' . . . 53627 1 3 '3D HNCACB' . . . 53627 1 4 '3D CBCACONH' . . . 53627 1 5 '3D HNN' . . . 53627 1 6 '3D HNCACO' . . . 53627 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 53627 1 2 $software_2 . . 53627 1 3 $software_3 . . 53627 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 SER C C 13 173.798 0.00 . 1 . . . . . 2 SER C . 53627 1 2 . 1 . 1 2 2 SER CA C 13 58.203 0.00 . 1 . . . . . 2 SER CA . 53627 1 3 . 1 . 1 2 2 SER CB C 13 63.807 0.00 . 1 . . . . . 2 SER CB . 53627 1 4 . 1 . 1 3 3 HIS H H 1 8.750 0.00 . 1 . . . . . 3 HIS H . 53627 1 5 . 1 . 1 3 3 HIS C C 13 174.360 0.00 . 1 . . . . . 3 HIS C . 53627 1 6 . 1 . 1 3 3 HIS CA C 13 55.616 0.00 . 1 . . . . . 3 HIS CA . 53627 1 7 . 1 . 1 3 3 HIS CB C 13 29.520 0.00 . 1 . . . . . 3 HIS CB . 53627 1 8 . 1 . 1 3 3 HIS N N 15 121.395 0.00 . 1 . . . . . 3 HIS N . 53627 1 9 . 1 . 1 4 4 VAL H H 1 8.210 0.00 . 1 . . . . . 4 VAL H . 53627 1 10 . 1 . 1 4 4 VAL C C 13 175.587 0.00 . 1 . . . . . 4 VAL C . 53627 1 11 . 1 . 1 4 4 VAL CA C 13 62.245 0.00 . 1 . . . . . 4 VAL CA . 53627 1 12 . 1 . 1 4 4 VAL CB C 13 32.804 0.00 . 1 . . . . . 4 VAL CB . 53627 1 13 . 1 . 1 4 4 VAL N N 15 122.060 0.01 . 1 . . . . . 4 VAL N . 53627 1 14 . 1 . 1 5 5 ALA H H 1 8.494 0.00 . 1 . . . . . 5 ALA H . 53627 1 15 . 1 . 1 5 5 ALA C C 13 177.711 0.00 . 1 . . . . . 5 ALA C . 53627 1 16 . 1 . 1 5 5 ALA CA C 13 52.482 0.00 . 1 . . . . . 5 ALA CA . 53627 1 17 . 1 . 1 5 5 ALA CB C 13 19.190 0.00 . 1 . . . . . 5 ALA CB . 53627 1 18 . 1 . 1 5 5 ALA N N 15 128.572 0.00 . 1 . . . . . 5 ALA N . 53627 1 19 . 1 . 1 6 6 VAL H H 1 8.230 0.00 . 1 . . . . . 6 VAL H . 53627 1 20 . 1 . 1 6 6 VAL C C 13 176.329 0.00 . 1 . . . . . 6 VAL C . 53627 1 21 . 1 . 1 6 6 VAL CA C 13 62.476 0.00 . 1 . . . . . 6 VAL CA . 53627 1 22 . 1 . 1 6 6 VAL CB C 13 32.788 0.00 . 1 . . . . . 6 VAL CB . 53627 1 23 . 1 . 1 6 6 VAL N N 15 120.272 0.00 . 1 . . . . . 6 VAL N . 53627 1 24 . 1 . 1 7 7 GLU H H 1 8.589 0.00 . 1 . . . . . 7 GLU H . 53627 1 25 . 1 . 1 7 7 GLU C C 13 176.273 0.00 . 1 . . . . . 7 GLU C . 53627 1 26 . 1 . 1 7 7 GLU CA C 13 56.732 0.00 . 1 . . . . . 7 GLU CA . 53627 1 27 . 1 . 1 7 7 GLU CB C 13 30.143 0.00 . 1 . . . . . 7 GLU CB . 53627 1 28 . 1 . 1 7 7 GLU N N 15 124.507 0.00 . 1 . . . . . 7 GLU N . 53627 1 29 . 1 . 1 8 8 ASN H H 1 8.518 0.00 . 1 . . . . . 8 ASN H . 53627 1 30 . 1 . 1 8 8 ASN C C 13 175.047 0.00 . 1 . . . . . 8 ASN C . 53627 1 31 . 1 . 1 8 8 ASN CA C 13 53.215 0.00 . 1 . . . . . 8 ASN CA . 53627 1 32 . 1 . 1 8 8 ASN CB C 13 38.874 0.00 . 1 . . . . . 8 ASN CB . 53627 1 33 . 1 . 1 8 8 ASN N N 15 119.936 0.00 . 1 . . . . . 8 ASN N . 53627 1 34 . 1 . 1 9 9 ALA H H 1 8.354 0.00 . 1 . . . . . 9 ALA H . 53627 1 35 . 1 . 1 9 9 ALA C C 13 177.851 0.00 . 1 . . . . . 9 ALA C . 53627 1 36 . 1 . 1 9 9 ALA CA C 13 52.992 0.00 . 1 . . . . . 9 ALA CA . 53627 1 37 . 1 . 1 9 9 ALA CB C 13 19.084 0.00 . 1 . . . . . 9 ALA CB . 53627 1 38 . 1 . 1 9 9 ALA N N 15 124.537 0.00 . 1 . . . . . 9 ALA N . 53627 1 39 . 1 . 1 10 10 LEU H H 1 8.245 0.00 . 1 . . . . . 10 LEU H . 53627 1 40 . 1 . 1 10 10 LEU C C 13 178.038 0.00 . 1 . . . . . 10 LEU C . 53627 1 41 . 1 . 1 10 10 LEU CA C 13 55.312 0.00 . 1 . . . . . 10 LEU CA . 53627 1 42 . 1 . 1 10 10 LEU CB C 13 42.232 0.00 . 1 . . . . . 10 LEU CB . 53627 1 43 . 1 . 1 10 10 LEU N N 15 120.376 0.00 . 1 . . . . . 10 LEU N . 53627 1 44 . 1 . 1 11 11 GLY H H 1 8.333 0.00 . 1 . . . . . 11 GLY H . 53627 1 45 . 1 . 1 11 11 GLY C C 13 174.468 0.00 . 1 . . . . . 11 GLY C . 53627 1 46 . 1 . 1 11 11 GLY CA C 13 45.444 0.00 . 1 . . . . . 11 GLY CA . 53627 1 47 . 1 . 1 11 11 GLY N N 15 109.073 0.00 . 1 . . . . . 11 GLY N . 53627 1 48 . 1 . 1 12 12 LEU H H 1 8.149 0.00 . 1 . . . . . 12 LEU H . 53627 1 49 . 1 . 1 12 12 LEU C C 13 177.488 0.00 . 1 . . . . . 12 LEU C . 53627 1 50 . 1 . 1 12 12 LEU CA C 13 55.516 0.00 . 1 . . . . . 12 LEU CA . 53627 1 51 . 1 . 1 12 12 LEU CB C 13 42.259 0.00 . 1 . . . . . 12 LEU CB . 53627 1 52 . 1 . 1 12 12 LEU N N 15 121.461 0.00 . 1 . . . . . 12 LEU N . 53627 1 53 . 1 . 1 13 13 ASP H H 1 8.487 0.00 . 1 . . . . . 13 ASP H . 53627 1 54 . 1 . 1 13 13 ASP C C 13 176.532 0.00 . 1 . . . . . 13 ASP C . 53627 1 55 . 1 . 1 13 13 ASP CA C 13 54.626 0.00 . 1 . . . . . 13 ASP CA . 53627 1 56 . 1 . 1 13 13 ASP CB C 13 40.770 0.00 . 1 . . . . . 13 ASP CB . 53627 1 57 . 1 . 1 13 13 ASP N N 15 120.250 0.00 . 1 . . . . . 13 ASP N . 53627 1 58 . 1 . 1 14 14 GLN H H 1 8.241 0.00 . 1 . . . . . 14 GLN H . 53627 1 59 . 1 . 1 14 14 GLN C C 13 176.138 0.00 . 1 . . . . . 14 GLN C . 53627 1 60 . 1 . 1 14 14 GLN CA C 13 56.803 0.00 . 1 . . . . . 14 GLN CA . 53627 1 61 . 1 . 1 14 14 GLN CB C 13 29.250 0.00 . 1 . . . . . 14 GLN CB . 53627 1 62 . 1 . 1 14 14 GLN N N 15 120.321 0.00 . 1 . . . . . 14 GLN N . 53627 1 63 . 1 . 1 15 15 GLN H H 1 8.331 0.00 . 1 . . . . . 15 GLN H . 53627 1 64 . 1 . 1 15 15 GLN C C 13 175.918 0.00 . 1 . . . . . 15 GLN C . 53627 1 65 . 1 . 1 15 15 GLN CA C 13 56.395 0.00 . 1 . . . . . 15 GLN CA . 53627 1 66 . 1 . 1 15 15 GLN CB C 13 29.134 0.00 . 1 . . . . . 15 GLN CB . 53627 1 67 . 1 . 1 15 15 GLN N N 15 120.584 0.02 . 1 . . . . . 15 GLN N . 53627 1 68 . 1 . 1 16 16 PHE H H 1 8.258 0.00 . 1 . . . . . 16 PHE H . 53627 1 69 . 1 . 1 16 16 PHE C C 13 175.593 0.01 . 1 . . . . . 16 PHE C . 53627 1 70 . 1 . 1 16 16 PHE CA C 13 57.585 0.00 . 1 . . . . . 16 PHE CA . 53627 1 71 . 1 . 1 16 16 PHE CB C 13 39.375 0.00 . 1 . . . . . 16 PHE CB . 53627 1 72 . 1 . 1 16 16 PHE N N 15 120.396 0.00 . 1 . . . . . 16 PHE N . 53627 1 73 . 1 . 1 17 17 ALA H H 1 8.202 0.00 . 1 . . . . . 17 ALA H . 53627 1 74 . 1 . 1 17 17 ALA C C 13 177.910 0.00 . 1 . . . . . 17 ALA C . 53627 1 75 . 1 . 1 17 17 ALA CA C 13 52.740 0.00 . 1 . . . . . 17 ALA CA . 53627 1 76 . 1 . 1 17 17 ALA CB C 13 19.223 0.00 . 1 . . . . . 17 ALA CB . 53627 1 77 . 1 . 1 17 17 ALA N N 15 125.579 0.00 . 1 . . . . . 17 ALA N . 53627 1 78 . 1 . 1 18 18 GLY H H 1 7.988 0.00 . 1 . . . . . 18 GLY H . 53627 1 79 . 1 . 1 18 18 GLY C C 13 173.991 0.00 . 1 . . . . . 18 GLY C . 53627 1 80 . 1 . 1 18 18 GLY CA C 13 45.308 0.00 . 1 . . . . . 18 GLY CA . 53627 1 81 . 1 . 1 18 18 GLY N N 15 107.566 0.00 . 1 . . . . . 18 GLY N . 53627 1 82 . 1 . 1 19 19 LEU H H 1 8.035 0.00 . 1 . . . . . 19 LEU H . 53627 1 83 . 1 . 1 19 19 LEU C C 13 176.912 0.00 . 1 . . . . . 19 LEU C . 53627 1 84 . 1 . 1 19 19 LEU CA C 13 55.080 0.00 . 1 . . . . . 19 LEU CA . 53627 1 85 . 1 . 1 19 19 LEU CB C 13 42.597 0.00 . 1 . . . . . 19 LEU CB . 53627 1 86 . 1 . 1 19 19 LEU N N 15 121.231 0.00 . 1 . . . . . 19 LEU N . 53627 1 87 . 1 . 1 20 20 ASP H H 1 8.479 0.00 . 1 . . . . . 20 ASP H . 53627 1 88 . 1 . 1 20 20 ASP C C 13 176.386 0.00 . 1 . . . . . 20 ASP C . 53627 1 89 . 1 . 1 20 20 ASP CA C 13 53.932 0.00 . 1 . . . . . 20 ASP CA . 53627 1 90 . 1 . 1 20 20 ASP CB C 13 40.852 0.00 . 1 . . . . . 20 ASP CB . 53627 1 91 . 1 . 1 20 20 ASP N N 15 121.189 0.00 . 1 . . . . . 20 ASP N . 53627 1 92 . 1 . 1 21 21 LEU H H 1 8.316 0.00 . 1 . . . . . 21 LEU H . 53627 1 93 . 1 . 1 21 21 LEU C C 13 177.487 0.00 . 1 . . . . . 21 LEU C . 53627 1 94 . 1 . 1 21 21 LEU CA C 13 55.578 0.00 . 1 . . . . . 21 LEU CA . 53627 1 95 . 1 . 1 21 21 LEU CB C 13 41.968 0.00 . 1 . . . . . 21 LEU CB . 53627 1 96 . 1 . 1 21 21 LEU N N 15 123.343 0.01 . 1 . . . . . 21 LEU N . 53627 1 97 . 1 . 1 22 22 ASN H H 1 8.518 0.00 . 1 . . . . . 22 ASN H . 53627 1 98 . 1 . 1 22 22 ASN C C 13 175.412 0.00 . 1 . . . . . 22 ASN C . 53627 1 99 . 1 . 1 22 22 ASN CA C 13 53.418 0.00 . 1 . . . . . 22 ASN CA . 53627 1 100 . 1 . 1 22 22 ASN CB C 13 38.930 0.00 . 1 . . . . . 22 ASN CB . 53627 1 101 . 1 . 1 22 22 ASN N N 15 118.548 0.00 . 1 . . . . . 22 ASN N . 53627 1 102 . 1 . 1 23 23 SER H H 1 8.175 0.00 . 1 . . . . . 23 SER H . 53627 1 103 . 1 . 1 23 23 SER C C 13 174.946 0.00 . 1 . . . . . 23 SER C . 53627 1 104 . 1 . 1 23 23 SER CA C 13 58.605 0.00 . 1 . . . . . 23 SER CA . 53627 1 105 . 1 . 1 23 23 SER CB C 13 63.754 0.00 . 1 . . . . . 23 SER CB . 53627 1 106 . 1 . 1 23 23 SER N N 15 116.133 0.00 . 1 . . . . . 23 SER N . 53627 1 107 . 1 . 1 24 24 SER H H 1 8.472 0.00 . 1 . . . . . 24 SER H . 53627 1 108 . 1 . 1 24 24 SER C C 13 174.453 0.00 . 1 . . . . . 24 SER C . 53627 1 109 . 1 . 1 24 24 SER CA C 13 58.844 0.00 . 1 . . . . . 24 SER CA . 53627 1 110 . 1 . 1 24 24 SER CB C 13 63.729 0.00 . 1 . . . . . 24 SER CB . 53627 1 111 . 1 . 1 24 24 SER N N 15 117.982 0.00 . 1 . . . . . 24 SER N . 53627 1 112 . 1 . 1 25 25 ASP H H 1 8.334 0.00 . 1 . . . . . 25 ASP H . 53627 1 113 . 1 . 1 25 25 ASP C C 13 176.106 0.00 . 1 . . . . . 25 ASP C . 53627 1 114 . 1 . 1 25 25 ASP CA C 13 54.533 0.00 . 1 . . . . . 25 ASP CA . 53627 1 115 . 1 . 1 25 25 ASP CB C 13 40.998 0.00 . 1 . . . . . 25 ASP CB . 53627 1 116 . 1 . 1 25 25 ASP N N 15 121.889 0.00 . 1 . . . . . 25 ASP N . 53627 1 117 . 1 . 1 26 26 ASN H H 1 8.324 0.00 . 1 . . . . . 26 ASN H . 53627 1 118 . 1 . 1 26 26 ASN C C 13 175.520 0.00 . 1 . . . . . 26 ASN C . 53627 1 119 . 1 . 1 26 26 ASN CA C 13 53.456 0.00 . 1 . . . . . 26 ASN CA . 53627 1 120 . 1 . 1 26 26 ASN CB C 13 38.683 0.00 . 1 . . . . . 26 ASN CB . 53627 1 121 . 1 . 1 26 26 ASN N N 15 118.849 0.00 . 1 . . . . . 26 ASN N . 53627 1 122 . 1 . 1 27 27 GLN H H 1 8.424 0.00 . 1 . . . . . 27 GLN H . 53627 1 123 . 1 . 1 27 27 GLN C C 13 176.359 0.00 . 1 . . . . . 27 GLN C . 53627 1 124 . 1 . 1 27 27 GLN CA C 13 56.139 0.00 . 1 . . . . . 27 GLN CA . 53627 1 125 . 1 . 1 27 27 GLN CB C 13 29.118 0.00 . 1 . . . . . 27 GLN CB . 53627 1 126 . 1 . 1 27 27 GLN N N 15 120.235 0.00 . 1 . . . . . 27 GLN N . 53627 1 127 . 1 . 1 28 28 SER H H 1 8.408 0.00 . 1 . . . . . 28 SER H . 53627 1 128 . 1 . 1 28 28 SER C C 13 175.219 0.00 . 1 . . . . . 28 SER C . 53627 1 129 . 1 . 1 28 28 SER CA C 13 58.769 0.00 . 1 . . . . . 28 SER CA . 53627 1 130 . 1 . 1 28 28 SER CB C 13 63.713 0.00 . 1 . . . . . 28 SER CB . 53627 1 131 . 1 . 1 28 28 SER N N 15 116.546 0.01 . 1 . . . . . 28 SER N . 53627 1 132 . 1 . 1 29 29 GLY H H 1 8.491 0.00 . 1 . . . . . 29 GLY H . 53627 1 133 . 1 . 1 29 29 GLY C C 13 174.718 0.00 . 1 . . . . . 29 GLY C . 53627 1 134 . 1 . 1 29 29 GLY CA C 13 45.461 0.00 . 1 . . . . . 29 GLY CA . 53627 1 135 . 1 . 1 29 29 GLY N N 15 110.992 0.00 . 1 . . . . . 29 GLY N . 53627 1 136 . 1 . 1 30 30 GLY H H 1 8.308 0.00 . 1 . . . . . 30 GLY H . 53627 1 137 . 1 . 1 30 30 GLY C C 13 174.340 0.00 . 1 . . . . . 30 GLY C . 53627 1 138 . 1 . 1 30 30 GLY CA C 13 45.182 0.00 . 1 . . . . . 30 GLY CA . 53627 1 139 . 1 . 1 30 30 GLY N N 15 108.731 0.01 . 1 . . . . . 30 GLY N . 53627 1 140 . 1 . 1 31 31 SER H H 1 8.394 0.00 . 1 . . . . . 31 SER H . 53627 1 141 . 1 . 1 31 31 SER C C 13 175.260 0.00 . 1 . . . . . 31 SER C . 53627 1 142 . 1 . 1 31 31 SER CA C 13 58.385 0.00 . 1 . . . . . 31 SER CA . 53627 1 143 . 1 . 1 31 31 SER CB C 13 63.850 0.00 . 1 . . . . . 31 SER CB . 53627 1 144 . 1 . 1 31 31 SER N N 15 115.777 0.00 . 1 . . . . . 31 SER N . 53627 1 145 . 1 . 1 32 32 THR H H 1 8.345 0.00 . 1 . . . . . 32 THR H . 53627 1 146 . 1 . 1 32 32 THR C C 13 174.637 0.00 . 1 . . . . . 32 THR C . 53627 1 147 . 1 . 1 32 32 THR CA C 13 62.213 0.00 . 1 . . . . . 32 THR CA . 53627 1 148 . 1 . 1 32 32 THR CB C 13 69.540 0.00 . 1 . . . . . 32 THR CB . 53627 1 149 . 1 . 1 32 32 THR N N 15 116.099 0.00 . 1 . . . . . 32 THR N . 53627 1 150 . 1 . 1 33 33 ALA H H 1 8.306 0.00 . 1 . . . . . 33 ALA H . 53627 1 151 . 1 . 1 33 33 ALA C C 13 177.925 0.00 . 1 . . . . . 33 ALA C . 53627 1 152 . 1 . 1 33 33 ALA CA C 13 52.829 0.00 . 1 . . . . . 33 ALA CA . 53627 1 153 . 1 . 1 33 33 ALA CB C 13 19.088 0.00 . 1 . . . . . 33 ALA CB . 53627 1 154 . 1 . 1 33 33 ALA N N 15 126.064 0.00 . 1 . . . . . 33 ALA N . 53627 1 155 . 1 . 1 34 34 SER H H 1 8.288 0.00 . 1 . . . . . 34 SER H . 53627 1 156 . 1 . 1 34 34 SER C C 13 174.812 0.00 . 1 . . . . . 34 SER C . 53627 1 157 . 1 . 1 34 34 SER CA C 13 58.548 0.00 . 1 . . . . . 34 SER CA . 53627 1 158 . 1 . 1 34 34 SER CB C 13 63.672 0.00 . 1 . . . . . 34 SER CB . 53627 1 159 . 1 . 1 34 34 SER N N 15 115.078 0.00 . 1 . . . . . 34 SER N . 53627 1 160 . 1 . 1 35 35 LYS H H 1 8.358 0.00 . 1 . . . . . 35 LYS H . 53627 1 161 . 1 . 1 35 35 LYS C C 13 177.050 0.00 . 1 . . . . . 35 LYS C . 53627 1 162 . 1 . 1 35 35 LYS CA C 13 56.624 0.00 . 1 . . . . . 35 LYS CA . 53627 1 163 . 1 . 1 35 35 LYS CB C 13 32.805 0.00 . 1 . . . . . 35 LYS CB . 53627 1 164 . 1 . 1 35 35 LYS N N 15 123.200 0.00 . 1 . . . . . 35 LYS N . 53627 1 165 . 1 . 1 36 36 GLY H H 1 8.409 0.00 . 1 . . . . . 36 GLY H . 53627 1 166 . 1 . 1 36 36 GLY C C 13 173.741 0.00 . 1 . . . . . 36 GLY C . 53627 1 167 . 1 . 1 36 36 GLY CA C 13 45.187 0.00 . 1 . . . . . 36 GLY CA . 53627 1 168 . 1 . 1 36 36 GLY N N 15 109.695 0.00 . 1 . . . . . 36 GLY N . 53627 1 169 . 1 . 1 37 37 ARG H H 1 8.118 0.00 . 1 . . . . . 37 ARG H . 53627 1 170 . 1 . 1 37 37 ARG C C 13 175.623 0.00 . 1 . . . . . 37 ARG C . 53627 1 171 . 1 . 1 37 37 ARG CA C 13 55.838 0.00 . 1 . . . . . 37 ARG CA . 53627 1 172 . 1 . 1 37 37 ARG CB C 13 31.051 0.00 . 1 . . . . . 37 ARG CB . 53627 1 173 . 1 . 1 37 37 ARG N N 15 120.679 0.01 . 1 . . . . . 37 ARG N . 53627 1 174 . 1 . 1 38 38 TYR H H 1 8.478 0.00 . 1 . . . . . 38 TYR H . 53627 1 175 . 1 . 1 38 38 TYR C C 13 174.583 0.00 . 1 . . . . . 38 TYR C . 53627 1 176 . 1 . 1 38 38 TYR CA C 13 58.229 0.00 . 1 . . . . . 38 TYR CA . 53627 1 177 . 1 . 1 38 38 TYR CB C 13 38.704 0.00 . 1 . . . . . 38 TYR CB . 53627 1 178 . 1 . 1 38 38 TYR N N 15 123.463 0.01 . 1 . . . . . 38 TYR N . 53627 1 179 . 1 . 1 39 39 ILE H H 1 7.904 0.00 . 1 . . . . . 39 ILE H . 53627 1 180 . 1 . 1 39 39 ILE C C 13 172.983 0.00 . 1 . . . . . 39 ILE C . 53627 1 181 . 1 . 1 39 39 ILE CA C 13 57.308 0.00 . 1 . . . . . 39 ILE CA . 53627 1 182 . 1 . 1 39 39 ILE CB C 13 39.318 0.00 . 1 . . . . . 39 ILE CB . 53627 1 183 . 1 . 1 39 39 ILE N N 15 129.141 0.01 . 1 . . . . . 39 ILE N . 53627 1 184 . 1 . 1 41 41 PRO C C 13 177.363 0.00 . 1 . . . . . 41 PRO C . 53627 1 185 . 1 . 1 41 41 PRO CA C 13 64.233 0.00 . 1 . . . . . 41 PRO CA . 53627 1 186 . 1 . 1 41 41 PRO CB C 13 32.261 0.00 . 1 . . . . . 41 PRO CB . 53627 1 187 . 1 . 1 42 42 HIS H H 1 8.408 0.00 . 1 . . . . . 42 HIS H . 53627 1 188 . 1 . 1 42 42 HIS C C 13 174.943 0.00 . 1 . . . . . 42 HIS C . 53627 1 189 . 1 . 1 42 42 HIS CA C 13 56.532 0.00 . 1 . . . . . 42 HIS CA . 53627 1 190 . 1 . 1 42 42 HIS CB C 13 29.198 0.00 . 1 . . . . . 42 HIS CB . 53627 1 191 . 1 . 1 42 42 HIS N N 15 116.147 0.01 . 1 . . . . . 42 HIS N . 53627 1 192 . 1 . 1 43 43 LEU H H 1 7.940 0.00 . 1 . . . . . 43 LEU H . 53627 1 193 . 1 . 1 43 43 LEU C C 13 177.106 0.01 . 1 . . . . . 43 LEU C . 53627 1 194 . 1 . 1 43 43 LEU CA C 13 54.615 0.00 . 1 . . . . . 43 LEU CA . 53627 1 195 . 1 . 1 43 43 LEU CB C 13 42.184 0.00 . 1 . . . . . 43 LEU CB . 53627 1 196 . 1 . 1 43 43 LEU N N 15 121.992 0.02 . 1 . . . . . 43 LEU N . 53627 1 197 . 1 . 1 44 44 ARG H H 1 7.951 0.00 . 1 . . . . . 44 ARG H . 53627 1 198 . 1 . 1 44 44 ARG C C 13 176.025 0.00 . 1 . . . . . 44 ARG C . 53627 1 199 . 1 . 1 44 44 ARG CA C 13 56.515 0.00 . 1 . . . . . 44 ARG CA . 53627 1 200 . 1 . 1 44 44 ARG CB C 13 30.688 0.00 . 1 . . . . . 44 ARG CB . 53627 1 201 . 1 . 1 44 44 ARG N N 15 121.140 0.01 . 1 . . . . . 44 ARG N . 53627 1 202 . 1 . 1 45 45 ASN H H 1 8.501 0.00 . 1 . . . . . 45 ASN H . 53627 1 203 . 1 . 1 45 45 ASN C C 13 175.365 0.00 . 1 . . . . . 45 ASN C . 53627 1 204 . 1 . 1 45 45 ASN CA C 13 53.361 0.00 . 1 . . . . . 45 ASN CA . 53627 1 205 . 1 . 1 45 45 ASN CB C 13 38.607 0.00 . 1 . . . . . 45 ASN CB . 53627 1 206 . 1 . 1 45 45 ASN N N 15 119.348 0.01 . 1 . . . . . 45 ASN N . 53627 1 207 . 1 . 1 46 46 ARG H H 1 8.379 0.00 . 1 . . . . . 46 ARG H . 53627 1 208 . 1 . 1 46 46 ARG C C 13 176.483 0.00 . 1 . . . . . 46 ARG C . 53627 1 209 . 1 . 1 46 46 ARG CA C 13 56.627 0.00 . 1 . . . . . 46 ARG CA . 53627 1 210 . 1 . 1 46 46 ARG CB C 13 30.573 0.00 . 1 . . . . . 46 ARG CB . 53627 1 211 . 1 . 1 46 46 ARG N N 15 121.648 0.00 . 1 . . . . . 46 ARG N . 53627 1 212 . 1 . 1 47 47 GLU H H 1 8.448 0.00 . 1 . . . . . 47 GLU H . 53627 1 213 . 1 . 1 47 47 GLU C C 13 176.486 0.01 . 1 . . . . . 47 GLU C . 53627 1 214 . 1 . 1 47 47 GLU CA C 13 56.830 0.00 . 1 . . . . . 47 GLU CA . 53627 1 215 . 1 . 1 47 47 GLU CB C 13 29.973 0.00 . 1 . . . . . 47 GLU CB . 53627 1 216 . 1 . 1 47 47 GLU N N 15 121.293 0.00 . 1 . . . . . 47 GLU N . 53627 1 217 . 1 . 1 48 48 ALA H H 1 8.296 0.00 . 1 . . . . . 48 ALA H . 53627 1 218 . 1 . 1 48 48 ALA C C 13 178.035 0.00 . 1 . . . . . 48 ALA C . 53627 1 219 . 1 . 1 48 48 ALA CA C 13 52.773 0.00 . 1 . . . . . 48 ALA CA . 53627 1 220 . 1 . 1 48 48 ALA CB C 13 19.156 0.00 . 1 . . . . . 48 ALA CB . 53627 1 221 . 1 . 1 48 48 ALA N N 15 124.412 0.01 . 1 . . . . . 48 ALA N . 53627 1 222 . 1 . 1 49 49 THR H H 1 8.068 0.00 . 1 . . . . . 49 THR H . 53627 1 223 . 1 . 1 49 49 THR C C 13 174.632 0.00 . 1 . . . . . 49 THR C . 53627 1 224 . 1 . 1 49 49 THR CA C 13 61.948 0.00 . 1 . . . . . 49 THR CA . 53627 1 225 . 1 . 1 49 49 THR CB C 13 69.798 0.00 . 1 . . . . . 49 THR CB . 53627 1 226 . 1 . 1 49 49 THR N N 15 113.081 0.00 . 1 . . . . . 49 THR N . 53627 1 227 . 1 . 1 50 50 LYS H H 1 8.308 0.00 . 1 . . . . . 50 LYS H . 53627 1 228 . 1 . 1 50 50 LYS C C 13 176.918 0.00 . 1 . . . . . 50 LYS C . 53627 1 229 . 1 . 1 50 50 LYS CA C 13 56.741 0.00 . 1 . . . . . 50 LYS CA . 53627 1 230 . 1 . 1 50 50 LYS CB C 13 32.850 0.00 . 1 . . . . . 50 LYS CB . 53627 1 231 . 1 . 1 50 50 LYS N N 15 123.701 0.00 . 1 . . . . . 50 LYS N . 53627 1 232 . 1 . 1 51 51 GLY H H 1 8.440 0.00 . 1 . . . . . 51 GLY H . 53627 1 233 . 1 . 1 51 51 GLY C C 13 173.736 0.00 . 1 . . . . . 51 GLY C . 53627 1 234 . 1 . 1 51 51 GLY CA C 13 45.139 0.00 . 1 . . . . . 51 GLY CA . 53627 1 235 . 1 . 1 51 51 GLY N N 15 110.010 0.00 . 1 . . . . . 51 GLY N . 53627 1 236 . 1 . 1 52 52 PHE H H 1 8.051 0.00 . 1 . . . . . 52 PHE H . 53627 1 237 . 1 . 1 52 52 PHE C C 13 175.346 0.00 . 1 . . . . . 52 PHE C . 53627 1 238 . 1 . 1 52 52 PHE CA C 13 58.251 0.00 . 1 . . . . . 52 PHE CA . 53627 1 239 . 1 . 1 52 52 PHE CB C 13 39.759 0.00 . 1 . . . . . 52 PHE CB . 53627 1 240 . 1 . 1 52 52 PHE N N 15 120.131 0.00 . 1 . . . . . 52 PHE N . 53627 1 241 . 1 . 1 53 53 TYR H H 1 8.206 0.00 . 1 . . . . . 53 TYR H . 53627 1 242 . 1 . 1 53 53 TYR C C 13 175.003 0.00 . 1 . . . . . 53 TYR C . 53627 1 243 . 1 . 1 53 53 TYR CA C 13 57.773 0.00 . 1 . . . . . 53 TYR CA . 53627 1 244 . 1 . 1 53 53 TYR CB C 13 38.842 0.00 . 1 . . . . . 53 TYR CB . 53627 1 245 . 1 . 1 53 53 TYR N N 15 120.695 0.00 . 1 . . . . . 53 TYR N . 53627 1 246 . 1 . 1 54 54 ASP H H 1 8.153 0.00 . 1 . . . . . 54 ASP H . 53627 1 247 . 1 . 1 54 54 ASP C C 13 176.159 0.00 . 1 . . . . . 54 ASP C . 53627 1 248 . 1 . 1 54 54 ASP CA C 13 54.008 0.00 . 1 . . . . . 54 ASP CA . 53627 1 249 . 1 . 1 54 54 ASP CB C 13 41.388 0.00 . 1 . . . . . 54 ASP CB . 53627 1 250 . 1 . 1 54 54 ASP N N 15 122.502 0.01 . 1 . . . . . 54 ASP N . 53627 1 251 . 1 . 1 55 55 LYS H H 1 8.211 0.00 . 1 . . . . . 55 LYS H . 53627 1 252 . 1 . 1 55 55 LYS C C 13 176.535 0.00 . 1 . . . . . 55 LYS C . 53627 1 253 . 1 . 1 55 55 LYS CA C 13 57.079 0.00 . 1 . . . . . 55 LYS CA . 53627 1 254 . 1 . 1 55 55 LYS CB C 13 32.701 0.00 . 1 . . . . . 55 LYS CB . 53627 1 255 . 1 . 1 55 55 LYS N N 15 121.898 0.00 . 1 . . . . . 55 LYS N . 53627 1 256 . 1 . 1 56 56 ASP H H 1 8.333 0.01 . 1 . . . . . 56 ASP H . 53627 1 257 . 1 . 1 56 56 ASP C C 13 176.556 0.00 . 1 . . . . . 56 ASP C . 53627 1 258 . 1 . 1 56 56 ASP CA C 13 54.610 0.00 . 1 . . . . . 56 ASP CA . 53627 1 259 . 1 . 1 56 56 ASP CB C 13 41.174 0.00 . 1 . . . . . 56 ASP CB . 53627 1 260 . 1 . 1 56 56 ASP N N 15 120.363 0.01 . 1 . . . . . 56 ASP N . 53627 1 261 . 1 . 1 57 57 SER H H 1 8.184 0.00 . 1 . . . . . 57 SER H . 53627 1 262 . 1 . 1 57 57 SER C C 13 175.064 0.01 . 1 . . . . . 57 SER C . 53627 1 263 . 1 . 1 57 57 SER CA C 13 58.662 0.00 . 1 . . . . . 57 SER CA . 53627 1 264 . 1 . 1 57 57 SER CB C 13 63.620 0.00 . 1 . . . . . 57 SER CB . 53627 1 265 . 1 . 1 57 57 SER N N 15 116.491 0.00 . 1 . . . . . 57 SER N . 53627 1 266 . 1 . 1 58 58 SER H H 1 8.433 0.00 . 1 . . . . . 58 SER H . 53627 1 267 . 1 . 1 58 58 SER C C 13 175.180 0.00 . 1 . . . . . 58 SER C . 53627 1 268 . 1 . 1 58 58 SER CA C 13 59.308 0.00 . 1 . . . . . 58 SER CA . 53627 1 269 . 1 . 1 58 58 SER CB C 13 63.675 0.00 . 1 . . . . . 58 SER CB . 53627 1 270 . 1 . 1 58 58 SER N N 15 117.999 0.00 . 1 . . . . . 58 SER N . 53627 1 271 . 1 . 1 59 59 GLY H H 1 8.353 0.00 . 1 . . . . . 59 GLY H . 53627 1 272 . 1 . 1 59 59 GLY C C 13 174.005 0.00 . 1 . . . . . 59 GLY C . 53627 1 273 . 1 . 1 59 59 GLY CA C 13 45.404 0.00 . 1 . . . . . 59 GLY CA . 53627 1 274 . 1 . 1 59 59 GLY N N 15 110.361 0.00 . 1 . . . . . 59 GLY N . 53627 1 275 . 1 . 1 60 60 TRP H H 1 8.032 0.00 . 1 . . . . . 60 TRP H . 53627 1 276 . 1 . 1 60 60 TRP C C 13 176.453 0.00 . 1 . . . . . 60 TRP C . 53627 1 277 . 1 . 1 60 60 TRP CA C 13 57.797 0.00 . 1 . . . . . 60 TRP CA . 53627 1 278 . 1 . 1 60 60 TRP CB C 13 29.684 0.00 . 1 . . . . . 60 TRP CB . 53627 1 279 . 1 . 1 60 60 TRP N N 15 121.341 0.00 . 1 . . . . . 60 TRP N . 53627 1 280 . 1 . 1 61 61 SER H H 1 8.076 0.00 . 1 . . . . . 61 SER H . 53627 1 281 . 1 . 1 61 61 SER C C 13 174.215 0.00 . 1 . . . . . 61 SER C . 53627 1 282 . 1 . 1 61 61 SER CA C 13 58.182 0.00 . 1 . . . . . 61 SER CA . 53627 1 283 . 1 . 1 61 61 SER CB C 13 63.961 0.00 . 1 . . . . . 61 SER CB . 53627 1 284 . 1 . 1 61 61 SER N N 15 117.460 0.01 . 1 . . . . . 61 SER N . 53627 1 285 . 1 . 1 62 62 SER H H 1 8.278 0.00 . 1 . . . . . 62 SER H . 53627 1 286 . 1 . 1 62 62 SER C C 13 174.844 0.01 . 1 . . . . . 62 SER C . 53627 1 287 . 1 . 1 62 62 SER CA C 13 58.500 0.00 . 1 . . . . . 62 SER CA . 53627 1 288 . 1 . 1 62 62 SER CB C 13 63.815 0.00 . 1 . . . . . 62 SER CB . 53627 1 289 . 1 . 1 62 62 SER N N 15 117.620 0.01 . 1 . . . . . 62 SER N . 53627 1 290 . 1 . 1 63 63 SER H H 1 8.323 0.00 . 1 . . . . . 63 SER H . 53627 1 291 . 1 . 1 63 63 SER C C 13 174.886 0.00 . 1 . . . . . 63 SER C . 53627 1 292 . 1 . 1 63 63 SER CA C 13 58.866 0.00 . 1 . . . . . 63 SER CA . 53627 1 293 . 1 . 1 63 63 SER CB C 13 63.622 0.00 . 1 . . . . . 63 SER CB . 53627 1 294 . 1 . 1 63 63 SER N N 15 117.809 0.00 . 1 . . . . . 63 SER N . 53627 1 295 . 1 . 1 64 64 LYS H H 1 8.247 0.00 . 1 . . . . . 64 LYS H . 53627 1 296 . 1 . 1 64 64 LYS C C 13 176.585 0.00 . 1 . . . . . 64 LYS C . 53627 1 297 . 1 . 1 64 64 LYS CA C 13 56.754 0.00 . 1 . . . . . 64 LYS CA . 53627 1 298 . 1 . 1 64 64 LYS CB C 13 32.668 0.00 . 1 . . . . . 64 LYS CB . 53627 1 299 . 1 . 1 64 64 LYS N N 15 122.852 0.00 . 1 . . . . . 64 LYS N . 53627 1 300 . 1 . 1 65 65 ASP H H 1 8.197 0.00 . 1 . . . . . 65 ASP H . 53627 1 301 . 1 . 1 65 65 ASP C C 13 176.499 0.00 . 1 . . . . . 65 ASP C . 53627 1 302 . 1 . 1 65 65 ASP CA C 13 54.671 0.00 . 1 . . . . . 65 ASP CA . 53627 1 303 . 1 . 1 65 65 ASP CB C 13 41.056 0.00 . 1 . . . . . 65 ASP CB . 53627 1 304 . 1 . 1 65 65 ASP N N 15 120.658 0.00 . 1 . . . . . 65 ASP N . 53627 1 305 . 1 . 1 66 66 LYS H H 1 8.180 0.00 . 1 . . . . . 66 LYS H . 53627 1 306 . 1 . 1 66 66 LYS C C 13 176.745 0.00 . 1 . . . . . 66 LYS C . 53627 1 307 . 1 . 1 66 66 LYS CA C 13 57.158 0.00 . 1 . . . . . 66 LYS CA . 53627 1 308 . 1 . 1 66 66 LYS CB C 13 32.721 0.03 . 1 . . . . . 66 LYS CB . 53627 1 309 . 1 . 1 66 66 LYS N N 15 121.330 0.01 . 1 . . . . . 66 LYS N . 53627 1 310 . 1 . 1 67 67 ASP H H 1 8.308 0.00 . 1 . . . . . 67 ASP H . 53627 1 311 . 1 . 1 67 67 ASP C C 13 176.326 0.00 . 1 . . . . . 67 ASP C . 53627 1 312 . 1 . 1 67 67 ASP CA C 13 54.625 0.00 . 1 . . . . . 67 ASP CA . 53627 1 313 . 1 . 1 67 67 ASP CB C 13 41.061 0.00 . 1 . . . . . 67 ASP CB . 53627 1 314 . 1 . 1 67 67 ASP N N 15 120.442 0.01 . 1 . . . . . 67 ASP N . 53627 1 315 . 1 . 1 68 68 ALA H H 1 8.060 0.00 . 1 . . . . . 68 ALA H . 53627 1 316 . 1 . 1 68 68 ALA C C 13 177.779 0.00 . 1 . . . . . 68 ALA C . 53627 1 317 . 1 . 1 68 68 ALA CA C 13 53.067 0.00 . 1 . . . . . 68 ALA CA . 53627 1 318 . 1 . 1 68 68 ALA CB C 13 19.014 0.00 . 1 . . . . . 68 ALA CB . 53627 1 319 . 1 . 1 68 68 ALA N N 15 123.572 0.00 . 1 . . . . . 68 ALA N . 53627 1 320 . 1 . 1 69 69 TYR H H 1 8.139 0.00 . 1 . . . . . 69 TYR H . 53627 1 321 . 1 . 1 69 69 TYR C C 13 176.163 0.00 . 1 . . . . . 69 TYR C . 53627 1 322 . 1 . 1 69 69 TYR CA C 13 58.190 0.00 . 1 . . . . . 69 TYR CA . 53627 1 323 . 1 . 1 69 69 TYR CB C 13 38.540 0.00 . 1 . . . . . 69 TYR CB . 53627 1 324 . 1 . 1 69 69 TYR N N 15 118.422 0.01 . 1 . . . . . 69 TYR N . 53627 1 325 . 1 . 1 70 70 SER H H 1 8.039 0.00 . 1 . . . . . 70 SER H . 53627 1 326 . 1 . 1 70 70 SER C C 13 174.565 0.00 . 1 . . . . . 70 SER C . 53627 1 327 . 1 . 1 70 70 SER CA C 13 58.357 0.00 . 1 . . . . . 70 SER CA . 53627 1 328 . 1 . 1 70 70 SER CB C 13 63.905 0.00 . 1 . . . . . 70 SER CB . 53627 1 329 . 1 . 1 70 70 SER N N 15 116.685 0.00 . 1 . . . . . 70 SER N . 53627 1 330 . 1 . 1 71 71 SER H H 1 8.287 0.00 . 1 . . . . . 71 SER H . 53627 1 331 . 1 . 1 71 71 SER C C 13 174.407 0.00 . 1 . . . . . 71 SER C . 53627 1 332 . 1 . 1 71 71 SER CA C 13 58.655 0.00 . 1 . . . . . 71 SER CA . 53627 1 333 . 1 . 1 71 71 SER CB C 13 63.667 0.00 . 1 . . . . . 71 SER CB . 53627 1 334 . 1 . 1 71 71 SER N N 15 117.787 0.01 . 1 . . . . . 71 SER N . 53627 1 335 . 1 . 1 72 72 PHE H H 1 8.218 0.00 . 1 . . . . . 72 PHE H . 53627 1 336 . 1 . 1 72 72 PHE C C 13 176.442 0.00 . 1 . . . . . 72 PHE C . 53627 1 337 . 1 . 1 72 72 PHE CA C 13 58.362 0.00 . 1 . . . . . 72 PHE CA . 53627 1 338 . 1 . 1 72 72 PHE CB C 13 39.357 0.00 . 1 . . . . . 72 PHE CB . 53627 1 339 . 1 . 1 72 72 PHE N N 15 121.791 0.00 . 1 . . . . . 72 PHE N . 53627 1 340 . 1 . 1 73 73 GLY H H 1 8.317 0.00 . 1 . . . . . 73 GLY H . 53627 1 341 . 1 . 1 73 73 GLY C C 13 174.128 0.00 . 1 . . . . . 73 GLY C . 53627 1 342 . 1 . 1 73 73 GLY CA C 13 45.328 0.00 . 1 . . . . . 73 GLY CA . 53627 1 343 . 1 . 1 73 73 GLY N N 15 110.232 0.00 . 1 . . . . . 73 GLY N . 53627 1 344 . 1 . 1 74 74 SER H H 1 8.221 0.00 . 1 . . . . . 74 SER H . 53627 1 345 . 1 . 1 74 74 SER C C 13 174.801 0.00 . 1 . . . . . 74 SER C . 53627 1 346 . 1 . 1 74 74 SER CA C 13 58.418 0.00 . 1 . . . . . 74 SER CA . 53627 1 347 . 1 . 1 74 74 SER CB C 13 63.926 0.00 . 1 . . . . . 74 SER CB . 53627 1 348 . 1 . 1 74 74 SER N N 15 115.749 0.01 . 1 . . . . . 74 SER N . 53627 1 349 . 1 . 1 75 75 ARG H H 1 8.459 0.00 . 1 . . . . . 75 ARG H . 53627 1 350 . 1 . 1 75 75 ARG C C 13 176.636 0.00 . 1 . . . . . 75 ARG C . 53627 1 351 . 1 . 1 75 75 ARG CA C 13 56.269 0.00 . 1 . . . . . 75 ARG CA . 53627 1 352 . 1 . 1 75 75 ARG CB C 13 30.856 0.00 . 1 . . . . . 75 ARG CB . 53627 1 353 . 1 . 1 75 75 ARG N N 15 122.822 0.00 . 1 . . . . . 75 ARG N . 53627 1 354 . 1 . 1 76 76 SER H H 1 8.395 0.00 . 1 . . . . . 76 SER H . 53627 1 355 . 1 . 1 76 76 SER C C 13 174.366 0.00 . 1 . . . . . 76 SER C . 53627 1 356 . 1 . 1 76 76 SER CA C 13 58.651 0.00 . 1 . . . . . 76 SER CA . 53627 1 357 . 1 . 1 76 76 SER CB C 13 63.673 0.00 . 1 . . . . . 76 SER CB . 53627 1 358 . 1 . 1 76 76 SER N N 15 116.603 0.00 . 1 . . . . . 76 SER N . 53627 1 359 . 1 . 1 77 77 ASP H H 1 8.353 0.00 . 1 . . . . . 77 ASP H . 53627 1 360 . 1 . 1 77 77 ASP C C 13 176.518 0.00 . 1 . . . . . 77 ASP C . 53627 1 361 . 1 . 1 77 77 ASP CA C 13 54.232 0.00 . 1 . . . . . 77 ASP CA . 53627 1 362 . 1 . 1 77 77 ASP CB C 13 41.177 0.00 . 1 . . . . . 77 ASP CB . 53627 1 363 . 1 . 1 77 77 ASP N N 15 122.317 0.00 . 1 . . . . . 77 ASP N . 53627 1 364 . 1 . 1 78 78 SER H H 1 8.317 0.00 . 1 . . . . . 78 SER H . 53627 1 365 . 1 . 1 78 78 SER C C 13 174.955 0.00 . 1 . . . . . 78 SER C . 53627 1 366 . 1 . 1 78 78 SER CA C 13 58.859 0.00 . 1 . . . . . 78 SER CA . 53627 1 367 . 1 . 1 78 78 SER CB C 13 63.550 0.00 . 1 . . . . . 78 SER CB . 53627 1 368 . 1 . 1 78 78 SER N N 15 116.475 0.01 . 1 . . . . . 78 SER N . 53627 1 369 . 1 . 1 79 79 ARG H H 1 8.345 0.00 . 1 . . . . . 79 ARG H . 53627 1 370 . 1 . 1 79 79 ARG C C 13 176.996 0.00 . 1 . . . . . 79 ARG C . 53627 1 371 . 1 . 1 79 79 ARG CA C 13 56.627 0.00 . 1 . . . . . 79 ARG CA . 53627 1 372 . 1 . 1 79 79 ARG CB C 13 30.426 0.00 . 1 . . . . . 79 ARG CB . 53627 1 373 . 1 . 1 79 79 ARG N N 15 122.457 0.01 . 1 . . . . . 79 ARG N . 53627 1 374 . 1 . 1 80 80 GLY H H 1 8.370 0.00 . 1 . . . . . 80 GLY H . 53627 1 375 . 1 . 1 80 80 GLY C C 13 174.202 0.00 . 1 . . . . . 80 GLY C . 53627 1 376 . 1 . 1 80 80 GLY CA C 13 45.320 0.00 . 1 . . . . . 80 GLY CA . 53627 1 377 . 1 . 1 80 80 GLY N N 15 109.248 0.00 . 1 . . . . . 80 GLY N . 53627 1 378 . 1 . 1 81 81 LYS H H 1 8.204 0.00 . 1 . . . . . 81 LYS H . 53627 1 379 . 1 . 1 81 81 LYS C C 13 176.881 0.00 . 1 . . . . . 81 LYS C . 53627 1 380 . 1 . 1 81 81 LYS CA C 13 56.465 0.00 . 1 . . . . . 81 LYS CA . 53627 1 381 . 1 . 1 81 81 LYS CB C 13 33.101 0.00 . 1 . . . . . 81 LYS CB . 53627 1 382 . 1 . 1 81 81 LYS N N 15 120.866 0.00 . 1 . . . . . 81 LYS N . 53627 1 383 . 1 . 1 82 82 SER H H 1 8.438 0.00 . 1 . . . . . 82 SER H . 53627 1 384 . 1 . 1 82 82 SER C C 13 174.690 0.01 . 1 . . . . . 82 SER C . 53627 1 385 . 1 . 1 82 82 SER CA C 13 58.505 0.00 . 1 . . . . . 82 SER CA . 53627 1 386 . 1 . 1 82 82 SER CB C 13 63.782 0.00 . 1 . . . . . 82 SER CB . 53627 1 387 . 1 . 1 82 82 SER N N 15 116.776 0.01 . 1 . . . . . 82 SER N . 53627 1 388 . 1 . 1 83 83 SER H H 1 8.349 0.00 . 1 . . . . . 83 SER H . 53627 1 389 . 1 . 1 83 83 SER C C 13 174.091 0.00 . 1 . . . . . 83 SER C . 53627 1 390 . 1 . 1 83 83 SER CA C 13 58.556 0.00 . 1 . . . . . 83 SER CA . 53627 1 391 . 1 . 1 83 83 SER CB C 13 63.721 0.00 . 1 . . . . . 83 SER CB . 53627 1 392 . 1 . 1 83 83 SER N N 15 117.941 0.01 . 1 . . . . . 83 SER N . 53627 1 393 . 1 . 1 84 84 PHE H H 1 8.191 0.00 . 1 . . . . . 84 PHE H . 53627 1 394 . 1 . 1 84 84 PHE C C 13 175.417 0.00 . 1 . . . . . 84 PHE C . 53627 1 395 . 1 . 1 84 84 PHE CA C 13 58.333 0.00 . 1 . . . . . 84 PHE CA . 53627 1 396 . 1 . 1 84 84 PHE CB C 13 39.647 0.00 . 1 . . . . . 84 PHE CB . 53627 1 397 . 1 . 1 84 84 PHE N N 15 121.864 0.01 . 1 . . . . . 84 PHE N . 53627 1 398 . 1 . 1 85 85 PHE H H 1 8.132 0.00 . 1 . . . . . 85 PHE H . 53627 1 399 . 1 . 1 85 85 PHE C C 13 175.573 0.00 . 1 . . . . . 85 PHE C . 53627 1 400 . 1 . 1 85 85 PHE CA C 13 57.897 0.00 . 1 . . . . . 85 PHE CA . 53627 1 401 . 1 . 1 85 85 PHE CB C 13 39.677 0.00 . 1 . . . . . 85 PHE CB . 53627 1 402 . 1 . 1 85 85 PHE N N 15 120.659 0.01 . 1 . . . . . 85 PHE N . 53627 1 403 . 1 . 1 86 86 SER H H 1 8.142 0.00 . 1 . . . . . 86 SER H . 53627 1 404 . 1 . 1 86 86 SER C C 13 174.066 0.00 . 1 . . . . . 86 SER C . 53627 1 405 . 1 . 1 86 86 SER CA C 13 58.275 0.00 . 1 . . . . . 86 SER CA . 53627 1 406 . 1 . 1 86 86 SER CB C 13 63.898 0.00 . 1 . . . . . 86 SER CB . 53627 1 407 . 1 . 1 86 86 SER N N 15 116.951 0.00 . 1 . . . . . 86 SER N . 53627 1 408 . 1 . 1 87 87 ASP H H 1 8.359 0.00 . 1 . . . . . 87 ASP H . 53627 1 409 . 1 . 1 87 87 ASP C C 13 176.405 0.00 . 1 . . . . . 87 ASP C . 53627 1 410 . 1 . 1 87 87 ASP CA C 13 54.371 0.00 . 1 . . . . . 87 ASP CA . 53627 1 411 . 1 . 1 87 87 ASP CB C 13 41.059 0.00 . 1 . . . . . 87 ASP CB . 53627 1 412 . 1 . 1 87 87 ASP N N 15 122.550 0.00 . 1 . . . . . 87 ASP N . 53627 1 413 . 1 . 1 88 88 ARG H H 1 8.300 0.00 . 1 . . . . . 88 ARG H . 53627 1 414 . 1 . 1 88 88 ARG C C 13 176.971 0.00 . 1 . . . . . 88 ARG C . 53627 1 415 . 1 . 1 88 88 ARG CA C 13 56.431 0.00 . 1 . . . . . 88 ARG CA . 53627 1 416 . 1 . 1 88 88 ARG CB C 13 30.440 0.00 . 1 . . . . . 88 ARG CB . 53627 1 417 . 1 . 1 88 88 ARG N N 15 121.160 0.00 . 1 . . . . . 88 ARG N . 53627 1 418 . 1 . 1 89 89 GLY H H 1 8.465 0.00 . 1 . . . . . 89 GLY H . 53627 1 419 . 1 . 1 89 89 GLY C C 13 174.465 0.00 . 1 . . . . . 89 GLY C . 53627 1 420 . 1 . 1 89 89 GLY CA C 13 45.335 0.00 . 1 . . . . . 89 GLY CA . 53627 1 421 . 1 . 1 89 89 GLY N N 15 109.447 0.01 . 1 . . . . . 89 GLY N . 53627 1 422 . 1 . 1 90 90 SER H H 1 8.342 0.00 . 1 . . . . . 90 SER H . 53627 1 423 . 1 . 1 90 90 SER C C 13 175.325 0.00 . 1 . . . . . 90 SER C . 53627 1 424 . 1 . 1 90 90 SER CA C 13 58.779 0.03 . 1 . . . . . 90 SER CA . 53627 1 425 . 1 . 1 90 90 SER CB C 13 63.808 0.00 . 1 . . . . . 90 SER CB . 53627 1 426 . 1 . 1 90 90 SER N N 15 115.945 0.01 . 1 . . . . . 90 SER N . 53627 1 427 . 1 . 1 91 91 GLY H H 1 8.577 0.00 . 1 . . . . . 91 GLY H . 53627 1 428 . 1 . 1 91 91 GLY C C 13 174.353 0.00 . 1 . . . . . 91 GLY C . 53627 1 429 . 1 . 1 91 91 GLY CA C 13 45.443 0.00 . 1 . . . . . 91 GLY CA . 53627 1 430 . 1 . 1 91 91 GLY N N 15 111.108 0.00 . 1 . . . . . 91 GLY N . 53627 1 431 . 1 . 1 92 92 SER H H 1 8.268 0.00 . 1 . . . . . 92 SER H . 53627 1 432 . 1 . 1 92 92 SER C C 13 174.820 0.00 . 1 . . . . . 92 SER C . 53627 1 433 . 1 . 1 92 92 SER CA C 13 58.543 0.00 . 1 . . . . . 92 SER CA . 53627 1 434 . 1 . 1 92 92 SER CB C 13 63.829 0.00 . 1 . . . . . 92 SER CB . 53627 1 435 . 1 . 1 92 92 SER N N 15 115.848 0.00 . 1 . . . . . 92 SER N . 53627 1 436 . 1 . 1 93 93 ARG H H 1 8.469 0.00 . 1 . . . . . 93 ARG H . 53627 1 437 . 1 . 1 93 93 ARG C C 13 176.723 0.00 . 1 . . . . . 93 ARG C . 53627 1 438 . 1 . 1 93 93 ARG CA C 13 56.461 0.00 . 1 . . . . . 93 ARG CA . 53627 1 439 . 1 . 1 93 93 ARG CB C 13 30.661 0.00 . 1 . . . . . 93 ARG CB . 53627 1 440 . 1 . 1 93 93 ARG N N 15 122.681 0.00 . 1 . . . . . 93 ARG N . 53627 1 441 . 1 . 1 94 94 GLY H H 1 8.426 0.00 . 1 . . . . . 94 GLY H . 53627 1 442 . 1 . 1 94 94 GLY C C 13 173.953 0.00 . 1 . . . . . 94 GLY C . 53627 1 443 . 1 . 1 94 94 GLY CA C 13 45.251 0.00 . 1 . . . . . 94 GLY CA . 53627 1 444 . 1 . 1 94 94 GLY N N 15 109.638 0.00 . 1 . . . . . 94 GLY N . 53627 1 445 . 1 . 1 95 95 ARG H H 1 8.152 0.00 . 1 . . . . . 95 ARG H . 53627 1 446 . 1 . 1 95 95 ARG C C 13 176.216 0.00 . 1 . . . . . 95 ARG C . 53627 1 447 . 1 . 1 95 95 ARG CA C 13 56.316 0.00 . 1 . . . . . 95 ARG CA . 53627 1 448 . 1 . 1 95 95 ARG CB C 13 30.829 0.00 . 1 . . . . . 95 ARG CB . 53627 1 449 . 1 . 1 95 95 ARG N N 15 120.455 0.01 . 1 . . . . . 95 ARG N . 53627 1 450 . 1 . 1 96 96 PHE H H 1 8.384 0.00 . 1 . . . . . 96 PHE H . 53627 1 451 . 1 . 1 96 96 PHE C C 13 175.380 0.00 . 1 . . . . . 96 PHE C . 53627 1 452 . 1 . 1 96 96 PHE CA C 13 57.609 0.00 . 1 . . . . . 96 PHE CA . 53627 1 453 . 1 . 1 96 96 PHE CB C 13 39.475 0.00 . 1 . . . . . 96 PHE CB . 53627 1 454 . 1 . 1 96 96 PHE N N 15 120.551 0.01 . 1 . . . . . 96 PHE N . 53627 1 455 . 1 . 1 97 97 ASP H H 1 8.200 0.00 . 1 . . . . . 97 ASP H . 53627 1 456 . 1 . 1 97 97 ASP C C 13 175.793 0.00 . 1 . . . . . 97 ASP C . 53627 1 457 . 1 . 1 97 97 ASP CA C 13 53.921 0.00 . 1 . . . . . 97 ASP CA . 53627 1 458 . 1 . 1 97 97 ASP CB C 13 41.072 0.00 . 1 . . . . . 97 ASP CB . 53627 1 459 . 1 . 1 97 97 ASP N N 15 121.378 0.01 . 1 . . . . . 97 ASP N . 53627 1 460 . 1 . 1 98 98 ASP H H 1 8.270 0.00 . 1 . . . . . 98 ASP H . 53627 1 461 . 1 . 1 98 98 ASP C C 13 176.662 0.00 . 1 . . . . . 98 ASP C . 53627 1 462 . 1 . 1 98 98 ASP CA C 13 54.424 0.00 . 1 . . . . . 98 ASP CA . 53627 1 463 . 1 . 1 98 98 ASP CB C 13 40.987 0.00 . 1 . . . . . 98 ASP CB . 53627 1 464 . 1 . 1 98 98 ASP N N 15 121.212 0.00 . 1 . . . . . 98 ASP N . 53627 1 465 . 1 . 1 99 99 ARG H H 1 8.297 0.00 . 1 . . . . . 99 ARG H . 53627 1 466 . 1 . 1 99 99 ARG C C 13 177.062 0.00 . 1 . . . . . 99 ARG C . 53627 1 467 . 1 . 1 99 99 ARG CA C 13 56.659 0.00 . 1 . . . . . 99 ARG CA . 53627 1 468 . 1 . 1 99 99 ARG CB C 13 30.232 0.00 . 1 . . . . . 99 ARG CB . 53627 1 469 . 1 . 1 99 99 ARG N N 15 120.637 0.01 . 1 . . . . . 99 ARG N . 53627 1 470 . 1 . 1 100 100 GLY H H 1 8.466 0.00 . 1 . . . . . 100 GLY H . 53627 1 471 . 1 . 1 100 100 GLY C C 13 174.258 0.00 . 1 . . . . . 100 GLY C . 53627 1 472 . 1 . 1 100 100 GLY CA C 13 45.456 0.00 . 1 . . . . . 100 GLY CA . 53627 1 473 . 1 . 1 100 100 GLY N N 15 108.968 0.01 . 1 . . . . . 100 GLY N . 53627 1 474 . 1 . 1 101 101 ARG H H 1 8.111 0.00 . 1 . . . . . 101 ARG H . 53627 1 475 . 1 . 1 101 101 ARG C C 13 176.632 0.00 . 1 . . . . . 101 ARG C . 53627 1 476 . 1 . 1 101 101 ARG CA C 13 56.194 0.00 . 1 . . . . . 101 ARG CA . 53627 1 477 . 1 . 1 101 101 ARG CB C 13 30.997 0.00 . 1 . . . . . 101 ARG CB . 53627 1 478 . 1 . 1 101 101 ARG N N 15 120.459 0.01 . 1 . . . . . 101 ARG N . 53627 1 479 . 1 . 1 102 102 SER H H 1 8.556 0.00 . 1 . . . . . 102 SER H . 53627 1 480 . 1 . 1 102 102 SER C C 13 174.339 0.00 . 1 . . . . . 102 SER C . 53627 1 481 . 1 . 1 102 102 SER CA C 13 58.475 0.00 . 1 . . . . . 102 SER CA . 53627 1 482 . 1 . 1 102 102 SER CB C 13 63.830 0.00 . 1 . . . . . 102 SER CB . 53627 1 483 . 1 . 1 102 102 SER N N 15 117.020 0.01 . 1 . . . . . 102 SER N . 53627 1 484 . 1 . 1 103 103 ASP H H 1 8.387 0.00 . 1 . . . . . 103 ASP H . 53627 1 485 . 1 . 1 103 103 ASP C C 13 175.936 0.00 . 1 . . . . . 103 ASP C . 53627 1 486 . 1 . 1 103 103 ASP CA C 13 54.288 0.00 . 1 . . . . . 103 ASP CA . 53627 1 487 . 1 . 1 103 103 ASP CB C 13 40.823 0.00 . 1 . . . . . 103 ASP CB . 53627 1 488 . 1 . 1 103 103 ASP N N 15 121.817 0.01 . 1 . . . . . 103 ASP N . 53627 1 489 . 1 . 1 104 104 TYR H H 1 8.067 0.00 . 1 . . . . . 104 TYR H . 53627 1 490 . 1 . 1 104 104 TYR C C 13 175.675 0.00 . 1 . . . . . 104 TYR C . 53627 1 491 . 1 . 1 104 104 TYR CA C 13 58.285 0.00 . 1 . . . . . 104 TYR CA . 53627 1 492 . 1 . 1 104 104 TYR CB C 13 38.726 0.00 . 1 . . . . . 104 TYR CB . 53627 1 493 . 1 . 1 104 104 TYR N N 15 120.118 0.01 . 1 . . . . . 104 TYR N . 53627 1 494 . 1 . 1 105 105 ASP H H 1 8.203 0.00 . 1 . . . . . 105 ASP H . 53627 1 495 . 1 . 1 105 105 ASP C C 13 176.418 0.00 . 1 . . . . . 105 ASP C . 53627 1 496 . 1 . 1 105 105 ASP CA C 13 54.263 0.00 . 1 . . . . . 105 ASP CA . 53627 1 497 . 1 . 1 105 105 ASP CB C 13 41.166 0.00 . 1 . . . . . 105 ASP CB . 53627 1 498 . 1 . 1 105 105 ASP N N 15 122.288 0.00 . 1 . . . . . 105 ASP N . 53627 1 499 . 1 . 1 106 106 GLY H H 1 7.620 0.00 . 1 . . . . . 106 GLY H . 53627 1 500 . 1 . 1 106 106 GLY C C 13 174.259 0.00 . 1 . . . . . 106 GLY C . 53627 1 501 . 1 . 1 106 106 GLY CA C 13 45.476 0.00 . 1 . . . . . 106 GLY CA . 53627 1 502 . 1 . 1 106 106 GLY N N 15 108.315 0.00 . 1 . . . . . 106 GLY N . 53627 1 503 . 1 . 1 107 107 ILE H H 1 8.090 0.00 . 1 . . . . . 107 ILE H . 53627 1 504 . 1 . 1 107 107 ILE C C 13 177.084 0.00 . 1 . . . . . 107 ILE C . 53627 1 505 . 1 . 1 107 107 ILE CA C 13 61.833 0.01 . 1 . . . . . 107 ILE CA . 53627 1 506 . 1 . 1 107 107 ILE CB C 13 38.413 0.00 . 1 . . . . . 107 ILE CB . 53627 1 507 . 1 . 1 107 107 ILE N N 15 120.206 0.01 . 1 . . . . . 107 ILE N . 53627 1 508 . 1 . 1 108 108 GLY H H 1 8.653 0.00 . 1 . . . . . 108 GLY H . 53627 1 509 . 1 . 1 108 108 GLY C C 13 174.364 0.00 . 1 . . . . . 108 GLY C . 53627 1 510 . 1 . 1 108 108 GLY CA C 13 45.365 0.00 . 1 . . . . . 108 GLY CA . 53627 1 511 . 1 . 1 108 108 GLY N N 15 112.577 0.01 . 1 . . . . . 108 GLY N . 53627 1 512 . 1 . 1 109 109 SER H H 1 8.277 0.00 . 1 . . . . . 109 SER H . 53627 1 513 . 1 . 1 109 109 SER C C 13 174.884 0.00 . 1 . . . . . 109 SER C . 53627 1 514 . 1 . 1 109 109 SER CA C 13 58.538 0.00 . 1 . . . . . 109 SER CA . 53627 1 515 . 1 . 1 109 109 SER CB C 13 63.877 0.00 . 1 . . . . . 109 SER CB . 53627 1 516 . 1 . 1 109 109 SER N N 15 115.920 0.00 . 1 . . . . . 109 SER N . 53627 1 517 . 1 . 1 110 110 ARG H H 1 8.466 0.00 . 1 . . . . . 110 ARG H . 53627 1 518 . 1 . 1 110 110 ARG C C 13 176.978 0.00 . 1 . . . . . 110 ARG C . 53627 1 519 . 1 . 1 110 110 ARG CA C 13 56.664 0.00 . 1 . . . . . 110 ARG CA . 53627 1 520 . 1 . 1 110 110 ARG CB C 13 30.441 0.00 . 1 . . . . . 110 ARG CB . 53627 1 521 . 1 . 1 110 110 ARG N N 15 122.608 0.00 . 1 . . . . . 110 ARG N . 53627 1 522 . 1 . 1 111 111 GLY H H 1 8.373 0.00 . 1 . . . . . 111 GLY H . 53627 1 523 . 1 . 1 111 111 GLY C C 13 173.838 0.00 . 1 . . . . . 111 GLY C . 53627 1 524 . 1 . 1 111 111 GLY CA C 13 45.319 0.00 . 1 . . . . . 111 GLY CA . 53627 1 525 . 1 . 1 111 111 GLY N N 15 109.237 0.01 . 1 . . . . . 111 GLY N . 53627 1 526 . 1 . 1 112 112 ASP H H 1 8.234 0.00 . 1 . . . . . 112 ASP H . 53627 1 527 . 1 . 1 112 112 ASP C C 13 176.643 0.00 . 1 . . . . . 112 ASP C . 53627 1 528 . 1 . 1 112 112 ASP CA C 13 54.322 0.00 . 1 . . . . . 112 ASP CA . 53627 1 529 . 1 . 1 112 112 ASP CB C 13 41.150 0.00 . 1 . . . . . 112 ASP CB . 53627 1 530 . 1 . 1 112 112 ASP N N 15 120.317 0.00 . 1 . . . . . 112 ASP N . 53627 1 531 . 1 . 1 113 113 ARG H H 1 8.440 0.00 . 1 . . . . . 113 ARG H . 53627 1 532 . 1 . 1 113 113 ARG C C 13 176.623 0.00 . 1 . . . . . 113 ARG C . 53627 1 533 . 1 . 1 113 113 ARG CA C 13 56.116 0.00 . 1 . . . . . 113 ARG CA . 53627 1 534 . 1 . 1 113 113 ARG CB C 13 30.306 0.00 . 1 . . . . . 113 ARG CB . 53627 1 535 . 1 . 1 113 113 ARG N N 15 121.713 0.01 . 1 . . . . . 113 ARG N . 53627 1 536 . 1 . 1 114 114 SER H H 1 8.402 0.00 . 1 . . . . . 114 SER H . 53627 1 537 . 1 . 1 114 114 SER C C 13 175.110 0.00 . 1 . . . . . 114 SER C . 53627 1 538 . 1 . 1 114 114 SER CA C 13 59.263 0.00 . 1 . . . . . 114 SER CA . 53627 1 539 . 1 . 1 114 114 SER CB C 13 63.788 0.00 . 1 . . . . . 114 SER CB . 53627 1 540 . 1 . 1 114 114 SER N N 15 116.598 0.00 . 1 . . . . . 114 SER N . 53627 1 541 . 1 . 1 115 115 GLY H H 1 8.401 0.00 . 1 . . . . . 115 GLY H . 53627 1 542 . 1 . 1 115 115 GLY C C 13 173.986 0.00 . 1 . . . . . 115 GLY C . 53627 1 543 . 1 . 1 115 115 GLY CA C 13 45.315 0.00 . 1 . . . . . 115 GLY CA . 53627 1 544 . 1 . 1 115 115 GLY N N 15 110.528 0.00 . 1 . . . . . 115 GLY N . 53627 1 545 . 1 . 1 116 116 PHE H H 1 8.133 0.00 . 1 . . . . . 116 PHE H . 53627 1 546 . 1 . 1 116 116 PHE C C 13 176.396 0.00 . 1 . . . . . 116 PHE C . 53627 1 547 . 1 . 1 116 116 PHE CA C 13 58.016 0.00 . 1 . . . . . 116 PHE CA . 53627 1 548 . 1 . 1 116 116 PHE CB C 13 39.484 0.00 . 1 . . . . . 116 PHE CB . 53627 1 549 . 1 . 1 116 116 PHE N N 15 119.874 0.00 . 1 . . . . . 116 PHE N . 53627 1 550 . 1 . 1 117 117 GLY H H 1 8.489 0.00 . 1 . . . . . 117 GLY H . 53627 1 551 . 1 . 1 117 117 GLY C C 13 173.994 0.00 . 1 . . . . . 117 GLY C . 53627 1 552 . 1 . 1 117 117 GLY CA C 13 45.375 0.00 . 1 . . . . . 117 GLY CA . 53627 1 553 . 1 . 1 117 117 GLY N N 15 110.608 0.00 . 1 . . . . . 117 GLY N . 53627 1 554 . 1 . 1 118 118 LYS H H 1 8.082 0.00 . 1 . . . . . 118 LYS H . 53627 1 555 . 1 . 1 118 118 LYS C C 13 176.342 0.00 . 1 . . . . . 118 LYS C . 53627 1 556 . 1 . 1 118 118 LYS CA C 13 56.609 0.00 . 1 . . . . . 118 LYS CA . 53627 1 557 . 1 . 1 118 118 LYS CB C 13 32.885 0.00 . 1 . . . . . 118 LYS CB . 53627 1 558 . 1 . 1 118 118 LYS N N 15 120.698 0.00 . 1 . . . . . 118 LYS N . 53627 1 559 . 1 . 1 119 119 PHE H H 1 8.307 0.00 . 1 . . . . . 119 PHE H . 53627 1 560 . 1 . 1 119 119 PHE C C 13 175.618 0.00 . 1 . . . . . 119 PHE C . 53627 1 561 . 1 . 1 119 119 PHE CA C 13 57.549 0.00 . 1 . . . . . 119 PHE CA . 53627 1 562 . 1 . 1 119 119 PHE CB C 13 39.421 0.00 . 1 . . . . . 119 PHE CB . 53627 1 563 . 1 . 1 119 119 PHE N N 15 120.353 0.00 . 1 . . . . . 119 PHE N . 53627 1 564 . 1 . 1 120 120 GLU H H 1 8.280 0.00 . 1 . . . . . 120 GLU H . 53627 1 565 . 1 . 1 120 120 GLU C C 13 176.164 0.00 . 1 . . . . . 120 GLU C . 53627 1 566 . 1 . 1 120 120 GLU CA C 13 56.400 0.00 . 1 . . . . . 120 GLU CA . 53627 1 567 . 1 . 1 120 120 GLU CB C 13 30.459 0.00 . 1 . . . . . 120 GLU CB . 53627 1 568 . 1 . 1 120 120 GLU N N 15 122.466 0.00 . 1 . . . . . 120 GLU N . 53627 1 569 . 1 . 1 121 121 ARG H H 1 8.433 0.00 . 1 . . . . . 121 ARG H . 53627 1 570 . 1 . 1 121 121 ARG C C 13 176.828 0.00 . 1 . . . . . 121 ARG C . 53627 1 571 . 1 . 1 121 121 ARG CA C 13 56.416 0.00 . 1 . . . . . 121 ARG CA . 53627 1 572 . 1 . 1 121 121 ARG CB C 13 30.648 0.00 . 1 . . . . . 121 ARG CB . 53627 1 573 . 1 . 1 121 121 ARG N N 15 122.249 0.00 . 1 . . . . . 121 ARG N . 53627 1 574 . 1 . 1 122 122 GLY H H 1 8.495 0.00 . 1 . . . . . 122 GLY H . 53627 1 575 . 1 . 1 122 122 GLY C C 13 174.705 0.00 . 1 . . . . . 122 GLY C . 53627 1 576 . 1 . 1 122 122 GLY CA C 13 45.303 0.00 . 1 . . . . . 122 GLY CA . 53627 1 577 . 1 . 1 122 122 GLY N N 15 109.989 0.00 . 1 . . . . . 122 GLY N . 53627 1 578 . 1 . 1 123 123 GLY H H 1 8.335 0.00 . 1 . . . . . 123 GLY H . 53627 1 579 . 1 . 1 123 123 GLY C C 13 174.047 0.00 . 1 . . . . . 123 GLY C . 53627 1 580 . 1 . 1 123 123 GLY CA C 13 45.406 0.00 . 1 . . . . . 123 GLY CA . 53627 1 581 . 1 . 1 123 123 GLY N N 15 108.730 0.00 . 1 . . . . . 123 GLY N . 53627 1 582 . 1 . 1 124 124 ASN H H 1 8.420 0.00 . 1 . . . . . 124 ASN H . 53627 1 583 . 1 . 1 124 124 ASN C C 13 175.415 0.00 . 1 . . . . . 124 ASN C . 53627 1 584 . 1 . 1 124 124 ASN CA C 13 53.206 0.00 . 1 . . . . . 124 ASN CA . 53627 1 585 . 1 . 1 124 124 ASN CB C 13 38.953 0.00 . 1 . . . . . 124 ASN CB . 53627 1 586 . 1 . 1 124 124 ASN N N 15 118.741 0.00 . 1 . . . . . 124 ASN N . 53627 1 587 . 1 . 1 125 125 SER H H 1 8.343 0.00 . 1 . . . . . 125 SER H . 53627 1 588 . 1 . 1 125 125 SER C C 13 174.978 0.00 . 1 . . . . . 125 SER C . 53627 1 589 . 1 . 1 125 125 SER CA C 13 58.756 0.00 . 1 . . . . . 125 SER CA . 53627 1 590 . 1 . 1 125 125 SER CB C 13 63.719 0.00 . 1 . . . . . 125 SER CB . 53627 1 591 . 1 . 1 125 125 SER N N 15 116.383 0.01 . 1 . . . . . 125 SER N . 53627 1 592 . 1 . 1 126 126 ARG H H 1 8.343 0.00 . 1 . . . . . 126 ARG H . 53627 1 593 . 1 . 1 126 126 ARG C C 13 176.220 0.00 . 1 . . . . . 126 ARG C . 53627 1 594 . 1 . 1 126 126 ARG CA C 13 56.495 0.00 . 1 . . . . . 126 ARG CA . 53627 1 595 . 1 . 1 126 126 ARG CB C 13 30.314 0.00 . 1 . . . . . 126 ARG CB . 53627 1 596 . 1 . 1 126 126 ARG N N 15 122.466 0.00 . 1 . . . . . 126 ARG N . 53627 1 597 . 1 . 1 127 127 TRP H H 1 8.177 0.00 . 1 . . . . . 127 TRP H . 53627 1 598 . 1 . 1 127 127 TRP C C 13 175.991 0.00 . 1 . . . . . 127 TRP C . 53627 1 599 . 1 . 1 127 127 TRP CA C 13 57.459 0.00 . 1 . . . . . 127 TRP CA . 53627 1 600 . 1 . 1 127 127 TRP CB C 13 29.462 0.00 . 1 . . . . . 127 TRP CB . 53627 1 601 . 1 . 1 127 127 TRP N N 15 121.461 0.00 . 1 . . . . . 127 TRP N . 53627 1 602 . 1 . 1 128 128 CYS H H 1 7.935 0.00 . 1 . . . . . 128 CYS H . 53627 1 603 . 1 . 1 128 128 CYS C C 13 173.601 0.00 . 1 . . . . . 128 CYS C . 53627 1 604 . 1 . 1 128 128 CYS CA C 13 58.029 0.00 . 1 . . . . . 128 CYS CA . 53627 1 605 . 1 . 1 128 128 CYS CB C 13 28.378 0.00 . 1 . . . . . 128 CYS CB . 53627 1 606 . 1 . 1 128 128 CYS N N 15 119.961 0.01 . 1 . . . . . 128 CYS N . 53627 1 607 . 1 . 1 129 129 ASP H H 1 8.295 0.00 . 1 . . . . . 129 ASP H . 53627 1 608 . 1 . 1 129 129 ASP C C 13 175.997 0.00 . 1 . . . . . 129 ASP C . 53627 1 609 . 1 . 1 129 129 ASP CA C 13 54.461 0.00 . 1 . . . . . 129 ASP CA . 53627 1 610 . 1 . 1 129 129 ASP CB C 13 41.227 0.00 . 1 . . . . . 129 ASP CB . 53627 1 611 . 1 . 1 129 129 ASP N N 15 122.890 0.01 . 1 . . . . . 129 ASP N . 53627 1 612 . 1 . 1 130 130 LYS H H 1 8.214 0.00 . 1 . . . . . 130 LYS H . 53627 1 613 . 1 . 1 130 130 LYS C C 13 176.589 0.00 . 1 . . . . . 130 LYS C . 53627 1 614 . 1 . 1 130 130 LYS CA C 13 56.285 0.00 . 1 . . . . . 130 LYS CA . 53627 1 615 . 1 . 1 130 130 LYS CB C 13 32.866 0.00 . 1 . . . . . 130 LYS CB . 53627 1 616 . 1 . 1 130 130 LYS N N 15 121.828 0.00 . 1 . . . . . 130 LYS N . 53627 1 617 . 1 . 1 131 131 SER H H 1 8.485 0.00 . 1 . . . . . 131 SER H . 53627 1 618 . 1 . 1 131 131 SER C C 13 174.516 0.00 . 1 . . . . . 131 SER C . 53627 1 619 . 1 . 1 131 131 SER CA C 13 58.681 0.00 . 1 . . . . . 131 SER CA . 53627 1 620 . 1 . 1 131 131 SER CB C 13 63.806 0.00 . 1 . . . . . 131 SER CB . 53627 1 621 . 1 . 1 131 131 SER N N 15 117.388 0.00 . 1 . . . . . 131 SER N . 53627 1 622 . 1 . 1 132 132 ASP H H 1 8.446 0.00 . 1 . . . . . 132 ASP H . 53627 1 623 . 1 . 1 132 132 ASP C C 13 176.325 0.00 . 1 . . . . . 132 ASP C . 53627 1 624 . 1 . 1 132 132 ASP CA C 13 54.597 0.00 . 1 . . . . . 132 ASP CA . 53627 1 625 . 1 . 1 132 132 ASP CB C 13 41.083 0.00 . 1 . . . . . 132 ASP CB . 53627 1 626 . 1 . 1 132 132 ASP N N 15 122.370 0.01 . 1 . . . . . 132 ASP N . 53627 1 627 . 1 . 1 133 133 GLU C C 13 176.440 0.00 . 1 . . . . . 133 GLU C . 53627 1 628 . 1 . 1 133 133 GLU CA C 13 56.840 0.00 . 1 . . . . . 133 GLU CA . 53627 1 629 . 1 . 1 133 133 GLU CB C 13 30.171 0.00 . 1 . . . . . 133 GLU CB . 53627 1 630 . 1 . 1 134 134 ASP H H 1 8.251 0.00 . 1 . . . . . 134 ASP H . 53627 1 631 . 1 . 1 134 134 ASP C C 13 176.002 0.00 . 1 . . . . . 134 ASP C . 53627 1 632 . 1 . 1 134 134 ASP CA C 13 54.580 0.00 . 1 . . . . . 134 ASP CA . 53627 1 633 . 1 . 1 134 134 ASP CB C 13 41.134 0.00 . 1 . . . . . 134 ASP CB . 53627 1 634 . 1 . 1 134 134 ASP N N 15 120.706 0.00 . 1 . . . . . 134 ASP N . 53627 1 635 . 1 . 1 135 135 ASP H H 1 8.199 0.00 . 1 . . . . . 135 ASP H . 53627 1 636 . 1 . 1 135 135 ASP C C 13 176.363 0.00 . 1 . . . . . 135 ASP C . 53627 1 637 . 1 . 1 135 135 ASP CA C 13 54.375 0.00 . 1 . . . . . 135 ASP CA . 53627 1 638 . 1 . 1 135 135 ASP CB C 13 40.851 0.00 . 1 . . . . . 135 ASP CB . 53627 1 639 . 1 . 1 135 135 ASP N N 15 120.359 0.00 . 1 . . . . . 135 ASP N . 53627 1 640 . 1 . 1 136 136 TRP H H 1 8.083 0.00 . 1 . . . . . 136 TRP H . 53627 1 641 . 1 . 1 136 136 TRP C C 13 176.413 0.00 . 1 . . . . . 136 TRP C . 53627 1 642 . 1 . 1 136 136 TRP CA C 13 57.438 0.00 . 1 . . . . . 136 TRP CA . 53627 1 643 . 1 . 1 136 136 TRP CB C 13 29.126 0.00 . 1 . . . . . 136 TRP CB . 53627 1 644 . 1 . 1 136 136 TRP N N 15 121.585 0.01 . 1 . . . . . 136 TRP N . 53627 1 645 . 1 . 1 137 137 SER H H 1 8.044 0.00 . 1 . . . . . 137 SER H . 53627 1 646 . 1 . 1 137 137 SER C C 13 173.758 0.01 . 1 . . . . . 137 SER C . 53627 1 647 . 1 . 1 137 137 SER CA C 13 58.530 0.00 . 1 . . . . . 137 SER CA . 53627 1 648 . 1 . 1 137 137 SER CB C 13 63.712 0.00 . 1 . . . . . 137 SER CB . 53627 1 649 . 1 . 1 137 137 SER N N 15 116.947 0.01 . 1 . . . . . 137 SER N . 53627 1 650 . 1 . 1 138 138 LYS H H 1 7.914 0.00 . 1 . . . . . 138 LYS H . 53627 1 651 . 1 . 1 138 138 LYS C C 13 174.144 0.00 . 1 . . . . . 138 LYS C . 53627 1 652 . 1 . 1 138 138 LYS CA C 13 54.314 0.00 . 1 . . . . . 138 LYS CA . 53627 1 653 . 1 . 1 138 138 LYS CB C 13 32.531 0.00 . 1 . . . . . 138 LYS CB . 53627 1 654 . 1 . 1 138 138 LYS N N 15 124.128 0.00 . 1 . . . . . 138 LYS N . 53627 1 655 . 1 . 1 139 139 PRO C C 13 176.679 0.00 . 1 . . . . . 139 PRO C . 53627 1 656 . 1 . 1 139 139 PRO CA C 13 62.761 0.00 . 1 . . . . . 139 PRO CA . 53627 1 657 . 1 . 1 139 139 PRO CB C 13 32.051 0.00 . 1 . . . . . 139 PRO CB . 53627 1 658 . 1 . 1 140 140 LEU H H 1 8.428 0.00 . 1 . . . . . 140 LEU H . 53627 1 659 . 1 . 1 140 140 LEU C C 13 174.847 0.00 . 1 . . . . . 140 LEU C . 53627 1 660 . 1 . 1 140 140 LEU CA C 13 52.921 0.00 . 1 . . . . . 140 LEU CA . 53627 1 661 . 1 . 1 140 140 LEU CB C 13 41.681 0.00 . 1 . . . . . 140 LEU CB . 53627 1 662 . 1 . 1 140 140 LEU N N 15 124.090 0.00 . 1 . . . . . 140 LEU N . 53627 1 663 . 1 . 1 142 142 PRO C C 13 177.347 0.00 . 1 . . . . . 142 PRO C . 53627 1 664 . 1 . 1 142 142 PRO CA C 13 63.658 0.00 . 1 . . . . . 142 PRO CA . 53627 1 665 . 1 . 1 142 142 PRO CB C 13 32.007 0.00 . 1 . . . . . 142 PRO CB . 53627 1 666 . 1 . 1 143 143 SER H H 1 8.417 0.00 . 1 . . . . . 143 SER H . 53627 1 667 . 1 . 1 143 143 SER C C 13 174.969 0.00 . 1 . . . . . 143 SER C . 53627 1 668 . 1 . 1 143 143 SER CA C 13 58.960 0.00 . 1 . . . . . 143 SER CA . 53627 1 669 . 1 . 1 143 143 SER CB C 13 63.558 0.00 . 1 . . . . . 143 SER CB . 53627 1 670 . 1 . 1 143 143 SER N N 15 115.087 0.00 . 1 . . . . . 143 SER N . 53627 1 671 . 1 . 1 144 144 GLU H H 1 8.369 0.00 . 1 . . . . . 144 GLU H . 53627 1 672 . 1 . 1 144 144 GLU C C 13 176.436 0.00 . 1 . . . . . 144 GLU C . 53627 1 673 . 1 . 1 144 144 GLU CA C 13 56.709 0.00 . 1 . . . . . 144 GLU CA . 53627 1 674 . 1 . 1 144 144 GLU CB C 13 30.255 0.00 . 1 . . . . . 144 GLU CB . 53627 1 675 . 1 . 1 144 144 GLU N N 15 122.624 0.01 . 1 . . . . . 144 GLU N . 53627 1 676 . 1 . 1 145 145 ARG H H 1 8.198 0.00 . 1 . . . . . 145 ARG H . 53627 1 677 . 1 . 1 145 145 ARG C C 13 176.377 0.00 . 1 . . . . . 145 ARG C . 53627 1 678 . 1 . 1 145 145 ARG CA C 13 56.548 0.00 . 1 . . . . . 145 ARG CA . 53627 1 679 . 1 . 1 145 145 ARG CB C 13 30.579 0.00 . 1 . . . . . 145 ARG CB . 53627 1 680 . 1 . 1 145 145 ARG N N 15 121.499 0.01 . 1 . . . . . 145 ARG N . 53627 1 681 . 1 . 1 146 146 LEU H H 1 8.300 0.00 . 1 . . . . . 146 LEU H . 53627 1 682 . 1 . 1 146 146 LEU C C 13 177.688 0.00 . 1 . . . . . 146 LEU C . 53627 1 683 . 1 . 1 146 146 LEU CA C 13 55.558 0.00 . 1 . . . . . 146 LEU CA . 53627 1 684 . 1 . 1 146 146 LEU CB C 13 42.180 0.00 . 1 . . . . . 146 LEU CB . 53627 1 685 . 1 . 1 146 146 LEU N N 15 123.255 0.00 . 1 . . . . . 146 LEU N . 53627 1 686 . 1 . 1 147 147 GLU H H 1 8.416 0.00 . 1 . . . . . 147 GLU H . 53627 1 687 . 1 . 1 147 147 GLU C C 13 176.756 0.00 . 1 . . . . . 147 GLU C . 53627 1 688 . 1 . 1 147 147 GLU CA C 13 56.971 0.00 . 1 . . . . . 147 GLU CA . 53627 1 689 . 1 . 1 147 147 GLU CB C 13 29.910 0.00 . 1 . . . . . 147 GLU CB . 53627 1 690 . 1 . 1 147 147 GLU N N 15 121.249 0.01 . 1 . . . . . 147 GLU N . 53627 1 691 . 1 . 1 148 148 GLN H H 1 8.316 0.00 . 1 . . . . . 148 GLN H . 53627 1 692 . 1 . 1 148 148 GLN C C 13 176.297 0.00 . 1 . . . . . 148 GLN C . 53627 1 693 . 1 . 1 148 148 GLN CA C 13 56.451 0.00 . 1 . . . . . 148 GLN CA . 53627 1 694 . 1 . 1 148 148 GLN CB C 13 29.502 0.00 . 1 . . . . . 148 GLN CB . 53627 1 695 . 1 . 1 148 148 GLN N N 15 120.354 0.02 . 1 . . . . . 148 GLN N . 53627 1 696 . 1 . 1 149 149 GLU H H 1 8.426 0.00 . 1 . . . . . 149 GLU H . 53627 1 697 . 1 . 1 149 149 GLU C C 13 176.603 0.00 . 1 . . . . . 149 GLU C . 53627 1 698 . 1 . 1 149 149 GLU CA C 13 56.912 0.00 . 1 . . . . . 149 GLU CA . 53627 1 699 . 1 . 1 149 149 GLU CB C 13 30.018 0.00 . 1 . . . . . 149 GLU CB . 53627 1 700 . 1 . 1 149 149 GLU N N 15 121.915 0.00 . 1 . . . . . 149 GLU N . 53627 1 701 . 1 . 1 150 150 LEU H H 1 8.213 0.00 . 1 . . . . . 150 LEU H . 53627 1 702 . 1 . 1 150 150 LEU C C 13 177.317 0.00 . 1 . . . . . 150 LEU C . 53627 1 703 . 1 . 1 150 150 LEU CA C 13 55.352 0.00 . 1 . . . . . 150 LEU CA . 53627 1 704 . 1 . 1 150 150 LEU CB C 13 42.318 0.00 . 1 . . . . . 150 LEU CB . 53627 1 705 . 1 . 1 150 150 LEU N N 15 122.586 0.01 . 1 . . . . . 150 LEU N . 53627 1 706 . 1 . 1 151 151 PHE H H 1 8.272 0.00 . 1 . . . . . 151 PHE H . 53627 1 707 . 1 . 1 151 151 PHE C C 13 176.009 0.00 . 1 . . . . . 151 PHE C . 53627 1 708 . 1 . 1 151 151 PHE CA C 13 57.811 0.00 . 1 . . . . . 151 PHE CA . 53627 1 709 . 1 . 1 151 151 PHE CB C 13 39.393 0.00 . 1 . . . . . 151 PHE CB . 53627 1 710 . 1 . 1 151 151 PHE N N 15 120.531 0.00 . 1 . . . . . 151 PHE N . 53627 1 711 . 1 . 1 152 152 SER H H 1 8.308 0.00 . 1 . . . . . 152 SER H . 53627 1 712 . 1 . 1 152 152 SER C C 13 174.964 0.00 . 1 . . . . . 152 SER C . 53627 1 713 . 1 . 1 152 152 SER CA C 13 58.419 0.00 . 1 . . . . . 152 SER CA . 53627 1 714 . 1 . 1 152 152 SER CB C 13 63.824 0.00 . 1 . . . . . 152 SER CB . 53627 1 715 . 1 . 1 152 152 SER N N 15 117.590 0.00 . 1 . . . . . 152 SER N . 53627 1 716 . 1 . 1 153 153 GLY H H 1 8.033 0.00 . 1 . . . . . 153 GLY H . 53627 1 717 . 1 . 1 153 153 GLY C C 13 174.588 0.00 . 1 . . . . . 153 GLY C . 53627 1 718 . 1 . 1 153 153 GLY CA C 13 45.466 0.00 . 1 . . . . . 153 GLY CA . 53627 1 719 . 1 . 1 153 153 GLY N N 15 110.428 0.00 . 1 . . . . . 153 GLY N . 53627 1 720 . 1 . 1 154 154 GLY H H 1 8.291 0.00 . 1 . . . . . 154 GLY H . 53627 1 721 . 1 . 1 154 154 GLY C C 13 173.935 0.00 . 1 . . . . . 154 GLY C . 53627 1 722 . 1 . 1 154 154 GLY CA C 13 45.250 0.00 . 1 . . . . . 154 GLY CA . 53627 1 723 . 1 . 1 154 154 GLY N N 15 108.605 0.01 . 1 . . . . . 154 GLY N . 53627 1 724 . 1 . 1 155 155 ASN H H 1 8.449 0.00 . 1 . . . . . 155 ASN H . 53627 1 725 . 1 . 1 155 155 ASN C C 13 175.579 0.00 . 1 . . . . . 155 ASN C . 53627 1 726 . 1 . 1 155 155 ASN CA C 13 53.161 0.00 . 1 . . . . . 155 ASN CA . 53627 1 727 . 1 . 1 155 155 ASN CB C 13 38.763 0.00 . 1 . . . . . 155 ASN CB . 53627 1 728 . 1 . 1 155 155 ASN N N 15 118.940 0.00 . 1 . . . . . 155 ASN N . 53627 1 729 . 1 . 1 156 156 THR H H 1 8.222 0.00 . 1 . . . . . 156 THR H . 53627 1 730 . 1 . 1 156 156 THR C C 13 175.158 0.00 . 1 . . . . . 156 THR C . 53627 1 731 . 1 . 1 156 156 THR CA C 13 62.009 0.00 . 1 . . . . . 156 THR CA . 53627 1 732 . 1 . 1 156 156 THR CB C 13 69.748 0.00 . 1 . . . . . 156 THR CB . 53627 1 733 . 1 . 1 156 156 THR N N 15 113.508 0.00 . 1 . . . . . 156 THR N . 53627 1 734 . 1 . 1 157 157 GLY H H 1 8.453 0.00 . 1 . . . . . 157 GLY H . 53627 1 735 . 1 . 1 157 157 GLY C C 13 174.035 0.00 . 1 . . . . . 157 GLY C . 53627 1 736 . 1 . 1 157 157 GLY CA C 13 45.291 0.00 . 1 . . . . . 157 GLY CA . 53627 1 737 . 1 . 1 157 157 GLY N N 15 111.056 0.00 . 1 . . . . . 157 GLY N . 53627 1 738 . 1 . 1 158 158 ILE H H 1 7.967 0.00 . 1 . . . . . 158 ILE H . 53627 1 739 . 1 . 1 158 158 ILE C C 13 175.708 0.00 . 1 . . . . . 158 ILE C . 53627 1 740 . 1 . 1 158 158 ILE CA C 13 61.215 0.00 . 1 . . . . . 158 ILE CA . 53627 1 741 . 1 . 1 158 158 ILE CB C 13 38.734 0.00 . 1 . . . . . 158 ILE CB . 53627 1 742 . 1 . 1 158 158 ILE N N 15 119.836 0.00 . 1 . . . . . 158 ILE N . 53627 1 743 . 1 . 1 159 159 ASN H H 1 8.468 0.00 . 1 . . . . . 159 ASN H . 53627 1 744 . 1 . 1 159 159 ASN C C 13 174.686 0.00 . 1 . . . . . 159 ASN C . 53627 1 745 . 1 . 1 159 159 ASN CA C 13 52.930 0.00 . 1 . . . . . 159 ASN CA . 53627 1 746 . 1 . 1 159 159 ASN CB C 13 38.832 0.00 . 1 . . . . . 159 ASN CB . 53627 1 747 . 1 . 1 159 159 ASN N N 15 122.258 0.00 . 1 . . . . . 159 ASN N . 53627 1 748 . 1 . 1 160 160 PHE H H 1 8.214 0.00 . 1 . . . . . 160 PHE H . 53627 1 749 . 1 . 1 160 160 PHE C C 13 175.554 0.00 . 1 . . . . . 160 PHE C . 53627 1 750 . 1 . 1 160 160 PHE CA C 13 58.061 0.00 . 1 . . . . . 160 PHE CA . 53627 1 751 . 1 . 1 160 160 PHE CB C 13 39.384 0.00 . 1 . . . . . 160 PHE CB . 53627 1 752 . 1 . 1 160 160 PHE N N 15 121.256 0.00 . 1 . . . . . 160 PHE N . 53627 1 753 . 1 . 1 161 161 GLU H H 1 8.332 0.00 . 1 . . . . . 161 GLU H . 53627 1 754 . 1 . 1 161 161 GLU C C 13 175.725 0.00 . 1 . . . . . 161 GLU C . 53627 1 755 . 1 . 1 161 161 GLU CA C 13 56.516 0.00 . 1 . . . . . 161 GLU CA . 53627 1 756 . 1 . 1 161 161 GLU CB C 13 30.150 0.00 . 1 . . . . . 161 GLU CB . 53627 1 757 . 1 . 1 161 161 GLU N N 15 122.195 0.01 . 1 . . . . . 161 GLU N . 53627 1 758 . 1 . 1 162 162 LYS H H 1 8.128 0.00 . 1 . . . . . 162 LYS H . 53627 1 759 . 1 . 1 162 162 LYS C C 13 176.015 0.00 . 1 . . . . . 162 LYS C . 53627 1 760 . 1 . 1 162 162 LYS CA C 13 56.032 0.04 . 1 . . . . . 162 LYS CA . 53627 1 761 . 1 . 1 162 162 LYS CB C 13 33.170 0.00 . 1 . . . . . 162 LYS CB . 53627 1 762 . 1 . 1 162 162 LYS N N 15 121.777 0.00 . 1 . . . . . 162 LYS N . 53627 1 763 . 1 . 1 163 163 TYR H H 1 8.283 0.00 . 1 . . . . . 163 TYR H . 53627 1 764 . 1 . 1 163 163 TYR C C 13 175.491 0.00 . 1 . . . . . 163 TYR C . 53627 1 765 . 1 . 1 163 163 TYR CA C 13 57.662 0.00 . 1 . . . . . 163 TYR CA . 53627 1 766 . 1 . 1 163 163 TYR CB C 13 38.841 0.00 . 1 . . . . . 163 TYR CB . 53627 1 767 . 1 . 1 163 163 TYR N N 15 121.873 0.00 . 1 . . . . . 163 TYR N . 53627 1 768 . 1 . 1 164 164 ASP H H 1 8.314 0.00 . 1 . . . . . 164 ASP H . 53627 1 769 . 1 . 1 164 164 ASP C C 13 175.505 0.00 . 1 . . . . . 164 ASP C . 53627 1 770 . 1 . 1 164 164 ASP CA C 13 54.174 0.00 . 1 . . . . . 164 ASP CA . 53627 1 771 . 1 . 1 164 164 ASP CB C 13 41.234 0.00 . 1 . . . . . 164 ASP CB . 53627 1 772 . 1 . 1 164 164 ASP N N 15 121.625 0.00 . 1 . . . . . 164 ASP N . 53627 1 773 . 1 . 1 165 165 ASP H H 1 8.227 0.00 . 1 . . . . . 165 ASP H . 53627 1 774 . 1 . 1 165 165 ASP C C 13 175.675 0.00 . 1 . . . . . 165 ASP C . 53627 1 775 . 1 . 1 165 165 ASP CA C 13 54.110 0.00 . 1 . . . . . 165 ASP CA . 53627 1 776 . 1 . 1 165 165 ASP CB C 13 41.110 0.00 . 1 . . . . . 165 ASP CB . 53627 1 777 . 1 . 1 165 165 ASP N N 15 120.398 0.01 . 1 . . . . . 165 ASP N . 53627 1 778 . 1 . 1 166 166 ILE H H 1 8.080 0.00 . 1 . . . . . 166 ILE H . 53627 1 779 . 1 . 1 166 166 ILE C C 13 174.516 0.00 . 1 . . . . . 166 ILE C . 53627 1 780 . 1 . 1 166 166 ILE CA C 13 58.701 0.00 . 1 . . . . . 166 ILE CA . 53627 1 781 . 1 . 1 166 166 ILE CB C 13 38.520 0.00 . 1 . . . . . 166 ILE CB . 53627 1 782 . 1 . 1 166 166 ILE N N 15 123.076 0.00 . 1 . . . . . 166 ILE N . 53627 1 783 . 1 . 1 167 167 PRO C C 13 176.133 0.00 . 1 . . . . . 167 PRO C . 53627 1 784 . 1 . 1 167 167 PRO CA C 13 63.356 0.00 . 1 . . . . . 167 PRO CA . 53627 1 785 . 1 . 1 167 167 PRO CB C 13 32.019 0.00 . 1 . . . . . 167 PRO CB . 53627 1 786 . 1 . 1 168 168 VAL H H 1 7.868 0.00 . 1 . . . . . 168 VAL H . 53627 1 787 . 1 . 1 168 168 VAL C C 13 181.333 0.00 . 1 . . . . . 168 VAL C . 53627 1 788 . 1 . 1 168 168 VAL CA C 13 63.553 0.00 . 1 . . . . . 168 VAL CA . 53627 1 789 . 1 . 1 168 168 VAL CB C 13 33.069 0.00 . 1 . . . . . 168 VAL CB . 53627 1 790 . 1 . 1 168 168 VAL N N 15 124.699 0.00 . 1 . . . . . 168 VAL N . 53627 1 stop_ save_