data_30977 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 30977 _Entry.Title ; NMR structure of crosslinked cyclophilin A ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2021-12-20 _Entry.Accession_date 2021-12-20 _Entry.Last_release_date 2022-01-19 _Entry.Original_release_date 2022-01-19 _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 NMR' _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 M. Lu M. . . . 30977 2 D. Toptygin D. . . . 30977 3 Y. Xiang Y. . . . 30977 4 Y. Shi Y. . . . 30977 5 C. Schwieters C. D. . . 30977 6 E. Lipinski E. C. . . 30977 7 J. Ahn J. . . . 30977 8 I. Byeon I. J.L. . . 30977 9 A. Gronenborn A. M. . . 30977 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID Isomerase . 30977 'side chain crosslink' . 30977 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 30977 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 509 30977 '15N chemical shifts' 172 30977 '1H chemical shifts' 944 30977 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 2 . . 2022-06-27 2021-12-20 update BMRB 'update entry citation' 30977 1 . . 2022-05-26 2021-12-20 original author 'original release' 30977 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 7TA8 'BMRB Entry Tracking System' 30977 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 30977 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 35574633 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; The Magic of Linking Rings: Discovery of a Unique Photoinduced Fluorescent Protein Crosslink ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Am. Chem. Soc.' _Citation.Journal_name_full . _Citation.Journal_volume 144 _Citation.Journal_issue 24 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD 0353 _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 10809 _Citation.Page_last 10816 _Citation.Year 2022 _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 M. Lu M. . . . 30977 1 2 D. Toptygin D. . . . 30977 1 3 Y. Xiang Y. . . . 30977 1 4 Y. Shi Y. . . . 30977 1 5 C. Schwieters C. D. . . 30977 1 6 E. Lipinski E. C. . . 30977 1 7 J. Ahn J. . . . 30977 1 8 I. Byeon I. J.L. . . 30977 1 9 A. Gronenborn A. M. . . 30977 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 30977 _Assembly.ID 1 _Assembly.Name 'Peptidyl-prolyl cis-trans isomerase A (E.C.5.2.1.8)' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _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 unit_1 1 $entity_1 A A yes . . . . . . 30977 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 30977 _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 A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MQNPTVFFDIAVDGEPLGRV SFELFADKVPKTAENFRALS TGEKGFGYKGSCFHRIIPGF MCQGGDFTRHNGTGGKSIYG EKFEDENFILKHTGPGILSM ANAGPNTNGSQFFICTAKTE WLDGKHVVFGKVKEGMNIVE AMERFGSRNGKTSKKITIAD CGQLE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 165 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number 5.2.1.8 _Entity.Calc_isoelectric_point . _Entity.Formula_weight 18065.502 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Cyclophilin A' common 30977 1 'Cyclosporin A-binding protein' common 30977 1 'PPIase A' common 30977 1 'Rotamase A' common 30977 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 . 30977 1 2 . GLN . 30977 1 3 . ASN . 30977 1 4 . PRO . 30977 1 5 . THR . 30977 1 6 . VAL . 30977 1 7 . PHE . 30977 1 8 . PHE . 30977 1 9 . ASP . 30977 1 10 . ILE . 30977 1 11 . ALA . 30977 1 12 . VAL . 30977 1 13 . ASP . 30977 1 14 . GLY . 30977 1 15 . GLU . 30977 1 16 . PRO . 30977 1 17 . LEU . 30977 1 18 . GLY . 30977 1 19 . ARG . 30977 1 20 . VAL . 30977 1 21 . SER . 30977 1 22 . PHE . 30977 1 23 . GLU . 30977 1 24 . LEU . 30977 1 25 . PHE . 30977 1 26 . ALA . 30977 1 27 . ASP . 30977 1 28 . LYS . 30977 1 29 . VAL . 30977 1 30 . PRO . 30977 1 31 . LYS . 30977 1 32 . THR . 30977 1 33 . ALA . 30977 1 34 . GLU . 30977 1 35 . ASN . 30977 1 36 . PHE . 30977 1 37 . ARG . 30977 1 38 . ALA . 30977 1 39 . LEU . 30977 1 40 . SER . 30977 1 41 . THR . 30977 1 42 . GLY . 30977 1 43 . GLU . 30977 1 44 . LYS . 30977 1 45 . GLY . 30977 1 46 . PHE . 30977 1 47 . GLY . 30977 1 48 . TYR . 30977 1 49 . LYS . 30977 1 50 . GLY . 30977 1 51 . SER . 30977 1 52 . CYS . 30977 1 53 . PHE . 30977 1 54 . HIS . 30977 1 55 . ARG . 30977 1 56 . ILE . 30977 1 57 . ILE . 30977 1 58 . PRO . 30977 1 59 . GLY . 30977 1 60 . PHE . 30977 1 61 . MET . 30977 1 62 . CYS . 30977 1 63 . GLN . 30977 1 64 . GLY . 30977 1 65 . GLY . 30977 1 66 . ASP . 30977 1 67 . PHE . 30977 1 68 . THR . 30977 1 69 . ARG . 30977 1 70 . HIS . 30977 1 71 . ASN . 30977 1 72 . GLY . 30977 1 73 . THR . 30977 1 74 . GLY . 30977 1 75 . GLY . 30977 1 76 . LYS . 30977 1 77 . SER . 30977 1 78 . ILE . 30977 1 79 . TYR . 30977 1 80 . GLY . 30977 1 81 . GLU . 30977 1 82 . LYS . 30977 1 83 . PHE . 30977 1 84 . GLU . 30977 1 85 . ASP . 30977 1 86 . GLU . 30977 1 87 . ASN . 30977 1 88 . PHE . 30977 1 89 . ILE . 30977 1 90 . LEU . 30977 1 91 . LYS . 30977 1 92 . HIS . 30977 1 93 . THR . 30977 1 94 . GLY . 30977 1 95 . PRO . 30977 1 96 . GLY . 30977 1 97 . ILE . 30977 1 98 . LEU . 30977 1 99 . SER . 30977 1 100 . MET . 30977 1 101 . ALA . 30977 1 102 . ASN . 30977 1 103 . ALA . 30977 1 104 . GLY . 30977 1 105 . PRO . 30977 1 106 . ASN . 30977 1 107 . THR . 30977 1 108 . ASN . 30977 1 109 . GLY . 30977 1 110 . SER . 30977 1 111 . GLN . 30977 1 112 . PHE . 30977 1 113 . PHE . 30977 1 114 . ILE . 30977 1 115 . CYS . 30977 1 116 . THR . 30977 1 117 . ALA . 30977 1 118 . LYS . 30977 1 119 . THR . 30977 1 120 . GLU . 30977 1 121 . TRP . 30977 1 122 . LEU . 30977 1 123 . ASP . 30977 1 124 . GLY . 30977 1 125 . LYS . 30977 1 126 . HIS . 30977 1 127 . VAL . 30977 1 128 . VAL . 30977 1 129 . PHE . 30977 1 130 . GLY . 30977 1 131 . LYS . 30977 1 132 . VAL . 30977 1 133 . LYS . 30977 1 134 . GLU . 30977 1 135 . GLY . 30977 1 136 . MET . 30977 1 137 . ASN . 30977 1 138 . ILE . 30977 1 139 . VAL . 30977 1 140 . GLU . 30977 1 141 . ALA . 30977 1 142 . MET . 30977 1 143 . GLU . 30977 1 144 . ARG . 30977 1 145 . PHE . 30977 1 146 . GLY . 30977 1 147 . SER . 30977 1 148 . ARG . 30977 1 149 . ASN . 30977 1 150 . GLY . 30977 1 151 . LYS . 30977 1 152 . THR . 30977 1 153 . SER . 30977 1 154 . LYS . 30977 1 155 . LYS . 30977 1 156 . ILE . 30977 1 157 . THR . 30977 1 158 . ILE . 30977 1 159 . ALA . 30977 1 160 . ASP . 30977 1 161 . CYS . 30977 1 162 . GLY . 30977 1 163 . GLN . 30977 1 164 . LEU . 30977 1 165 . GLU . 30977 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 30977 1 . GLN 2 2 30977 1 . ASN 3 3 30977 1 . PRO 4 4 30977 1 . THR 5 5 30977 1 . VAL 6 6 30977 1 . PHE 7 7 30977 1 . PHE 8 8 30977 1 . ASP 9 9 30977 1 . ILE 10 10 30977 1 . ALA 11 11 30977 1 . VAL 12 12 30977 1 . ASP 13 13 30977 1 . GLY 14 14 30977 1 . GLU 15 15 30977 1 . PRO 16 16 30977 1 . LEU 17 17 30977 1 . GLY 18 18 30977 1 . ARG 19 19 30977 1 . VAL 20 20 30977 1 . SER 21 21 30977 1 . PHE 22 22 30977 1 . GLU 23 23 30977 1 . LEU 24 24 30977 1 . PHE 25 25 30977 1 . ALA 26 26 30977 1 . ASP 27 27 30977 1 . LYS 28 28 30977 1 . VAL 29 29 30977 1 . PRO 30 30 30977 1 . LYS 31 31 30977 1 . THR 32 32 30977 1 . ALA 33 33 30977 1 . GLU 34 34 30977 1 . ASN 35 35 30977 1 . PHE 36 36 30977 1 . ARG 37 37 30977 1 . ALA 38 38 30977 1 . LEU 39 39 30977 1 . SER 40 40 30977 1 . THR 41 41 30977 1 . GLY 42 42 30977 1 . GLU 43 43 30977 1 . LYS 44 44 30977 1 . GLY 45 45 30977 1 . PHE 46 46 30977 1 . GLY 47 47 30977 1 . TYR 48 48 30977 1 . LYS 49 49 30977 1 . GLY 50 50 30977 1 . SER 51 51 30977 1 . CYS 52 52 30977 1 . PHE 53 53 30977 1 . HIS 54 54 30977 1 . ARG 55 55 30977 1 . ILE 56 56 30977 1 . ILE 57 57 30977 1 . PRO 58 58 30977 1 . GLY 59 59 30977 1 . PHE 60 60 30977 1 . MET 61 61 30977 1 . CYS 62 62 30977 1 . GLN 63 63 30977 1 . GLY 64 64 30977 1 . GLY 65 65 30977 1 . ASP 66 66 30977 1 . PHE 67 67 30977 1 . THR 68 68 30977 1 . ARG 69 69 30977 1 . HIS 70 70 30977 1 . ASN 71 71 30977 1 . GLY 72 72 30977 1 . THR 73 73 30977 1 . GLY 74 74 30977 1 . GLY 75 75 30977 1 . LYS 76 76 30977 1 . SER 77 77 30977 1 . ILE 78 78 30977 1 . TYR 79 79 30977 1 . GLY 80 80 30977 1 . GLU 81 81 30977 1 . LYS 82 82 30977 1 . PHE 83 83 30977 1 . GLU 84 84 30977 1 . ASP 85 85 30977 1 . GLU 86 86 30977 1 . ASN 87 87 30977 1 . PHE 88 88 30977 1 . ILE 89 89 30977 1 . LEU 90 90 30977 1 . LYS 91 91 30977 1 . HIS 92 92 30977 1 . THR 93 93 30977 1 . GLY 94 94 30977 1 . PRO 95 95 30977 1 . GLY 96 96 30977 1 . ILE 97 97 30977 1 . LEU 98 98 30977 1 . SER 99 99 30977 1 . MET 100 100 30977 1 . ALA 101 101 30977 1 . ASN 102 102 30977 1 . ALA 103 103 30977 1 . GLY 104 104 30977 1 . PRO 105 105 30977 1 . ASN 106 106 30977 1 . THR 107 107 30977 1 . ASN 108 108 30977 1 . GLY 109 109 30977 1 . SER 110 110 30977 1 . GLN 111 111 30977 1 . PHE 112 112 30977 1 . PHE 113 113 30977 1 . ILE 114 114 30977 1 . CYS 115 115 30977 1 . THR 116 116 30977 1 . ALA 117 117 30977 1 . LYS 118 118 30977 1 . THR 119 119 30977 1 . GLU 120 120 30977 1 . TRP 121 121 30977 1 . LEU 122 122 30977 1 . ASP 123 123 30977 1 . GLY 124 124 30977 1 . LYS 125 125 30977 1 . HIS 126 126 30977 1 . VAL 127 127 30977 1 . VAL 128 128 30977 1 . PHE 129 129 30977 1 . GLY 130 130 30977 1 . LYS 131 131 30977 1 . VAL 132 132 30977 1 . LYS 133 133 30977 1 . GLU 134 134 30977 1 . GLY 135 135 30977 1 . MET 136 136 30977 1 . ASN 137 137 30977 1 . ILE 138 138 30977 1 . VAL 139 139 30977 1 . GLU 140 140 30977 1 . ALA 141 141 30977 1 . MET 142 142 30977 1 . GLU 143 143 30977 1 . ARG 144 144 30977 1 . PHE 145 145 30977 1 . GLY 146 146 30977 1 . SER 147 147 30977 1 . ARG 148 148 30977 1 . ASN 149 149 30977 1 . GLY 150 150 30977 1 . LYS 151 151 30977 1 . THR 152 152 30977 1 . SER 153 153 30977 1 . LYS 154 154 30977 1 . LYS 155 155 30977 1 . ILE 156 156 30977 1 . THR 157 157 30977 1 . ILE 158 158 30977 1 . ALA 159 159 30977 1 . ASP 160 160 30977 1 . CYS 161 161 30977 1 . GLY 162 162 30977 1 . GLN 163 163 30977 1 . LEU 164 164 30977 1 . GLU 165 165 30977 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 30977 _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 . . . . . . . . . . . 'PPIA, CYPA' . 30977 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 30977 _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' . . 562 Escherichia coli . . . . . . . . . . 30977 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 30977 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '390 uM [U-13C; U-15N] cyclophilin A, 93% H2O/7% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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 'cyclophilin A' '[U-13C; U-15N]' . . 1 $entity_1 . . 390 . . uM . . . . 30977 1 2 'sodium phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 30977 1 3 TCEP 'natural abundance' . . . . . . 1 . . mM . . . . 30977 1 4 NaN3 'natural abundance' . . . . . . 0.02 . . % . . . . 30977 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 30977 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 25 . mM 30977 1 pH 6.5 . pH 30977 1 pressure 1 . atm 30977 1 temperature 298 . K 30977 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 30977 _Software.ID 1 _Software.Type . _Software.Name 'CcpNmr Analysis' _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 30977 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 30977 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 30977 _Software.ID 2 _Software.Type . _Software.Name 'X-PLOR NIH' _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 30977 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID refinement . 30977 2 'structure calculation' . 30977 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 30977 _Software.ID 3 _Software.Type . _Software.Name TopSpin _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 30977 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 30977 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 30977 _Software.ID 4 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 30977 4 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 30977 4 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 30977 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 30977 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III HD' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 30977 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker AVANCE . 900 . . . 30977 1 2 NMR_spectrometer_2 Bruker 'AVANCE III HD' . 600 . . . 30977 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 30977 _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 . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30977 1 2 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30977 1 3 '2D 1H-13C TROSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30977 1 4 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30977 1 5 '3D HNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30977 1 6 '3D HN(CO)CA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30977 1 7 '3D C(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30977 1 8 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30977 1 9 '3D H(CCO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30977 1 10 '3D simultaneous 13C,15N-edited NOESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 30977 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 30977 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _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 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.251449530 . . . . . 30977 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 30977 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.101329118 . . . . . 30977 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 30977 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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' . . . 30977 1 2 '2D 1H-13C HSQC aromatic' . . . 30977 1 3 '2D 1H-13C TROSY' . . . 30977 1 4 '3D HNCACB' . . . 30977 1 5 '3D HNCA' . . . 30977 1 6 '3D HN(CO)CA' . . . 30977 1 7 '3D C(CO)NH' . . . 30977 1 8 '3D HNCO' . . . 30977 1 9 '3D H(CCO)NH' . . . 30977 1 10 '3D simultaneous 13C,15N-edited NOESY' . . . 30977 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 GLN HA H 1 4.473 0.011 . 1 . . . . A 2 GLN HA . 30977 1 2 . 1 . 1 2 2 GLN HB3 H 1 2.096 0.013 . 1 . . . . A 2 GLN HB3 . 30977 1 3 . 1 . 1 2 2 GLN HG3 H 1 2.416 0.013 . 1 . . . . A 2 GLN HG3 . 30977 1 4 . 1 . 1 2 2 GLN HE21 H 1 6.941 0.004 . 1 . . . . A 2 GLN HE21 . 30977 1 5 . 1 . 1 2 2 GLN HE22 H 1 7.646 0.001 . 1 . . . . A 2 GLN HE22 . 30977 1 6 . 1 . 1 2 2 GLN CA C 13 55.522 0.000 . 1 . . . . A 2 GLN CA . 30977 1 7 . 1 . 1 2 2 GLN CB C 13 30.340 0.000 . 1 . . . . A 2 GLN CB . 30977 1 8 . 1 . 1 2 2 GLN CG C 13 33.584 0.000 . 1 . . . . A 2 GLN CG . 30977 1 9 . 1 . 1 2 2 GLN NE2 N 15 112.733 0.003 . 1 . . . . A 2 GLN NE2 . 30977 1 10 . 1 . 1 3 3 ASN H H 1 8.880 0.008 . 1 . . . . A 3 ASN H . 30977 1 11 . 1 . 1 3 3 ASN HA H 1 5.159 0.001 . 1 . . . . A 3 ASN HA . 30977 1 12 . 1 . 1 3 3 ASN HB2 H 1 3.719 0.009 . 2 . . . . A 3 ASN HB2 . 30977 1 13 . 1 . 1 3 3 ASN HB3 H 1 2.807 0.013 . 2 . . . . A 3 ASN HB3 . 30977 1 14 . 1 . 1 3 3 ASN HD21 H 1 7.047 0.008 . 1 . . . . A 3 ASN HD21 . 30977 1 15 . 1 . 1 3 3 ASN HD22 H 1 8.589 0.003 . 1 . . . . A 3 ASN HD22 . 30977 1 16 . 1 . 1 3 3 ASN CA C 13 51.400 0.006 . 1 . . . . A 3 ASN CA . 30977 1 17 . 1 . 1 3 3 ASN CB C 13 37.950 0.000 . 1 . . . . A 3 ASN CB . 30977 1 18 . 1 . 1 3 3 ASN N N 15 125.313 0.038 . 1 . . . . A 3 ASN N . 30977 1 19 . 1 . 1 3 3 ASN ND2 N 15 110.202 0.012 . 1 . . . . A 3 ASN ND2 . 30977 1 20 . 1 . 1 4 4 PRO HA H 1 4.857 0.011 . 1 . . . . A 4 PRO HA . 30977 1 21 . 1 . 1 4 4 PRO HB2 H 1 2.451 0.028 . 2 . . . . A 4 PRO HB2 . 30977 1 22 . 1 . 1 4 4 PRO HB3 H 1 1.768 0.012 . 2 . . . . A 4 PRO HB3 . 30977 1 23 . 1 . 1 4 4 PRO HG2 H 1 2.195 0.021 . 2 . . . . A 4 PRO HG2 . 30977 1 24 . 1 . 1 4 4 PRO HG3 H 1 2.271 0.000 . 2 . . . . A 4 PRO HG3 . 30977 1 25 . 1 . 1 4 4 PRO HD2 H 1 4.124 0.011 . 1 . . . . A 4 PRO HD2 . 30977 1 26 . 1 . 1 4 4 PRO CA C 13 62.878 0.000 . 1 . . . . A 4 PRO CA . 30977 1 27 . 1 . 1 4 4 PRO CB C 13 33.253 0.000 . 1 . . . . A 4 PRO CB . 30977 1 28 . 1 . 1 4 4 PRO CG C 13 26.686 0.000 . 1 . . . . A 4 PRO CG . 30977 1 29 . 1 . 1 4 4 PRO CD C 13 50.781 0.000 . 1 . . . . A 4 PRO CD . 30977 1 30 . 1 . 1 5 5 THR H H 1 8.816 0.006 . 1 . . . . A 5 THR H . 30977 1 31 . 1 . 1 5 5 THR HA H 1 5.781 0.010 . 1 . . . . A 5 THR HA . 30977 1 32 . 1 . 1 5 5 THR HB H 1 4.108 0.010 . 1 . . . . A 5 THR HB . 30977 1 33 . 1 . 1 5 5 THR HG21 H 1 1.266 0.008 . 1 . . . . A 5 THR HG1 . 30977 1 34 . 1 . 1 5 5 THR HG22 H 1 1.266 0.008 . 1 . . . . A 5 THR HG1 . 30977 1 35 . 1 . 1 5 5 THR HG23 H 1 1.266 0.008 . 1 . . . . A 5 THR HG1 . 30977 1 36 . 1 . 1 5 5 THR CA C 13 60.324 0.025 . 1 . . . . A 5 THR CA . 30977 1 37 . 1 . 1 5 5 THR CB C 13 70.942 0.030 . 1 . . . . A 5 THR CB . 30977 1 38 . 1 . 1 5 5 THR CG2 C 13 22.475 0.000 . 1 . . . . A 5 THR CG2 . 30977 1 39 . 1 . 1 5 5 THR N N 15 114.943 0.038 . 1 . . . . A 5 THR N . 30977 1 40 . 1 . 1 6 6 VAL H H 1 8.822 0.006 . 1 . . . . A 6 VAL H . 30977 1 41 . 1 . 1 6 6 VAL HA H 1 5.396 0.012 . 1 . . . . A 6 VAL HA . 30977 1 42 . 1 . 1 6 6 VAL HB H 1 2.406 0.013 . 1 . . . . A 6 VAL HB . 30977 1 43 . 1 . 1 6 6 VAL HG11 H 1 1.130 0.017 . 2 . . . . A 6 VAL HG11 . 30977 1 44 . 1 . 1 6 6 VAL HG12 H 1 1.130 0.017 . 2 . . . . A 6 VAL HG12 . 30977 1 45 . 1 . 1 6 6 VAL HG13 H 1 1.130 0.017 . 2 . . . . A 6 VAL HG13 . 30977 1 46 . 1 . 1 6 6 VAL HG21 H 1 1.097 0.009 . 2 . . . . A 6 VAL HG21 . 30977 1 47 . 1 . 1 6 6 VAL HG22 H 1 1.097 0.009 . 2 . . . . A 6 VAL HG22 . 30977 1 48 . 1 . 1 6 6 VAL HG23 H 1 1.097 0.009 . 2 . . . . A 6 VAL HG23 . 30977 1 49 . 1 . 1 6 6 VAL CA C 13 58.904 0.000 . 1 . . . . A 6 VAL CA . 30977 1 50 . 1 . 1 6 6 VAL CB C 13 36.176 0.000 . 1 . . . . A 6 VAL CB . 30977 1 51 . 1 . 1 6 6 VAL CG1 C 13 21.954 0.000 . 2 . . . . A 6 VAL CG1 . 30977 1 52 . 1 . 1 6 6 VAL CG2 C 13 20.686 0.000 . 2 . . . . A 6 VAL CG2 . 30977 1 53 . 1 . 1 6 6 VAL N N 15 119.858 0.025 . 1 . . . . A 6 VAL N . 30977 1 54 . 1 . 1 7 7 PHE H H 1 9.009 0.013 . 1 . . . . A 7 PHE H . 30977 1 55 . 1 . 1 7 7 PHE HA H 1 5.952 0.019 . 1 . . . . A 7 PHE HA . 30977 1 56 . 1 . 1 7 7 PHE HB2 H 1 2.891 0.017 . 2 . . . . A 7 PHE HB2 . 30977 1 57 . 1 . 1 7 7 PHE HB3 H 1 2.696 0.021 . 2 . . . . A 7 PHE HB3 . 30977 1 58 . 1 . 1 7 7 PHE HD1 H 1 6.796 0.012 . 1 . . . . A 7 PHE HD1 . 30977 1 59 . 1 . 1 7 7 PHE HD2 H 1 6.796 0.012 . 1 . . . . A 7 PHE HD2 . 30977 1 60 . 1 . 1 7 7 PHE HE1 H 1 7.056 0.014 . 1 . . . . A 7 PHE HE1 . 30977 1 61 . 1 . 1 7 7 PHE HE2 H 1 7.056 0.014 . 1 . . . . A 7 PHE HE2 . 30977 1 62 . 1 . 1 7 7 PHE HZ H 1 6.913 0.008 . 1 . . . . A 7 PHE HZ . 30977 1 63 . 1 . 1 7 7 PHE CA C 13 55.899 0.000 . 1 . . . . A 7 PHE CA . 30977 1 64 . 1 . 1 7 7 PHE CB C 13 43.238 0.000 . 1 . . . . A 7 PHE CB . 30977 1 65 . 1 . 1 7 7 PHE CD1 C 13 132.277 0.033 . 1 . . . . A 7 PHE CD1 . 30977 1 66 . 1 . 1 7 7 PHE CD2 C 13 132.277 0.033 . 1 . . . . A 7 PHE CD2 . 30977 1 67 . 1 . 1 7 7 PHE CE1 C 13 130.804 0.037 . 1 . . . . A 7 PHE CE1 . 30977 1 68 . 1 . 1 7 7 PHE CE2 C 13 130.804 0.037 . 1 . . . . A 7 PHE CE2 . 30977 1 69 . 1 . 1 7 7 PHE CZ C 13 130.576 0.000 . 1 . . . . A 7 PHE CZ . 30977 1 70 . 1 . 1 7 7 PHE N N 15 118.979 0.091 . 1 . . . . A 7 PHE N . 30977 1 71 . 1 . 1 8 8 PHE H H 1 9.589 0.010 . 1 . . . . A 8 PHE H . 30977 1 72 . 1 . 1 8 8 PHE HA H 1 5.361 0.015 . 1 . . . . A 8 PHE HA . 30977 1 73 . 1 . 1 8 8 PHE HB2 H 1 3.317 0.027 . 2 . . . . A 8 PHE HB2 . 30977 1 74 . 1 . 1 8 8 PHE HB3 H 1 3.515 0.011 . 2 . . . . A 8 PHE HB3 . 30977 1 75 . 1 . 1 8 8 PHE HD1 H 1 7.546 0.010 . 1 . . . . A 8 PHE HD1 . 30977 1 76 . 1 . 1 8 8 PHE HD2 H 1 7.546 0.010 . 1 . . . . A 8 PHE HD2 . 30977 1 77 . 1 . 1 8 8 PHE CA C 13 53.367 0.000 . 1 . . . . A 8 PHE CA . 30977 1 78 . 1 . 1 8 8 PHE CB C 13 43.073 0.000 . 1 . . . . A 8 PHE CB . 30977 1 79 . 1 . 1 8 8 PHE CD1 C 13 129.361 0.064 . 1 . . . . A 8 PHE CD1 . 30977 1 80 . 1 . 1 8 8 PHE CD2 C 13 129.361 0.064 . 1 . . . . A 8 PHE CD2 . 30977 1 81 . 1 . 1 8 8 PHE N N 15 116.860 0.013 . 1 . . . . A 8 PHE N . 30977 1 82 . 1 . 1 9 9 ASP H H 1 9.313 0.013 . 1 . . . . A 9 ASP H . 30977 1 83 . 1 . 1 9 9 ASP HA H 1 5.592 0.017 . 1 . . . . A 9 ASP HA . 30977 1 84 . 1 . 1 9 9 ASP HB2 H 1 2.558 0.014 . 2 . . . . A 9 ASP HB2 . 30977 1 85 . 1 . 1 9 9 ASP HB3 H 1 2.924 0.009 . 2 . . . . A 9 ASP HB3 . 30977 1 86 . 1 . 1 9 9 ASP CA C 13 54.787 0.000 . 1 . . . . A 9 ASP CA . 30977 1 87 . 1 . 1 9 9 ASP CB C 13 41.356 0.000 . 1 . . . . A 9 ASP CB . 30977 1 88 . 1 . 1 9 9 ASP N N 15 124.141 0.014 . 1 . . . . A 9 ASP N . 30977 1 89 . 1 . 1 10 10 ILE H H 1 9.090 0.006 . 1 . . . . A 10 ILE H . 30977 1 90 . 1 . 1 10 10 ILE HA H 1 5.232 0.028 . 1 . . . . A 10 ILE HA . 30977 1 91 . 1 . 1 10 10 ILE HB H 1 2.116 0.018 . 1 . . . . A 10 ILE HB . 30977 1 92 . 1 . 1 10 10 ILE HG12 H 1 1.907 0.023 . 2 . . . . A 10 ILE HG12 . 30977 1 93 . 1 . 1 10 10 ILE HG13 H 1 1.719 0.013 . 2 . . . . A 10 ILE HG13 . 30977 1 94 . 1 . 1 10 10 ILE HG21 H 1 1.029 0.014 . 1 . . . . A 10 ILE HG21 . 30977 1 95 . 1 . 1 10 10 ILE HG22 H 1 1.029 0.014 . 1 . . . . A 10 ILE HG22 . 30977 1 96 . 1 . 1 10 10 ILE HG23 H 1 1.029 0.014 . 1 . . . . A 10 ILE HG23 . 30977 1 97 . 1 . 1 10 10 ILE HD11 H 1 1.061 0.013 . 1 . . . . A 10 ILE HD11 . 30977 1 98 . 1 . 1 10 10 ILE HD12 H 1 1.061 0.013 . 1 . . . . A 10 ILE HD12 . 30977 1 99 . 1 . 1 10 10 ILE HD13 H 1 1.061 0.013 . 1 . . . . A 10 ILE HD13 . 30977 1 100 . 1 . 1 10 10 ILE CA C 13 58.260 0.000 . 1 . . . . A 10 ILE CA . 30977 1 101 . 1 . 1 10 10 ILE CB C 13 37.709 0.000 . 1 . . . . A 10 ILE CB . 30977 1 102 . 1 . 1 10 10 ILE CG1 C 13 27.194 0.000 . 1 . . . . A 10 ILE CG1 . 30977 1 103 . 1 . 1 10 10 ILE CG2 C 13 18.680 0.000 . 1 . . . . A 10 ILE CG2 . 30977 1 104 . 1 . 1 10 10 ILE CD1 C 13 11.601 0.000 . 1 . . . . A 10 ILE CD1 . 30977 1 105 . 1 . 1 10 10 ILE N N 15 124.262 0.007 . 1 . . . . A 10 ILE N . 30977 1 106 . 1 . 1 11 11 ALA H H 1 9.644 0.008 . 1 . . . . A 11 ALA H . 30977 1 107 . 1 . 1 11 11 ALA HA H 1 5.203 0.011 . 1 . . . . A 11 ALA HA . 30977 1 108 . 1 . 1 11 11 ALA HB1 H 1 1.086 0.014 . 1 . . . . A 11 ALA HB1 . 30977 1 109 . 1 . 1 11 11 ALA HB2 H 1 1.086 0.014 . 1 . . . . A 11 ALA HB2 . 30977 1 110 . 1 . 1 11 11 ALA HB3 H 1 1.086 0.014 . 1 . . . . A 11 ALA HB3 . 30977 1 111 . 1 . 1 11 11 ALA CA C 13 50.900 0.000 . 1 . . . . A 11 ALA CA . 30977 1 112 . 1 . 1 11 11 ALA CB C 13 22.914 0.000 . 1 . . . . A 11 ALA CB . 30977 1 113 . 1 . 1 11 11 ALA N N 15 132.327 0.019 . 1 . . . . A 11 ALA N . 30977 1 114 . 1 . 1 12 12 VAL H H 1 8.970 0.005 . 1 . . . . A 12 VAL H . 30977 1 115 . 1 . 1 12 12 VAL HA H 1 4.545 0.013 . 1 . . . . A 12 VAL HA . 30977 1 116 . 1 . 1 12 12 VAL HG11 H 1 0.697 0.012 . 2 . . . . A 12 VAL HG11 . 30977 1 117 . 1 . 1 12 12 VAL HG12 H 1 0.697 0.012 . 2 . . . . A 12 VAL HG12 . 30977 1 118 . 1 . 1 12 12 VAL HG13 H 1 0.697 0.012 . 2 . . . . A 12 VAL HG13 . 30977 1 119 . 1 . 1 12 12 VAL HG21 H 1 0.351 0.008 . 2 . . . . A 12 VAL HG21 . 30977 1 120 . 1 . 1 12 12 VAL HG22 H 1 0.351 0.008 . 2 . . . . A 12 VAL HG22 . 30977 1 121 . 1 . 1 12 12 VAL HG23 H 1 0.351 0.008 . 2 . . . . A 12 VAL HG23 . 30977 1 122 . 1 . 1 12 12 VAL CA C 13 60.537 0.000 . 1 . . . . A 12 VAL CA . 30977 1 123 . 1 . 1 12 12 VAL CB C 13 33.206 0.000 . 1 . . . . A 12 VAL CB . 30977 1 124 . 1 . 1 12 12 VAL CG1 C 13 21.665 0.000 . 1 . . . . A 12 VAL CG1 . 30977 1 125 . 1 . 1 12 12 VAL N N 15 118.352 0.017 . 1 . . . . A 12 VAL N . 30977 1 126 . 1 . 1 13 13 ASP H H 1 9.871 0.004 . 1 . . . . A 13 ASP H . 30977 1 127 . 1 . 1 13 13 ASP HA H 1 4.365 0.019 . 1 . . . . A 13 ASP HA . 30977 1 128 . 1 . 1 13 13 ASP HB2 H 1 3.154 0.017 . 2 . . . . A 13 ASP HB2 . 30977 1 129 . 1 . 1 13 13 ASP HB3 H 1 2.558 0.009 . 2 . . . . A 13 ASP HB3 . 30977 1 130 . 1 . 1 13 13 ASP CA C 13 55.771 0.000 . 1 . . . . A 13 ASP CA . 30977 1 131 . 1 . 1 13 13 ASP CB C 13 40.108 0.000 . 1 . . . . A 13 ASP CB . 30977 1 132 . 1 . 1 13 13 ASP N N 15 130.914 0.011 . 1 . . . . A 13 ASP N . 30977 1 133 . 1 . 1 14 14 GLY H H 1 8.588 0.007 . 1 . . . . A 14 GLY H . 30977 1 134 . 1 . 1 14 14 GLY HA2 H 1 4.265 0.014 . 2 . . . . A 14 GLY HA2 . 30977 1 135 . 1 . 1 14 14 GLY HA3 H 1 3.472 0.013 . 2 . . . . A 14 GLY HA3 . 30977 1 136 . 1 . 1 14 14 GLY CA C 13 45.491 0.000 . 1 . . . . A 14 GLY CA . 30977 1 137 . 1 . 1 14 14 GLY N N 15 101.643 0.031 . 1 . . . . A 14 GLY N . 30977 1 138 . 1 . 1 15 15 GLU H H 1 8.082 0.003 . 1 . . . . A 15 GLU H . 30977 1 139 . 1 . 1 15 15 GLU HA H 1 4.879 0.008 . 1 . . . . A 15 GLU HA . 30977 1 140 . 1 . 1 15 15 GLU HB2 H 1 2.036 0.009 . 2 . . . . A 15 GLU HB2 . 30977 1 141 . 1 . 1 15 15 GLU HB3 H 1 2.148 0.004 . 2 . . . . A 15 GLU HB3 . 30977 1 142 . 1 . 1 15 15 GLU HG2 H 1 2.243 0.000 . 2 . . . . A 15 GLU HG2 . 30977 1 143 . 1 . 1 15 15 GLU HG3 H 1 2.330 0.019 . 2 . . . . A 15 GLU HG3 . 30977 1 144 . 1 . 1 15 15 GLU CA C 13 53.021 0.011 . 1 . . . . A 15 GLU CA . 30977 1 145 . 1 . 1 15 15 GLU CB C 13 30.417 0.000 . 1 . . . . A 15 GLU CB . 30977 1 146 . 1 . 1 15 15 GLU CG C 13 35.844 0.000 . 1 . . . . A 15 GLU CG . 30977 1 147 . 1 . 1 15 15 GLU N N 15 123.263 0.024 . 1 . . . . A 15 GLU N . 30977 1 148 . 1 . 1 16 16 PRO HA H 1 4.240 0.018 . 1 . . . . A 16 PRO HA . 30977 1 149 . 1 . 1 16 16 PRO HB2 H 1 2.374 0.014 . 2 . . . . A 16 PRO HB2 . 30977 1 150 . 1 . 1 16 16 PRO HB3 H 1 1.950 0.004 . 2 . . . . A 16 PRO HB3 . 30977 1 151 . 1 . 1 16 16 PRO HG2 H 1 2.067 0.000 . 2 . . . . A 16 PRO HG2 . 30977 1 152 . 1 . 1 16 16 PRO HG3 H 1 2.244 0.000 . 2 . . . . A 16 PRO HG3 . 30977 1 153 . 1 . 1 16 16 PRO HD2 H 1 3.770 0.021 . 1 . . . . A 16 PRO HD2 . 30977 1 154 . 1 . 1 16 16 PRO CA C 13 64.839 0.000 . 1 . . . . A 16 PRO CA . 30977 1 155 . 1 . 1 16 16 PRO CB C 13 32.512 0.000 . 1 . . . . A 16 PRO CB . 30977 1 156 . 1 . 1 16 16 PRO CG C 13 27.831 0.000 . 1 . . . . A 16 PRO CG . 30977 1 157 . 1 . 1 16 16 PRO CD C 13 51.160 0.000 . 1 . . . . A 16 PRO CD . 30977 1 158 . 1 . 1 17 17 LEU H H 1 9.219 0.002 . 1 . . . . A 17 LEU H . 30977 1 159 . 1 . 1 17 17 LEU HA H 1 4.745 0.011 . 1 . . . . A 17 LEU HA . 30977 1 160 . 1 . 1 17 17 LEU HB2 H 1 1.495 0.033 . 2 . . . . A 17 LEU HB2 . 30977 1 161 . 1 . 1 17 17 LEU HB3 H 1 1.652 0.021 . 2 . . . . A 17 LEU HB3 . 30977 1 162 . 1 . 1 17 17 LEU HD11 H 1 1.063 0.005 . 2 . . . . A 17 LEU HD11 . 30977 1 163 . 1 . 1 17 17 LEU HD12 H 1 1.063 0.005 . 2 . . . . A 17 LEU HD12 . 30977 1 164 . 1 . 1 17 17 LEU HD13 H 1 1.063 0.005 . 2 . . . . A 17 LEU HD13 . 30977 1 165 . 1 . 1 17 17 LEU HD21 H 1 0.880 0.009 . 2 . . . . A 17 LEU HD21 . 30977 1 166 . 1 . 1 17 17 LEU HD22 H 1 0.880 0.009 . 2 . . . . A 17 LEU HD22 . 30977 1 167 . 1 . 1 17 17 LEU HD23 H 1 0.880 0.009 . 2 . . . . A 17 LEU HD23 . 30977 1 168 . 1 . 1 17 17 LEU CA C 13 55.615 0.000 . 1 . . . . A 17 LEU CA . 30977 1 169 . 1 . 1 17 17 LEU CB C 13 44.481 0.000 . 1 . . . . A 17 LEU CB . 30977 1 170 . 1 . 1 17 17 LEU CD1 C 13 25.923 0.000 . 2 . . . . A 17 LEU CD1 . 30977 1 171 . 1 . 1 17 17 LEU CD2 C 13 22.779 0.000 . 2 . . . . A 17 LEU CD2 . 30977 1 172 . 1 . 1 17 17 LEU N N 15 125.889 0.022 . 1 . . . . A 17 LEU N . 30977 1 173 . 1 . 1 18 18 GLY H H 1 7.276 0.004 . 1 . . . . A 18 GLY H . 30977 1 174 . 1 . 1 18 18 GLY HA2 H 1 4.311 0.018 . 2 . . . . A 18 GLY HA2 . 30977 1 175 . 1 . 1 18 18 GLY HA3 H 1 4.005 0.013 . 2 . . . . A 18 GLY HA3 . 30977 1 176 . 1 . 1 18 18 GLY CA C 13 45.359 0.000 . 1 . . . . A 18 GLY CA . 30977 1 177 . 1 . 1 18 18 GLY N N 15 102.454 0.024 . 1 . . . . A 18 GLY N . 30977 1 178 . 1 . 1 19 19 ARG H H 1 8.397 0.003 . 1 . . . . A 19 ARG H . 30977 1 179 . 1 . 1 19 19 ARG HA H 1 5.667 0.018 . 1 . . . . A 19 ARG HA . 30977 1 180 . 1 . 1 19 19 ARG HB2 H 1 2.041 0.021 . 2 . . . . A 19 ARG HB2 . 30977 1 181 . 1 . 1 19 19 ARG HB3 H 1 1.669 0.014 . 2 . . . . A 19 ARG HB3 . 30977 1 182 . 1 . 1 19 19 ARG HG2 H 1 1.493 0.015 . 2 . . . . A 19 ARG HG2 . 30977 1 183 . 1 . 1 19 19 ARG HG3 H 1 1.679 0.015 . 2 . . . . A 19 ARG HG3 . 30977 1 184 . 1 . 1 19 19 ARG HE H 1 9.062 0.010 . 1 . . . . A 19 ARG HE . 30977 1 185 . 1 . 1 19 19 ARG CA C 13 55.229 0.000 . 1 . . . . A 19 ARG CA . 30977 1 186 . 1 . 1 19 19 ARG CB C 13 33.588 0.000 . 1 . . . . A 19 ARG CB . 30977 1 187 . 1 . 1 19 19 ARG CG C 13 27.473 0.000 . 1 . . . . A 19 ARG CG . 30977 1 188 . 1 . 1 19 19 ARG N N 15 121.166 0.029 . 1 . . . . A 19 ARG N . 30977 1 189 . 1 . 1 19 19 ARG NE N 15 85.908 0.003 . 1 . . . . A 19 ARG NE . 30977 1 190 . 1 . 1 20 20 VAL H H 1 9.405 0.009 . 1 . . . . A 20 VAL H . 30977 1 191 . 1 . 1 20 20 VAL HA H 1 4.647 0.011 . 1 . . . . A 20 VAL HA . 30977 1 192 . 1 . 1 20 20 VAL HB H 1 1.827 0.029 . 1 . . . . A 20 VAL HB . 30977 1 193 . 1 . 1 20 20 VAL HG11 H 1 0.566 0.015 . 2 . . . . A 20 VAL HG11 . 30977 1 194 . 1 . 1 20 20 VAL HG12 H 1 0.566 0.015 . 2 . . . . A 20 VAL HG12 . 30977 1 195 . 1 . 1 20 20 VAL HG13 H 1 0.566 0.015 . 2 . . . . A 20 VAL HG13 . 30977 1 196 . 1 . 1 20 20 VAL HG21 H 1 0.895 0.022 . 2 . . . . A 20 VAL HG21 . 30977 1 197 . 1 . 1 20 20 VAL HG22 H 1 0.895 0.022 . 2 . . . . A 20 VAL HG22 . 30977 1 198 . 1 . 1 20 20 VAL HG23 H 1 0.895 0.022 . 2 . . . . A 20 VAL HG23 . 30977 1 199 . 1 . 1 20 20 VAL CA C 13 60.041 0.000 . 1 . . . . A 20 VAL CA . 30977 1 200 . 1 . 1 20 20 VAL CB C 13 35.009 0.000 . 1 . . . . A 20 VAL CB . 30977 1 201 . 1 . 1 20 20 VAL CG1 C 13 22.275 0.161 . 1 . . . . A 20 VAL CG1 . 30977 1 202 . 1 . 1 20 20 VAL N N 15 126.746 0.014 . 1 . . . . A 20 VAL N . 30977 1 203 . 1 . 1 21 21 SER H H 1 8.820 0.002 . 1 . . . . A 21 SER H . 30977 1 204 . 1 . 1 21 21 SER HA H 1 5.566 0.019 . 1 . . . . A 21 SER HA . 30977 1 205 . 1 . 1 21 21 SER HB2 H 1 3.801 0.011 . 2 . . . . A 21 SER HB2 . 30977 1 206 . 1 . 1 21 21 SER HB3 H 1 3.609 0.021 . 2 . . . . A 21 SER HB3 . 30977 1 207 . 1 . 1 21 21 SER CA C 13 55.087 0.000 . 1 . . . . A 21 SER CA . 30977 1 208 . 1 . 1 21 21 SER CB C 13 67.086 0.000 . 1 . . . . A 21 SER CB . 30977 1 209 . 1 . 1 21 21 SER N N 15 120.226 0.028 . 1 . . . . A 21 SER N . 30977 1 210 . 1 . 1 22 22 PHE H H 1 9.549 0.001 . 1 . . . . A 22 PHE H . 30977 1 211 . 1 . 1 22 22 PHE HA H 1 5.302 0.009 . 1 . . . . A 22 PHE HA . 30977 1 212 . 1 . 1 22 22 PHE HB2 H 1 2.481 0.018 . 2 . . . . A 22 PHE HB2 . 30977 1 213 . 1 . 1 22 22 PHE HB3 H 1 2.373 0.013 . 2 . . . . A 22 PHE HB3 . 30977 1 214 . 1 . 1 22 22 PHE HD1 H 1 6.582 0.009 . 1 . . . . A 22 PHE HD1 . 30977 1 215 . 1 . 1 22 22 PHE HD2 H 1 6.582 0.009 . 1 . . . . A 22 PHE HD2 . 30977 1 216 . 1 . 1 22 22 PHE HE1 H 1 6.219 0.013 . 1 . . . . A 22 PHE HE1 . 30977 1 217 . 1 . 1 22 22 PHE HE2 H 1 6.219 0.013 . 1 . . . . A 22 PHE HE2 . 30977 1 218 . 1 . 1 22 22 PHE HZ H 1 6.697 0.014 . 1 . . . . A 22 PHE HZ . 30977 1 219 . 1 . 1 22 22 PHE CA C 13 55.836 0.000 . 1 . . . . A 22 PHE CA . 30977 1 220 . 1 . 1 22 22 PHE CB C 13 42.634 0.000 . 1 . . . . A 22 PHE CB . 30977 1 221 . 1 . 1 22 22 PHE CD1 C 13 132.110 0.016 . 1 . . . . A 22 PHE CD1 . 30977 1 222 . 1 . 1 22 22 PHE CD2 C 13 132.110 0.016 . 1 . . . . A 22 PHE CD2 . 30977 1 223 . 1 . 1 22 22 PHE CE1 C 13 130.591 0.006 . 1 . . . . A 22 PHE CE1 . 30977 1 224 . 1 . 1 22 22 PHE CE2 C 13 130.591 0.006 . 1 . . . . A 22 PHE CE2 . 30977 1 225 . 1 . 1 22 22 PHE CZ C 13 128.377 0.043 . 1 . . . . A 22 PHE CZ . 30977 1 226 . 1 . 1 22 22 PHE N N 15 118.840 0.013 . 1 . . . . A 22 PHE N . 30977 1 227 . 1 . 1 23 23 GLU H H 1 8.787 0.009 . 1 . . . . A 23 GLU H . 30977 1 228 . 1 . 1 23 23 GLU HA H 1 4.806 0.013 . 1 . . . . A 23 GLU HA . 30977 1 229 . 1 . 1 23 23 GLU HB2 H 1 1.758 0.019 . 2 . . . . A 23 GLU HB2 . 30977 1 230 . 1 . 1 23 23 GLU HB3 H 1 1.880 0.022 . 2 . . . . A 23 GLU HB3 . 30977 1 231 . 1 . 1 23 23 GLU HG2 H 1 2.296 0.021 . 1 . . . . A 23 GLU HG2 . 30977 1 232 . 1 . 1 23 23 GLU CA C 13 55.116 0.000 . 1 . . . . A 23 GLU CA . 30977 1 233 . 1 . 1 23 23 GLU CB C 13 31.936 0.000 . 1 . . . . A 23 GLU CB . 30977 1 234 . 1 . 1 23 23 GLU CG C 13 36.652 0.000 . 1 . . . . A 23 GLU CG . 30977 1 235 . 1 . 1 23 23 GLU N N 15 123.251 0.021 . 1 . . . . A 23 GLU N . 30977 1 236 . 1 . 1 24 24 LEU H H 1 8.214 0.003 . 1 . . . . A 24 LEU H . 30977 1 237 . 1 . 1 24 24 LEU HA H 1 4.766 0.007 . 1 . . . . A 24 LEU HA . 30977 1 238 . 1 . 1 24 24 LEU HB2 H 1 1.927 0.023 . 2 . . . . A 24 LEU HB2 . 30977 1 239 . 1 . 1 24 24 LEU HB3 H 1 1.293 0.009 . 2 . . . . A 24 LEU HB3 . 30977 1 240 . 1 . 1 24 24 LEU HD11 H 1 0.514 0.007 . 2 . . . . A 24 LEU HD11 . 30977 1 241 . 1 . 1 24 24 LEU HD12 H 1 0.514 0.007 . 2 . . . . A 24 LEU HD12 . 30977 1 242 . 1 . 1 24 24 LEU HD13 H 1 0.514 0.007 . 2 . . . . A 24 LEU HD13 . 30977 1 243 . 1 . 1 24 24 LEU HD21 H 1 0.537 0.014 . 2 . . . . A 24 LEU HD21 . 30977 1 244 . 1 . 1 24 24 LEU HD22 H 1 0.537 0.014 . 2 . . . . A 24 LEU HD22 . 30977 1 245 . 1 . 1 24 24 LEU HD23 H 1 0.537 0.014 . 2 . . . . A 24 LEU HD23 . 30977 1 246 . 1 . 1 24 24 LEU CA C 13 51.654 0.000 . 1 . . . . A 24 LEU CA . 30977 1 247 . 1 . 1 24 24 LEU CB C 13 43.261 0.000 . 1 . . . . A 24 LEU CB . 30977 1 248 . 1 . 1 24 24 LEU CG C 13 26.756 0.000 . 1 . . . . A 24 LEU CG . 30977 1 249 . 1 . 1 24 24 LEU CD1 C 13 23.189 0.021 . 1 . . . . A 24 LEU CD1 . 30977 1 250 . 1 . 1 24 24 LEU N N 15 122.418 0.008 . 1 . . . . A 24 LEU N . 30977 1 251 . 1 . 1 25 25 PHE H H 1 8.897 0.004 . 1 . . . . A 25 PHE H . 30977 1 252 . 1 . 1 25 25 PHE HA H 1 5.187 0.019 . 1 . . . . A 25 PHE HA . 30977 1 253 . 1 . 1 25 25 PHE HB2 H 1 3.303 0.018 . 2 . . . . A 25 PHE HB2 . 30977 1 254 . 1 . 1 25 25 PHE HB3 H 1 2.750 0.018 . 2 . . . . A 25 PHE HB3 . 30977 1 255 . 1 . 1 25 25 PHE HD1 H 1 6.908 0.012 . 1 . . . . A 25 PHE HD1 . 30977 1 256 . 1 . 1 25 25 PHE HD2 H 1 6.908 0.012 . 1 . . . . A 25 PHE HD2 . 30977 1 257 . 1 . 1 25 25 PHE CA C 13 54.439 0.000 . 1 . . . . A 25 PHE CA . 30977 1 258 . 1 . 1 25 25 PHE CB C 13 36.165 0.000 . 1 . . . . A 25 PHE CB . 30977 1 259 . 1 . 1 25 25 PHE CD1 C 13 131.350 0.092 . 1 . . . . A 25 PHE CD1 . 30977 1 260 . 1 . 1 25 25 PHE CD2 C 13 131.350 0.092 . 1 . . . . A 25 PHE CD2 . 30977 1 261 . 1 . 1 25 25 PHE N N 15 124.649 0.018 . 1 . . . . A 25 PHE N . 30977 1 262 . 1 . 1 26 26 ALA H H 1 8.486 0.006 . 1 . . . . A 26 ALA H . 30977 1 263 . 1 . 1 26 26 ALA HA H 1 3.818 0.020 . 1 . . . . A 26 ALA HA . 30977 1 264 . 1 . 1 26 26 ALA HB1 H 1 1.542 0.022 . 1 . . . . A 26 ALA HB1 . 30977 1 265 . 1 . 1 26 26 ALA HB2 H 1 1.542 0.022 . 1 . . . . A 26 ALA HB2 . 30977 1 266 . 1 . 1 26 26 ALA HB3 H 1 1.542 0.022 . 1 . . . . A 26 ALA HB3 . 30977 1 267 . 1 . 1 26 26 ALA CA C 13 54.174 0.000 . 1 . . . . A 26 ALA CA . 30977 1 268 . 1 . 1 26 26 ALA CB C 13 18.897 0.000 . 1 . . . . A 26 ALA CB . 30977 1 269 . 1 . 1 26 26 ALA N N 15 128.959 0.013 . 1 . . . . A 26 ALA N . 30977 1 270 . 1 . 1 27 27 ASP H H 1 9.071 0.003 . 1 . . . . A 27 ASP H . 30977 1 271 . 1 . 1 27 27 ASP HA H 1 4.284 0.017 . 1 . . . . A 27 ASP HA . 30977 1 272 . 1 . 1 27 27 ASP HB2 H 1 2.777 0.009 . 2 . . . . A 27 ASP HB2 . 30977 1 273 . 1 . 1 27 27 ASP HB3 H 1 2.912 0.012 . 2 . . . . A 27 ASP HB3 . 30977 1 274 . 1 . 1 27 27 ASP CA C 13 55.661 0.000 . 1 . . . . A 27 ASP CA . 30977 1 275 . 1 . 1 27 27 ASP CB C 13 39.067 0.000 . 1 . . . . A 27 ASP CB . 30977 1 276 . 1 . 1 27 27 ASP N N 15 114.066 0.027 . 1 . . . . A 27 ASP N . 30977 1 277 . 1 . 1 28 28 LYS H H 1 7.553 0.002 . 1 . . . . A 28 LYS H . 30977 1 278 . 1 . 1 28 28 LYS HA H 1 4.605 0.019 . 1 . . . . A 28 LYS HA . 30977 1 279 . 1 . 1 28 28 LYS HB2 H 1 1.810 0.014 . 1 . . . . A 28 LYS HB2 . 30977 1 280 . 1 . 1 28 28 LYS HD2 H 1 1.433 0.009 . 1 . . . . A 28 LYS HD2 . 30977 1 281 . 1 . 1 28 28 LYS HE2 H 1 2.878 0.000 . 1 . . . . A 28 LYS HE2 . 30977 1 282 . 1 . 1 28 28 LYS CA C 13 56.233 0.000 . 1 . . . . A 28 LYS CA . 30977 1 283 . 1 . 1 28 28 LYS CB C 13 35.982 0.000 . 1 . . . . A 28 LYS CB . 30977 1 284 . 1 . 1 28 28 LYS CG C 13 24.815 0.000 . 1 . . . . A 28 LYS CG . 30977 1 285 . 1 . 1 28 28 LYS CD C 13 28.753 0.000 . 1 . . . . A 28 LYS CD . 30977 1 286 . 1 . 1 28 28 LYS CE C 13 42.069 0.000 . 1 . . . . A 28 LYS CE . 30977 1 287 . 1 . 1 28 28 LYS N N 15 117.963 0.014 . 1 . . . . A 28 LYS N . 30977 1 288 . 1 . 1 29 29 VAL H H 1 8.390 0.002 . 1 . . . . A 29 VAL H . 30977 1 289 . 1 . 1 29 29 VAL HA H 1 4.517 0.016 . 1 . . . . A 29 VAL HA . 30977 1 290 . 1 . 1 29 29 VAL HB H 1 2.633 0.024 . 1 . . . . A 29 VAL HB . 30977 1 291 . 1 . 1 29 29 VAL HG11 H 1 1.369 0.019 . 2 . . . . A 29 VAL HG11 . 30977 1 292 . 1 . 1 29 29 VAL HG12 H 1 1.369 0.019 . 2 . . . . A 29 VAL HG12 . 30977 1 293 . 1 . 1 29 29 VAL HG13 H 1 1.369 0.019 . 2 . . . . A 29 VAL HG13 . 30977 1 294 . 1 . 1 29 29 VAL HG21 H 1 1.026 0.014 . 2 . . . . A 29 VAL HG21 . 30977 1 295 . 1 . 1 29 29 VAL HG22 H 1 1.026 0.014 . 2 . . . . A 29 VAL HG22 . 30977 1 296 . 1 . 1 29 29 VAL HG23 H 1 1.026 0.014 . 2 . . . . A 29 VAL HG23 . 30977 1 297 . 1 . 1 29 29 VAL CA C 13 58.332 0.046 . 1 . . . . A 29 VAL CA . 30977 1 298 . 1 . 1 29 29 VAL CB C 13 32.115 0.000 . 1 . . . . A 29 VAL CB . 30977 1 299 . 1 . 1 29 29 VAL CG1 C 13 20.973 0.000 . 2 . . . . A 29 VAL CG1 . 30977 1 300 . 1 . 1 29 29 VAL CG2 C 13 25.643 0.000 . 2 . . . . A 29 VAL CG2 . 30977 1 301 . 1 . 1 29 29 VAL N N 15 114.267 0.030 . 1 . . . . A 29 VAL N . 30977 1 302 . 1 . 1 30 30 PRO HA H 1 4.442 0.015 . 1 . . . . A 30 PRO HA . 30977 1 303 . 1 . 1 30 30 PRO HB2 H 1 2.708 0.000 . 2 . . . . A 30 PRO HB2 . 30977 1 304 . 1 . 1 30 30 PRO HB3 H 1 2.045 0.007 . 2 . . . . A 30 PRO HB3 . 30977 1 305 . 1 . 1 30 30 PRO HD2 H 1 3.576 0.013 . 2 . . . . A 30 PRO HD2 . 30977 1 306 . 1 . 1 30 30 PRO HD3 H 1 3.149 0.011 . 2 . . . . A 30 PRO HD3 . 30977 1 307 . 1 . 1 30 30 PRO CA C 13 66.252 0.000 . 1 . . . . A 30 PRO CA . 30977 1 308 . 1 . 1 30 30 PRO CB C 13 31.401 0.000 . 1 . . . . A 30 PRO CB . 30977 1 309 . 1 . 1 30 30 PRO CD C 13 50.575 0.005 . 1 . . . . A 30 PRO CD . 30977 1 310 . 1 . 1 31 31 LYS H H 1 10.678 0.015 . 1 . . . . A 31 LYS H . 30977 1 311 . 1 . 1 31 31 LYS HA H 1 4.060 0.009 . 1 . . . . A 31 LYS HA . 30977 1 312 . 1 . 1 31 31 LYS HB2 H 1 1.750 0.014 . 2 . . . . A 31 LYS HB2 . 30977 1 313 . 1 . 1 31 31 LYS HB3 H 1 1.572 0.014 . 2 . . . . A 31 LYS HB3 . 30977 1 314 . 1 . 1 31 31 LYS CA C 13 60.571 0.000 . 1 . . . . A 31 LYS CA . 30977 1 315 . 1 . 1 31 31 LYS CB C 13 32.554 0.000 . 1 . . . . A 31 LYS CB . 30977 1 316 . 1 . 1 31 31 LYS CG C 13 26.855 0.000 . 1 . . . . A 31 LYS CG . 30977 1 317 . 1 . 1 31 31 LYS CE C 13 41.363 0.000 . 1 . . . . A 31 LYS CE . 30977 1 318 . 1 . 1 31 31 LYS N N 15 123.630 0.016 . 1 . . . . A 31 LYS N . 30977 1 319 . 1 . 1 32 32 THR H H 1 10.303 0.003 . 1 . . . . A 32 THR H . 30977 1 320 . 1 . 1 32 32 THR HA H 1 4.059 0.011 . 1 . . . . A 32 THR HA . 30977 1 321 . 1 . 1 32 32 THR HB H 1 4.233 0.016 . 1 . . . . A 32 THR HB . 30977 1 322 . 1 . 1 32 32 THR HG21 H 1 1.003 0.016 . 1 . . . . A 32 THR HG21 . 30977 1 323 . 1 . 1 32 32 THR HG22 H 1 1.003 0.016 . 1 . . . . A 32 THR HG22 . 30977 1 324 . 1 . 1 32 32 THR HG23 H 1 1.003 0.016 . 1 . . . . A 32 THR HG23 . 30977 1 325 . 1 . 1 32 32 THR CA C 13 67.426 0.000 . 1 . . . . A 32 THR CA . 30977 1 326 . 1 . 1 32 32 THR CB C 13 68.310 0.000 . 1 . . . . A 32 THR CB . 30977 1 327 . 1 . 1 32 32 THR CG2 C 13 22.341 0.000 . 1 . . . . A 32 THR CG2 . 30977 1 328 . 1 . 1 32 32 THR N N 15 123.898 0.015 . 1 . . . . A 32 THR N . 30977 1 329 . 1 . 1 33 33 ALA H H 1 9.337 0.003 . 1 . . . . A 33 ALA H . 30977 1 330 . 1 . 1 33 33 ALA HA H 1 4.075 0.017 . 1 . . . . A 33 ALA HA . 30977 1 331 . 1 . 1 33 33 ALA HB1 H 1 1.482 0.016 . 1 . . . . A 33 ALA HB1 . 30977 1 332 . 1 . 1 33 33 ALA HB2 H 1 1.482 0.016 . 1 . . . . A 33 ALA HB2 . 30977 1 333 . 1 . 1 33 33 ALA HB3 H 1 1.482 0.016 . 1 . . . . A 33 ALA HB3 . 30977 1 334 . 1 . 1 33 33 ALA CA C 13 55.954 0.000 . 1 . . . . A 33 ALA CA . 30977 1 335 . 1 . 1 33 33 ALA CB C 13 18.398 0.000 . 1 . . . . A 33 ALA CB . 30977 1 336 . 1 . 1 33 33 ALA N N 15 125.627 0.014 . 1 . . . . A 33 ALA N . 30977 1 337 . 1 . 1 34 34 GLU H H 1 8.058 0.009 . 1 . . . . A 34 GLU H . 30977 1 338 . 1 . 1 34 34 GLU HA H 1 4.548 0.011 . 1 . . . . A 34 GLU HA . 30977 1 339 . 1 . 1 34 34 GLU HB2 H 1 2.314 0.013 . 2 . . . . A 34 GLU HB2 . 30977 1 340 . 1 . 1 34 34 GLU HB3 H 1 1.808 0.014 . 2 . . . . A 34 GLU HB3 . 30977 1 341 . 1 . 1 34 34 GLU HG2 H 1 2.524 0.014 . 2 . . . . A 34 GLU HG2 . 30977 1 342 . 1 . 1 34 34 GLU HG3 H 1 2.060 0.013 . 2 . . . . A 34 GLU HG3 . 30977 1 343 . 1 . 1 34 34 GLU CA C 13 57.908 0.000 . 1 . . . . A 34 GLU CA . 30977 1 344 . 1 . 1 34 34 GLU CB C 13 28.126 0.000 . 1 . . . . A 34 GLU CB . 30977 1 345 . 1 . 1 34 34 GLU CG C 13 33.794 0.000 . 1 . . . . A 34 GLU CG . 30977 1 346 . 1 . 1 34 34 GLU N N 15 117.210 0.017 . 1 . . . . A 34 GLU N . 30977 1 347 . 1 . 1 35 35 ASN H H 1 7.164 0.006 . 1 . . . . A 35 ASN H . 30977 1 348 . 1 . 1 35 35 ASN HA H 1 4.106 0.018 . 1 . . . . A 35 ASN HA . 30977 1 349 . 1 . 1 35 35 ASN HB2 H 1 2.967 0.011 . 2 . . . . A 35 ASN HB2 . 30977 1 350 . 1 . 1 35 35 ASN HB3 H 1 2.433 0.015 . 2 . . . . A 35 ASN HB3 . 30977 1 351 . 1 . 1 35 35 ASN HD21 H 1 6.836 0.001 . 1 . . . . A 35 ASN HD21 . 30977 1 352 . 1 . 1 35 35 ASN HD22 H 1 9.031 0.001 . 1 . . . . A 35 ASN HD22 . 30977 1 353 . 1 . 1 35 35 ASN CA C 13 56.711 0.000 . 1 . . . . A 35 ASN CA . 30977 1 354 . 1 . 1 35 35 ASN CB C 13 39.631 0.000 . 1 . . . . A 35 ASN CB . 30977 1 355 . 1 . 1 35 35 ASN N N 15 115.531 0.048 . 1 . . . . A 35 ASN N . 30977 1 356 . 1 . 1 35 35 ASN ND2 N 15 115.276 0.025 . 1 . . . . A 35 ASN ND2 . 30977 1 357 . 1 . 1 36 36 PHE H H 1 7.051 0.003 . 1 . . . . A 36 PHE H . 30977 1 358 . 1 . 1 36 36 PHE HA H 1 4.139 0.020 . 1 . . . . A 36 PHE HA . 30977 1 359 . 1 . 1 36 36 PHE HB2 H 1 3.005 0.011 . 2 . . . . A 36 PHE HB2 . 30977 1 360 . 1 . 1 36 36 PHE HB3 H 1 3.077 0.000 . 2 . . . . A 36 PHE HB3 . 30977 1 361 . 1 . 1 36 36 PHE HD1 H 1 7.055 0.014 . 1 . . . . A 36 PHE HD1 . 30977 1 362 . 1 . 1 36 36 PHE HD2 H 1 7.055 0.014 . 1 . . . . A 36 PHE HD2 . 30977 1 363 . 1 . 1 36 36 PHE CA C 13 61.592 0.000 . 1 . . . . A 36 PHE CA . 30977 1 364 . 1 . 1 36 36 PHE CB C 13 40.212 0.000 . 1 . . . . A 36 PHE CB . 30977 1 365 . 1 . 1 36 36 PHE CD1 C 13 130.824 0.019 . 1 . . . . A 36 PHE CD1 . 30977 1 366 . 1 . 1 36 36 PHE CD2 C 13 130.824 0.019 . 1 . . . . A 36 PHE CD2 . 30977 1 367 . 1 . 1 36 36 PHE N N 15 117.887 0.034 . 1 . . . . A 36 PHE N . 30977 1 368 . 1 . 1 37 37 ARG H H 1 8.959 0.007 . 1 . . . . A 37 ARG H . 30977 1 369 . 1 . 1 37 37 ARG HA H 1 3.695 0.020 . 1 . . . . A 37 ARG HA . 30977 1 370 . 1 . 1 37 37 ARG HB2 H 1 2.000 0.023 . 2 . . . . A 37 ARG HB2 . 30977 1 371 . 1 . 1 37 37 ARG HB3 H 1 1.866 0.019 . 2 . . . . A 37 ARG HB3 . 30977 1 372 . 1 . 1 37 37 ARG HG2 H 1 1.110 0.017 . 2 . . . . A 37 ARG HG2 . 30977 1 373 . 1 . 1 37 37 ARG HG3 H 1 1.555 0.021 . 2 . . . . A 37 ARG HG3 . 30977 1 374 . 1 . 1 37 37 ARG CA C 13 60.495 0.000 . 1 . . . . A 37 ARG CA . 30977 1 375 . 1 . 1 37 37 ARG CB C 13 30.058 0.000 . 1 . . . . A 37 ARG CB . 30977 1 376 . 1 . 1 37 37 ARG CG C 13 24.419 0.000 . 1 . . . . A 37 ARG CG . 30977 1 377 . 1 . 1 37 37 ARG CD C 13 41.253 0.000 . 1 . . . . A 37 ARG CD . 30977 1 378 . 1 . 1 37 37 ARG N N 15 120.923 0.016 . 1 . . . . A 37 ARG N . 30977 1 379 . 1 . 1 38 38 ALA H H 1 8.707 0.003 . 1 . . . . A 38 ALA H . 30977 1 380 . 1 . 1 38 38 ALA HA H 1 4.129 0.010 . 1 . . . . A 38 ALA HA . 30977 1 381 . 1 . 1 38 38 ALA HB1 H 1 1.285 0.013 . 1 . . . . A 38 ALA HB1 . 30977 1 382 . 1 . 1 38 38 ALA HB2 H 1 1.285 0.013 . 1 . . . . A 38 ALA HB2 . 30977 1 383 . 1 . 1 38 38 ALA HB3 H 1 1.285 0.013 . 1 . . . . A 38 ALA HB3 . 30977 1 384 . 1 . 1 38 38 ALA CA C 13 54.497 0.000 . 1 . . . . A 38 ALA CA . 30977 1 385 . 1 . 1 38 38 ALA CB C 13 18.469 0.000 . 1 . . . . A 38 ALA CB . 30977 1 386 . 1 . 1 38 38 ALA N N 15 119.055 0.016 . 1 . . . . A 38 ALA N . 30977 1 387 . 1 . 1 39 39 LEU H H 1 8.237 0.002 . 1 . . . . A 39 LEU H . 30977 1 388 . 1 . 1 39 39 LEU HA H 1 3.802 0.015 . 1 . . . . A 39 LEU HA . 30977 1 389 . 1 . 1 39 39 LEU HB2 H 1 1.418 0.015 . 2 . . . . A 39 LEU HB2 . 30977 1 390 . 1 . 1 39 39 LEU HB3 H 1 1.448 0.000 . 2 . . . . A 39 LEU HB3 . 30977 1 391 . 1 . 1 39 39 LEU HD11 H 1 0.549 0.021 . 1 . . . . A 39 LEU HD11 . 30977 1 392 . 1 . 1 39 39 LEU HD12 H 1 0.549 0.021 . 1 . . . . A 39 LEU HD12 . 30977 1 393 . 1 . 1 39 39 LEU HD13 H 1 0.549 0.021 . 1 . . . . A 39 LEU HD13 . 30977 1 394 . 1 . 1 39 39 LEU CA C 13 57.204 0.000 . 1 . . . . A 39 LEU CA . 30977 1 395 . 1 . 1 39 39 LEU CB C 13 41.207 0.000 . 1 . . . . A 39 LEU CB . 30977 1 396 . 1 . 1 39 39 LEU CG C 13 26.895 0.000 . 1 . . . . A 39 LEU CG . 30977 1 397 . 1 . 1 39 39 LEU CD1 C 13 24.358 0.040 . 1 . . . . A 39 LEU CD1 . 30977 1 398 . 1 . 1 39 39 LEU N N 15 120.692 0.025 . 1 . . . . A 39 LEU N . 30977 1 399 . 1 . 1 40 40 SER H H 1 7.925 0.006 . 1 . . . . A 40 SER H . 30977 1 400 . 1 . 1 40 40 SER HA H 1 4.492 0.003 . 1 . . . . A 40 SER HA . 30977 1 401 . 1 . 1 40 40 SER HB2 H 1 3.546 0.014 . 1 . . . . A 40 SER HB2 . 30977 1 402 . 1 . 1 40 40 SER CA C 13 62.676 0.002 . 1 . . . . A 40 SER CA . 30977 1 403 . 1 . 1 40 40 SER N N 15 119.187 0.018 . 1 . . . . A 40 SER N . 30977 1 404 . 1 . 1 41 41 THR H H 1 8.017 0.005 . 1 . . . . A 41 THR H . 30977 1 405 . 1 . 1 41 41 THR HA H 1 4.324 0.018 . 1 . . . . A 41 THR HA . 30977 1 406 . 1 . 1 41 41 THR HB H 1 4.520 0.012 . 1 . . . . A 41 THR HB . 30977 1 407 . 1 . 1 41 41 THR HG21 H 1 1.361 0.013 . 1 . . . . A 41 THR HG21 . 30977 1 408 . 1 . 1 41 41 THR HG22 H 1 1.361 0.013 . 1 . . . . A 41 THR HG22 . 30977 1 409 . 1 . 1 41 41 THR HG23 H 1 1.361 0.013 . 1 . . . . A 41 THR HG23 . 30977 1 410 . 1 . 1 41 41 THR CA C 13 62.904 0.000 . 1 . . . . A 41 THR CA . 30977 1 411 . 1 . 1 41 41 THR CB C 13 69.479 0.000 . 1 . . . . A 41 THR CB . 30977 1 412 . 1 . 1 41 41 THR CG2 C 13 22.621 0.000 . 1 . . . . A 41 THR CG2 . 30977 1 413 . 1 . 1 41 41 THR N N 15 108.412 0.009 . 1 . . . . A 41 THR N . 30977 1 414 . 1 . 1 42 42 GLY H H 1 7.622 0.003 . 1 . . . . A 42 GLY H . 30977 1 415 . 1 . 1 42 42 GLY HA2 H 1 3.546 0.014 . 2 . . . . A 42 GLY HA2 . 30977 1 416 . 1 . 1 42 42 GLY HA3 H 1 3.914 0.020 . 2 . . . . A 42 GLY HA3 . 30977 1 417 . 1 . 1 42 42 GLY CA C 13 45.898 0.000 . 1 . . . . A 42 GLY CA . 30977 1 418 . 1 . 1 42 42 GLY N N 15 108.266 0.048 . 1 . . . . A 42 GLY N . 30977 1 419 . 1 . 1 43 43 GLU H H 1 8.042 0.004 . 1 . . . . A 43 GLU H . 30977 1 420 . 1 . 1 43 43 GLU HA H 1 4.161 0.016 . 1 . . . . A 43 GLU HA . 30977 1 421 . 1 . 1 43 43 GLU HB2 H 1 2.101 0.009 . 2 . . . . A 43 GLU HB2 . 30977 1 422 . 1 . 1 43 43 GLU HB3 H 1 2.246 0.026 . 2 . . . . A 43 GLU HB3 . 30977 1 423 . 1 . 1 43 43 GLU HG2 H 1 1.831 0.019 . 1 . . . . A 43 GLU HG2 . 30977 1 424 . 1 . 1 43 43 GLU CA C 13 58.588 0.000 . 1 . . . . A 43 GLU CA . 30977 1 425 . 1 . 1 43 43 GLU CB C 13 30.196 0.000 . 1 . . . . A 43 GLU CB . 30977 1 426 . 1 . 1 43 43 GLU CG C 13 35.384 0.000 . 1 . . . . A 43 GLU CG . 30977 1 427 . 1 . 1 43 43 GLU N N 15 118.580 0.010 . 1 . . . . A 43 GLU N . 30977 1 428 . 1 . 1 44 44 LYS H H 1 9.136 0.005 . 1 . . . . A 44 LYS H . 30977 1 429 . 1 . 1 44 44 LYS HA H 1 4.347 0.006 . 1 . . . . A 44 LYS HA . 30977 1 430 . 1 . 1 44 44 LYS HB2 H 1 1.674 0.019 . 2 . . . . A 44 LYS HB2 . 30977 1 431 . 1 . 1 44 44 LYS HB3 H 1 0.946 0.012 . 2 . . . . A 44 LYS HB3 . 30977 1 432 . 1 . 1 44 44 LYS HG2 H 1 1.086 0.004 . 2 . . . . A 44 LYS HG2 . 30977 1 433 . 1 . 1 44 44 LYS HG3 H 1 1.072 0.007 . 2 . . . . A 44 LYS HG3 . 30977 1 434 . 1 . 1 44 44 LYS HE2 H 1 2.711 0.002 . 1 . . . . A 44 LYS HE2 . 30977 1 435 . 1 . 1 44 44 LYS CA C 13 54.400 0.000 . 1 . . . . A 44 LYS CA . 30977 1 436 . 1 . 1 44 44 LYS CB C 13 30.602 0.000 . 1 . . . . A 44 LYS CB . 30977 1 437 . 1 . 1 44 44 LYS CG C 13 25.037 0.000 . 1 . . . . A 44 LYS CG . 30977 1 438 . 1 . 1 44 44 LYS CD C 13 27.750 0.000 . 1 . . . . A 44 LYS CD . 30977 1 439 . 1 . 1 44 44 LYS CE C 13 42.381 0.000 . 1 . . . . A 44 LYS CE . 30977 1 440 . 1 . 1 44 44 LYS N N 15 118.370 0.009 . 1 . . . . A 44 LYS N . 30977 1 441 . 1 . 1 45 45 GLY H H 1 7.972 0.004 . 1 . . . . A 45 GLY H . 30977 1 442 . 1 . 1 45 45 GLY HA2 H 1 3.589 0.018 . 2 . . . . A 45 GLY HA2 . 30977 1 443 . 1 . 1 45 45 GLY HA3 H 1 4.334 0.022 . 2 . . . . A 45 GLY HA3 . 30977 1 444 . 1 . 1 45 45 GLY CA C 13 44.586 0.000 . 1 . . . . A 45 GLY CA . 30977 1 445 . 1 . 1 45 45 GLY N N 15 105.529 0.010 . 1 . . . . A 45 GLY N . 30977 1 446 . 1 . 1 46 46 PHE H H 1 6.451 0.003 . 1 . . . . A 46 PHE H . 30977 1 447 . 1 . 1 46 46 PHE HA H 1 4.667 0.017 . 1 . . . . A 46 PHE HA . 30977 1 448 . 1 . 1 46 46 PHE HB2 H 1 2.769 0.006 . 2 . . . . A 46 PHE HB2 . 30977 1 449 . 1 . 1 46 46 PHE HB3 H 1 3.160 0.015 . 2 . . . . A 46 PHE HB3 . 30977 1 450 . 1 . 1 46 46 PHE HD1 H 1 6.669 0.009 . 1 . . . . A 46 PHE HD1 . 30977 1 451 . 1 . 1 46 46 PHE HD2 H 1 6.669 0.009 . 1 . . . . A 46 PHE HD2 . 30977 1 452 . 1 . 1 46 46 PHE HE1 H 1 7.032 0.008 . 1 . . . . A 46 PHE HE1 . 30977 1 453 . 1 . 1 46 46 PHE HE2 H 1 7.032 0.008 . 1 . . . . A 46 PHE HE2 . 30977 1 454 . 1 . 1 46 46 PHE HZ H 1 7.119 0.001 . 1 . . . . A 46 PHE HZ . 30977 1 455 . 1 . 1 46 46 PHE CA C 13 54.191 0.000 . 1 . . . . A 46 PHE CA . 30977 1 456 . 1 . 1 46 46 PHE CB C 13 39.631 0.000 . 1 . . . . A 46 PHE CB . 30977 1 457 . 1 . 1 46 46 PHE CD1 C 13 132.885 0.008 . 1 . . . . A 46 PHE CD1 . 30977 1 458 . 1 . 1 46 46 PHE CD2 C 13 132.885 0.008 . 1 . . . . A 46 PHE CD2 . 30977 1 459 . 1 . 1 46 46 PHE CE1 C 13 130.811 0.012 . 1 . . . . A 46 PHE CE1 . 30977 1 460 . 1 . 1 46 46 PHE CE2 C 13 130.811 0.012 . 1 . . . . A 46 PHE CE2 . 30977 1 461 . 1 . 1 46 46 PHE CZ C 13 129.408 0.016 . 1 . . . . A 46 PHE CZ . 30977 1 462 . 1 . 1 46 46 PHE N N 15 113.593 0.007 . 1 . . . . A 46 PHE N . 30977 1 463 . 1 . 1 47 47 GLY H H 1 7.760 0.008 . 1 . . . . A 47 GLY H . 30977 1 464 . 1 . 1 47 47 GLY HA2 H 1 2.590 0.012 . 2 . . . . A 47 GLY HA2 . 30977 1 465 . 1 . 1 47 47 GLY HA3 H 1 4.403 0.011 . 2 . . . . A 47 GLY HA3 . 30977 1 466 . 1 . 1 47 47 GLY CA C 13 45.715 0.000 . 1 . . . . A 47 GLY CA . 30977 1 467 . 1 . 1 47 47 GLY N N 15 104.568 0.012 . 1 . . . . A 47 GLY N . 30977 1 468 . 1 . 1 48 48 TYR H H 1 6.928 0.002 . 1 . . . . A 48 TYR H . 30977 1 469 . 1 . 1 48 48 TYR HA H 1 4.266 0.023 . 1 . . . . A 48 TYR HA . 30977 1 470 . 1 . 1 48 48 TYR HB2 H 1 2.855 0.016 . 2 . . . . A 48 TYR HB2 . 30977 1 471 . 1 . 1 48 48 TYR HB3 H 1 2.678 0.023 . 2 . . . . A 48 TYR HB3 . 30977 1 472 . 1 . 1 48 48 TYR HD1 H 1 6.788 0.017 . 1 . . . . A 48 TYR HD1 . 30977 1 473 . 1 . 1 48 48 TYR HD2 H 1 6.788 0.017 . 1 . . . . A 48 TYR HD2 . 30977 1 474 . 1 . 1 48 48 TYR CA C 13 57.345 0.000 . 1 . . . . A 48 TYR CA . 30977 1 475 . 1 . 1 48 48 TYR CB C 13 38.699 0.000 . 1 . . . . A 48 TYR CB . 30977 1 476 . 1 . 1 48 48 TYR N N 15 113.731 0.010 . 1 . . . . A 48 TYR N . 30977 1 477 . 1 . 1 49 49 LYS H H 1 8.505 0.006 . 1 . . . . A 49 LYS H . 30977 1 478 . 1 . 1 49 49 LYS HA H 1 3.678 0.023 . 1 . . . . A 49 LYS HA . 30977 1 479 . 1 . 1 49 49 LYS HB2 H 1 1.655 0.016 . 2 . . . . A 49 LYS HB2 . 30977 1 480 . 1 . 1 49 49 LYS HB3 H 1 2.014 0.025 . 2 . . . . A 49 LYS HB3 . 30977 1 481 . 1 . 1 49 49 LYS HG2 H 1 1.331 0.019 . 1 . . . . A 49 LYS HG2 . 30977 1 482 . 1 . 1 49 49 LYS CA C 13 61.069 0.000 . 1 . . . . A 49 LYS CA . 30977 1 483 . 1 . 1 49 49 LYS CB C 13 31.339 0.000 . 1 . . . . A 49 LYS CB . 30977 1 484 . 1 . 1 49 49 LYS CG C 13 25.556 0.000 . 1 . . . . A 49 LYS CG . 30977 1 485 . 1 . 1 49 49 LYS N N 15 124.907 0.019 . 1 . . . . A 49 LYS N . 30977 1 486 . 1 . 1 50 50 GLY H H 1 9.539 0.010 . 1 . . . . A 50 GLY H . 30977 1 487 . 1 . 1 50 50 GLY HA2 H 1 3.770 0.000 . 2 . . . . A 50 GLY HA2 . 30977 1 488 . 1 . 1 50 50 GLY HA3 H 1 4.431 0.009 . 2 . . . . A 50 GLY HA3 . 30977 1 489 . 1 . 1 50 50 GLY CA C 13 45.440 0.000 . 1 . . . . A 50 GLY CA . 30977 1 490 . 1 . 1 50 50 GLY N N 15 117.846 0.045 . 1 . . . . A 50 GLY N . 30977 1 491 . 1 . 1 51 51 SER H H 1 8.418 0.001 . 1 . . . . A 51 SER H . 30977 1 492 . 1 . 1 51 51 SER HA H 1 4.685 0.007 . 1 . . . . A 51 SER HA . 30977 1 493 . 1 . 1 51 51 SER HB2 H 1 4.364 0.000 . 1 . . . . A 51 SER HB2 . 30977 1 494 . 1 . 1 51 51 SER CA C 13 59.140 0.000 . 1 . . . . A 51 SER CA . 30977 1 495 . 1 . 1 51 51 SER CB C 13 64.860 0.010 . 1 . . . . A 51 SER CB . 30977 1 496 . 1 . 1 51 51 SER N N 15 116.414 0.020 . 1 . . . . A 51 SER N . 30977 1 497 . 1 . 1 52 52 CYS H H 1 9.982 0.010 . 1 . . . . A 52 CYS H . 30977 1 498 . 1 . 1 52 52 CYS HA H 1 5.940 0.018 . 1 . . . . A 52 CYS HA . 30977 1 499 . 1 . 1 52 52 CYS HB2 H 1 3.086 0.018 . 1 . . . . A 52 CYS HB2 . 30977 1 500 . 1 . 1 52 52 CYS CA C 13 56.112 0.000 . 1 . . . . A 52 CYS CA . 30977 1 501 . 1 . 1 52 52 CYS CB C 13 32.045 0.000 . 1 . . . . A 52 CYS CB . 30977 1 502 . 1 . 1 52 52 CYS N N 15 114.985 0.022 . 1 . . . . A 52 CYS N . 30977 1 503 . 1 . 1 53 53 PHE H H 1 8.719 0.004 . 1 . . . . A 53 PHE H . 30977 1 504 . 1 . 1 53 53 PHE HB2 H 1 2.723 0.020 . 2 . . . . A 53 PHE HB2 . 30977 1 505 . 1 . 1 53 53 PHE HB3 H 1 2.913 0.020 . 2 . . . . A 53 PHE HB3 . 30977 1 506 . 1 . 1 53 53 PHE HD1 H 1 6.970 0.013 . 1 . . . . A 53 PHE HD1 . 30977 1 507 . 1 . 1 53 53 PHE HD2 H 1 6.970 0.013 . 1 . . . . A 53 PHE HD2 . 30977 1 508 . 1 . 1 53 53 PHE HE1 H 1 7.232 0.009 . 1 . . . . A 53 PHE HE1 . 30977 1 509 . 1 . 1 53 53 PHE HE2 H 1 7.232 0.009 . 1 . . . . A 53 PHE HE2 . 30977 1 510 . 1 . 1 53 53 PHE HZ H 1 7.431 0.003 . 1 . . . . A 53 PHE HZ . 30977 1 511 . 1 . 1 53 53 PHE CA C 13 58.407 0.000 . 1 . . . . A 53 PHE CA . 30977 1 512 . 1 . 1 53 53 PHE CB C 13 38.995 0.000 . 1 . . . . A 53 PHE CB . 30977 1 513 . 1 . 1 53 53 PHE CD1 C 13 131.548 0.013 . 1 . . . . A 53 PHE CD1 . 30977 1 514 . 1 . 1 53 53 PHE CD2 C 13 131.548 0.013 . 1 . . . . A 53 PHE CD2 . 30977 1 515 . 1 . 1 53 53 PHE CE1 C 13 130.990 0.056 . 1 . . . . A 53 PHE CE1 . 30977 1 516 . 1 . 1 53 53 PHE CE2 C 13 130.990 0.056 . 1 . . . . A 53 PHE CE2 . 30977 1 517 . 1 . 1 53 53 PHE CZ C 13 128.557 0.105 . 1 . . . . A 53 PHE CZ . 30977 1 518 . 1 . 1 53 53 PHE N N 15 122.837 0.013 . 1 . . . . A 53 PHE N . 30977 1 519 . 1 . 1 54 54 HIS H H 1 7.691 0.007 . 1 . . . . A 54 HIS H . 30977 1 520 . 1 . 1 54 54 HIS HA H 1 4.792 0.027 . 1 . . . . A 54 HIS HA . 30977 1 521 . 1 . 1 54 54 HIS HB2 H 1 3.165 0.159 . 2 . . . . A 54 HIS HB2 . 30977 1 522 . 1 . 1 54 54 HIS HB3 H 1 3.311 0.000 . 2 . . . . A 54 HIS HB3 . 30977 1 523 . 1 . 1 54 54 HIS HD2 H 1 6.894 0.014 . 1 . . . . A 54 HIS HD2 . 30977 1 524 . 1 . 1 54 54 HIS HE1 H 1 7.411 0.006 . 1 . . . . A 54 HIS HE1 . 30977 1 525 . 1 . 1 54 54 HIS CA C 13 57.228 0.000 . 1 . . . . A 54 HIS CA . 30977 1 526 . 1 . 1 54 54 HIS CB C 13 31.365 0.000 . 1 . . . . A 54 HIS CB . 30977 1 527 . 1 . 1 54 54 HIS CD2 C 13 118.432 0.016 . 1 . . . . A 54 HIS CD2 . 30977 1 528 . 1 . 1 54 54 HIS CE1 C 13 137.949 0.027 . 1 . . . . A 54 HIS CE1 . 30977 1 529 . 1 . 1 54 54 HIS N N 15 120.388 0.026 . 1 . . . . A 54 HIS N . 30977 1 530 . 1 . 1 55 55 ARG H H 1 7.101 0.003 . 1 . . . . A 55 ARG H . 30977 1 531 . 1 . 1 55 55 ARG HA H 1 5.156 0.010 . 1 . . . . A 55 ARG HA . 30977 1 532 . 1 . 1 55 55 ARG HB2 H 1 1.465 0.020 . 2 . . . . A 55 ARG HB2 . 30977 1 533 . 1 . 1 55 55 ARG HB3 H 1 1.329 0.018 . 2 . . . . A 55 ARG HB3 . 30977 1 534 . 1 . 1 55 55 ARG HG2 H 1 1.633 0.012 . 2 . . . . A 55 ARG HG2 . 30977 1 535 . 1 . 1 55 55 ARG HG3 H 1 1.312 0.015 . 2 . . . . A 55 ARG HG3 . 30977 1 536 . 1 . 1 55 55 ARG HD2 H 1 3.241 0.000 . 1 . . . . A 55 ARG HD2 . 30977 1 537 . 1 . 1 55 55 ARG CA C 13 55.201 0.000 . 1 . . . . A 55 ARG CA . 30977 1 538 . 1 . 1 55 55 ARG CB C 13 34.147 0.000 . 1 . . . . A 55 ARG CB . 30977 1 539 . 1 . 1 55 55 ARG CG C 13 28.387 0.000 . 1 . . . . A 55 ARG CG . 30977 1 540 . 1 . 1 55 55 ARG CD C 13 43.506 0.000 . 1 . . . . A 55 ARG CD . 30977 1 541 . 1 . 1 55 55 ARG N N 15 122.246 0.034 . 1 . . . . A 55 ARG N . 30977 1 542 . 1 . 1 56 56 ILE H H 1 9.289 0.008 . 1 . . . . A 56 ILE H . 30977 1 543 . 1 . 1 56 56 ILE HA H 1 4.622 0.016 . 1 . . . . A 56 ILE HA . 30977 1 544 . 1 . 1 56 56 ILE HB H 1 1.635 0.018 . 1 . . . . A 56 ILE HB . 30977 1 545 . 1 . 1 56 56 ILE HG21 H 1 1.056 0.021 . 1 . . . . A 56 ILE HG21 . 30977 1 546 . 1 . 1 56 56 ILE HG22 H 1 1.056 0.021 . 1 . . . . A 56 ILE HG22 . 30977 1 547 . 1 . 1 56 56 ILE HG23 H 1 1.056 0.021 . 1 . . . . A 56 ILE HG23 . 30977 1 548 . 1 . 1 56 56 ILE HD11 H 1 0.901 0.011 . 1 . . . . A 56 ILE HD11 . 30977 1 549 . 1 . 1 56 56 ILE HD12 H 1 0.901 0.011 . 1 . . . . A 56 ILE HD12 . 30977 1 550 . 1 . 1 56 56 ILE HD13 H 1 0.901 0.011 . 1 . . . . A 56 ILE HD13 . 30977 1 551 . 1 . 1 56 56 ILE CA C 13 61.808 0.000 . 1 . . . . A 56 ILE CA . 30977 1 552 . 1 . 1 56 56 ILE CB C 13 41.857 0.100 . 1 . . . . A 56 ILE CB . 30977 1 553 . 1 . 1 56 56 ILE CG1 C 13 27.638 0.000 . 1 . . . . A 56 ILE CG1 . 30977 1 554 . 1 . 1 56 56 ILE CG2 C 13 17.634 0.000 . 1 . . . . A 56 ILE CG2 . 30977 1 555 . 1 . 1 56 56 ILE CD1 C 13 14.417 0.000 . 1 . . . . A 56 ILE CD1 . 30977 1 556 . 1 . 1 56 56 ILE N N 15 125.826 0.008 . 1 . . . . A 56 ILE N . 30977 1 557 . 1 . 1 57 57 ILE H H 1 8.859 0.008 . 1 . . . . A 57 ILE H . 30977 1 558 . 1 . 1 57 57 ILE HA H 1 5.203 0.021 . 1 . . . . A 57 ILE HA . 30977 1 559 . 1 . 1 57 57 ILE HB H 1 1.961 0.014 . 1 . . . . A 57 ILE HB . 30977 1 560 . 1 . 1 57 57 ILE HG12 H 1 1.494 0.010 . 1 . . . . A 57 ILE HG12 . 30977 1 561 . 1 . 1 57 57 ILE HG21 H 1 1.148 0.036 . 1 . . . . A 57 ILE HG21 . 30977 1 562 . 1 . 1 57 57 ILE HG22 H 1 1.148 0.036 . 1 . . . . A 57 ILE HG22 . 30977 1 563 . 1 . 1 57 57 ILE HG23 H 1 1.148 0.036 . 1 . . . . A 57 ILE HG23 . 30977 1 564 . 1 . 1 57 57 ILE HD11 H 1 0.978 0.038 . 1 . . . . A 57 ILE HD11 . 30977 1 565 . 1 . 1 57 57 ILE HD12 H 1 0.978 0.038 . 1 . . . . A 57 ILE HD12 . 30977 1 566 . 1 . 1 57 57 ILE HD13 H 1 0.978 0.038 . 1 . . . . A 57 ILE HD13 . 30977 1 567 . 1 . 1 57 57 ILE CA C 13 57.777 0.012 . 1 . . . . A 57 ILE CA . 30977 1 568 . 1 . 1 57 57 ILE CB C 13 40.350 0.000 . 1 . . . . A 57 ILE CB . 30977 1 569 . 1 . 1 57 57 ILE CG1 C 13 27.584 0.000 . 1 . . . . A 57 ILE CG1 . 30977 1 570 . 1 . 1 57 57 ILE CG2 C 13 17.632 0.000 . 1 . . . . A 57 ILE CG2 . 30977 1 571 . 1 . 1 57 57 ILE CD1 C 13 13.855 0.000 . 1 . . . . A 57 ILE CD1 . 30977 1 572 . 1 . 1 57 57 ILE N N 15 128.470 0.015 . 1 . . . . A 57 ILE N . 30977 1 573 . 1 . 1 58 58 PRO HA H 1 4.262 0.016 . 1 . . . . A 58 PRO HA . 30977 1 574 . 1 . 1 58 58 PRO HB2 H 1 1.862 0.012 . 2 . . . . A 58 PRO HB2 . 30977 1 575 . 1 . 1 58 58 PRO HB3 H 1 2.285 0.011 . 2 . . . . A 58 PRO HB3 . 30977 1 576 . 1 . 1 58 58 PRO HG2 H 1 1.891 0.016 . 1 . . . . A 58 PRO HG2 . 30977 1 577 . 1 . 1 58 58 PRO HD2 H 1 3.488 0.008 . 1 . . . . A 58 PRO HD2 . 30977 1 578 . 1 . 1 58 58 PRO CA C 13 63.353 0.000 . 1 . . . . A 58 PRO CA . 30977 1 579 . 1 . 1 58 58 PRO CB C 13 32.196 0.000 . 1 . . . . A 58 PRO CB . 30977 1 580 . 1 . 1 58 58 PRO CG C 13 27.334 0.000 . 1 . . . . A 58 PRO CG . 30977 1 581 . 1 . 1 58 58 PRO CD C 13 52.269 0.000 . 1 . . . . A 58 PRO CD . 30977 1 582 . 1 . 1 59 59 GLY H H 1 9.833 0.003 . 1 . . . . A 59 GLY H . 30977 1 583 . 1 . 1 59 59 GLY HA2 H 1 3.864 0.009 . 2 . . . . A 59 GLY HA2 . 30977 1 584 . 1 . 1 59 59 GLY HA3 H 1 4.047 0.016 . 2 . . . . A 59 GLY HA3 . 30977 1 585 . 1 . 1 59 59 GLY CA C 13 45.324 0.019 . 1 . . . . A 59 GLY CA . 30977 1 586 . 1 . 1 59 59 GLY N N 15 114.531 0.022 . 1 . . . . A 59 GLY N . 30977 1 587 . 1 . 1 60 60 PHE H H 1 8.374 0.002 . 1 . . . . A 60 PHE H . 30977 1 588 . 1 . 1 60 60 PHE HA H 1 5.000 0.022 . 1 . . . . A 60 PHE HA . 30977 1 589 . 1 . 1 60 60 PHE HB2 H 1 2.922 0.029 . 2 . . . . A 60 PHE HB2 . 30977 1 590 . 1 . 1 60 60 PHE HB3 H 1 3.274 0.013 . 2 . . . . A 60 PHE HB3 . 30977 1 591 . 1 . 1 60 60 PHE HD1 H 1 7.369 0.006 . 1 . . . . A 60 PHE HD1 . 30977 1 592 . 1 . 1 60 60 PHE HD2 H 1 7.369 0.006 . 1 . . . . A 60 PHE HD2 . 30977 1 593 . 1 . 1 60 60 PHE HE1 H 1 7.479 0.003 . 1 . . . . A 60 PHE HE1 . 30977 1 594 . 1 . 1 60 60 PHE HE2 H 1 7.479 0.003 . 1 . . . . A 60 PHE HE2 . 30977 1 595 . 1 . 1 60 60 PHE CA C 13 57.196 0.056 . 1 . . . . A 60 PHE CA . 30977 1 596 . 1 . 1 60 60 PHE CB C 13 41.136 0.003 . 1 . . . . A 60 PHE CB . 30977 1 597 . 1 . 1 60 60 PHE CD1 C 13 130.525 0.055 . 1 . . . . A 60 PHE CD1 . 30977 1 598 . 1 . 1 60 60 PHE CD2 C 13 130.525 0.055 . 1 . . . . A 60 PHE CD2 . 30977 1 599 . 1 . 1 60 60 PHE CE1 C 13 131.035 0.050 . 1 . . . . A 60 PHE CE1 . 30977 1 600 . 1 . 1 60 60 PHE CE2 C 13 131.035 0.050 . 1 . . . . A 60 PHE CE2 . 30977 1 601 . 1 . 1 60 60 PHE N N 15 120.918 0.025 . 1 . . . . A 60 PHE N . 30977 1 602 . 1 . 1 61 61 MET H H 1 8.305 0.003 . 1 . . . . A 61 MET H . 30977 1 603 . 1 . 1 61 61 MET HA H 1 5.523 0.032 . 1 . . . . A 61 MET HA . 30977 1 604 . 1 . 1 61 61 MET HB2 H 1 2.370 0.024 . 2 . . . . A 61 MET HB2 . 30977 1 605 . 1 . 1 61 61 MET HB3 H 1 1.478 0.018 . 2 . . . . A 61 MET HB3 . 30977 1 606 . 1 . 1 61 61 MET HG2 H 1 1.743 0.029 . 1 . . . . A 61 MET HG2 . 30977 1 607 . 1 . 1 61 61 MET HE1 H 1 1.221 0.021 . 1 . . . . A 61 MET HE1 . 30977 1 608 . 1 . 1 61 61 MET HE2 H 1 1.221 0.021 . 1 . . . . A 61 MET HE2 . 30977 1 609 . 1 . 1 61 61 MET HE3 H 1 1.221 0.021 . 1 . . . . A 61 MET HE3 . 30977 1 610 . 1 . 1 61 61 MET CA C 13 55.909 0.000 . 1 . . . . A 61 MET CA . 30977 1 611 . 1 . 1 61 61 MET CB C 13 34.468 0.000 . 1 . . . . A 61 MET CB . 30977 1 612 . 1 . 1 61 61 MET CG C 13 29.664 0.000 . 1 . . . . A 61 MET CG . 30977 1 613 . 1 . 1 61 61 MET CE C 13 14.574 0.000 . 1 . . . . A 61 MET CE . 30977 1 614 . 1 . 1 61 61 MET N N 15 111.930 0.011 . 1 . . . . A 61 MET N . 30977 1 615 . 1 . 1 62 62 CYS H H 1 8.781 0.012 . 1 . . . . A 62 CYS H . 30977 1 616 . 1 . 1 62 62 CYS HA H 1 4.974 0.021 . 1 . . . . A 62 CYS HA . 30977 1 617 . 1 . 1 62 62 CYS HB2 H 1 3.037 0.022 . 2 . . . . A 62 CYS HB2 . 30977 1 618 . 1 . 1 62 62 CYS HB3 H 1 2.595 0.019 . 2 . . . . A 62 CYS HB3 . 30977 1 619 . 1 . 1 62 62 CYS CA C 13 57.548 0.000 . 1 . . . . A 62 CYS CA . 30977 1 620 . 1 . 1 62 62 CYS CB C 13 30.035 0.000 . 1 . . . . A 62 CYS CB . 30977 1 621 . 1 . 1 62 62 CYS N N 15 116.566 0.011 . 1 . . . . A 62 CYS N . 30977 1 622 . 1 . 1 63 63 GLN H H 1 9.694 0.010 . 1 . . . . A 63 GLN H . 30977 1 623 . 1 . 1 63 63 GLN HA H 1 5.448 0.026 . 1 . . . . A 63 GLN HA . 30977 1 624 . 1 . 1 63 63 GLN HB2 H 1 1.900 0.016 . 2 . . . . A 63 GLN HB2 . 30977 1 625 . 1 . 1 63 63 GLN HB3 H 1 2.039 0.013 . 2 . . . . A 63 GLN HB3 . 30977 1 626 . 1 . 1 63 63 GLN HG2 H 1 2.094 0.018 . 2 . . . . A 63 GLN HG2 . 30977 1 627 . 1 . 1 63 63 GLN HG3 H 1 2.485 0.021 . 2 . . . . A 63 GLN HG3 . 30977 1 628 . 1 . 1 63 63 GLN HE21 H 1 7.700 0.001 . 1 . . . . A 63 GLN HE21 . 30977 1 629 . 1 . 1 63 63 GLN HE22 H 1 6.828 0.002 . 1 . . . . A 63 GLN HE22 . 30977 1 630 . 1 . 1 63 63 GLN CA C 13 54.652 0.000 . 1 . . . . A 63 GLN CA . 30977 1 631 . 1 . 1 63 63 GLN CB C 13 30.474 0.000 . 1 . . . . A 63 GLN CB . 30977 1 632 . 1 . 1 63 63 GLN CG C 13 33.229 0.000 . 1 . . . . A 63 GLN CG . 30977 1 633 . 1 . 1 63 63 GLN N N 15 125.315 0.014 . 1 . . . . A 63 GLN N . 30977 1 634 . 1 . 1 63 63 GLN NE2 N 15 110.350 0.051 . 1 . . . . A 63 GLN NE2 . 30977 1 635 . 1 . 1 64 64 GLY H H 1 7.524 0.008 . 1 . . . . A 64 GLY H . 30977 1 636 . 1 . 1 64 64 GLY HA2 H 1 2.643 0.020 . 2 . . . . A 64 GLY HA2 . 30977 1 637 . 1 . 1 64 64 GLY HA3 H 1 4.793 0.020 . 2 . . . . A 64 GLY HA3 . 30977 1 638 . 1 . 1 64 64 GLY CA C 13 44.565 0.007 . 1 . . . . A 64 GLY CA . 30977 1 639 . 1 . 1 64 64 GLY N N 15 110.158 0.018 . 1 . . . . A 64 GLY N . 30977 1 640 . 1 . 1 65 65 GLY H H 1 9.399 0.018 . 1 . . . . A 65 GLY H . 30977 1 641 . 1 . 1 65 65 GLY HA2 H 1 4.869 0.018 . 2 . . . . A 65 GLY HA2 . 30977 1 642 . 1 . 1 65 65 GLY HA3 H 1 3.828 0.024 . 2 . . . . A 65 GLY HA3 . 30977 1 643 . 1 . 1 65 65 GLY CA C 13 46.739 0.000 . 1 . . . . A 65 GLY CA . 30977 1 644 . 1 . 1 65 65 GLY N N 15 106.160 0.003 . 1 . . . . A 65 GLY N . 30977 1 645 . 1 . 1 66 66 ASP H H 1 9.997 0.013 . 1 . . . . A 66 ASP H . 30977 1 646 . 1 . 1 66 66 ASP HA H 1 4.354 0.029 . 1 . . . . A 66 ASP HA . 30977 1 647 . 1 . 1 66 66 ASP HB2 H 1 3.014 0.013 . 2 . . . . A 66 ASP HB2 . 30977 1 648 . 1 . 1 66 66 ASP HB3 H 1 1.712 0.015 . 2 . . . . A 66 ASP HB3 . 30977 1 649 . 1 . 1 66 66 ASP CA C 13 52.048 0.010 . 1 . . . . A 66 ASP CA . 30977 1 650 . 1 . 1 66 66 ASP CB C 13 38.857 0.000 . 1 . . . . A 66 ASP CB . 30977 1 651 . 1 . 1 66 66 ASP N N 15 123.770 0.015 . 1 . . . . A 66 ASP N . 30977 1 652 . 1 . 1 67 67 PHE H H 1 6.677 0.006 . 1 . . . . A 67 PHE H . 30977 1 653 . 1 . 1 67 67 PHE HA H 1 4.655 0.020 . 1 . . . . A 67 PHE HA . 30977 1 654 . 1 . 1 67 67 PHE HB2 H 1 2.627 0.021 . 2 . . . . A 67 PHE HB2 . 30977 1 655 . 1 . 1 67 67 PHE HB3 H 1 3.956 0.010 . 2 . . . . A 67 PHE HB3 . 30977 1 656 . 1 . 1 67 67 PHE HD1 H 1 7.237 0.002 . 1 . . . . A 67 PHE HD1 . 30977 1 657 . 1 . 1 67 67 PHE HD2 H 1 7.237 0.002 . 1 . . . . A 67 PHE HD2 . 30977 1 658 . 1 . 1 67 67 PHE HE1 H 1 7.440 0.021 . 1 . . . . A 67 PHE HE1 . 30977 1 659 . 1 . 1 67 67 PHE HE2 H 1 7.440 0.021 . 1 . . . . A 67 PHE HE2 . 30977 1 660 . 1 . 1 67 67 PHE CA C 13 56.216 0.000 . 1 . . . . A 67 PHE CA . 30977 1 661 . 1 . 1 67 67 PHE CB C 13 39.614 0.036 . 1 . . . . A 67 PHE CB . 30977 1 662 . 1 . 1 67 67 PHE CD1 C 13 132.461 0.011 . 1 . . . . A 67 PHE CD1 . 30977 1 663 . 1 . 1 67 67 PHE CD2 C 13 132.461 0.011 . 1 . . . . A 67 PHE CD2 . 30977 1 664 . 1 . 1 67 67 PHE CE1 C 13 131.179 0.067 . 1 . . . . A 67 PHE CE1 . 30977 1 665 . 1 . 1 67 67 PHE CE2 C 13 131.179 0.067 . 1 . . . . A 67 PHE CE2 . 30977 1 666 . 1 . 1 67 67 PHE N N 15 116.121 0.029 . 1 . . . . A 67 PHE N . 30977 1 667 . 1 . 1 68 68 THR H H 1 7.318 0.024 . 1 . . . . A 68 THR H . 30977 1 668 . 1 . 1 68 68 THR HA H 1 4.690 0.013 . 1 . . . . A 68 THR HA . 30977 1 669 . 1 . 1 68 68 THR HB H 1 4.162 0.017 . 1 . . . . A 68 THR HB . 30977 1 670 . 1 . 1 68 68 THR HG21 H 1 0.721 0.020 . 1 . . . . A 68 THR HG21 . 30977 1 671 . 1 . 1 68 68 THR HG22 H 1 0.721 0.020 . 1 . . . . A 68 THR HG22 . 30977 1 672 . 1 . 1 68 68 THR HG23 H 1 0.721 0.020 . 1 . . . . A 68 THR HG23 . 30977 1 673 . 1 . 1 68 68 THR CA C 13 61.797 0.000 . 1 . . . . A 68 THR CA . 30977 1 674 . 1 . 1 68 68 THR CB C 13 69.277 0.000 . 1 . . . . A 68 THR CB . 30977 1 675 . 1 . 1 68 68 THR CG2 C 13 22.980 0.000 . 1 . . . . A 68 THR CG2 . 30977 1 676 . 1 . 1 68 68 THR N N 15 108.843 0.026 . 1 . . . . A 68 THR N . 30977 1 677 . 1 . 1 69 69 ARG H H 1 8.699 0.006 . 1 . . . . A 69 ARG H . 30977 1 678 . 1 . 1 69 69 ARG HA H 1 4.421 0.005 . 1 . . . . A 69 ARG HA . 30977 1 679 . 1 . 1 69 69 ARG HB2 H 1 1.660 0.010 . 2 . . . . A 69 ARG HB2 . 30977 1 680 . 1 . 1 69 69 ARG HB3 H 1 1.927 0.011 . 2 . . . . A 69 ARG HB3 . 30977 1 681 . 1 . 1 69 69 ARG HG2 H 1 1.434 0.019 . 2 . . . . A 69 ARG HG2 . 30977 1 682 . 1 . 1 69 69 ARG HG3 H 1 1.498 0.005 . 2 . . . . A 69 ARG HG3 . 30977 1 683 . 1 . 1 69 69 ARG HD2 H 1 2.987 0.013 . 1 . . . . A 69 ARG HD2 . 30977 1 684 . 1 . 1 69 69 ARG CA C 13 55.350 0.030 . 1 . . . . A 69 ARG CA . 30977 1 685 . 1 . 1 69 69 ARG CB C 13 31.922 0.000 . 1 . . . . A 69 ARG CB . 30977 1 686 . 1 . 1 69 69 ARG CG C 13 26.841 0.000 . 1 . . . . A 69 ARG CG . 30977 1 687 . 1 . 1 69 69 ARG CD C 13 43.203 0.000 . 1 . . . . A 69 ARG CD . 30977 1 688 . 1 . 1 69 69 ARG N N 15 121.919 0.033 . 1 . . . . A 69 ARG N . 30977 1 689 . 1 . 1 70 70 HIS HA H 1 4.476 0.005 . 1 . . . . A 70 HIS HA . 30977 1 690 . 1 . 1 70 70 HIS HB3 H 1 3.289 0.004 . 1 . . . . A 70 HIS HB3 . 30977 1 691 . 1 . 1 70 70 HIS HE1 H 1 7.777 0.002 . 1 . . . . A 70 HIS HE1 . 30977 1 692 . 1 . 1 70 70 HIS CA C 13 57.576 0.000 . 1 . . . . A 70 HIS CA . 30977 1 693 . 1 . 1 70 70 HIS CB C 13 28.578 0.000 . 1 . . . . A 70 HIS CB . 30977 1 694 . 1 . 1 70 70 HIS CE1 C 13 138.399 0.007 . 1 . . . . A 70 HIS CE1 . 30977 1 695 . 1 . 1 71 71 ASN H H 1 7.590 0.006 . 1 . . . . A 71 ASN H . 30977 1 696 . 1 . 1 71 71 ASN HB2 H 1 3.216 0.008 . 1 . . . . A 71 ASN HB2 . 30977 1 697 . 1 . 1 71 71 ASN HD21 H 1 7.614 0.001 . 1 . . . . A 71 ASN HD21 . 30977 1 698 . 1 . 1 71 71 ASN HD22 H 1 6.772 0.002 . 1 . . . . A 71 ASN HD22 . 30977 1 699 . 1 . 1 71 71 ASN CA C 13 52.784 0.000 . 1 . . . . A 71 ASN CA . 30977 1 700 . 1 . 1 71 71 ASN CB C 13 38.977 0.000 . 1 . . . . A 71 ASN CB . 30977 1 701 . 1 . 1 71 71 ASN N N 15 112.446 0.005 . 1 . . . . A 71 ASN N . 30977 1 702 . 1 . 1 71 71 ASN ND2 N 15 110.109 0.008 . 1 . . . . A 71 ASN ND2 . 30977 1 703 . 1 . 1 72 72 GLY H H 1 9.663 0.008 . 1 . . . . A 72 GLY H . 30977 1 704 . 1 . 1 72 72 GLY HA2 H 1 4.431 0.018 . 2 . . . . A 72 GLY HA2 . 30977 1 705 . 1 . 1 72 72 GLY HA3 H 1 3.169 0.024 . 2 . . . . A 72 GLY HA3 . 30977 1 706 . 1 . 1 72 72 GLY CA C 13 44.676 0.000 . 1 . . . . A 72 GLY CA . 30977 1 707 . 1 . 1 72 72 GLY N N 15 110.393 0.010 . 1 . . . . A 72 GLY N . 30977 1 708 . 1 . 1 73 73 THR H H 1 7.947 0.007 . 1 . . . . A 73 THR H . 30977 1 709 . 1 . 1 73 73 THR HA H 1 4.570 0.011 . 1 . . . . A 73 THR HA . 30977 1 710 . 1 . 1 73 73 THR HB H 1 4.310 0.008 . 1 . . . . A 73 THR HB . 30977 1 711 . 1 . 1 73 73 THR HG21 H 1 1.067 0.011 . 1 . . . . A 73 THR HG21 . 30977 1 712 . 1 . 1 73 73 THR HG22 H 1 1.067 0.011 . 1 . . . . A 73 THR HG22 . 30977 1 713 . 1 . 1 73 73 THR HG23 H 1 1.067 0.011 . 1 . . . . A 73 THR HG23 . 30977 1 714 . 1 . 1 73 73 THR CA C 13 62.010 0.000 . 1 . . . . A 73 THR CA . 30977 1 715 . 1 . 1 73 73 THR CB C 13 70.581 0.000 . 1 . . . . A 73 THR CB . 30977 1 716 . 1 . 1 73 73 THR CG2 C 13 21.026 0.000 . 1 . . . . A 73 THR CG2 . 30977 1 717 . 1 . 1 73 73 THR N N 15 111.973 0.014 . 1 . . . . A 73 THR N . 30977 1 718 . 1 . 1 74 74 GLY H H 1 8.708 0.005 . 1 . . . . A 74 GLY H . 30977 1 719 . 1 . 1 74 74 GLY HA2 H 1 3.514 0.009 . 2 . . . . A 74 GLY HA2 . 30977 1 720 . 1 . 1 74 74 GLY HA3 H 1 4.548 0.007 . 2 . . . . A 74 GLY HA3 . 30977 1 721 . 1 . 1 74 74 GLY CA C 13 45.282 0.000 . 1 . . . . A 74 GLY CA . 30977 1 722 . 1 . 1 74 74 GLY N N 15 113.901 0.025 . 1 . . . . A 74 GLY N . 30977 1 723 . 1 . 1 75 75 GLY H H 1 8.168 0.003 . 1 . . . . A 75 GLY H . 30977 1 724 . 1 . 1 75 75 GLY HA2 H 1 4.599 0.004 . 2 . . . . A 75 GLY HA2 . 30977 1 725 . 1 . 1 75 75 GLY HA3 H 1 4.564 0.000 . 2 . . . . A 75 GLY HA3 . 30977 1 726 . 1 . 1 75 75 GLY CA C 13 43.120 0.000 . 1 . . . . A 75 GLY CA . 30977 1 727 . 1 . 1 75 75 GLY N N 15 108.895 0.003 . 1 . . . . A 75 GLY N . 30977 1 728 . 1 . 1 76 76 LYS H H 1 7.010 0.012 . 1 . . . . A 76 LYS H . 30977 1 729 . 1 . 1 76 76 LYS HA H 1 4.684 0.018 . 1 . . . . A 76 LYS HA . 30977 1 730 . 1 . 1 76 76 LYS HB2 H 1 1.949 0.017 . 2 . . . . A 76 LYS HB2 . 30977 1 731 . 1 . 1 76 76 LYS HB3 H 1 1.584 0.016 . 2 . . . . A 76 LYS HB3 . 30977 1 732 . 1 . 1 76 76 LYS HG2 H 1 1.018 0.018 . 2 . . . . A 76 LYS HG2 . 30977 1 733 . 1 . 1 76 76 LYS HG3 H 1 0.945 0.004 . 2 . . . . A 76 LYS HG3 . 30977 1 734 . 1 . 1 76 76 LYS HD2 H 1 1.241 0.004 . 1 . . . . A 76 LYS HD2 . 30977 1 735 . 1 . 1 76 76 LYS CA C 13 55.940 0.000 . 1 . . . . A 76 LYS CA . 30977 1 736 . 1 . 1 76 76 LYS CB C 13 34.700 0.000 . 1 . . . . A 76 LYS CB . 30977 1 737 . 1 . 1 76 76 LYS CG C 13 23.447 0.000 . 1 . . . . A 76 LYS CG . 30977 1 738 . 1 . 1 76 76 LYS CD C 13 29.429 0.000 . 1 . . . . A 76 LYS CD . 30977 1 739 . 1 . 1 76 76 LYS N N 15 115.107 0.002 . 1 . . . . A 76 LYS N . 30977 1 740 . 1 . 1 77 77 SER H H 1 7.724 0.003 . 1 . . . . A 77 SER H . 30977 1 741 . 1 . 1 77 77 SER HB2 H 1 4.285 0.017 . 1 . . . . A 77 SER HB2 . 30977 1 742 . 1 . 1 77 77 SER CA C 13 57.127 0.000 . 1 . . . . A 77 SER CA . 30977 1 743 . 1 . 1 77 77 SER CB C 13 69.601 0.000 . 1 . . . . A 77 SER CB . 30977 1 744 . 1 . 1 77 77 SER N N 15 113.985 0.004 . 1 . . . . A 77 SER N . 30977 1 745 . 1 . 1 78 78 ILE H H 1 8.586 0.003 . 1 . . . . A 78 ILE H . 30977 1 746 . 1 . 1 78 78 ILE HA H 1 4.236 0.019 . 1 . . . . A 78 ILE HA . 30977 1 747 . 1 . 1 78 78 ILE HB H 1 1.743 0.003 . 1 . . . . A 78 ILE HB . 30977 1 748 . 1 . 1 78 78 ILE HG21 H 1 0.732 0.022 . 1 . . . . A 78 ILE HG21 . 30977 1 749 . 1 . 1 78 78 ILE HG22 H 1 0.732 0.022 . 1 . . . . A 78 ILE HG22 . 30977 1 750 . 1 . 1 78 78 ILE HG23 H 1 0.732 0.022 . 1 . . . . A 78 ILE HG23 . 30977 1 751 . 1 . 1 78 78 ILE HD11 H 1 0.521 0.010 . 1 . . . . A 78 ILE HD11 . 30977 1 752 . 1 . 1 78 78 ILE HD12 H 1 0.521 0.010 . 1 . . . . A 78 ILE HD12 . 30977 1 753 . 1 . 1 78 78 ILE HD13 H 1 0.521 0.010 . 1 . . . . A 78 ILE HD13 . 30977 1 754 . 1 . 1 78 78 ILE CA C 13 63.713 0.000 . 1 . . . . A 78 ILE CA . 30977 1 755 . 1 . 1 78 78 ILE CB C 13 37.518 0.000 . 1 . . . . A 78 ILE CB . 30977 1 756 . 1 . 1 78 78 ILE CG2 C 13 17.701 0.000 . 1 . . . . A 78 ILE CG2 . 30977 1 757 . 1 . 1 78 78 ILE CD1 C 13 14.258 0.000 . 1 . . . . A 78 ILE CD1 . 30977 1 758 . 1 . 1 78 78 ILE N N 15 111.203 0.010 . 1 . . . . A 78 ILE N . 30977 1 759 . 1 . 1 79 79 TYR H H 1 8.081 0.004 . 1 . . . . A 79 TYR H . 30977 1 760 . 1 . 1 79 79 TYR HA H 1 4.718 0.016 . 1 . . . . A 79 TYR HA . 30977 1 761 . 1 . 1 79 79 TYR HB2 H 1 2.357 0.016 . 2 . . . . A 79 TYR HB2 . 30977 1 762 . 1 . 1 79 79 TYR HB3 H 1 3.473 0.012 . 2 . . . . A 79 TYR HB3 . 30977 1 763 . 1 . 1 79 79 TYR HD1 H 1 6.433 0.022 . 1 . . . . A 79 TYR HD1 . 30977 1 764 . 1 . 1 79 79 TYR HD2 H 1 6.433 0.022 . 1 . . . . A 79 TYR HD2 . 30977 1 765 . 1 . 1 79 79 TYR HE1 H 1 6.120 0.009 . 1 . . . . A 79 TYR HE1 . 30977 1 766 . 1 . 1 79 79 TYR HE2 H 1 6.120 0.009 . 1 . . . . A 79 TYR HE2 . 30977 1 767 . 1 . 1 79 79 TYR CA C 13 56.252 0.000 . 1 . . . . A 79 TYR CA . 30977 1 768 . 1 . 1 79 79 TYR CB C 13 38.880 0.000 . 1 . . . . A 79 TYR CB . 30977 1 769 . 1 . 1 79 79 TYR CD1 C 13 132.607 0.083 . 1 . . . . A 79 TYR CD1 . 30977 1 770 . 1 . 1 79 79 TYR CD2 C 13 132.607 0.083 . 1 . . . . A 79 TYR CD2 . 30977 1 771 . 1 . 1 79 79 TYR CE1 C 13 117.941 0.015 . 1 . . . . A 79 TYR CE1 . 30977 1 772 . 1 . 1 79 79 TYR CE2 C 13 117.941 0.015 . 1 . . . . A 79 TYR CE2 . 30977 1 773 . 1 . 1 79 79 TYR N N 15 120.817 0.042 . 1 . . . . A 79 TYR N . 30977 1 774 . 1 . 1 80 80 GLY H H 1 7.105 0.006 . 1 . . . . A 80 GLY H . 30977 1 775 . 1 . 1 80 80 GLY HA2 H 1 3.858 0.002 . 1 . . . . A 80 GLY HA2 . 30977 1 776 . 1 . 1 80 80 GLY CA C 13 44.047 0.000 . 1 . . . . A 80 GLY CA . 30977 1 777 . 1 . 1 80 80 GLY N N 15 106.279 0.007 . 1 . . . . A 80 GLY N . 30977 1 778 . 1 . 1 81 81 GLU H H 1 9.052 0.002 . 1 . . . . A 81 GLU H . 30977 1 779 . 1 . 1 81 81 GLU HA H 1 3.953 0.012 . 1 . . . . A 81 GLU HA . 30977 1 780 . 1 . 1 81 81 GLU HB2 H 1 2.128 0.016 . 1 . . . . A 81 GLU HB2 . 30977 1 781 . 1 . 1 81 81 GLU HG2 H 1 2.312 0.010 . 2 . . . . A 81 GLU HG2 . 30977 1 782 . 1 . 1 81 81 GLU HG3 H 1 2.422 0.000 . 2 . . . . A 81 GLU HG3 . 30977 1 783 . 1 . 1 81 81 GLU CA C 13 60.820 0.000 . 1 . . . . A 81 GLU CA . 30977 1 784 . 1 . 1 81 81 GLU CB C 13 30.168 0.000 . 1 . . . . A 81 GLU CB . 30977 1 785 . 1 . 1 81 81 GLU CG C 13 36.674 0.000 . 1 . . . . A 81 GLU CG . 30977 1 786 . 1 . 1 81 81 GLU N N 15 123.764 0.014 . 1 . . . . A 81 GLU N . 30977 1 787 . 1 . 1 82 82 LYS H H 1 7.829 0.004 . 1 . . . . A 82 LYS H . 30977 1 788 . 1 . 1 82 82 LYS HA H 1 5.582 0.014 . 1 . . . . A 82 LYS HA . 30977 1 789 . 1 . 1 82 82 LYS HB2 H 1 1.698 0.018 . 2 . . . . A 82 LYS HB2 . 30977 1 790 . 1 . 1 82 82 LYS HB3 H 1 1.574 0.023 . 2 . . . . A 82 LYS HB3 . 30977 1 791 . 1 . 1 82 82 LYS HG2 H 1 1.284 0.015 . 1 . . . . A 82 LYS HG2 . 30977 1 792 . 1 . 1 82 82 LYS CA C 13 53.853 0.000 . 1 . . . . A 82 LYS CA . 30977 1 793 . 1 . 1 82 82 LYS CB C 13 36.877 0.000 . 1 . . . . A 82 LYS CB . 30977 1 794 . 1 . 1 82 82 LYS CG C 13 24.439 0.000 . 1 . . . . A 82 LYS CG . 30977 1 795 . 1 . 1 82 82 LYS CD C 13 29.424 0.000 . 1 . . . . A 82 LYS CD . 30977 1 796 . 1 . 1 82 82 LYS N N 15 111.708 0.076 . 1 . . . . A 82 LYS N . 30977 1 797 . 1 . 1 83 83 PHE H H 1 9.137 0.009 . 1 . . . . A 83 PHE H . 30977 1 798 . 1 . 1 83 83 PHE HA H 1 4.975 0.017 . 1 . . . . A 83 PHE HA . 30977 1 799 . 1 . 1 83 83 PHE HB2 H 1 3.047 0.014 . 1 . . . . A 83 PHE HB2 . 30977 1 800 . 1 . 1 83 83 PHE HD1 H 1 7.380 0.018 . 1 . . . . A 83 PHE HD1 . 30977 1 801 . 1 . 1 83 83 PHE HD2 H 1 7.380 0.018 . 1 . . . . A 83 PHE HD2 . 30977 1 802 . 1 . 1 83 83 PHE HE1 H 1 7.552 0.012 . 1 . . . . A 83 PHE HE1 . 30977 1 803 . 1 . 1 83 83 PHE HE2 H 1 7.552 0.012 . 1 . . . . A 83 PHE HE2 . 30977 1 804 . 1 . 1 83 83 PHE CA C 13 55.956 0.000 . 1 . . . . A 83 PHE CA . 30977 1 805 . 1 . 1 83 83 PHE CB C 13 41.399 0.000 . 1 . . . . A 83 PHE CB . 30977 1 806 . 1 . 1 83 83 PHE CD1 C 13 134.534 0.022 . 1 . . . . A 83 PHE CD1 . 30977 1 807 . 1 . 1 83 83 PHE CD2 C 13 134.534 0.022 . 1 . . . . A 83 PHE CD2 . 30977 1 808 . 1 . 1 83 83 PHE CE1 C 13 130.966 0.032 . 1 . . . . A 83 PHE CE1 . 30977 1 809 . 1 . 1 83 83 PHE CE2 C 13 130.966 0.032 . 1 . . . . A 83 PHE CE2 . 30977 1 810 . 1 . 1 83 83 PHE N N 15 116.287 0.017 . 1 . . . . A 83 PHE N . 30977 1 811 . 1 . 1 84 84 GLU H H 1 9.309 0.002 . 1 . . . . A 84 GLU H . 30977 1 812 . 1 . 1 84 84 GLU HA H 1 3.818 0.018 . 1 . . . . A 84 GLU HA . 30977 1 813 . 1 . 1 84 84 GLU HB2 H 1 1.878 0.012 . 2 . . . . A 84 GLU HB2 . 30977 1 814 . 1 . 1 84 84 GLU HB3 H 1 2.075 0.011 . 2 . . . . A 84 GLU HB3 . 30977 1 815 . 1 . 1 84 84 GLU HG2 H 1 2.114 0.003 . 2 . . . . A 84 GLU HG2 . 30977 1 816 . 1 . 1 84 84 GLU HG3 H 1 2.326 0.008 . 2 . . . . A 84 GLU HG3 . 30977 1 817 . 1 . 1 84 84 GLU CA C 13 56.466 0.000 . 1 . . . . A 84 GLU CA . 30977 1 818 . 1 . 1 84 84 GLU CB C 13 29.312 0.000 . 1 . . . . A 84 GLU CB . 30977 1 819 . 1 . 1 84 84 GLU CG C 13 35.425 0.000 . 1 . . . . A 84 GLU CG . 30977 1 820 . 1 . 1 84 84 GLU N N 15 119.514 0.023 . 1 . . . . A 84 GLU N . 30977 1 821 . 1 . 1 85 85 ASP H H 1 8.630 0.005 . 1 . . . . A 85 ASP H . 30977 1 822 . 1 . 1 85 85 ASP HA H 1 4.262 0.016 . 1 . . . . A 85 ASP HA . 30977 1 823 . 1 . 1 85 85 ASP HB2 H 1 2.445 0.007 . 2 . . . . A 85 ASP HB2 . 30977 1 824 . 1 . 1 85 85 ASP HB3 H 1 1.992 0.022 . 2 . . . . A 85 ASP HB3 . 30977 1 825 . 1 . 1 85 85 ASP CA C 13 54.375 0.000 . 1 . . . . A 85 ASP CA . 30977 1 826 . 1 . 1 85 85 ASP CB C 13 41.076 0.000 . 1 . . . . A 85 ASP CB . 30977 1 827 . 1 . 1 85 85 ASP N N 15 118.714 0.005 . 1 . . . . A 85 ASP N . 30977 1 828 . 1 . 1 86 86 GLU H H 1 9.482 0.003 . 1 . . . . A 86 GLU H . 30977 1 829 . 1 . 1 86 86 GLU HA H 1 3.851 0.010 . 1 . . . . A 86 GLU HA . 30977 1 830 . 1 . 1 86 86 GLU HB2 H 1 1.883 0.012 . 2 . . . . A 86 GLU HB2 . 30977 1 831 . 1 . 1 86 86 GLU HB3 H 1 2.157 0.019 . 2 . . . . A 86 GLU HB3 . 30977 1 832 . 1 . 1 86 86 GLU HG2 H 1 2.407 0.008 . 1 . . . . A 86 GLU HG2 . 30977 1 833 . 1 . 1 86 86 GLU CA C 13 60.357 0.000 . 1 . . . . A 86 GLU CA . 30977 1 834 . 1 . 1 86 86 GLU CB C 13 31.953 0.000 . 1 . . . . A 86 GLU CB . 30977 1 835 . 1 . 1 86 86 GLU CG C 13 35.266 0.000 . 1 . . . . A 86 GLU CG . 30977 1 836 . 1 . 1 86 86 GLU N N 15 131.590 0.013 . 1 . . . . A 86 GLU N . 30977 1 837 . 1 . 1 87 87 ASN H H 1 7.046 0.003 . 1 . . . . A 87 ASN H . 30977 1 838 . 1 . 1 87 87 ASN HA H 1 4.194 0.022 . 1 . . . . A 87 ASN HA . 30977 1 839 . 1 . 1 87 87 ASN HB2 H 1 2.775 0.010 . 2 . . . . A 87 ASN HB2 . 30977 1 840 . 1 . 1 87 87 ASN HB3 H 1 3.495 0.013 . 2 . . . . A 87 ASN HB3 . 30977 1 841 . 1 . 1 87 87 ASN HD21 H 1 6.873 0.003 . 1 . . . . A 87 ASN HD21 . 30977 1 842 . 1 . 1 87 87 ASN HD22 H 1 8.009 0.002 . 1 . . . . A 87 ASN HD22 . 30977 1 843 . 1 . 1 87 87 ASN CA C 13 52.848 0.000 . 1 . . . . A 87 ASN CA . 30977 1 844 . 1 . 1 87 87 ASN CB C 13 39.597 0.000 . 1 . . . . A 87 ASN CB . 30977 1 845 . 1 . 1 87 87 ASN N N 15 106.686 0.013 . 1 . . . . A 87 ASN N . 30977 1 846 . 1 . 1 87 87 ASN ND2 N 15 116.930 0.004 . 1 . . . . A 87 ASN ND2 . 30977 1 847 . 1 . 1 88 88 PHE H H 1 8.371 0.003 . 1 . . . . A 88 PHE H . 30977 1 848 . 1 . 1 88 88 PHE HA H 1 5.956 0.016 . 1 . . . . A 88 PHE HA . 30977 1 849 . 1 . 1 88 88 PHE HB2 H 1 3.551 0.026 . 2 . . . . A 88 PHE HB2 . 30977 1 850 . 1 . 1 88 88 PHE HB3 H 1 2.561 0.025 . 2 . . . . A 88 PHE HB3 . 30977 1 851 . 1 . 1 88 88 PHE HD1 H 1 7.285 0.006 . 1 . . . . A 88 PHE HD1 . 30977 1 852 . 1 . 1 88 88 PHE HD2 H 1 7.285 0.006 . 1 . . . . A 88 PHE HD2 . 30977 1 853 . 1 . 1 88 88 PHE HE1 H 1 6.892 0.021 . 1 . . . . A 88 PHE HE1 . 30977 1 854 . 1 . 1 88 88 PHE HE2 H 1 6.892 0.021 . 1 . . . . A 88 PHE HE2 . 30977 1 855 . 1 . 1 88 88 PHE CA C 13 56.139 0.000 . 1 . . . . A 88 PHE CA . 30977 1 856 . 1 . 1 88 88 PHE CB C 13 38.972 0.000 . 1 . . . . A 88 PHE CB . 30977 1 857 . 1 . 1 88 88 PHE CD1 C 13 132.126 0.055 . 1 . . . . A 88 PHE CD1 . 30977 1 858 . 1 . 1 88 88 PHE CD2 C 13 132.126 0.055 . 1 . . . . A 88 PHE CD2 . 30977 1 859 . 1 . 1 88 88 PHE CE1 C 13 130.620 0.053 . 1 . . . . A 88 PHE CE1 . 30977 1 860 . 1 . 1 88 88 PHE CE2 C 13 130.620 0.053 . 1 . . . . A 88 PHE CE2 . 30977 1 861 . 1 . 1 88 88 PHE N N 15 112.955 0.036 . 1 . . . . A 88 PHE N . 30977 1 862 . 1 . 1 89 89 ILE H H 1 8.319 0.008 . 1 . . . . A 89 ILE H . 30977 1 863 . 1 . 1 89 89 ILE HA H 1 3.717 0.014 . 1 . . . . A 89 ILE HA . 30977 1 864 . 1 . 1 89 89 ILE HB H 1 1.592 0.013 . 1 . . . . A 89 ILE HB . 30977 1 865 . 1 . 1 89 89 ILE HG12 H 1 1.193 0.011 . 2 . . . . A 89 ILE HG12 . 30977 1 866 . 1 . 1 89 89 ILE HG13 H 1 1.536 0.001 . 2 . . . . A 89 ILE HG13 . 30977 1 867 . 1 . 1 89 89 ILE HG21 H 1 0.908 0.001 . 1 . . . . A 89 ILE HG21 . 30977 1 868 . 1 . 1 89 89 ILE HG22 H 1 0.908 0.001 . 1 . . . . A 89 ILE HG22 . 30977 1 869 . 1 . 1 89 89 ILE HG23 H 1 0.908 0.001 . 1 . . . . A 89 ILE HG23 . 30977 1 870 . 1 . 1 89 89 ILE HD11 H 1 0.928 0.027 . 1 . . . . A 89 ILE HD11 . 30977 1 871 . 1 . 1 89 89 ILE HD12 H 1 0.928 0.027 . 1 . . . . A 89 ILE HD12 . 30977 1 872 . 1 . 1 89 89 ILE HD13 H 1 0.928 0.027 . 1 . . . . A 89 ILE HD13 . 30977 1 873 . 1 . 1 89 89 ILE CA C 13 65.113 0.000 . 1 . . . . A 89 ILE CA . 30977 1 874 . 1 . 1 89 89 ILE CB C 13 39.172 0.000 . 1 . . . . A 89 ILE CB . 30977 1 875 . 1 . 1 89 89 ILE CG1 C 13 29.519 0.000 . 1 . . . . A 89 ILE CG1 . 30977 1 876 . 1 . 1 89 89 ILE CG2 C 13 17.121 0.000 . 1 . . . . A 89 ILE CG2 . 30977 1 877 . 1 . 1 89 89 ILE CD1 C 13 13.755 0.064 . 1 . . . . A 89 ILE CD1 . 30977 1 878 . 1 . 1 89 89 ILE N N 15 119.636 0.025 . 1 . . . . A 89 ILE N . 30977 1 879 . 1 . 1 90 90 LEU H H 1 7.694 0.003 . 1 . . . . A 90 LEU H . 30977 1 880 . 1 . 1 90 90 LEU HA H 1 4.527 0.008 . 1 . . . . A 90 LEU HA . 30977 1 881 . 1 . 1 90 90 LEU HB2 H 1 1.862 0.016 . 2 . . . . A 90 LEU HB2 . 30977 1 882 . 1 . 1 90 90 LEU HB3 H 1 1.451 0.022 . 2 . . . . A 90 LEU HB3 . 30977 1 883 . 1 . 1 90 90 LEU HG H 1 0.814 0.008 . 1 . . . . A 90 LEU HG . 30977 1 884 . 1 . 1 90 90 LEU CA C 13 54.161 0.000 . 1 . . . . A 90 LEU CA . 30977 1 885 . 1 . 1 90 90 LEU CB C 13 42.338 0.000 . 1 . . . . A 90 LEU CB . 30977 1 886 . 1 . 1 90 90 LEU CG C 13 27.079 0.000 . 1 . . . . A 90 LEU CG . 30977 1 887 . 1 . 1 90 90 LEU N N 15 117.017 0.041 . 1 . . . . A 90 LEU N . 30977 1 888 . 1 . 1 91 91 LYS H H 1 8.207 0.008 . 1 . . . . A 91 LYS H . 30977 1 889 . 1 . 1 91 91 LYS HA H 1 4.756 0.032 . 1 . . . . A 91 LYS HA . 30977 1 890 . 1 . 1 91 91 LYS HB2 H 1 1.618 0.018 . 2 . . . . A 91 LYS HB2 . 30977 1 891 . 1 . 1 91 91 LYS HB3 H 1 2.278 0.012 . 2 . . . . A 91 LYS HB3 . 30977 1 892 . 1 . 1 91 91 LYS HG2 H 1 1.558 0.000 . 2 . . . . A 91 LYS HG2 . 30977 1 893 . 1 . 1 91 91 LYS HG3 H 1 1.418 0.002 . 2 . . . . A 91 LYS HG3 . 30977 1 894 . 1 . 1 91 91 LYS CA C 13 54.556 0.000 . 1 . . . . A 91 LYS CA . 30977 1 895 . 1 . 1 91 91 LYS CB C 13 34.844 0.000 . 1 . . . . A 91 LYS CB . 30977 1 896 . 1 . 1 91 91 LYS CG C 13 26.122 0.000 . 1 . . . . A 91 LYS CG . 30977 1 897 . 1 . 1 91 91 LYS CD C 13 28.572 0.000 . 1 . . . . A 91 LYS CD . 30977 1 898 . 1 . 1 91 91 LYS N N 15 119.004 0.005 . 1 . . . . A 91 LYS N . 30977 1 899 . 1 . 1 92 92 HIS H H 1 10.710 0.003 . 1 . . . . A 92 HIS H . 30977 1 900 . 1 . 1 92 92 HIS HA H 1 4.429 0.032 . 1 . . . . A 92 HIS HA . 30977 1 901 . 1 . 1 92 92 HIS HB2 H 1 3.338 0.023 . 2 . . . . A 92 HIS HB2 . 30977 1 902 . 1 . 1 92 92 HIS HB3 H 1 3.022 0.024 . 2 . . . . A 92 HIS HB3 . 30977 1 903 . 1 . 1 92 92 HIS HD1 H 1 12.340 0.020 . 1 . . . . A 92 HIS HD1 . 30977 1 904 . 1 . 1 92 92 HIS HD2 H 1 6.734 0.003 . 1 . . . . A 92 HIS HD2 . 30977 1 905 . 1 . 1 92 92 HIS HE1 H 1 8.043 0.015 . 1 . . . . A 92 HIS HE1 . 30977 1 906 . 1 . 1 92 92 HIS CA C 13 56.662 0.000 . 1 . . . . A 92 HIS CA . 30977 1 907 . 1 . 1 92 92 HIS CB C 13 26.089 0.000 . 1 . . . . A 92 HIS CB . 30977 1 908 . 1 . 1 92 92 HIS CD2 C 13 118.423 0.046 . 1 . . . . A 92 HIS CD2 . 30977 1 909 . 1 . 1 92 92 HIS CE1 C 13 139.787 0.016 . 1 . . . . A 92 HIS CE1 . 30977 1 910 . 1 . 1 92 92 HIS N N 15 122.467 0.015 . 1 . . . . A 92 HIS N . 30977 1 911 . 1 . 1 92 92 HIS ND1 N 15 169.305 0.000 . 1 . . . . A 92 HIS ND1 . 30977 1 912 . 1 . 1 93 93 THR H H 1 7.356 0.009 . 1 . . . . A 93 THR H . 30977 1 913 . 1 . 1 93 93 THR HA H 1 4.051 0.014 . 1 . . . . A 93 THR HA . 30977 1 914 . 1 . 1 93 93 THR HB H 1 4.513 0.000 . 1 . . . . A 93 THR HB . 30977 1 915 . 1 . 1 93 93 THR HG21 H 1 1.287 0.022 . 1 . . . . A 93 THR HG21 . 30977 1 916 . 1 . 1 93 93 THR HG22 H 1 1.287 0.022 . 1 . . . . A 93 THR HG22 . 30977 1 917 . 1 . 1 93 93 THR HG23 H 1 1.287 0.022 . 1 . . . . A 93 THR HG23 . 30977 1 918 . 1 . 1 93 93 THR CA C 13 63.502 0.000 . 1 . . . . A 93 THR CA . 30977 1 919 . 1 . 1 93 93 THR CB C 13 69.560 0.000 . 1 . . . . A 93 THR CB . 30977 1 920 . 1 . 1 93 93 THR CG2 C 13 22.826 0.000 . 1 . . . . A 93 THR CG2 . 30977 1 921 . 1 . 1 93 93 THR N N 15 110.574 0.035 . 1 . . . . A 93 THR N . 30977 1 922 . 1 . 1 94 94 GLY H H 1 7.544 0.005 . 1 . . . . A 94 GLY H . 30977 1 923 . 1 . 1 94 94 GLY CA C 13 45.809 0.000 . 1 . . . . A 94 GLY CA . 30977 1 924 . 1 . 1 94 94 GLY N N 15 107.257 0.009 . 1 . . . . A 94 GLY N . 30977 1 925 . 1 . 1 95 95 PRO HA H 1 3.891 0.011 . 1 . . . . A 95 PRO HA . 30977 1 926 . 1 . 1 95 95 PRO HB2 H 1 2.079 0.016 . 2 . . . . A 95 PRO HB2 . 30977 1 927 . 1 . 1 95 95 PRO HB3 H 1 1.884 0.015 . 2 . . . . A 95 PRO HB3 . 30977 1 928 . 1 . 1 95 95 PRO HD2 H 1 3.451 0.011 . 2 . . . . A 95 PRO HD2 . 30977 1 929 . 1 . 1 95 95 PRO HD3 H 1 3.679 0.020 . 2 . . . . A 95 PRO HD3 . 30977 1 930 . 1 . 1 95 95 PRO CA C 13 62.890 0.000 . 1 . . . . A 95 PRO CA . 30977 1 931 . 1 . 1 95 95 PRO CB C 13 32.166 0.000 . 1 . . . . A 95 PRO CB . 30977 1 932 . 1 . 1 95 95 PRO CG C 13 27.807 0.000 . 1 . . . . A 95 PRO CG . 30977 1 933 . 1 . 1 95 95 PRO CD C 13 49.845 0.007 . 1 . . . . A 95 PRO CD . 30977 1 934 . 1 . 1 96 96 GLY H H 1 9.315 0.004 . 1 . . . . A 96 GLY H . 30977 1 935 . 1 . 1 96 96 GLY HA2 H 1 3.389 0.000 . 2 . . . . A 96 GLY HA2 . 30977 1 936 . 1 . 1 96 96 GLY HA3 H 1 4.369 0.274 . 2 . . . . A 96 GLY HA3 . 30977 1 937 . 1 . 1 96 96 GLY CA C 13 45.057 0.000 . 1 . . . . A 96 GLY CA . 30977 1 938 . 1 . 1 96 96 GLY N N 15 109.952 0.038 . 1 . . . . A 96 GLY N . 30977 1 939 . 1 . 1 97 97 ILE H H 1 6.816 0.014 . 1 . . . . A 97 ILE H . 30977 1 940 . 1 . 1 97 97 ILE HA H 1 4.195 0.008 . 1 . . . . A 97 ILE HA . 30977 1 941 . 1 . 1 97 97 ILE HB H 1 2.295 0.015 . 1 . . . . A 97 ILE HB . 30977 1 942 . 1 . 1 97 97 ILE HG12 H 1 1.691 0.020 . 1 . . . . A 97 ILE HG12 . 30977 1 943 . 1 . 1 97 97 ILE HG21 H 1 1.049 0.018 . 1 . . . . A 97 ILE HG21 . 30977 1 944 . 1 . 1 97 97 ILE HG22 H 1 1.049 0.018 . 1 . . . . A 97 ILE HG22 . 30977 1 945 . 1 . 1 97 97 ILE HG23 H 1 1.049 0.018 . 1 . . . . A 97 ILE HG23 . 30977 1 946 . 1 . 1 97 97 ILE HD11 H 1 1.029 0.003 . 1 . . . . A 97 ILE HD11 . 30977 1 947 . 1 . 1 97 97 ILE HD12 H 1 1.029 0.003 . 1 . . . . A 97 ILE HD12 . 30977 1 948 . 1 . 1 97 97 ILE HD13 H 1 1.029 0.003 . 1 . . . . A 97 ILE HD13 . 30977 1 949 . 1 . 1 97 97 ILE CA C 13 59.567 0.000 . 1 . . . . A 97 ILE CA . 30977 1 950 . 1 . 1 97 97 ILE CB C 13 38.061 0.000 . 1 . . . . A 97 ILE CB . 30977 1 951 . 1 . 1 97 97 ILE CG1 C 13 28.930 0.000 . 1 . . . . A 97 ILE CG1 . 30977 1 952 . 1 . 1 97 97 ILE CG2 C 13 20.412 0.000 . 1 . . . . A 97 ILE CG2 . 30977 1 953 . 1 . 1 97 97 ILE CD1 C 13 9.085 0.000 . 1 . . . . A 97 ILE CD1 . 30977 1 954 . 1 . 1 97 97 ILE N N 15 121.434 0.018 . 1 . . . . A 97 ILE N . 30977 1 955 . 1 . 1 98 98 LEU H H 1 7.946 0.015 . 1 . . . . A 98 LEU H . 30977 1 956 . 1 . 1 98 98 LEU HA H 1 5.171 0.022 . 1 . . . . A 98 LEU HA . 30977 1 957 . 1 . 1 98 98 LEU HB2 H 1 0.152 0.008 . 2 . . . . A 98 LEU HB2 . 30977 1 958 . 1 . 1 98 98 LEU HB3 H 1 0.166 0.005 . 2 . . . . A 98 LEU HB3 . 30977 1 959 . 1 . 1 98 98 LEU HD11 H 1 -0.137 0.024 . 2 . . . . A 98 LEU HD11 . 30977 1 960 . 1 . 1 98 98 LEU HD12 H 1 -0.137 0.024 . 2 . . . . A 98 LEU HD12 . 30977 1 961 . 1 . 1 98 98 LEU HD13 H 1 -0.137 0.024 . 2 . . . . A 98 LEU HD13 . 30977 1 962 . 1 . 1 98 98 LEU HD21 H 1 -0.445 0.016 . 2 . . . . A 98 LEU HD21 . 30977 1 963 . 1 . 1 98 98 LEU HD22 H 1 -0.445 0.016 . 2 . . . . A 98 LEU HD22 . 30977 1 964 . 1 . 1 98 98 LEU HD23 H 1 -0.445 0.016 . 2 . . . . A 98 LEU HD23 . 30977 1 965 . 1 . 1 98 98 LEU CA C 13 53.348 0.000 . 1 . . . . A 98 LEU CA . 30977 1 966 . 1 . 1 98 98 LEU CB C 13 43.646 0.000 . 1 . . . . A 98 LEU CB . 30977 1 967 . 1 . 1 98 98 LEU CD1 C 13 24.358 0.003 . 2 . . . . A 98 LEU CD1 . 30977 1 968 . 1 . 1 98 98 LEU CD2 C 13 25.142 0.000 . 2 . . . . A 98 LEU CD2 . 30977 1 969 . 1 . 1 98 98 LEU N N 15 128.207 0.013 . 1 . . . . A 98 LEU N . 30977 1 970 . 1 . 1 99 99 SER H H 1 8.423 0.003 . 1 . . . . A 99 SER H . 30977 1 971 . 1 . 1 99 99 SER HA H 1 5.408 0.016 . 1 . . . . A 99 SER HA . 30977 1 972 . 1 . 1 99 99 SER HB2 H 1 3.274 0.018 . 2 . . . . A 99 SER HB2 . 30977 1 973 . 1 . 1 99 99 SER HB3 H 1 3.498 0.019 . 2 . . . . A 99 SER HB3 . 30977 1 974 . 1 . 1 99 99 SER CA C 13 55.616 0.000 . 1 . . . . A 99 SER CA . 30977 1 975 . 1 . 1 99 99 SER CB C 13 66.014 0.000 . 1 . . . . A 99 SER CB . 30977 1 976 . 1 . 1 99 99 SER N N 15 117.920 0.035 . 1 . . . . A 99 SER N . 30977 1 977 . 1 . 1 100 100 MET H H 1 8.592 0.010 . 1 . . . . A 100 MET H . 30977 1 978 . 1 . 1 100 100 MET HA H 1 5.236 0.024 . 1 . . . . A 100 MET HA . 30977 1 979 . 1 . 1 100 100 MET HE1 H 1 2.093 0.013 . 1 . . . . A 100 MET HE1 . 30977 1 980 . 1 . 1 100 100 MET HE2 H 1 2.093 0.013 . 1 . . . . A 100 MET HE2 . 30977 1 981 . 1 . 1 100 100 MET HE3 H 1 2.093 0.013 . 1 . . . . A 100 MET HE3 . 30977 1 982 . 1 . 1 100 100 MET CA C 13 54.001 0.000 . 1 . . . . A 100 MET CA . 30977 1 983 . 1 . 1 100 100 MET CB C 13 32.222 0.000 . 1 . . . . A 100 MET CB . 30977 1 984 . 1 . 1 100 100 MET CE C 13 16.294 0.000 . 1 . . . . A 100 MET CE . 30977 1 985 . 1 . 1 100 100 MET N N 15 122.571 0.016 . 1 . . . . A 100 MET N . 30977 1 986 . 1 . 1 101 101 ALA H H 1 7.933 0.002 . 1 . . . . A 101 ALA H . 30977 1 987 . 1 . 1 101 101 ALA HA H 1 4.015 0.015 . 1 . . . . A 101 ALA HA . 30977 1 988 . 1 . 1 101 101 ALA HB1 H 1 1.031 0.027 . 1 . . . . A 101 ALA HB1 . 30977 1 989 . 1 . 1 101 101 ALA HB2 H 1 1.031 0.027 . 1 . . . . A 101 ALA HB2 . 30977 1 990 . 1 . 1 101 101 ALA HB3 H 1 1.031 0.027 . 1 . . . . A 101 ALA HB3 . 30977 1 991 . 1 . 1 101 101 ALA CA C 13 51.366 0.000 . 1 . . . . A 101 ALA CA . 30977 1 992 . 1 . 1 101 101 ALA CB C 13 19.763 0.000 . 1 . . . . A 101 ALA CB . 30977 1 993 . 1 . 1 101 101 ALA N N 15 125.812 0.014 . 1 . . . . A 101 ALA N . 30977 1 994 . 1 . 1 102 102 ASN H H 1 8.011 0.008 . 1 . . . . A 102 ASN H . 30977 1 995 . 1 . 1 102 102 ASN HA H 1 4.602 0.020 . 1 . . . . A 102 ASN HA . 30977 1 996 . 1 . 1 102 102 ASN HB2 H 1 2.904 0.010 . 2 . . . . A 102 ASN HB2 . 30977 1 997 . 1 . 1 102 102 ASN HB3 H 1 3.270 0.021 . 2 . . . . A 102 ASN HB3 . 30977 1 998 . 1 . 1 102 102 ASN HD21 H 1 6.218 0.001 . 1 . . . . A 102 ASN HD21 . 30977 1 999 . 1 . 1 102 102 ASN HD22 H 1 7.801 0.004 . 1 . . . . A 102 ASN HD22 . 30977 1 1000 . 1 . 1 102 102 ASN CA C 13 54.303 0.000 . 1 . . . . A 102 ASN CA . 30977 1 1001 . 1 . 1 102 102 ASN CB C 13 40.641 0.000 . 1 . . . . A 102 ASN CB . 30977 1 1002 . 1 . 1 102 102 ASN N N 15 112.923 0.003 . 1 . . . . A 102 ASN N . 30977 1 1003 . 1 . 1 102 102 ASN ND2 N 15 119.969 0.021 . 1 . . . . A 102 ASN ND2 . 30977 1 1004 . 1 . 1 103 103 ALA H H 1 8.802 0.004 . 1 . . . . A 103 ALA H . 30977 1 1005 . 1 . 1 103 103 ALA HA H 1 4.823 0.022 . 1 . . . . A 103 ALA HA . 30977 1 1006 . 1 . 1 103 103 ALA HB1 H 1 1.338 0.011 . 1 . . . . A 103 ALA HB1 . 30977 1 1007 . 1 . 1 103 103 ALA HB2 H 1 1.338 0.011 . 1 . . . . A 103 ALA HB2 . 30977 1 1008 . 1 . 1 103 103 ALA HB3 H 1 1.338 0.011 . 1 . . . . A 103 ALA HB3 . 30977 1 1009 . 1 . 1 103 103 ALA CA C 13 50.439 0.000 . 1 . . . . A 103 ALA CA . 30977 1 1010 . 1 . 1 103 103 ALA CB C 13 19.395 0.000 . 1 . . . . A 103 ALA CB . 30977 1 1011 . 1 . 1 103 103 ALA N N 15 123.303 0.006 . 1 . . . . A 103 ALA N . 30977 1 1012 . 1 . 1 104 104 GLY H H 1 8.142 0.008 . 1 . . . . A 104 GLY H . 30977 1 1013 . 1 . 1 104 104 GLY HA2 H 1 3.756 0.001 . 2 . . . . A 104 GLY HA2 . 30977 1 1014 . 1 . 1 104 104 GLY HA3 H 1 4.647 0.001 . 2 . . . . A 104 GLY HA3 . 30977 1 1015 . 1 . 1 104 104 GLY CA C 13 43.467 0.043 . 1 . . . . A 104 GLY CA . 30977 1 1016 . 1 . 1 104 104 GLY N N 15 109.067 0.026 . 1 . . . . A 104 GLY N . 30977 1 1017 . 1 . 1 105 105 PRO HA H 1 4.380 0.026 . 1 . . . . A 105 PRO HA . 30977 1 1018 . 1 . 1 105 105 PRO HB2 H 1 2.373 0.008 . 2 . . . . A 105 PRO HB2 . 30977 1 1019 . 1 . 1 105 105 PRO HB3 H 1 1.858 0.008 . 2 . . . . A 105 PRO HB3 . 30977 1 1020 . 1 . 1 105 105 PRO HG2 H 1 2.183 0.000 . 1 . . . . A 105 PRO HG2 . 30977 1 1021 . 1 . 1 105 105 PRO HD2 H 1 3.557 0.013 . 2 . . . . A 105 PRO HD2 . 30977 1 1022 . 1 . 1 105 105 PRO HD3 H 1 3.644 0.018 . 2 . . . . A 105 PRO HD3 . 30977 1 1023 . 1 . 1 105 105 PRO CA C 13 63.951 0.000 . 1 . . . . A 105 PRO CA . 30977 1 1024 . 1 . 1 105 105 PRO CB C 13 32.116 0.000 . 1 . . . . A 105 PRO CB . 30977 1 1025 . 1 . 1 105 105 PRO CG C 13 27.903 0.000 . 1 . . . . A 105 PRO CG . 30977 1 1026 . 1 . 1 105 105 PRO CD C 13 49.356 0.083 . 1 . . . . A 105 PRO CD . 30977 1 1027 . 1 . 1 106 106 ASN H H 1 8.874 0.005 . 1 . . . . A 106 ASN H . 30977 1 1028 . 1 . 1 106 106 ASN HA H 1 4.030 0.009 . 1 . . . . A 106 ASN HA . 30977 1 1029 . 1 . 1 106 106 ASN HB2 H 1 3.120 0.009 . 2 . . . . A 106 ASN HB2 . 30977 1 1030 . 1 . 1 106 106 ASN HB3 H 1 2.705 0.012 . 2 . . . . A 106 ASN HB3 . 30977 1 1031 . 1 . 1 106 106 ASN HD21 H 1 7.779 0.002 . 1 . . . . A 106 ASN HD21 . 30977 1 1032 . 1 . 1 106 106 ASN HD22 H 1 7.142 0.001 . 1 . . . . A 106 ASN HD22 . 30977 1 1033 . 1 . 1 106 106 ASN CA C 13 54.211 0.000 . 1 . . . . A 106 ASN CA . 30977 1 1034 . 1 . 1 106 106 ASN CB C 13 37.229 0.000 . 1 . . . . A 106 ASN CB . 30977 1 1035 . 1 . 1 106 106 ASN N N 15 118.972 0.017 . 1 . . . . A 106 ASN N . 30977 1 1036 . 1 . 1 106 106 ASN ND2 N 15 116.269 0.004 . 1 . . . . A 106 ASN ND2 . 30977 1 1037 . 1 . 1 107 107 THR H H 1 10.191 0.006 . 1 . . . . A 107 THR H . 30977 1 1038 . 1 . 1 107 107 THR HA H 1 4.461 0.011 . 1 . . . . A 107 THR HA . 30977 1 1039 . 1 . 1 107 107 THR HG21 H 1 0.926 0.004 . 1 . . . . A 107 THR HG21 . 30977 1 1040 . 1 . 1 107 107 THR HG22 H 1 0.926 0.004 . 1 . . . . A 107 THR HG22 . 30977 1 1041 . 1 . 1 107 107 THR HG23 H 1 0.926 0.004 . 1 . . . . A 107 THR HG23 . 30977 1 1042 . 1 . 1 107 107 THR CA C 13 60.290 0.000 . 1 . . . . A 107 THR CA . 30977 1 1043 . 1 . 1 107 107 THR CB C 13 68.879 0.000 . 1 . . . . A 107 THR CB . 30977 1 1044 . 1 . 1 107 107 THR CG2 C 13 21.289 0.000 . 1 . . . . A 107 THR CG2 . 30977 1 1045 . 1 . 1 107 107 THR N N 15 110.132 0.003 . 1 . . . . A 107 THR N . 30977 1 1046 . 1 . 1 108 108 ASN H H 1 7.405 0.006 . 1 . . . . A 108 ASN H . 30977 1 1047 . 1 . 1 108 108 ASN HA H 1 4.235 0.014 . 1 . . . . A 108 ASN HA . 30977 1 1048 . 1 . 1 108 108 ASN HB2 H 1 0.936 0.025 . 2 . . . . A 108 ASN HB2 . 30977 1 1049 . 1 . 1 108 108 ASN HB3 H 1 1.580 0.015 . 2 . . . . A 108 ASN HB3 . 30977 1 1050 . 1 . 1 108 108 ASN HD21 H 1 7.065 0.002 . 1 . . . . A 108 ASN HD21 . 30977 1 1051 . 1 . 1 108 108 ASN HD22 H 1 6.874 0.001 . 1 . . . . A 108 ASN HD22 . 30977 1 1052 . 1 . 1 108 108 ASN CA C 13 55.768 0.000 . 1 . . . . A 108 ASN CA . 30977 1 1053 . 1 . 1 108 108 ASN CB C 13 40.038 0.000 . 1 . . . . A 108 ASN CB . 30977 1 1054 . 1 . 1 108 108 ASN N N 15 120.539 0.026 . 1 . . . . A 108 ASN N . 30977 1 1055 . 1 . 1 108 108 ASN ND2 N 15 109.156 0.046 . 1 . . . . A 108 ASN ND2 . 30977 1 1056 . 1 . 1 109 109 GLY H H 1 9.173 0.013 . 1 . . . . A 109 GLY H . 30977 1 1057 . 1 . 1 109 109 GLY HA2 H 1 4.620 0.012 . 2 . . . . A 109 GLY HA2 . 30977 1 1058 . 1 . 1 109 109 GLY HA3 H 1 3.659 0.016 . 2 . . . . A 109 GLY HA3 . 30977 1 1059 . 1 . 1 109 109 GLY CA C 13 45.959 0.000 . 1 . . . . A 109 GLY CA . 30977 1 1060 . 1 . 1 109 109 GLY N N 15 110.622 0.018 . 1 . . . . A 109 GLY N . 30977 1 1061 . 1 . 1 110 110 SER H H 1 8.796 0.003 . 1 . . . . A 110 SER H . 30977 1 1062 . 1 . 1 110 110 SER HB2 H 1 4.648 0.020 . 2 . . . . A 110 SER HB2 . 30977 1 1063 . 1 . 1 110 110 SER HB3 H 1 4.441 0.010 . 2 . . . . A 110 SER HB3 . 30977 1 1064 . 1 . 1 110 110 SER CA C 13 57.670 0.000 . 1 . . . . A 110 SER CA . 30977 1 1065 . 1 . 1 110 110 SER CB C 13 66.200 0.000 . 1 . . . . A 110 SER CB . 30977 1 1066 . 1 . 1 110 110 SER N N 15 117.007 0.021 . 1 . . . . A 110 SER N . 30977 1 1067 . 1 . 1 111 111 GLN H H 1 8.434 0.005 . 1 . . . . A 111 GLN H . 30977 1 1068 . 1 . 1 111 111 GLN HA H 1 5.172 0.013 . 1 . . . . A 111 GLN HA . 30977 1 1069 . 1 . 1 111 111 GLN HE21 H 1 7.458 0.003 . 1 . . . . A 111 GLN HE21 . 30977 1 1070 . 1 . 1 111 111 GLN HE22 H 1 6.137 0.002 . 1 . . . . A 111 GLN HE22 . 30977 1 1071 . 1 . 1 111 111 GLN CA C 13 57.660 0.000 . 1 . . . . A 111 GLN CA . 30977 1 1072 . 1 . 1 111 111 GLN CB C 13 31.962 0.000 . 1 . . . . A 111 GLN CB . 30977 1 1073 . 1 . 1 111 111 GLN CG C 13 35.364 0.000 . 1 . . . . A 111 GLN CG . 30977 1 1074 . 1 . 1 111 111 GLN N N 15 124.597 0.032 . 1 . . . . A 111 GLN N . 30977 1 1075 . 1 . 1 111 111 GLN NE2 N 15 111.402 0.020 . 1 . . . . A 111 GLN NE2 . 30977 1 1076 . 1 . 1 112 112 PHE H H 1 8.105 0.003 . 1 . . . . A 112 PHE H . 30977 1 1077 . 1 . 1 112 112 PHE HA H 1 5.664 0.018 . 1 . . . . A 112 PHE HA . 30977 1 1078 . 1 . 1 112 112 PHE HB2 H 1 3.320 0.016 . 1 . . . . A 112 PHE HB2 . 30977 1 1079 . 1 . 1 112 112 PHE HD1 H 1 6.895 0.006 . 1 . . . . A 112 PHE HD1 . 30977 1 1080 . 1 . 1 112 112 PHE HD2 H 1 6.895 0.006 . 1 . . . . A 112 PHE HD2 . 30977 1 1081 . 1 . 1 112 112 PHE CA C 13 55.677 0.000 . 1 . . . . A 112 PHE CA . 30977 1 1082 . 1 . 1 112 112 PHE CB C 13 43.217 0.000 . 1 . . . . A 112 PHE CB . 30977 1 1083 . 1 . 1 112 112 PHE CD1 C 13 131.343 0.011 . 1 . . . . A 112 PHE CD1 . 30977 1 1084 . 1 . 1 112 112 PHE CD2 C 13 131.343 0.011 . 1 . . . . A 112 PHE CD2 . 30977 1 1085 . 1 . 1 112 112 PHE N N 15 117.132 0.017 . 1 . . . . A 112 PHE N . 30977 1 1086 . 1 . 1 113 113 PHE H H 1 9.875 0.006 . 1 . . . . A 113 PHE H . 30977 1 1087 . 1 . 1 113 113 PHE HA H 1 5.722 0.011 . 1 . . . . A 113 PHE HA . 30977 1 1088 . 1 . 1 113 113 PHE HB2 H 1 3.050 0.000 . 2 . . . . A 113 PHE HB2 . 30977 1 1089 . 1 . 1 113 113 PHE HB3 H 1 2.992 0.019 . 2 . . . . A 113 PHE HB3 . 30977 1 1090 . 1 . 1 113 113 PHE HD1 H 1 6.887 0.016 . 1 . . . . A 113 PHE HD1 . 30977 1 1091 . 1 . 1 113 113 PHE HD2 H 1 6.887 0.016 . 1 . . . . A 113 PHE HD2 . 30977 1 1092 . 1 . 1 113 113 PHE HE1 H 1 6.695 0.010 . 1 . . . . A 113 PHE HE1 . 30977 1 1093 . 1 . 1 113 113 PHE HE2 H 1 6.695 0.010 . 1 . . . . A 113 PHE HE2 . 30977 1 1094 . 1 . 1 113 113 PHE HZ H 1 6.911 0.009 . 1 . . . . A 113 PHE HZ . 30977 1 1095 . 1 . 1 113 113 PHE CA C 13 53.921 0.011 . 1 . . . . A 113 PHE CA . 30977 1 1096 . 1 . 1 113 113 PHE CB C 13 42.387 0.000 . 1 . . . . A 113 PHE CB . 30977 1 1097 . 1 . 1 113 113 PHE CD1 C 13 130.709 0.050 . 1 . . . . A 113 PHE CD1 . 30977 1 1098 . 1 . 1 113 113 PHE CD2 C 13 130.709 0.050 . 1 . . . . A 113 PHE CD2 . 30977 1 1099 . 1 . 1 113 113 PHE CE1 C 13 130.590 0.000 . 1 . . . . A 113 PHE CE1 . 30977 1 1100 . 1 . 1 113 113 PHE CE2 C 13 130.590 0.000 . 1 . . . . A 113 PHE CE2 . 30977 1 1101 . 1 . 1 113 113 PHE CZ C 13 128.888 0.011 . 1 . . . . A 113 PHE CZ . 30977 1 1102 . 1 . 1 113 113 PHE N N 15 117.221 0.027 . 1 . . . . A 113 PHE N . 30977 1 1103 . 1 . 1 114 114 ILE H H 1 9.078 0.004 . 1 . . . . A 114 ILE H . 30977 1 1104 . 1 . 1 114 114 ILE HA H 1 4.890 0.046 . 1 . . . . A 114 ILE HA . 30977 1 1105 . 1 . 1 114 114 ILE HB H 1 1.875 0.016 . 1 . . . . A 114 ILE HB . 30977 1 1106 . 1 . 1 114 114 ILE HG12 H 1 1.124 0.026 . 2 . . . . A 114 ILE HG12 . 30977 1 1107 . 1 . 1 114 114 ILE HG13 H 1 2.149 0.005 . 2 . . . . A 114 ILE HG13 . 30977 1 1108 . 1 . 1 114 114 ILE HG21 H 1 0.887 0.020 . 1 . . . . A 114 ILE HG21 . 30977 1 1109 . 1 . 1 114 114 ILE HG22 H 1 0.887 0.020 . 1 . . . . A 114 ILE HG22 . 30977 1 1110 . 1 . 1 114 114 ILE HG23 H 1 0.887 0.020 . 1 . . . . A 114 ILE HG23 . 30977 1 1111 . 1 . 1 114 114 ILE HD11 H 1 1.248 0.022 . 1 . . . . A 114 ILE HD11 . 30977 1 1112 . 1 . 1 114 114 ILE HD12 H 1 1.248 0.022 . 1 . . . . A 114 ILE HD12 . 30977 1 1113 . 1 . 1 114 114 ILE HD13 H 1 1.248 0.022 . 1 . . . . A 114 ILE HD13 . 30977 1 1114 . 1 . 1 114 114 ILE CA C 13 60.548 0.000 . 1 . . . . A 114 ILE CA . 30977 1 1115 . 1 . 1 114 114 ILE CB C 13 40.161 0.000 . 1 . . . . A 114 ILE CB . 30977 1 1116 . 1 . 1 114 114 ILE CG1 C 13 27.436 0.000 . 1 . . . . A 114 ILE CG1 . 30977 1 1117 . 1 . 1 114 114 ILE CG2 C 13 17.649 0.000 . 1 . . . . A 114 ILE CG2 . 30977 1 1118 . 1 . 1 114 114 ILE CD1 C 13 14.948 0.026 . 1 . . . . A 114 ILE CD1 . 30977 1 1119 . 1 . 1 114 114 ILE N N 15 118.487 0.004 . 1 . . . . A 114 ILE N . 30977 1 1120 . 1 . 1 115 115 CYS H H 1 9.695 0.009 . 1 . . . . A 115 CYS H . 30977 1 1121 . 1 . 1 115 115 CYS HA H 1 4.853 0.020 . 1 . . . . A 115 CYS HA . 30977 1 1122 . 1 . 1 115 115 CYS HB2 H 1 3.384 0.011 . 2 . . . . A 115 CYS HB2 . 30977 1 1123 . 1 . 1 115 115 CYS HB3 H 1 3.327 0.053 . 2 . . . . A 115 CYS HB3 . 30977 1 1124 . 1 . 1 115 115 CYS CA C 13 60.524 0.000 . 1 . . . . A 115 CYS CA . 30977 1 1125 . 1 . 1 115 115 CYS CB C 13 28.794 0.000 . 1 . . . . A 115 CYS CB . 30977 1 1126 . 1 . 1 115 115 CYS N N 15 125.993 0.024 . 1 . . . . A 115 CYS N . 30977 1 1127 . 1 . 1 116 116 THR H H 1 8.815 0.005 . 1 . . . . A 116 THR H . 30977 1 1128 . 1 . 1 116 116 THR HA H 1 4.372 0.025 . 1 . . . . A 116 THR HA . 30977 1 1129 . 1 . 1 116 116 THR HB H 1 4.523 0.042 . 1 . . . . A 116 THR HB . 30977 1 1130 . 1 . 1 116 116 THR HG21 H 1 0.880 0.011 . 1 . . . . A 116 THR HG21 . 30977 1 1131 . 1 . 1 116 116 THR HG22 H 1 0.880 0.011 . 1 . . . . A 116 THR HG22 . 30977 1 1132 . 1 . 1 116 116 THR HG23 H 1 0.880 0.011 . 1 . . . . A 116 THR HG23 . 30977 1 1133 . 1 . 1 116 116 THR CA C 13 61.099 0.000 . 1 . . . . A 116 THR CA . 30977 1 1134 . 1 . 1 116 116 THR CB C 13 66.167 0.000 . 1 . . . . A 116 THR CB . 30977 1 1135 . 1 . 1 116 116 THR CG2 C 13 23.072 0.014 . 1 . . . . A 116 THR CG2 . 30977 1 1136 . 1 . 1 116 116 THR N N 15 115.517 0.021 . 1 . . . . A 116 THR N . 30977 1 1137 . 1 . 1 117 117 ALA H H 1 7.611 0.003 . 1 . . . . A 117 ALA H . 30977 1 1138 . 1 . 1 117 117 ALA HA H 1 4.394 0.029 . 1 . . . . A 117 ALA HA . 30977 1 1139 . 1 . 1 117 117 ALA HB1 H 1 1.444 0.015 . 1 . . . . A 117 ALA HB1 . 30977 1 1140 . 1 . 1 117 117 ALA HB2 H 1 1.444 0.015 . 1 . . . . A 117 ALA HB2 . 30977 1 1141 . 1 . 1 117 117 ALA HB3 H 1 1.444 0.015 . 1 . . . . A 117 ALA HB3 . 30977 1 1142 . 1 . 1 117 117 ALA CA C 13 50.664 0.000 . 1 . . . . A 117 ALA CA . 30977 1 1143 . 1 . 1 117 117 ALA CB C 13 22.688 0.000 . 1 . . . . A 117 ALA CB . 30977 1 1144 . 1 . 1 117 117 ALA N N 15 121.498 0.010 . 1 . . . . A 117 ALA N . 30977 1 1145 . 1 . 1 118 118 LYS H H 1 8.731 0.012 . 1 . . . . A 118 LYS H . 30977 1 1146 . 1 . 1 118 118 LYS HA H 1 3.937 0.019 . 1 . . . . A 118 LYS HA . 30977 1 1147 . 1 . 1 118 118 LYS HB2 H 1 1.771 0.014 . 2 . . . . A 118 LYS HB2 . 30977 1 1148 . 1 . 1 118 118 LYS HB3 H 1 1.999 0.019 . 2 . . . . A 118 LYS HB3 . 30977 1 1149 . 1 . 1 118 118 LYS HG2 H 1 1.584 0.044 . 1 . . . . A 118 LYS HG2 . 30977 1 1150 . 1 . 1 118 118 LYS CA C 13 58.340 0.000 . 1 . . . . A 118 LYS CA . 30977 1 1151 . 1 . 1 118 118 LYS CB C 13 32.705 0.000 . 1 . . . . A 118 LYS CB . 30977 1 1152 . 1 . 1 118 118 LYS CG C 13 24.960 0.000 . 1 . . . . A 118 LYS CG . 30977 1 1153 . 1 . 1 118 118 LYS N N 15 119.793 0.009 . 1 . . . . A 118 LYS N . 30977 1 1154 . 1 . 1 119 119 THR H H 1 7.459 0.001 . 1 . . . . A 119 THR H . 30977 1 1155 . 1 . 1 119 119 THR HA H 1 4.790 0.019 . 1 . . . . A 119 THR HA . 30977 1 1156 . 1 . 1 119 119 THR HG21 H 1 1.113 0.018 . 1 . . . . A 119 THR HG21 . 30977 1 1157 . 1 . 1 119 119 THR HG22 H 1 1.113 0.018 . 1 . . . . A 119 THR HG22 . 30977 1 1158 . 1 . 1 119 119 THR HG23 H 1 1.113 0.018 . 1 . . . . A 119 THR HG23 . 30977 1 1159 . 1 . 1 119 119 THR CA C 13 57.863 0.000 . 1 . . . . A 119 THR CA . 30977 1 1160 . 1 . 1 119 119 THR CB C 13 69.114 0.000 . 1 . . . . A 119 THR CB . 30977 1 1161 . 1 . 1 119 119 THR CG2 C 13 20.462 0.000 . 1 . . . . A 119 THR CG2 . 30977 1 1162 . 1 . 1 119 119 THR N N 15 118.494 0.010 . 1 . . . . A 119 THR N . 30977 1 1163 . 1 . 1 120 120 GLU H H 1 9.534 0.003 . 1 . . . . A 120 GLU H . 30977 1 1164 . 1 . 1 120 120 GLU HA H 1 4.249 0.020 . 1 . . . . A 120 GLU HA . 30977 1 1165 . 1 . 1 120 120 GLU HB2 H 1 2.205 0.014 . 1 . . . . A 120 GLU HB2 . 30977 1 1166 . 1 . 1 120 120 GLU HG2 H 1 2.510 0.024 . 1 . . . . A 120 GLU HG2 . 30977 1 1167 . 1 . 1 120 120 GLU CA C 13 59.694 0.000 . 1 . . . . A 120 GLU CA . 30977 1 1168 . 1 . 1 120 120 GLU CB C 13 29.417 0.000 . 1 . . . . A 120 GLU CB . 30977 1 1169 . 1 . 1 120 120 GLU CG C 13 36.348 0.000 . 1 . . . . A 120 GLU CG . 30977 1 1170 . 1 . 1 120 120 GLU N N 15 125.746 0.009 . 1 . . . . A 120 GLU N . 30977 1 1171 . 1 . 1 121 121 TRP H H 1 7.459 0.007 . 1 . . . . A 121 TRP H . 30977 1 1172 . 1 . 1 121 121 TRP HA H 1 4.573 0.026 . 1 . . . . A 121 TRP HA . 30977 1 1173 . 1 . 1 121 121 TRP HB2 H 1 3.243 0.019 . 2 . . . . A 121 TRP HB2 . 30977 1 1174 . 1 . 1 121 121 TRP HB3 H 1 3.659 0.022 . 2 . . . . A 121 TRP HB3 . 30977 1 1175 . 1 . 1 121 121 TRP HE1 H 1 10.350 0.030 . 1 . . . . A 121 TRP HE1 . 30977 1 1176 . 1 . 1 121 121 TRP CA C 13 56.866 0.000 . 1 . . . . A 121 TRP CA . 30977 1 1177 . 1 . 1 121 121 TRP CB C 13 26.895 0.000 . 1 . . . . A 121 TRP CB . 30977 1 1178 . 1 . 1 121 121 TRP N N 15 116.661 0.008 . 1 . . . . A 121 TRP N . 30977 1 1179 . 1 . 1 122 122 LEU H H 1 6.846 0.005 . 1 . . . . A 122 LEU H . 30977 1 1180 . 1 . 1 122 122 LEU HA H 1 4.090 0.031 . 1 . . . . A 122 LEU HA . 30977 1 1181 . 1 . 1 122 122 LEU HB2 H 1 0.807 0.017 . 1 . . . . A 122 LEU HB2 . 30977 1 1182 . 1 . 1 122 122 LEU HG H 1 -0.015 0.030 . 1 . . . . A 122 LEU HG . 30977 1 1183 . 1 . 1 122 122 LEU HD11 H 1 -0.322 0.012 . 2 . . . . A 122 LEU HD11 . 30977 1 1184 . 1 . 1 122 122 LEU HD12 H 1 -0.322 0.012 . 2 . . . . A 122 LEU HD12 . 30977 1 1185 . 1 . 1 122 122 LEU HD13 H 1 -0.322 0.012 . 2 . . . . A 122 LEU HD13 . 30977 1 1186 . 1 . 1 122 122 LEU HD21 H 1 -0.373 0.015 . 2 . . . . A 122 LEU HD21 . 30977 1 1187 . 1 . 1 122 122 LEU HD22 H 1 -0.373 0.015 . 2 . . . . A 122 LEU HD22 . 30977 1 1188 . 1 . 1 122 122 LEU HD23 H 1 -0.373 0.015 . 2 . . . . A 122 LEU HD23 . 30977 1 1189 . 1 . 1 122 122 LEU CA C 13 55.092 0.000 . 1 . . . . A 122 LEU CA . 30977 1 1190 . 1 . 1 122 122 LEU CB C 13 39.966 0.000 . 1 . . . . A 122 LEU CB . 30977 1 1191 . 1 . 1 122 122 LEU CG C 13 25.352 0.002 . 1 . . . . A 122 LEU CG . 30977 1 1192 . 1 . 1 122 122 LEU N N 15 119.829 0.009 . 1 . . . . A 122 LEU N . 30977 1 1193 . 1 . 1 123 123 ASP H H 1 7.659 0.004 . 1 . . . . A 123 ASP H . 30977 1 1194 . 1 . 1 123 123 ASP HA H 1 5.134 0.009 . 1 . . . . A 123 ASP HA . 30977 1 1195 . 1 . 1 123 123 ASP HB2 H 1 3.054 0.017 . 2 . . . . A 123 ASP HB2 . 30977 1 1196 . 1 . 1 123 123 ASP HB3 H 1 2.723 0.005 . 2 . . . . A 123 ASP HB3 . 30977 1 1197 . 1 . 1 123 123 ASP CA C 13 55.789 0.009 . 1 . . . . A 123 ASP CA . 30977 1 1198 . 1 . 1 123 123 ASP CB C 13 39.830 0.000 . 1 . . . . A 123 ASP CB . 30977 1 1199 . 1 . 1 123 123 ASP N N 15 120.979 0.004 . 1 . . . . A 123 ASP N . 30977 1 1200 . 1 . 1 124 124 GLY H H 1 9.533 0.010 . 1 . . . . A 124 GLY H . 30977 1 1201 . 1 . 1 124 124 GLY HA2 H 1 2.992 0.011 . 2 . . . . A 124 GLY HA2 . 30977 1 1202 . 1 . 1 124 124 GLY HA3 H 1 3.937 0.010 . 2 . . . . A 124 GLY HA3 . 30977 1 1203 . 1 . 1 124 124 GLY CA C 13 45.337 0.000 . 1 . . . . A 124 GLY CA . 30977 1 1204 . 1 . 1 124 124 GLY N N 15 110.432 0.024 . 1 . . . . A 124 GLY N . 30977 1 1205 . 1 . 1 125 125 LYS H H 1 7.427 0.006 . 1 . . . . A 125 LYS H . 30977 1 1206 . 1 . 1 125 125 LYS HA H 1 4.151 0.024 . 1 . . . . A 125 LYS HA . 30977 1 1207 . 1 . 1 125 125 LYS HB2 H 1 1.855 0.018 . 2 . . . . A 125 LYS HB2 . 30977 1 1208 . 1 . 1 125 125 LYS HB3 H 1 1.724 0.000 . 2 . . . . A 125 LYS HB3 . 30977 1 1209 . 1 . 1 125 125 LYS HG2 H 1 1.298 0.009 . 1 . . . . A 125 LYS HG2 . 30977 1 1210 . 1 . 1 125 125 LYS HD2 H 1 1.602 0.012 . 1 . . . . A 125 LYS HD2 . 30977 1 1211 . 1 . 1 125 125 LYS CA C 13 56.122 0.000 . 1 . . . . A 125 LYS CA . 30977 1 1212 . 1 . 1 125 125 LYS CB C 13 35.690 0.000 . 1 . . . . A 125 LYS CB . 30977 1 1213 . 1 . 1 125 125 LYS CG C 13 25.342 0.000 . 1 . . . . A 125 LYS CG . 30977 1 1214 . 1 . 1 125 125 LYS CD C 13 29.437 0.000 . 1 . . . . A 125 LYS CD . 30977 1 1215 . 1 . 1 125 125 LYS N N 15 114.766 0.022 . 1 . . . . A 125 LYS N . 30977 1 1216 . 1 . 1 126 126 HIS H H 1 7.562 0.010 . 1 . . . . A 126 HIS H . 30977 1 1217 . 1 . 1 126 126 HIS HD2 H 1 6.975 0.009 . 1 . . . . A 126 HIS HD2 . 30977 1 1218 . 1 . 1 126 126 HIS HE1 H 1 8.294 0.014 . 1 . . . . A 126 HIS HE1 . 30977 1 1219 . 1 . 1 126 126 HIS CA C 13 57.458 0.000 . 1 . . . . A 126 HIS CA . 30977 1 1220 . 1 . 1 126 126 HIS CB C 13 31.586 0.000 . 1 . . . . A 126 HIS CB . 30977 1 1221 . 1 . 1 126 126 HIS CD2 C 13 125.803 0.023 . 1 . . . . A 126 HIS CD2 . 30977 1 1222 . 1 . 1 126 126 HIS CE1 C 13 136.714 0.002 . 1 . . . . A 126 HIS CE1 . 30977 1 1223 . 1 . 1 126 126 HIS N N 15 119.565 0.021 . 1 . . . . A 126 HIS N . 30977 1 1224 . 1 . 1 127 127 VAL H H 1 8.529 0.009 . 1 . . . . A 127 VAL H . 30977 1 1225 . 1 . 1 127 127 VAL HA H 1 4.295 0.010 . 1 . . . . A 127 VAL HA . 30977 1 1226 . 1 . 1 127 127 VAL HB H 1 2.049 0.021 . 1 . . . . A 127 VAL HB . 30977 1 1227 . 1 . 1 127 127 VAL HG11 H 1 1.199 0.023 . 2 . . . . A 127 VAL HG11 . 30977 1 1228 . 1 . 1 127 127 VAL HG12 H 1 1.199 0.023 . 2 . . . . A 127 VAL HG12 . 30977 1 1229 . 1 . 1 127 127 VAL HG13 H 1 1.199 0.023 . 2 . . . . A 127 VAL HG13 . 30977 1 1230 . 1 . 1 127 127 VAL HG21 H 1 1.051 0.019 . 2 . . . . A 127 VAL HG21 . 30977 1 1231 . 1 . 1 127 127 VAL HG22 H 1 1.051 0.019 . 2 . . . . A 127 VAL HG22 . 30977 1 1232 . 1 . 1 127 127 VAL HG23 H 1 1.051 0.019 . 2 . . . . A 127 VAL HG23 . 30977 1 1233 . 1 . 1 127 127 VAL CA C 13 63.767 0.000 . 1 . . . . A 127 VAL CA . 30977 1 1234 . 1 . 1 127 127 VAL CB C 13 33.761 0.041 . 1 . . . . A 127 VAL CB . 30977 1 1235 . 1 . 1 127 127 VAL CG1 C 13 21.217 0.000 . 1 . . . . A 127 VAL CG1 . 30977 1 1236 . 1 . 1 127 127 VAL N N 15 125.213 0.020 . 1 . . . . A 127 VAL N . 30977 1 1237 . 1 . 1 128 128 VAL H H 1 9.580 0.013 . 1 . . . . A 128 VAL H . 30977 1 1238 . 1 . 1 128 128 VAL HA H 1 4.199 0.019 . 1 . . . . A 128 VAL HA . 30977 1 1239 . 1 . 1 128 128 VAL HG11 H 1 1.004 0.012 . 2 . . . . A 128 VAL HG11 . 30977 1 1240 . 1 . 1 128 128 VAL HG12 H 1 1.004 0.012 . 2 . . . . A 128 VAL HG12 . 30977 1 1241 . 1 . 1 128 128 VAL HG13 H 1 1.004 0.012 . 2 . . . . A 128 VAL HG13 . 30977 1 1242 . 1 . 1 128 128 VAL HG21 H 1 0.145 0.014 . 2 . . . . A 128 VAL HG21 . 30977 1 1243 . 1 . 1 128 128 VAL HG22 H 1 0.145 0.014 . 2 . . . . A 128 VAL HG22 . 30977 1 1244 . 1 . 1 128 128 VAL HG23 H 1 0.145 0.014 . 2 . . . . A 128 VAL HG23 . 30977 1 1245 . 1 . 1 128 128 VAL CA C 13 63.209 0.000 . 1 . . . . A 128 VAL CA . 30977 1 1246 . 1 . 1 128 128 VAL CB C 13 31.792 0.000 . 1 . . . . A 128 VAL CB . 30977 1 1247 . 1 . 1 128 128 VAL CG1 C 13 21.768 0.000 . 2 . . . . A 128 VAL CG1 . 30977 1 1248 . 1 . 1 128 128 VAL CG2 C 13 20.085 0.048 . 2 . . . . A 128 VAL CG2 . 30977 1 1249 . 1 . 1 128 128 VAL N N 15 132.999 0.013 . 1 . . . . A 128 VAL N . 30977 1 1250 . 1 . 1 129 129 PHE H H 1 8.100 0.004 . 1 . . . . A 129 PHE H . 30977 1 1251 . 1 . 1 129 129 PHE HA H 1 5.323 0.005 . 1 . . . . A 129 PHE HA . 30977 1 1252 . 1 . 1 129 129 PHE HB2 H 1 3.163 0.015 . 2 . . . . A 129 PHE HB2 . 30977 1 1253 . 1 . 1 129 129 PHE HB3 H 1 2.559 0.022 . 2 . . . . A 129 PHE HB3 . 30977 1 1254 . 1 . 1 129 129 PHE HD1 H 1 6.563 0.016 . 1 . . . . A 129 PHE HD1 . 30977 1 1255 . 1 . 1 129 129 PHE HD2 H 1 6.563 0.016 . 1 . . . . A 129 PHE HD2 . 30977 1 1256 . 1 . 1 129 129 PHE CA C 13 55.889 0.000 . 1 . . . . A 129 PHE CA . 30977 1 1257 . 1 . 1 129 129 PHE CB C 13 42.681 0.000 . 1 . . . . A 129 PHE CB . 30977 1 1258 . 1 . 1 129 129 PHE CD1 C 13 132.132 0.013 . 1 . . . . A 129 PHE CD1 . 30977 1 1259 . 1 . 1 129 129 PHE CD2 C 13 132.132 0.013 . 1 . . . . A 129 PHE CD2 . 30977 1 1260 . 1 . 1 129 129 PHE N N 15 117.784 0.006 . 1 . . . . A 129 PHE N . 30977 1 1261 . 1 . 1 130 130 GLY H H 1 7.305 0.003 . 1 . . . . A 130 GLY H . 30977 1 1262 . 1 . 1 130 130 GLY HA2 H 1 3.227 0.018 . 2 . . . . A 130 GLY HA2 . 30977 1 1263 . 1 . 1 130 130 GLY HA3 H 1 2.866 0.013 . 2 . . . . A 130 GLY HA3 . 30977 1 1264 . 1 . 1 130 130 GLY CA C 13 46.466 0.000 . 1 . . . . A 130 GLY CA . 30977 1 1265 . 1 . 1 130 130 GLY N N 15 110.960 0.010 . 1 . . . . A 130 GLY N . 30977 1 1266 . 1 . 1 131 131 LYS H H 1 8.398 0.003 . 1 . . . . A 131 LYS H . 30977 1 1267 . 1 . 1 131 131 LYS HA H 1 5.285 0.011 . 1 . . . . A 131 LYS HA . 30977 1 1268 . 1 . 1 131 131 LYS HB2 H 1 1.860 0.015 . 1 . . . . A 131 LYS HB2 . 30977 1 1269 . 1 . 1 131 131 LYS HG2 H 1 1.099 0.017 . 2 . . . . A 131 LYS HG2 . 30977 1 1270 . 1 . 1 131 131 LYS HG3 H 1 1.542 0.017 . 2 . . . . A 131 LYS HG3 . 30977 1 1271 . 1 . 1 131 131 LYS HE2 H 1 2.944 0.000 . 1 . . . . A 131 LYS HE2 . 30977 1 1272 . 1 . 1 131 131 LYS CA C 13 54.818 0.000 . 1 . . . . A 131 LYS CA . 30977 1 1273 . 1 . 1 131 131 LYS CB C 13 36.004 0.000 . 1 . . . . A 131 LYS CB . 30977 1 1274 . 1 . 1 131 131 LYS CG C 13 24.082 0.000 . 1 . . . . A 131 LYS CG . 30977 1 1275 . 1 . 1 131 131 LYS CD C 13 29.538 0.000 . 1 . . . . A 131 LYS CD . 30977 1 1276 . 1 . 1 131 131 LYS CE C 13 41.424 0.000 . 1 . . . . A 131 LYS CE . 30977 1 1277 . 1 . 1 131 131 LYS N N 15 114.974 0.023 . 1 . . . . A 131 LYS N . 30977 1 1278 . 1 . 1 132 132 VAL H H 1 9.089 0.005 . 1 . . . . A 132 VAL H . 30977 1 1279 . 1 . 1 132 132 VAL HA H 1 3.939 0.026 . 1 . . . . A 132 VAL HA . 30977 1 1280 . 1 . 1 132 132 VAL HB H 1 1.953 0.015 . 1 . . . . A 132 VAL HB . 30977 1 1281 . 1 . 1 132 132 VAL HG11 H 1 1.080 0.014 . 2 . . . . A 132 VAL HG11 . 30977 1 1282 . 1 . 1 132 132 VAL HG12 H 1 1.080 0.014 . 2 . . . . A 132 VAL HG12 . 30977 1 1283 . 1 . 1 132 132 VAL HG13 H 1 1.080 0.014 . 2 . . . . A 132 VAL HG13 . 30977 1 1284 . 1 . 1 132 132 VAL HG21 H 1 0.646 0.016 . 2 . . . . A 132 VAL HG21 . 30977 1 1285 . 1 . 1 132 132 VAL HG22 H 1 0.646 0.016 . 2 . . . . A 132 VAL HG22 . 30977 1 1286 . 1 . 1 132 132 VAL HG23 H 1 0.646 0.016 . 2 . . . . A 132 VAL HG23 . 30977 1 1287 . 1 . 1 132 132 VAL CA C 13 63.989 0.000 . 1 . . . . A 132 VAL CA . 30977 1 1288 . 1 . 1 132 132 VAL CB C 13 32.783 0.000 . 1 . . . . A 132 VAL CB . 30977 1 1289 . 1 . 1 132 132 VAL CG1 C 13 22.936 0.000 . 2 . . . . A 132 VAL CG1 . 30977 1 1290 . 1 . 1 132 132 VAL CG2 C 13 21.488 0.061 . 2 . . . . A 132 VAL CG2 . 30977 1 1291 . 1 . 1 132 132 VAL N N 15 123.801 0.008 . 1 . . . . A 132 VAL N . 30977 1 1292 . 1 . 1 133 133 LYS H H 1 9.521 0.006 . 1 . . . . A 133 LYS H . 30977 1 1293 . 1 . 1 133 133 LYS HA H 1 4.473 0.025 . 1 . . . . A 133 LYS HA . 30977 1 1294 . 1 . 1 133 133 LYS HB2 H 1 1.782 0.000 . 2 . . . . A 133 LYS HB2 . 30977 1 1295 . 1 . 1 133 133 LYS HB3 H 1 1.708 0.015 . 2 . . . . A 133 LYS HB3 . 30977 1 1296 . 1 . 1 133 133 LYS HG2 H 1 1.328 0.020 . 2 . . . . A 133 LYS HG2 . 30977 1 1297 . 1 . 1 133 133 LYS HG3 H 1 1.502 0.007 . 2 . . . . A 133 LYS HG3 . 30977 1 1298 . 1 . 1 133 133 LYS CA C 13 57.036 0.000 . 1 . . . . A 133 LYS CA . 30977 1 1299 . 1 . 1 133 133 LYS CB C 13 34.163 0.000 . 1 . . . . A 133 LYS CB . 30977 1 1300 . 1 . 1 133 133 LYS CG C 13 24.902 0.000 . 1 . . . . A 133 LYS CG . 30977 1 1301 . 1 . 1 133 133 LYS CD C 13 29.898 0.000 . 1 . . . . A 133 LYS CD . 30977 1 1302 . 1 . 1 133 133 LYS CE C 13 41.741 0.000 . 1 . . . . A 133 LYS CE . 30977 1 1303 . 1 . 1 133 133 LYS N N 15 131.812 0.019 . 1 . . . . A 133 LYS N . 30977 1 1304 . 1 . 1 134 134 GLU H H 1 7.586 0.006 . 1 . . . . A 134 GLU H . 30977 1 1305 . 1 . 1 134 134 GLU HA H 1 4.621 0.011 . 1 . . . . A 134 GLU HA . 30977 1 1306 . 1 . 1 134 134 GLU HB2 H 1 1.918 0.024 . 2 . . . . A 134 GLU HB2 . 30977 1 1307 . 1 . 1 134 134 GLU HB3 H 1 1.996 0.021 . 2 . . . . A 134 GLU HB3 . 30977 1 1308 . 1 . 1 134 134 GLU HG2 H 1 2.224 0.015 . 1 . . . . A 134 GLU HG2 . 30977 1 1309 . 1 . 1 134 134 GLU CA C 13 55.557 0.000 . 1 . . . . A 134 GLU CA . 30977 1 1310 . 1 . 1 134 134 GLU CB C 13 32.930 0.000 . 1 . . . . A 134 GLU CB . 30977 1 1311 . 1 . 1 134 134 GLU CG C 13 36.861 0.000 . 1 . . . . A 134 GLU CG . 30977 1 1312 . 1 . 1 134 134 GLU N N 15 118.288 0.002 . 1 . . . . A 134 GLU N . 30977 1 1313 . 1 . 1 135 135 GLY H H 1 8.714 0.002 . 1 . . . . A 135 GLY H . 30977 1 1314 . 1 . 1 135 135 GLY HA2 H 1 4.037 0.014 . 2 . . . . A 135 GLY HA2 . 30977 1 1315 . 1 . 1 135 135 GLY HA3 H 1 4.802 0.017 . 2 . . . . A 135 GLY HA3 . 30977 1 1316 . 1 . 1 135 135 GLY CA C 13 46.031 0.000 . 1 . . . . A 135 GLY CA . 30977 1 1317 . 1 . 1 135 135 GLY N N 15 107.883 0.018 . 1 . . . . A 135 GLY N . 30977 1 1318 . 1 . 1 136 136 MET H H 1 8.891 0.001 . 1 . . . . A 136 MET H . 30977 1 1319 . 1 . 1 136 136 MET HA H 1 4.475 0.013 . 1 . . . . A 136 MET HA . 30977 1 1320 . 1 . 1 136 136 MET HB2 H 1 2.805 0.000 . 2 . . . . A 136 MET HB2 . 30977 1 1321 . 1 . 1 136 136 MET HB3 H 1 2.720 0.023 . 2 . . . . A 136 MET HB3 . 30977 1 1322 . 1 . 1 136 136 MET HG2 H 1 1.990 0.011 . 2 . . . . A 136 MET HG2 . 30977 1 1323 . 1 . 1 136 136 MET HG3 H 1 2.152 0.007 . 2 . . . . A 136 MET HG3 . 30977 1 1324 . 1 . 1 136 136 MET HE1 H 1 2.041 0.018 . 1 . . . . A 136 MET HE1 . 30977 1 1325 . 1 . 1 136 136 MET HE2 H 1 2.041 0.018 . 1 . . . . A 136 MET HE2 . 30977 1 1326 . 1 . 1 136 136 MET HE3 H 1 2.041 0.018 . 1 . . . . A 136 MET HE3 . 30977 1 1327 . 1 . 1 136 136 MET CA C 13 56.974 0.000 . 1 . . . . A 136 MET CA . 30977 1 1328 . 1 . 1 136 136 MET CB C 13 33.051 0.000 . 1 . . . . A 136 MET CB . 30977 1 1329 . 1 . 1 136 136 MET CG C 13 30.337 0.000 . 1 . . . . A 136 MET CG . 30977 1 1330 . 1 . 1 136 136 MET CE C 13 17.273 0.000 . 1 . . . . A 136 MET CE . 30977 1 1331 . 1 . 1 136 136 MET N N 15 122.519 0.020 . 1 . . . . A 136 MET N . 30977 1 1332 . 1 . 1 137 137 ASN H H 1 8.953 0.002 . 1 . . . . A 137 ASN H . 30977 1 1333 . 1 . 1 137 137 ASN HA H 1 4.504 0.017 . 1 . . . . A 137 ASN HA . 30977 1 1334 . 1 . 1 137 137 ASN HB2 H 1 2.843 0.011 . 1 . . . . A 137 ASN HB2 . 30977 1 1335 . 1 . 1 137 137 ASN HD21 H 1 7.793 0.001 . 1 . . . . A 137 ASN HD21 . 30977 1 1336 . 1 . 1 137 137 ASN HD22 H 1 7.069 0.001 . 1 . . . . A 137 ASN HD22 . 30977 1 1337 . 1 . 1 137 137 ASN CA C 13 56.046 0.000 . 1 . . . . A 137 ASN CA . 30977 1 1338 . 1 . 1 137 137 ASN CB C 13 36.020 0.000 . 1 . . . . A 137 ASN CB . 30977 1 1339 . 1 . 1 137 137 ASN N N 15 114.385 0.014 . 1 . . . . A 137 ASN N . 30977 1 1340 . 1 . 1 137 137 ASN ND2 N 15 114.884 0.015 . 1 . . . . A 137 ASN ND2 . 30977 1 1341 . 1 . 1 138 138 ILE H H 1 7.677 0.003 . 1 . . . . A 138 ILE H . 30977 1 1342 . 1 . 1 138 138 ILE HA H 1 3.809 0.018 . 1 . . . . A 138 ILE HA . 30977 1 1343 . 1 . 1 138 138 ILE HB H 1 2.475 0.022 . 1 . . . . A 138 ILE HB . 30977 1 1344 . 1 . 1 138 138 ILE HG12 H 1 1.565 0.015 . 2 . . . . A 138 ILE HG12 . 30977 1 1345 . 1 . 1 138 138 ILE HG13 H 1 1.327 0.021 . 2 . . . . A 138 ILE HG13 . 30977 1 1346 . 1 . 1 138 138 ILE HG21 H 1 0.685 0.017 . 1 . . . . A 138 ILE HG21 . 30977 1 1347 . 1 . 1 138 138 ILE HG22 H 1 0.685 0.017 . 1 . . . . A 138 ILE HG22 . 30977 1 1348 . 1 . 1 138 138 ILE HG23 H 1 0.685 0.017 . 1 . . . . A 138 ILE HG23 . 30977 1 1349 . 1 . 1 138 138 ILE HD11 H 1 0.684 0.014 . 1 . . . . A 138 ILE HD11 . 30977 1 1350 . 1 . 1 138 138 ILE HD12 H 1 0.684 0.014 . 1 . . . . A 138 ILE HD12 . 30977 1 1351 . 1 . 1 138 138 ILE HD13 H 1 0.684 0.014 . 1 . . . . A 138 ILE HD13 . 30977 1 1352 . 1 . 1 138 138 ILE CA C 13 61.480 0.000 . 1 . . . . A 138 ILE CA . 30977 1 1353 . 1 . 1 138 138 ILE CB C 13 34.433 0.000 . 1 . . . . A 138 ILE CB . 30977 1 1354 . 1 . 1 138 138 ILE CG1 C 13 27.112 0.000 . 1 . . . . A 138 ILE CG1 . 30977 1 1355 . 1 . 1 138 138 ILE CG2 C 13 17.309 0.000 . 1 . . . . A 138 ILE CG2 . 30977 1 1356 . 1 . 1 138 138 ILE CD1 C 13 9.159 0.000 . 1 . . . . A 138 ILE CD1 . 30977 1 1357 . 1 . 1 138 138 ILE N N 15 124.229 0.023 . 1 . . . . A 138 ILE N . 30977 1 1358 . 1 . 1 139 139 VAL H H 1 7.292 0.003 . 1 . . . . A 139 VAL H . 30977 1 1359 . 1 . 1 139 139 VAL HA H 1 3.906 0.024 . 1 . . . . A 139 VAL HA . 30977 1 1360 . 1 . 1 139 139 VAL HB H 1 2.543 0.013 . 1 . . . . A 139 VAL HB . 30977 1 1361 . 1 . 1 139 139 VAL HG11 H 1 1.070 0.010 . 2 . . . . A 139 VAL HG11 . 30977 1 1362 . 1 . 1 139 139 VAL HG12 H 1 1.070 0.010 . 2 . . . . A 139 VAL HG12 . 30977 1 1363 . 1 . 1 139 139 VAL HG13 H 1 1.070 0.010 . 2 . . . . A 139 VAL HG13 . 30977 1 1364 . 1 . 1 139 139 VAL HG21 H 1 0.881 0.016 . 2 . . . . A 139 VAL HG21 . 30977 1 1365 . 1 . 1 139 139 VAL HG22 H 1 0.881 0.016 . 2 . . . . A 139 VAL HG22 . 30977 1 1366 . 1 . 1 139 139 VAL HG23 H 1 0.881 0.016 . 2 . . . . A 139 VAL HG23 . 30977 1 1367 . 1 . 1 139 139 VAL CA C 13 66.096 0.000 . 1 . . . . A 139 VAL CA . 30977 1 1368 . 1 . 1 139 139 VAL CB C 13 31.283 0.000 . 1 . . . . A 139 VAL CB . 30977 1 1369 . 1 . 1 139 139 VAL CG1 C 13 22.367 0.000 . 2 . . . . A 139 VAL CG1 . 30977 1 1370 . 1 . 1 139 139 VAL CG2 C 13 23.175 0.000 . 2 . . . . A 139 VAL CG2 . 30977 1 1371 . 1 . 1 139 139 VAL N N 15 121.877 0.020 . 1 . . . . A 139 VAL N . 30977 1 1372 . 1 . 1 140 140 GLU H H 1 8.305 0.005 . 1 . . . . A 140 GLU H . 30977 1 1373 . 1 . 1 140 140 GLU HA H 1 4.163 0.012 . 1 . . . . A 140 GLU HA . 30977 1 1374 . 1 . 1 140 140 GLU HB2 H 1 2.022 0.004 . 2 . . . . A 140 GLU HB2 . 30977 1 1375 . 1 . 1 140 140 GLU HB3 H 1 2.123 0.012 . 2 . . . . A 140 GLU HB3 . 30977 1 1376 . 1 . 1 140 140 GLU HG2 H 1 2.254 0.009 . 2 . . . . A 140 GLU HG2 . 30977 1 1377 . 1 . 1 140 140 GLU HG3 H 1 2.465 0.008 . 2 . . . . A 140 GLU HG3 . 30977 1 1378 . 1 . 1 140 140 GLU CA C 13 59.203 0.000 . 1 . . . . A 140 GLU CA . 30977 1 1379 . 1 . 1 140 140 GLU CB C 13 29.562 0.000 . 1 . . . . A 140 GLU CB . 30977 1 1380 . 1 . 1 140 140 GLU CG C 13 36.939 0.000 . 1 . . . . A 140 GLU CG . 30977 1 1381 . 1 . 1 140 140 GLU N N 15 117.188 0.005 . 1 . . . . A 140 GLU N . 30977 1 1382 . 1 . 1 141 141 ALA H H 1 7.554 0.005 . 1 . . . . A 141 ALA H . 30977 1 1383 . 1 . 1 141 141 ALA HA H 1 4.129 0.010 . 1 . . . . A 141 ALA HA . 30977 1 1384 . 1 . 1 141 141 ALA HB1 H 1 1.627 0.020 . 1 . . . . A 141 ALA HB1 . 30977 1 1385 . 1 . 1 141 141 ALA HB2 H 1 1.627 0.020 . 1 . . . . A 141 ALA HB2 . 30977 1 1386 . 1 . 1 141 141 ALA HB3 H 1 1.627 0.020 . 1 . . . . A 141 ALA HB3 . 30977 1 1387 . 1 . 1 141 141 ALA CA C 13 54.973 0.000 . 1 . . . . A 141 ALA CA . 30977 1 1388 . 1 . 1 141 141 ALA CB C 13 18.279 0.000 . 1 . . . . A 141 ALA CB . 30977 1 1389 . 1 . 1 141 141 ALA N N 15 121.087 0.009 . 1 . . . . A 141 ALA N . 30977 1 1390 . 1 . 1 142 142 MET H H 1 8.318 0.005 . 1 . . . . A 142 MET H . 30977 1 1391 . 1 . 1 142 142 MET HA H 1 4.024 0.023 . 1 . . . . A 142 MET HA . 30977 1 1392 . 1 . 1 142 142 MET HB2 H 1 2.633 0.015 . 2 . . . . A 142 MET HB2 . 30977 1 1393 . 1 . 1 142 142 MET HB3 H 1 2.003 0.010 . 2 . . . . A 142 MET HB3 . 30977 1 1394 . 1 . 1 142 142 MET HG2 H 1 2.343 0.000 . 2 . . . . A 142 MET HG2 . 30977 1 1395 . 1 . 1 142 142 MET HG3 H 1 2.685 0.000 . 2 . . . . A 142 MET HG3 . 30977 1 1396 . 1 . 1 142 142 MET HE1 H 1 2.135 0.018 . 1 . . . . A 142 MET HE1 . 30977 1 1397 . 1 . 1 142 142 MET HE2 H 1 2.135 0.018 . 1 . . . . A 142 MET HE2 . 30977 1 1398 . 1 . 1 142 142 MET HE3 H 1 2.135 0.018 . 1 . . . . A 142 MET HE3 . 30977 1 1399 . 1 . 1 142 142 MET CA C 13 59.839 0.000 . 1 . . . . A 142 MET CA . 30977 1 1400 . 1 . 1 142 142 MET CB C 13 33.614 0.000 . 1 . . . . A 142 MET CB . 30977 1 1401 . 1 . 1 142 142 MET CG C 13 31.244 0.000 . 1 . . . . A 142 MET CG . 30977 1 1402 . 1 . 1 142 142 MET CE C 13 16.934 0.000 . 1 . . . . A 142 MET CE . 30977 1 1403 . 1 . 1 142 142 MET N N 15 117.689 0.012 . 1 . . . . A 142 MET N . 30977 1 1404 . 1 . 1 143 143 GLU H H 1 7.813 0.002 . 1 . . . . A 143 GLU H . 30977 1 1405 . 1 . 1 143 143 GLU HA H 1 3.793 0.019 . 1 . . . . A 143 GLU HA . 30977 1 1406 . 1 . 1 143 143 GLU HB2 H 1 1.919 0.016 . 2 . . . . A 143 GLU HB2 . 30977 1 1407 . 1 . 1 143 143 GLU HB3 H 1 2.330 0.010 . 2 . . . . A 143 GLU HB3 . 30977 1 1408 . 1 . 1 143 143 GLU HG2 H 1 2.556 0.015 . 2 . . . . A 143 GLU HG2 . 30977 1 1409 . 1 . 1 143 143 GLU HG3 H 1 2.031 0.023 . 2 . . . . A 143 GLU HG3 . 30977 1 1410 . 1 . 1 143 143 GLU CA C 13 59.712 0.000 . 1 . . . . A 143 GLU CA . 30977 1 1411 . 1 . 1 143 143 GLU CB C 13 30.615 0.000 . 1 . . . . A 143 GLU CB . 30977 1 1412 . 1 . 1 143 143 GLU CG C 13 38.376 0.000 . 1 . . . . A 143 GLU CG . 30977 1 1413 . 1 . 1 143 143 GLU N N 15 115.472 0.007 . 1 . . . . A 143 GLU N . 30977 1 1414 . 1 . 1 144 144 ARG H H 1 7.121 0.009 . 1 . . . . A 144 ARG H . 30977 1 1415 . 1 . 1 144 144 ARG HA H 1 3.966 0.013 . 1 . . . . A 144 ARG HA . 30977 1 1416 . 1 . 1 144 144 ARG HB2 H 1 1.423 0.007 . 1 . . . . A 144 ARG HB2 . 30977 1 1417 . 1 . 1 144 144 ARG HG2 H 1 1.506 0.000 . 2 . . . . A 144 ARG HG2 . 30977 1 1418 . 1 . 1 144 144 ARG HG3 H 1 1.637 0.025 . 2 . . . . A 144 ARG HG3 . 30977 1 1419 . 1 . 1 144 144 ARG HD2 H 1 3.112 0.011 . 1 . . . . A 144 ARG HD2 . 30977 1 1420 . 1 . 1 144 144 ARG HE H 1 7.146 0.001 . 1 . . . . A 144 ARG HE . 30977 1 1421 . 1 . 1 144 144 ARG CA C 13 57.714 0.000 . 1 . . . . A 144 ARG CA . 30977 1 1422 . 1 . 1 144 144 ARG CB C 13 29.551 0.000 . 1 . . . . A 144 ARG CB . 30977 1 1423 . 1 . 1 144 144 ARG CG C 13 27.536 0.000 . 1 . . . . A 144 ARG CG . 30977 1 1424 . 1 . 1 144 144 ARG CD C 13 43.315 0.000 . 1 . . . . A 144 ARG CD . 30977 1 1425 . 1 . 1 144 144 ARG N N 15 115.275 0.007 . 1 . . . . A 144 ARG N . 30977 1 1426 . 1 . 1 144 144 ARG NE N 15 84.837 0.016 . 1 . . . . A 144 ARG NE . 30977 1 1427 . 1 . 1 145 145 PHE H H 1 7.606 0.001 . 1 . . . . A 145 PHE H . 30977 1 1428 . 1 . 1 145 145 PHE HA H 1 4.836 0.012 . 1 . . . . A 145 PHE HA . 30977 1 1429 . 1 . 1 145 145 PHE HB2 H 1 2.924 0.021 . 2 . . . . A 145 PHE HB2 . 30977 1 1430 . 1 . 1 145 145 PHE HB3 H 1 3.570 0.016 . 2 . . . . A 145 PHE HB3 . 30977 1 1431 . 1 . 1 145 145 PHE HD1 H 1 7.362 0.016 . 1 . . . . A 145 PHE HD1 . 30977 1 1432 . 1 . 1 145 145 PHE HD2 H 1 7.362 0.016 . 1 . . . . A 145 PHE HD2 . 30977 1 1433 . 1 . 1 145 145 PHE CA C 13 57.767 0.000 . 1 . . . . A 145 PHE CA . 30977 1 1434 . 1 . 1 145 145 PHE CB C 13 39.117 0.000 . 1 . . . . A 145 PHE CB . 30977 1 1435 . 1 . 1 145 145 PHE CD1 C 13 131.818 0.010 . 1 . . . . A 145 PHE CD1 . 30977 1 1436 . 1 . 1 145 145 PHE CD2 C 13 131.818 0.010 . 1 . . . . A 145 PHE CD2 . 30977 1 1437 . 1 . 1 145 145 PHE N N 15 115.119 0.057 . 1 . . . . A 145 PHE N . 30977 1 1438 . 1 . 1 146 146 GLY H H 1 7.510 0.007 . 1 . . . . A 146 GLY H . 30977 1 1439 . 1 . 1 146 146 GLY HA2 H 1 3.704 0.012 . 2 . . . . A 146 GLY HA2 . 30977 1 1440 . 1 . 1 146 146 GLY HA3 H 1 4.691 0.011 . 2 . . . . A 146 GLY HA3 . 30977 1 1441 . 1 . 1 146 146 GLY CA C 13 44.174 0.000 . 1 . . . . A 146 GLY CA . 30977 1 1442 . 1 . 1 146 146 GLY N N 15 104.598 0.013 . 1 . . . . A 146 GLY N . 30977 1 1443 . 1 . 1 147 147 SER H H 1 8.164 0.003 . 1 . . . . A 147 SER H . 30977 1 1444 . 1 . 1 147 147 SER HB2 H 1 4.175 0.017 . 2 . . . . A 147 SER HB2 . 30977 1 1445 . 1 . 1 147 147 SER HB3 H 1 4.121 0.000 . 2 . . . . A 147 SER HB3 . 30977 1 1446 . 1 . 1 147 147 SER CA C 13 58.322 0.000 . 1 . . . . A 147 SER CA . 30977 1 1447 . 1 . 1 147 147 SER CB C 13 65.778 0.000 . 1 . . . . A 147 SER CB . 30977 1 1448 . 1 . 1 147 147 SER N N 15 109.909 0.012 . 1 . . . . A 147 SER N . 30977 1 1449 . 1 . 1 148 148 ARG H H 1 8.887 0.009 . 1 . . . . A 148 ARG H . 30977 1 1450 . 1 . 1 148 148 ARG HA H 1 4.205 0.008 . 1 . . . . A 148 ARG HA . 30977 1 1451 . 1 . 1 148 148 ARG HB2 H 1 1.950 0.012 . 1 . . . . A 148 ARG HB2 . 30977 1 1452 . 1 . 1 148 148 ARG HG2 H 1 1.760 0.011 . 1 . . . . A 148 ARG HG2 . 30977 1 1453 . 1 . 1 148 148 ARG HD2 H 1 3.282 0.000 . 1 . . . . A 148 ARG HD2 . 30977 1 1454 . 1 . 1 148 148 ARG CA C 13 59.923 0.000 . 1 . . . . A 148 ARG CA . 30977 1 1455 . 1 . 1 148 148 ARG CB C 13 29.932 0.000 . 1 . . . . A 148 ARG CB . 30977 1 1456 . 1 . 1 148 148 ARG CG C 13 27.095 0.000 . 1 . . . . A 148 ARG CG . 30977 1 1457 . 1 . 1 148 148 ARG CD C 13 43.250 0.000 . 1 . . . . A 148 ARG CD . 30977 1 1458 . 1 . 1 148 148 ARG N N 15 120.115 0.011 . 1 . . . . A 148 ARG N . 30977 1 1459 . 1 . 1 149 149 ASN H H 1 7.904 0.007 . 1 . . . . A 149 ASN H . 30977 1 1460 . 1 . 1 149 149 ASN HA H 1 4.873 0.012 . 1 . . . . A 149 ASN HA . 30977 1 1461 . 1 . 1 149 149 ASN HB2 H 1 2.856 0.026 . 2 . . . . A 149 ASN HB2 . 30977 1 1462 . 1 . 1 149 149 ASN HB3 H 1 3.237 0.011 . 2 . . . . A 149 ASN HB3 . 30977 1 1463 . 1 . 1 149 149 ASN HD21 H 1 7.443 0.002 . 1 . . . . A 149 ASN HD21 . 30977 1 1464 . 1 . 1 149 149 ASN HD22 H 1 5.767 0.000 . 1 . . . . A 149 ASN HD22 . 30977 1 1465 . 1 . 1 149 149 ASN CA C 13 52.171 0.000 . 1 . . . . A 149 ASN CA . 30977 1 1466 . 1 . 1 149 149 ASN CB C 13 38.515 0.000 . 1 . . . . A 149 ASN CB . 30977 1 1467 . 1 . 1 149 149 ASN N N 15 111.788 0.010 . 1 . . . . A 149 ASN N . 30977 1 1468 . 1 . 1 149 149 ASN ND2 N 15 112.953 0.001 . 1 . . . . A 149 ASN ND2 . 30977 1 1469 . 1 . 1 150 150 GLY H H 1 8.115 0.004 . 1 . . . . A 150 GLY H . 30977 1 1470 . 1 . 1 150 150 GLY HA2 H 1 4.154 0.008 . 2 . . . . A 150 GLY HA2 . 30977 1 1471 . 1 . 1 150 150 GLY HA3 H 1 3.945 0.019 . 2 . . . . A 150 GLY HA3 . 30977 1 1472 . 1 . 1 150 150 GLY CA C 13 45.035 0.000 . 1 . . . . A 150 GLY CA . 30977 1 1473 . 1 . 1 150 150 GLY N N 15 109.986 0.039 . 1 . . . . A 150 GLY N . 30977 1 1474 . 1 . 1 151 151 LYS H H 1 7.598 0.003 . 1 . . . . A 151 LYS H . 30977 1 1475 . 1 . 1 151 151 LYS HA H 1 4.454 0.018 . 1 . . . . A 151 LYS HA . 30977 1 1476 . 1 . 1 151 151 LYS HB2 H 1 1.890 0.010 . 1 . . . . A 151 LYS HB2 . 30977 1 1477 . 1 . 1 151 151 LYS HG2 H 1 1.564 0.010 . 1 . . . . A 151 LYS HG2 . 30977 1 1478 . 1 . 1 151 151 LYS HE2 H 1 3.148 0.021 . 1 . . . . A 151 LYS HE2 . 30977 1 1479 . 1 . 1 151 151 LYS CA C 13 57.379 0.000 . 1 . . . . A 151 LYS CA . 30977 1 1480 . 1 . 1 151 151 LYS CB C 13 32.470 0.000 . 1 . . . . A 151 LYS CB . 30977 1 1481 . 1 . 1 151 151 LYS CG C 13 25.150 0.000 . 1 . . . . A 151 LYS CG . 30977 1 1482 . 1 . 1 151 151 LYS CD C 13 29.193 0.000 . 1 . . . . A 151 LYS CD . 30977 1 1483 . 1 . 1 151 151 LYS CE C 13 42.303 0.000 . 1 . . . . A 151 LYS CE . 30977 1 1484 . 1 . 1 151 151 LYS N N 15 120.086 0.005 . 1 . . . . A 151 LYS N . 30977 1 1485 . 1 . 1 152 152 THR H H 1 8.898 0.005 . 1 . . . . A 152 THR H . 30977 1 1486 . 1 . 1 152 152 THR HA H 1 5.599 0.016 . 1 . . . . A 152 THR HA . 30977 1 1487 . 1 . 1 152 152 THR HB H 1 4.746 0.018 . 1 . . . . A 152 THR HB . 30977 1 1488 . 1 . 1 152 152 THR HG21 H 1 1.402 0.019 . 1 . . . . A 152 THR HG21 . 30977 1 1489 . 1 . 1 152 152 THR HG22 H 1 1.402 0.019 . 1 . . . . A 152 THR HG22 . 30977 1 1490 . 1 . 1 152 152 THR HG23 H 1 1.402 0.019 . 1 . . . . A 152 THR HG23 . 30977 1 1491 . 1 . 1 152 152 THR CA C 13 60.192 0.000 . 1 . . . . A 152 THR CA . 30977 1 1492 . 1 . 1 152 152 THR CB C 13 71.205 0.000 . 1 . . . . A 152 THR CB . 30977 1 1493 . 1 . 1 152 152 THR CG2 C 13 22.201 0.000 . 1 . . . . A 152 THR CG2 . 30977 1 1494 . 1 . 1 152 152 THR N N 15 116.654 0.019 . 1 . . . . A 152 THR N . 30977 1 1495 . 1 . 1 153 153 SER H H 1 9.454 0.002 . 1 . . . . A 153 SER H . 30977 1 1496 . 1 . 1 153 153 SER HA H 1 4.524 0.020 . 1 . . . . A 153 SER HA . 30977 1 1497 . 1 . 1 153 153 SER HB2 H 1 4.079 0.004 . 1 . . . . A 153 SER HB2 . 30977 1 1498 . 1 . 1 153 153 SER CA C 13 58.728 0.000 . 1 . . . . A 153 SER CA . 30977 1 1499 . 1 . 1 153 153 SER CB C 13 63.697 0.000 . 1 . . . . A 153 SER CB . 30977 1 1500 . 1 . 1 153 153 SER N N 15 116.974 0.036 . 1 . . . . A 153 SER N . 30977 1 1501 . 1 . 1 154 154 LYS H H 1 7.583 0.003 . 1 . . . . A 154 LYS H . 30977 1 1502 . 1 . 1 154 154 LYS HA H 1 4.607 0.027 . 1 . . . . A 154 LYS HA . 30977 1 1503 . 1 . 1 154 154 LYS HB2 H 1 1.472 0.012 . 2 . . . . A 154 LYS HB2 . 30977 1 1504 . 1 . 1 154 154 LYS HB3 H 1 0.912 0.015 . 2 . . . . A 154 LYS HB3 . 30977 1 1505 . 1 . 1 154 154 LYS HG2 H 1 1.267 0.018 . 2 . . . . A 154 LYS HG2 . 30977 1 1506 . 1 . 1 154 154 LYS HG3 H 1 1.452 0.003 . 2 . . . . A 154 LYS HG3 . 30977 1 1507 . 1 . 1 154 154 LYS CA C 13 54.764 0.000 . 1 . . . . A 154 LYS CA . 30977 1 1508 . 1 . 1 154 154 LYS CB C 13 38.679 0.000 . 1 . . . . A 154 LYS CB . 30977 1 1509 . 1 . 1 154 154 LYS CG C 13 26.446 0.000 . 1 . . . . A 154 LYS CG . 30977 1 1510 . 1 . 1 154 154 LYS N N 15 119.458 0.004 . 1 . . . . A 154 LYS N . 30977 1 1511 . 1 . 1 155 155 LYS H H 1 8.831 0.007 . 1 . . . . A 155 LYS H . 30977 1 1512 . 1 . 1 155 155 LYS HA H 1 4.370 0.016 . 1 . . . . A 155 LYS HA . 30977 1 1513 . 1 . 1 155 155 LYS HB2 H 1 1.850 0.016 . 2 . . . . A 155 LYS HB2 . 30977 1 1514 . 1 . 1 155 155 LYS HB3 H 1 1.935 0.012 . 2 . . . . A 155 LYS HB3 . 30977 1 1515 . 1 . 1 155 155 LYS HG2 H 1 1.385 0.017 . 2 . . . . A 155 LYS HG2 . 30977 1 1516 . 1 . 1 155 155 LYS HG3 H 1 1.459 0.007 . 2 . . . . A 155 LYS HG3 . 30977 1 1517 . 1 . 1 155 155 LYS CA C 13 56.464 0.000 . 1 . . . . A 155 LYS CA . 30977 1 1518 . 1 . 1 155 155 LYS CB C 13 32.230 0.000 . 1 . . . . A 155 LYS CB . 30977 1 1519 . 1 . 1 155 155 LYS CG C 13 24.939 0.000 . 1 . . . . A 155 LYS CG . 30977 1 1520 . 1 . 1 155 155 LYS CD C 13 28.990 0.000 . 1 . . . . A 155 LYS CD . 30977 1 1521 . 1 . 1 155 155 LYS CE C 13 41.824 0.000 . 1 . . . . A 155 LYS CE . 30977 1 1522 . 1 . 1 155 155 LYS N N 15 121.670 0.031 . 1 . . . . A 155 LYS N . 30977 1 1523 . 1 . 1 156 156 ILE H H 1 9.637 0.002 . 1 . . . . A 156 ILE H . 30977 1 1524 . 1 . 1 156 156 ILE HA H 1 5.157 0.012 . 1 . . . . A 156 ILE HA . 30977 1 1525 . 1 . 1 156 156 ILE HB H 1 2.404 0.015 . 1 . . . . A 156 ILE HB . 30977 1 1526 . 1 . 1 156 156 ILE HG12 H 1 1.562 0.023 . 1 . . . . A 156 ILE HG12 . 30977 1 1527 . 1 . 1 156 156 ILE HG21 H 1 0.977 0.017 . 1 . . . . A 156 ILE HG21 . 30977 1 1528 . 1 . 1 156 156 ILE HG22 H 1 0.977 0.017 . 1 . . . . A 156 ILE HG22 . 30977 1 1529 . 1 . 1 156 156 ILE HG23 H 1 0.977 0.017 . 1 . . . . A 156 ILE HG23 . 30977 1 1530 . 1 . 1 156 156 ILE HD11 H 1 0.678 0.017 . 1 . . . . A 156 ILE HD11 . 30977 1 1531 . 1 . 1 156 156 ILE HD12 H 1 0.678 0.017 . 1 . . . . A 156 ILE HD12 . 30977 1 1532 . 1 . 1 156 156 ILE HD13 H 1 0.678 0.017 . 1 . . . . A 156 ILE HD13 . 30977 1 1533 . 1 . 1 156 156 ILE CA C 13 59.316 0.000 . 1 . . . . A 156 ILE CA . 30977 1 1534 . 1 . 1 156 156 ILE CB C 13 36.908 0.000 . 1 . . . . A 156 ILE CB . 30977 1 1535 . 1 . 1 156 156 ILE CG1 C 13 26.846 0.000 . 1 . . . . A 156 ILE CG1 . 30977 1 1536 . 1 . 1 156 156 ILE CG2 C 13 19.193 0.000 . 1 . . . . A 156 ILE CG2 . 30977 1 1537 . 1 . 1 156 156 ILE CD1 C 13 13.432 0.000 . 1 . . . . A 156 ILE CD1 . 30977 1 1538 . 1 . 1 156 156 ILE N N 15 134.213 0.042 . 1 . . . . A 156 ILE N . 30977 1 1539 . 1 . 1 157 157 THR H H 1 9.276 0.004 . 1 . . . . A 157 THR H . 30977 1 1540 . 1 . 1 157 157 THR HA H 1 5.344 0.009 . 1 . . . . A 157 THR HA . 30977 1 1541 . 1 . 1 157 157 THR HB H 1 3.932 0.013 . 1 . . . . A 157 THR HB . 30977 1 1542 . 1 . 1 157 157 THR HG21 H 1 1.061 0.018 . 1 . . . . A 157 THR HG21 . 30977 1 1543 . 1 . 1 157 157 THR HG22 H 1 1.061 0.018 . 1 . . . . A 157 THR HG22 . 30977 1 1544 . 1 . 1 157 157 THR HG23 H 1 1.061 0.018 . 1 . . . . A 157 THR HG23 . 30977 1 1545 . 1 . 1 157 157 THR CA C 13 59.388 0.000 . 1 . . . . A 157 THR CA . 30977 1 1546 . 1 . 1 157 157 THR CB C 13 72.843 0.000 . 1 . . . . A 157 THR CB . 30977 1 1547 . 1 . 1 157 157 THR CG2 C 13 22.632 0.000 . 1 . . . . A 157 THR CG2 . 30977 1 1548 . 1 . 1 157 157 THR N N 15 116.976 0.014 . 1 . . . . A 157 THR N . 30977 1 1549 . 1 . 1 158 158 ILE H H 1 8.604 0.003 . 1 . . . . A 158 ILE H . 30977 1 1550 . 1 . 1 158 158 ILE HA H 1 4.303 0.014 . 1 . . . . A 158 ILE HA . 30977 1 1551 . 1 . 1 158 158 ILE HB H 1 1.706 0.020 . 1 . . . . A 158 ILE HB . 30977 1 1552 . 1 . 1 158 158 ILE HG12 H 1 0.373 0.010 . 2 . . . . A 158 ILE HG12 . 30977 1 1553 . 1 . 1 158 158 ILE HG13 H 1 0.422 0.006 . 2 . . . . A 158 ILE HG13 . 30977 1 1554 . 1 . 1 158 158 ILE HG21 H 1 0.351 0.014 . 1 . . . . A 158 ILE HG21 . 30977 1 1555 . 1 . 1 158 158 ILE HG22 H 1 0.351 0.014 . 1 . . . . A 158 ILE HG22 . 30977 1 1556 . 1 . 1 158 158 ILE HG23 H 1 0.351 0.014 . 1 . . . . A 158 ILE HG23 . 30977 1 1557 . 1 . 1 158 158 ILE HD11 H 1 -0.105 0.005 . 1 . . . . A 158 ILE HD11 . 30977 1 1558 . 1 . 1 158 158 ILE HD12 H 1 -0.105 0.005 . 1 . . . . A 158 ILE HD12 . 30977 1 1559 . 1 . 1 158 158 ILE HD13 H 1 -0.105 0.005 . 1 . . . . A 158 ILE HD13 . 30977 1 1560 . 1 . 1 158 158 ILE CA C 13 60.902 0.000 . 1 . . . . A 158 ILE CA . 30977 1 1561 . 1 . 1 158 158 ILE CB C 13 37.050 0.000 . 1 . . . . A 158 ILE CB . 30977 1 1562 . 1 . 1 158 158 ILE CG1 C 13 28.392 0.000 . 1 . . . . A 158 ILE CG1 . 30977 1 1563 . 1 . 1 158 158 ILE CG2 C 13 18.453 0.000 . 1 . . . . A 158 ILE CG2 . 30977 1 1564 . 1 . 1 158 158 ILE CD1 C 13 13.929 0.000 . 1 . . . . A 158 ILE CD1 . 30977 1 1565 . 1 . 1 158 158 ILE N N 15 121.577 0.013 . 1 . . . . A 158 ILE N . 30977 1 1566 . 1 . 1 159 159 ALA H H 1 8.917 0.005 . 1 . . . . A 159 ALA H . 30977 1 1567 . 1 . 1 159 159 ALA HA H 1 4.166 0.015 . 1 . . . . A 159 ALA HA . 30977 1 1568 . 1 . 1 159 159 ALA HB1 H 1 1.331 0.020 . 1 . . . . A 159 ALA HB1 . 30977 1 1569 . 1 . 1 159 159 ALA HB2 H 1 1.331 0.020 . 1 . . . . A 159 ALA HB2 . 30977 1 1570 . 1 . 1 159 159 ALA HB3 H 1 1.331 0.020 . 1 . . . . A 159 ALA HB3 . 30977 1 1571 . 1 . 1 159 159 ALA CA C 13 54.252 0.000 . 1 . . . . A 159 ALA CA . 30977 1 1572 . 1 . 1 159 159 ALA CB C 13 19.299 0.000 . 1 . . . . A 159 ALA CB . 30977 1 1573 . 1 . 1 159 159 ALA N N 15 132.377 0.016 . 1 . . . . A 159 ALA N . 30977 1 1574 . 1 . 1 160 160 ASP H H 1 8.100 0.004 . 1 . . . . A 160 ASP H . 30977 1 1575 . 1 . 1 160 160 ASP HA H 1 4.947 0.023 . 1 . . . . A 160 ASP HA . 30977 1 1576 . 1 . 1 160 160 ASP HB2 H 1 3.061 0.016 . 2 . . . . A 160 ASP HB2 . 30977 1 1577 . 1 . 1 160 160 ASP HB3 H 1 2.937 0.005 . 2 . . . . A 160 ASP HB3 . 30977 1 1578 . 1 . 1 160 160 ASP CA C 13 52.891 0.000 . 1 . . . . A 160 ASP CA . 30977 1 1579 . 1 . 1 160 160 ASP CB C 13 43.766 0.000 . 1 . . . . A 160 ASP CB . 30977 1 1580 . 1 . 1 160 160 ASP N N 15 111.460 0.007 . 1 . . . . A 160 ASP N . 30977 1 1581 . 1 . 1 161 161 CYS H H 1 8.634 0.004 . 1 . . . . A 161 CYS H . 30977 1 1582 . 1 . 1 161 161 CYS HA H 1 4.577 0.018 . 1 . . . . A 161 CYS HA . 30977 1 1583 . 1 . 1 161 161 CYS HB2 H 1 3.294 0.011 . 2 . . . . A 161 CYS HB2 . 30977 1 1584 . 1 . 1 161 161 CYS HB3 H 1 3.161 0.005 . 2 . . . . A 161 CYS HB3 . 30977 1 1585 . 1 . 1 161 161 CYS CA C 13 55.515 0.000 . 1 . . . . A 161 CYS CA . 30977 1 1586 . 1 . 1 161 161 CYS CB C 13 31.459 0.000 . 1 . . . . A 161 CYS CB . 30977 1 1587 . 1 . 1 161 161 CYS N N 15 116.035 0.009 . 1 . . . . A 161 CYS N . 30977 1 1588 . 1 . 1 162 162 GLY H H 1 6.856 0.007 . 1 . . . . A 162 GLY H . 30977 1 1589 . 1 . 1 162 162 GLY HA2 H 1 3.929 0.014 . 2 . . . . A 162 GLY HA2 . 30977 1 1590 . 1 . 1 162 162 GLY HA3 H 1 3.590 0.021 . 2 . . . . A 162 GLY HA3 . 30977 1 1591 . 1 . 1 162 162 GLY CA C 13 45.667 0.000 . 1 . . . . A 162 GLY CA . 30977 1 1592 . 1 . 1 162 162 GLY N N 15 104.087 0.015 . 1 . . . . A 162 GLY N . 30977 1 1593 . 1 . 1 163 163 GLN H H 1 9.123 0.006 . 1 . . . . A 163 GLN H . 30977 1 1594 . 1 . 1 163 163 GLN HA H 1 5.106 0.013 . 1 . . . . A 163 GLN HA . 30977 1 1595 . 1 . 1 163 163 GLN HB2 H 1 1.806 0.017 . 2 . . . . A 163 GLN HB2 . 30977 1 1596 . 1 . 1 163 163 GLN HB3 H 1 1.999 0.020 . 2 . . . . A 163 GLN HB3 . 30977 1 1597 . 1 . 1 163 163 GLN HG2 H 1 2.590 0.020 . 2 . . . . A 163 GLN HG2 . 30977 1 1598 . 1 . 1 163 163 GLN HG3 H 1 2.652 0.000 . 2 . . . . A 163 GLN HG3 . 30977 1 1599 . 1 . 1 163 163 GLN HE21 H 1 7.230 0.001 . 1 . . . . A 163 GLN HE21 . 30977 1 1600 . 1 . 1 163 163 GLN HE22 H 1 8.190 0.002 . 1 . . . . A 163 GLN HE22 . 30977 1 1601 . 1 . 1 163 163 GLN CA C 13 55.186 0.000 . 1 . . . . A 163 GLN CA . 30977 1 1602 . 1 . 1 163 163 GLN CB C 13 30.789 0.000 . 1 . . . . A 163 GLN CB . 30977 1 1603 . 1 . 1 163 163 GLN CG C 13 33.483 0.000 . 1 . . . . A 163 GLN CG . 30977 1 1604 . 1 . 1 163 163 GLN N N 15 121.045 0.012 . 1 . . . . A 163 GLN N . 30977 1 1605 . 1 . 1 163 163 GLN NE2 N 15 110.781 0.016 . 1 . . . . A 163 GLN NE2 . 30977 1 1606 . 1 . 1 164 164 LEU H H 1 8.660 0.007 . 1 . . . . A 164 LEU H . 30977 1 1607 . 1 . 1 164 164 LEU HA H 1 4.672 0.016 . 1 . . . . A 164 LEU HA . 30977 1 1608 . 1 . 1 164 164 LEU HB2 H 1 1.686 0.010 . 2 . . . . A 164 LEU HB2 . 30977 1 1609 . 1 . 1 164 164 LEU HB3 H 1 1.727 0.004 . 2 . . . . A 164 LEU HB3 . 30977 1 1610 . 1 . 1 164 164 LEU HD11 H 1 0.889 0.017 . 2 . . . . A 164 LEU HD11 . 30977 1 1611 . 1 . 1 164 164 LEU HD12 H 1 0.889 0.017 . 2 . . . . A 164 LEU HD12 . 30977 1 1612 . 1 . 1 164 164 LEU HD13 H 1 0.889 0.017 . 2 . . . . A 164 LEU HD13 . 30977 1 1613 . 1 . 1 164 164 LEU HD21 H 1 0.817 0.018 . 2 . . . . A 164 LEU HD21 . 30977 1 1614 . 1 . 1 164 164 LEU HD22 H 1 0.817 0.018 . 2 . . . . A 164 LEU HD22 . 30977 1 1615 . 1 . 1 164 164 LEU HD23 H 1 0.817 0.018 . 2 . . . . A 164 LEU HD23 . 30977 1 1616 . 1 . 1 164 164 LEU CA C 13 55.079 0.000 . 1 . . . . A 164 LEU CA . 30977 1 1617 . 1 . 1 164 164 LEU CB C 13 43.523 0.000 . 1 . . . . A 164 LEU CB . 30977 1 1618 . 1 . 1 164 164 LEU CG C 13 27.220 0.000 . 1 . . . . A 164 LEU CG . 30977 1 1619 . 1 . 1 164 164 LEU CD1 C 13 23.467 0.000 . 2 . . . . A 164 LEU CD1 . 30977 1 1620 . 1 . 1 164 164 LEU CD2 C 13 25.386 0.000 . 2 . . . . A 164 LEU CD2 . 30977 1 1621 . 1 . 1 164 164 LEU N N 15 125.936 0.008 . 1 . . . . A 164 LEU N . 30977 1 1622 . 1 . 1 165 165 GLU H H 1 8.154 0.003 . 1 . . . . A 165 GLU H . 30977 1 1623 . 1 . 1 165 165 GLU CA C 13 58.139 0.025 . 1 . . . . A 165 GLU CA . 30977 1 1624 . 1 . 1 165 165 GLU CB C 13 31.802 0.000 . 1 . . . . A 165 GLU CB . 30977 1 1625 . 1 . 1 165 165 GLU N N 15 125.437 0.026 . 1 . . . . A 165 GLU N . 30977 1 stop_ save_