data_16767 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16767 _Entry.Title ; Human Regenerating Gene Type IV (REG IV) PROTEIN, P91S mutant ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-03-04 _Entry.Accession_date 2010-03-04 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Meng-Ru Ho . . . 16767 2 Yuan-Chao Lou . . . 16767 3 Chinpan Chen . . . 16767 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 16767 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'C-type lectin' . 16767 GISP . 16767 'Reg 4' . 16767 'Reg IV' . 16767 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16767 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 523 16767 '15N chemical shifts' 145 16767 '1H chemical shifts' 805 16767 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2010-09-29 2010-03-04 update BMRB 'Update entry citation' 16767 1 . . 2010-08-12 2010-03-04 original author 'original release' 16767 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2KV3 'BMRB Entry Tracking System' 16767 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16767 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 20692269 _Citation.Full_citation . _Citation.Title 'Human RegIV Protein Adopts a Typical C-Type Lectin Fold but Binds Mannan with Two Calcium-Independent Sites.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full 'Journal of molecular biology' _Citation.Journal_volume 402 _Citation.Journal_issue 4 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 682 _Citation.Page_last 695 _Citation.Year 2010 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Meng-Ru Ho . . . 16767 1 2 Yuan-Chao Lou . . . 16767 1 3 Shu-Yi Wei . . . 16767 1 4 Shih-Chi Luo . . . 16767 1 5 Wen-Chang Lin . . . 16767 1 6 Ping-Chiang Lyu . . . 16767 1 7 Chinpan Chen . . . 16767 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16767 _Assembly.ID 1 _Assembly.Name 'Reg IV' _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 P91S 1 $entity A . yes native no no . . . 16767 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 16767 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name P91S _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 ; QSCAPGWFYHKSNCYGYFRK LRNWSDAELECQSYGNGAHL ASILSLKEASTIAEYISGYQ RSQSIWIGLHDPQKRQQWQW IDGAMYLYRSWSGKSMGGNK HCAEMSSNNNFLTWSSNECN KRQHFLCKYR ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 130 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 16301 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details 'P91S mutant' _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2KV3 . "Human Regenerating Gene Type Iv (Reg Iv) Protein, P91s Mutant" . . . . . 100.00 131 100.00 100.00 3.73e-90 . . . . 16767 1 2 no GB AAG02562 . "regenerating gene type IV [Homo sapiens]" . . . . . 99.23 158 99.22 99.22 2.02e-89 . . . . 16767 1 3 no GB AAH17089 . "Regenerating islet-derived family, member 4 [Homo sapiens]" . . . . . 99.23 158 99.22 99.22 2.02e-89 . . . . 16767 1 4 no GB AAK48435 . "gastrointestinal secretory protein GISP [Homo sapiens]" . . . . . 99.23 158 99.22 99.22 2.02e-89 . . . . 16767 1 5 no GB AAK59869 . "regenerating gene type IV [Homo sapiens]" . . . . . 99.23 158 99.22 99.22 2.02e-89 . . . . 16767 1 6 no GB AAM95598 . "REG-like protein [Homo sapiens]" . . . . . 99.23 158 99.22 99.22 2.02e-89 . . . . 16767 1 7 no REF NP_001152824 . "regenerating islet-derived protein 4 isoform 1 precursor [Homo sapiens]" . . . . . 99.23 158 99.22 99.22 2.02e-89 . . . . 16767 1 8 no REF NP_114433 . "regenerating islet-derived protein 4 isoform 1 precursor [Homo sapiens]" . . . . . 99.23 158 99.22 99.22 2.02e-89 . . . . 16767 1 9 no REF XP_001139975 . "PREDICTED: regenerating islet-derived protein 4 [Pan troglodytes]" . . . . . 99.23 158 98.45 99.22 6.79e-89 . . . . 16767 1 10 no REF XP_003268113 . "PREDICTED: regenerating islet-derived protein 4 isoform X2 [Nomascus leucogenys]" . . . . . 99.23 158 96.90 97.67 5.17e-88 . . . . 16767 1 11 no REF XP_003268114 . "PREDICTED: regenerating islet-derived protein 4 isoform X2 [Nomascus leucogenys]" . . . . . 99.23 158 96.90 97.67 5.17e-88 . . . . 16767 1 12 no SP Q9BYZ8 . "RecName: Full=Regenerating islet-derived protein 4; Short=REG-4; AltName: Full=Gastrointestinal secretory protein; AltName: Ful" . . . . . 99.23 158 99.22 99.22 2.02e-89 . . . . 16767 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 . GLN . 16767 1 2 . SER . 16767 1 3 . CYS . 16767 1 4 . ALA . 16767 1 5 . PRO . 16767 1 6 . GLY . 16767 1 7 . TRP . 16767 1 8 . PHE . 16767 1 9 . TYR . 16767 1 10 . HIS . 16767 1 11 . LYS . 16767 1 12 . SER . 16767 1 13 . ASN . 16767 1 14 . CYS . 16767 1 15 . TYR . 16767 1 16 . GLY . 16767 1 17 . TYR . 16767 1 18 . PHE . 16767 1 19 . ARG . 16767 1 20 . LYS . 16767 1 21 . LEU . 16767 1 22 . ARG . 16767 1 23 . ASN . 16767 1 24 . TRP . 16767 1 25 . SER . 16767 1 26 . ASP . 16767 1 27 . ALA . 16767 1 28 . GLU . 16767 1 29 . LEU . 16767 1 30 . GLU . 16767 1 31 . CYS . 16767 1 32 . GLN . 16767 1 33 . SER . 16767 1 34 . TYR . 16767 1 35 . GLY . 16767 1 36 . ASN . 16767 1 37 . GLY . 16767 1 38 . ALA . 16767 1 39 . HIS . 16767 1 40 . LEU . 16767 1 41 . ALA . 16767 1 42 . SER . 16767 1 43 . ILE . 16767 1 44 . LEU . 16767 1 45 . SER . 16767 1 46 . LEU . 16767 1 47 . LYS . 16767 1 48 . GLU . 16767 1 49 . ALA . 16767 1 50 . SER . 16767 1 51 . THR . 16767 1 52 . ILE . 16767 1 53 . ALA . 16767 1 54 . GLU . 16767 1 55 . TYR . 16767 1 56 . ILE . 16767 1 57 . SER . 16767 1 58 . GLY . 16767 1 59 . TYR . 16767 1 60 . GLN . 16767 1 61 . ARG . 16767 1 62 . SER . 16767 1 63 . GLN . 16767 1 64 . SER . 16767 1 65 . ILE . 16767 1 66 . TRP . 16767 1 67 . ILE . 16767 1 68 . GLY . 16767 1 69 . LEU . 16767 1 70 . HIS . 16767 1 71 . ASP . 16767 1 72 . PRO . 16767 1 73 . GLN . 16767 1 74 . LYS . 16767 1 75 . ARG . 16767 1 76 . GLN . 16767 1 77 . GLN . 16767 1 78 . TRP . 16767 1 79 . GLN . 16767 1 80 . TRP . 16767 1 81 . ILE . 16767 1 82 . ASP . 16767 1 83 . GLY . 16767 1 84 . ALA . 16767 1 85 . MET . 16767 1 86 . TYR . 16767 1 87 . LEU . 16767 1 88 . TYR . 16767 1 89 . ARG . 16767 1 90 . SER . 16767 1 91 . TRP . 16767 1 92 . SER . 16767 1 93 . GLY . 16767 1 94 . LYS . 16767 1 95 . SER . 16767 1 96 . MET . 16767 1 97 . GLY . 16767 1 98 . GLY . 16767 1 99 . ASN . 16767 1 100 . LYS . 16767 1 101 . HIS . 16767 1 102 . CYS . 16767 1 103 . ALA . 16767 1 104 . GLU . 16767 1 105 . MET . 16767 1 106 . SER . 16767 1 107 . SER . 16767 1 108 . ASN . 16767 1 109 . ASN . 16767 1 110 . ASN . 16767 1 111 . PHE . 16767 1 112 . LEU . 16767 1 113 . THR . 16767 1 114 . TRP . 16767 1 115 . SER . 16767 1 116 . SER . 16767 1 117 . ASN . 16767 1 118 . GLU . 16767 1 119 . CYS . 16767 1 120 . ASN . 16767 1 121 . LYS . 16767 1 122 . ARG . 16767 1 123 . GLN . 16767 1 124 . HIS . 16767 1 125 . PHE . 16767 1 126 . LEU . 16767 1 127 . CYS . 16767 1 128 . LYS . 16767 1 129 . TYR . 16767 1 130 . ARG . 16767 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 . GLN 1 1 16767 1 . SER 2 2 16767 1 . CYS 3 3 16767 1 . ALA 4 4 16767 1 . PRO 5 5 16767 1 . GLY 6 6 16767 1 . TRP 7 7 16767 1 . PHE 8 8 16767 1 . TYR 9 9 16767 1 . HIS 10 10 16767 1 . LYS 11 11 16767 1 . SER 12 12 16767 1 . ASN 13 13 16767 1 . CYS 14 14 16767 1 . TYR 15 15 16767 1 . GLY 16 16 16767 1 . TYR 17 17 16767 1 . PHE 18 18 16767 1 . ARG 19 19 16767 1 . LYS 20 20 16767 1 . LEU 21 21 16767 1 . ARG 22 22 16767 1 . ASN 23 23 16767 1 . TRP 24 24 16767 1 . SER 25 25 16767 1 . ASP 26 26 16767 1 . ALA 27 27 16767 1 . GLU 28 28 16767 1 . LEU 29 29 16767 1 . GLU 30 30 16767 1 . CYS 31 31 16767 1 . GLN 32 32 16767 1 . SER 33 33 16767 1 . TYR 34 34 16767 1 . GLY 35 35 16767 1 . ASN 36 36 16767 1 . GLY 37 37 16767 1 . ALA 38 38 16767 1 . HIS 39 39 16767 1 . LEU 40 40 16767 1 . ALA 41 41 16767 1 . SER 42 42 16767 1 . ILE 43 43 16767 1 . LEU 44 44 16767 1 . SER 45 45 16767 1 . LEU 46 46 16767 1 . LYS 47 47 16767 1 . GLU 48 48 16767 1 . ALA 49 49 16767 1 . SER 50 50 16767 1 . THR 51 51 16767 1 . ILE 52 52 16767 1 . ALA 53 53 16767 1 . GLU 54 54 16767 1 . TYR 55 55 16767 1 . ILE 56 56 16767 1 . SER 57 57 16767 1 . GLY 58 58 16767 1 . TYR 59 59 16767 1 . GLN 60 60 16767 1 . ARG 61 61 16767 1 . SER 62 62 16767 1 . GLN 63 63 16767 1 . SER 64 64 16767 1 . ILE 65 65 16767 1 . TRP 66 66 16767 1 . ILE 67 67 16767 1 . GLY 68 68 16767 1 . LEU 69 69 16767 1 . HIS 70 70 16767 1 . ASP 71 71 16767 1 . PRO 72 72 16767 1 . GLN 73 73 16767 1 . LYS 74 74 16767 1 . ARG 75 75 16767 1 . GLN 76 76 16767 1 . GLN 77 77 16767 1 . TRP 78 78 16767 1 . GLN 79 79 16767 1 . TRP 80 80 16767 1 . ILE 81 81 16767 1 . ASP 82 82 16767 1 . GLY 83 83 16767 1 . ALA 84 84 16767 1 . MET 85 85 16767 1 . TYR 86 86 16767 1 . LEU 87 87 16767 1 . TYR 88 88 16767 1 . ARG 89 89 16767 1 . SER 90 90 16767 1 . TRP 91 91 16767 1 . SER 92 92 16767 1 . GLY 93 93 16767 1 . LYS 94 94 16767 1 . SER 95 95 16767 1 . MET 96 96 16767 1 . GLY 97 97 16767 1 . GLY 98 98 16767 1 . ASN 99 99 16767 1 . LYS 100 100 16767 1 . HIS 101 101 16767 1 . CYS 102 102 16767 1 . ALA 103 103 16767 1 . GLU 104 104 16767 1 . MET 105 105 16767 1 . SER 106 106 16767 1 . SER 107 107 16767 1 . ASN 108 108 16767 1 . ASN 109 109 16767 1 . ASN 110 110 16767 1 . PHE 111 111 16767 1 . LEU 112 112 16767 1 . THR 113 113 16767 1 . TRP 114 114 16767 1 . SER 115 115 16767 1 . SER 116 116 16767 1 . ASN 117 117 16767 1 . GLU 118 118 16767 1 . CYS 119 119 16767 1 . ASN 120 120 16767 1 . LYS 121 121 16767 1 . ARG 122 122 16767 1 . GLN 123 123 16767 1 . HIS 124 124 16767 1 . PHE 125 125 16767 1 . LEU 126 126 16767 1 . CYS 127 127 16767 1 . LYS 128 128 16767 1 . TYR 129 129 16767 1 . ARG 130 130 16767 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 16767 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 16767 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 16767 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pQE1 . . . . . . 16767 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16767 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Human Regenerating Gene Type IV' '[U-99% 15N]' . . 1 $entity . . 1 . . mM . . . . 16767 1 2 'Human Regenerating Gene Type IV' '[U-99% 13C; U-99% 15N]' . . 1 $entity . . 1 . . mM . . . . 16767 1 3 H2O 'natural abundance' . . . . . . 90 . . % . . . . 16767 1 4 D2O 'natural abundance' . . . . . . 10 . . % . . . . 16767 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 16767 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.1 . M 16767 1 pH 4.5 . pH 16767 1 pressure 1 . atm 16767 1 temperature 310 . K 16767 1 stop_ save_ ############################ # Computer software used # ############################ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 16767 _Software.ID 1 _Software.Name 'X-PLOR NIH' _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 16767 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 16767 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 16767 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 16767 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 16767 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 16767 1 2 spectrometer_2 Bruker Avance . 800 . . . 16767 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 16767 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16767 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16767 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16767 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16767 1 5 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16767 1 6 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16767 1 7 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16767 1 8 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16767 1 9 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16767 1 10 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16767 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 16767 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . 1 $entry_citation . . 1 $entry_citation 16767 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . 1 $entry_citation . . 1 $entry_citation 16767 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . 1 $entry_citation . . 1 $entry_citation 16767 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_assignments_chemical_shifts _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assignments_chemical_shifts _Assigned_chem_shift_list.Entry_ID 16767 _Assigned_chem_shift_list.ID 1 _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 $chemical_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' . . . 16767 1 3 '3D CBCA(CO)NH' . . . 16767 1 5 '3D HNCACB' . . . 16767 1 8 '3D HCCH-TOCSY' . . . 16767 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 GLN HA H 1 4.205 . . 1 . . 1 . 1 GLN HA . 16767 1 2 . 1 1 1 1 GLN HB2 H 1 1.878 . . 2 . . 1 . 1 GLN HB1 . 16767 1 3 . 1 1 1 1 GLN HB3 H 1 1.792 . . 2 . . 1 . 1 GLN HB2 . 16767 1 4 . 1 1 1 1 GLN C C 13 174.687 . . 1 . . 1 . 1 GLN C . 16767 1 5 . 1 1 1 1 GLN CA C 13 54.603 . . 1 . . 1 . 1 GLN CA . 16767 1 6 . 1 1 1 1 GLN CB C 13 28.355 . . 1 . . 1 . 1 GLN CB . 16767 1 7 . 1 1 1 1 GLN CG C 13 32.961 . . 1 . . 1 . 1 GLN CG . 16767 1 8 . 1 1 2 2 SER H H 1 7.940 . . 1 . . 1 . 2 SER HN . 16767 1 9 . 1 1 2 2 SER HA H 1 4.236 . . 1 . . 1 . 2 SER HA . 16767 1 10 . 1 1 2 2 SER HB2 H 1 3.629 . . 2 . . 1 . 2 SER HB1 . 16767 1 11 . 1 1 2 2 SER HB3 H 1 3.625 . . 2 . . 1 . 2 SER HB2 . 16767 1 12 . 1 1 2 2 SER C C 13 173.751 . . 1 . . 1 . 2 SER C . 16767 1 13 . 1 1 2 2 SER CA C 13 57.381 . . 1 . . 1 . 2 SER CA . 16767 1 14 . 1 1 2 2 SER CB C 13 63.630 . . 1 . . 1 . 2 SER CB . 16767 1 15 . 1 1 2 2 SER N N 15 115.293 . . 1 . . 1 . 2 SER N . 16767 1 16 . 1 1 3 3 CYS H H 1 8.432 . . 1 . . 1 . 3 CYS HN . 16767 1 17 . 1 1 3 3 CYS HA H 1 4.791 . . 1 . . 1 . 3 CYS HA . 16767 1 18 . 1 1 3 3 CYS HB2 H 1 2.745 . . 2 . . 1 . 3 CYS HB1 . 16767 1 19 . 1 1 3 3 CYS HB3 H 1 2.948 . . 2 . . 1 . 3 CYS HB2 . 16767 1 20 . 1 1 3 3 CYS C C 13 173.589 . . 1 . . 1 . 3 CYS C . 16767 1 21 . 1 1 3 3 CYS CA C 13 57.278 . . 1 . . 1 . 3 CYS CA . 16767 1 22 . 1 1 3 3 CYS CB C 13 41.566 . . 1 . . 1 . 3 CYS CB . 16767 1 23 . 1 1 3 3 CYS N N 15 117.458 . . 1 . . 1 . 3 CYS N . 16767 1 24 . 1 1 4 4 ALA H H 1 7.137 . . 1 . . 1 . 4 ALA HN . 16767 1 25 . 1 1 4 4 ALA HA H 1 4.351 . . 1 . . 1 . 4 ALA HA . 16767 1 26 . 1 1 4 4 ALA HB1 H 1 0.888 . . 1 . . 1 . 4 ALA HB1 . 16767 1 27 . 1 1 4 4 ALA HB2 H 1 0.888 . . 1 . . 1 . 4 ALA HB1 . 16767 1 28 . 1 1 4 4 ALA HB3 H 1 0.888 . . 1 . . 1 . 4 ALA HB1 . 16767 1 29 . 1 1 4 4 ALA CA C 13 50.477 . . 1 . . 1 . 4 ALA CA . 16767 1 30 . 1 1 4 4 ALA CB C 13 15.381 . . 1 . . 1 . 4 ALA CB . 16767 1 31 . 1 1 4 4 ALA N N 15 124.507 . . 1 . . 1 . 4 ALA N . 16767 1 32 . 1 1 5 5 PRO HA H 1 4.401 . . 1 . . 1 . 5 PRO HA . 16767 1 33 . 1 1 5 5 PRO HB2 H 1 2.354 . . 2 . . 1 . 5 PRO HB1 . 16767 1 34 . 1 1 5 5 PRO HB3 H 1 1.964 . . 2 . . 1 . 5 PRO HB2 . 16767 1 35 . 1 1 5 5 PRO HD2 H 1 4.741 . . 2 . . 1 . 5 PRO HD1 . 16767 1 36 . 1 1 5 5 PRO HD3 H 1 4.797 . . 2 . . 1 . 5 PRO HD2 . 16767 1 37 . 1 1 5 5 PRO HG2 H 1 2.041 . . 2 . . 1 . 5 PRO HG1 . 16767 1 38 . 1 1 5 5 PRO HG3 H 1 2.158 . . 2 . . 1 . 5 PRO HG2 . 16767 1 39 . 1 1 5 5 PRO C C 13 178.269 . . 1 . . 1 . 5 PRO C . 16767 1 40 . 1 1 5 5 PRO CA C 13 63.814 . . 1 . . 1 . 5 PRO CA . 16767 1 41 . 1 1 5 5 PRO CB C 13 30.671 . . 1 . . 1 . 5 PRO CB . 16767 1 42 . 1 1 5 5 PRO CD C 13 49.587 . . 1 . . 1 . 5 PRO CD . 16767 1 43 . 1 1 5 5 PRO CG C 13 27.315 . . 1 . . 1 . 5 PRO CG . 16767 1 44 . 1 1 6 6 GLY H H 1 8.942 . . 1 . . 1 . 6 GLY HN . 16767 1 45 . 1 1 6 6 GLY HA2 H 1 3.705 . . 2 . . 1 . 6 GLY HA1 . 16767 1 46 . 1 1 6 6 GLY HA3 H 1 4.402 . . 2 . . 1 . 6 GLY HA2 . 16767 1 47 . 1 1 6 6 GLY C C 13 174.831 . . 1 . . 1 . 6 GLY C . 16767 1 48 . 1 1 6 6 GLY CA C 13 44.587 . . 1 . . 1 . 6 GLY CA . 16767 1 49 . 1 1 6 6 GLY N N 15 112.670 . . 1 . . 1 . 6 GLY N . 16767 1 50 . 1 1 7 7 TRP H H 1 8.459 . . 1 . . 1 . 7 TRP HN . 16767 1 51 . 1 1 7 7 TRP HA H 1 4.814 . . 1 . . 1 . 7 TRP HA . 16767 1 52 . 1 1 7 7 TRP HB2 H 1 3.393 . . 2 . . 1 . 7 TRP HB1 . 16767 1 53 . 1 1 7 7 TRP HB3 H 1 2.924 . . 2 . . 1 . 7 TRP HB2 . 16767 1 54 . 1 1 7 7 TRP HD1 H 1 7.197 . . 1 . . 1 . 7 TRP HD1 . 16767 1 55 . 1 1 7 7 TRP HE1 H 1 9.789 . . 3 . . 1 . 7 TRP HE1 . 16767 1 56 . 1 1 7 7 TRP CA C 13 56.672 . . 1 . . 1 . 7 TRP CA . 16767 1 57 . 1 1 7 7 TRP CB C 13 27.741 . . 1 . . 1 . 7 TRP CB . 16767 1 58 . 1 1 7 7 TRP CD1 C 13 124.558 . . 3 . . 1 . 7 TRP CD1 . 16767 1 59 . 1 1 7 7 TRP N N 15 122.685 . . 1 . . 1 . 7 TRP N . 16767 1 60 . 1 1 7 7 TRP NE1 N 15 130.316 . . 1 . . 1 . 7 TRP NE1 . 16767 1 61 . 1 1 8 8 PHE H H 1 9.765 . . 1 . . 1 . 8 PHE HN . 16767 1 62 . 1 1 8 8 PHE HA H 1 4.915 . . 1 . . 1 . 8 PHE HA . 16767 1 63 . 1 1 8 8 PHE HB2 H 1 2.714 . . 2 . . 1 . 8 PHE HB1 . 16767 1 64 . 1 1 8 8 PHE HB3 H 1 2.433 . . 2 . . 1 . 8 PHE HB2 . 16767 1 65 . 1 1 8 8 PHE HD1 H 1 6.641 . . 3 . . 1 . 8 PHE HD1 . 16767 1 66 . 1 1 8 8 PHE HD2 H 1 6.641 . . 3 . . 1 . 8 PHE HD2 . 16767 1 67 . 1 1 8 8 PHE HE1 H 1 6.728 . . 3 . . 1 . 8 PHE HE1 . 16767 1 68 . 1 1 8 8 PHE HE2 H 1 6.728 . . 3 . . 1 . 8 PHE HE2 . 16767 1 69 . 1 1 8 8 PHE C C 13 173.517 . . 1 . . 1 . 8 PHE C . 16767 1 70 . 1 1 8 8 PHE CA C 13 55.116 . . 1 . . 1 . 8 PHE CA . 16767 1 71 . 1 1 8 8 PHE CB C 13 41.108 . . 1 . . 1 . 8 PHE CB . 16767 1 72 . 1 1 8 8 PHE CD1 C 13 131.761 . . 3 . . 1 . 8 PHE CD1 . 16767 1 73 . 1 1 8 8 PHE CD2 C 13 131.761 . . 3 . . 1 . 8 PHE CD2 . 16767 1 74 . 1 1 8 8 PHE CE1 C 13 130.237 . . 3 . . 1 . 8 PHE CE1 . 16767 1 75 . 1 1 8 8 PHE CE2 C 13 130.237 . . 3 . . 1 . 8 PHE CE2 . 16767 1 76 . 1 1 8 8 PHE N N 15 124.340 . . 1 . . 1 . 8 PHE N . 16767 1 77 . 1 1 9 9 TYR H H 1 8.406 . . 1 . . 1 . 9 TYR HN . 16767 1 78 . 1 1 9 9 TYR HA H 1 5.087 . . 1 . . 1 . 9 TYR HA . 16767 1 79 . 1 1 9 9 TYR HB2 H 1 3.065 . . 2 . . 1 . 9 TYR HB1 . 16767 1 80 . 1 1 9 9 TYR HB3 H 1 2.714 . . 2 . . 1 . 9 TYR HB2 . 16767 1 81 . 1 1 9 9 TYR HD1 H 1 6.876 . . 3 . . 1 . 9 TYR HD1 . 16767 1 82 . 1 1 9 9 TYR HD2 H 1 6.876 . . 3 . . 1 . 9 TYR HD2 . 16767 1 83 . 1 1 9 9 TYR HE1 H 1 6.536 . . 3 . . 1 . 9 TYR HE1 . 16767 1 84 . 1 1 9 9 TYR HE2 H 1 6.536 . . 3 . . 1 . 9 TYR HE2 . 16767 1 85 . 1 1 9 9 TYR C C 13 175.173 . . 1 . . 1 . 9 TYR C . 16767 1 86 . 1 1 9 9 TYR CA C 13 56.306 . . 1 . . 1 . 9 TYR CA . 16767 1 87 . 1 1 9 9 TYR CB C 13 39.185 . . 1 . . 1 . 9 TYR CB . 16767 1 88 . 1 1 9 9 TYR CD1 C 13 131.761 . . 3 . . 1 . 9 TYR CD1 . 16767 1 89 . 1 1 9 9 TYR CD2 C 13 131.761 . . 3 . . 1 . 9 TYR CD2 . 16767 1 90 . 1 1 9 9 TYR CE1 C 13 117.433 . . 3 . . 1 . 9 TYR CE1 . 16767 1 91 . 1 1 9 9 TYR CE2 C 13 117.433 . . 3 . . 1 . 9 TYR CE2 . 16767 1 92 . 1 1 9 9 TYR N N 15 127.880 . . 1 . . 1 . 9 TYR N . 16767 1 93 . 1 1 10 10 HIS H H 1 8.451 . . 1 . . 1 . 10 HIS HN . 16767 1 94 . 1 1 10 10 HIS HA H 1 3.971 . . 1 . . 1 . 10 HIS HA . 16767 1 95 . 1 1 10 10 HIS HB2 H 1 2.737 . . 2 . . 1 . 10 HIS HB1 . 16767 1 96 . 1 1 10 10 HIS HB3 H 1 2.698 . . 2 . . 1 . 10 HIS HB2 . 16767 1 97 . 1 1 10 10 HIS HD2 H 1 6.892 . . 3 . . 1 . 10 HIS HD2 . 16767 1 98 . 1 1 10 10 HIS C C 13 173.373 . . 1 . . 1 . 10 HIS C . 16767 1 99 . 1 1 10 10 HIS CA C 13 56.581 . . 1 . . 1 . 10 HIS CA . 16767 1 100 . 1 1 10 10 HIS CB C 13 30.488 . . 1 . . 1 . 10 HIS CB . 16767 1 101 . 1 1 10 10 HIS N N 15 123.978 . . 1 . . 1 . 10 HIS N . 16767 1 102 . 1 1 11 11 LYS H H 1 8.854 . . 1 . . 1 . 11 LYS HN . 16767 1 103 . 1 1 11 11 LYS HA H 1 3.971 . . 1 . . 1 . 11 LYS HA . 16767 1 104 . 1 1 11 11 LYS HB2 H 1 1.644 . . 2 . . 1 . 11 LYS HB1 . 16767 1 105 . 1 1 11 11 LYS HB3 H 1 0.894 . . 2 . . 1 . 11 LYS HB2 . 16767 1 106 . 1 1 11 11 LYS HD2 H 1 1.454 . . 2 . . 1 . 11 LYS HD1 . 16767 1 107 . 1 1 11 11 LYS HD3 H 1 1.454 . . 2 . . 1 . 11 LYS HD2 . 16767 1 108 . 1 1 11 11 LYS HE2 H 1 2.836 . . 2 . . 1 . 11 LYS HE1 . 16767 1 109 . 1 1 11 11 LYS HE3 H 1 2.836 . . 2 . . 1 . 11 LYS HE2 . 16767 1 110 . 1 1 11 11 LYS HG2 H 1 0.822 . . 2 . . 1 . 11 LYS HG1 . 16767 1 111 . 1 1 11 11 LYS HG3 H 1 0.783 . . 2 . . 1 . 11 LYS HG2 . 16767 1 112 . 1 1 11 11 LYS C C 13 174.687 . . 1 . . 1 . 11 LYS C . 16767 1 113 . 1 1 11 11 LYS CA C 13 56.581 . . 1 . . 1 . 11 LYS CA . 16767 1 114 . 1 1 11 11 LYS CB C 13 30.488 . . 1 . . 1 . 11 LYS CB . 16767 1 115 . 1 1 11 11 LYS CD C 13 27.785 . . 1 . . 1 . 11 LYS CD . 16767 1 116 . 1 1 11 11 LYS CE C 13 41.274 . . 1 . . 1 . 11 LYS CE . 16767 1 117 . 1 1 11 11 LYS CG C 13 24.021 . . 1 . . 1 . 11 LYS CG . 16767 1 118 . 1 1 11 11 LYS N N 15 129.219 . . 1 . . 1 . 11 LYS N . 16767 1 119 . 1 1 12 12 SER H H 1 6.898 . . 1 . . 1 . 12 SER HN . 16767 1 120 . 1 1 12 12 SER HA H 1 4.096 . . 1 . . 1 . 12 SER HA . 16767 1 121 . 1 1 12 12 SER HB2 H 1 3.955 . . 2 . . 1 . 12 SER HB1 . 16767 1 122 . 1 1 12 12 SER HB3 H 1 3.955 . . 2 . . 1 . 12 SER HB2 . 16767 1 123 . 1 1 12 12 SER C C 13 171.393 . . 1 . . 1 . 12 SER C . 16767 1 124 . 1 1 12 12 SER CA C 13 59.602 . . 1 . . 1 . 12 SER CA . 16767 1 125 . 1 1 12 12 SER CB C 13 61.067 . . 1 . . 1 . 12 SER CB . 16767 1 126 . 1 1 12 12 SER N N 15 105.906 . . 1 . . 1 . 12 SER N . 16767 1 127 . 1 1 13 13 ASN H H 1 7.440 . . 1 . . 1 . 13 ASN HN . 16767 1 128 . 1 1 13 13 ASN HA H 1 4.994 . . 1 . . 1 . 13 ASN HA . 16767 1 129 . 1 1 13 13 ASN HB2 H 1 2.495 . . 2 . . 1 . 13 ASN HB1 . 16767 1 130 . 1 1 13 13 ASN HB3 H 1 1.581 . . 2 . . 1 . 13 ASN HB2 . 16767 1 131 . 1 1 13 13 ASN HD21 H 1 7.113 . . 2 . . 1 . 13 ASN HD21 . 16767 1 132 . 1 1 13 13 ASN HD22 H 1 6.570 . . 2 . . 1 . 13 ASN HD22 . 16767 1 133 . 1 1 13 13 ASN C C 13 171.645 . . 1 . . 1 . 13 ASN C . 16767 1 134 . 1 1 13 13 ASN CA C 13 51.728 . . 1 . . 1 . 13 ASN CA . 16767 1 135 . 1 1 13 13 ASN CB C 13 43.672 . . 1 . . 1 . 13 ASN CB . 16767 1 136 . 1 1 13 13 ASN N N 15 116.308 . . 1 . . 1 . 13 ASN N . 16767 1 137 . 1 1 13 13 ASN ND2 N 15 113.187 . . 1 . . 1 . 13 ASN ND2 . 16767 1 138 . 1 1 14 14 CYS H H 1 8.657 . . 1 . . 1 . 14 CYS HN . 16767 1 139 . 1 1 14 14 CYS HA H 1 5.306 . . 1 . . 1 . 14 CYS HA . 16767 1 140 . 1 1 14 14 CYS HB2 H 1 2.284 . . 2 . . 1 . 14 CYS HB1 . 16767 1 141 . 1 1 14 14 CYS HB3 H 1 1.265 . . 2 . . 1 . 14 CYS HB2 . 16767 1 142 . 1 1 14 14 CYS C C 13 173.517 . . 1 . . 1 . 14 CYS C . 16767 1 143 . 1 1 14 14 CYS CA C 13 52.827 . . 1 . . 1 . 14 CYS CA . 16767 1 144 . 1 1 14 14 CYS CB C 13 42.665 . . 1 . . 1 . 14 CYS CB . 16767 1 145 . 1 1 14 14 CYS N N 15 116.051 . . 1 . . 1 . 14 CYS N . 16767 1 146 . 1 1 15 15 TYR H H 1 9.742 . . 1 . . 1 . 15 TYR HN . 16767 1 147 . 1 1 15 15 TYR HA H 1 5.478 . . 1 . . 1 . 15 TYR HA . 16767 1 148 . 1 1 15 15 TYR HB2 H 1 2.667 . . 2 . . 1 . 15 TYR HB1 . 16767 1 149 . 1 1 15 15 TYR HB3 H 1 2.503 . . 2 . . 1 . 15 TYR HB2 . 16767 1 150 . 1 1 15 15 TYR HD1 H 1 6.938 . . 3 . . 1 . 15 TYR HD1 . 16767 1 151 . 1 1 15 15 TYR HD2 H 1 6.938 . . 3 . . 1 . 15 TYR HD2 . 16767 1 152 . 1 1 15 15 TYR HE1 H 1 6.789 . . 3 . . 1 . 15 TYR HE1 . 16767 1 153 . 1 1 15 15 TYR HE2 H 1 6.789 . . 3 . . 1 . 15 TYR HE2 . 16767 1 154 . 1 1 15 15 TYR C C 13 174.651 . . 1 . . 1 . 15 TYR C . 16767 1 155 . 1 1 15 15 TYR CA C 13 56.216 . . 1 . . 1 . 15 TYR CA . 16767 1 156 . 1 1 15 15 TYR CB C 13 40.467 . . 1 . . 1 . 15 TYR CB . 16767 1 157 . 1 1 15 15 TYR CD1 C 13 133.085 . . 3 . . 1 . 15 TYR CD1 . 16767 1 158 . 1 1 15 15 TYR CD2 C 13 133.085 . . 3 . . 1 . 15 TYR CD2 . 16767 1 159 . 1 1 15 15 TYR CE1 C 13 117.838 . . 3 . . 1 . 15 TYR CE1 . 16767 1 160 . 1 1 15 15 TYR CE2 C 13 117.838 . . 3 . . 1 . 15 TYR CE2 . 16767 1 161 . 1 1 15 15 TYR N N 15 120.372 . . 1 . . 1 . 15 TYR N . 16767 1 162 . 1 1 16 16 GLY H H 1 8.530 . . 1 . . 1 . 16 GLY HN . 16767 1 163 . 1 1 16 16 GLY HA2 H 1 0.926 . . 2 . . 1 . 16 GLY HA1 . 16767 1 164 . 1 1 16 16 GLY HA3 H 1 3.658 . . 2 . . 1 . 16 GLY HA2 . 16767 1 165 . 1 1 16 16 GLY C C 13 170.547 . . 1 . . 1 . 16 GLY C . 16767 1 166 . 1 1 16 16 GLY CA C 13 43.489 . . 1 . . 1 . 16 GLY CA . 16767 1 167 . 1 1 16 16 GLY N N 15 112.846 . . 1 . . 1 . 16 GLY N . 16767 1 168 . 1 1 17 17 TYR H H 1 8.336 . . 1 . . 1 . 17 TYR HN . 16767 1 169 . 1 1 17 17 TYR HA H 1 4.798 . . 1 . . 1 . 17 TYR HA . 16767 1 170 . 1 1 17 17 TYR HB2 H 1 2.448 . . 2 . . 1 . 17 TYR HB1 . 16767 1 171 . 1 1 17 17 TYR HB3 H 1 2.448 . . 2 . . 1 . 17 TYR HB2 . 16767 1 172 . 1 1 17 17 TYR HD1 H 1 6.931 . . 3 . . 1 . 17 TYR HD1 . 16767 1 173 . 1 1 17 17 TYR HD2 H 1 6.931 . . 3 . . 1 . 17 TYR HD2 . 16767 1 174 . 1 1 17 17 TYR HE1 H 1 7.145 . . 3 . . 1 . 17 TYR HE1 . 16767 1 175 . 1 1 17 17 TYR HE2 H 1 7.145 . . 3 . . 1 . 17 TYR HE2 . 16767 1 176 . 1 1 17 17 TYR C C 13 172.707 . . 1 . . 1 . 17 TYR C . 16767 1 177 . 1 1 17 17 TYR CA C 13 53.651 . . 1 . . 1 . 17 TYR CA . 16767 1 178 . 1 1 17 17 TYR CB C 13 37.171 . . 1 . . 1 . 17 TYR CB . 16767 1 179 . 1 1 17 17 TYR CD1 C 13 133.101 . . 3 . . 1 . 17 TYR CD1 . 16767 1 180 . 1 1 17 17 TYR CD2 C 13 133.101 . . 3 . . 1 . 17 TYR CD2 . 16767 1 181 . 1 1 17 17 TYR CE1 C 13 117.901 . . 3 . . 1 . 17 TYR CE1 . 16767 1 182 . 1 1 17 17 TYR CE2 C 13 117.901 . . 3 . . 1 . 17 TYR CE2 . 16767 1 183 . 1 1 17 17 TYR N N 15 127.734 . . 1 . . 1 . 17 TYR N . 16767 1 184 . 1 1 18 18 PHE H H 1 8.293 . . 1 . . 1 . 18 PHE HN . 16767 1 185 . 1 1 18 18 PHE HA H 1 3.736 . . 1 . . 1 . 18 PHE HA . 16767 1 186 . 1 1 18 18 PHE HB2 H 1 1.714 . . 2 . . 1 . 18 PHE HB1 . 16767 1 187 . 1 1 18 18 PHE HB3 H 1 0.879 . . 2 . . 1 . 18 PHE HB2 . 16767 1 188 . 1 1 18 18 PHE HD1 H 1 6.679 . . 3 . . 1 . 18 PHE HD1 . 16767 1 189 . 1 1 18 18 PHE HD2 H 1 6.679 . . 3 . . 1 . 18 PHE HD2 . 16767 1 190 . 1 1 18 18 PHE C C 13 173.733 . . 1 . . 1 . 18 PHE C . 16767 1 191 . 1 1 18 18 PHE CA C 13 58.672 . . 1 . . 1 . 18 PHE CA . 16767 1 192 . 1 1 18 18 PHE CB C 13 39.185 . . 1 . . 1 . 18 PHE CB . 16767 1 193 . 1 1 18 18 PHE CD1 C 13 132.432 . . 3 . . 1 . 18 PHE CD1 . 16767 1 194 . 1 1 18 18 PHE CD2 C 13 132.432 . . 3 . . 1 . 18 PHE CD2 . 16767 1 195 . 1 1 18 18 PHE N N 15 128.521 . . 1 . . 1 . 18 PHE N . 16767 1 196 . 1 1 19 19 ARG H H 1 7.885 . . 1 . . 1 . 19 ARG HN . 16767 1 197 . 1 1 19 19 ARG HA H 1 2.472 . . 1 . . 1 . 19 ARG HA . 16767 1 198 . 1 1 19 19 ARG HB2 H 1 1.144 . . 2 . . 1 . 19 ARG HB1 . 16767 1 199 . 1 1 19 19 ARG HB3 H 1 1.097 . . 2 . . 1 . 19 ARG HB2 . 16767 1 200 . 1 1 19 19 ARG HD2 H 1 2.479 . . 2 . . 1 . 19 ARG HD1 . 16767 1 201 . 1 1 19 19 ARG HD3 H 1 2.479 . . 2 . . 1 . 19 ARG HD2 . 16767 1 202 . 1 1 19 19 ARG HG2 H 1 0.059 . . 2 . . 1 . 19 ARG HG1 . 16767 1 203 . 1 1 19 19 ARG HG3 H 1 0.671 . . 2 . . 1 . 19 ARG HG2 . 16767 1 204 . 1 1 19 19 ARG C C 13 175.227 . . 1 . . 1 . 19 ARG C . 16767 1 205 . 1 1 19 19 ARG CA C 13 52.644 . . 1 . . 1 . 19 ARG CA . 16767 1 206 . 1 1 19 19 ARG CB C 13 26.734 . . 1 . . 1 . 19 ARG CB . 16767 1 207 . 1 1 19 19 ARG CD C 13 42.294 . . 1 . . 1 . 19 ARG CD . 16767 1 208 . 1 1 19 19 ARG CG C 13 25.354 . . 1 . . 1 . 19 ARG CG . 16767 1 209 . 1 1 19 19 ARG N N 15 126.331 . . 1 . . 1 . 19 ARG N . 16767 1 210 . 1 1 20 20 LYS H H 1 6.920 . . 1 . . 1 . 20 LYS HN . 16767 1 211 . 1 1 20 20 LYS HA H 1 4.408 . . 1 . . 1 . 20 LYS HA . 16767 1 212 . 1 1 20 20 LYS HB2 H 1 1.683 . . 2 . . 1 . 20 LYS HB1 . 16767 1 213 . 1 1 20 20 LYS HB3 H 1 1.597 . . 2 . . 1 . 20 LYS HB2 . 16767 1 214 . 1 1 20 20 LYS HD2 H 1 1.684 . . 2 . . 1 . 20 LYS HD1 . 16767 1 215 . 1 1 20 20 LYS HD3 H 1 1.684 . . 2 . . 1 . 20 LYS HD2 . 16767 1 216 . 1 1 20 20 LYS HE2 H 1 2.931 . . 2 . . 1 . 20 LYS HE1 . 16767 1 217 . 1 1 20 20 LYS HE3 H 1 2.931 . . 2 . . 1 . 20 LYS HE2 . 16767 1 218 . 1 1 20 20 LYS HG2 H 1 1.281 . . 2 . . 1 . 20 LYS HG1 . 16767 1 219 . 1 1 20 20 LYS HG3 H 1 1.281 . . 2 . . 1 . 20 LYS HG2 . 16767 1 220 . 1 1 20 20 LYS C C 13 173.697 . . 1 . . 1 . 20 LYS C . 16767 1 221 . 1 1 20 20 LYS CA C 13 53.561 . . 1 . . 1 . 20 LYS CA . 16767 1 222 . 1 1 20 20 LYS CB C 13 34.791 . . 1 . . 1 . 20 LYS CB . 16767 1 223 . 1 1 20 20 LYS CD C 13 29.275 . . 1 . . 1 . 20 LYS CD . 16767 1 224 . 1 1 20 20 LYS CE C 13 41.196 . . 1 . . 1 . 20 LYS CE . 16767 1 225 . 1 1 20 20 LYS CG C 13 24.021 . . 1 . . 1 . 20 LYS CG . 16767 1 226 . 1 1 20 20 LYS N N 15 119.555 . . 1 . . 1 . 20 LYS N . 16767 1 227 . 1 1 21 21 LEU H H 1 8.401 . . 1 . . 1 . 21 LEU HN . 16767 1 228 . 1 1 21 21 LEU HA H 1 4.291 . . 1 . . 1 . 21 LEU HA . 16767 1 229 . 1 1 21 21 LEU HB2 H 1 1.886 . . 2 . . 1 . 21 LEU HB1 . 16767 1 230 . 1 1 21 21 LEU HB3 H 1 1.011 . . 2 . . 1 . 21 LEU HB2 . 16767 1 231 . 1 1 21 21 LEU HD11 H 1 0.914 . . 2 . . 1 . 21 LEU HD11 . 16767 1 232 . 1 1 21 21 LEU HD12 H 1 0.914 . . 2 . . 1 . 21 LEU HD11 . 16767 1 233 . 1 1 21 21 LEU HD13 H 1 0.914 . . 2 . . 1 . 21 LEU HD11 . 16767 1 234 . 1 1 21 21 LEU HD21 H 1 0.914 . . 2 . . 1 . 21 LEU HD21 . 16767 1 235 . 1 1 21 21 LEU HD22 H 1 0.914 . . 2 . . 1 . 21 LEU HD21 . 16767 1 236 . 1 1 21 21 LEU HD23 H 1 0.914 . . 2 . . 1 . 21 LEU HD21 . 16767 1 237 . 1 1 21 21 LEU HG H 1 1.648 . . 1 . . 1 . 21 LEU HG . 16767 1 238 . 1 1 21 21 LEU C C 13 177.262 . . 1 . . 1 . 21 LEU C . 16767 1 239 . 1 1 21 21 LEU CA C 13 53.674 . . 1 . . 1 . 21 LEU CA . 16767 1 240 . 1 1 21 21 LEU CB C 13 40.833 . . 1 . . 1 . 21 LEU CB . 16767 1 241 . 1 1 21 21 LEU CD1 C 13 22.609 . . 1 . . 1 . 21 LEU CD1 . 16767 1 242 . 1 1 21 21 LEU CD2 C 13 22.609 . . 1 . . 1 . 21 LEU CD2 . 16767 1 243 . 1 1 21 21 LEU CG C 13 25.197 . . 1 . . 1 . 21 LEU CG . 16767 1 244 . 1 1 21 21 LEU N N 15 120.244 . . 1 . . 1 . 21 LEU N . 16767 1 245 . 1 1 22 22 ARG H H 1 9.231 . . 1 . . 1 . 22 ARG HN . 16767 1 246 . 1 1 22 22 ARG HA H 1 4.994 . . 1 . . 1 . 22 ARG HA . 16767 1 247 . 1 1 22 22 ARG HB2 H 1 1.777 . . 2 . . 1 . 22 ARG HB1 . 16767 1 248 . 1 1 22 22 ARG HB3 H 1 1.636 . . 2 . . 1 . 22 ARG HB2 . 16767 1 249 . 1 1 22 22 ARG HD2 H 1 3.172 . . 2 . . 1 . 22 ARG HD1 . 16767 1 250 . 1 1 22 22 ARG HD3 H 1 3.172 . . 2 . . 1 . 22 ARG HD2 . 16767 1 251 . 1 1 22 22 ARG HG2 H 1 1.439 . . 2 . . 1 . 22 ARG HG1 . 16767 1 252 . 1 1 22 22 ARG HG3 H 1 1.336 . . 2 . . 1 . 22 ARG HG2 . 16767 1 253 . 1 1 22 22 ARG C C 13 176.595 . . 1 . . 1 . 22 ARG C . 16767 1 254 . 1 1 22 22 ARG CA C 13 52.369 . . 1 . . 1 . 22 ARG CA . 16767 1 255 . 1 1 22 22 ARG CB C 13 34.882 . . 1 . . 1 . 22 ARG CB . 16767 1 256 . 1 1 22 22 ARG CD C 13 42.451 . . 1 . . 1 . 22 ARG CD . 16767 1 257 . 1 1 22 22 ARG CG C 13 27.785 . . 1 . . 1 . 22 ARG CG . 16767 1 258 . 1 1 22 22 ARG N N 15 126.138 . . 1 . . 1 . 22 ARG N . 16767 1 259 . 1 1 23 23 ASN H H 1 9.515 . . 1 . . 1 . 23 ASN HN . 16767 1 260 . 1 1 23 23 ASN HA H 1 5.649 . . 1 . . 1 . 23 ASN HA . 16767 1 261 . 1 1 23 23 ASN HB2 H 1 3.799 . . 2 . . 1 . 23 ASN HB1 . 16767 1 262 . 1 1 23 23 ASN HB3 H 1 2.636 . . 2 . . 1 . 23 ASN HB2 . 16767 1 263 . 1 1 23 23 ASN HD21 H 1 7.490 . . 2 . . 1 . 23 ASN HD21 . 16767 1 264 . 1 1 23 23 ASN HD22 H 1 6.683 . . 2 . . 1 . 23 ASN HD22 . 16767 1 265 . 1 1 23 23 ASN C C 13 173.625 . . 1 . . 1 . 23 ASN C . 16767 1 266 . 1 1 23 23 ASN CA C 13 51.454 . . 1 . . 1 . 23 ASN CA . 16767 1 267 . 1 1 23 23 ASN CB C 13 36.073 . . 1 . . 1 . 23 ASN CB . 16767 1 268 . 1 1 23 23 ASN N N 15 122.590 . . 1 . . 1 . 23 ASN N . 16767 1 269 . 1 1 23 23 ASN ND2 N 15 110.449 . . 1 . . 1 . 23 ASN ND2 . 16767 1 270 . 1 1 24 24 TRP H H 1 7.673 . . 1 . . 1 . 24 TRP HN . 16767 1 271 . 1 1 24 24 TRP HA H 1 2.839 . . 1 . . 1 . 24 TRP HA . 16767 1 272 . 1 1 24 24 TRP HB2 H 1 2.941 . . 2 . . 1 . 24 TRP HB1 . 16767 1 273 . 1 1 24 24 TRP HB3 H 1 1.597 . . 2 . . 1 . 24 TRP HB2 . 16767 1 274 . 1 1 24 24 TRP HD1 H 1 6.549 . . 1 . . 1 . 24 TRP HD1 . 16767 1 275 . 1 1 24 24 TRP HE1 H 1 9.747 . . 3 . . 1 . 24 TRP HE1 . 16767 1 276 . 1 1 24 24 TRP C C 13 177.046 . . 1 . . 1 . 24 TRP C . 16767 1 277 . 1 1 24 24 TRP CA C 13 63.271 . . 1 . . 1 . 24 TRP CA . 16767 1 278 . 1 1 24 24 TRP CB C 13 31.024 . . 1 . . 1 . 24 TRP CB . 16767 1 279 . 1 1 24 24 TRP CD1 C 13 126.835 . . 3 . . 1 . 24 TRP CD1 . 16767 1 280 . 1 1 24 24 TRP N N 15 118.328 . . 1 . . 1 . 24 TRP N . 16767 1 281 . 1 1 24 24 TRP NE1 N 15 126.203 . . 1 . . 1 . 24 TRP NE1 . 16767 1 282 . 1 1 25 25 SER H H 1 8.450 . . 1 . . 1 . 25 SER HN . 16767 1 283 . 1 1 25 25 SER HA H 1 3.846 . . 1 . . 1 . 25 SER HA . 16767 1 284 . 1 1 25 25 SER HB2 H 1 3.916 . . 2 . . 1 . 25 SER HB1 . 16767 1 285 . 1 1 25 25 SER HB3 H 1 3.916 . . 2 . . 1 . 25 SER HB2 . 16767 1 286 . 1 1 25 25 SER C C 13 177.334 . . 1 . . 1 . 25 SER C . 16767 1 287 . 1 1 25 25 SER CA C 13 61.727 . . 1 . . 1 . 25 SER CA . 16767 1 288 . 1 1 25 25 SER CB C 13 64.089 . . 1 . . 1 . 25 SER CB . 16767 1 289 . 1 1 25 25 SER N N 15 110.848 . . 1 . . 1 . 25 SER N . 16767 1 290 . 1 1 26 26 ASP H H 1 8.925 . . 1 . . 1 . 26 ASP HN . 16767 1 291 . 1 1 26 26 ASP HA H 1 4.306 . . 1 . . 1 . 26 ASP HA . 16767 1 292 . 1 1 26 26 ASP HB2 H 1 2.534 . . 2 . . 1 . 26 ASP HB1 . 16767 1 293 . 1 1 26 26 ASP HB3 H 1 2.371 . . 2 . . 1 . 26 ASP HB2 . 16767 1 294 . 1 1 26 26 ASP C C 13 178.612 . . 1 . . 1 . 26 ASP C . 16767 1 295 . 1 1 26 26 ASP CA C 13 56.095 . . 1 . . 1 . 26 ASP CA . 16767 1 296 . 1 1 26 26 ASP CB C 13 38.745 . . 1 . . 1 . 26 ASP CB . 16767 1 297 . 1 1 26 26 ASP N N 15 122.435 . . 1 . . 1 . 26 ASP N . 16767 1 298 . 1 1 27 27 ALA H H 1 8.550 . . 1 . . 1 . 27 ALA HN . 16767 1 299 . 1 1 27 27 ALA HA H 1 2.628 . . 1 . . 1 . 27 ALA HA . 16767 1 300 . 1 1 27 27 ALA HB1 H 1 0.738 . . 1 . . 1 . 27 ALA HB1 . 16767 1 301 . 1 1 27 27 ALA HB2 H 1 0.738 . . 1 . . 1 . 27 ALA HB1 . 16767 1 302 . 1 1 27 27 ALA HB3 H 1 0.738 . . 1 . . 1 . 27 ALA HB1 . 16767 1 303 . 1 1 27 27 ALA C C 13 176.992 . . 1 . . 1 . 27 ALA C . 16767 1 304 . 1 1 27 27 ALA CA C 13 54.097 . . 1 . . 1 . 27 ALA CA . 16767 1 305 . 1 1 27 27 ALA CB C 13 17.398 . . 1 . . 1 . 27 ALA CB . 16767 1 306 . 1 1 27 27 ALA N N 15 126.225 . . 1 . . 1 . 27 ALA N . 16767 1 307 . 1 1 28 28 GLU H H 1 7.532 . . 1 . . 1 . 28 GLU HN . 16767 1 308 . 1 1 28 28 GLU HA H 1 3.986 . . 1 . . 1 . 28 GLU HA . 16767 1 309 . 1 1 28 28 GLU HB2 H 1 1.472 . . 2 . . 1 . 28 GLU HB1 . 16767 1 310 . 1 1 28 28 GLU HB3 H 1 1.285 . . 2 . . 1 . 28 GLU HB2 . 16767 1 311 . 1 1 28 28 GLU HG2 H 1 2.186 . . 2 . . 1 . 28 GLU HG1 . 16767 1 312 . 1 1 28 28 GLU HG3 H 1 2.186 . . 2 . . 1 . 28 GLU HG2 . 16767 1 313 . 1 1 28 28 GLU C C 13 178.414 . . 1 . . 1 . 28 GLU C . 16767 1 314 . 1 1 28 28 GLU CA C 13 57.912 . . 1 . . 1 . 28 GLU CA . 16767 1 315 . 1 1 28 28 GLU CB C 13 25.574 . . 1 . . 1 . 28 GLU CB . 16767 1 316 . 1 1 28 28 GLU CG C 13 33.041 . . 1 . . 1 . 28 GLU CG . 16767 1 317 . 1 1 28 28 GLU N N 15 118.414 . . 1 . . 1 . 28 GLU N . 16767 1 318 . 1 1 29 29 LEU H H 1 7.638 . . 1 . . 1 . 29 LEU HN . 16767 1 319 . 1 1 29 29 LEU HA H 1 3.838 . . 1 . . 1 . 29 LEU HA . 16767 1 320 . 1 1 29 29 LEU HB2 H 1 1.761 . . 2 . . 1 . 29 LEU HB1 . 16767 1 321 . 1 1 29 29 LEU HB3 H 1 1.449 . . 2 . . 1 . 29 LEU HB2 . 16767 1 322 . 1 1 29 29 LEU HD11 H 1 0.771 . . 2 . . 1 . 29 LEU HD11 . 16767 1 323 . 1 1 29 29 LEU HD12 H 1 0.771 . . 2 . . 1 . 29 LEU HD11 . 16767 1 324 . 1 1 29 29 LEU HD13 H 1 0.771 . . 2 . . 1 . 29 LEU HD11 . 16767 1 325 . 1 1 29 29 LEU HD21 H 1 0.350 . . 2 . . 1 . 29 LEU HD21 . 16767 1 326 . 1 1 29 29 LEU HD22 H 1 0.350 . . 2 . . 1 . 29 LEU HD21 . 16767 1 327 . 1 1 29 29 LEU HD23 H 1 0.350 . . 2 . . 1 . 29 LEU HD21 . 16767 1 328 . 1 1 29 29 LEU HG H 1 1.657 . . 1 . . 1 . 29 LEU HG . 16767 1 329 . 1 1 29 29 LEU C C 13 180.088 . . 1 . . 1 . 29 LEU C . 16767 1 330 . 1 1 29 29 LEU CA C 13 57.185 . . 1 . . 1 . 29 LEU CA . 16767 1 331 . 1 1 29 29 LEU CB C 13 40.653 . . 1 . . 1 . 29 LEU CB . 16767 1 332 . 1 1 29 29 LEU CD1 C 13 22.296 . . 1 . . 1 . 29 LEU CD1 . 16767 1 333 . 1 1 29 29 LEU CD2 C 13 24.256 . . 1 . . 1 . 29 LEU CD2 . 16767 1 334 . 1 1 29 29 LEU CG C 13 26.061 . . 1 . . 1 . 29 LEU CG . 16767 1 335 . 1 1 29 29 LEU N N 15 118.468 . . 1 . . 1 . 29 LEU N . 16767 1 336 . 1 1 30 30 GLU H H 1 8.090 . . 1 . . 1 . 30 GLU HN . 16767 1 337 . 1 1 30 30 GLU HA H 1 3.822 . . 1 . . 1 . 30 GLU HA . 16767 1 338 . 1 1 30 30 GLU HB2 H 1 1.948 . . 2 . . 1 . 30 GLU HB1 . 16767 1 339 . 1 1 30 30 GLU HB3 H 1 1.886 . . 2 . . 1 . 30 GLU HB2 . 16767 1 340 . 1 1 30 30 GLU HG2 H 1 2.048 . . 2 . . 1 . 30 GLU HG1 . 16767 1 341 . 1 1 30 30 GLU HG3 H 1 2.048 . . 2 . . 1 . 30 GLU HG2 . 16767 1 342 . 1 1 30 30 GLU C C 13 180.519 . . 1 . . 1 . 30 GLU C . 16767 1 343 . 1 1 30 30 GLU CA C 13 59.274 . . 1 . . 1 . 30 GLU CA . 16767 1 344 . 1 1 30 30 GLU CB C 13 26.754 . . 1 . . 1 . 30 GLU CB . 16767 1 345 . 1 1 30 30 GLU CG C 13 35.157 . . 1 . . 1 . 30 GLU CG . 16767 1 346 . 1 1 30 30 GLU N N 15 121.811 . . 1 . . 1 . 30 GLU N . 16767 1 347 . 1 1 31 31 CYS H H 1 8.873 . . 1 . . 1 . 31 CYS HN . 16767 1 348 . 1 1 31 31 CYS HA H 1 4.572 . . 1 . . 1 . 31 CYS HA . 16767 1 349 . 1 1 31 31 CYS HB2 H 1 2.932 . . 2 . . 1 . 31 CYS HB1 . 16767 1 350 . 1 1 31 31 CYS HB3 H 1 2.573 . . 2 . . 1 . 31 CYS HB2 . 16767 1 351 . 1 1 31 31 CYS C C 13 176.127 . . 1 . . 1 . 31 CYS C . 16767 1 352 . 1 1 31 31 CYS CA C 13 55.913 . . 1 . . 1 . 31 CYS CA . 16767 1 353 . 1 1 31 31 CYS CB C 13 33.295 . . 1 . . 1 . 31 CYS CB . 16767 1 354 . 1 1 31 31 CYS N N 15 118.289 . . 1 . . 1 . 31 CYS N . 16767 1 355 . 1 1 32 32 GLN H H 1 8.219 . . 1 . . 1 . 32 GLN HN . 16767 1 356 . 1 1 32 32 GLN HA H 1 3.986 . . 1 . . 1 . 32 GLN HA . 16767 1 357 . 1 1 32 32 GLN HB2 H 1 2.058 . . 2 . . 1 . 32 GLN HB1 . 16767 1 358 . 1 1 32 32 GLN HB3 H 1 2.003 . . 2 . . 1 . 32 GLN HB2 . 16767 1 359 . 1 1 32 32 GLN HE21 H 1 8.296 . . 2 . . 1 . 32 GLN HE21 . 16767 1 360 . 1 1 32 32 GLN HE22 H 1 6.714 . . 2 . . 1 . 32 GLN HE22 . 16767 1 361 . 1 1 32 32 GLN HG2 H 1 2.609 . . 2 . . 1 . 32 GLN HG1 . 16767 1 362 . 1 1 32 32 GLN HG3 H 1 2.283 . . 2 . . 1 . 32 GLN HG2 . 16767 1 363 . 1 1 32 32 GLN C C 13 179.171 . . 1 . . 1 . 32 GLN C . 16767 1 364 . 1 1 32 32 GLN CA C 13 57.912 . . 1 . . 1 . 32 GLN CA . 16767 1 365 . 1 1 32 32 GLN CB C 13 28.391 . . 1 . . 1 . 32 GLN CB . 16767 1 366 . 1 1 32 32 GLN CG C 13 33.432 . . 1 . . 1 . 32 GLN CG . 16767 1 367 . 1 1 32 32 GLN N N 15 116.359 . . 1 . . 1 . 32 GLN N . 16767 1 368 . 1 1 32 32 GLN NE2 N 15 112.649 . . 1 . . 1 . 32 GLN NE2 . 16767 1 369 . 1 1 33 33 SER H H 1 7.870 . . 1 . . 1 . 33 SER HN . 16767 1 370 . 1 1 33 33 SER HA H 1 4.103 . . 1 . . 1 . 33 SER HA . 16767 1 371 . 1 1 33 33 SER HB2 H 1 3.791 . . 2 . . 1 . 33 SER HB1 . 16767 1 372 . 1 1 33 33 SER HB3 H 1 3.791 . . 2 . . 1 . 33 SER HB2 . 16767 1 373 . 1 1 33 33 SER C C 13 174.759 . . 1 . . 1 . 33 SER C . 16767 1 374 . 1 1 33 33 SER CA C 13 60.183 . . 1 . . 1 . 33 SER CA . 16767 1 375 . 1 1 33 33 SER CB C 13 62.181 . . 1 . . 1 . 33 SER CB . 16767 1 376 . 1 1 33 33 SER N N 15 116.665 . . 1 . . 1 . 33 SER N . 16767 1 377 . 1 1 34 34 TYR H H 1 7.558 . . 1 . . 1 . 34 TYR HN . 16767 1 378 . 1 1 34 34 TYR HA H 1 4.244 . . 1 . . 1 . 34 TYR HA . 16767 1 379 . 1 1 34 34 TYR HB2 H 1 3.003 . . 2 . . 1 . 34 TYR HB1 . 16767 1 380 . 1 1 34 34 TYR HB3 H 1 2.871 . . 2 . . 1 . 34 TYR HB2 . 16767 1 381 . 1 1 34 34 TYR HD1 H 1 6.478 . . 3 . . 1 . 34 TYR HD1 . 16767 1 382 . 1 1 34 34 TYR HD2 H 1 6.478 . . 3 . . 1 . 34 TYR HD2 . 16767 1 383 . 1 1 34 34 TYR HE1 H 1 6.387 . . 3 . . 1 . 34 TYR HE1 . 16767 1 384 . 1 1 34 34 TYR HE2 H 1 6.387 . . 3 . . 1 . 34 TYR HE2 . 16767 1 385 . 1 1 34 34 TYR C C 13 176.073 . . 1 . . 1 . 34 TYR C . 16767 1 386 . 1 1 34 34 TYR CA C 13 58.911 . . 1 . . 1 . 34 TYR CA . 16767 1 387 . 1 1 34 34 TYR CB C 13 37.019 . . 1 . . 1 . 34 TYR CB . 16767 1 388 . 1 1 34 34 TYR CD1 C 13 132.391 . . 3 . . 1 . 34 TYR CD1 . 16767 1 389 . 1 1 34 34 TYR CD2 C 13 132.391 . . 3 . . 1 . 34 TYR CD2 . 16767 1 390 . 1 1 34 34 TYR CE1 C 13 117.601 . . 3 . . 1 . 34 TYR CE1 . 16767 1 391 . 1 1 34 34 TYR CE2 C 13 117.601 . . 3 . . 1 . 34 TYR CE2 . 16767 1 392 . 1 1 34 34 TYR N N 15 120.500 . . 1 . . 1 . 34 TYR N . 16767 1 393 . 1 1 35 35 GLY H H 1 7.682 . . 1 . . 1 . 35 GLY HN . 16767 1 394 . 1 1 35 35 GLY HA2 H 1 3.761 . . 2 . . 1 . 35 GLY HA1 . 16767 1 395 . 1 1 35 35 GLY HA3 H 1 3.651 . . 2 . . 1 . 35 GLY HA2 . 16767 1 396 . 1 1 35 35 GLY C C 13 172.977 . . 1 . . 1 . 35 GLY C . 16767 1 397 . 1 1 35 35 GLY CA C 13 44.195 . . 1 . . 1 . 35 GLY CA . 16767 1 398 . 1 1 35 35 GLY N N 15 106.763 . . 1 . . 1 . 35 GLY N . 16767 1 399 . 1 1 36 36 ASN H H 1 8.242 . . 1 . . 1 . 36 ASN HN . 16767 1 400 . 1 1 36 36 ASN HA H 1 4.213 . . 1 . . 1 . 36 ASN HA . 16767 1 401 . 1 1 36 36 ASN HB2 H 1 2.401 . . 2 . . 1 . 36 ASN HB1 . 16767 1 402 . 1 1 36 36 ASN HB3 H 1 2.081 . . 2 . . 1 . 36 ASN HB2 . 16767 1 403 . 1 1 36 36 ASN HD21 H 1 6.504 . . 2 . . 1 . 36 ASN HD21 . 16767 1 404 . 1 1 36 36 ASN HD22 H 1 6.705 . . 2 . . 1 . 36 ASN HD22 . 16767 1 405 . 1 1 36 36 ASN C C 13 175.047 . . 1 . . 1 . 36 ASN C . 16767 1 406 . 1 1 36 36 ASN CA C 13 53.552 . . 1 . . 1 . 36 ASN CA . 16767 1 407 . 1 1 36 36 ASN CB C 13 37.111 . . 1 . . 1 . 36 ASN CB . 16767 1 408 . 1 1 36 36 ASN N N 15 114.352 . . 1 . . 1 . 36 ASN N . 16767 1 409 . 1 1 36 36 ASN ND2 N 15 112.396 . . 1 . . 1 . 36 ASN ND2 . 16767 1 410 . 1 1 37 37 GLY H H 1 8.478 . . 1 . . 1 . 37 GLY HN . 16767 1 411 . 1 1 37 37 GLY HA2 H 1 3.961 . . 2 . . 1 . 37 GLY HA1 . 16767 1 412 . 1 1 37 37 GLY HA3 H 1 3.791 . . 2 . . 1 . 37 GLY HA2 . 16767 1 413 . 1 1 37 37 GLY C C 13 174.147 . . 1 . . 1 . 37 GLY C . 16767 1 414 . 1 1 37 37 GLY CA C 13 45.195 . . 1 . . 1 . 37 GLY CA . 16767 1 415 . 1 1 37 37 GLY N N 15 107.175 . . 1 . . 1 . 37 GLY N . 16767 1 416 . 1 1 38 38 ALA H H 1 7.408 . . 1 . . 1 . 38 ALA HN . 16767 1 417 . 1 1 38 38 ALA HA H 1 4.869 . . 1 . . 1 . 38 ALA HA . 16767 1 418 . 1 1 38 38 ALA HB1 H 1 1.378 . . 1 . . 1 . 38 ALA HB1 . 16767 1 419 . 1 1 38 38 ALA HB2 H 1 1.378 . . 1 . . 1 . 38 ALA HB1 . 16767 1 420 . 1 1 38 38 ALA HB3 H 1 1.378 . . 1 . . 1 . 38 ALA HB1 . 16767 1 421 . 1 1 38 38 ALA C C 13 175.785 . . 1 . . 1 . 38 ALA C . 16767 1 422 . 1 1 38 38 ALA CA C 13 51.372 . . 1 . . 1 . 38 ALA CA . 16767 1 423 . 1 1 38 38 ALA CB C 13 19.215 . . 1 . . 1 . 38 ALA CB . 16767 1 424 . 1 1 38 38 ALA N N 15 121.876 . . 1 . . 1 . 38 ALA N . 16767 1 425 . 1 1 39 39 HIS H H 1 8.139 . . 1 . . 1 . 39 HIS HN . 16767 1 426 . 1 1 39 39 HIS HA H 1 4.978 . . 1 . . 1 . 39 HIS HA . 16767 1 427 . 1 1 39 39 HIS HB2 H 1 3.666 . . 2 . . 1 . 39 HIS HB1 . 16767 1 428 . 1 1 39 39 HIS HB3 H 1 3.034 . . 2 . . 1 . 39 HIS HB2 . 16767 1 429 . 1 1 39 39 HIS HD2 H 1 7.323 . . 3 . . 1 . 39 HIS HD2 . 16767 1 430 . 1 1 39 39 HIS C C 13 175.047 . . 1 . . 1 . 39 HIS C . 16767 1 431 . 1 1 39 39 HIS CA C 13 53.733 . . 1 . . 1 . 39 HIS CA . 16767 1 432 . 1 1 39 39 HIS CB C 13 35.384 . . 1 . . 1 . 39 HIS CB . 16767 1 433 . 1 1 39 39 HIS CD2 C 13 119.605 . . 1 . . 1 . 39 HIS CD2 . 16767 1 434 . 1 1 39 39 HIS N N 15 113.675 . . 1 . . 1 . 39 HIS N . 16767 1 435 . 1 1 40 40 LEU H H 1 9.800 . . 1 . . 1 . 40 LEU HN . 16767 1 436 . 1 1 40 40 LEU HA H 1 4.939 . . 1 . . 1 . 40 LEU HA . 16767 1 437 . 1 1 40 40 LEU HB2 H 1 1.605 . . 2 . . 1 . 40 LEU HB1 . 16767 1 438 . 1 1 40 40 LEU HB3 H 1 0.957 . . 2 . . 1 . 40 LEU HB2 . 16767 1 439 . 1 1 40 40 LEU HD11 H 1 0.755 . . 2 . . 1 . 40 LEU HD11 . 16767 1 440 . 1 1 40 40 LEU HD12 H 1 0.755 . . 2 . . 1 . 40 LEU HD11 . 16767 1 441 . 1 1 40 40 LEU HD13 H 1 0.755 . . 2 . . 1 . 40 LEU HD11 . 16767 1 442 . 1 1 40 40 LEU HD21 H 1 -0.441 . . 2 . . 1 . 40 LEU HD21 . 16767 1 443 . 1 1 40 40 LEU HD22 H 1 -0.441 . . 2 . . 1 . 40 LEU HD21 . 16767 1 444 . 1 1 40 40 LEU HD23 H 1 -0.441 . . 2 . . 1 . 40 LEU HD21 . 16767 1 445 . 1 1 40 40 LEU HG H 1 1.223 . . 1 . . 1 . 40 LEU HG . 16767 1 446 . 1 1 40 40 LEU C C 13 179.962 . . 1 . . 1 . 40 LEU C . 16767 1 447 . 1 1 40 40 LEU CA C 13 56.186 . . 1 . . 1 . 40 LEU CA . 16767 1 448 . 1 1 40 40 LEU CB C 13 35.384 . . 1 . . 1 . 40 LEU CB . 16767 1 449 . 1 1 40 40 LEU CD1 C 13 24.398 . . 1 . . 1 . 40 LEU CD1 . 16767 1 450 . 1 1 40 40 LEU CD2 C 13 24.579 . . 1 . . 1 . 40 LEU CD2 . 16767 1 451 . 1 1 40 40 LEU CG C 13 26.138 . . 1 . . 1 . 40 LEU CG . 16767 1 452 . 1 1 40 40 LEU N N 15 123.645 . . 1 . . 1 . 40 LEU N . 16767 1 453 . 1 1 41 41 ALA H H 1 9.226 . . 1 . . 1 . 41 ALA HN . 16767 1 454 . 1 1 41 41 ALA HA H 1 4.142 . . 1 . . 1 . 41 ALA HA . 16767 1 455 . 1 1 41 41 ALA HB1 H 1 1.301 . . 1 . . 1 . 41 ALA HB1 . 16767 1 456 . 1 1 41 41 ALA HB2 H 1 1.301 . . 1 . . 1 . 41 ALA HB1 . 16767 1 457 . 1 1 41 41 ALA HB3 H 1 1.301 . . 1 . . 1 . 41 ALA HB1 . 16767 1 458 . 1 1 41 41 ALA C C 13 177.118 . . 1 . . 1 . 41 ALA C . 16767 1 459 . 1 1 41 41 ALA CA C 13 53.188 . . 1 . . 1 . 41 ALA CA . 16767 1 460 . 1 1 41 41 ALA CB C 13 19.487 . . 1 . . 1 . 41 ALA CB . 16767 1 461 . 1 1 41 41 ALA N N 15 122.875 . . 1 . . 1 . 41 ALA N . 16767 1 462 . 1 1 42 42 SER H H 1 6.744 . . 1 . . 1 . 42 SER HN . 16767 1 463 . 1 1 42 42 SER HA H 1 3.617 . . 1 . . 1 . 42 SER HA . 16767 1 464 . 1 1 42 42 SER HB2 H 1 2.489 . . 2 . . 1 . 42 SER HB1 . 16767 1 465 . 1 1 42 42 SER HB3 H 1 2.489 . . 2 . . 1 . 42 SER HB2 . 16767 1 466 . 1 1 42 42 SER C C 13 172.743 . . 1 . . 1 . 42 SER C . 16767 1 467 . 1 1 42 42 SER CA C 13 54.642 . . 1 . . 1 . 42 SER CA . 16767 1 468 . 1 1 42 42 SER CB C 13 62.817 . . 1 . . 1 . 42 SER CB . 16767 1 469 . 1 1 42 42 SER N N 15 113.470 . . 1 . . 1 . 42 SER N . 16767 1 470 . 1 1 43 43 ILE H H 1 5.240 . . 1 . . 1 . 43 ILE HN . 16767 1 471 . 1 1 43 43 ILE HA H 1 4.103 . . 1 . . 1 . 43 ILE HA . 16767 1 472 . 1 1 43 43 ILE HB H 1 2.337 . . 1 . . 1 . 43 ILE HB . 16767 1 473 . 1 1 43 43 ILE HD11 H 1 0.817 . . 1 . . 1 . 43 ILE HD11 . 16767 1 474 . 1 1 43 43 ILE HD12 H 1 0.817 . . 1 . . 1 . 43 ILE HD11 . 16767 1 475 . 1 1 43 43 ILE HD13 H 1 0.817 . . 1 . . 1 . 43 ILE HD11 . 16767 1 476 . 1 1 43 43 ILE HG12 H 1 1.439 . . 1 . . 1 . 43 ILE HG11 . 16767 1 477 . 1 1 43 43 ILE HG13 H 1 1.439 . . 1 . . 1 . 43 ILE HG12 . 16767 1 478 . 1 1 43 43 ILE HG21 H 1 1.136 . . 2 . . 1 . 43 ILE HG21 . 16767 1 479 . 1 1 43 43 ILE HG22 H 1 1.136 . . 2 . . 1 . 43 ILE HG21 . 16767 1 480 . 1 1 43 43 ILE HG23 H 1 1.136 . . 2 . . 1 . 43 ILE HG21 . 16767 1 481 . 1 1 43 43 ILE C C 13 175.101 . . 1 . . 1 . 43 ILE C . 16767 1 482 . 1 1 43 43 ILE CA C 13 59.093 . . 1 . . 1 . 43 ILE CA . 16767 1 483 . 1 1 43 43 ILE CB C 13 37.473 . . 1 . . 1 . 43 ILE CB . 16767 1 484 . 1 1 43 43 ILE CD1 C 13 11.159 . . 1 . . 1 . 43 ILE CD1 . 16767 1 485 . 1 1 43 43 ILE CG1 C 13 25.746 . . 2 . . 1 . 43 ILE CG1 . 16767 1 486 . 1 1 43 43 ILE CG2 C 13 17.198 . . 1 . . 1 . 43 ILE CG2 . 16767 1 487 . 1 1 43 43 ILE N N 15 121.063 . . 1 . . 1 . 43 ILE N . 16767 1 488 . 1 1 44 44 LEU H H 1 8.561 . . 1 . . 1 . 44 LEU HN . 16767 1 489 . 1 1 44 44 LEU HA H 1 4.103 . . 1 . . 1 . 44 LEU HA . 16767 1 490 . 1 1 44 44 LEU HB2 H 1 2.329 . . 2 . . 1 . 44 LEU HB1 . 16767 1 491 . 1 1 44 44 LEU HB3 H 1 2.329 . . 2 . . 1 . 44 LEU HB2 . 16767 1 492 . 1 1 44 44 LEU HD11 H 1 0.539 . . 2 . . 1 . 44 LEU HD11 . 16767 1 493 . 1 1 44 44 LEU HD12 H 1 0.539 . . 2 . . 1 . 44 LEU HD11 . 16767 1 494 . 1 1 44 44 LEU HD13 H 1 0.539 . . 2 . . 1 . 44 LEU HD11 . 16767 1 495 . 1 1 44 44 LEU HD21 H 1 0.794 . . 2 . . 1 . 44 LEU HD21 . 16767 1 496 . 1 1 44 44 LEU HD22 H 1 0.794 . . 2 . . 1 . 44 LEU HD21 . 16767 1 497 . 1 1 44 44 LEU HD23 H 1 0.794 . . 2 . . 1 . 44 LEU HD21 . 16767 1 498 . 1 1 44 44 LEU HG H 1 1.115 . . 1 . . 1 . 44 LEU HG . 16767 1 499 . 1 1 44 44 LEU C C 13 176.919 . . 1 . . 1 . 44 LEU C . 16767 1 500 . 1 1 44 44 LEU CA C 13 54.369 . . 1 . . 1 . 44 LEU CA . 16767 1 501 . 1 1 44 44 LEU CB C 13 42.197 . . 1 . . 1 . 44 LEU CB . 16767 1 502 . 1 1 44 44 LEU CD1 C 13 21.747 . . 1 . . 1 . 44 LEU CD1 . 16767 1 503 . 1 1 44 44 LEU CD2 C 13 24.491 . . 1 . . 1 . 44 LEU CD2 . 16767 1 504 . 1 1 44 44 LEU CG C 13 26.217 . . 1 . . 1 . 44 LEU CG . 16767 1 505 . 1 1 44 44 LEU N N 15 120.949 . . 1 . . 1 . 44 LEU N . 16767 1 506 . 1 1 45 45 SER H H 1 7.466 . . 1 . . 1 . 45 SER HN . 16767 1 507 . 1 1 45 45 SER HA H 1 3.784 . . 1 . . 1 . 45 SER HA . 16767 1 508 . 1 1 45 45 SER HB2 H 1 4.352 . . 2 . . 1 . 45 SER HB1 . 16767 1 509 . 1 1 45 45 SER HB3 H 1 4.352 . . 2 . . 1 . 45 SER HB2 . 16767 1 510 . 1 1 45 45 SER C C 13 172.455 . . 1 . . 1 . 45 SER C . 16767 1 511 . 1 1 45 45 SER CA C 13 56.004 . . 1 . . 1 . 45 SER CA . 16767 1 512 . 1 1 45 45 SER CB C 13 65.271 . . 1 . . 1 . 45 SER CB . 16767 1 513 . 1 1 45 45 SER N N 15 111.624 . . 1 . . 1 . 45 SER N . 16767 1 514 . 1 1 46 46 LEU H H 1 8.425 . . 1 . . 1 . 46 LEU HN . 16767 1 515 . 1 1 46 46 LEU HA H 1 4.081 . . 1 . . 1 . 46 LEU HA . 16767 1 516 . 1 1 46 46 LEU HB2 H 1 1.652 . . 2 . . 1 . 46 LEU HB1 . 16767 1 517 . 1 1 46 46 LEU HB3 H 1 1.652 . . 2 . . 1 . 46 LEU HB2 . 16767 1 518 . 1 1 46 46 LEU HD11 H 1 0.983 . . 2 . . 1 . 46 LEU HD11 . 16767 1 519 . 1 1 46 46 LEU HD12 H 1 0.983 . . 2 . . 1 . 46 LEU HD11 . 16767 1 520 . 1 1 46 46 LEU HD13 H 1 0.983 . . 2 . . 1 . 46 LEU HD11 . 16767 1 521 . 1 1 46 46 LEU HD21 H 1 0.931 . . 2 . . 1 . 46 LEU HD21 . 16767 1 522 . 1 1 46 46 LEU HD22 H 1 0.931 . . 2 . . 1 . 46 LEU HD21 . 16767 1 523 . 1 1 46 46 LEU HD23 H 1 0.931 . . 2 . . 1 . 46 LEU HD21 . 16767 1 524 . 1 1 46 46 LEU HG H 1 1.538 . . 1 . . 1 . 46 LEU HG . 16767 1 525 . 1 1 46 46 LEU C C 13 178.936 . . 1 . . 1 . 46 LEU C . 16767 1 526 . 1 1 46 46 LEU CA C 13 56.640 . . 1 . . 1 . 46 LEU CA . 16767 1 527 . 1 1 46 46 LEU CB C 13 40.462 . . 1 . . 1 . 46 LEU CB . 16767 1 528 . 1 1 46 46 LEU CD1 C 13 22.296 . . 1 . . 1 . 46 LEU CD1 . 16767 1 529 . 1 1 46 46 LEU CD2 C 13 25.197 . . 1 . . 1 . 46 LEU CD2 . 16767 1 530 . 1 1 46 46 LEU CG C 13 26.374 . . 1 . . 1 . 46 LEU CG . 16767 1 531 . 1 1 46 46 LEU N N 15 123.128 . . 1 . . 1 . 46 LEU N . 16767 1 532 . 1 1 47 47 LYS H H 1 8.145 . . 1 . . 1 . 47 LYS HN . 16767 1 533 . 1 1 47 47 LYS HA H 1 4.011 . . 1 . . 1 . 47 LYS HA . 16767 1 534 . 1 1 47 47 LYS HB2 H 1 1.776 . . 2 . . 1 . 47 LYS HB1 . 16767 1 535 . 1 1 47 47 LYS HB3 H 1 1.776 . . 2 . . 1 . 47 LYS HB2 . 16767 1 536 . 1 1 47 47 LYS HD2 H 1 1.661 . . 2 . . 1 . 47 LYS HD1 . 16767 1 537 . 1 1 47 47 LYS HD3 H 1 1.661 . . 2 . . 1 . 47 LYS HD2 . 16767 1 538 . 1 1 47 47 LYS HE2 H 1 2.954 . . 2 . . 1 . 47 LYS HE1 . 16767 1 539 . 1 1 47 47 LYS HE3 H 1 2.954 . . 2 . . 1 . 47 LYS HE2 . 16767 1 540 . 1 1 47 47 LYS HG2 H 1 1.459 . . 2 . . 1 . 47 LYS HG1 . 16767 1 541 . 1 1 47 47 LYS HG3 H 1 1.459 . . 2 . . 1 . 47 LYS HG2 . 16767 1 542 . 1 1 47 47 LYS C C 13 179.296 . . 1 . . 1 . 47 LYS C . 16767 1 543 . 1 1 47 47 LYS CA C 13 58.548 . . 1 . . 1 . 47 LYS CA . 16767 1 544 . 1 1 47 47 LYS CB C 13 30.933 . . 1 . . 1 . 47 LYS CB . 16767 1 545 . 1 1 47 47 LYS CD C 13 28.099 . . 1 . . 1 . 47 LYS CD . 16767 1 546 . 1 1 47 47 LYS CE C 13 41.431 . . 1 . . 1 . 47 LYS CE . 16767 1 547 . 1 1 47 47 LYS CG C 13 24.571 . . 1 . . 1 . 47 LYS CG . 16767 1 548 . 1 1 47 47 LYS N N 15 119.478 . . 1 . . 1 . 47 LYS N . 16767 1 549 . 1 1 48 48 GLU H H 1 7.815 . . 1 . . 1 . 48 GLU HN . 16767 1 550 . 1 1 48 48 GLU HA H 1 3.807 . . 1 . . 1 . 48 GLU HA . 16767 1 551 . 1 1 48 48 GLU HB2 H 1 2.057 . . 2 . . 1 . 48 GLU HB1 . 16767 1 552 . 1 1 48 48 GLU HB3 H 1 1.979 . . 2 . . 1 . 48 GLU HB2 . 16767 1 553 . 1 1 48 48 GLU HG2 H 1 2.038 . . 2 . . 1 . 48 GLU HG1 . 16767 1 554 . 1 1 48 48 GLU HG3 H 1 2.038 . . 2 . . 1 . 48 GLU HG2 . 16767 1 555 . 1 1 48 48 GLU C C 13 177.298 . . 1 . . 1 . 48 GLU C . 16767 1 556 . 1 1 48 48 GLU CA C 13 59.002 . . 1 . . 1 . 48 GLU CA . 16767 1 557 . 1 1 48 48 GLU CB C 13 29.007 . . 1 . . 1 . 48 GLU CB . 16767 1 558 . 1 1 48 48 GLU CG C 13 35.314 . . 1 . . 1 . 48 GLU CG . 16767 1 559 . 1 1 48 48 GLU N N 15 122.762 . . 1 . . 1 . 48 GLU N . 16767 1 560 . 1 1 49 49 ALA H H 1 8.323 . . 1 . . 1 . 49 ALA HN . 16767 1 561 . 1 1 49 49 ALA HA H 1 3.862 . . 1 . . 1 . 49 ALA HA . 16767 1 562 . 1 1 49 49 ALA HB1 H 1 1.661 . . 1 . . 1 . 49 ALA HB1 . 16767 1 563 . 1 1 49 49 ALA HB2 H 1 1.661 . . 1 . . 1 . 49 ALA HB1 . 16767 1 564 . 1 1 49 49 ALA HB3 H 1 1.661 . . 1 . . 1 . 49 ALA HB1 . 16767 1 565 . 1 1 49 49 ALA C C 13 179.891 . . 1 . . 1 . 49 ALA C . 16767 1 566 . 1 1 49 49 ALA CA C 13 54.914 . . 1 . . 1 . 49 ALA CA . 16767 1 567 . 1 1 49 49 ALA CB C 13 18.488 . . 1 . . 1 . 49 ALA CB . 16767 1 568 . 1 1 49 49 ALA N N 15 120.845 . . 1 . . 1 . 49 ALA N . 16767 1 569 . 1 1 50 50 SER H H 1 8.877 . . 1 . . 1 . 50 SER HN . 16767 1 570 . 1 1 50 50 SER HA H 1 4.056 . . 1 . . 1 . 50 SER HA . 16767 1 571 . 1 1 50 50 SER HB2 H 1 3.885 . . 2 . . 1 . 50 SER HB1 . 16767 1 572 . 1 1 50 50 SER HB3 H 1 3.885 . . 2 . . 1 . 50 SER HB2 . 16767 1 573 . 1 1 50 50 SER C C 13 176.811 . . 1 . . 1 . 50 SER C . 16767 1 574 . 1 1 50 50 SER CA C 13 60.911 . . 1 . . 1 . 50 SER CA . 16767 1 575 . 1 1 50 50 SER CB C 13 62.091 . . 1 . . 1 . 50 SER CB . 16767 1 576 . 1 1 50 50 SER N N 15 112.676 . . 1 . . 1 . 50 SER N . 16767 1 577 . 1 1 51 51 THR H H 1 7.743 . . 1 . . 1 . 51 THR HN . 16767 1 578 . 1 1 51 51 THR HA H 1 3.776 . . 1 . . 1 . 51 THR HA . 16767 1 579 . 1 1 51 51 THR HB H 1 3.745 . . 1 . . 1 . 51 THR HB . 16767 1 580 . 1 1 51 51 THR HG21 H 1 1.125 . . 1 . . 1 . 51 THR HG21 . 16767 1 581 . 1 1 51 51 THR HG22 H 1 1.125 . . 1 . . 1 . 51 THR HG21 . 16767 1 582 . 1 1 51 51 THR HG23 H 1 1.125 . . 1 . . 1 . 51 THR HG21 . 16767 1 583 . 1 1 51 51 THR C C 13 176.469 . . 1 . . 1 . 51 THR C . 16767 1 584 . 1 1 51 51 THR CA C 13 66.178 . . 1 . . 1 . 51 THR CA . 16767 1 585 . 1 1 51 51 THR CB C 13 67.722 . . 1 . . 1 . 51 THR CB . 16767 1 586 . 1 1 51 51 THR CG2 C 13 19.315 . . 1 . . 1 . 51 THR CG2 . 16767 1 587 . 1 1 51 51 THR N N 15 119.889 . . 1 . . 1 . 51 THR N . 16767 1 588 . 1 1 52 52 ILE H H 1 8.130 . . 1 . . 1 . 52 ILE HN . 16767 1 589 . 1 1 52 52 ILE HA H 1 3.473 . . 1 . . 1 . 52 ILE HA . 16767 1 590 . 1 1 52 52 ILE HB H 1 1.831 . . 1 . . 1 . 52 ILE HB . 16767 1 591 . 1 1 52 52 ILE HD11 H 1 0.096 . . 1 . . 1 . 52 ILE HD11 . 16767 1 592 . 1 1 52 52 ILE HD12 H 1 0.096 . . 1 . . 1 . 52 ILE HD11 . 16767 1 593 . 1 1 52 52 ILE HD13 H 1 0.096 . . 1 . . 1 . 52 ILE HD11 . 16767 1 594 . 1 1 52 52 ILE HG12 H 1 0.917 . . 1 . . 1 . 52 ILE HG11 . 16767 1 595 . 1 1 52 52 ILE HG13 H 1 0.917 . . 1 . . 1 . 52 ILE HG12 . 16767 1 596 . 1 1 52 52 ILE HG21 H 1 0.655 . . 2 . . 1 . 52 ILE HG21 . 16767 1 597 . 1 1 52 52 ILE HG22 H 1 0.655 . . 2 . . 1 . 52 ILE HG21 . 16767 1 598 . 1 1 52 52 ILE HG23 H 1 0.655 . . 2 . . 1 . 52 ILE HG21 . 16767 1 599 . 1 1 52 52 ILE C C 13 177.082 . . 1 . . 1 . 52 ILE C . 16767 1 600 . 1 1 52 52 ILE CA C 13 62.545 . . 1 . . 1 . 52 ILE CA . 16767 1 601 . 1 1 52 52 ILE CB C 13 35.657 . . 1 . . 1 . 52 ILE CB . 16767 1 602 . 1 1 52 52 ILE CD1 C 13 11.081 . . 1 . . 1 . 52 ILE CD1 . 16767 1 603 . 1 1 52 52 ILE CG1 C 13 28.334 . . 2 . . 1 . 52 ILE CG1 . 16767 1 604 . 1 1 52 52 ILE CG2 C 13 18.766 . . 1 . . 1 . 52 ILE CG2 . 16767 1 605 . 1 1 52 52 ILE N N 15 122.412 . . 1 . . 1 . 52 ILE N . 16767 1 606 . 1 1 53 53 ALA H H 1 8.716 . . 1 . . 1 . 53 ALA HN . 16767 1 607 . 1 1 53 53 ALA HA H 1 3.801 . . 1 . . 1 . 53 ALA HA . 16767 1 608 . 1 1 53 53 ALA HB1 H 1 1.621 . . 1 . . 1 . 53 ALA HB1 . 16767 1 609 . 1 1 53 53 ALA HB2 H 1 1.621 . . 1 . . 1 . 53 ALA HB1 . 16767 1 610 . 1 1 53 53 ALA HB3 H 1 1.621 . . 1 . . 1 . 53 ALA HB1 . 16767 1 611 . 1 1 53 53 ALA C C 13 180.178 . . 1 . . 1 . 53 ALA C . 16767 1 612 . 1 1 53 53 ALA CA C 13 55.096 . . 1 . . 1 . 53 ALA CA . 16767 1 613 . 1 1 53 53 ALA CB C 13 18.216 . . 1 . . 1 . 53 ALA CB . 16767 1 614 . 1 1 53 53 ALA N N 15 122.957 . . 1 . . 1 . 53 ALA N . 16767 1 615 . 1 1 54 54 GLU H H 1 7.678 . . 1 . . 1 . 54 GLU HN . 16767 1 616 . 1 1 54 54 GLU HA H 1 3.885 . . 1 . . 1 . 54 GLU HA . 16767 1 617 . 1 1 54 54 GLU HB2 H 1 2.103 . . 2 . . 1 . 54 GLU HB1 . 16767 1 618 . 1 1 54 54 GLU HB3 H 1 2.018 . . 2 . . 1 . 54 GLU HB2 . 16767 1 619 . 1 1 54 54 GLU HG2 H 1 2.332 . . 2 . . 1 . 54 GLU HG1 . 16767 1 620 . 1 1 54 54 GLU HG3 H 1 2.175 . . 2 . . 1 . 54 GLU HG2 . 16767 1 621 . 1 1 54 54 GLU C C 13 18.342 . . 1 . . 1 . 54 GLU C . 16767 1 622 . 1 1 54 54 GLU CA C 13 58.366 . . 1 . . 1 . 54 GLU CA . 16767 1 623 . 1 1 54 54 GLU CB C 13 28.026 . . 1 . . 1 . 54 GLU CB . 16767 1 624 . 1 1 54 54 GLU CG C 13 34.531 . . 1 . . 1 . 54 GLU CG . 16767 1 625 . 1 1 54 54 GLU N N 15 118.362 . . 1 . . 1 . 54 GLU N . 16767 1 626 . 1 1 55 55 TYR H H 1 7.415 . . 1 . . 1 . 55 TYR HN . 16767 1 627 . 1 1 55 55 TYR HA H 1 5.644 . . 1 . . 1 . 55 TYR HA . 16767 1 628 . 1 1 55 55 TYR HB2 H 1 2.632 . . 2 . . 1 . 55 TYR HB1 . 16767 1 629 . 1 1 55 55 TYR HB3 H 1 2.632 . . 2 . . 1 . 55 TYR HB2 . 16767 1 630 . 1 1 55 55 TYR HD1 H 1 7.151 . . 3 . . 1 . 55 TYR HD1 . 16767 1 631 . 1 1 55 55 TYR HD2 H 1 6.855 . . 3 . . 1 . 55 TYR HD2 . 16767 1 632 . 1 1 55 55 TYR HE1 H 1 6.855 . . 3 . . 1 . 55 TYR HE1 . 16767 1 633 . 1 1 55 55 TYR HE2 H 1 6.855 . . 3 . . 1 . 55 TYR HE2 . 16767 1 634 . 1 1 55 55 TYR C C 13 178.414 . . 1 . . 1 . 55 TYR C . 16767 1 635 . 1 1 55 55 TYR CA C 13 59.274 . . 1 . . 1 . 55 TYR CA . 16767 1 636 . 1 1 55 55 TYR CB C 13 37.111 . . 1 . . 1 . 55 TYR CB . 16767 1 637 . 1 1 55 55 TYR CD1 C 13 133.179 . . 3 . . 1 . 55 TYR CD1 . 16767 1 638 . 1 1 55 55 TYR CD2 C 13 118.294 . . 3 . . 1 . 55 TYR CD2 . 16767 1 639 . 1 1 55 55 TYR CE1 C 13 118.294 . . 3 . . 1 . 55 TYR CE1 . 16767 1 640 . 1 1 55 55 TYR CE2 C 13 118.294 . . 3 . . 1 . 55 TYR CE2 . 16767 1 641 . 1 1 55 55 TYR N N 15 121.077 . . 1 . . 1 . 55 TYR N . 16767 1 642 . 1 1 56 56 ILE H H 1 7.672 . . 1 . . 1 . 56 ILE HN . 16767 1 643 . 1 1 56 56 ILE HA H 1 3.006 . . 1 . . 1 . 56 ILE HA . 16767 1 644 . 1 1 56 56 ILE HB H 1 1.123 . . 1 . . 1 . 56 ILE HB . 16767 1 645 . 1 1 56 56 ILE HD11 H 1 -0.023 . . 1 . . 1 . 56 ILE HD11 . 16767 1 646 . 1 1 56 56 ILE HD12 H 1 -0.023 . . 1 . . 1 . 56 ILE HD11 . 16767 1 647 . 1 1 56 56 ILE HD13 H 1 -0.023 . . 1 . . 1 . 56 ILE HD11 . 16767 1 648 . 1 1 56 56 ILE HG12 H 1 0.435 . . 1 . . 1 . 56 ILE HG11 . 16767 1 649 . 1 1 56 56 ILE HG13 H 1 0.965 . . 1 . . 1 . 56 ILE HG12 . 16767 1 650 . 1 1 56 56 ILE HG21 H 1 -0.342 . . 2 . . 1 . 56 ILE HG21 . 16767 1 651 . 1 1 56 56 ILE HG22 H 1 -0.342 . . 2 . . 1 . 56 ILE HG21 . 16767 1 652 . 1 1 56 56 ILE HG23 H 1 -0.342 . . 2 . . 1 . 56 ILE HG21 . 16767 1 653 . 1 1 56 56 ILE C C 13 178.522 . . 1 . . 1 . 56 ILE C . 16767 1 654 . 1 1 56 56 ILE CA C 13 63.544 . . 1 . . 1 . 56 ILE CA . 16767 1 655 . 1 1 56 56 ILE CB C 13 36.202 . . 1 . . 1 . 56 ILE CB . 16767 1 656 . 1 1 56 56 ILE CD1 C 13 12.101 . . 1 . . 1 . 56 ILE CD1 . 16767 1 657 . 1 1 56 56 ILE CG1 C 13 26.766 . . 2 . . 1 . 56 ILE CG1 . 16767 1 658 . 1 1 56 56 ILE CG2 C 13 16.257 . . 1 . . 1 . 56 ILE CG2 . 16767 1 659 . 1 1 56 56 ILE N N 15 118.342 . . 1 . . 1 . 56 ILE N . 16767 1 660 . 1 1 57 57 SER H H 1 8.057 . . 1 . . 1 . 57 SER HN . 16767 1 661 . 1 1 57 57 SER HA H 1 4.453 . . 1 . . 1 . 57 SER HA . 16767 1 662 . 1 1 57 57 SER HB2 H 1 3.979 . . 2 . . 1 . 57 SER HB1 . 16767 1 663 . 1 1 57 57 SER HB3 H 1 3.878 . . 2 . . 1 . 57 SER HB2 . 16767 1 664 . 1 1 57 57 SER C C 13 175.137 . . 1 . . 1 . 57 SER C . 16767 1 665 . 1 1 57 57 SER CA C 13 60.546 . . 1 . . 1 . 57 SER CA . 16767 1 666 . 1 1 57 57 SER CB C 13 62.454 . . 1 . . 1 . 57 SER CB . 16767 1 667 . 1 1 57 57 SER N N 15 113.853 . . 1 . . 1 . 57 SER N . 16767 1 668 . 1 1 58 58 GLY H H 1 7.320 . . 1 . . 1 . 58 GLY HN . 16767 1 669 . 1 1 58 58 GLY HA2 H 1 3.807 . . 2 . . 1 . 58 GLY HA1 . 16767 1 670 . 1 1 58 58 GLY HA3 H 1 3.574 . . 2 . . 1 . 58 GLY HA2 . 16767 1 671 . 1 1 58 58 GLY C C 13 174.381 . . 1 . . 1 . 58 GLY C . 16767 1 672 . 1 1 58 58 GLY CA C 13 45.104 . . 1 . . 1 . 58 GLY CA . 16767 1 673 . 1 1 58 58 GLY N N 15 107.038 . . 1 . . 1 . 58 GLY N . 16767 1 674 . 1 1 59 59 TYR H H 1 8.084 . . 1 . . 1 . 59 TYR HN . 16767 1 675 . 1 1 59 59 TYR HA H 1 4.337 . . 1 . . 1 . 59 TYR HA . 16767 1 676 . 1 1 59 59 TYR HB2 H 1 3.068 . . 2 . . 1 . 59 TYR HB1 . 16767 1 677 . 1 1 59 59 TYR HB3 H 1 2.928 . . 2 . . 1 . 59 TYR HB2 . 16767 1 678 . 1 1 59 59 TYR HD1 H 1 7.002 . . 3 . . 1 . 59 TYR HD1 . 16767 1 679 . 1 1 59 59 TYR HD2 H 1 7.002 . . 3 . . 1 . 59 TYR HD2 . 16767 1 680 . 1 1 59 59 TYR HE1 H 1 6.338 . . 3 . . 1 . 59 TYR HE1 . 16767 1 681 . 1 1 59 59 TYR HE2 H 1 6.338 . . 3 . . 1 . 59 TYR HE2 . 16767 1 682 . 1 1 59 59 TYR C C 13 176.037 . . 1 . . 1 . 59 TYR C . 16767 1 683 . 1 1 59 59 TYR CA C 13 59.365 . . 1 . . 1 . 59 TYR CA . 16767 1 684 . 1 1 59 59 TYR CB C 13 39.108 . . 1 . . 1 . 59 TYR CB . 16767 1 685 . 1 1 59 59 TYR CD1 C 13 133.363 . . 3 . . 1 . 59 TYR CD1 . 16767 1 686 . 1 1 59 59 TYR CD2 C 13 133.363 . . 3 . . 1 . 59 TYR CD2 . 16767 1 687 . 1 1 59 59 TYR CE1 C 13 118.476 . . 3 . . 1 . 59 TYR CE1 . 16767 1 688 . 1 1 59 59 TYR CE2 C 13 118.476 . . 3 . . 1 . 59 TYR CE2 . 16767 1 689 . 1 1 59 59 TYR N N 15 117.967 . . 1 . . 1 . 59 TYR N . 16767 1 690 . 1 1 60 60 GLN H H 1 8.194 . . 1 . . 1 . 60 GLN HN . 16767 1 691 . 1 1 60 60 GLN HA H 1 4.422 . . 1 . . 1 . 60 GLN HA . 16767 1 692 . 1 1 60 60 GLN HB2 H 1 2.345 . . 2 . . 1 . 60 GLN HB1 . 16767 1 693 . 1 1 60 60 GLN HB3 H 1 2.274 . . 2 . . 1 . 60 GLN HB2 . 16767 1 694 . 1 1 60 60 GLN HE22 H 1 7.281 . . 2 . . 1 . 60 GLN HE22 . 16767 1 695 . 1 1 60 60 GLN HG2 H 1 2.424 . . 2 . . 1 . 60 GLN HG1 . 16767 1 696 . 1 1 60 60 GLN HG3 H 1 2.424 . . 2 . . 1 . 60 GLN HG2 . 16767 1 697 . 1 1 60 60 GLN C C 13 173.535 . . 1 . . 1 . 60 GLN C . 16767 1 698 . 1 1 60 60 GLN CA C 13 55.096 . . 1 . . 1 . 60 GLN CA . 16767 1 699 . 1 1 60 60 GLN CB C 13 26.482 . . 1 . . 1 . 60 GLN CB . 16767 1 700 . 1 1 60 60 GLN CD C 13 110.744 . . 1 . . 1 . 60 GLN CD . 16767 1 701 . 1 1 60 60 GLN CG C 13 30.295 . . 1 . . 1 . 60 GLN CG . 16767 1 702 . 1 1 60 60 GLN N N 15 115.455 . . 1 . . 1 . 60 GLN N . 16767 1 703 . 1 1 60 60 GLN NE2 N 15 110.748 . . 1 . . 1 . 60 GLN NE2 . 16767 1 704 . 1 1 61 61 ARG H H 1 8.528 . . 1 . . 1 . 61 ARG HN . 16767 1 705 . 1 1 61 61 ARG HA H 1 4.734 . . 1 . . 1 . 61 ARG HA . 16767 1 706 . 1 1 61 61 ARG HB2 H 1 2.057 . . 2 . . 1 . 61 ARG HB1 . 16767 1 707 . 1 1 61 61 ARG HB3 H 1 1.652 . . 2 . . 1 . 61 ARG HB2 . 16767 1 708 . 1 1 61 61 ARG HD2 H 1 3.159 . . 2 . . 1 . 61 ARG HD1 . 16767 1 709 . 1 1 61 61 ARG HD3 H 1 3.159 . . 2 . . 1 . 61 ARG HD2 . 16767 1 710 . 1 1 61 61 ARG HG2 H 1 1.604 . . 2 . . 1 . 61 ARG HG1 . 16767 1 711 . 1 1 61 61 ARG HG3 H 1 1.604 . . 2 . . 1 . 61 ARG HG2 . 16767 1 712 . 1 1 61 61 ARG C C 13 175.947 . . 1 . . 1 . 61 ARG C . 16767 1 713 . 1 1 61 61 ARG CA C 13 54.278 . . 1 . . 1 . 61 ARG CA . 16767 1 714 . 1 1 61 61 ARG CB C 13 30.751 . . 1 . . 1 . 61 ARG CB . 16767 1 715 . 1 1 61 61 ARG CD C 13 42.529 . . 1 . . 1 . 61 ARG CD . 16767 1 716 . 1 1 61 61 ARG CG C 13 26.609 . . 1 . . 1 . 61 ARG CG . 16767 1 717 . 1 1 61 61 ARG N N 15 116.904 . . 1 . . 1 . 61 ARG N . 16767 1 718 . 1 1 62 62 SER H H 1 8.686 . . 1 . . 1 . 62 SER HN . 16767 1 719 . 1 1 62 62 SER HA H 1 4.574 . . 1 . . 1 . 62 SER HA . 16767 1 720 . 1 1 62 62 SER HB2 H 1 3.165 . . 2 . . 1 . 62 SER HB1 . 16767 1 721 . 1 1 62 62 SER HB3 H 1 3.076 . . 2 . . 1 . 62 SER HB2 . 16767 1 722 . 1 1 62 62 SER C C 13 174.004 . . 1 . . 1 . 62 SER C . 16767 1 723 . 1 1 62 62 SER CA C 13 58.184 . . 1 . . 1 . 62 SER CA . 16767 1 724 . 1 1 62 62 SER CB C 13 64.634 . . 1 . . 1 . 62 SER CB . 16767 1 725 . 1 1 62 62 SER N N 15 114.299 . . 1 . . 1 . 62 SER N . 16767 1 726 . 1 1 63 63 GLN H H 1 8.425 . . 1 . . 1 . 63 GLN HN . 16767 1 727 . 1 1 63 63 GLN HA H 1 4.204 . . 1 . . 1 . 63 GLN HA . 16767 1 728 . 1 1 63 63 GLN HB2 H 1 1.963 . . 2 . . 1 . 63 GLN HB1 . 16767 1 729 . 1 1 63 63 GLN HB3 H 1 1.815 . . 2 . . 1 . 63 GLN HB2 . 16767 1 730 . 1 1 63 63 GLN HE21 H 1 7.500 . . 2 . . 1 . 63 GLN HE21 . 16767 1 731 . 1 1 63 63 GLN HE22 H 1 6.847 . . 2 . . 1 . 63 GLN HE22 . 16767 1 732 . 1 1 63 63 GLN HG2 H 1 2.211 . . 2 . . 1 . 63 GLN HG1 . 16767 1 733 . 1 1 63 63 GLN HG3 H 1 2.211 . . 2 . . 1 . 63 GLN HG2 . 16767 1 734 . 1 1 63 63 GLN CA C 13 54.611 . . 1 . . 1 . 63 GLN CA . 16767 1 735 . 1 1 63 63 GLN CB C 13 28.393 . . 1 . . 1 . 63 GLN CB . 16767 1 736 . 1 1 63 63 GLN CG C 13 33.118 . . 1 . . 1 . 63 GLN CG . 16767 1 737 . 1 1 63 63 GLN N N 15 121.728 . . 1 . . 1 . 63 GLN N . 16767 1 738 . 1 1 63 63 GLN NE2 N 15 111.987 . . 1 . . 1 . 63 GLN NE2 . 16767 1 739 . 1 1 65 65 ILE H H 1 7.846 . . 1 . . 1 . 65 ILE HN . 16767 1 740 . 1 1 65 65 ILE HA H 1 4.368 . . 1 . . 1 . 65 ILE HA . 16767 1 741 . 1 1 65 65 ILE HB H 1 1.675 . . 1 . . 1 . 65 ILE HB . 16767 1 742 . 1 1 65 65 ILE HD11 H 1 0.384 . . 1 . . 1 . 65 ILE HD11 . 16767 1 743 . 1 1 65 65 ILE HD12 H 1 0.384 . . 1 . . 1 . 65 ILE HD11 . 16767 1 744 . 1 1 65 65 ILE HD13 H 1 0.384 . . 1 . . 1 . 65 ILE HD11 . 16767 1 745 . 1 1 65 65 ILE HG12 H 1 1.468 . . 1 . . 1 . 65 ILE HG11 . 16767 1 746 . 1 1 65 65 ILE HG13 H 1 1.057 . . 1 . . 1 . 65 ILE HG12 . 16767 1 747 . 1 1 65 65 ILE HG21 H 1 0.849 . . 2 . . 1 . 65 ILE HG21 . 16767 1 748 . 1 1 65 65 ILE HG22 H 1 0.849 . . 2 . . 1 . 65 ILE HG21 . 16767 1 749 . 1 1 65 65 ILE HG23 H 1 0.849 . . 2 . . 1 . 65 ILE HG21 . 16767 1 750 . 1 1 65 65 ILE C C 13 176.379 . . 1 . . 1 . 65 ILE C . 16767 1 751 . 1 1 65 65 ILE CA C 13 59.911 . . 1 . . 1 . 65 ILE CA . 16767 1 752 . 1 1 65 65 ILE CB C 13 42.106 . . 1 . . 1 . 65 ILE CB . 16767 1 753 . 1 1 65 65 ILE CD1 C 13 15.316 . . 1 . . 1 . 65 ILE CD1 . 16767 1 754 . 1 1 65 65 ILE CG1 C 13 17.591 . . 2 . . 1 . 65 ILE CG1 . 16767 1 755 . 1 1 65 65 ILE CG2 C 13 26.766 . . 1 . . 1 . 65 ILE CG2 . 16767 1 756 . 1 1 65 65 ILE N N 15 114.340 . . 1 . . 1 . 65 ILE N . 16767 1 757 . 1 1 66 66 TRP H H 1 9.917 . . 1 . . 1 . 66 TRP HN . 16767 1 758 . 1 1 66 66 TRP HA H 1 5.667 . . 1 . . 1 . 66 TRP HA . 16767 1 759 . 1 1 66 66 TRP HB2 H 1 3.496 . . 2 . . 1 . 66 TRP HB1 . 16767 1 760 . 1 1 66 66 TRP HB3 H 1 3.496 . . 2 . . 1 . 66 TRP HB2 . 16767 1 761 . 1 1 66 66 TRP HD1 H 1 7.218 . . 1 . . 1 . 66 TRP HD1 . 16767 1 762 . 1 1 66 66 TRP HE1 H 1 10.345 . . 3 . . 1 . 66 TRP HE1 . 16767 1 763 . 1 1 66 66 TRP C C 13 175.875 . . 1 . . 1 . 66 TRP C . 16767 1 764 . 1 1 66 66 TRP CA C 13 57.912 . . 1 . . 1 . 66 TRP CA . 16767 1 765 . 1 1 66 66 TRP CB C 13 31.478 . . 1 . . 1 . 66 TRP CB . 16767 1 766 . 1 1 66 66 TRP CD1 C 13 124.742 . . 3 . . 1 . 66 TRP CD1 . 16767 1 767 . 1 1 66 66 TRP N N 15 126.519 . . 1 . . 1 . 66 TRP N . 16767 1 768 . 1 1 66 66 TRP NE1 N 15 129.808 . . 1 . . 1 . 66 TRP NE1 . 16767 1 769 . 1 1 67 67 ILE H H 1 8.258 . . 1 . . 1 . 67 ILE HN . 16767 1 770 . 1 1 67 67 ILE HA H 1 5.099 . . 1 . . 1 . 67 ILE HA . 16767 1 771 . 1 1 67 67 ILE HB H 1 2.502 . . 1 . . 1 . 67 ILE HB . 16767 1 772 . 1 1 67 67 ILE HD11 H 1 -0.010 . . 1 . . 1 . 67 ILE HD11 . 16767 1 773 . 1 1 67 67 ILE HD12 H 1 -0.010 . . 1 . . 1 . 67 ILE HD11 . 16767 1 774 . 1 1 67 67 ILE HD13 H 1 -0.010 . . 1 . . 1 . 67 ILE HD11 . 16767 1 775 . 1 1 67 67 ILE HG12 H 1 1.199 . . 1 . . 1 . 67 ILE HG11 . 16767 1 776 . 1 1 67 67 ILE HG13 H 1 1.037 . . 1 . . 1 . 67 ILE HG12 . 16767 1 777 . 1 1 67 67 ILE HG21 H 1 1.157 . . 2 . . 1 . 67 ILE HG21 . 16767 1 778 . 1 1 67 67 ILE HG22 H 1 1.157 . . 2 . . 1 . 67 ILE HG21 . 16767 1 779 . 1 1 67 67 ILE HG23 H 1 1.157 . . 2 . . 1 . 67 ILE HG21 . 16767 1 780 . 1 1 67 67 ILE C C 13 176.469 . . 1 . . 1 . 67 ILE C . 16767 1 781 . 1 1 67 67 ILE CA C 13 59.547 . . 1 . . 1 . 67 ILE CA . 16767 1 782 . 1 1 67 67 ILE CB C 13 40.834 . . 1 . . 1 . 67 ILE CB . 16767 1 783 . 1 1 67 67 ILE CD1 C 13 12.022 . . 1 . . 1 . 67 ILE CD1 . 16767 1 784 . 1 1 67 67 ILE CG1 C 13 25.276 . . 2 . . 1 . 67 ILE CG1 . 16767 1 785 . 1 1 67 67 ILE CG2 C 13 19.551 . . 1 . . 1 . 67 ILE CG2 . 16767 1 786 . 1 1 67 67 ILE N N 15 111.190 . . 1 . . 1 . 67 ILE N . 16767 1 787 . 1 1 68 68 GLY H H 1 9.570 . . 1 . . 1 . 68 GLY HN . 16767 1 788 . 1 1 68 68 GLY HA2 H 1 4.274 . . 2 . . 1 . 68 GLY HA1 . 16767 1 789 . 1 1 68 68 GLY HA3 H 1 3.878 . . 2 . . 1 . 68 GLY HA2 . 16767 1 790 . 1 1 68 68 GLY C C 13 172.419 . . 1 . . 1 . 68 GLY C . 16767 1 791 . 1 1 68 68 GLY CA C 13 48.374 . . 1 . . 1 . 68 GLY CA . 16767 1 792 . 1 1 68 68 GLY N N 15 107.267 . . 1 . . 1 . 68 GLY N . 16767 1 793 . 1 1 69 69 LEU H H 1 7.145 . . 1 . . 1 . 69 LEU HN . 16767 1 794 . 1 1 69 69 LEU HA H 1 4.734 . . 1 . . 1 . 69 LEU HA . 16767 1 795 . 1 1 69 69 LEU HB2 H 1 1.208 . . 2 . . 1 . 69 LEU HB1 . 16767 1 796 . 1 1 69 69 LEU HB3 H 1 0.329 . . 2 . . 1 . 69 LEU HB2 . 16767 1 797 . 1 1 69 69 LEU HD11 H 1 -0.899 . . 2 . . 1 . 69 LEU HD11 . 16767 1 798 . 1 1 69 69 LEU HD12 H 1 -0.899 . . 2 . . 1 . 69 LEU HD11 . 16767 1 799 . 1 1 69 69 LEU HD13 H 1 -0.899 . . 2 . . 1 . 69 LEU HD11 . 16767 1 800 . 1 1 69 69 LEU HD21 H 1 -0.899 . . 2 . . 1 . 69 LEU HD21 . 16767 1 801 . 1 1 69 69 LEU HD22 H 1 -0.899 . . 2 . . 1 . 69 LEU HD21 . 16767 1 802 . 1 1 69 69 LEU HD23 H 1 -0.899 . . 2 . . 1 . 69 LEU HD21 . 16767 1 803 . 1 1 69 69 LEU HG H 1 -0.218 . . 1 . . 1 . 69 LEU HG . 16767 1 804 . 1 1 69 69 LEU C C 13 174.741 . . 1 . . 1 . 69 LEU C . 16767 1 805 . 1 1 69 69 LEU CA C 13 52.643 . . 1 . . 1 . 69 LEU CA . 16767 1 806 . 1 1 69 69 LEU CB C 13 41.834 . . 1 . . 1 . 69 LEU CB . 16767 1 807 . 1 1 69 69 LEU CD1 C 13 20.806 . . 1 . . 1 . 69 LEU CD1 . 16767 1 808 . 1 1 69 69 LEU CD2 C 13 20.806 . . 1 . . 1 . 69 LEU CD2 . 16767 1 809 . 1 1 69 69 LEU CG C 13 25.825 . . 1 . . 1 . 69 LEU CG . 16767 1 810 . 1 1 69 69 LEU N N 15 126.483 . . 1 . . 1 . 69 LEU N . 16767 1 811 . 1 1 70 70 HIS H H 1 9.307 . . 1 . . 1 . 70 HIS HN . 16767 1 812 . 1 1 70 70 HIS HA H 1 5.224 . . 1 . . 1 . 70 HIS HA . 16767 1 813 . 1 1 70 70 HIS HB2 H 1 2.702 . . 2 . . 1 . 70 HIS HB1 . 16767 1 814 . 1 1 70 70 HIS HB3 H 1 2.516 . . 2 . . 1 . 70 HIS HB2 . 16767 1 815 . 1 1 70 70 HIS HD2 H 1 7.068 . . 3 . . 1 . 70 HIS HD2 . 16767 1 816 . 1 1 70 70 HIS C C 13 171.213 . . 1 . . 1 . 70 HIS C . 16767 1 817 . 1 1 70 70 HIS CA C 13 53.007 . . 1 . . 1 . 70 HIS CA . 16767 1 818 . 1 1 70 70 HIS CB C 13 30.025 . . 1 . . 1 . 70 HIS CB . 16767 1 819 . 1 1 70 70 HIS CD2 C 13 119.799 . . 1 . . 1 . 70 HIS CD2 . 16767 1 820 . 1 1 70 70 HIS N N 15 120.324 . . 1 . . 1 . 70 HIS N . 16767 1 821 . 1 1 71 71 ASP H H 1 7.753 . . 1 . . 1 . 71 ASP HN . 16767 1 822 . 1 1 71 71 ASP CA C 13 49.464 . . 1 . . 1 . 71 ASP CA . 16767 1 823 . 1 1 71 71 ASP CB C 13 39.926 . . 1 . . 1 . 71 ASP CB . 16767 1 824 . 1 1 71 71 ASP N N 15 118.634 . . 1 . . 1 . 71 ASP N . 16767 1 825 . 1 1 72 72 PRO HA H 1 3.932 . . 1 . . 1 . 72 PRO HA . 16767 1 826 . 1 1 72 72 PRO HB2 H 1 1.839 . . 2 . . 1 . 72 PRO HB1 . 16767 1 827 . 1 1 72 72 PRO HB3 H 1 1.731 . . 2 . . 1 . 72 PRO HB2 . 16767 1 828 . 1 1 72 72 PRO HD2 H 1 3.421 . . 2 . . 1 . 72 PRO HD1 . 16767 1 829 . 1 1 72 72 PRO HD3 H 1 3.421 . . 2 . . 1 . 72 PRO HD2 . 16767 1 830 . 1 1 72 72 PRO HG2 H 1 1.628 . . 2 . . 1 . 72 PRO HG1 . 16767 1 831 . 1 1 72 72 PRO HG3 H 1 1.322 . . 2 . . 1 . 72 PRO HG2 . 16767 1 832 . 1 1 72 72 PRO C C 13 178.036 . . 1 . . 1 . 72 PRO C . 16767 1 833 . 1 1 72 72 PRO CA C 13 63.544 . . 1 . . 1 . 72 PRO CA . 16767 1 834 . 1 1 72 72 PRO CB C 13 30.751 . . 1 . . 1 . 72 PRO CB . 16767 1 835 . 1 1 72 72 PRO CD C 13 49.038 . . 1 . . 1 . 72 PRO CD . 16767 1 836 . 1 1 72 72 PRO CG C 13 26.217 . . 1 . . 1 . 72 PRO CG . 16767 1 837 . 1 1 73 73 GLN H H 1 8.838 . . 1 . . 1 . 73 GLN HN . 16767 1 838 . 1 1 73 73 GLN HA H 1 4.103 . . 1 . . 1 . 73 GLN HA . 16767 1 839 . 1 1 73 73 GLN HB2 H 1 2.025 . . 2 . . 1 . 73 GLN HB1 . 16767 1 840 . 1 1 73 73 GLN HB3 H 1 1.722 . . 2 . . 1 . 73 GLN HB2 . 16767 1 841 . 1 1 73 73 GLN HE21 H 1 7.471 . . 2 . . 1 . 73 GLN HE21 . 16767 1 842 . 1 1 73 73 GLN HE22 H 1 6.885 . . 2 . . 1 . 73 GLN HE22 . 16767 1 843 . 1 1 73 73 GLN HG2 H 1 2.122 . . 2 . . 1 . 73 GLN HG1 . 16767 1 844 . 1 1 73 73 GLN HG3 H 1 2.122 . . 2 . . 1 . 73 GLN HG2 . 16767 1 845 . 1 1 73 73 GLN C C 13 174.867 . . 1 . . 1 . 73 GLN C . 16767 1 846 . 1 1 73 73 GLN CA C 13 54.733 . . 1 . . 1 . 73 GLN CA . 16767 1 847 . 1 1 73 73 GLN CB C 13 27.118 . . 1 . . 1 . 73 GLN CB . 16767 1 848 . 1 1 73 73 GLN CG C 13 33.824 . . 1 . . 1 . 73 GLN CG . 16767 1 849 . 1 1 73 73 GLN N N 15 116.171 . . 1 . . 1 . 73 GLN N . 16767 1 850 . 1 1 73 73 GLN NE2 N 15 111.153 . . 1 . . 1 . 73 GLN NE2 . 16767 1 851 . 1 1 74 74 LYS H H 1 7.390 . . 1 . . 1 . 74 LYS HN . 16767 1 852 . 1 1 74 74 LYS HA H 1 3.045 . . 1 . . 1 . 74 LYS HA . 16767 1 853 . 1 1 74 74 LYS HB2 H 1 1.784 . . 2 . . 1 . 74 LYS HB1 . 16767 1 854 . 1 1 74 74 LYS HB3 H 1 1.123 . . 2 . . 1 . 74 LYS HB2 . 16767 1 855 . 1 1 74 74 LYS HD2 H 1 1.269 . . 2 . . 1 . 74 LYS HD1 . 16767 1 856 . 1 1 74 74 LYS HD3 H 1 1.269 . . 2 . . 1 . 74 LYS HD2 . 16767 1 857 . 1 1 74 74 LYS HE2 H 1 3.027 . . 2 . . 1 . 74 LYS HE1 . 16767 1 858 . 1 1 74 74 LYS HE3 H 1 3.027 . . 2 . . 1 . 74 LYS HE2 . 16767 1 859 . 1 1 74 74 LYS HG2 H 1 -0.186 . . 2 . . 1 . 74 LYS HG1 . 16767 1 860 . 1 1 74 74 LYS HG3 H 1 0.664 . . 2 . . 1 . 74 LYS HG2 . 16767 1 861 . 1 1 74 74 LYS C C 13 175.263 . . 1 . . 1 . 74 LYS C . 16767 1 862 . 1 1 74 74 LYS CA C 13 56.438 . . 1 . . 1 . 74 LYS CA . 16767 1 863 . 1 1 74 74 LYS CB C 13 27.663 . . 1 . . 1 . 74 LYS CB . 16767 1 864 . 1 1 74 74 LYS CD C 13 28.413 . . 1 . . 1 . 74 LYS CD . 16767 1 865 . 1 1 74 74 LYS CE C 13 41.274 . . 1 . . 1 . 74 LYS CE . 16767 1 866 . 1 1 74 74 LYS CG C 13 23.864 . . 1 . . 1 . 74 LYS CG . 16767 1 867 . 1 1 74 74 LYS N N 15 114.111 . . 1 . . 1 . 74 LYS N . 16767 1 868 . 1 1 75 75 ARG H H 1 7.973 . . 1 . . 1 . 75 ARG HN . 16767 1 869 . 1 1 75 75 ARG HA H 1 4.569 . . 1 . . 1 . 75 ARG HA . 16767 1 870 . 1 1 75 75 ARG HB2 H 1 1.808 . . 2 . . 1 . 75 ARG HB1 . 16767 1 871 . 1 1 75 75 ARG HB3 H 1 1.241 . . 2 . . 1 . 75 ARG HB2 . 16767 1 872 . 1 1 75 75 ARG HD2 H 1 2.983 . . 2 . . 1 . 75 ARG HD1 . 16767 1 873 . 1 1 75 75 ARG HD3 H 1 2.983 . . 2 . . 1 . 75 ARG HD2 . 16767 1 874 . 1 1 75 75 ARG HG2 H 1 1.328 . . 2 . . 1 . 75 ARG HG1 . 16767 1 875 . 1 1 75 75 ARG HG3 H 1 1.279 . . 2 . . 1 . 75 ARG HG2 . 16767 1 876 . 1 1 75 75 ARG C C 13 175.011 . . 1 . . 1 . 75 ARG C . 16767 1 877 . 1 1 75 75 ARG CA C 13 53.824 . . 1 . . 1 . 75 ARG CA . 16767 1 878 . 1 1 75 75 ARG CB C 13 30.479 . . 1 . . 1 . 75 ARG CB . 16767 1 879 . 1 1 75 75 ARG CD C 13 42.686 . . 1 . . 1 . 75 ARG CD . 16767 1 880 . 1 1 75 75 ARG CG C 13 25.668 . . 1 . . 1 . 75 ARG CG . 16767 1 881 . 1 1 75 75 ARG N N 15 118.142 . . 1 . . 1 . 75 ARG N . 16767 1 882 . 1 1 76 76 GLN H H 1 9.931 . . 1 . . 1 . 76 GLN HN . 16767 1 883 . 1 1 76 76 GLN HA H 1 2.851 . . 1 . . 1 . 76 GLN HA . 16767 1 884 . 1 1 76 76 GLN HB2 H 1 2.267 . . 2 . . 1 . 76 GLN HB1 . 16767 1 885 . 1 1 76 76 GLN HB3 H 1 2.267 . . 2 . . 1 . 76 GLN HB2 . 16767 1 886 . 1 1 76 76 GLN HE21 H 1 7.508 . . 2 . . 1 . 76 GLN HE21 . 16767 1 887 . 1 1 76 76 GLN HE22 H 1 6.902 . . 2 . . 1 . 76 GLN HE22 . 16767 1 888 . 1 1 76 76 GLN HG2 H 1 2.219 . . 2 . . 1 . 76 GLN HG1 . 16767 1 889 . 1 1 76 76 GLN HG3 H 1 2.219 . . 2 . . 1 . 76 GLN HG2 . 16767 1 890 . 1 1 76 76 GLN C C 13 174.869 . . 1 . . 1 . 76 GLN C . 16767 1 891 . 1 1 76 76 GLN CA C 13 55.823 . . 1 . . 1 . 76 GLN CA . 16767 1 892 . 1 1 76 76 GLN CB C 13 24.393 . . 1 . . 1 . 76 GLN CB . 16767 1 893 . 1 1 76 76 GLN CG C 13 32.961 . . 1 . . 1 . 76 GLN CG . 16767 1 894 . 1 1 76 76 GLN N N 15 120.180 . . 1 . . 1 . 76 GLN N . 16767 1 895 . 1 1 76 76 GLN NE2 N 15 112.675 . . 1 . . 1 . 76 GLN NE2 . 16767 1 896 . 1 1 77 77 GLN H H 1 7.465 . . 1 . . 1 . 77 GLN HN . 16767 1 897 . 1 1 77 77 GLN HA H 1 4.477 . . 1 . . 1 . 77 GLN HA . 16767 1 898 . 1 1 77 77 GLN HB2 H 1 1.862 . . 2 . . 1 . 77 GLN HB1 . 16767 1 899 . 1 1 77 77 GLN HB3 H 1 1.457 . . 2 . . 1 . 77 GLN HB2 . 16767 1 900 . 1 1 77 77 GLN HE21 H 1 7.386 . . 2 . . 1 . 77 GLN HE21 . 16767 1 901 . 1 1 77 77 GLN HE22 H 1 6.798 . . 2 . . 1 . 77 GLN HE22 . 16767 1 902 . 1 1 77 77 GLN HG2 H 1 2.106 . . 2 . . 1 . 77 GLN HG1 . 16767 1 903 . 1 1 77 77 GLN HG3 H 1 2.106 . . 2 . . 1 . 77 GLN HG2 . 16767 1 904 . 1 1 77 77 GLN C C 13 173.805 . . 1 . . 1 . 77 GLN C . 16767 1 905 . 1 1 77 77 GLN CA C 13 52.734 . . 1 . . 1 . 77 GLN CA . 16767 1 906 . 1 1 77 77 GLN CB C 13 27.572 . . 1 . . 1 . 77 GLN CB . 16767 1 907 . 1 1 77 77 GLN CG C 13 32.569 . . 1 . . 1 . 77 GLN CG . 16767 1 908 . 1 1 77 77 GLN N N 15 122.196 . . 1 . . 1 . 77 GLN N . 16767 1 909 . 1 1 77 77 GLN NE2 N 15 111.521 . . 1 . . 1 . 77 GLN NE2 . 16767 1 910 . 1 1 78 78 TRP H H 1 7.115 . . 1 . . 1 . 78 TRP HN . 16767 1 911 . 1 1 78 78 TRP HA H 1 4.025 . . 1 . . 1 . 78 TRP HA . 16767 1 912 . 1 1 78 78 TRP HB2 H 1 2.453 . . 2 . . 1 . 78 TRP HB1 . 16767 1 913 . 1 1 78 78 TRP HB3 H 1 2.212 . . 2 . . 1 . 78 TRP HB2 . 16767 1 914 . 1 1 78 78 TRP HD1 H 1 7.088 . . 1 . . 1 . 78 TRP HD1 . 16767 1 915 . 1 1 78 78 TRP HE1 H 1 9.661 . . 3 . . 1 . 78 TRP HE1 . 16767 1 916 . 1 1 78 78 TRP C C 13 174.903 . . 1 . . 1 . 78 TRP C . 16767 1 917 . 1 1 78 78 TRP CA C 13 56.641 . . 1 . . 1 . 78 TRP CA . 16767 1 918 . 1 1 78 78 TRP CB C 13 28.026 . . 1 . . 1 . 78 TRP CB . 16767 1 919 . 1 1 78 78 TRP CD1 C 13 126.725 . . 3 . . 1 . 78 TRP CD1 . 16767 1 920 . 1 1 78 78 TRP N N 15 122.913 . . 1 . . 1 . 78 TRP N . 16767 1 921 . 1 1 78 78 TRP NE1 N 15 128.886 . . 1 . . 1 . 78 TRP NE1 . 16767 1 922 . 1 1 79 79 GLN H H 1 8.932 . . 1 . . 1 . 79 GLN HN . 16767 1 923 . 1 1 79 79 GLN HA H 1 4.531 . . 1 . . 1 . 79 GLN HA . 16767 1 924 . 1 1 79 79 GLN HB2 H 1 2.337 . . 2 . . 1 . 79 GLN HB1 . 16767 1 925 . 1 1 79 79 GLN HB3 H 1 2.079 . . 2 . . 1 . 79 GLN HB2 . 16767 1 926 . 1 1 79 79 GLN HE21 H 1 7.416 . . 2 . . 1 . 79 GLN HE21 . 16767 1 927 . 1 1 79 79 GLN HE22 H 1 6.908 . . 2 . . 1 . 79 GLN HE22 . 16767 1 928 . 1 1 79 79 GLN HG2 H 1 2.426 . . 2 . . 1 . 79 GLN HG1 . 16767 1 929 . 1 1 79 79 GLN HG3 H 1 2.426 . . 2 . . 1 . 79 GLN HG2 . 16767 1 930 . 1 1 79 79 GLN C C 13 179.047 . . 1 . . 1 . 79 GLN C . 16767 1 931 . 1 1 79 79 GLN CA C 13 53.097 . . 1 . . 1 . 79 GLN CA . 16767 1 932 . 1 1 79 79 GLN CB C 13 32.477 . . 1 . . 1 . 79 GLN CB . 16767 1 933 . 1 1 79 79 GLN CG C 13 32.726 . . 1 . . 1 . 79 GLN CG . 16767 1 934 . 1 1 79 79 GLN N N 15 116.553 . . 1 . . 1 . 79 GLN N . 16767 1 935 . 1 1 79 79 GLN NE2 N 15 112.659 . . 1 . . 1 . 79 GLN NE2 . 16767 1 936 . 1 1 80 80 TRP H H 1 9.191 . . 1 . . 1 . 80 TRP HN . 16767 1 937 . 1 1 80 80 TRP HA H 1 5.403 . . 1 . . 1 . 80 TRP HA . 16767 1 938 . 1 1 80 80 TRP HB2 H 1 3.527 . . 2 . . 1 . 80 TRP HB1 . 16767 1 939 . 1 1 80 80 TRP HB3 H 1 3.426 . . 2 . . 1 . 80 TRP HB2 . 16767 1 940 . 1 1 80 80 TRP HD1 H 1 7.562 . . 1 . . 1 . 80 TRP HD1 . 16767 1 941 . 1 1 80 80 TRP HE1 H 1 10.525 . . 3 . . 1 . 80 TRP HE1 . 16767 1 942 . 1 1 80 80 TRP C C 13 180.161 . . 1 . . 1 . 80 TRP C . 16767 1 943 . 1 1 80 80 TRP CA C 13 54.733 . . 1 . . 1 . 80 TRP CA . 16767 1 944 . 1 1 80 80 TRP CB C 13 30.025 . . 1 . . 1 . 80 TRP CB . 16767 1 945 . 1 1 80 80 TRP N N 15 124.479 . . 1 . . 1 . 80 TRP N . 16767 1 946 . 1 1 80 80 TRP NE1 N 15 128.001 . . 1 . . 1 . 80 TRP NE1 . 16767 1 947 . 1 1 81 81 ILE H H 1 9.687 . . 1 . . 1 . 81 ILE HN . 16767 1 948 . 1 1 81 81 ILE HA H 1 4.555 . . 1 . . 1 . 81 ILE HA . 16767 1 949 . 1 1 81 81 ILE HB H 1 1.808 . . 1 . . 1 . 81 ILE HB . 16767 1 950 . 1 1 81 81 ILE HD11 H 1 1.025 . . 1 . . 1 . 81 ILE HD11 . 16767 1 951 . 1 1 81 81 ILE HD12 H 1 1.025 . . 1 . . 1 . 81 ILE HD11 . 16767 1 952 . 1 1 81 81 ILE HD13 H 1 1.025 . . 1 . . 1 . 81 ILE HD11 . 16767 1 953 . 1 1 81 81 ILE HG12 H 1 1.431 . . 1 . . 1 . 81 ILE HG11 . 16767 1 954 . 1 1 81 81 ILE HG13 H 1 1.255 . . 1 . . 1 . 81 ILE HG12 . 16767 1 955 . 1 1 81 81 ILE HG21 H 1 1.134 . . 2 . . 1 . 81 ILE HG21 . 16767 1 956 . 1 1 81 81 ILE HG22 H 1 1.134 . . 2 . . 1 . 81 ILE HG21 . 16767 1 957 . 1 1 81 81 ILE HG23 H 1 1.134 . . 2 . . 1 . 81 ILE HG21 . 16767 1 958 . 1 1 81 81 ILE C C 13 174.363 . . 1 . . 1 . 81 ILE C . 16767 1 959 . 1 1 81 81 ILE CA C 13 60.183 . . 1 . . 1 . 81 ILE CA . 16767 1 960 . 1 1 81 81 ILE CB C 13 38.382 . . 1 . . 1 . 81 ILE CB . 16767 1 961 . 1 1 81 81 ILE CD1 C 13 14.139 . . 1 . . 1 . 81 ILE CD1 . 16767 1 962 . 1 1 81 81 ILE CG1 C 13 29.118 . . 2 . . 1 . 81 ILE CG1 . 16767 1 963 . 1 1 81 81 ILE CG2 C 13 19.081 . . 1 . . 1 . 81 ILE CG2 . 16767 1 964 . 1 1 81 81 ILE N N 15 127.279 . . 1 . . 1 . 81 ILE N . 16767 1 965 . 1 1 82 82 ASP H H 1 8.224 . . 1 . . 1 . 82 ASP HN . 16767 1 966 . 1 1 82 82 ASP HA H 1 3.667 . . 1 . . 1 . 82 ASP HA . 16767 1 967 . 1 1 82 82 ASP HB2 H 1 3.115 . . 2 . . 1 . 82 ASP HB1 . 16767 1 968 . 1 1 82 82 ASP HB3 H 1 2.329 . . 2 . . 1 . 82 ASP HB2 . 16767 1 969 . 1 1 82 82 ASP C C 13 177.136 . . 1 . . 1 . 82 ASP C . 16767 1 970 . 1 1 82 82 ASP CA C 13 52.371 . . 1 . . 1 . 82 ASP CA . 16767 1 971 . 1 1 82 82 ASP CB C 13 39.835 . . 1 . . 1 . 82 ASP CB . 16767 1 972 . 1 1 82 82 ASP N N 15 119.224 . . 1 . . 1 . 82 ASP N . 16767 1 973 . 1 1 83 83 GLY H H 1 8.066 . . 1 . . 1 . 83 GLY HN . 16767 1 974 . 1 1 83 83 GLY HA2 H 1 4.228 . . 2 . . 1 . 83 GLY HA1 . 16767 1 975 . 1 1 83 83 GLY HA3 H 1 3.846 . . 2 . . 1 . 83 GLY HA2 . 16767 1 976 . 1 1 83 83 GLY C C 13 174.615 . . 1 . . 1 . 83 GLY C . 16767 1 977 . 1 1 83 83 GLY CA C 13 44.286 . . 1 . . 1 . 83 GLY CA . 16767 1 978 . 1 1 83 83 GLY N N 15 107.832 . . 1 . . 1 . 83 GLY N . 16767 1 979 . 1 1 84 84 ALA H H 1 8.257 . . 1 . . 1 . 84 ALA HN . 16767 1 980 . 1 1 84 84 ALA HA H 1 4.212 . . 1 . . 1 . 84 ALA HA . 16767 1 981 . 1 1 84 84 ALA HB1 H 1 1.302 . . 1 . . 1 . 84 ALA HB1 . 16767 1 982 . 1 1 84 84 ALA HB2 H 1 1.302 . . 1 . . 1 . 84 ALA HB1 . 16767 1 983 . 1 1 84 84 ALA HB3 H 1 1.302 . . 1 . . 1 . 84 ALA HB1 . 16767 1 984 . 1 1 84 84 ALA C C 13 176.829 . . 1 . . 1 . 84 ALA C . 16767 1 985 . 1 1 84 84 ALA CA C 13 51.917 . . 1 . . 1 . 84 ALA CA . 16767 1 986 . 1 1 84 84 ALA CB C 13 18.942 . . 1 . . 1 . 84 ALA CB . 16767 1 987 . 1 1 84 84 ALA N N 15 124.921 . . 1 . . 1 . 84 ALA N . 16767 1 988 . 1 1 85 85 MET H H 1 8.575 . . 1 . . 1 . 85 MET HN . 16767 1 989 . 1 1 85 85 MET HA H 1 4.453 . . 1 . . 1 . 85 MET HA . 16767 1 990 . 1 1 85 85 MET HB2 H 1 2.158 . . 2 . . 1 . 85 MET HB1 . 16767 1 991 . 1 1 85 85 MET HB3 H 1 2.057 . . 2 . . 1 . 85 MET HB2 . 16767 1 992 . 1 1 85 85 MET HG2 H 1 2.751 . . 2 . . 1 . 85 MET HG1 . 16767 1 993 . 1 1 85 85 MET HG3 H 1 2.627 . . 2 . . 1 . 85 MET HG2 . 16767 1 994 . 1 1 85 85 MET C C 13 176.487 . . 1 . . 1 . 85 MET C . 16767 1 995 . 1 1 85 85 MET CA C 13 55.641 . . 1 . . 1 . 85 MET CA . 16767 1 996 . 1 1 85 85 MET CB C 13 32.296 . . 1 . . 1 . 85 MET CB . 16767 1 997 . 1 1 85 85 MET CG C 13 31.628 . . 1 . . 1 . 85 MET CG . 16767 1 998 . 1 1 85 85 MET N N 15 120.063 . . 1 . . 1 . 85 MET N . 16767 1 999 . 1 1 86 86 TYR H H 1 8.927 . . 1 . . 1 . 86 TYR HN . 16767 1 1000 . 1 1 86 86 TYR HA H 1 5.309 . . 1 . . 1 . 86 TYR HA . 16767 1 1001 . 1 1 86 86 TYR HB2 H 1 3.169 . . 2 . . 1 . 86 TYR HB1 . 16767 1 1002 . 1 1 86 86 TYR HB3 H 1 2.983 . . 2 . . 1 . 86 TYR HB2 . 16767 1 1003 . 1 1 86 86 TYR HD1 H 1 7.094 . . 3 . . 1 . 86 TYR HD1 . 16767 1 1004 . 1 1 86 86 TYR HD2 H 1 7.094 . . 3 . . 1 . 86 TYR HD2 . 16767 1 1005 . 1 1 86 86 TYR HE1 H 1 6.531 . . 3 . . 1 . 86 TYR HE1 . 16767 1 1006 . 1 1 86 86 TYR HE2 H 1 6.531 . . 3 . . 1 . 86 TYR HE2 . 16767 1 1007 . 1 1 86 86 TYR C C 13 173.887 . . 1 . . 1 . 86 TYR C . 16767 1 1008 . 1 1 86 86 TYR CA C 13 55.641 . . 1 . . 1 . 86 TYR CA . 16767 1 1009 . 1 1 86 86 TYR CB C 13 37.019 . . 1 . . 1 . 86 TYR CB . 16767 1 1010 . 1 1 86 86 TYR CD1 C 13 132.969 . . 3 . . 1 . 86 TYR CD1 . 16767 1 1011 . 1 1 86 86 TYR CD2 C 13 132.969 . . 3 . . 1 . 86 TYR CD2 . 16767 1 1012 . 1 1 86 86 TYR CE1 C 13 119.108 . . 3 . . 1 . 86 TYR CE1 . 16767 1 1013 . 1 1 86 86 TYR CE2 C 13 119.108 . . 3 . . 1 . 86 TYR CE2 . 16767 1 1014 . 1 1 86 86 TYR N N 15 126.474 . . 1 . . 1 . 86 TYR N . 16767 1 1015 . 1 1 87 87 LEU H H 1 8.861 . . 1 . . 1 . 87 LEU HN . 16767 1 1016 . 1 1 87 87 LEU HA H 1 4.359 . . 1 . . 1 . 87 LEU HA . 16767 1 1017 . 1 1 87 87 LEU HB2 H 1 1.761 . . 2 . . 1 . 87 LEU HB1 . 16767 1 1018 . 1 1 87 87 LEU HB3 H 1 1.699 . . 2 . . 1 . 87 LEU HB2 . 16767 1 1019 . 1 1 87 87 LEU HD11 H 1 0.966 . . 2 . . 1 . 87 LEU HD11 . 16767 1 1020 . 1 1 87 87 LEU HD12 H 1 0.966 . . 2 . . 1 . 87 LEU HD11 . 16767 1 1021 . 1 1 87 87 LEU HD13 H 1 0.966 . . 2 . . 1 . 87 LEU HD11 . 16767 1 1022 . 1 1 87 87 LEU HD21 H 1 0.966 . . 2 . . 1 . 87 LEU HD21 . 16767 1 1023 . 1 1 87 87 LEU HD22 H 1 0.966 . . 2 . . 1 . 87 LEU HD21 . 16767 1 1024 . 1 1 87 87 LEU HD23 H 1 0.966 . . 2 . . 1 . 87 LEU HD21 . 16767 1 1025 . 1 1 87 87 LEU HG H 1 1.534 . . 1 . . 1 . 87 LEU HG . 16767 1 1026 . 1 1 87 87 LEU C C 13 175.317 . . 1 . . 1 . 87 LEU C . 16767 1 1027 . 1 1 87 87 LEU CA C 13 56.004 . . 1 . . 1 . 87 LEU CA . 16767 1 1028 . 1 1 87 87 LEU CB C 13 42.924 . . 1 . . 1 . 87 LEU CB . 16767 1 1029 . 1 1 87 87 LEU CD1 C 13 23.786 . . 1 . . 1 . 87 LEU CD1 . 16767 1 1030 . 1 1 87 87 LEU CD2 C 13 23.786 . . 1 . . 1 . 87 LEU CD2 . 16767 1 1031 . 1 1 87 87 LEU CG C 13 26.529 . . 1 . . 1 . 87 LEU CG . 16767 1 1032 . 1 1 87 87 LEU N N 15 131.547 . . 1 . . 1 . 87 LEU N . 16767 1 1033 . 1 1 88 88 TYR H H 1 8.525 . . 1 . . 1 . 88 TYR HN . 16767 1 1034 . 1 1 88 88 TYR HA H 1 4.313 . . 1 . . 1 . 88 TYR HA . 16767 1 1035 . 1 1 88 88 TYR HB2 H 1 3.146 . . 2 . . 1 . 88 TYR HB1 . 16767 1 1036 . 1 1 88 88 TYR HB3 H 1 2.702 . . 2 . . 1 . 88 TYR HB2 . 16767 1 1037 . 1 1 88 88 TYR HD1 H 1 7.156 . . 3 . . 1 . 88 TYR HD1 . 16767 1 1038 . 1 1 88 88 TYR HD2 H 1 7.156 . . 3 . . 1 . 88 TYR HD2 . 16767 1 1039 . 1 1 88 88 TYR HE1 H 1 6.505 . . 3 . . 1 . 88 TYR HE1 . 16767 1 1040 . 1 1 88 88 TYR HE2 H 1 6.505 . . 3 . . 1 . 88 TYR HE2 . 16767 1 1041 . 1 1 88 88 TYR C C 13 174.039 . . 1 . . 1 . 88 TYR C . 16767 1 1042 . 1 1 88 88 TYR CA C 13 58.821 . . 1 . . 1 . 88 TYR CA . 16767 1 1043 . 1 1 88 88 TYR CB C 13 38.386 . . 1 . . 1 . 88 TYR CB . 16767 1 1044 . 1 1 88 88 TYR CD1 C 13 132.996 . . 3 . . 1 . 88 TYR CD1 . 16767 1 1045 . 1 1 88 88 TYR CD2 C 13 132.996 . . 3 . . 1 . 88 TYR CD2 . 16767 1 1046 . 1 1 88 88 TYR CE1 C 13 117.583 . . 3 . . 1 . 88 TYR CE1 . 16767 1 1047 . 1 1 88 88 TYR CE2 C 13 117.583 . . 3 . . 1 . 88 TYR CE2 . 16767 1 1048 . 1 1 88 88 TYR N N 15 123.409 . . 1 . . 1 . 88 TYR N . 16767 1 1049 . 1 1 89 89 ARG H H 1 7.297 . . 1 . . 1 . 89 ARG HN . 16767 1 1050 . 1 1 89 89 ARG HA H 1 4.593 . . 1 . . 1 . 89 ARG HA . 16767 1 1051 . 1 1 89 89 ARG HB2 H 1 1.831 . . 2 . . 1 . 89 ARG HB1 . 16767 1 1052 . 1 1 89 89 ARG HB3 H 1 1.613 . . 2 . . 1 . 89 ARG HB2 . 16767 1 1053 . 1 1 89 89 ARG HD2 H 1 2.844 . . 2 . . 1 . 89 ARG HD1 . 16767 1 1054 . 1 1 89 89 ARG HD3 H 1 2.985 . . 2 . . 1 . 89 ARG HD2 . 16767 1 1055 . 1 1 89 89 ARG HG2 H 1 2.077 . . 2 . . 1 . 89 ARG HG1 . 16767 1 1056 . 1 1 89 89 ARG HG3 H 1 2.077 . . 2 . . 1 . 89 ARG HG2 . 16767 1 1057 . 1 1 89 89 ARG C C 13 175.209 . . 1 . . 1 . 89 ARG C . 16767 1 1058 . 1 1 89 89 ARG CA C 13 53.279 . . 1 . . 1 . 89 ARG CA . 16767 1 1059 . 1 1 89 89 ARG CB C 13 31.206 . . 1 . . 1 . 89 ARG CB . 16767 1 1060 . 1 1 89 89 ARG CD C 13 37.118 . . 1 . . 1 . 89 ARG CD . 16767 1 1061 . 1 1 89 89 ARG CG C 13 32.334 . . 1 . . 1 . 89 ARG CG . 16767 1 1062 . 1 1 89 89 ARG N N 15 121.500 . . 1 . . 1 . 89 ARG N . 16767 1 1063 . 1 1 90 90 SER H H 1 8.376 . . 1 . . 1 . 90 SER HN . 16767 1 1064 . 1 1 90 90 SER HA H 1 3.932 . . 1 . . 1 . 90 SER HA . 16767 1 1065 . 1 1 90 90 SER HB2 H 1 2.601 . . 2 . . 1 . 90 SER HB1 . 16767 1 1066 . 1 1 90 90 SER HB3 H 1 2.352 . . 2 . . 1 . 90 SER HB2 . 16767 1 1067 . 1 1 90 90 SER C C 13 172.689 . . 1 . . 1 . 90 SER C . 16767 1 1068 . 1 1 90 90 SER CA C 13 58.131 . . 1 . . 1 . 90 SER CA . 16767 1 1069 . 1 1 90 90 SER CB C 13 61.786 . . 1 . . 1 . 90 SER CB . 16767 1 1070 . 1 1 90 90 SER N N 15 118.028 . . 1 . . 1 . 90 SER N . 16767 1 1071 . 1 1 91 91 TRP H H 1 7.983 . . 1 . . 1 . 91 TRP HN . 16767 1 1072 . 1 1 91 91 TRP HA H 1 4.741 . . 1 . . 1 . 91 TRP HA . 16767 1 1073 . 1 1 91 91 TRP HB2 H 1 3.379 . . 2 . . 1 . 91 TRP HB1 . 16767 1 1074 . 1 1 91 91 TRP HB3 H 1 2.858 . . 2 . . 1 . 91 TRP HB2 . 16767 1 1075 . 1 1 91 91 TRP HD1 H 1 7.166 . . 1 . . 1 . 91 TRP HD1 . 16767 1 1076 . 1 1 91 91 TRP C C 13 177.406 . . 1 . . 1 . 91 TRP C . 16767 1 1077 . 1 1 91 91 TRP CA C 13 56.095 . . 1 . . 1 . 91 TRP CA . 16767 1 1078 . 1 1 91 91 TRP CB C 13 29.752 . . 1 . . 1 . 91 TRP CB . 16767 1 1079 . 1 1 91 91 TRP CD1 C 13 124.541 . . 3 . . 1 . 91 TRP CD1 . 16767 1 1080 . 1 1 91 91 TRP N N 15 123.172 . . 1 . . 1 . 91 TRP N . 16767 1 1081 . 1 1 92 92 SER H H 1 9.358 . . 1 . . 1 . 92 SER HN . 16767 1 1082 . 1 1 92 92 SER HA H 1 4.352 . . 1 . . 1 . 92 SER HA . 16767 1 1083 . 1 1 92 92 SER HB2 H 1 3.924 . . 2 . . 1 . 92 SER HB1 . 16767 1 1084 . 1 1 92 92 SER HB3 H 1 3.854 . . 2 . . 1 . 92 SER HB2 . 16767 1 1085 . 1 1 92 92 SER C C 13 174.651 . . 1 . . 1 . 92 SER C . 16767 1 1086 . 1 1 92 92 SER CA C 13 58.094 . . 1 . . 1 . 92 SER CA . 16767 1 1087 . 1 1 92 92 SER CB C 13 63.271 . . 1 . . 1 . 92 SER CB . 16767 1 1088 . 1 1 92 92 SER N N 15 117.384 . . 1 . . 1 . 92 SER N . 16767 1 1089 . 1 1 93 93 GLY H H 1 8.294 . . 1 . . 1 . 93 GLY HN . 16767 1 1090 . 1 1 93 93 GLY HA2 H 1 3.488 . . 2 . . 1 . 93 GLY HA1 . 16767 1 1091 . 1 1 93 93 GLY HA3 H 1 3.294 . . 2 . . 1 . 93 GLY HA2 . 16767 1 1092 . 1 1 93 93 GLY C C 13 173.751 . . 1 . . 1 . 93 GLY C . 16767 1 1093 . 1 1 93 93 GLY CA C 13 44.651 . . 1 . . 1 . 93 GLY CA . 16767 1 1094 . 1 1 93 93 GLY N N 15 110.440 . . 1 . . 1 . 93 GLY N . 16767 1 1095 . 1 1 94 94 LYS H H 1 8.151 . . 1 . . 1 . 94 LYS HN . 16767 1 1096 . 1 1 94 94 LYS HA H 1 4.282 . . 1 . . 1 . 94 LYS HA . 16767 1 1097 . 1 1 94 94 LYS HB2 H 1 1.808 . . 2 . . 1 . 94 LYS HB1 . 16767 1 1098 . 1 1 94 94 LYS HB3 H 1 1.652 . . 2 . . 1 . 94 LYS HB2 . 16767 1 1099 . 1 1 94 94 LYS HD2 H 1 1.578 . . 2 . . 1 . 94 LYS HD1 . 16767 1 1100 . 1 1 94 94 LYS HD3 H 1 1.578 . . 2 . . 1 . 94 LYS HD2 . 16767 1 1101 . 1 1 94 94 LYS HE2 H 1 2.904 . . 2 . . 1 . 94 LYS HE1 . 16767 1 1102 . 1 1 94 94 LYS HE3 H 1 2.904 . . 2 . . 1 . 94 LYS HE2 . 16767 1 1103 . 1 1 94 94 LYS HG2 H 1 1.312 . . 2 . . 1 . 94 LYS HG1 . 16767 1 1104 . 1 1 94 94 LYS HG3 H 1 1.312 . . 2 . . 1 . 94 LYS HG2 . 16767 1 1105 . 1 1 94 94 LYS C C 13 176.361 . . 1 . . 1 . 94 LYS C . 16767 1 1106 . 1 1 94 94 LYS CA C 13 55.368 . . 1 . . 1 . 94 LYS CA . 16767 1 1107 . 1 1 94 94 LYS CB C 13 32.114 . . 1 . . 1 . 94 LYS CB . 16767 1 1108 . 1 1 94 94 LYS CD C 13 28.334 . . 1 . . 1 . 94 LYS CD . 16767 1 1109 . 1 1 94 94 LYS CE C 13 41.509 . . 1 . . 1 . 94 LYS CE . 16767 1 1110 . 1 1 94 94 LYS CG C 13 24.021 . . 1 . . 1 . 94 LYS CG . 16767 1 1111 . 1 1 94 94 LYS N N 15 121.007 . . 1 . . 1 . 94 LYS N . 16767 1 1112 . 1 1 95 95 SER H H 1 8.251 . . 1 . . 1 . 95 SER HN . 16767 1 1113 . 1 1 95 95 SER HA H 1 4.352 . . 1 . . 1 . 95 SER HA . 16767 1 1114 . 1 1 95 95 SER HB2 H 1 3.784 . . 2 . . 1 . 95 SER HB1 . 16767 1 1115 . 1 1 95 95 SER HB3 H 1 3.784 . . 2 . . 1 . 95 SER HB2 . 16767 1 1116 . 1 1 95 95 SER C C 13 174.525 . . 1 . . 1 . 95 SER C . 16767 1 1117 . 1 1 95 95 SER CA C 13 57.731 . . 1 . . 1 . 95 SER CA . 16767 1 1118 . 1 1 95 95 SER CB C 13 62.908 . . 1 . . 1 . 95 SER CB . 16767 1 1119 . 1 1 95 95 SER N N 15 116.664 . . 1 . . 1 . 95 SER N . 16767 1 1120 . 1 1 96 96 MET H H 1 8.425 . . 1 . . 1 . 96 MET HN . 16767 1 1121 . 1 1 96 96 MET HA H 1 4.492 . . 1 . . 1 . 96 MET HA . 16767 1 1122 . 1 1 96 96 MET HB2 H 1 1.994 . . 2 . . 1 . 96 MET HB1 . 16767 1 1123 . 1 1 96 96 MET HB3 H 1 1.831 . . 2 . . 1 . 96 MET HB2 . 16767 1 1124 . 1 1 96 96 MET HG2 H 1 2.417 . . 2 . . 1 . 96 MET HG1 . 16767 1 1125 . 1 1 96 96 MET HG3 H 1 2.328 . . 2 . . 1 . 96 MET HG2 . 16767 1 1126 . 1 1 96 96 MET C C 13 176.307 . . 1 . . 1 . 96 MET C . 16767 1 1127 . 1 1 96 96 MET CA C 13 54.278 . . 1 . . 1 . 96 MET CA . 16767 1 1128 . 1 1 96 96 MET CB C 13 32.205 . . 1 . . 1 . 96 MET CB . 16767 1 1129 . 1 1 96 96 MET CG C 13 31.314 . . 1 . . 1 . 96 MET CG . 16767 1 1130 . 1 1 96 96 MET N N 15 123.128 . . 1 . . 1 . 96 MET N . 16767 1 1131 . 1 1 97 97 GLY H H 1 8.268 . . 1 . . 1 . 97 GLY HN . 16767 1 1132 . 1 1 97 97 GLY HA2 H 1 3.994 . . 2 . . 1 . 97 GLY HA1 . 16767 1 1133 . 1 1 97 97 GLY HA3 H 1 3.871 . . 2 . . 1 . 97 GLY HA2 . 16767 1 1134 . 1 1 97 97 GLY C C 13 174.219 . . 1 . . 1 . 97 GLY C . 16767 1 1135 . 1 1 97 97 GLY CA C 13 44.286 . . 1 . . 1 . 97 GLY CA . 16767 1 1136 . 1 1 97 97 GLY N N 15 109.276 . . 1 . . 1 . 97 GLY N . 16767 1 1137 . 1 1 98 98 GLY H H 1 8.393 . . 1 . . 1 . 98 GLY HN . 16767 1 1138 . 1 1 98 98 GLY HA2 H 1 3.878 . . 2 . . 1 . 98 GLY HA1 . 16767 1 1139 . 1 1 98 98 GLY HA3 H 1 3.878 . . 2 . . 1 . 98 GLY HA2 . 16767 1 1140 . 1 1 98 98 GLY C C 13 174.221 . . 1 . . 1 . 98 GLY C . 16767 1 1141 . 1 1 98 98 GLY CA C 13 44.741 . . 1 . . 1 . 98 GLY CA . 16767 1 1142 . 1 1 98 98 GLY N N 15 108.448 . . 1 . . 1 . 98 GLY N . 16767 1 1143 . 1 1 99 99 ASN H H 1 8.694 . . 1 . . 1 . 99 ASN HN . 16767 1 1144 . 1 1 99 99 ASN HA H 1 4.741 . . 1 . . 1 . 99 ASN HA . 16767 1 1145 . 1 1 99 99 ASN HB2 H 1 2.975 . . 2 . . 1 . 99 ASN HB1 . 16767 1 1146 . 1 1 99 99 ASN HB3 H 1 2.757 . . 2 . . 1 . 99 ASN HB2 . 16767 1 1147 . 1 1 99 99 ASN HD21 H 1 7.728 . . 2 . . 1 . 99 ASN HD21 . 16767 1 1148 . 1 1 99 99 ASN HD22 H 1 6.936 . . 2 . . 1 . 99 ASN HD22 . 16767 1 1149 . 1 1 99 99 ASN C C 13 174.651 . . 1 . . 1 . 99 ASN C . 16767 1 1150 . 1 1 99 99 ASN CA C 13 51.826 . . 1 . . 1 . 99 ASN CA . 16767 1 1151 . 1 1 99 99 ASN CB C 13 37.019 . . 1 . . 1 . 99 ASN CB . 16767 1 1152 . 1 1 99 99 ASN N N 15 119.184 . . 1 . . 1 . 99 ASN N . 16767 1 1153 . 1 1 99 99 ASN ND2 N 15 112.377 . . 1 . . 1 . 99 ASN ND2 . 16767 1 1154 . 1 1 100 100 LYS H H 1 7.264 . . 1 . . 1 . 100 LYS HN . 16767 1 1155 . 1 1 100 100 LYS HA H 1 4.181 . . 1 . . 1 . 100 LYS HA . 16767 1 1156 . 1 1 100 100 LYS HB2 H 1 1.714 . . 2 . . 1 . 100 LYS HB1 . 16767 1 1157 . 1 1 100 100 LYS HB3 H 1 1.395 . . 2 . . 1 . 100 LYS HB2 . 16767 1 1158 . 1 1 100 100 LYS HD2 H 1 1.538 . . 2 . . 1 . 100 LYS HD1 . 16767 1 1159 . 1 1 100 100 LYS HD3 H 1 1.538 . . 2 . . 1 . 100 LYS HD2 . 16767 1 1160 . 1 1 100 100 LYS HE2 H 1 3.009 . . 2 . . 1 . 100 LYS HE1 . 16767 1 1161 . 1 1 100 100 LYS HE3 H 1 3.009 . . 2 . . 1 . 100 LYS HE2 . 16767 1 1162 . 1 1 100 100 LYS HG2 H 1 1.112 . . 2 . . 1 . 100 LYS HG1 . 16767 1 1163 . 1 1 100 100 LYS HG3 H 1 1.112 . . 2 . . 1 . 100 LYS HG2 . 16767 1 1164 . 1 1 100 100 LYS C C 13 175.857 . . 1 . . 1 . 100 LYS C . 16767 1 1165 . 1 1 100 100 LYS CA C 13 55.096 . . 1 . . 1 . 100 LYS CA . 16767 1 1166 . 1 1 100 100 LYS CB C 13 32.386 . . 1 . . 1 . 100 LYS CB . 16767 1 1167 . 1 1 100 100 LYS CD C 13 28.962 . . 1 . . 1 . 100 LYS CD . 16767 1 1168 . 1 1 100 100 LYS CE C 13 41.902 . . 1 . . 1 . 100 LYS CE . 16767 1 1169 . 1 1 100 100 LYS CG C 13 24.491 . . 1 . . 1 . 100 LYS CG . 16767 1 1170 . 1 1 100 100 LYS N N 15 120.669 . . 1 . . 1 . 100 LYS N . 16767 1 1171 . 1 1 101 101 HIS H H 1 8.167 . . 1 . . 1 . 101 HIS HN . 16767 1 1172 . 1 1 101 101 HIS HA H 1 4.944 . . 1 . . 1 . 101 HIS HA . 16767 1 1173 . 1 1 101 101 HIS HB2 H 1 3.418 . . 2 . . 1 . 101 HIS HB1 . 16767 1 1174 . 1 1 101 101 HIS HB3 H 1 2.998 . . 2 . . 1 . 101 HIS HB2 . 16767 1 1175 . 1 1 101 101 HIS HD2 H 1 7.241 . . 3 . . 1 . 101 HIS HD2 . 16767 1 1176 . 1 1 101 101 HIS C C 13 172.977 . . 1 . . 1 . 101 HIS C . 16767 1 1177 . 1 1 101 101 HIS CA C 13 54.642 . . 1 . . 1 . 101 HIS CA . 16767 1 1178 . 1 1 101 101 HIS CB C 13 27.935 . . 1 . . 1 . 101 HIS CB . 16767 1 1179 . 1 1 101 101 HIS CD2 C 13 119.699 . . 1 . . 1 . 101 HIS CD2 . 16767 1 1180 . 1 1 101 101 HIS N N 15 117.580 . . 1 . . 1 . 101 HIS N . 16767 1 1181 . 1 1 102 102 CYS H H 1 8.478 . . 1 . . 1 . 102 CYS HN . 16767 1 1182 . 1 1 102 102 CYS HA H 1 4.921 . . 1 . . 1 . 102 CYS HA . 16767 1 1183 . 1 1 102 102 CYS HB2 H 1 2.656 . . 2 . . 1 . 102 CYS HB1 . 16767 1 1184 . 1 1 102 102 CYS HB3 H 1 2.499 . . 2 . . 1 . 102 CYS HB2 . 16767 1 1185 . 1 1 102 102 CYS C C 13 171.321 . . 1 . . 1 . 102 CYS C . 16767 1 1186 . 1 1 102 102 CYS CA C 13 59.547 . . 1 . . 1 . 102 CYS CA . 16767 1 1187 . 1 1 102 102 CYS CB C 13 47.284 . . 1 . . 1 . 102 CYS CB . 16767 1 1188 . 1 1 102 102 CYS N N 15 119.085 . . 1 . . 1 . 102 CYS N . 16767 1 1189 . 1 1 103 103 ALA H H 1 8.239 . . 1 . . 1 . 103 ALA HN . 16767 1 1190 . 1 1 103 103 ALA HA H 1 5.551 . . 1 . . 1 . 103 ALA HA . 16767 1 1191 . 1 1 103 103 ALA HB1 H 1 1.076 . . 1 . . 1 . 103 ALA HB1 . 16767 1 1192 . 1 1 103 103 ALA HB2 H 1 1.076 . . 1 . . 1 . 103 ALA HB1 . 16767 1 1193 . 1 1 103 103 ALA HB3 H 1 1.076 . . 1 . . 1 . 103 ALA HB1 . 16767 1 1194 . 1 1 103 103 ALA C C 13 173.607 . . 1 . . 1 . 103 ALA C . 16767 1 1195 . 1 1 103 103 ALA CA C 13 50.578 . . 1 . . 1 . 103 ALA CA . 16767 1 1196 . 1 1 103 103 ALA CB C 13 22.255 . . 1 . . 1 . 103 ALA CB . 16767 1 1197 . 1 1 103 103 ALA N N 15 123.430 . . 1 . . 1 . 103 ALA N . 16767 1 1198 . 1 1 104 104 GLU H H 1 8.945 . . 1 . . 1 . 104 GLU HN . 16767 1 1199 . 1 1 104 104 GLU HA H 1 5.675 . . 1 . . 1 . 104 GLU HA . 16767 1 1200 . 1 1 104 104 GLU HB2 H 1 1.761 . . 2 . . 1 . 104 GLU HB1 . 16767 1 1201 . 1 1 104 104 GLU HB3 H 1 1.761 . . 2 . . 1 . 104 GLU HB2 . 16767 1 1202 . 1 1 104 104 GLU HG2 H 1 2.589 . . 2 . . 1 . 104 GLU HG1 . 16767 1 1203 . 1 1 104 104 GLU HG3 H 1 2.589 . . 2 . . 1 . 104 GLU HG2 . 16767 1 1204 . 1 1 104 104 GLU C C 13 173.767 . . 1 . . 1 . 104 GLU C . 16767 1 1205 . 1 1 104 104 GLU CA C 13 51.138 . . 1 . . 1 . 104 GLU CA . 16767 1 1206 . 1 1 104 104 GLU CB C 13 32.328 . . 1 . . 1 . 104 GLU CB . 16767 1 1207 . 1 1 104 104 GLU CG C 13 32.804 . . 1 . . 1 . 104 GLU CG . 16767 1 1208 . 1 1 104 104 GLU N N 15 115.375 . . 1 . . 1 . 104 GLU N . 16767 1 1209 . 1 1 105 105 MET H H 1 9.474 . . 1 . . 1 . 105 MET HN . 16767 1 1210 . 1 1 105 105 MET HA H 1 4.842 . . 1 . . 1 . 105 MET HA . 16767 1 1211 . 1 1 105 105 MET HB2 H 1 2.329 . . 2 . . 1 . 105 MET HB1 . 16767 1 1212 . 1 1 105 105 MET HB3 H 1 2.142 . . 2 . . 1 . 105 MET HB2 . 16767 1 1213 . 1 1 105 105 MET HG2 H 1 2.605 . . 2 . . 1 . 105 MET HG1 . 16767 1 1214 . 1 1 105 105 MET HG3 H 1 2.688 . . 2 . . 1 . 105 MET HG2 . 16767 1 1215 . 1 1 105 105 MET C C 13 176.307 . . 1 . . 1 . 105 MET C . 16767 1 1216 . 1 1 105 105 MET CA C 13 55.168 . . 1 . . 1 . 105 MET CA . 16767 1 1217 . 1 1 105 105 MET CB C 13 35.129 . . 1 . . 1 . 105 MET CB . 16767 1 1218 . 1 1 105 105 MET CG C 13 31.471 . . 1 . . 1 . 105 MET CG . 16767 1 1219 . 1 1 105 105 MET N N 15 119.184 . . 1 . . 1 . 105 MET N . 16767 1 1220 . 1 1 106 106 SER H H 1 8.735 . . 1 . . 1 . 106 SER HN . 16767 1 1221 . 1 1 106 106 SER HA H 1 4.352 . . 1 . . 1 . 106 SER HA . 16767 1 1222 . 1 1 106 106 SER HB2 H 1 3.807 . . 2 . . 1 . 106 SER HB1 . 16767 1 1223 . 1 1 106 106 SER HB3 H 1 3.753 . . 2 . . 1 . 106 SER HB2 . 16767 1 1224 . 1 1 106 106 SER C C 13 174.525 . . 1 . . 1 . 106 SER C . 16767 1 1225 . 1 1 106 106 SER CA C 13 56.735 . . 1 . . 1 . 106 SER CA . 16767 1 1226 . 1 1 106 106 SER CB C 13 63.116 . . 1 . . 1 . 106 SER CB . 16767 1 1227 . 1 1 106 106 SER N N 15 118.336 . . 1 . . 1 . 106 SER N . 16767 1 1228 . 1 1 107 107 SER H H 1 8.424 . . 1 . . 1 . 107 SER HN . 16767 1 1229 . 1 1 107 107 SER N N 15 123.634 . . 1 . . 1 . 107 SER N . 16767 1 1230 . 1 1 108 108 ASN HA H 1 4.734 . . 1 . . 1 . 108 ASN HA . 16767 1 1231 . 1 1 108 108 ASN HB2 H 1 1.948 . . 2 . . 1 . 108 ASN HB1 . 16767 1 1232 . 1 1 108 108 ASN HB3 H 1 1.255 . . 2 . . 1 . 108 ASN HB2 . 16767 1 1233 . 1 1 108 108 ASN HD21 H 1 7.458 . . 2 . . 1 . 108 ASN HD21 . 16767 1 1234 . 1 1 108 108 ASN HD22 H 1 6.558 . . 2 . . 1 . 108 ASN HD22 . 16767 1 1235 . 1 1 108 108 ASN C C 13 174.354 . . 1 . . 1 . 108 ASN C . 16767 1 1236 . 1 1 108 108 ASN CA C 13 54.944 . . 1 . . 1 . 108 ASN CA . 16767 1 1237 . 1 1 108 108 ASN CB C 13 31.435 . . 1 . . 1 . 108 ASN CB . 16767 1 1238 . 1 1 108 108 ASN ND2 N 15 111.521 . . 1 . . 1 . 108 ASN ND2 . 16767 1 1239 . 1 1 109 109 ASN H H 1 7.656 . . 1 . . 1 . 109 ASN HN . 16767 1 1240 . 1 1 109 109 ASN HA H 1 4.827 . . 1 . . 1 . 109 ASN HA . 16767 1 1241 . 1 1 109 109 ASN HB2 H 1 2.951 . . 2 . . 1 . 109 ASN HB1 . 16767 1 1242 . 1 1 109 109 ASN HB3 H 1 3.488 . . 2 . . 1 . 109 ASN HB2 . 16767 1 1243 . 1 1 109 109 ASN C C 13 170.979 . . 1 . . 1 . 109 ASN C . 16767 1 1244 . 1 1 109 109 ASN CA C 13 54.906 . . 1 . . 1 . 109 ASN CA . 16767 1 1245 . 1 1 109 109 ASN CB C 13 28.055 . . 1 . . 1 . 109 ASN CB . 16767 1 1246 . 1 1 109 109 ASN N N 15 115.977 . . 1 . . 1 . 109 ASN N . 16767 1 1247 . 1 1 110 110 ASN H H 1 8.766 . . 1 . . 1 . 110 ASN HN . 16767 1 1248 . 1 1 110 110 ASN HA H 1 4.269 . . 1 . . 1 . 110 ASN HA . 16767 1 1249 . 1 1 110 110 ASN HB2 H 1 1.731 . . 2 . . 1 . 110 ASN HB1 . 16767 1 1250 . 1 1 110 110 ASN HB3 H 1 1.523 . . 2 . . 1 . 110 ASN HB2 . 16767 1 1251 . 1 1 110 110 ASN CA C 13 54.906 . . 1 . . 1 . 110 ASN CA . 16767 1 1252 . 1 1 110 110 ASN CB C 13 42.539 . . 1 . . 1 . 110 ASN CB . 16767 1 1253 . 1 1 110 110 ASN N N 15 124.424 . . 1 . . 1 . 110 ASN N . 16767 1 1254 . 1 1 111 111 PHE H H 1 7.753 . . 1 . . 1 . 111 PHE HN . 16767 1 1255 . 1 1 111 111 PHE HA H 1 4.889 . . 1 . . 1 . 111 PHE HA . 16767 1 1256 . 1 1 111 111 PHE HB2 H 1 2.913 . . 2 . . 1 . 111 PHE HB1 . 16767 1 1257 . 1 1 111 111 PHE HB3 H 1 2.316 . . 2 . . 1 . 111 PHE HB2 . 16767 1 1258 . 1 1 111 111 PHE HD1 H 1 7.069 . . 3 . . 1 . 111 PHE HD1 . 16767 1 1259 . 1 1 111 111 PHE HD2 H 1 7.069 . . 3 . . 1 . 111 PHE HD2 . 16767 1 1260 . 1 1 111 111 PHE HE1 H 1 6.817 . . 3 . . 1 . 111 PHE HE1 . 16767 1 1261 . 1 1 111 111 PHE HE2 H 1 6.817 . . 3 . . 1 . 111 PHE HE2 . 16767 1 1262 . 1 1 111 111 PHE C C 13 174.957 . . 1 . . 1 . 111 PHE C . 16767 1 1263 . 1 1 111 111 PHE CA C 13 51.251 . . 1 . . 1 . 111 PHE CA . 16767 1 1264 . 1 1 111 111 PHE CB C 13 37.816 . . 1 . . 1 . 111 PHE CB . 16767 1 1265 . 1 1 111 111 PHE CD1 C 13 133.251 . . 3 . . 1 . 111 PHE CD1 . 16767 1 1266 . 1 1 111 111 PHE CD2 C 13 133.251 . . 3 . . 1 . 111 PHE CD2 . 16767 1 1267 . 1 1 111 111 PHE CE1 C 13 130.790 . . 3 . . 1 . 111 PHE CE1 . 16767 1 1268 . 1 1 111 111 PHE CE2 C 13 130.790 . . 3 . . 1 . 111 PHE CE2 . 16767 1 1269 . 1 1 111 111 PHE N N 15 108.647 . . 1 . . 1 . 111 PHE N . 16767 1 1270 . 1 1 112 112 LEU H H 1 7.758 . . 1 . . 1 . 112 LEU HN . 16767 1 1271 . 1 1 112 112 LEU HA H 1 4.002 . . 1 . . 1 . 112 LEU HA . 16767 1 1272 . 1 1 112 112 LEU HB2 H 1 2.695 . . 2 . . 1 . 112 LEU HB1 . 16767 1 1273 . 1 1 112 112 LEU HB3 H 1 2.368 . . 2 . . 1 . 112 LEU HB2 . 16767 1 1274 . 1 1 112 112 LEU C C 13 175.209 . . 1 . . 1 . 112 LEU C . 16767 1 1275 . 1 1 112 112 LEU CA C 13 54.161 . . 1 . . 1 . 112 LEU CA . 16767 1 1276 . 1 1 112 112 LEU CB C 13 36.137 . . 1 . . 1 . 112 LEU CB . 16767 1 1277 . 1 1 112 112 LEU N N 15 115.334 . . 1 . . 1 . 112 LEU N . 16767 1 1278 . 1 1 113 113 THR H H 1 8.378 . . 1 . . 1 . 113 THR HN . 16767 1 1279 . 1 1 113 113 THR HA H 1 4.765 . . 1 . . 1 . 113 THR HA . 16767 1 1280 . 1 1 113 113 THR HB H 1 3.597 . . 1 . . 1 . 113 THR HB . 16767 1 1281 . 1 1 113 113 THR HG21 H 1 0.958 . . 1 . . 1 . 113 THR HG21 . 16767 1 1282 . 1 1 113 113 THR HG22 H 1 0.958 . . 1 . . 1 . 113 THR HG21 . 16767 1 1283 . 1 1 113 113 THR HG23 H 1 0.958 . . 1 . . 1 . 113 THR HG21 . 16767 1 1284 . 1 1 113 113 THR C C 13 175.263 . . 1 . . 1 . 113 THR C . 16767 1 1285 . 1 1 113 113 THR CA C 13 58.974 . . 1 . . 1 . 113 THR CA . 16767 1 1286 . 1 1 113 113 THR CB C 13 62.781 . . 1 . . 1 . 113 THR CB . 16767 1 1287 . 1 1 113 113 THR CG2 C 13 20.649 . . 1 . . 1 . 113 THR CG2 . 16767 1 1288 . 1 1 113 113 THR N N 15 118.622 . . 1 . . 1 . 113 THR N . 16767 1 1289 . 1 1 114 114 TRP H H 1 7.739 . . 1 . . 1 . 114 TRP HN . 16767 1 1290 . 1 1 114 114 TRP HA H 1 6.064 . . 1 . . 1 . 114 TRP HA . 16767 1 1291 . 1 1 114 114 TRP HB2 H 1 2.501 . . 2 . . 1 . 114 TRP HB1 . 16767 1 1292 . 1 1 114 114 TRP HB3 H 1 2.259 . . 2 . . 1 . 114 TRP HB2 . 16767 1 1293 . 1 1 114 114 TRP HE1 H 1 11.137 . . 3 . . 1 . 114 TRP HE1 . 16767 1 1294 . 1 1 114 114 TRP C C 13 176.649 . . 1 . . 1 . 114 TRP C . 16767 1 1295 . 1 1 114 114 TRP CA C 13 51.809 . . 1 . . 1 . 114 TRP CA . 16767 1 1296 . 1 1 114 114 TRP CB C 13 30.203 . . 1 . . 1 . 114 TRP CB . 16767 1 1297 . 1 1 114 114 TRP N N 15 116.909 . . 1 . . 1 . 114 TRP N . 16767 1 1298 . 1 1 114 114 TRP NE1 N 15 130.850 . . 1 . . 1 . 114 TRP NE1 . 16767 1 1299 . 1 1 115 115 SER H H 1 9.010 . . 1 . . 1 . 115 SER HN . 16767 1 1300 . 1 1 115 115 SER HA H 1 5.379 . . 1 . . 1 . 115 SER HA . 16767 1 1301 . 1 1 115 115 SER HB2 H 1 3.994 . . 2 . . 1 . 115 SER HB1 . 16767 1 1302 . 1 1 115 115 SER HB3 H 1 3.815 . . 2 . . 1 . 115 SER HB2 . 16767 1 1303 . 1 1 115 115 SER C C 13 173.679 . . 1 . . 1 . 115 SER C . 16767 1 1304 . 1 1 115 115 SER CA C 13 55.952 . . 1 . . 1 . 115 SER CA . 16767 1 1305 . 1 1 115 115 SER CB C 13 65.243 . . 1 . . 1 . 115 SER CB . 16767 1 1306 . 1 1 115 115 SER N N 15 114.463 . . 1 . . 1 . 115 SER N . 16767 1 1307 . 1 1 116 116 SER H H 1 8.992 . . 1 . . 1 . 116 SER HN . 16767 1 1308 . 1 1 116 116 SER HA H 1 5.356 . . 1 . . 1 . 116 SER HA . 16767 1 1309 . 1 1 116 116 SER HB2 H 1 4.111 . . 2 . . 1 . 116 SER HB1 . 16767 1 1310 . 1 1 116 116 SER HB3 H 1 3.924 . . 2 . . 1 . 116 SER HB2 . 16767 1 1311 . 1 1 116 116 SER C C 13 173.697 . . 1 . . 1 . 116 SER C . 16767 1 1312 . 1 1 116 116 SER CA C 13 56.175 . . 1 . . 1 . 116 SER CA . 16767 1 1313 . 1 1 116 116 SER CB C 13 64.461 . . 1 . . 1 . 116 SER CB . 16767 1 1314 . 1 1 116 116 SER N N 15 119.216 . . 1 . . 1 . 116 SER N . 16767 1 1315 . 1 1 117 117 ASN H H 1 9.784 . . 1 . . 1 . 117 ASN HN . 16767 1 1316 . 1 1 117 117 ASN HA H 1 4.835 . . 1 . . 1 . 117 ASN HA . 16767 1 1317 . 1 1 117 117 ASN HB2 H 1 2.874 . . 2 . . 1 . 117 ASN HB1 . 16767 1 1318 . 1 1 117 117 ASN HB3 H 1 2.586 . . 2 . . 1 . 117 ASN HB2 . 16767 1 1319 . 1 1 117 117 ASN HD21 H 1 7.371 . . 2 . . 1 . 117 ASN HD21 . 16767 1 1320 . 1 1 117 117 ASN HD22 H 1 6.771 . . 2 . . 1 . 117 ASN HD22 . 16767 1 1321 . 1 1 117 117 ASN C C 13 173.895 . . 1 . . 1 . 117 ASN C . 16767 1 1322 . 1 1 117 117 ASN CA C 13 50.354 . . 1 . . 1 . 117 ASN CA . 16767 1 1323 . 1 1 117 117 ASN CB C 13 41.174 . . 1 . . 1 . 117 ASN CB . 16767 1 1324 . 1 1 117 117 ASN N N 15 120.373 . . 1 . . 1 . 117 ASN N . 16767 1 1325 . 1 1 117 117 ASN ND2 N 15 112.078 . . 1 . . 1 . 117 ASN ND2 . 16767 1 1326 . 1 1 118 118 GLU H H 1 9.319 . . 1 . . 1 . 118 GLU HN . 16767 1 1327 . 1 1 118 118 GLU HA H 1 4.625 . . 1 . . 1 . 118 GLU HA . 16767 1 1328 . 1 1 118 118 GLU HB2 H 1 2.359 . . 2 . . 1 . 118 GLU HB1 . 16767 1 1329 . 1 1 118 118 GLU HB3 H 1 2.088 . . 2 . . 1 . 118 GLU HB2 . 16767 1 1330 . 1 1 118 118 GLU HG2 H 1 2.484 . . 2 . . 1 . 118 GLU HG1 . 16767 1 1331 . 1 1 118 118 GLU HG3 H 1 2.416 . . 2 . . 1 . 118 GLU HG2 . 16767 1 1332 . 1 1 118 118 GLU C C 13 178.181 . . 1 . . 1 . 118 GLU C . 16767 1 1333 . 1 1 118 118 GLU CA C 13 56.623 . . 1 . . 1 . 118 GLU CA . 16767 1 1334 . 1 1 118 118 GLU CB C 13 28.972 . . 1 . . 1 . 118 GLU CB . 16767 1 1335 . 1 1 118 118 GLU CG C 13 36.098 . . 1 . . 1 . 118 GLU CG . 16767 1 1336 . 1 1 118 118 GLU N N 15 122.293 . . 1 . . 1 . 118 GLU N . 16767 1 1337 . 1 1 119 119 CYS H H 1 9.087 . . 1 . . 1 . 119 CYS HN . 16767 1 1338 . 1 1 119 119 CYS HA H 1 4.181 . . 1 . . 1 . 119 CYS HA . 16767 1 1339 . 1 1 119 119 CYS HB2 H 1 3.169 . . 2 . . 1 . 119 CYS HB1 . 16767 1 1340 . 1 1 119 119 CYS HB3 H 1 3.006 . . 2 . . 1 . 119 CYS HB2 . 16767 1 1341 . 1 1 119 119 CYS C C 13 174.759 . . 1 . . 1 . 119 CYS C . 16767 1 1342 . 1 1 119 119 CYS CA C 13 57.295 . . 1 . . 1 . 119 CYS CA . 16767 1 1343 . 1 1 119 119 CYS CB C 13 43.973 . . 1 . . 1 . 119 CYS CB . 16767 1 1344 . 1 1 119 119 CYS N N 15 122.946 . . 1 . . 1 . 119 CYS N . 16767 1 1345 . 1 1 120 120 ASN H H 1 8.554 . . 1 . . 1 . 120 ASN HN . 16767 1 1346 . 1 1 120 120 ASN HA H 1 4.749 . . 1 . . 1 . 120 ASN HA . 16767 1 1347 . 1 1 120 120 ASN HB2 H 1 3.045 . . 2 . . 1 . 120 ASN HB1 . 16767 1 1348 . 1 1 120 120 ASN HB3 H 1 2.889 . . 2 . . 1 . 120 ASN HB2 . 16767 1 1349 . 1 1 120 120 ASN HD21 H 1 7.673 . . 2 . . 1 . 120 ASN HD21 . 16767 1 1350 . 1 1 120 120 ASN HD22 H 1 7.008 . . 2 . . 1 . 120 ASN HD22 . 16767 1 1351 . 1 1 120 120 ASN C C 13 175.605 . . 1 . . 1 . 120 ASN C . 16767 1 1352 . 1 1 120 120 ASN CA C 13 53.377 . . 1 . . 1 . 120 ASN CA . 16767 1 1353 . 1 1 120 120 ASN CB C 13 37.368 . . 1 . . 1 . 120 ASN CB . 16767 1 1354 . 1 1 120 120 ASN N N 15 114.878 . . 1 . . 1 . 120 ASN N . 16767 1 1355 . 1 1 120 120 ASN ND2 N 15 112.324 . . 1 . . 1 . 120 ASN ND2 . 16767 1 1356 . 1 1 121 121 LYS H H 1 8.337 . . 1 . . 1 . 121 LYS HN . 16767 1 1357 . 1 1 121 121 LYS HA H 1 4.243 . . 1 . . 1 . 121 LYS HA . 16767 1 1358 . 1 1 121 121 LYS HB2 H 1 2.119 . . 2 . . 1 . 121 LYS HB1 . 16767 1 1359 . 1 1 121 121 LYS HB3 H 1 1.909 . . 2 . . 1 . 121 LYS HB2 . 16767 1 1360 . 1 1 121 121 LYS HD2 H 1 1.586 . . 2 . . 1 . 121 LYS HD1 . 16767 1 1361 . 1 1 121 121 LYS HD3 H 1 1.586 . . 2 . . 1 . 121 LYS HD2 . 16767 1 1362 . 1 1 121 121 LYS HE2 H 1 2.895 . . 2 . . 1 . 121 LYS HE1 . 16767 1 1363 . 1 1 121 121 LYS HE3 H 1 2.895 . . 2 . . 1 . 121 LYS HE2 . 16767 1 1364 . 1 1 121 121 LYS HG2 H 1 1.522 . . 2 . . 1 . 121 LYS HG1 . 16767 1 1365 . 1 1 121 121 LYS HG3 H 1 1.376 . . 2 . . 1 . 121 LYS HG2 . 16767 1 1366 . 1 1 121 121 LYS C C 13 175.443 . . 1 . . 1 . 121 LYS C . 16767 1 1367 . 1 1 121 121 LYS CA C 13 56.623 . . 1 . . 1 . 121 LYS CA . 16767 1 1368 . 1 1 121 121 LYS CB C 13 31.883 . . 1 . . 1 . 121 LYS CB . 16767 1 1369 . 1 1 121 121 LYS CD C 13 28.413 . . 1 . . 1 . 121 LYS CD . 16767 1 1370 . 1 1 121 121 LYS CE C 13 41.666 . . 1 . . 1 . 121 LYS CE . 16767 1 1371 . 1 1 121 121 LYS CG C 13 25.197 . . 1 . . 1 . 121 LYS CG . 16767 1 1372 . 1 1 121 121 LYS N N 15 123.944 . . 1 . . 1 . 121 LYS N . 16767 1 1373 . 1 1 122 122 ARG H H 1 8.563 . . 1 . . 1 . 122 ARG HN . 16767 1 1374 . 1 1 122 122 ARG HA H 1 4.321 . . 1 . . 1 . 122 ARG HA . 16767 1 1375 . 1 1 122 122 ARG HB2 H 1 1.854 . . 2 . . 1 . 122 ARG HB1 . 16767 1 1376 . 1 1 122 122 ARG HB3 H 1 1.311 . . 2 . . 1 . 122 ARG HB2 . 16767 1 1377 . 1 1 122 122 ARG HD2 H 1 3.288 . . 2 . . 1 . 122 ARG HD1 . 16767 1 1378 . 1 1 122 122 ARG HD3 H 1 3.288 . . 2 . . 1 . 122 ARG HD2 . 16767 1 1379 . 1 1 122 122 ARG HG2 H 1 1.919 . . 2 . . 1 . 122 ARG HG1 . 16767 1 1380 . 1 1 122 122 ARG HG3 H 1 1.474 . . 2 . . 1 . 122 ARG HG2 . 16767 1 1381 . 1 1 122 122 ARG C C 13 174.885 . . 1 . . 1 . 122 ARG C . 16767 1 1382 . 1 1 122 122 ARG CA C 13 54.721 . . 1 . . 1 . 122 ARG CA . 16767 1 1383 . 1 1 122 122 ARG CB C 13 29.532 . . 1 . . 1 . 122 ARG CB . 16767 1 1384 . 1 1 122 122 ARG CD C 13 43.156 . . 1 . . 1 . 122 ARG CD . 16767 1 1385 . 1 1 122 122 ARG CG C 13 27.236 . . 1 . . 1 . 122 ARG CG . 16767 1 1386 . 1 1 122 122 ARG N N 15 122.817 . . 1 . . 1 . 122 ARG N . 16767 1 1387 . 1 1 123 123 GLN H H 1 8.901 . . 1 . . 1 . 123 GLN HN . 16767 1 1388 . 1 1 123 123 GLN HA H 1 4.392 . . 1 . . 1 . 123 GLN HA . 16767 1 1389 . 1 1 123 123 GLN HB2 H 1 1.357 . . 2 . . 1 . 123 GLN HB1 . 16767 1 1390 . 1 1 123 123 GLN HB3 H 1 1.661 . . 2 . . 1 . 123 GLN HB2 . 16767 1 1391 . 1 1 123 123 GLN HE21 H 1 7.156 . . 2 . . 1 . 123 GLN HE21 . 16767 1 1392 . 1 1 123 123 GLN HE22 H 1 6.755 . . 2 . . 1 . 123 GLN HE22 . 16767 1 1393 . 1 1 123 123 GLN CA C 13 56.287 . . 1 . . 1 . 123 GLN CA . 16767 1 1394 . 1 1 123 123 GLN CB C 13 31.323 . . 1 . . 1 . 123 GLN CB . 16767 1 1395 . 1 1 123 123 GLN N N 15 121.485 . . 1 . . 1 . 123 GLN N . 16767 1 1396 . 1 1 123 123 GLN NE2 N 15 112.270 . . 1 . . 1 . 123 GLN NE2 . 16767 1 1397 . 1 1 124 124 HIS HA H 1 5.558 . . 1 . . 1 . 124 HIS HA . 16767 1 1398 . 1 1 124 124 HIS HB2 H 1 3.644 . . 2 . . 1 . 124 HIS HB1 . 16767 1 1399 . 1 1 124 124 HIS HB3 H 1 3.146 . . 2 . . 1 . 124 HIS HB2 . 16767 1 1400 . 1 1 124 124 HIS C C 13 174.525 . . 1 . . 1 . 124 HIS C . 16767 1 1401 . 1 1 124 124 HIS CA C 13 54.272 . . 1 . . 1 . 124 HIS CA . 16767 1 1402 . 1 1 124 124 HIS CB C 13 32.778 . . 1 . . 1 . 124 HIS CB . 16767 1 1403 . 1 1 125 125 PHE H H 1 8.153 . . 1 . . 1 . 125 PHE HN . 16767 1 1404 . 1 1 125 125 PHE HA H 1 5.636 . . 1 . . 1 . 125 PHE HA . 16767 1 1405 . 1 1 125 125 PHE HB2 H 1 3.481 . . 2 . . 1 . 125 PHE HB1 . 16767 1 1406 . 1 1 125 125 PHE HB3 H 1 2.983 . . 2 . . 1 . 125 PHE HB2 . 16767 1 1407 . 1 1 125 125 PHE HD1 H 1 6.960 . . 3 . . 1 . 125 PHE HD1 . 16767 1 1408 . 1 1 125 125 PHE HD2 H 1 6.960 . . 3 . . 1 . 125 PHE HD2 . 16767 1 1409 . 1 1 125 125 PHE HE1 H 1 7.066 . . 3 . . 1 . 125 PHE HE1 . 16767 1 1410 . 1 1 125 125 PHE HE2 H 1 7.066 . . 3 . . 1 . 125 PHE HE2 . 16767 1 1411 . 1 1 125 125 PHE C C 13 171.303 . . 1 . . 1 . 125 PHE C . 16767 1 1412 . 1 1 125 125 PHE CA C 13 56.175 . . 1 . . 1 . 125 PHE CA . 16767 1 1413 . 1 1 125 125 PHE CB C 13 41.286 . . 1 . . 1 . 125 PHE CB . 16767 1 1414 . 1 1 125 125 PHE CD1 C 13 133.161 . . 3 . . 1 . 125 PHE CD1 . 16767 1 1415 . 1 1 125 125 PHE CD2 C 13 133.161 . . 3 . . 1 . 125 PHE CD2 . 16767 1 1416 . 1 1 125 125 PHE CE1 C 13 130.421 . . 3 . . 1 . 125 PHE CE1 . 16767 1 1417 . 1 1 125 125 PHE CE2 C 13 130.421 . . 3 . . 1 . 125 PHE CE2 . 16767 1 1418 . 1 1 125 125 PHE N N 15 111.228 . . 1 . . 1 . 125 PHE N . 16767 1 1419 . 1 1 126 126 LEU H H 1 7.720 . . 1 . . 1 . 126 LEU HN . 16767 1 1420 . 1 1 126 126 LEU HA H 1 5.543 . . 1 . . 1 . 126 LEU HA . 16767 1 1421 . 1 1 126 126 LEU HB2 H 1 2.134 . . 2 . . 1 . 126 LEU HB1 . 16767 1 1422 . 1 1 126 126 LEU HB3 H 1 1.193 . . 2 . . 1 . 126 LEU HB2 . 16767 1 1423 . 1 1 126 126 LEU HD11 H 1 1.654 . . 2 . . 1 . 126 LEU HD11 . 16767 1 1424 . 1 1 126 126 LEU HD12 H 1 1.654 . . 2 . . 1 . 126 LEU HD11 . 16767 1 1425 . 1 1 126 126 LEU HD13 H 1 1.654 . . 2 . . 1 . 126 LEU HD11 . 16767 1 1426 . 1 1 126 126 LEU HD21 H 1 0.904 . . 2 . . 1 . 126 LEU HD21 . 16767 1 1427 . 1 1 126 126 LEU HD22 H 1 0.904 . . 2 . . 1 . 126 LEU HD21 . 16767 1 1428 . 1 1 126 126 LEU HD23 H 1 0.904 . . 2 . . 1 . 126 LEU HD21 . 16767 1 1429 . 1 1 126 126 LEU HG H 1 0.844 . . 1 . . 1 . 126 LEU HG . 16767 1 1430 . 1 1 126 126 LEU C C 13 175.371 . . 1 . . 1 . 126 LEU C . 16767 1 1431 . 1 1 126 126 LEU CA C 13 52.145 . . 1 . . 1 . 126 LEU CA . 16767 1 1432 . 1 1 126 126 LEU CB C 13 46.324 . . 1 . . 1 . 126 LEU CB . 16767 1 1433 . 1 1 126 126 LEU CD1 C 13 26.543 . . 1 . . 1 . 126 LEU CD1 . 16767 1 1434 . 1 1 126 126 LEU CD2 C 13 23.158 . . 1 . . 1 . 126 LEU CD2 . 16767 1 1435 . 1 1 126 126 LEU CG C 13 26.766 . . 1 . . 1 . 126 LEU CG . 16767 1 1436 . 1 1 126 126 LEU N N 15 121.526 . . 1 . . 1 . 126 LEU N . 16767 1 1437 . 1 1 127 127 CYS H H 1 9.688 . . 1 . . 1 . 127 CYS HN . 16767 1 1438 . 1 1 127 127 CYS HA H 1 5.801 . . 1 . . 1 . 127 CYS HA . 16767 1 1439 . 1 1 127 127 CYS HB2 H 1 3.286 . . 2 . . 1 . 127 CYS HB1 . 16767 1 1440 . 1 1 127 127 CYS HB3 H 1 2.827 . . 2 . . 1 . 127 CYS HB2 . 16767 1 1441 . 1 1 127 127 CYS C C 13 174.633 . . 1 . . 1 . 127 CYS C . 16767 1 1442 . 1 1 127 127 CYS CA C 13 51.697 . . 1 . . 1 . 127 CYS CA . 16767 1 1443 . 1 1 127 127 CYS CB C 13 40.391 . . 1 . . 1 . 127 CYS CB . 16767 1 1444 . 1 1 127 127 CYS N N 15 124.281 . . 1 . . 1 . 127 CYS N . 16767 1 1445 . 1 1 128 128 LYS H H 1 9.572 . . 1 . . 1 . 128 LYS HN . 16767 1 1446 . 1 1 128 128 LYS HA H 1 5.871 . . 1 . . 1 . 128 LYS HA . 16767 1 1447 . 1 1 128 128 LYS HB2 H 1 2.142 . . 2 . . 1 . 128 LYS HB1 . 16767 1 1448 . 1 1 128 128 LYS HB3 H 1 1.629 . . 2 . . 1 . 128 LYS HB2 . 16767 1 1449 . 1 1 128 128 LYS HD2 H 1 1.705 . . 2 . . 1 . 128 LYS HD1 . 16767 1 1450 . 1 1 128 128 LYS HD3 H 1 1.705 . . 2 . . 1 . 128 LYS HD2 . 16767 1 1451 . 1 1 128 128 LYS HE2 H 1 2.655 . . 2 . . 1 . 128 LYS HE1 . 16767 1 1452 . 1 1 128 128 LYS HE3 H 1 2.655 . . 2 . . 1 . 128 LYS HE2 . 16767 1 1453 . 1 1 128 128 LYS HG2 H 1 0.918 . . 2 . . 1 . 128 LYS HG1 . 16767 1 1454 . 1 1 128 128 LYS HG3 H 1 0.611 . . 2 . . 1 . 128 LYS HG2 . 16767 1 1455 . 1 1 128 128 LYS C C 13 175.209 . . 1 . . 1 . 128 LYS C . 16767 1 1456 . 1 1 128 128 LYS CA C 13 54.721 . . 1 . . 1 . 128 LYS CA . 16767 1 1457 . 1 1 128 128 LYS CB C 13 37.481 . . 1 . . 1 . 128 LYS CB . 16767 1 1458 . 1 1 128 128 LYS CD C 13 30.531 . . 1 . . 1 . 128 LYS CD . 16767 1 1459 . 1 1 128 128 LYS CE C 13 41.039 . . 1 . . 1 . 128 LYS CE . 16767 1 1460 . 1 1 128 128 LYS CG C 13 24.099 . . 1 . . 1 . 128 LYS CG . 16767 1 1461 . 1 1 128 128 LYS N N 15 123.962 . . 1 . . 1 . 128 LYS N . 16767 1 1462 . 1 1 129 129 TYR H H 1 8.901 . . 1 . . 1 . 129 TYR HN . 16767 1 1463 . 1 1 129 129 TYR HA H 1 4.851 . . 1 . . 1 . 129 TYR HA . 16767 1 1464 . 1 1 129 129 TYR HB2 H 1 2.967 . . 2 . . 1 . 129 TYR HB1 . 16767 1 1465 . 1 1 129 129 TYR HB3 H 1 2.617 . . 2 . . 1 . 129 TYR HB2 . 16767 1 1466 . 1 1 129 129 TYR C C 13 171.177 . . 1 . . 1 . 129 TYR C . 16767 1 1467 . 1 1 129 129 TYR CA C 13 56.287 . . 1 . . 1 . 129 TYR CA . 16767 1 1468 . 1 1 129 129 TYR CB C 13 39.943 . . 1 . . 1 . 129 TYR CB . 16767 1 1469 . 1 1 129 129 TYR N N 15 121.478 . . 1 . . 1 . 129 TYR N . 16767 1 1470 . 1 1 130 130 ARG H H 1 8.862 . . 1 . . 1 . 130 ARG HN . 16767 1 1471 . 1 1 130 130 ARG CA C 13 52.033 . . 1 . . 1 . 130 ARG CA . 16767 1 1472 . 1 1 130 130 ARG CB C 13 30.539 . . 1 . . 1 . 130 ARG CB . 16767 1 1473 . 1 1 130 130 ARG N N 15 124.204 . . 1 . . 1 . 130 ARG N . 16767 1 stop_ save_ ######################### # Spectral peak lists # ######################### save_spectral_peak_list_p63s _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_p63s _Spectral_peak_list.Entry_ID 16767 _Spectral_peak_list.ID 1 _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $sample_1 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Experiment_ID 1 _Spectral_peak_list.Experiment_name '2D 1H-15N HSQC' _Spectral_peak_list.Number_of_spectral_dimensions 2 _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; 0 1.326 0.000 0.000 0 2 {?} {?} 11.13659954 0.03843000 0.04082000 {++} 0.00000000 0 0 0 {?} {?} 130.85435486 0.35018000 0.36706999 {++} 0.00000000 0 0 0 {?} 1 4.277 0.000 0.000 0 2 {?} {?} 10.52530003 0.02626000 0.05126000 {++} 0.00000000 0 0 0 {?} {?} 128.00439453 0.32841000 0.50019002 {++} 0.00000000 0 0 0 {?} 2 4.483 0.000 0.000 0 2 {?} {?} 10.34410954 0.03347000 0.06058000 {++} 0.00000000 0 0 0 {?} {?} 129.81164551 0.34522000 0.54523998 {++} 0.00000000 0 0 0 {?} 3 4.492 4.492 0.000 0 2 {?} {76.hn} 9.93087959 0.03446000 0.05701000 {++} 0.00000000 0 0 0 {?} {76.n} 120.17957306 0.30937001 0.49765000 {++} 0.00000000 0 0 0 {?} 4 3.628 3.628 0.000 0 2 {?} {66.hn} 9.91744041 0.03475000 0.05414000 {++} 0.00000000 0 0 0 {?} {66.n} 126.51866150 0.33102000 0.49316001 {++} 0.00000000 0 0 0 {?} 5 3.609 3.609 0.000 0 2 {?} {40.hn} 9.79977989 0.03313000 0.05681000 {++} 0.00000000 0 0 0 {?} {40.n} 123.64495087 0.36298999 0.52082998 {++} 0.00000000 0 0 0 {?} 6 4.635 0.000 0.000 0 2 {?} {?} 9.78981972 0.02689000 0.05313000 {++} 0.00000000 0 0 0 {?} {?} 130.31448364 0.34132999 0.51525003 {++} 0.00000000 0 0 0 {?} 7 4.736 4.736 0.000 0 2 {?} {15.hn} 9.74162006 0.04663000 0.07108000 {++} 0.00000000 0 0 0 {?} {15.n} 120.37214661 0.38011000 0.57999003 {++} 0.00000000 0 0 0 {?} 8 3.541 3.541 0.000 0 2 {?} {8.hn} 9.76471996 0.02630000 0.04413000 {++} 0.00000000 0 0 0 {?} {8.n} 124.34023285 0.29611999 0.45400000 {++} 0.00000000 0 0 0 {?} 9 2.245 0.000 0.000 0 2 {?} {?} 9.74726963 0.03465000 0.04922000 {++} 0.00000000 0 0 0 {?} {?} 126.20694733 0.34099999 0.46002001 {++} 0.00000000 0 0 0 {?} 10 3.849 3.849 0.000 0 2 {?} {81.hn} 9.68706989 0.03619000 0.05590000 {++} 0.00000000 0 0 0 {?} {81.n} 127.27877045 0.36719999 0.53385001 {++} 0.00000000 0 0 0 {?} 11 4.115 4.115 0.000 0 2 {?} {127.hn} 9.68822002 0.04102000 0.07309000 {++} 0.00000000 0 0 0 {?} {127.n} 124.28058624 0.30274001 0.47290999 {++} 0.00000000 0 0 0 {?} 12 4.371 0.000 0.000 0 2 {?} {?} 9.66086006 0.03820000 0.06427000 {++} 0.00000000 0 0 0 {?} {?} 128.88687134 0.30871001 0.47821000 {++} 0.00000000 0 0 0 {?} 13 3.792 3.792 0.000 0 2 {?} {128.hn} 9.57207966 0.02597000 0.04820000 {++} 0.00000000 0 0 0 {?} {128.n} 123.96166992 0.32493001 0.50869000 {++} 0.00000000 0 0 0 {?} 14 3.347 3.347 0.000 0 2 {?} {68.hn} 9.57003975 0.03323000 0.06046000 {++} 0.00000000 0 0 0 {?} {68.n} 107.26703644 0.30678001 0.45462000 {++} 0.00000000 0 0 0 {?} 15 4.962 4.962 0.000 0 2 {?} {23.hn} 9.51471996 0.02977000 0.05406000 {++} 0.00000000 0 0 0 {?} {23.n} 122.59031677 0.33377999 0.52140999 {++} 0.00000000 0 0 0 {?} 16 2.912 2.912 0.000 0 2 {?} {105.hn} 9.47432995 0.03214000 0.05086000 {++} 0.00000000 0 0 0 {?} {105.n} 119.18424225 0.37169001 0.52471000 {++} 0.00000000 0 0 0 {?} 17 0.620 0.620 0.000 0 2 {?} {92.hn} 9.35758018 0.00015000 0.00015000 {NN} 0.00000000 0 0 0 {?} {92.n} 117.38408661 0.00127000 0.00126000 {NN} 0.00000000 0 0 0 {?} 18 6.466 6.466 0.000 0 2 {?} {118.hn} 9.31912041 0.03339000 0.05695000 {++} 0.00000000 0 0 0 {?} {118.n} 122.29342651 0.33636999 0.53961003 {++} 0.00000000 0 0 0 {?} 19 4.261 4.261 0.000 0 2 {?} {70.hn} 9.30665970 0.03852000 0.06355000 {++} 0.00000000 0 0 0 {?} {70.n} 120.32386017 0.31884000 0.50962001 {++} 0.00000000 0 0 0 {?} 20 4.030 4.030 0.000 0 2 {?} {22.hn} 9.23128033 0.02848000 0.05268000 {++} 0.00000000 0 0 0 {?} {22.n} 126.13751221 0.31075999 0.47947001 {++} 0.00000000 0 0 0 {?} 21 4.558 4.558 0.000 0 2 {?} {41.hn} 9.22552967 0.03591000 0.06015000 {++} 0.00000000 0 0 0 {?} {41.n} 122.87457275 0.31358001 0.50125003 {++} 0.00000000 0 0 0 {?} 22 4.238 4.238 0.000 0 2 {?} {80.hn} 9.19110012 0.02633000 0.04987000 {++} 0.00000000 0 0 0 {?} {80.n} 124.47899628 0.32291999 0.50771999 {++} 0.00000000 0 0 0 {?} 23 4.710 4.710 0.000 0 2 {?} {119.hn} 9.08745003 0.03428000 0.05526000 {++} 0.00000000 0 0 0 {?} {119.n} 122.94628906 0.31703001 0.51450998 {++} 0.00000000 0 0 0 {?} 24 3.736 3.736 0.000 0 2 {?} {115.hn} 9.00977993 0.03384000 0.05446000 {++} 0.00000000 0 0 0 {?} {115.n} 114.46308899 0.31613001 0.48543000 {++} 0.00000000 0 0 0 {?} 25 2.482 2.482 0.000 0 2 {?} {116.hn} 8.99246979 0.04500000 0.06814000 {++} 0.00000000 0 0 0 {?} {116.n} 119.21627808 0.32157999 0.45065001 {++} 0.00000000 0 0 0 {?} 26 2.743 2.743 0.000 0 2 {?} {104.hn} 8.94462013 0.03204000 0.05025000 {++} 0.00000000 0 0 0 {?} {104.n} 115.37536621 0.32609001 0.45906001 {++} 0.00000000 0 0 0 {?} 27 4.911 4.911 0.000 0 2 {?} {6.hn} 8.94159985 0.03205000 0.06960000 {P+} 0.00000000 0 0 0 {?} {6.n} 112.66989899 0.33834001 0.53364003 {++} 0.00000000 0 0 0 {?} 28 3.589 3.589 0.000 0 2 {?} {86.hn} 8.92702961 0.03774000 0.06328000 {++} 0.00000000 0 0 0 {?} {86.n} 126.47408295 0.34966001 0.53376001 {++} 0.00000000 0 0 0 {?} 29 6.018 6.018 0.000 0 2 {?} {26.hn} 8.92525959 0.03591000 0.06342000 {++} 0.00000000 0 0 0 {?} {26.n} 122.43505859 0.32765999 0.53724003 {++} 0.00000000 0 0 0 {?} 30 4.657 4.657 0.000 0 2 {?} {79.hn} 8.93155956 0.02575000 0.05054000 {++} 0.00000000 0 0 0 {?} {79.n} 116.55294037 0.30404001 0.50095999 {++} 0.00000000 0 0 0 {?} 31 8.680 8.680 0.000 0 2 {?} {123.hn} 8.90124035 0.03328000 0.07356000 {++} 0.00000000 0 0 0 {?} {123.n} 121.48491669 0.35896000 0.59154999 {++} 0.00000000 0 0 0 {?} 32 5.480 5.480 0.000 0 2 {?} {31.hn} 8.87271023 0.03103000 0.05288000 {++} 0.00000000 0 0 0 {?} {31.n} 118.28855896 0.35156000 0.56098998 {++} 0.00000000 0 0 0 {?} 33 5.177 5.177 0.000 0 2 {?} {50.hn} 8.87687016 0.02647000 0.05215000 {+P} 0.00000000 0 0 0 {?} {50.n} 112.67620850 0.33194000 0.53685999 {++} 0.00000000 0 0 0 {?} 34 2.262 2.262 0.000 0 2 {?} {87.hn} 8.86124992 0.03871000 0.05412000 {++} 0.00000000 0 0 0 {?} {87.n} 131.54736328 0.30520999 0.41211000 {++} 0.00000000 0 0 0 {?} 35 4.400 4.400 0.000 0 2 {?} {11.hn} 8.85379982 0.03318000 0.06244000 {++} 0.00000000 0 0 0 {?} {11.n} 129.21949768 0.35303000 0.56389999 {++} 0.00000000 0 0 0 {?} 36 5.202 5.202 0.000 0 2 {?} {130.hn} 8.86172962 0.02796000 0.05243000 {++} 0.00000000 0 0 0 {?} {130.n} 124.20390320 0.30507001 0.49595001 {++} 0.00000000 0 0 0 {?} 37 5.875 5.875 0.000 0 2 {?} {73.hn} 8.83843994 0.02736000 0.05238000 {++} 0.00000000 0 0 0 {?} {73.n} 116.17131805 0.30772001 0.51154000 {++} 0.00000000 0 0 0 {?} 38 1.513 1.513 0.000 0 2 {?} {110.hn} 8.76556969 0.03608000 0.04183000 {++} 0.00000000 0 0 0 {?} {110.n} 124.42407990 0.51084000 0.58113998 {++} 0.00000000 0 0 0 {?} 39 4.394 4.394 0.000 0 2 {?} {106.hn} 8.73484993 0.03611000 0.05755000 {++} 0.00000000 0 0 0 {?} {106.n} 118.33637238 0.31371000 0.50753999 {++} 0.00000000 0 0 0 {?} 40 4.663 4.663 0.000 0 2 {?} {53.hn} 8.71644020 0.03125000 0.05733000 {++} 0.00000000 0 0 0 {?} {53.n} 122.95744324 0.32528999 0.50847000 {++} 0.00000000 0 0 0 {?} 41 0.790 0.000 0.000 0 2 {?} {?} 8.63728046 0.02917000 0.02917000 {++} 0.00000000 0 0 0 {?} {?} 120.38593292 0.24229001 0.24228001 {++} 0.00000000 0 0 0 {?} 42 5.300 5.300 0.000 0 2 {?} {99.hn} 8.69369984 0.03693000 0.06223000 {++} 0.00000000 0 0 0 {?} {99.n} 119.18366241 0.37474999 0.58937001 {++} 0.00000000 0 0 0 {?} 43 3.440 3.440 0.000 0 2 {?} {62.hn} 8.68554974 0.04802000 0.07728000 {++} 0.00000000 0 0 0 {?} {62.n} 114.29900360 0.35624000 0.52623999 {++} 0.00000000 0 0 0 {?} 44 3.928 3.928 0.000 0 2 {?} {14.hn} 8.65734959 0.03176000 0.05406000 {++} 0.00000000 0 0 0 {?} {14.n} 116.05055237 0.33274001 0.51853001 {++} 0.00000000 0 0 0 {?} 45 11.464 11.464 0.000 0 2 {?} {85.hn} 8.57497025 0.02742000 0.06881000 {++} 0.00000000 0 0 0 {?} {85.n} 120.06310272 0.36214000 0.62229002 {++} 0.00000000 0 0 0 {?} 46 5.717 5.717 0.000 0 2 {?} {122.hn} 8.56332970 0.02444000 0.04841000 {++} 0.00000000 0 0 0 {?} {122.n} 122.81716156 0.34619999 0.54712999 {++} 0.00000000 0 0 0 {?} 47 3.554 3.554 0.000 0 2 {?} {44.hn} 8.56091022 0.03728000 0.07362000 {++} 0.00000000 0 0 0 {?} {44.n} 120.94872284 0.36216000 0.54232001 {++} 0.00000000 0 0 0 {?} 48 6.340 6.340 0.000 0 2 {?} {120.hn} 8.55393982 0.02813000 0.05229000 {++} 0.00000000 0 0 0 {?} {120.n} 114.87780762 0.35769999 0.57709998 {++} 0.00000000 0 0 0 {?} 49 5.161 5.161 0.000 0 2 {?} {27.hn} 8.54965973 0.02614000 0.05278000 {++} 0.00000000 0 0 0 {?} {27.n} 126.22457886 0.33618000 0.53008002 {++} 0.00000000 0 0 0 {?} 50 4.836 4.836 0.000 0 2 {?} {88.hn} 8.52492046 0.02531000 0.04655000 {++} 0.00000000 0 0 0 {?} {88.n} 123.40870667 0.35352999 0.54759997 {++} 0.00000000 0 0 0 {?} 51 3.657 3.657 0.000 0 2 {?} {61.hn} 8.52775002 0.03222000 0.05199000 {++} 0.00000000 0 0 0 {?} {61.n} 116.90406036 0.40098000 0.64010000 {++} 0.00000000 0 0 0 {?} 52 3.174 3.174 0.000 0 2 {?} {16.hn} 8.53034019 0.04022000 0.06352000 {++} 0.00000000 0 0 0 {?} {16.n} 112.84618378 0.32462001 0.49699000 {++} 0.00000000 0 0 0 {?} 53 0.700 0.000 0.000 0 2 {?} {?} 8.50697041 0.02057000 0.02057000 {+P} 0.00000000 0 0 0 {?} {?} 120.83286285 0.18042000 0.18043000 {++} 0.00000000 0 0 0 {?} 54 4.907 4.907 0.000 0 2 {?} {102.hn} 8.47752953 0.03317000 0.05446000 {++} 0.00000000 0 0 0 {?} {102.n} 119.08548737 0.31158999 0.50669998 {++} 0.00000000 0 0 0 {?} 55 5.801 5.801 0.000 0 2 {?} {37.hn} 8.47807980 0.03095000 0.05323000 {++} 0.00000000 0 0 0 {?} {37.n} 107.17466736 0.34172001 0.53821999 {++} 0.00000000 0 0 0 {?} 56 4.688 4.688 0.000 0 2 {?} {7.hn} 8.45903015 0.02795000 0.05157000 {++} 0.00000000 0 0 0 {?} {7.n} 122.68466187 0.35030001 0.54763001 {++} 0.00000000 0 0 0 {?} 57 4.028 4.028 0.000 0 2 {?} {10.hn} 8.45106983 0.02599000 0.04268000 {++} 0.00000000 0 0 0 {?} {10.n} 123.97802734 0.32675001 1.11327004 {P+} 0.00000000 0 0 0 {?} 58 6.011 6.011 0.000 0 2 {?} {?} 8.44324017 0.03212000 0.05747000 {++} 0.00000000 0 0 0 {?} {?} 110.84970856 0.31516001 0.52969998 {++} 0.00000000 0 0 0 {?} 59 6.903 6.903 0.000 0 2 {?} {3.hn} 8.43231010 0.03129000 0.05713000 {++} 0.00000000 0 0 0 {?} {3.n} 117.45841217 0.32172000 0.53641999 {++} 0.00000000 0 0 0 {?} 60 4.358 4.358 0.000 0 2 {?} {107.hn} 8.42374992 0.03121000 0.05313000 {++} 0.00000000 0 0 0 {?} {107.n} 123.63417816 0.34773999 0.52847999 {P+} 0.00000000 0 0 0 {?} 61 7.341 7.341 0.000 0 2 {?} {96.hn} 8.42539024 0.02493000 0.05153000 {++} 0.00000000 0 0 0 {?} {96.n} 123.12751770 0.36273000 0.59812999 {+P} 0.00000000 0 0 0 {?} 62 5.880 5.880 0.000 0 2 {?} {63.hn} 8.42525959 0.02657000 0.05116000 {++} 0.00000000 0 0 0 {?} {63.n} 121.72847748 0.34551001 0.58778000 {++} 0.00000000 0 0 0 {?} 63 4.685 4.685 0.000 0 2 {?} {9.hn} 8.40639973 0.03475000 0.09534000 {P+} 0.00000000 0 0 0 {?} {9.n} 127.88049316 0.35148001 0.55984002 {++} 0.00000000 0 0 0 {?} 64 6.559 6.559 0.000 0 2 {?} {21.hn} 8.40054989 0.02473000 0.05149000 {++} 0.00000000 0 0 0 {?} {21.n} 120.24398041 0.33491999 0.55605000 {++} 0.00000000 0 0 0 {?} 65 8.262 8.262 0.000 0 2 {?} {98.hn} 8.39338017 0.03323000 0.05843000 {++} 0.00000000 0 0 0 {?} {98.n} 108.44767761 0.31895000 0.53691000 {++} 0.00000000 0 0 0 {?} 66 3.674 3.674 0.000 0 2 {?} {113.hn} 8.37771988 0.03023000 0.04964000 {++} 0.00000000 0 0 0 {?} {113.n} 118.62214661 0.37955999 0.62643999 {P+} 0.00000000 0 0 0 {?} 67 4.987 4.987 0.000 0 2 {?} {90.hn} 8.37639046 0.02863000 0.05087000 {++} 0.00000000 0 0 0 {?} {90.n} 118.02803802 0.31555000 0.51806003 {+P} 0.00000000 0 0 0 {?} 68 3.852 3.852 0.000 0 2 {?} {17.hn} 8.33646965 0.03508000 0.06810000 {+P} 0.00000000 0 0 0 {?} {17.n} 127.73370361 0.34709999 0.53301001 {++} 0.00000000 0 0 0 {?} 69 6.376 6.376 0.000 0 2 {?} {121.hn} 8.33689976 0.03142000 0.06134000 {++} 0.00000000 0 0 0 {?} {121.n} 123.94425201 0.34724000 0.55888999 {++} 0.00000000 0 0 0 {?} 70 3.906 3.906 0.000 0 2 {?} {49.hn} 8.32343006 0.03696000 0.06546000 {++} 0.00000000 0 0 0 {?} {49.n} 120.84480286 0.32969001 0.51823997 {++} 0.00000000 0 0 0 {?} 71 2.776 2.776 0.000 0 2 {?} {18.hn} 8.29333973 0.03192000 0.05038000 {++} 0.00000000 0 0 0 {?} {18.n} 128.52061462 0.32376999 0.45353001 {++} 0.00000000 0 0 0 {?} 72 4.179 4.179 0.000 0 2 {?} {32.he21} 8.29644966 0.03511000 0.06060000 {++} 0.00000000 0 0 0 {?} {32.ne} 112.65647125 0.36357000 0.55001998 {++} 0.00000000 0 0 0 {?} 73 1.252 1.252 0.000 0 2 {?} {93.hn} 8.29444981 0.04895000 0.04940000 {++} 0.00000000 0 0 0 {?} {93.n} 110.43961334 0.35892999 0.36153999 {++} 0.00000000 0 0 0 {?} 74 9.297 9.297 0.000 0 2 {?} {97.hn} 8.26809978 0.02602000 0.05117000 {++} 0.00000000 0 0 0 {?} {97.n} 109.27584076 0.29067999 0.51084000 {++} 0.00000000 0 0 0 {?} 75 6.256 6.256 0.000 0 2 {?} {84.hn} 8.25685978 0.03394000 0.05941000 {++} 0.00000000 0 0 0 {?} {84.n} 124.92072296 0.32295001 0.54145998 {++} 0.00000000 0 0 0 {?} 76 3.337 3.337 0.000 0 2 {?} {67.hn} 8.25753975 0.04025000 0.06167000 {++} 0.00000000 0 0 0 {?} {67.n} 111.18984985 0.33532000 0.49434999 {++} 0.00000000 0 0 0 {?} 77 4.323 4.323 0.000 0 2 {?} {103.hn} 8.23915005 0.03060000 0.06148000 {++} 0.00000000 0 0 0 {?} {103.n} 123.43029785 0.35289001 0.55575001 {++} 0.00000000 0 0 0 {?} 78 9.402 9.402 0.000 0 2 {?} {95.hn} 8.25129986 0.02373000 0.05178000 {++} 0.00000000 0 0 0 {?} {95.n} 116.66364288 0.38047001 0.66279000 {++} 0.00000000 0 0 0 {?} 79 5.828 5.828 0.000 0 2 {?} {36.hn} 8.24242020 0.03146000 0.05413000 {++} 0.00000000 0 0 0 {?} {36.n} 114.35220337 0.34296000 0.55087000 {++} 0.00000000 0 0 0 {?} 80 4.552 4.552 0.000 0 2 {?} {82.hn} 8.22436047 0.02685000 0.05118000 {++} 0.00000000 0 0 0 {?} {82.n} 119.22351074 0.30199999 0.49836001 {++} 0.00000000 0 0 0 {?} 81 5.728 5.728 0.000 0 2 {?} {32.hn} 8.21860027 0.03337000 0.05689000 {++} 0.00000000 0 0 0 {?} {32.n} 116.35923767 0.35128999 0.55596000 {++} 0.00000000 0 0 0 {?} 82 3.940 3.940 0.000 0 2 {?} {60.hn} 8.19425011 0.02615000 0.04705000 {++} 0.00000000 0 0 0 {?} {60.n} 115.45477295 0.35578001 0.55607003 {++} 0.00000000 0 0 0 {?} 83 4.063 4.063 0.000 0 2 {?} {101.hn} 8.16740036 0.03040000 0.05354000 {++} 0.00000000 0 0 0 {?} {101.n} 117.57997131 0.31764999 0.50489998 {++} 0.00000000 0 0 0 {?} 84 5.374 5.374 0.000 0 2 {?} {94.hn} 8.15120983 0.03088000 0.05255000 {++} 0.00000000 0 0 0 {?} {94.n} 121.00681305 0.31602001 0.96483999 {P+} 0.00000000 0 0 0 {?} 85 1.287 0.000 0.000 0 2 {?} {?} 8.14962959 0.04950000 0.05094000 {++} 0.00000000 0 0 0 {?} {?} 120.44609833 0.29491001 0.30217001 {+P} 0.00000000 0 0 0 {?} 86 6.588 6.588 0.000 0 2 {?} {47.hn} 8.14540958 0.02882000 0.05408000 {++} 0.00000000 0 0 0 {?} {47.n} 119.47791290 0.34330001 0.55298001 {++} 0.00000000 0 0 0 {?} 87 3.812 3.812 0.000 0 2 {?} {125.hn} 8.15330029 0.03052000 0.05226000 {++} 0.00000000 0 0 0 {?} {125.n} 111.22820282 0.33517000 0.51786000 {++} 0.00000000 0 0 0 {?} 88 5.037 5.037 0.000 0 2 {?} {52.hn} 8.13006973 0.02860000 0.05394000 {++} 0.00000000 0 0 0 {?} {52.n} 122.41191864 0.30627999 0.50278002 {++} 0.00000000 0 0 0 {?} 89 4.411 4.411 0.000 0 2 {?} {39.hn} 8.13879013 0.03012000 0.05234000 {++} 0.00000000 0 0 0 {?} {39.n} 113.67507172 0.32392001 0.51520997 {++} 0.00000000 0 0 0 {?} 90 6.474 6.474 0.000 0 2 {?} {30.hn} 8.08959007 0.02595000 0.05063000 {++} 0.00000000 0 0 0 {?} {30.n} 121.81076813 0.32076001 0.54876000 {++} 0.00000000 0 0 0 {?} 91 1.985 1.985 0.000 0 2 {?} {59.hn} 8.08353996 0.03868000 0.05041000 {++} 0.00000000 0 0 0 {?} {59.n} 117.96663666 0.27998000 0.36399999 {++} 0.00000000 0 0 0 {?} 92 5.103 5.103 0.000 0 2 {?} {83.hn} 8.06632996 0.03495000 0.05899000 {++} 0.00000000 0 0 0 {?} {83.n} 107.83188629 0.35574001 0.54294997 {++} 0.00000000 0 0 0 {?} 93 3.475 3.475 0.000 0 2 {?} {57.hn} 8.05741024 0.03264000 0.05339000 {++} 0.00000000 0 0 0 {?} {57.n} 113.85253143 0.35843000 0.53140998 {++} 0.00000000 0 0 0 {?} 94 2.513 2.513 0.000 0 2 {?} {91.hn} 7.98311996 0.04159000 0.06410000 {++} 0.00000000 0 0 0 {?} {91.n} 123.17247772 0.32313001 0.44587001 {++} 0.00000000 0 0 0 {?} 95 6.273 6.273 0.000 0 2 {?} {75.hn} 7.97279978 0.03542000 0.06385000 {++} 0.00000000 0 0 0 {?} {75.n} 118.14244843 0.34729999 0.55479002 {++} 0.00000000 0 0 0 {?} 96 7.107 7.107 0.000 0 2 {?} {2.hn} 7.94021988 0.02601000 0.05188000 {++} 0.00000000 0 0 0 {?} {2.n} 115.29295349 0.30059001 0.52825999 {++} 0.00000000 0 0 0 {?} 97 3.727 3.727 0.000 0 2 {?} {19.hn} 7.88533020 0.03165000 0.05563000 {++} 0.00000000 0 0 0 {?} {19.n} 126.33120728 0.34757000 0.54372001 {++} 0.00000000 0 0 0 {?} 98 2.588 0.000 0.000 0 2 {?} {?} 7.87925005 0.03017000 0.04547000 {++} 0.00000000 0 0 0 {?} {?} 123.84864807 0.35385999 0.50383002 {++} 0.00000000 0 0 0 {?} 99 5.450 5.450 0.000 0 2 {?} {33.hn} 7.86999989 0.02392000 0.04860000 {++} 0.00000000 0 0 0 {?} {33.n} 116.66506958 0.37018999 0.57752001 {++} 0.00000000 0 0 0 {?} 100 4.925 4.925 0.000 0 2 {?} {48.hn} 7.81500006 0.02455000 0.04840000 {++} 0.00000000 0 0 0 {?} {48.n} 122.76174164 0.35128999 0.57163000 {++} 0.00000000 0 0 0 {?} 101 3.674 3.674 0.000 0 2 {?} {71.hn} 7.75289011 0.03592000 0.05487000 {++} 0.00000000 0 0 0 {?} {71.n} 118.63371277 0.28996000 0.44132999 {++} 0.00000000 0 0 0 {?} 102 1.916 1.916 0.000 0 2 {?} {112.hn} 7.75785017 0.04133000 0.05591000 {++} 0.00000000 0 0 0 {?} {112.n} 115.33421326 0.36849001 0.46015000 {++} 0.00000000 0 0 0 {?} 103 1.377 1.377 0.000 0 2 {?} {111.hn} 7.75264978 0.04707000 0.05076000 {++} 0.00000000 0 0 0 {?} {111.n} 108.64698792 0.43048000 0.46004000 {++} 0.00000000 0 0 0 {?} 104 6.161 6.161 0.000 0 2 {?} {51.hn} 7.74340010 0.02958000 0.05315000 {++} 0.00000000 0 0 0 {?} {51.n} 119.88942719 0.31420001 0.53807002 {++} 0.00000000 0 0 0 {?} 105 1.285 1.285 0.000 0 2 {?} {114.hn} 7.73915005 0.05123000 0.05260000 {++} 0.00000000 0 0 0 {?} {114.n} 116.90912628 0.34906000 0.35879001 {++} 0.00000000 0 0 0 {?} 106 3.684 3.684 0.000 0 2 {?} {126.hn} 7.72045994 0.03110000 0.05456000 {++} 0.00000000 0 0 0 {?} {126.n} 121.52570343 0.29973000 0.46348000 {++} 0.00000000 0 0 0 {?} 107 7.678 7.678 0.000 0 2 {?} {99.hd21} 7.72806978 0.03269000 0.06810000 {P+} 0.00000000 0 0 0 {?} {99.nd2} 112.42622375 0.33733001 0.55686998 {++} 0.00000000 0 0 0 {?} 108 5.139 5.139 0.000 0 2 {?} {35.hn} 7.68176985 0.02753000 0.05090000 {++} 0.00000000 0 0 0 {?} {35.n} 106.76280975 0.30531999 0.51186001 {++} 0.00000000 0 0 0 {?} 109 3.530 3.530 0.000 0 2 {?} {24.hn} 7.67336988 0.03990000 0.07977000 {++} 0.00000000 0 0 0 {?} {24.n} 118.32753754 0.33447000 0.62888998 {++} 0.00000000 0 0 0 {?} 110 6.140 6.140 0.000 0 2 {?} {120.hd21} 7.67301989 0.03150000 0.05251000 {+P} 0.00000000 0 0 0 {?} {120.nd2} 112.33680725 0.30633000 0.51440001 {++} 0.00000000 0 0 0 {?} 111 3.147 3.147 0.000 0 2 {?} {109.hn} 7.65593004 0.04087000 0.07126000 {++} 0.00000000 0 0 0 {?} {109.n} 115.97673798 0.32233000 0.47025001 {++} 0.00000000 0 0 0 {?} 112 4.667 4.667 0.000 0 2 {?} {34.hn} 7.55835009 0.02681000 0.05074000 {++} 0.00000000 0 0 0 {?} {34.n} 120.50007629 0.32078001 0.51036000 {++} 0.00000000 0 0 0 {?} 113 5.320 5.320 0.000 0 2 {?} {28.hn} 7.53243017 0.03026000 0.05444000 {++} 0.00000000 0 0 0 {?} {28.n} 118.41351318 0.30388999 0.50586998 {++} 0.00000000 0 0 0 {?} 114 12.552 12.552 0.000 0 2 {?} {63.he22} 6.84688997 0.03108000 0.06139000 {++} 0.00000000 0 0 0 {?} {63.he2} 112.21515656 0.47374001 0.72952002 {++} 0.00000000 0 0 0 {?} 115 2.547 2.547 0.000 0 2 {?} {23.hd21} 7.49004984 0.02754000 0.04553000 {++} 0.00000000 0 0 0 {?} {23.nd2} 110.45275879 0.31404001 0.43719000 {++} 0.00000000 0 0 0 {?} 116 6.560 6.560 0.000 0 2 {?} {77.hn} 7.46466017 0.03041000 0.05737000 {++} 0.00000000 0 0 0 {?} {77.n} 122.19624329 0.28860000 0.49360001 {++} 0.00000000 0 0 0 {?} 117 10.219 10.219 0.000 0 2 {?} {45.hn} 7.46564007 0.03317000 0.06452000 {++} 0.00000000 0 0 0 {?} {45.n} 111.62364960 0.39146000 0.81639999 {+P} 0.00000000 0 0 0 {?} 118 5.913 5.913 0.000 0 2 {?} {13.hn} 7.43984985 0.03794000 0.06614000 {++} 0.00000000 0 0 0 {?} {13.n} 116.30840302 0.36802000 0.58034003 {++} 0.00000000 0 0 0 {?} 119 6.148 6.148 0.000 0 2 {?} {38.hn} 7.40814018 0.02509000 0.05155000 {++} 0.00000000 0 0 0 {?} {38.n} 121.87648773 0.31542000 0.49515000 {++} 0.00000000 0 0 0 {?} 120 5.232 5.232 0.000 0 2 {?} {55.hn} 7.41500998 0.03544000 0.06683000 {++} 0.00000000 0 0 0 {?} {55.n} 121.07697296 0.29912999 0.49063000 {++} 0.00000000 0 0 0 {?} 121 7.833 7.833 0.000 0 2 {?} {79.he21} 7.41573000 0.03271000 0.06152000 {++} 0.00000000 0 0 0 {?} {79.ne2} 112.63950348 0.29172000 0.50880003 {++} 0.00000000 0 0 0 {?} 122 5.537 5.537 0.000 0 2 {?} {74.hn} 7.38992023 0.02868000 0.05197000 {++} 0.00000000 0 0 0 {?} {74.n} 114.11132050 0.31362000 0.53218001 {++} 0.00000000 0 0 0 {?} 123 19.317 19.317 0.000 0 2 {?} {77.he1} 7.39208984 0.02215000 0.04926000 {++} 0.00000000 0 0 0 {?} {77.ne2} 111.52062988 0.37015000 0.65008003 {++} 0.00000000 0 0 0 {?} 124 2.577 0.000 0.000 0 2 {?} {?} 7.37181997 0.04038000 0.05911000 {++} 0.00000000 0 0 0 {?} {?} 105.88622284 0.34393999 0.48550999 {++} 0.00000000 0 0 0 {?} 125 1.248 1.248 0.000 0 2 {?} {60.he22} 7.35538006 0.03087000 0.03103000 {++} 0.00000000 0 0 0 {?} {60.ne2} 110.75055695 0.33669001 0.33845001 {++} 0.00000000 0 0 0 {?} 126 4.089 4.089 0.000 0 2 {?} {58.hn} 7.32004976 0.03352000 0.05351000 {++} 0.00000000 0 0 0 {?} {58.n} 107.03830719 0.31248000 0.47878000 {++} 0.00000000 0 0 0 {?} 127 1.466 1.466 0.000 0 2 {?} {89.hn} 7.29715014 0.04233000 0.04736000 {++} 0.00000000 0 0 0 {?} {89.n} 121.50028229 0.38371000 0.42697001 {++} 0.00000000 0 0 0 {?} 128 6.265 6.265 0.000 0 2 {?} {100.hn} 7.26433992 0.03480000 0.06027000 {++} 0.00000000 0 0 0 {?} {100.n} 120.66940308 0.35778999 0.56932002 {++} 0.00000000 0 0 0 {?} 129 4.514 0.000 0.000 0 2 {?} {?} 7.22620010 0.02433000 0.04899000 {++} 0.00000000 0 0 0 {?} {?} 123.13594055 0.31507999 0.46441999 {++} 0.00000000 0 0 0 {?} 130 2.655 2.655 0.000 0 2 {?} {60.he22} 7.20616007 0.03652000 0.05443000 {++} 0.00000000 0 0 0 {?} {60.ne2} 110.74545288 0.34659001 0.49728999 {++} 0.00000000 0 0 0 {?} 131 3.323 0.000 0.000 0 2 {?} {?} 7.17926979 0.02706000 0.06810000 {P+} 0.00000000 0 0 0 {?} {?} 122.81266785 0.36070001 0.52706999 {++} 0.00000000 0 0 0 {?} 132 3.825 3.825 0.000 0 2 {?} {?} 7.16268015 0.02184000 0.04177000 {++} 0.00000000 0 0 0 {?} {?} 124.00399017 0.37779000 0.53817999 {++} 0.00000000 0 0 0 {?} 133 4.770 4.770 0.000 0 2 {?} {69.hn} 7.14453983 0.03043000 0.05265000 {++} 0.00000000 0 0 0 {?} {69.n} 126.48293304 0.32347000 0.52525002 {++} 0.00000000 0 0 0 {?} 134 4.799 4.799 0.000 0 2 {?} {4.hn} 7.13657999 0.02822000 0.05337000 {++} 0.00000000 0 0 0 {?} {4.n} 124.50659943 0.31891999 0.96483999 {P+} 0.00000000 0 0 0 {?} 135 4.382 4.382 0.000 0 2 {?} {78.hn} 7.11497021 0.03613000 0.05854000 {+P} 0.00000000 0 0 0 {?} {78.n} 122.91343689 0.32879999 0.51955003 {++} 0.00000000 0 0 0 {?} 136 3.678 3.678 0.000 0 2 {?} {13.hd21} 7.11266994 0.03716000 0.06193000 {++} 0.00000000 0 0 0 {?} {13.nd2} 113.18604279 0.34828001 0.53327000 {++} 0.00000000 0 0 0 {?} 137 5.795 5.795 0.000 0 2 {?} {120.hd22} 7.00826979 0.03078000 0.05325000 {++} 0.00000000 0 0 0 {?} {120.nd2} 112.31098938 0.30987999 0.51069999 {++} 0.00000000 0 0 0 {?} 138 4.659 0.000 0.000 0 2 {?} {?} 6.98065996 0.02396000 0.04509000 {++} 0.00000000 0 0 0 {?} {?} 122.76332092 0.32607001 0.48910999 {++} 0.00000000 0 0 0 {?} 139 7.211 7.211 0.000 0 2 {?} {20.hn} 6.92047977 0.03036000 0.05508000 {++} 0.00000000 0 0 0 {?} {20.n} 119.55486298 0.35073000 0.56594998 {++} 0.00000000 0 0 0 {?} 140 10.353 10.353 0.000 0 2 {?} {76.he22} 6.90164995 0.05858000 0.10305000 {++} 0.00000000 0 0 0 {?} {76.ne2} 112.63950348 0.29699001 0.54161000 {++} 0.00000000 0 0 0 {?} 141 4.945 4.945 0.000 0 2 {?} {12.hn} 6.89800978 0.03284000 0.05440000 {++} 0.00000000 0 0 0 {?} {12.n} 105.90569305 0.35505000 0.54364997 {++} 0.00000000 0 0 0 {?} 142 9.348 9.348 0.000 0 2 {?} {73.hd22} 6.88484001 0.02688000 0.05012000 {++} 0.00000000 0 0 0 {?} {73.ne2} 111.18006897 0.32189000 0.54188001 {++} 0.00000000 0 0 0 {?} 143 17.503 17.503 0.000 0 2 {?} {63.he21} 7.50013018 0.03619000 0.06962000 {++} 0.00000000 0 0 0 {?} {63.ne2} 112.21933746 0.37705001 0.69659001 {++} 0.00000000 0 0 0 {?} 144 3.287 0.000 0.000 0 2 {?} {?} 6.79500008 0.02914000 0.05102000 {++} 0.00000000 0 0 0 {?} {?} 114.23880768 0.33070999 0.50481999 {++} 0.00000000 0 0 0 {?} 145 11.877 11.877 0.000 0 2 {?} {77.he22} 6.80135012 0.03263000 0.06810000 {P+} 0.00000000 0 0 0 {?} {77.ne2} 111.52100372 0.30438000 0.57609999 {++} 0.00000000 0 0 0 {?} 146 12.282 12.282 0.000 0 2 {?} {123.he22} 6.75463009 0.02512000 0.06810000 {+P} 0.00000000 0 0 0 {?} {63.ne2} 111.75553894 0.41433999 0.64655000 {++} 0.00000000 0 0 0 {?} 147 2.322 0.000 0.000 0 2 {?} {?} 6.74678993 0.03584000 0.04935000 {++} 0.00000000 0 0 0 {?} {?} 121.49088287 0.35811001 0.46380001 {++} 0.00000000 0 0 0 {?} 148 3.974 3.974 0.000 0 2 {?} {42.hn} 6.74376011 0.03824000 0.07006000 {++} 0.00000000 0 0 0 {?} {42.n} 113.46991730 0.37478000 0.54895997 {++} 0.00000000 0 0 0 {?} 149 5.874 5.874 0.000 0 2 {?} {32.he22} 6.71391010 0.03360000 0.05771000 {++} 0.00000000 0 0 0 {?} {32.ne2} 112.64943695 0.47103000 0.70818001 {++} 0.00000000 0 0 0 {?} 150 6.033 6.033 0.000 0 2 {?} {36.hd22} 6.70543003 0.04075000 0.07402000 {++} 0.00000000 0 0 0 {?} {36.nd2} 112.43488312 0.46313000 0.72485000 {++} 0.00000000 0 0 0 {?} 151 3.100 3.100 0.000 0 2 {?} {23.hd22} 6.68278980 0.02922000 0.04799000 {++} 0.00000000 0 0 0 {?} {23.nd2} 110.44435120 0.34547001 0.51762998 {++} 0.00000000 0 0 0 {?} 152 4.473 4.473 0.000 0 2 {?} {13.hd22} 6.57031012 0.03516000 0.05644000 {++} 0.00000000 0 0 0 {?} {13.nd2} 113.18820190 0.35157001 0.56444001 {++} 0.00000000 0 0 0 {?} 153 7.613 7.613 0.000 0 2 {?} {108.hd22} 6.55825996 0.02967000 0.05346000 {++} 0.00000000 0 0 0 {?} {108.nd2} 111.52306366 0.30994999 0.53024000 {++} 0.00000000 0 0 0 {?} 154 4.911 4.911 0.000 0 2 {?} {36.hd21} 6.50427008 0.03210000 0.05470000 {++} 0.00000000 0 0 0 {?} {36.nd2} 112.35740662 0.35227001 0.55254000 {++} 0.00000000 0 0 0 {?} 155 0.996 0.000 0.000 0 2 {?} {?} 6.35193014 0.04272000 0.03492000 {++} 0.00000000 0 0 0 {?} {?} 122.52085114 0.37555000 0.31421000 {++} 0.00000000 0 0 0 {?} 156 1.049 1.049 0.000 0 2 {?} {43.hn} 5.24005985 0.02260000 0.02260000 {++} 0.00000000 0 0 0 {?} {43.n} 121.06342316 0.34766999 0.30195999 {++} 0.00000000 0 0 0 {?} 157 0.400 0.000 0.000 0 2 {?} {?} 6.37304020 0.03762000 0.03652000 {++} 0.00000000 0 0 0 {?} {?} 109.73033142 0.39886999 0.39138001 {++} 0.00000000 0 0 0 {?} 158 0.388 0.388 0.000 0 2 {?} {65.hn} 7.84636021 0.03322000 0.03246000 {++} 0.00000000 0 0 0 {?} {65.n} 114.33970642 0.31775999 0.31051001 {++} 0.00000000 0 0 0 {?} 159 0.455 0.455 0.000 0 2 {?} {?} 7.93442011 0.04169000 0.04468000 {++} 0.00000000 0 0 0 {?} {?} 121.15580750 0.37134999 0.40263000 {++} 0.00000000 0 0 0 {?} 160 0.347 0.000 0.000 0 2 {?} {?} 8.03316975 0.03656000 0.02734000 {++} 0.00000000 0 0 0 {?} {?} 120.43150330 0.26232001 0.26233000 {++} 0.00000000 0 0 0 {?} 161 0.312 0.000 0.000 0 2 {?} {?} 8.64840031 0.07896000 0.06020000 {++} 0.00000000 0 0 0 {?} {?} 124.21547699 0.40902001 0.33037999 {++} 0.00000000 0 0 0 {?} 162 0.282 0.000 0.000 0 2 {?} {?} 7.05433989 0.02721000 0.02011000 {++} 0.00000000 0 0 0 {?} {?} 121.87567902 0.24888000 0.24889000 {++} 0.00000000 0 0 0 {?} 163 0.747 0.000 0.000 0 2 {?} {?} 8.71494007 0.02742000 0.07883000 {++} 0.00000000 0 0 0 {?} {?} 120.61512756 0.36214000 0.65666997 {++} 0.00000000 0 0 0 {?} 164 0.470 0.000 0.000 0 2 {?} {?} 8.34619045 0.02818000 0.03158000 {++} 0.00000000 0 0 0 {?} {?} 109.59014893 0.25567001 0.27943999 {++} 0.00000000 0 0 0 {?} 165 0.343 0.000 0.000 0 2 {?} {?} 8.23005009 0.03215000 0.03385000 {++} 0.00000000 0 0 0 {?} {?} 108.60015106 0.38672999 0.41723001 {++} 0.00000000 0 0 0 {?} 166 0.470 0.000 0.000 0 2 {?} {?} 10.12570953 0.05787000 0.06229000 {++} 0.00000000 0 0 0 {?} {?} 129.49816895 0.35784999 0.38580000 {++} 0.00000000 0 0 0 {?} 167 0.321 0.000 0.000 0 2 {?} {?} 10.07155037 0.04416000 0.04416000 {++} 0.00000000 0 0 0 {?} {?} 129.28332520 0.28173000 0.28173000 {++} 0.00000000 0 0 0 {?} 168 1.190 1.190 0.000 0 2 {?} {117.hn} 9.78446007 0.04663000 0.07769000 {++} 0.00000000 0 0 0 {?} {117.n} 120.37341309 0.38011000 0.65096003 {++} 0.00000000 0 0 0 {?} 169 5.168 5.168 0.000 0 2 {?} {129.hn} 8.90065002 0.03328000 0.08048000 {++} 0.00000000 0 0 0 {?} {129.n} 121.47836304 0.35896000 0.63611001 {++} 0.00000000 0 0 0 {?} 170 5.845 5.845 0.000 0 2 {?} {25.hn} 8.45040989 0.03212000 0.07222000 {++} 0.00000000 0 0 0 {?} {25.n} 110.84842682 0.31516001 0.57493001 {++} 0.00000000 0 0 0 {?} 171 3.530 3.530 0.000 0 2 {?} {29.hn} 7.63825989 0.03990000 0.07977000 {++} 0.00000000 0 0 0 {?} {29.n} 118.46843719 0.33447000 0.62888998 {++} 0.00000000 0 0 0 {?} 172 9.359 9.359 0.000 0 2 {?} {54.hn} 7.67806005 0.03990000 0.07977000 {++} 0.00000000 0 0 0 {?} {54.n} 118.36184692 0.33447000 0.62888998 {++} 0.00000000 0 0 0 {?} 173 5.179 5.179 0.000 1 2 {?} {?} 8.64270020 0.02742000 0.07883000 {++} 0.00000000 0 0 0 {?} {?} 120.43331909 0.36214000 0.65666997 {++} 0.00000000 0 0 0 {?} 174 8.802 8.802 0.000 0 2 {?} {73.he21} 7.47113991 0.03317000 0.06905000 {++} 0.00000000 0 0 0 {?} {73.ne2} 111.12583923 0.39146000 0.81639999 {+P} 0.00000000 0 0 0 {?} 175 6.809 6.809 0.000 0 2 {?} {56.hn} 7.67213011 0.03990000 0.07983000 {++} 0.00000000 0 0 0 {?} {56.n} 118.34187317 0.33447000 0.62943000 {++} 0.00000000 0 0 0 {?} 176 0.229 0.000 0.000 0 2 {?} {?} 8.00244999 0.03013000 0.03022000 {++} 0.00000000 0 0 0 {?} {?} 105.65287018 0.31272000 0.31347999 {++} 0.00000000 0 0 0 {?} 177 0.192 0.000 0.000 0 2 {?} {?} 7.26705980 0.04794000 0.03759000 {++} 0.00000000 0 0 0 {?} {?} 105.09882355 0.58454001 0.49818000 {++} 0.00000000 0 0 0 {?} 178 0.298 0.000 0.000 0 2 {?} {?} 7.96154022 0.02162000 0.02619000 {++} 0.00000000 0 0 0 {?} {?} 113.99133301 0.38800001 0.44501001 {++} 0.00000000 0 0 0 {?} 179 0.181 0.000 0.000 0 2 {?} {?} 8.57528019 0.02706000 0.02317000 {++} 0.00000000 0 0 0 {?} {?} 116.05236053 0.39989001 0.39989001 {++} 0.00000000 0 0 0 {?} 180 0.216 0.000 0.000 0 2 {?} {?} 8.75720978 0.04173000 0.04103000 {++} 0.00000000 0 0 0 {?} {?} 116.48548126 0.24959999 0.24515000 {++} 0.00000000 0 0 0 {?} 181 0.250 0.000 0.000 0 2 {?} {?} 7.55211020 0.04086000 0.11067000 {P+} 0.00000000 0 0 0 {?} {?} 116.84958649 0.43634999 0.50515002 {++} 0.00000000 0 0 0 {?} 182 0.211 0.000 0.000 0 2 {?} {?} 7.50744009 0.03794000 0.07655000 {++} 0.00000000 0 0 0 {?} {?} 116.78501129 0.36802000 0.65594000 {++} 0.00000000 0 0 0 {?} 183 0.275 0.000 0.000 0 2 {?} {?} 8.30650997 0.06351000 0.06810000 {+P} 0.00000000 0 0 0 {?} {?} 118.54255676 0.42144001 0.48648000 {++} 0.00000000 0 0 0 {?} 184 0.236 0.000 0.000 0 2 {?} {?} 8.19742966 0.04086000 0.05104000 {P+} 0.00000000 0 0 0 {?} {?} 120.43221283 0.22266001 0.67878002 {P+} 0.00000000 0 0 0 {?} 185 0.345 0.000 0.000 0 2 {?} {?} 6.63029003 0.03261000 0.06810000 {+P} 0.00000000 0 0 0 {?} {?} 112.58394623 0.40544000 0.50682002 {++} 0.00000000 0 0 0 {?} 186 0.274 0.000 0.000 0 2 {?} {?} 8.39288044 0.02881000 0.02963000 {++} 0.00000000 0 0 0 {?} {?} 122.37460327 0.32615000 0.33892000 {++} 0.00000000 0 0 0 {?} 187 7.341 7.341 0.000 0 2 {?} {46.hn} 8.42539024 0.02493000 0.06434000 {++} 0.00000000 0 0 0 {?} {46.n} 123.12751770 0.36273000 0.66795999 {+P} 0.00000000 0 0 0 {?} 188 7.913 7.913 0.000 0 2 {?} {123.he21} 7.15582991 0.03108000 0.06840000 {++} 0.00000000 0 0 0 {?} {123.ne2} 112.26952362 0.47374001 0.75097001 {++} 0.00000000 0 0 0 {?} 189 5.275 5.275 0.000 0 2 {?} {76.he21} 7.50839996 0.03108000 0.06840000 {++} 0.00000000 0 0 0 {?} {76.ne2} 112.70957947 0.47374001 0.75097001 {++} 0.00000000 0 0 0 {?} 190 3.364 0.000 0.000 0 2 {?} {?} 7.48424006 0.03108000 0.06840000 {++} 0.00000000 0 0 0 {?} {?} 112.20049286 0.47374001 0.75097001 {++} 0.00000000 0 0 0 {?} 191 4.674 4.674 0.000 0 2 {?} {99.hd22} 6.93591976 0.05858000 0.10695000 {++} 0.00000000 0 0 0 {?} {99.nd2} 112.32850647 0.29699001 0.56408000 {++} 0.00000000 0 0 0 {?} 192 4.312 4.312 0.000 0 2 {?} {117.hd21} 7.37131023 0.02215000 0.05031000 {++} 0.00000000 0 0 0 {?} {117.nd2} 112.07884979 0.37015000 0.66619998 {++} 0.00000000 0 0 0 {?} 193 7.136 7.136 0.000 0 2 {?} {117.hd22} 6.77057981 0.02512000 0.06810000 {+P} 0.00000000 0 0 0 {?} {117.nd2} 112.07717896 0.41433999 0.66509998 {++} 0.00000000 0 0 0 {?} 194 8.410 8.410 0.000 0 2 {?} {108.hd21} 7.45831013 0.03317000 0.06905000 {++} 0.00000000 0 0 0 {?} {108.nd2} 111.51927948 0.39146000 0.81639999 {+P} 0.00000000 0 0 0 {?} 195 8.757 8.757 0.000 0 2 {?} {79.he22} 6.90766001 0.05858000 0.10802000 {++} 0.00000000 0 0 0 {?} {79.ne2} 112.67841339 0.29699001 0.57021999 {++} 0.00000000 0 0 0 {?} ; loop_ _Spectral_dim.ID _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 2 N 15 NH . 6132.234 . . . 16767 1 stop_ save_