data_27040 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27040 _Entry.Title ; NMR resonance assignments of a hypoallergenic isoform of the major birch pollen allergen Bet v 1 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2017-03-03 _Entry.Accession_date 2017-03-03 _Entry.Last_release_date 2017-03-03 _Entry.Original_release_date 2017-03-03 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1 _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.ORCID _Entry_author.Entry_ID 1 Linda Ahammer . . . . 27040 2 Sarina Grutsch . . . . 27040 3 Michael Wallner . . . . 27040 4 Fatima Ferreira . . . . 27040 5 Martin Tollinger . . . . 27040 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 27040 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 620 27040 '15N chemical shifts' 152 27040 '1H chemical shifts' 985 27040 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 . . 2017-08-10 . original BMRB . 27040 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27040 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.3390/ijms18061192 _Citation.PubMed_ID 28587205 _Citation.Full_citation . _Citation.Title ; Conformational Flexibility Differentiates Naturally Occurring Bet v 1 Isoforms ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Int. J. Mol. Sci.' _Citation.Journal_name_full 'International journal of molecular sciences' _Citation.Journal_volume 18 _Citation.Journal_issue 6 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1422-0067 _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 E1192 _Citation.Page_last E1192 _Citation.Year 2017 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Sarina Grutsch S. . . . 27040 1 2 Julian Fuchs J. E. . . 27040 1 3 Linda Ahammer L. . . . 27040 1 4 Anna Kamenik A. S. . . 27040 1 5 Klaus Liedl K. R. . . 27040 1 6 Martin Tollinger M. . . . 27040 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'Bet v 1' 27040 1 allergen 27040 1 birch 27040 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27040 _Assembly.ID 1 _Assembly.Name 'Bet v 1.0102' _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 'Bet v 1.0102, subunit 1' 1 $Bet_v_1.0102 A . yes native no no . . . 27040 1 2 'Bet v 1.0102, subunit 2' 1 $Bet_v_1.0102 B . yes native no no . . . 27040 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Bet_v_1.0102 _Entity.Sf_category entity _Entity.Sf_framecode Bet_v_1.0102 _Entity.Entry_ID 27040 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Bet_v_1.0102 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GVFNYEIETTSVIPAARLFK AFILDGDNLVPKVAPQAISS VENIEGNGGPGTIKKINFPE GFPFKYVKDRVDEVDHTNFK YNYSVIEGGPVGDTLEKISN EIKIVATPDGGCVLKISNKY HTKGNHEVKAEQVKASKEMG ETLLRAVESYLLAHSDAYN ; _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 159 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 17417.69 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID . yes UNP P43177 . BETV1D . . . . . . . . . . . . . . 27040 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 27040 1 2 . VAL . 27040 1 3 . PHE . 27040 1 4 . ASN . 27040 1 5 . TYR . 27040 1 6 . GLU . 27040 1 7 . ILE . 27040 1 8 . GLU . 27040 1 9 . THR . 27040 1 10 . THR . 27040 1 11 . SER . 27040 1 12 . VAL . 27040 1 13 . ILE . 27040 1 14 . PRO . 27040 1 15 . ALA . 27040 1 16 . ALA . 27040 1 17 . ARG . 27040 1 18 . LEU . 27040 1 19 . PHE . 27040 1 20 . LYS . 27040 1 21 . ALA . 27040 1 22 . PHE . 27040 1 23 . ILE . 27040 1 24 . LEU . 27040 1 25 . ASP . 27040 1 26 . GLY . 27040 1 27 . ASP . 27040 1 28 . ASN . 27040 1 29 . LEU . 27040 1 30 . VAL . 27040 1 31 . PRO . 27040 1 32 . LYS . 27040 1 33 . VAL . 27040 1 34 . ALA . 27040 1 35 . PRO . 27040 1 36 . GLN . 27040 1 37 . ALA . 27040 1 38 . ILE . 27040 1 39 . SER . 27040 1 40 . SER . 27040 1 41 . VAL . 27040 1 42 . GLU . 27040 1 43 . ASN . 27040 1 44 . ILE . 27040 1 45 . GLU . 27040 1 46 . GLY . 27040 1 47 . ASN . 27040 1 48 . GLY . 27040 1 49 . GLY . 27040 1 50 . PRO . 27040 1 51 . GLY . 27040 1 52 . THR . 27040 1 53 . ILE . 27040 1 54 . LYS . 27040 1 55 . LYS . 27040 1 56 . ILE . 27040 1 57 . ASN . 27040 1 58 . PHE . 27040 1 59 . PRO . 27040 1 60 . GLU . 27040 1 61 . GLY . 27040 1 62 . PHE . 27040 1 63 . PRO . 27040 1 64 . PHE . 27040 1 65 . LYS . 27040 1 66 . TYR . 27040 1 67 . VAL . 27040 1 68 . LYS . 27040 1 69 . ASP . 27040 1 70 . ARG . 27040 1 71 . VAL . 27040 1 72 . ASP . 27040 1 73 . GLU . 27040 1 74 . VAL . 27040 1 75 . ASP . 27040 1 76 . HIS . 27040 1 77 . THR . 27040 1 78 . ASN . 27040 1 79 . PHE . 27040 1 80 . LYS . 27040 1 81 . TYR . 27040 1 82 . ASN . 27040 1 83 . TYR . 27040 1 84 . SER . 27040 1 85 . VAL . 27040 1 86 . ILE . 27040 1 87 . GLU . 27040 1 88 . GLY . 27040 1 89 . GLY . 27040 1 90 . PRO . 27040 1 91 . VAL . 27040 1 92 . GLY . 27040 1 93 . ASP . 27040 1 94 . THR . 27040 1 95 . LEU . 27040 1 96 . GLU . 27040 1 97 . LYS . 27040 1 98 . ILE . 27040 1 99 . SER . 27040 1 100 . ASN . 27040 1 101 . GLU . 27040 1 102 . ILE . 27040 1 103 . LYS . 27040 1 104 . ILE . 27040 1 105 . VAL . 27040 1 106 . ALA . 27040 1 107 . THR . 27040 1 108 . PRO . 27040 1 109 . ASP . 27040 1 110 . GLY . 27040 1 111 . GLY . 27040 1 112 . CYS . 27040 1 113 . VAL . 27040 1 114 . LEU . 27040 1 115 . LYS . 27040 1 116 . ILE . 27040 1 117 . SER . 27040 1 118 . ASN . 27040 1 119 . LYS . 27040 1 120 . TYR . 27040 1 121 . HIS . 27040 1 122 . THR . 27040 1 123 . LYS . 27040 1 124 . GLY . 27040 1 125 . ASN . 27040 1 126 . HIS . 27040 1 127 . GLU . 27040 1 128 . VAL . 27040 1 129 . LYS . 27040 1 130 . ALA . 27040 1 131 . GLU . 27040 1 132 . GLN . 27040 1 133 . VAL . 27040 1 134 . LYS . 27040 1 135 . ALA . 27040 1 136 . SER . 27040 1 137 . LYS . 27040 1 138 . GLU . 27040 1 139 . MET . 27040 1 140 . GLY . 27040 1 141 . GLU . 27040 1 142 . THR . 27040 1 143 . LEU . 27040 1 144 . LEU . 27040 1 145 . ARG . 27040 1 146 . ALA . 27040 1 147 . VAL . 27040 1 148 . GLU . 27040 1 149 . SER . 27040 1 150 . TYR . 27040 1 151 . LEU . 27040 1 152 . LEU . 27040 1 153 . ALA . 27040 1 154 . HIS . 27040 1 155 . SER . 27040 1 156 . ASP . 27040 1 157 . ALA . 27040 1 158 . TYR . 27040 1 159 . ASN . 27040 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 27040 1 . VAL 2 2 27040 1 . PHE 3 3 27040 1 . ASN 4 4 27040 1 . TYR 5 5 27040 1 . GLU 6 6 27040 1 . ILE 7 7 27040 1 . GLU 8 8 27040 1 . THR 9 9 27040 1 . THR 10 10 27040 1 . SER 11 11 27040 1 . VAL 12 12 27040 1 . ILE 13 13 27040 1 . PRO 14 14 27040 1 . ALA 15 15 27040 1 . ALA 16 16 27040 1 . ARG 17 17 27040 1 . LEU 18 18 27040 1 . PHE 19 19 27040 1 . LYS 20 20 27040 1 . ALA 21 21 27040 1 . PHE 22 22 27040 1 . ILE 23 23 27040 1 . LEU 24 24 27040 1 . ASP 25 25 27040 1 . GLY 26 26 27040 1 . ASP 27 27 27040 1 . ASN 28 28 27040 1 . LEU 29 29 27040 1 . VAL 30 30 27040 1 . PRO 31 31 27040 1 . LYS 32 32 27040 1 . VAL 33 33 27040 1 . ALA 34 34 27040 1 . PRO 35 35 27040 1 . GLN 36 36 27040 1 . ALA 37 37 27040 1 . ILE 38 38 27040 1 . SER 39 39 27040 1 . SER 40 40 27040 1 . VAL 41 41 27040 1 . GLU 42 42 27040 1 . ASN 43 43 27040 1 . ILE 44 44 27040 1 . GLU 45 45 27040 1 . GLY 46 46 27040 1 . ASN 47 47 27040 1 . GLY 48 48 27040 1 . GLY 49 49 27040 1 . PRO 50 50 27040 1 . GLY 51 51 27040 1 . THR 52 52 27040 1 . ILE 53 53 27040 1 . LYS 54 54 27040 1 . LYS 55 55 27040 1 . ILE 56 56 27040 1 . ASN 57 57 27040 1 . PHE 58 58 27040 1 . PRO 59 59 27040 1 . GLU 60 60 27040 1 . GLY 61 61 27040 1 . PHE 62 62 27040 1 . PRO 63 63 27040 1 . PHE 64 64 27040 1 . LYS 65 65 27040 1 . TYR 66 66 27040 1 . VAL 67 67 27040 1 . LYS 68 68 27040 1 . ASP 69 69 27040 1 . ARG 70 70 27040 1 . VAL 71 71 27040 1 . ASP 72 72 27040 1 . GLU 73 73 27040 1 . VAL 74 74 27040 1 . ASP 75 75 27040 1 . HIS 76 76 27040 1 . THR 77 77 27040 1 . ASN 78 78 27040 1 . PHE 79 79 27040 1 . LYS 80 80 27040 1 . TYR 81 81 27040 1 . ASN 82 82 27040 1 . TYR 83 83 27040 1 . SER 84 84 27040 1 . VAL 85 85 27040 1 . ILE 86 86 27040 1 . GLU 87 87 27040 1 . GLY 88 88 27040 1 . GLY 89 89 27040 1 . PRO 90 90 27040 1 . VAL 91 91 27040 1 . GLY 92 92 27040 1 . ASP 93 93 27040 1 . THR 94 94 27040 1 . LEU 95 95 27040 1 . GLU 96 96 27040 1 . LYS 97 97 27040 1 . ILE 98 98 27040 1 . SER 99 99 27040 1 . ASN 100 100 27040 1 . GLU 101 101 27040 1 . ILE 102 102 27040 1 . LYS 103 103 27040 1 . ILE 104 104 27040 1 . VAL 105 105 27040 1 . ALA 106 106 27040 1 . THR 107 107 27040 1 . PRO 108 108 27040 1 . ASP 109 109 27040 1 . GLY 110 110 27040 1 . GLY 111 111 27040 1 . CYS 112 112 27040 1 . VAL 113 113 27040 1 . LEU 114 114 27040 1 . LYS 115 115 27040 1 . ILE 116 116 27040 1 . SER 117 117 27040 1 . ASN 118 118 27040 1 . LYS 119 119 27040 1 . TYR 120 120 27040 1 . HIS 121 121 27040 1 . THR 122 122 27040 1 . LYS 123 123 27040 1 . GLY 124 124 27040 1 . ASN 125 125 27040 1 . HIS 126 126 27040 1 . GLU 127 127 27040 1 . VAL 128 128 27040 1 . LYS 129 129 27040 1 . ALA 130 130 27040 1 . GLU 131 131 27040 1 . GLN 132 132 27040 1 . VAL 133 133 27040 1 . LYS 134 134 27040 1 . ALA 135 135 27040 1 . SER 136 136 27040 1 . LYS 137 137 27040 1 . GLU 138 138 27040 1 . MET 139 139 27040 1 . GLY 140 140 27040 1 . GLU 141 141 27040 1 . THR 142 142 27040 1 . LEU 143 143 27040 1 . LEU 144 144 27040 1 . ARG 145 145 27040 1 . ALA 146 146 27040 1 . VAL 147 147 27040 1 . GLU 148 148 27040 1 . SER 149 149 27040 1 . TYR 150 150 27040 1 . LEU 151 151 27040 1 . LEU 152 152 27040 1 . ALA 153 153 27040 1 . HIS 154 154 27040 1 . SER 155 155 27040 1 . ASP 156 156 27040 1 . ALA 157 157 27040 1 . TYR 158 158 27040 1 . ASN 159 159 27040 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 27040 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Bet_v_1.0102 . 3505 organism . 'Betula verrucosa' 'European white birch' . . Eukaryota Viridiplantae Betula verrucosa . . . . . . . . . . . . . 27040 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 27040 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Bet_v_1.0102 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 Star (DE3)' . . . . . pET28b . . . 27040 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27040 _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 'Bet v 1.0102' '[U-99% 13C; U-99% 15N]' . . 1 $Bet_v_1.0102 . . 0.8 . . mM . . . . 27040 1 2 'sodium phosphate' 'natural abundance' . . . . . . 10 . . mM . . . . 27040 1 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 27040 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 27040 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.0 . pH 27040 1 pressure 1 . atm 27040 1 temperature 298 . K 27040 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 27040 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 27040 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 27040 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 27040 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model DD2 _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 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 27040 _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 Varian DD2 . 500 . . . 27040 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 27040 _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 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27040 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27040 1 3 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27040 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27040 1 5 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27040 1 6 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27040 1 7 '3D (H)CC(CO)NH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27040 1 8 '3D H(CCCO)NH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27040 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 27040 _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 27040 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 27040 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 27040 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 27040 _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' . . . 27040 1 2 '2D 1H-13C HSQC' . . . 27040 1 3 '3D HNCO' . . . 27040 1 4 '3D HNCACB' . . . 27040 1 5 '3D CBCA(CO)NH' . . . 27040 1 6 '3D HCCH-TOCSY' . . . 27040 1 7 '3D (H)CC(CO)NH-TOCSY' . . . 27040 1 8 '3D H(CCCO)NH-TOCSY' . . . 27040 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 GLY HA2 H 1 3.844 0.05 . 1 . . . . 1 GLY HA2 . 27040 1 2 . 1 1 1 1 GLY HA3 H 1 3.844 0.05 . 1 . . . . 1 GLY HA3 . 27040 1 3 . 1 1 1 1 GLY C C 13 169.210 0.1 . 1 . . . . 1 GLY C . 27040 1 4 . 1 1 1 1 GLY CA C 13 43.425 0.15 . 1 . . . . 1 GLY CA . 27040 1 5 . 1 1 2 2 VAL H H 1 8.168 0.01 . 1 . . . . 2 VAL H . 27040 1 6 . 1 1 2 2 VAL HA H 1 4.811 0.05 . 1 . . . . 2 VAL HA . 27040 1 7 . 1 1 2 2 VAL HB H 1 1.706 0.05 . 1 . . . . 2 VAL HB . 27040 1 8 . 1 1 2 2 VAL HG11 H 1 0.510 0.05 . 1 . . . . 2 VAL MG1 . 27040 1 9 . 1 1 2 2 VAL HG12 H 1 0.510 0.05 . 1 . . . . 2 VAL MG1 . 27040 1 10 . 1 1 2 2 VAL HG13 H 1 0.510 0.05 . 1 . . . . 2 VAL MG1 . 27040 1 11 . 1 1 2 2 VAL HG21 H 1 0.510 0.05 . 1 . . . . 2 VAL MG2 . 27040 1 12 . 1 1 2 2 VAL HG22 H 1 0.510 0.05 . 1 . . . . 2 VAL MG2 . 27040 1 13 . 1 1 2 2 VAL HG23 H 1 0.510 0.05 . 1 . . . . 2 VAL MG2 . 27040 1 14 . 1 1 2 2 VAL C C 13 174.650 0.1 . 1 . . . . 2 VAL C . 27040 1 15 . 1 1 2 2 VAL CA C 13 61.306 0.15 . 1 . . . . 2 VAL CA . 27040 1 16 . 1 1 2 2 VAL CB C 13 33.740 0.15 . 1 . . . . 2 VAL CB . 27040 1 17 . 1 1 2 2 VAL CG1 C 13 21.052 0.2 . 1 . . . . 2 VAL CG1 . 27040 1 18 . 1 1 2 2 VAL CG2 C 13 21.052 0.2 . 1 . . . . 2 VAL CG2 . 27040 1 19 . 1 1 2 2 VAL N N 15 120.464 0.05 . 1 . . . . 2 VAL N . 27040 1 20 . 1 1 3 3 PHE H H 1 8.769 0.01 . 1 . . . . 3 PHE H . 27040 1 21 . 1 1 3 3 PHE HA H 1 4.786 0.05 . 1 . . . . 3 PHE HA . 27040 1 22 . 1 1 3 3 PHE HB2 H 1 3.049 0.05 . 1 . . . . 3 PHE HB2 . 27040 1 23 . 1 1 3 3 PHE HB3 H 1 3.049 0.05 . 1 . . . . 3 PHE HB3 . 27040 1 24 . 1 1 3 3 PHE C C 13 173.743 0.1 . 1 . . . . 3 PHE C . 27040 1 25 . 1 1 3 3 PHE CA C 13 56.876 0.15 . 1 . . . . 3 PHE CA . 27040 1 26 . 1 1 3 3 PHE CB C 13 42.311 0.15 . 1 . . . . 3 PHE CB . 27040 1 27 . 1 1 3 3 PHE N N 15 126.833 0.05 . 1 . . . . 3 PHE N . 27040 1 28 . 1 1 4 4 ASN H H 1 8.699 0.01 . 1 . . . . 4 ASN H . 27040 1 29 . 1 1 4 4 ASN HA H 1 5.410 0.05 . 1 . . . . 4 ASN HA . 27040 1 30 . 1 1 4 4 ASN HB2 H 1 2.480 0.05 . 2 . . . . 4 ASN HB2 . 27040 1 31 . 1 1 4 4 ASN HB3 H 1 2.694 0.05 . 2 . . . . 4 ASN HB3 . 27040 1 32 . 1 1 4 4 ASN HD21 H 1 7.329 0.05 . 1 . . . . 4 ASN HD21 . 27040 1 33 . 1 1 4 4 ASN HD22 H 1 6.712 0.05 . 1 . . . . 4 ASN HD22 . 27040 1 34 . 1 1 4 4 ASN C C 13 173.679 0.1 . 1 . . . . 4 ASN C . 27040 1 35 . 1 1 4 4 ASN CA C 13 52.610 0.15 . 1 . . . . 4 ASN CA . 27040 1 36 . 1 1 4 4 ASN CB C 13 41.397 0.15 . 1 . . . . 4 ASN CB . 27040 1 37 . 1 1 4 4 ASN CG C 13 175.339 0.2 . 1 . . . . 4 ASN CG . 27040 1 38 . 1 1 4 4 ASN N N 15 123.946 0.05 . 1 . . . . 4 ASN N . 27040 1 39 . 1 1 4 4 ASN ND2 N 15 111.464 0.05 . 1 . . . . 4 ASN ND2 . 27040 1 40 . 1 1 5 5 TYR H H 1 9.016 0.01 . 1 . . . . 5 TYR H . 27040 1 41 . 1 1 5 5 TYR HA H 1 4.675 0.05 . 1 . . . . 5 TYR HA . 27040 1 42 . 1 1 5 5 TYR HB2 H 1 3.143 0.05 . 1 . . . . 5 TYR HB2 . 27040 1 43 . 1 1 5 5 TYR HB3 H 1 3.143 0.05 . 1 . . . . 5 TYR HB3 . 27040 1 44 . 1 1 5 5 TYR C C 13 174.183 0.1 . 1 . . . . 5 TYR C . 27040 1 45 . 1 1 5 5 TYR CA C 13 58.003 0.15 . 1 . . . . 5 TYR CA . 27040 1 46 . 1 1 5 5 TYR CB C 13 41.213 0.15 . 1 . . . . 5 TYR CB . 27040 1 47 . 1 1 5 5 TYR N N 15 125.484 0.05 . 1 . . . . 5 TYR N . 27040 1 48 . 1 1 6 6 GLU H H 1 8.427 0.01 . 1 . . . . 6 GLU H . 27040 1 49 . 1 1 6 6 GLU HA H 1 5.377 0.05 . 1 . . . . 6 GLU HA . 27040 1 50 . 1 1 6 6 GLU HB2 H 1 1.931 0.05 . 1 . . . . 6 GLU HB2 . 27040 1 51 . 1 1 6 6 GLU HB3 H 1 1.931 0.05 . 1 . . . . 6 GLU HB3 . 27040 1 52 . 1 1 6 6 GLU HG2 H 1 2.153 0.05 . 1 . . . . 6 GLU HG2 . 27040 1 53 . 1 1 6 6 GLU HG3 H 1 2.153 0.05 . 1 . . . . 6 GLU HG3 . 27040 1 54 . 1 1 6 6 GLU C C 13 175.779 0.1 . 1 . . . . 6 GLU C . 27040 1 55 . 1 1 6 6 GLU CA C 13 55.181 0.15 . 1 . . . . 6 GLU CA . 27040 1 56 . 1 1 6 6 GLU CB C 13 32.621 0.15 . 1 . . . . 6 GLU CB . 27040 1 57 . 1 1 6 6 GLU CG C 13 36.756 0.2 . 1 . . . . 6 GLU CG . 27040 1 58 . 1 1 6 6 GLU N N 15 122.930 0.05 . 1 . . . . 6 GLU N . 27040 1 59 . 1 1 7 7 ILE H H 1 9.168 0.01 . 1 . . . . 7 ILE H . 27040 1 60 . 1 1 7 7 ILE HA H 1 4.548 0.05 . 1 . . . . 7 ILE HA . 27040 1 61 . 1 1 7 7 ILE HB H 1 1.719 0.05 . 1 . . . . 7 ILE HB . 27040 1 62 . 1 1 7 7 ILE HG12 H 1 1.154 0.05 . 2 . . . . 7 ILE HG12 . 27040 1 63 . 1 1 7 7 ILE HG13 H 1 1.499 0.05 . 2 . . . . 7 ILE HG13 . 27040 1 64 . 1 1 7 7 ILE HG21 H 1 0.934 0.05 . 1 . . . . 7 ILE MG . 27040 1 65 . 1 1 7 7 ILE HG22 H 1 0.934 0.05 . 1 . . . . 7 ILE MG . 27040 1 66 . 1 1 7 7 ILE HG23 H 1 0.934 0.05 . 1 . . . . 7 ILE MG . 27040 1 67 . 1 1 7 7 ILE HD11 H 1 0.962 0.05 . 1 . . . . 7 ILE MD . 27040 1 68 . 1 1 7 7 ILE HD12 H 1 0.962 0.05 . 1 . . . . 7 ILE MD . 27040 1 69 . 1 1 7 7 ILE HD13 H 1 0.962 0.05 . 1 . . . . 7 ILE MD . 27040 1 70 . 1 1 7 7 ILE C C 13 174.153 0.1 . 1 . . . . 7 ILE C . 27040 1 71 . 1 1 7 7 ILE CA C 13 60.184 0.15 . 1 . . . . 7 ILE CA . 27040 1 72 . 1 1 7 7 ILE CB C 13 42.852 0.15 . 1 . . . . 7 ILE CB . 27040 1 73 . 1 1 7 7 ILE CG1 C 13 28.322 0.2 . 1 . . . . 7 ILE CG1 . 27040 1 74 . 1 1 7 7 ILE CG2 C 13 18.546 0.2 . 1 . . . . 7 ILE CG2 . 27040 1 75 . 1 1 7 7 ILE CD1 C 13 14.738 0.2 . 1 . . . . 7 ILE CD1 . 27040 1 76 . 1 1 7 7 ILE N N 15 123.124 0.05 . 1 . . . . 7 ILE N . 27040 1 77 . 1 1 8 8 GLU H H 1 8.455 0.01 . 1 . . . . 8 GLU H . 27040 1 78 . 1 1 8 8 GLU HA H 1 5.639 0.05 . 1 . . . . 8 GLU HA . 27040 1 79 . 1 1 8 8 GLU HB2 H 1 2.152 0.05 . 1 . . . . 8 GLU HB2 . 27040 1 80 . 1 1 8 8 GLU HB3 H 1 2.152 0.05 . 1 . . . . 8 GLU HB3 . 27040 1 81 . 1 1 8 8 GLU HG2 H 1 2.243 0.05 . 1 . . . . 8 GLU HG2 . 27040 1 82 . 1 1 8 8 GLU HG3 H 1 2.243 0.05 . 1 . . . . 8 GLU HG3 . 27040 1 83 . 1 1 8 8 GLU C C 13 175.692 0.1 . 1 . . . . 8 GLU C . 27040 1 84 . 1 1 8 8 GLU CA C 13 55.003 0.15 . 1 . . . . 8 GLU CA . 27040 1 85 . 1 1 8 8 GLU CB C 13 33.234 0.15 . 1 . . . . 8 GLU CB . 27040 1 86 . 1 1 8 8 GLU CG C 13 36.989 0.2 . 1 . . . . 8 GLU CG . 27040 1 87 . 1 1 8 8 GLU N N 15 124.545 0.05 . 1 . . . . 8 GLU N . 27040 1 88 . 1 1 9 9 THR H H 1 8.709 0.01 . 1 . . . . 9 THR H . 27040 1 89 . 1 1 9 9 THR HA H 1 4.872 0.05 . 1 . . . . 9 THR HA . 27040 1 90 . 1 1 9 9 THR HB H 1 4.000 0.05 . 1 . . . . 9 THR HB . 27040 1 91 . 1 1 9 9 THR HG21 H 1 1.154 0.05 . 1 . . . . 9 THR MG . 27040 1 92 . 1 1 9 9 THR HG22 H 1 1.154 0.05 . 1 . . . . 9 THR MG . 27040 1 93 . 1 1 9 9 THR HG23 H 1 1.154 0.05 . 1 . . . . 9 THR MG . 27040 1 94 . 1 1 9 9 THR C C 13 172.373 0.1 . 1 . . . . 9 THR C . 27040 1 95 . 1 1 9 9 THR CA C 13 60.178 0.15 . 1 . . . . 9 THR CA . 27040 1 96 . 1 1 9 9 THR CB C 13 70.256 0.15 . 1 . . . . 9 THR CB . 27040 1 97 . 1 1 9 9 THR CG2 C 13 21.538 0.2 . 1 . . . . 9 THR CG2 . 27040 1 98 . 1 1 9 9 THR N N 15 119.312 0.05 . 1 . . . . 9 THR N . 27040 1 99 . 1 1 10 10 THR H H 1 8.382 0.01 . 1 . . . . 10 THR H . 27040 1 100 . 1 1 10 10 THR HA H 1 5.102 0.05 . 1 . . . . 10 THR HA . 27040 1 101 . 1 1 10 10 THR HB H 1 4.343 0.05 . 1 . . . . 10 THR HB . 27040 1 102 . 1 1 10 10 THR HG21 H 1 1.265 0.05 . 1 . . . . 10 THR MG . 27040 1 103 . 1 1 10 10 THR HG22 H 1 1.265 0.05 . 1 . . . . 10 THR MG . 27040 1 104 . 1 1 10 10 THR HG23 H 1 1.265 0.05 . 1 . . . . 10 THR MG . 27040 1 105 . 1 1 10 10 THR C C 13 173.709 0.1 . 1 . . . . 10 THR C . 27040 1 106 . 1 1 10 10 THR CA C 13 60.864 0.15 . 1 . . . . 10 THR CA . 27040 1 107 . 1 1 10 10 THR CB C 13 71.663 0.15 . 1 . . . . 10 THR CB . 27040 1 108 . 1 1 10 10 THR CG2 C 13 21.990 0.2 . 1 . . . . 10 THR CG2 . 27040 1 109 . 1 1 10 10 THR N N 15 115.609 0.05 . 1 . . . . 10 THR N . 27040 1 110 . 1 1 11 11 SER H H 1 8.795 0.01 . 1 . . . . 11 SER H . 27040 1 111 . 1 1 11 11 SER HA H 1 5.020 0.05 . 1 . . . . 11 SER HA . 27040 1 112 . 1 1 11 11 SER HB2 H 1 3.463 0.05 . 2 . . . . 11 SER HB2 . 27040 1 113 . 1 1 11 11 SER HB3 H 1 3.719 0.05 . 2 . . . . 11 SER HB3 . 27040 1 114 . 1 1 11 11 SER C C 13 174.606 0.1 . 1 . . . . 11 SER C . 27040 1 115 . 1 1 11 11 SER CA C 13 56.142 0.15 . 1 . . . . 11 SER CA . 27040 1 116 . 1 1 11 11 SER CB C 13 65.570 0.15 . 1 . . . . 11 SER CB . 27040 1 117 . 1 1 11 11 SER N N 15 113.681 0.05 . 1 . . . . 11 SER N . 27040 1 118 . 1 1 12 12 VAL H H 1 7.613 0.01 . 1 . . . . 12 VAL H . 27040 1 119 . 1 1 12 12 VAL HA H 1 4.378 0.05 . 1 . . . . 12 VAL HA . 27040 1 120 . 1 1 12 12 VAL HB H 1 2.451 0.05 . 1 . . . . 12 VAL HB . 27040 1 121 . 1 1 12 12 VAL HG11 H 1 0.958 0.05 . 2 . . . . 12 VAL MG1 . 27040 1 122 . 1 1 12 12 VAL HG12 H 1 0.958 0.05 . 2 . . . . 12 VAL MG1 . 27040 1 123 . 1 1 12 12 VAL HG13 H 1 0.958 0.05 . 2 . . . . 12 VAL MG1 . 27040 1 124 . 1 1 12 12 VAL HG21 H 1 1.012 0.05 . 2 . . . . 12 VAL MG2 . 27040 1 125 . 1 1 12 12 VAL HG22 H 1 1.012 0.05 . 2 . . . . 12 VAL MG2 . 27040 1 126 . 1 1 12 12 VAL HG23 H 1 1.012 0.05 . 2 . . . . 12 VAL MG2 . 27040 1 127 . 1 1 12 12 VAL C C 13 175.986 0.1 . 1 . . . . 12 VAL C . 27040 1 128 . 1 1 12 12 VAL CA C 13 61.879 0.15 . 1 . . . . 12 VAL CA . 27040 1 129 . 1 1 12 12 VAL CB C 13 31.734 0.15 . 1 . . . . 12 VAL CB . 27040 1 130 . 1 1 12 12 VAL CG1 C 13 18.531 0.2 . 2 . . . . 12 VAL CG1 . 27040 1 131 . 1 1 12 12 VAL CG2 C 13 21.352 0.2 . 2 . . . . 12 VAL CG2 . 27040 1 132 . 1 1 12 12 VAL N N 15 118.543 0.05 . 1 . . . . 12 VAL N . 27040 1 133 . 1 1 13 13 ILE H H 1 8.419 0.01 . 1 . . . . 13 ILE H . 27040 1 134 . 1 1 13 13 ILE HA H 1 4.350 0.05 . 1 . . . . 13 ILE HA . 27040 1 135 . 1 1 13 13 ILE HB H 1 2.071 0.05 . 1 . . . . 13 ILE HB . 27040 1 136 . 1 1 13 13 ILE HD11 H 1 0.869 0.05 . 1 . . . . 13 ILE MD . 27040 1 137 . 1 1 13 13 ILE HD12 H 1 0.869 0.05 . 1 . . . . 13 ILE MD . 27040 1 138 . 1 1 13 13 ILE HD13 H 1 0.869 0.05 . 1 . . . . 13 ILE MD . 27040 1 139 . 1 1 13 13 ILE CA C 13 55.251 0.15 . 1 . . . . 13 ILE CA . 27040 1 140 . 1 1 13 13 ILE CB C 13 36.697 0.15 . 1 . . . . 13 ILE CB . 27040 1 141 . 1 1 13 13 ILE CD1 C 13 12.843 0.2 . 1 . . . . 13 ILE CD1 . 27040 1 142 . 1 1 13 13 ILE N N 15 125.550 0.05 . 1 . . . . 13 ILE N . 27040 1 143 . 1 1 14 14 PRO HA H 1 4.545 0.05 . 1 . . . . 14 PRO HA . 27040 1 144 . 1 1 14 14 PRO HB2 H 1 1.855 0.05 . 2 . . . . 14 PRO HB2 . 27040 1 145 . 1 1 14 14 PRO HB3 H 1 2.508 0.05 . 2 . . . . 14 PRO HB3 . 27040 1 146 . 1 1 14 14 PRO HG2 H 1 2.178 0.05 . 1 . . . . 14 PRO HG2 . 27040 1 147 . 1 1 14 14 PRO HG3 H 1 2.178 0.05 . 1 . . . . 14 PRO HG3 . 27040 1 148 . 1 1 14 14 PRO HD2 H 1 4.014 0.05 . 2 . . . . 14 PRO HD2 . 27040 1 149 . 1 1 14 14 PRO HD3 H 1 3.679 0.05 . 2 . . . . 14 PRO HD3 . 27040 1 150 . 1 1 14 14 PRO C C 13 177.413 0.1 . 1 . . . . 14 PRO C . 27040 1 151 . 1 1 14 14 PRO CA C 13 63.117 0.15 . 1 . . . . 14 PRO CA . 27040 1 152 . 1 1 14 14 PRO CB C 13 32.717 0.15 . 1 . . . . 14 PRO CB . 27040 1 153 . 1 1 14 14 PRO CG C 13 28.068 0.2 . 1 . . . . 14 PRO CG . 27040 1 154 . 1 1 14 14 PRO CD C 13 51.389 0.2 . 1 . . . . 14 PRO CD . 27040 1 155 . 1 1 15 15 ALA H H 1 8.581 0.01 . 1 . . . . 15 ALA H . 27040 1 156 . 1 1 15 15 ALA HA H 1 3.896 0.05 . 1 . . . . 15 ALA HA . 27040 1 157 . 1 1 15 15 ALA HB1 H 1 1.160 0.05 . 1 . . . . 15 ALA MB . 27040 1 158 . 1 1 15 15 ALA HB2 H 1 1.160 0.05 . 1 . . . . 15 ALA MB . 27040 1 159 . 1 1 15 15 ALA HB3 H 1 1.160 0.05 . 1 . . . . 15 ALA MB . 27040 1 160 . 1 1 15 15 ALA C C 13 178.203 0.1 . 1 . . . . 15 ALA C . 27040 1 161 . 1 1 15 15 ALA CA C 13 55.510 0.15 . 1 . . . . 15 ALA CA . 27040 1 162 . 1 1 15 15 ALA CB C 13 19.630 0.15 . 1 . . . . 15 ALA CB . 27040 1 163 . 1 1 15 15 ALA N N 15 124.543 0.05 . 1 . . . . 15 ALA N . 27040 1 164 . 1 1 16 16 ALA H H 1 8.474 0.01 . 1 . . . . 16 ALA H . 27040 1 165 . 1 1 16 16 ALA HA H 1 4.268 0.05 . 1 . . . . 16 ALA HA . 27040 1 166 . 1 1 16 16 ALA HB1 H 1 1.493 0.05 . 1 . . . . 16 ALA MB . 27040 1 167 . 1 1 16 16 ALA HB2 H 1 1.493 0.05 . 1 . . . . 16 ALA MB . 27040 1 168 . 1 1 16 16 ALA HB3 H 1 1.493 0.05 . 1 . . . . 16 ALA MB . 27040 1 169 . 1 1 16 16 ALA C C 13 179.983 0.1 . 1 . . . . 16 ALA C . 27040 1 170 . 1 1 16 16 ALA CA C 13 55.197 0.15 . 1 . . . . 16 ALA CA . 27040 1 171 . 1 1 16 16 ALA CB C 13 18.779 0.15 . 1 . . . . 16 ALA CB . 27040 1 172 . 1 1 16 16 ALA N N 15 115.946 0.05 . 1 . . . . 16 ALA N . 27040 1 173 . 1 1 17 17 ARG H H 1 6.717 0.01 . 1 . . . . 17 ARG H . 27040 1 174 . 1 1 17 17 ARG HA H 1 4.128 0.05 . 1 . . . . 17 ARG HA . 27040 1 175 . 1 1 17 17 ARG HB2 H 1 2.044 0.05 . 1 . . . . 17 ARG HB2 . 27040 1 176 . 1 1 17 17 ARG HB3 H 1 2.044 0.05 . 1 . . . . 17 ARG HB3 . 27040 1 177 . 1 1 17 17 ARG HG2 H 1 2.094 0.05 . 1 . . . . 17 ARG HG2 . 27040 1 178 . 1 1 17 17 ARG HG3 H 1 2.094 0.05 . 1 . . . . 17 ARG HG3 . 27040 1 179 . 1 1 17 17 ARG HD2 H 1 3.273 0.05 . 1 . . . . 17 ARG HD2 . 27040 1 180 . 1 1 17 17 ARG HD3 H 1 3.273 0.05 . 1 . . . . 17 ARG HD3 . 27040 1 181 . 1 1 17 17 ARG C C 13 177.251 0.1 . 1 . . . . 17 ARG C . 27040 1 182 . 1 1 17 17 ARG CA C 13 58.914 0.15 . 1 . . . . 17 ARG CA . 27040 1 183 . 1 1 17 17 ARG CB C 13 30.507 0.15 . 1 . . . . 17 ARG CB . 27040 1 184 . 1 1 17 17 ARG CG C 13 28.489 0.2 . 1 . . . . 17 ARG CG . 27040 1 185 . 1 1 17 17 ARG CD C 13 44.450 0.2 . 1 . . . . 17 ARG CD . 27040 1 186 . 1 1 17 17 ARG N N 15 117.311 0.05 . 1 . . . . 17 ARG N . 27040 1 187 . 1 1 18 18 LEU H H 1 8.258 0.01 . 1 . . . . 18 LEU H . 27040 1 188 . 1 1 18 18 LEU HA H 1 3.794 0.05 . 1 . . . . 18 LEU HA . 27040 1 189 . 1 1 18 18 LEU HB2 H 1 1.151 0.05 . 2 . . . . 18 LEU HB2 . 27040 1 190 . 1 1 18 18 LEU HB3 H 1 1.795 0.05 . 2 . . . . 18 LEU HB3 . 27040 1 191 . 1 1 18 18 LEU HG H 1 0.860 0.05 . 1 . . . . 18 LEU HG . 27040 1 192 . 1 1 18 18 LEU HD11 H 1 0.787 0.05 . 2 . . . . 18 LEU MD1 . 27040 1 193 . 1 1 18 18 LEU HD12 H 1 0.787 0.05 . 2 . . . . 18 LEU MD1 . 27040 1 194 . 1 1 18 18 LEU HD13 H 1 0.787 0.05 . 2 . . . . 18 LEU MD1 . 27040 1 195 . 1 1 18 18 LEU HD21 H 1 0.622 0.05 . 2 . . . . 18 LEU MD2 . 27040 1 196 . 1 1 18 18 LEU HD22 H 1 0.622 0.05 . 2 . . . . 18 LEU MD2 . 27040 1 197 . 1 1 18 18 LEU HD23 H 1 0.622 0.05 . 2 . . . . 18 LEU MD2 . 27040 1 198 . 1 1 18 18 LEU C C 13 178.768 0.1 . 1 . . . . 18 LEU C . 27040 1 199 . 1 1 18 18 LEU CA C 13 57.689 0.15 . 1 . . . . 18 LEU CA . 27040 1 200 . 1 1 18 18 LEU CB C 13 41.565 0.15 . 1 . . . . 18 LEU CB . 27040 1 201 . 1 1 18 18 LEU CG C 13 27.389 0.2 . 1 . . . . 18 LEU CG . 27040 1 202 . 1 1 18 18 LEU CD1 C 13 22.609 0.2 . 1 . . . . 18 LEU CD1 . 27040 1 203 . 1 1 18 18 LEU CD2 C 13 22.609 0.2 . 1 . . . . 18 LEU CD2 . 27040 1 204 . 1 1 18 18 LEU N N 15 118.598 0.05 . 1 . . . . 18 LEU N . 27040 1 205 . 1 1 19 19 PHE H H 1 8.750 0.01 . 1 . . . . 19 PHE H . 27040 1 206 . 1 1 19 19 PHE HA H 1 3.792 0.05 . 1 . . . . 19 PHE HA . 27040 1 207 . 1 1 19 19 PHE HB2 H 1 2.803 0.05 . 1 . . . . 19 PHE HB2 . 27040 1 208 . 1 1 19 19 PHE HB3 H 1 2.803 0.05 . 1 . . . . 19 PHE HB3 . 27040 1 209 . 1 1 19 19 PHE C C 13 177.433 0.1 . 1 . . . . 19 PHE C . 27040 1 210 . 1 1 19 19 PHE CA C 13 62.633 0.15 . 1 . . . . 19 PHE CA . 27040 1 211 . 1 1 19 19 PHE CB C 13 39.721 0.15 . 1 . . . . 19 PHE CB . 27040 1 212 . 1 1 19 19 PHE N N 15 118.119 0.05 . 1 . . . . 19 PHE N . 27040 1 213 . 1 1 20 20 LYS H H 1 7.758 0.01 . 1 . . . . 20 LYS H . 27040 1 214 . 1 1 20 20 LYS HA H 1 3.739 0.05 . 1 . . . . 20 LYS HA . 27040 1 215 . 1 1 20 20 LYS HB2 H 1 2.130 0.05 . 1 . . . . 20 LYS HB2 . 27040 1 216 . 1 1 20 20 LYS HB3 H 1 2.130 0.05 . 1 . . . . 20 LYS HB3 . 27040 1 217 . 1 1 20 20 LYS HG2 H 1 1.635 0.05 . 1 . . . . 20 LYS HG2 . 27040 1 218 . 1 1 20 20 LYS HG3 H 1 1.635 0.05 . 1 . . . . 20 LYS HG3 . 27040 1 219 . 1 1 20 20 LYS HD2 H 1 1.856 0.05 . 1 . . . . 20 LYS HD2 . 27040 1 220 . 1 1 20 20 LYS HD3 H 1 1.856 0.05 . 1 . . . . 20 LYS HD3 . 27040 1 221 . 1 1 20 20 LYS HE2 H 1 3.087 0.05 . 1 . . . . 20 LYS HE2 . 27040 1 222 . 1 1 20 20 LYS HE3 H 1 3.087 0.05 . 1 . . . . 20 LYS HE3 . 27040 1 223 . 1 1 20 20 LYS C C 13 176.880 0.1 . 1 . . . . 20 LYS C . 27040 1 224 . 1 1 20 20 LYS CA C 13 60.093 0.15 . 1 . . . . 20 LYS CA . 27040 1 225 . 1 1 20 20 LYS CB C 13 33.280 0.15 . 1 . . . . 20 LYS CB . 27040 1 226 . 1 1 20 20 LYS CG C 13 26.113 0.2 . 1 . . . . 20 LYS CG . 27040 1 227 . 1 1 20 20 LYS CD C 13 29.870 0.2 . 1 . . . . 20 LYS CD . 27040 1 228 . 1 1 20 20 LYS CE C 13 42.296 0.2 . 1 . . . . 20 LYS CE . 27040 1 229 . 1 1 20 20 LYS N N 15 117.620 0.05 . 1 . . . . 20 LYS N . 27040 1 230 . 1 1 21 21 ALA H H 1 7.529 0.01 . 1 . . . . 21 ALA H . 27040 1 231 . 1 1 21 21 ALA HA H 1 3.044 0.05 . 1 . . . . 21 ALA HA . 27040 1 232 . 1 1 21 21 ALA HB1 H 1 0.683 0.05 . 1 . . . . 21 ALA HB1 . 27040 1 233 . 1 1 21 21 ALA HB2 H 1 0.683 0.05 . 1 . . . . 21 ALA HB2 . 27040 1 234 . 1 1 21 21 ALA HB3 H 1 0.683 0.05 . 1 . . . . 21 ALA HB3 . 27040 1 235 . 1 1 21 21 ALA C C 13 175.022 0.1 . 1 . . . . 21 ALA C . 27040 1 236 . 1 1 21 21 ALA CA C 13 54.431 0.15 . 1 . . . . 21 ALA CA . 27040 1 237 . 1 1 21 21 ALA CB C 13 21.631 0.15 . 1 . . . . 21 ALA CB . 27040 1 238 . 1 1 21 21 ALA N N 15 119.668 0.05 . 1 . . . . 21 ALA N . 27040 1 239 . 1 1 22 22 PHE H H 1 8.260 0.01 . 1 . . . . 22 PHE H . 27040 1 240 . 1 1 22 22 PHE HA H 1 4.109 0.05 . 1 . . . . 22 PHE HA . 27040 1 241 . 1 1 22 22 PHE HB2 H 1 2.855 0.05 . 1 . . . . 22 PHE HB2 . 27040 1 242 . 1 1 22 22 PHE HB3 H 1 2.855 0.05 . 1 . . . . 22 PHE HB3 . 27040 1 243 . 1 1 22 22 PHE CA C 13 56.400 0.15 . 1 . . . . 22 PHE CA . 27040 1 244 . 1 1 22 22 PHE CB C 13 40.863 0.15 . 1 . . . . 22 PHE CB . 27040 1 245 . 1 1 22 22 PHE N N 15 111.265 0.05 . 1 . . . . 22 PHE N . 27040 1 246 . 1 1 23 23 ILE HA H 1 3.605 0.05 . 1 . . . . 23 ILE HA . 27040 1 247 . 1 1 23 23 ILE HB H 1 1.275 0.05 . 1 . . . . 23 ILE HB . 27040 1 248 . 1 1 23 23 ILE HG12 H 1 0.950 0.05 . 1 . . . . 23 ILE HG12 . 27040 1 249 . 1 1 23 23 ILE HG13 H 1 0.950 0.05 . 1 . . . . 23 ILE HG13 . 27040 1 250 . 1 1 23 23 ILE HG21 H 1 -0.362 0.05 . 1 . . . . 23 ILE MG . 27040 1 251 . 1 1 23 23 ILE HG22 H 1 -0.362 0.05 . 1 . . . . 23 ILE MG . 27040 1 252 . 1 1 23 23 ILE HG23 H 1 -0.362 0.05 . 1 . . . . 23 ILE MG . 27040 1 253 . 1 1 23 23 ILE HD11 H 1 0.149 0.05 . 1 . . . . 23 ILE MD . 27040 1 254 . 1 1 23 23 ILE HD12 H 1 0.149 0.05 . 1 . . . . 23 ILE MD . 27040 1 255 . 1 1 23 23 ILE HD13 H 1 0.149 0.05 . 1 . . . . 23 ILE MD . 27040 1 256 . 1 1 23 23 ILE C C 13 178.753 0.1 . 1 . . . . 23 ILE C . 27040 1 257 . 1 1 23 23 ILE CA C 13 59.605 0.15 . 1 . . . . 23 ILE CA . 27040 1 258 . 1 1 23 23 ILE CB C 13 34.818 0.15 . 1 . . . . 23 ILE CB . 27040 1 259 . 1 1 23 23 ILE CG1 C 13 27.154 0.2 . 1 . . . . 23 ILE CG1 . 27040 1 260 . 1 1 23 23 ILE CG2 C 13 17.033 0.2 . 1 . . . . 23 ILE CG2 . 27040 1 261 . 1 1 23 23 ILE CD1 C 13 10.233 0.2 . 1 . . . . 23 ILE CD1 . 27040 1 262 . 1 1 24 24 LEU H H 1 7.696 0.01 . 1 . . . . 24 LEU H . 27040 1 263 . 1 1 24 24 LEU HA H 1 3.788 0.05 . 1 . . . . 24 LEU HA . 27040 1 264 . 1 1 24 24 LEU HB2 H 1 1.433 0.05 . 2 . . . . 24 LEU HB2 . 27040 1 265 . 1 1 24 24 LEU HB3 H 1 2.105 0.05 . 2 . . . . 24 LEU HB3 . 27040 1 266 . 1 1 24 24 LEU HG H 1 1.057 0.05 . 1 . . . . 24 LEU HG . 27040 1 267 . 1 1 24 24 LEU HD11 H 1 1.061 0.05 . 2 . . . . 24 LEU MD1 . 27040 1 268 . 1 1 24 24 LEU HD12 H 1 1.061 0.05 . 2 . . . . 24 LEU MD1 . 27040 1 269 . 1 1 24 24 LEU HD13 H 1 1.061 0.05 . 2 . . . . 24 LEU MD1 . 27040 1 270 . 1 1 24 24 LEU HD21 H 1 0.616 0.05 . 2 . . . . 24 LEU MD2 . 27040 1 271 . 1 1 24 24 LEU HD22 H 1 0.616 0.05 . 2 . . . . 24 LEU MD2 . 27040 1 272 . 1 1 24 24 LEU HD23 H 1 0.616 0.05 . 2 . . . . 24 LEU MD2 . 27040 1 273 . 1 1 24 24 LEU C C 13 178.767 0.1 . 1 . . . . 24 LEU C . 27040 1 274 . 1 1 24 24 LEU CA C 13 57.849 0.15 . 1 . . . . 24 LEU CA . 27040 1 275 . 1 1 24 24 LEU CB C 13 39.812 0.15 . 1 . . . . 24 LEU CB . 27040 1 276 . 1 1 24 24 LEU CG C 13 25.957 0.2 . 1 . . . . 24 LEU CG . 27040 1 277 . 1 1 24 24 LEU CD1 C 13 25.955 0.2 . 2 . . . . 24 LEU CD1 . 27040 1 278 . 1 1 24 24 LEU CD2 C 13 21.457 0.2 . 2 . . . . 24 LEU CD2 . 27040 1 279 . 1 1 24 24 LEU N N 15 116.923 0.05 . 1 . . . . 24 LEU N . 27040 1 280 . 1 1 25 25 ASP H H 1 7.270 0.01 . 1 . . . . 25 ASP H . 27040 1 281 . 1 1 25 25 ASP HA H 1 5.517 0.05 . 1 . . . . 25 ASP HA . 27040 1 282 . 1 1 25 25 ASP HB2 H 1 2.575 0.05 . 2 . . . . 25 ASP HB2 . 27040 1 283 . 1 1 25 25 ASP HB3 H 1 2.911 0.05 . 2 . . . . 25 ASP HB3 . 27040 1 284 . 1 1 25 25 ASP C C 13 178.306 0.1 . 1 . . . . 25 ASP C . 27040 1 285 . 1 1 25 25 ASP CA C 13 52.589 0.15 . 1 . . . . 25 ASP CA . 27040 1 286 . 1 1 25 25 ASP CB C 13 43.185 0.15 . 1 . . . . 25 ASP CB . 27040 1 287 . 1 1 25 25 ASP N N 15 116.389 0.05 . 1 . . . . 25 ASP N . 27040 1 288 . 1 1 26 26 GLY H H 1 6.847 0.01 . 1 . . . . 26 GLY H . 27040 1 289 . 1 1 26 26 GLY HA2 H 1 3.570 0.05 . 2 . . . . 26 GLY HA2 . 27040 1 290 . 1 1 26 26 GLY HA3 H 1 3.890 0.05 . 2 . . . . 26 GLY HA3 . 27040 1 291 . 1 1 26 26 GLY C C 13 174.787 0.1 . 1 . . . . 26 GLY C . 27040 1 292 . 1 1 26 26 GLY CA C 13 48.667 0.15 . 1 . . . . 26 GLY CA . 27040 1 293 . 1 1 26 26 GLY N N 15 108.352 0.05 . 1 . . . . 26 GLY N . 27040 1 294 . 1 1 27 27 ASP H H 1 8.254 0.01 . 1 . . . . 27 ASP H . 27040 1 295 . 1 1 27 27 ASP HA H 1 3.700 0.05 . 1 . . . . 27 ASP HA . 27040 1 296 . 1 1 27 27 ASP HB2 H 1 2.372 0.05 . 1 . . . . 27 ASP HB2 . 27040 1 297 . 1 1 27 27 ASP HB3 H 1 2.372 0.05 . 1 . . . . 27 ASP HB3 . 27040 1 298 . 1 1 27 27 ASP C C 13 175.976 0.1 . 1 . . . . 27 ASP C . 27040 1 299 . 1 1 27 27 ASP CA C 13 56.716 0.15 . 1 . . . . 27 ASP CA . 27040 1 300 . 1 1 27 27 ASP CB C 13 39.983 0.15 . 1 . . . . 27 ASP CB . 27040 1 301 . 1 1 27 27 ASP N N 15 117.568 0.05 . 1 . . . . 27 ASP N . 27040 1 302 . 1 1 28 28 ASN H H 1 7.080 0.01 . 1 . . . . 28 ASN H . 27040 1 303 . 1 1 28 28 ASN HA H 1 4.642 0.05 . 1 . . . . 28 ASN HA . 27040 1 304 . 1 1 28 28 ASN HB2 H 1 2.689 0.05 . 1 . . . . 28 ASN HB2 . 27040 1 305 . 1 1 28 28 ASN HB3 H 1 2.689 0.05 . 1 . . . . 28 ASN HB3 . 27040 1 306 . 1 1 28 28 ASN HD21 H 1 8.300 0.05 . 1 . . . . 28 ASN HD21 . 27040 1 307 . 1 1 28 28 ASN HD22 H 1 6.964 0.05 . 1 . . . . 28 ASN HD22 . 27040 1 308 . 1 1 28 28 ASN C C 13 176.911 0.1 . 1 . . . . 28 ASN C . 27040 1 309 . 1 1 28 28 ASN CA C 13 53.760 0.15 . 1 . . . . 28 ASN CA . 27040 1 310 . 1 1 28 28 ASN CB C 13 40.495 0.15 . 1 . . . . 28 ASN CB . 27040 1 311 . 1 1 28 28 ASN CG C 13 176.349 0.2 . 1 . . . . 28 ASN CG . 27040 1 312 . 1 1 28 28 ASN N N 15 111.194 0.05 . 1 . . . . 28 ASN N . 27040 1 313 . 1 1 28 28 ASN ND2 N 15 116.466 0.05 . 1 . . . . 28 ASN ND2 . 27040 1 314 . 1 1 29 29 LEU H H 1 8.388 0.01 . 1 . . . . 29 LEU H . 27040 1 315 . 1 1 29 29 LEU HA H 1 4.018 0.05 . 1 . . . . 29 LEU HA . 27040 1 316 . 1 1 29 29 LEU HB2 H 1 1.512 0.05 . 1 . . . . 29 LEU HB2 . 27040 1 317 . 1 1 29 29 LEU HB3 H 1 1.512 0.05 . 1 . . . . 29 LEU HB3 . 27040 1 318 . 1 1 29 29 LEU HG H 1 1.512 0.05 . 1 . . . . 29 LEU HG . 27040 1 319 . 1 1 29 29 LEU HD11 H 1 0.616 0.05 . 2 . . . . 29 LEU MD1 . 27040 1 320 . 1 1 29 29 LEU HD12 H 1 0.616 0.05 . 2 . . . . 29 LEU MD1 . 27040 1 321 . 1 1 29 29 LEU HD13 H 1 0.616 0.05 . 2 . . . . 29 LEU MD1 . 27040 1 322 . 1 1 29 29 LEU HD21 H 1 0.330 0.05 . 2 . . . . 29 LEU MD2 . 27040 1 323 . 1 1 29 29 LEU HD22 H 1 0.330 0.05 . 2 . . . . 29 LEU MD2 . 27040 1 324 . 1 1 29 29 LEU HD23 H 1 0.330 0.05 . 2 . . . . 29 LEU MD2 . 27040 1 325 . 1 1 29 29 LEU C C 13 178.445 0.1 . 1 . . . . 29 LEU C . 27040 1 326 . 1 1 29 29 LEU CA C 13 57.623 0.15 . 1 . . . . 29 LEU CA . 27040 1 327 . 1 1 29 29 LEU CB C 13 42.737 0.15 . 1 . . . . 29 LEU CB . 27040 1 328 . 1 1 29 29 LEU CG C 13 26.949 0.2 . 1 . . . . 29 LEU CG . 27040 1 329 . 1 1 29 29 LEU CD1 C 13 26.913 0.2 . 2 . . . . 29 LEU CD1 . 27040 1 330 . 1 1 29 29 LEU CD2 C 13 22.058 0.2 . 2 . . . . 29 LEU CD2 . 27040 1 331 . 1 1 29 29 LEU N N 15 119.921 0.05 . 1 . . . . 29 LEU N . 27040 1 332 . 1 1 30 30 VAL H H 1 8.649 0.01 . 1 . . . . 30 VAL H . 27040 1 333 . 1 1 30 30 VAL CA C 13 69.115 0.15 . 1 . . . . 30 VAL CA . 27040 1 334 . 1 1 30 30 VAL CB C 13 28.137 0.15 . 1 . . . . 30 VAL CB . 27040 1 335 . 1 1 30 30 VAL N N 15 116.024 0.05 . 1 . . . . 30 VAL N . 27040 1 336 . 1 1 31 31 PRO HA H 1 4.273 0.05 . 1 . . . . 31 PRO HA . 27040 1 337 . 1 1 31 31 PRO HB2 H 1 1.620 0.05 . 1 . . . . 31 PRO HB2 . 27040 1 338 . 1 1 31 31 PRO HB3 H 1 1.620 0.05 . 1 . . . . 31 PRO HB3 . 27040 1 339 . 1 1 31 31 PRO HG2 H 1 1.362 0.05 . 2 . . . . 31 PRO HG2 . 27040 1 340 . 1 1 31 31 PRO HG3 H 1 2.133 0.05 . 2 . . . . 31 PRO HG3 . 27040 1 341 . 1 1 31 31 PRO HD2 H 1 3.256 0.05 . 2 . . . . 31 PRO HD2 . 27040 1 342 . 1 1 31 31 PRO HD3 H 1 3.409 0.05 . 2 . . . . 31 PRO HD3 . 27040 1 343 . 1 1 31 31 PRO C C 13 177.461 0.1 . 1 . . . . 31 PRO C . 27040 1 344 . 1 1 31 31 PRO CA C 13 64.693 0.15 . 1 . . . . 31 PRO CA . 27040 1 345 . 1 1 31 31 PRO CB C 13 30.842 0.15 . 1 . . . . 31 PRO CB . 27040 1 346 . 1 1 31 31 PRO CG C 13 28.661 0.2 . 1 . . . . 31 PRO CG . 27040 1 347 . 1 1 31 31 PRO CD C 13 49.991 0.2 . 1 . . . . 31 PRO CD . 27040 1 348 . 1 1 32 32 LYS H H 1 6.578 0.01 . 1 . . . . 32 LYS H . 27040 1 349 . 1 1 32 32 LYS HA H 1 4.120 0.05 . 1 . . . . 32 LYS HA . 27040 1 350 . 1 1 32 32 LYS HB2 H 1 1.885 0.05 . 1 . . . . 32 LYS HB2 . 27040 1 351 . 1 1 32 32 LYS HB3 H 1 1.885 0.05 . 1 . . . . 32 LYS HB3 . 27040 1 352 . 1 1 32 32 LYS HG2 H 1 1.509 0.05 . 2 . . . . 32 LYS HG2 . 27040 1 353 . 1 1 32 32 LYS HG3 H 1 1.283 0.05 . 2 . . . . 32 LYS HG3 . 27040 1 354 . 1 1 32 32 LYS HD2 H 1 1.591 0.05 . 1 . . . . 32 LYS HD2 . 27040 1 355 . 1 1 32 32 LYS HD3 H 1 1.591 0.05 . 1 . . . . 32 LYS HD3 . 27040 1 356 . 1 1 32 32 LYS HE2 H 1 2.907 0.05 . 1 . . . . 32 LYS HE2 . 27040 1 357 . 1 1 32 32 LYS HE3 H 1 2.907 0.05 . 1 . . . . 32 LYS HE3 . 27040 1 358 . 1 1 32 32 LYS C C 13 178.998 0.1 . 1 . . . . 32 LYS C . 27040 1 359 . 1 1 32 32 LYS CA C 13 58.408 0.15 . 1 . . . . 32 LYS CA . 27040 1 360 . 1 1 32 32 LYS CB C 13 32.968 0.15 . 1 . . . . 32 LYS CB . 27040 1 361 . 1 1 32 32 LYS CG C 13 25.085 0.2 . 1 . . . . 32 LYS CG . 27040 1 362 . 1 1 32 32 LYS CD C 13 29.354 0.2 . 1 . . . . 32 LYS CD . 27040 1 363 . 1 1 32 32 LYS CE C 13 42.115 0.2 . 1 . . . . 32 LYS CE . 27040 1 364 . 1 1 32 32 LYS N N 15 112.446 0.05 . 1 . . . . 32 LYS N . 27040 1 365 . 1 1 33 33 VAL H H 1 7.680 0.01 . 1 . . . . 33 VAL H . 27040 1 366 . 1 1 33 33 VAL HA H 1 4.453 0.05 . 1 . . . . 33 VAL HA . 27040 1 367 . 1 1 33 33 VAL HB H 1 2.354 0.05 . 1 . . . . 33 VAL HB . 27040 1 368 . 1 1 33 33 VAL HG11 H 1 0.670 0.05 . 2 . . . . 33 VAL MG1 . 27040 1 369 . 1 1 33 33 VAL HG12 H 1 0.670 0.05 . 2 . . . . 33 VAL MG1 . 27040 1 370 . 1 1 33 33 VAL HG13 H 1 0.670 0.05 . 2 . . . . 33 VAL MG1 . 27040 1 371 . 1 1 33 33 VAL HG21 H 1 0.796 0.05 . 2 . . . . 33 VAL MG2 . 27040 1 372 . 1 1 33 33 VAL HG22 H 1 0.796 0.05 . 2 . . . . 33 VAL MG2 . 27040 1 373 . 1 1 33 33 VAL HG23 H 1 0.796 0.05 . 2 . . . . 33 VAL MG2 . 27040 1 374 . 1 1 33 33 VAL C C 13 175.818 0.1 . 1 . . . . 33 VAL C . 27040 1 375 . 1 1 33 33 VAL CA C 13 61.283 0.15 . 1 . . . . 33 VAL CA . 27040 1 376 . 1 1 33 33 VAL CB C 13 32.396 0.15 . 1 . . . . 33 VAL CB . 27040 1 377 . 1 1 33 33 VAL CG1 C 13 22.544 0.2 . 2 . . . . 33 VAL CG1 . 27040 1 378 . 1 1 33 33 VAL CG2 C 13 19.504 0.2 . 2 . . . . 33 VAL CG2 . 27040 1 379 . 1 1 33 33 VAL N N 15 109.567 0.05 . 1 . . . . 33 VAL N . 27040 1 380 . 1 1 34 34 ALA H H 1 8.370 0.01 . 1 . . . . 34 ALA H . 27040 1 381 . 1 1 34 34 ALA HA H 1 5.131 0.05 . 1 . . . . 34 ALA HA . 27040 1 382 . 1 1 34 34 ALA HB1 H 1 1.133 0.05 . 1 . . . . 34 ALA MB . 27040 1 383 . 1 1 34 34 ALA HB2 H 1 1.133 0.05 . 1 . . . . 34 ALA MB . 27040 1 384 . 1 1 34 34 ALA HB3 H 1 1.133 0.05 . 1 . . . . 34 ALA MB . 27040 1 385 . 1 1 34 34 ALA CA C 13 50.205 0.15 . 1 . . . . 34 ALA CA . 27040 1 386 . 1 1 34 34 ALA CB C 13 18.532 0.15 . 1 . . . . 34 ALA CB . 27040 1 387 . 1 1 34 34 ALA N N 15 124.781 0.05 . 1 . . . . 34 ALA N . 27040 1 388 . 1 1 35 35 PRO HA H 1 4.890 0.05 . 1 . . . . 35 PRO HA . 27040 1 389 . 1 1 35 35 PRO HB2 H 1 2.030 0.05 . 2 . . . . 35 PRO HB2 . 27040 1 390 . 1 1 35 35 PRO HB3 H 1 2.458 0.05 . 2 . . . . 35 PRO HB3 . 27040 1 391 . 1 1 35 35 PRO HG2 H 1 1.962 0.05 . 1 . . . . 35 PRO HG2 . 27040 1 392 . 1 1 35 35 PRO HG3 H 1 1.962 0.05 . 1 . . . . 35 PRO HG3 . 27040 1 393 . 1 1 35 35 PRO HD2 H 1 3.783 0.05 . 1 . . . . 35 PRO HD2 . 27040 1 394 . 1 1 35 35 PRO HD3 H 1 3.783 0.05 . 1 . . . . 35 PRO HD3 . 27040 1 395 . 1 1 35 35 PRO C C 13 177.596 0.1 . 1 . . . . 35 PRO C . 27040 1 396 . 1 1 35 35 PRO CA C 13 64.414 0.15 . 1 . . . . 35 PRO CA . 27040 1 397 . 1 1 35 35 PRO CB C 13 31.435 0.15 . 1 . . . . 35 PRO CB . 27040 1 398 . 1 1 35 35 PRO CG C 13 27.240 0.2 . 1 . . . . 35 PRO CG . 27040 1 399 . 1 1 35 35 PRO CD C 13 50.476 0.2 . 1 . . . . 35 PRO CD . 27040 1 400 . 1 1 36 36 GLN H H 1 9.072 0.01 . 1 . . . . 36 GLN H . 27040 1 401 . 1 1 36 36 GLN HA H 1 4.327 0.05 . 1 . . . . 36 GLN HA . 27040 1 402 . 1 1 36 36 GLN HB2 H 1 2.256 0.05 . 1 . . . . 36 GLN HB2 . 27040 1 403 . 1 1 36 36 GLN HB3 H 1 2.256 0.05 . 1 . . . . 36 GLN HB3 . 27040 1 404 . 1 1 36 36 GLN HG2 H 1 2.601 0.05 . 1 . . . . 36 GLN HG2 . 27040 1 405 . 1 1 36 36 GLN HG3 H 1 2.601 0.05 . 1 . . . . 36 GLN HG3 . 27040 1 406 . 1 1 36 36 GLN HE21 H 1 7.602 0.05 . 1 . . . . 36 GLN HE21 . 27040 1 407 . 1 1 36 36 GLN HE22 H 1 7.233 0.05 . 1 . . . . 36 GLN HE22 . 27040 1 408 . 1 1 36 36 GLN C C 13 175.077 0.1 . 1 . . . . 36 GLN C . 27040 1 409 . 1 1 36 36 GLN CA C 13 56.288 0.15 . 1 . . . . 36 GLN CA . 27040 1 410 . 1 1 36 36 GLN CB C 13 26.784 0.15 . 1 . . . . 36 GLN CB . 27040 1 411 . 1 1 36 36 GLN CG C 13 33.183 0.2 . 1 . . . . 36 GLN CG . 27040 1 412 . 1 1 36 36 GLN CD C 13 181.382 0.2 . 1 . . . . 36 GLN CD . 27040 1 413 . 1 1 36 36 GLN N N 15 117.797 0.05 . 1 . . . . 36 GLN N . 27040 1 414 . 1 1 36 36 GLN NE2 N 15 111.191 0.05 . 1 . . . . 36 GLN NE2 . 27040 1 415 . 1 1 37 37 ALA H H 1 8.155 0.01 . 1 . . . . 37 ALA H . 27040 1 416 . 1 1 37 37 ALA HA H 1 4.664 0.05 . 1 . . . . 37 ALA HA . 27040 1 417 . 1 1 37 37 ALA HB1 H 1 1.413 0.05 . 1 . . . . 37 ALA MB . 27040 1 418 . 1 1 37 37 ALA HB2 H 1 1.413 0.05 . 1 . . . . 37 ALA MB . 27040 1 419 . 1 1 37 37 ALA HB3 H 1 1.413 0.05 . 1 . . . . 37 ALA MB . 27040 1 420 . 1 1 37 37 ALA C C 13 174.438 0.1 . 1 . . . . 37 ALA C . 27040 1 421 . 1 1 37 37 ALA CA C 13 52.874 0.15 . 1 . . . . 37 ALA CA . 27040 1 422 . 1 1 37 37 ALA CB C 13 22.057 0.15 . 1 . . . . 37 ALA CB . 27040 1 423 . 1 1 37 37 ALA N N 15 124.450 0.05 . 1 . . . . 37 ALA N . 27040 1 424 . 1 1 38 38 ILE H H 1 7.614 0.01 . 1 . . . . 38 ILE H . 27040 1 425 . 1 1 38 38 ILE HA H 1 4.109 0.05 . 1 . . . . 38 ILE HA . 27040 1 426 . 1 1 38 38 ILE HB H 1 1.464 0.05 . 1 . . . . 38 ILE HB . 27040 1 427 . 1 1 38 38 ILE HG12 H 1 1.184 0.05 . 1 . . . . 38 ILE HG12 . 27040 1 428 . 1 1 38 38 ILE HG13 H 1 1.184 0.05 . 1 . . . . 38 ILE HG13 . 27040 1 429 . 1 1 38 38 ILE HG21 H 1 0.515 0.05 . 1 . . . . 38 ILE MG . 27040 1 430 . 1 1 38 38 ILE HG22 H 1 0.515 0.05 . 1 . . . . 38 ILE MG . 27040 1 431 . 1 1 38 38 ILE HG23 H 1 0.515 0.05 . 1 . . . . 38 ILE MG . 27040 1 432 . 1 1 38 38 ILE HD11 H 1 0.670 0.05 . 1 . . . . 38 ILE MD . 27040 1 433 . 1 1 38 38 ILE HD12 H 1 0.670 0.05 . 1 . . . . 38 ILE MD . 27040 1 434 . 1 1 38 38 ILE HD13 H 1 0.670 0.05 . 1 . . . . 38 ILE MD . 27040 1 435 . 1 1 38 38 ILE C C 13 173.798 0.1 . 1 . . . . 38 ILE C . 27040 1 436 . 1 1 38 38 ILE CA C 13 59.060 0.15 . 1 . . . . 38 ILE CA . 27040 1 437 . 1 1 38 38 ILE CB C 13 41.188 0.15 . 1 . . . . 38 ILE CB . 27040 1 438 . 1 1 38 38 ILE CG1 C 13 27.233 0.2 . 1 . . . . 38 ILE CG1 . 27040 1 439 . 1 1 38 38 ILE CG2 C 13 17.991 0.2 . 1 . . . . 38 ILE CG2 . 27040 1 440 . 1 1 38 38 ILE CD1 C 13 12.443 0.2 . 1 . . . . 38 ILE CD1 . 27040 1 441 . 1 1 38 38 ILE N N 15 113.872 0.05 . 1 . . . . 38 ILE N . 27040 1 442 . 1 1 39 39 SER H H 1 8.407 0.01 . 1 . . . . 39 SER H . 27040 1 443 . 1 1 39 39 SER HA H 1 4.562 0.05 . 1 . . . . 39 SER HA . 27040 1 444 . 1 1 39 39 SER HB2 H 1 3.482 0.05 . 1 . . . . 39 SER HB2 . 27040 1 445 . 1 1 39 39 SER HB3 H 1 3.482 0.05 . 1 . . . . 39 SER HB3 . 27040 1 446 . 1 1 39 39 SER C C 13 175.853 0.1 . 1 . . . . 39 SER C . 27040 1 447 . 1 1 39 39 SER CA C 13 59.603 0.15 . 1 . . . . 39 SER CA . 27040 1 448 . 1 1 39 39 SER CB C 13 63.962 0.15 . 1 . . . . 39 SER CB . 27040 1 449 . 1 1 39 39 SER N N 15 118.391 0.05 . 1 . . . . 39 SER N . 27040 1 450 . 1 1 40 40 SER H H 1 7.501 0.01 . 1 . . . . 40 SER H . 27040 1 451 . 1 1 40 40 SER HA H 1 4.328 0.05 . 1 . . . . 40 SER HA . 27040 1 452 . 1 1 40 40 SER HB2 H 1 3.774 0.05 . 2 . . . . 40 SER HB2 . 27040 1 453 . 1 1 40 40 SER HB3 H 1 4.120 0.05 . 2 . . . . 40 SER HB3 . 27040 1 454 . 1 1 40 40 SER C C 13 171.290 0.1 . 1 . . . . 40 SER C . 27040 1 455 . 1 1 40 40 SER CA C 13 58.061 0.15 . 1 . . . . 40 SER CA . 27040 1 456 . 1 1 40 40 SER CB C 13 64.282 0.15 . 1 . . . . 40 SER CB . 27040 1 457 . 1 1 40 40 SER N N 15 110.082 0.05 . 1 . . . . 40 SER N . 27040 1 458 . 1 1 41 41 VAL H H 1 8.585 0.01 . 1 . . . . 41 VAL H . 27040 1 459 . 1 1 41 41 VAL HA H 1 4.689 0.05 . 1 . . . . 41 VAL HA . 27040 1 460 . 1 1 41 41 VAL HB H 1 1.877 0.05 . 1 . . . . 41 VAL HB . 27040 1 461 . 1 1 41 41 VAL HG11 H 1 0.676 0.05 . 2 . . . . 41 VAL MG1 . 27040 1 462 . 1 1 41 41 VAL HG12 H 1 0.676 0.05 . 2 . . . . 41 VAL MG1 . 27040 1 463 . 1 1 41 41 VAL HG13 H 1 0.676 0.05 . 2 . . . . 41 VAL MG1 . 27040 1 464 . 1 1 41 41 VAL HG21 H 1 0.759 0.05 . 2 . . . . 41 VAL MG2 . 27040 1 465 . 1 1 41 41 VAL HG22 H 1 0.759 0.05 . 2 . . . . 41 VAL MG2 . 27040 1 466 . 1 1 41 41 VAL HG23 H 1 0.759 0.05 . 2 . . . . 41 VAL MG2 . 27040 1 467 . 1 1 41 41 VAL C C 13 174.616 0.1 . 1 . . . . 41 VAL C . 27040 1 468 . 1 1 41 41 VAL CA C 13 61.503 0.15 . 1 . . . . 41 VAL CA . 27040 1 469 . 1 1 41 41 VAL CB C 13 34.913 0.15 . 1 . . . . 41 VAL CB . 27040 1 470 . 1 1 41 41 VAL CG1 C 13 21.655 0.2 . 1 . . . . 41 VAL CG1 . 27040 1 471 . 1 1 41 41 VAL CG2 C 13 21.655 0.2 . 1 . . . . 41 VAL CG2 . 27040 1 472 . 1 1 41 41 VAL N N 15 119.899 0.05 . 1 . . . . 41 VAL N . 27040 1 473 . 1 1 42 42 GLU H H 1 9.105 0.01 . 1 . . . . 42 GLU H . 27040 1 474 . 1 1 42 42 GLU HA H 1 4.639 0.05 . 1 . . . . 42 GLU HA . 27040 1 475 . 1 1 42 42 GLU HB2 H 1 1.923 0.05 . 1 . . . . 42 GLU HB2 . 27040 1 476 . 1 1 42 42 GLU HB3 H 1 1.923 0.05 . 1 . . . . 42 GLU HB3 . 27040 1 477 . 1 1 42 42 GLU HG2 H 1 2.044 0.05 . 1 . . . . 42 GLU HG2 . 27040 1 478 . 1 1 42 42 GLU HG3 H 1 2.044 0.05 . 1 . . . . 42 GLU HG3 . 27040 1 479 . 1 1 42 42 GLU C C 13 175.142 0.1 . 1 . . . . 42 GLU C . 27040 1 480 . 1 1 42 42 GLU CA C 13 54.041 0.15 . 1 . . . . 42 GLU CA . 27040 1 481 . 1 1 42 42 GLU CB C 13 33.839 0.15 . 1 . . . . 42 GLU CB . 27040 1 482 . 1 1 42 42 GLU CG C 13 36.177 0.2 . 1 . . . . 42 GLU CG . 27040 1 483 . 1 1 42 42 GLU N N 15 125.572 0.05 . 1 . . . . 42 GLU N . 27040 1 484 . 1 1 43 43 ASN H H 1 9.061 0.01 . 1 . . . . 43 ASN H . 27040 1 485 . 1 1 43 43 ASN HA H 1 4.969 0.05 . 1 . . . . 43 ASN HA . 27040 1 486 . 1 1 43 43 ASN HB2 H 1 2.475 0.05 . 2 . . . . 43 ASN HB2 . 27040 1 487 . 1 1 43 43 ASN HB3 H 1 2.703 0.05 . 2 . . . . 43 ASN HB3 . 27040 1 488 . 1 1 43 43 ASN C C 13 175.105 0.1 . 1 . . . . 43 ASN C . 27040 1 489 . 1 1 43 43 ASN CA C 13 53.644 0.15 . 1 . . . . 43 ASN CA . 27040 1 490 . 1 1 43 43 ASN CB C 13 38.262 0.15 . 1 . . . . 43 ASN CB . 27040 1 491 . 1 1 43 43 ASN N N 15 124.176 0.05 . 1 . . . . 43 ASN N . 27040 1 492 . 1 1 44 44 ILE H H 1 8.899 0.01 . 1 . . . . 44 ILE H . 27040 1 493 . 1 1 44 44 ILE HA H 1 4.130 0.05 . 1 . . . . 44 ILE HA . 27040 1 494 . 1 1 44 44 ILE HB H 1 1.849 0.05 . 1 . . . . 44 ILE HB . 27040 1 495 . 1 1 44 44 ILE HG12 H 1 1.239 0.05 . 1 . . . . 44 ILE HG12 . 27040 1 496 . 1 1 44 44 ILE HG13 H 1 1.239 0.05 . 1 . . . . 44 ILE HG13 . 27040 1 497 . 1 1 44 44 ILE HG21 H 1 0.921 0.05 . 1 . . . . 44 ILE MG . 27040 1 498 . 1 1 44 44 ILE HG22 H 1 0.921 0.05 . 1 . . . . 44 ILE MG . 27040 1 499 . 1 1 44 44 ILE HG23 H 1 0.921 0.05 . 1 . . . . 44 ILE MG . 27040 1 500 . 1 1 44 44 ILE HD11 H 1 0.756 0.05 . 1 . . . . 44 ILE MD . 27040 1 501 . 1 1 44 44 ILE HD12 H 1 0.756 0.05 . 1 . . . . 44 ILE MD . 27040 1 502 . 1 1 44 44 ILE HD13 H 1 0.756 0.05 . 1 . . . . 44 ILE MD . 27040 1 503 . 1 1 44 44 ILE C C 13 176.407 0.1 . 1 . . . . 44 ILE C . 27040 1 504 . 1 1 44 44 ILE CA C 13 62.183 0.15 . 1 . . . . 44 ILE CA . 27040 1 505 . 1 1 44 44 ILE CB C 13 38.185 0.15 . 1 . . . . 44 ILE CB . 27040 1 506 . 1 1 44 44 ILE CG1 C 13 27.368 0.2 . 1 . . . . 44 ILE CG1 . 27040 1 507 . 1 1 44 44 ILE CG2 C 13 17.676 0.2 . 1 . . . . 44 ILE CG2 . 27040 1 508 . 1 1 44 44 ILE CD1 C 13 12.185 0.2 . 1 . . . . 44 ILE CD1 . 27040 1 509 . 1 1 44 44 ILE N N 15 125.392 0.05 . 1 . . . . 44 ILE N . 27040 1 510 . 1 1 45 45 GLU H H 1 7.710 0.01 . 1 . . . . 45 GLU H . 27040 1 511 . 1 1 45 45 GLU HA H 1 4.552 0.05 . 1 . . . . 45 GLU HA . 27040 1 512 . 1 1 45 45 GLU HB2 H 1 2.179 0.05 . 1 . . . . 45 GLU HB2 . 27040 1 513 . 1 1 45 45 GLU HB3 H 1 2.179 0.05 . 1 . . . . 45 GLU HB3 . 27040 1 514 . 1 1 45 45 GLU HG2 H 1 2.255 0.05 . 1 . . . . 45 GLU HG2 . 27040 1 515 . 1 1 45 45 GLU HG3 H 1 2.255 0.05 . 1 . . . . 45 GLU HG3 . 27040 1 516 . 1 1 45 45 GLU C C 13 175.370 0.1 . 1 . . . . 45 GLU C . 27040 1 517 . 1 1 45 45 GLU CA C 13 56.135 0.15 . 1 . . . . 45 GLU CA . 27040 1 518 . 1 1 45 45 GLU CB C 13 33.119 0.15 . 1 . . . . 45 GLU CB . 27040 1 519 . 1 1 45 45 GLU CG C 13 36.261 0.2 . 1 . . . . 45 GLU CG . 27040 1 520 . 1 1 45 45 GLU N N 15 118.405 0.05 . 1 . . . . 45 GLU N . 27040 1 521 . 1 1 46 46 GLY H H 1 8.508 0.01 . 1 . . . . 46 GLY H . 27040 1 522 . 1 1 46 46 GLY HA2 H 1 3.782 0.05 . 2 . . . . 46 GLY HA2 . 27040 1 523 . 1 1 46 46 GLY HA3 H 1 4.662 0.05 . 2 . . . . 46 GLY HA3 . 27040 1 524 . 1 1 46 46 GLY C C 13 173.739 0.1 . 1 . . . . 46 GLY C . 27040 1 525 . 1 1 46 46 GLY CA C 13 44.682 0.15 . 1 . . . . 46 GLY CA . 27040 1 526 . 1 1 46 46 GLY N N 15 110.305 0.05 . 1 . . . . 46 GLY N . 27040 1 527 . 1 1 47 47 ASN H H 1 8.306 0.01 . 1 . . . . 47 ASN H . 27040 1 528 . 1 1 47 47 ASN HA H 1 4.976 0.05 . 1 . . . . 47 ASN HA . 27040 1 529 . 1 1 47 47 ASN HB2 H 1 2.848 0.05 . 2 . . . . 47 ASN HB2 . 27040 1 530 . 1 1 47 47 ASN HB3 H 1 2.995 0.05 . 2 . . . . 47 ASN HB3 . 27040 1 531 . 1 1 47 47 ASN HD21 H 1 6.852 0.05 . 1 . . . . 47 ASN HD21 . 27040 1 532 . 1 1 47 47 ASN HD22 H 1 7.590 0.05 . 1 . . . . 47 ASN HD22 . 27040 1 533 . 1 1 47 47 ASN C C 13 176.087 0.1 . 1 . . . . 47 ASN C . 27040 1 534 . 1 1 47 47 ASN CA C 13 52.500 0.15 . 1 . . . . 47 ASN CA . 27040 1 535 . 1 1 47 47 ASN CB C 13 39.772 0.15 . 1 . . . . 47 ASN CB . 27040 1 536 . 1 1 47 47 ASN CG C 13 177.791 0.2 . 1 . . . . 47 ASN CG . 27040 1 537 . 1 1 47 47 ASN N N 15 114.425 0.05 . 1 . . . . 47 ASN N . 27040 1 538 . 1 1 47 47 ASN ND2 N 15 111.636 0.05 . 1 . . . . 47 ASN ND2 . 27040 1 539 . 1 1 48 48 GLY H H 1 8.861 0.01 . 1 . . . . 48 GLY H . 27040 1 540 . 1 1 48 48 GLY HA2 H 1 3.457 0.05 . 2 . . . . 48 GLY HA2 . 27040 1 541 . 1 1 48 48 GLY HA3 H 1 4.841 0.05 . 2 . . . . 48 GLY HA3 . 27040 1 542 . 1 1 48 48 GLY C C 13 175.129 0.1 . 1 . . . . 48 GLY C . 27040 1 543 . 1 1 48 48 GLY CA C 13 45.430 0.15 . 1 . . . . 48 GLY CA . 27040 1 544 . 1 1 48 48 GLY N N 15 109.961 0.05 . 1 . . . . 48 GLY N . 27040 1 545 . 1 1 49 49 GLY H H 1 8.201 0.01 . 1 . . . . 49 GLY H . 27040 1 546 . 1 1 49 49 GLY HA2 H 1 4.790 0.05 . 1 . . . . 49 GLY HA2 . 27040 1 547 . 1 1 49 49 GLY HA3 H 1 4.790 0.05 . 1 . . . . 49 GLY HA3 . 27040 1 548 . 1 1 49 49 GLY CA C 13 44.118 0.15 . 1 . . . . 49 GLY CA . 27040 1 549 . 1 1 49 49 GLY N N 15 106.994 0.05 . 1 . . . . 49 GLY N . 27040 1 550 . 1 1 50 50 PRO HA H 1 3.898 0.05 . 1 . . . . 50 PRO HA . 27040 1 551 . 1 1 50 50 PRO HB2 H 1 2.296 0.05 . 2 . . . . 50 PRO HB2 . 27040 1 552 . 1 1 50 50 PRO HB3 H 1 2.465 0.05 . 2 . . . . 50 PRO HB3 . 27040 1 553 . 1 1 50 50 PRO HG2 H 1 1.916 0.05 . 1 . . . . 50 PRO HG2 . 27040 1 554 . 1 1 50 50 PRO HG3 H 1 1.916 0.05 . 1 . . . . 50 PRO HG3 . 27040 1 555 . 1 1 50 50 PRO HD2 H 1 3.711 0.05 . 1 . . . . 50 PRO HD2 . 27040 1 556 . 1 1 50 50 PRO HD3 H 1 3.711 0.05 . 1 . . . . 50 PRO HD3 . 27040 1 557 . 1 1 50 50 PRO C C 13 176.738 0.1 . 1 . . . . 50 PRO C . 27040 1 558 . 1 1 50 50 PRO CA C 13 64.514 0.15 . 1 . . . . 50 PRO CA . 27040 1 559 . 1 1 50 50 PRO CB C 13 31.242 0.15 . 1 . . . . 50 PRO CB . 27040 1 560 . 1 1 50 50 PRO CG C 13 28.933 0.2 . 1 . . . . 50 PRO CG . 27040 1 561 . 1 1 50 50 PRO CD C 13 49.962 0.2 . 1 . . . . 50 PRO CD . 27040 1 562 . 1 1 51 51 GLY H H 1 9.512 0.01 . 1 . . . . 51 GLY H . 27040 1 563 . 1 1 51 51 GLY HA2 H 1 3.494 0.05 . 2 . . . . 51 GLY HA2 . 27040 1 564 . 1 1 51 51 GLY HA3 H 1 4.517 0.05 . 2 . . . . 51 GLY HA3 . 27040 1 565 . 1 1 51 51 GLY C C 13 174.475 0.1 . 1 . . . . 51 GLY C . 27040 1 566 . 1 1 51 51 GLY CA C 13 44.666 0.15 . 1 . . . . 51 GLY CA . 27040 1 567 . 1 1 51 51 GLY N N 15 114.550 0.05 . 1 . . . . 51 GLY N . 27040 1 568 . 1 1 52 52 THR H H 1 8.023 0.01 . 1 . . . . 52 THR H . 27040 1 569 . 1 1 52 52 THR HA H 1 4.544 0.05 . 1 . . . . 52 THR HA . 27040 1 570 . 1 1 52 52 THR HB H 1 3.914 0.05 . 1 . . . . 52 THR HB . 27040 1 571 . 1 1 52 52 THR HG21 H 1 1.157 0.05 . 1 . . . . 52 THR MG . 27040 1 572 . 1 1 52 52 THR HG22 H 1 1.157 0.05 . 1 . . . . 52 THR MG . 27040 1 573 . 1 1 52 52 THR HG23 H 1 1.157 0.05 . 1 . . . . 52 THR MG . 27040 1 574 . 1 1 52 52 THR C C 13 173.150 0.1 . 1 . . . . 52 THR C . 27040 1 575 . 1 1 52 52 THR CA C 13 64.487 0.15 . 1 . . . . 52 THR CA . 27040 1 576 . 1 1 52 52 THR CB C 13 69.738 0.15 . 1 . . . . 52 THR CB . 27040 1 577 . 1 1 52 52 THR CG2 C 13 20.415 0.2 . 1 . . . . 52 THR CG2 . 27040 1 578 . 1 1 52 52 THR N N 15 119.506 0.05 . 1 . . . . 52 THR N . 27040 1 579 . 1 1 53 53 ILE H H 1 8.662 0.01 . 1 . . . . 53 ILE H . 27040 1 580 . 1 1 53 53 ILE HA H 1 5.091 0.05 . 1 . . . . 53 ILE HA . 27040 1 581 . 1 1 53 53 ILE HB H 1 1.959 0.05 . 1 . . . . 53 ILE HB . 27040 1 582 . 1 1 53 53 ILE HG12 H 1 1.286 0.05 . 1 . . . . 53 ILE HG12 . 27040 1 583 . 1 1 53 53 ILE HG13 H 1 1.286 0.05 . 1 . . . . 53 ILE HG13 . 27040 1 584 . 1 1 53 53 ILE HG21 H 1 0.871 0.05 . 1 . . . . 53 ILE MG . 27040 1 585 . 1 1 53 53 ILE HG22 H 1 0.871 0.05 . 1 . . . . 53 ILE MG . 27040 1 586 . 1 1 53 53 ILE HG23 H 1 0.871 0.05 . 1 . . . . 53 ILE MG . 27040 1 587 . 1 1 53 53 ILE HD11 H 1 0.796 0.05 . 1 . . . . 53 ILE MD . 27040 1 588 . 1 1 53 53 ILE HD12 H 1 0.796 0.05 . 1 . . . . 53 ILE MD . 27040 1 589 . 1 1 53 53 ILE HD13 H 1 0.796 0.05 . 1 . . . . 53 ILE MD . 27040 1 590 . 1 1 53 53 ILE C C 13 174.949 0.1 . 1 . . . . 53 ILE C . 27040 1 591 . 1 1 53 53 ILE CA C 13 58.748 0.15 . 1 . . . . 53 ILE CA . 27040 1 592 . 1 1 53 53 ILE CB C 13 38.707 0.15 . 1 . . . . 53 ILE CB . 27040 1 593 . 1 1 53 53 ILE CG1 C 13 26.606 0.2 . 1 . . . . 53 ILE CG1 . 27040 1 594 . 1 1 53 53 ILE CG2 C 13 17.288 0.2 . 1 . . . . 53 ILE CG2 . 27040 1 595 . 1 1 53 53 ILE CD1 C 13 11.057 0.2 . 1 . . . . 53 ILE CD1 . 27040 1 596 . 1 1 53 53 ILE N N 15 126.093 0.05 . 1 . . . . 53 ILE N . 27040 1 597 . 1 1 54 54 LYS H H 1 9.429 0.01 . 1 . . . . 54 LYS H . 27040 1 598 . 1 1 54 54 LYS HA H 1 5.221 0.05 . 1 . . . . 54 LYS HA . 27040 1 599 . 1 1 54 54 LYS HB2 H 1 1.512 0.05 . 1 . . . . 54 LYS HB2 . 27040 1 600 . 1 1 54 54 LYS HB3 H 1 1.512 0.05 . 1 . . . . 54 LYS HB3 . 27040 1 601 . 1 1 54 54 LYS HG2 H 1 1.436 0.05 . 1 . . . . 54 LYS HG2 . 27040 1 602 . 1 1 54 54 LYS HG3 H 1 1.436 0.05 . 1 . . . . 54 LYS HG3 . 27040 1 603 . 1 1 54 54 LYS HD2 H 1 1.478 0.05 . 1 . . . . 54 LYS HD2 . 27040 1 604 . 1 1 54 54 LYS HD3 H 1 1.478 0.05 . 1 . . . . 54 LYS HD3 . 27040 1 605 . 1 1 54 54 LYS HE2 H 1 2.901 0.05 . 1 . . . . 54 LYS HE2 . 27040 1 606 . 1 1 54 54 LYS HE3 H 1 2.901 0.05 . 1 . . . . 54 LYS HE3 . 27040 1 607 . 1 1 54 54 LYS C C 13 174.601 0.1 . 1 . . . . 54 LYS C . 27040 1 608 . 1 1 54 54 LYS CA C 13 54.069 0.15 . 1 . . . . 54 LYS CA . 27040 1 609 . 1 1 54 54 LYS CB C 13 36.071 0.15 . 1 . . . . 54 LYS CB . 27040 1 610 . 1 1 54 54 LYS CG C 13 24.254 0.2 . 1 . . . . 54 LYS CG . 27040 1 611 . 1 1 54 54 LYS CD C 13 29.302 0.2 . 1 . . . . 54 LYS CD . 27040 1 612 . 1 1 54 54 LYS CE C 13 41.356 0.2 . 1 . . . . 54 LYS CE . 27040 1 613 . 1 1 54 54 LYS N N 15 127.214 0.05 . 1 . . . . 54 LYS N . 27040 1 614 . 1 1 55 55 LYS H H 1 9.524 0.01 . 1 . . . . 55 LYS H . 27040 1 615 . 1 1 55 55 LYS HA H 1 4.988 0.05 . 1 . . . . 55 LYS HA . 27040 1 616 . 1 1 55 55 LYS HD2 H 1 1.257 0.05 . 1 . . . . 55 LYS HD2 . 27040 1 617 . 1 1 55 55 LYS HD3 H 1 1.257 0.05 . 1 . . . . 55 LYS HD3 . 27040 1 618 . 1 1 55 55 LYS C C 13 173.674 0.1 . 1 . . . . 55 LYS C . 27040 1 619 . 1 1 55 55 LYS CA C 13 54.813 0.15 . 1 . . . . 55 LYS CA . 27040 1 620 . 1 1 55 55 LYS CB C 13 36.250 0.15 . 1 . . . . 55 LYS CB . 27040 1 621 . 1 1 55 55 LYS CG C 13 25.305 0.2 . 1 . . . . 55 LYS CG . 27040 1 622 . 1 1 55 55 LYS CD C 13 30.237 0.2 . 1 . . . . 55 LYS CD . 27040 1 623 . 1 1 55 55 LYS CE C 13 41.211 0.2 . 1 . . . . 55 LYS CE . 27040 1 624 . 1 1 55 55 LYS N N 15 124.872 0.05 . 1 . . . . 55 LYS N . 27040 1 625 . 1 1 56 56 ILE H H 1 9.072 0.01 . 1 . . . . 56 ILE H . 27040 1 626 . 1 1 56 56 ILE HA H 1 4.167 0.05 . 1 . . . . 56 ILE HA . 27040 1 627 . 1 1 56 56 ILE HB H 1 1.643 0.05 . 1 . . . . 56 ILE HB . 27040 1 628 . 1 1 56 56 ILE HG12 H 1 1.158 0.05 . 1 . . . . 56 ILE HG12 . 27040 1 629 . 1 1 56 56 ILE HG13 H 1 1.158 0.05 . 1 . . . . 56 ILE HG13 . 27040 1 630 . 1 1 56 56 ILE HG21 H 1 0.235 0.05 . 1 . . . . 56 ILE MG . 27040 1 631 . 1 1 56 56 ILE HG22 H 1 0.235 0.05 . 1 . . . . 56 ILE MG . 27040 1 632 . 1 1 56 56 ILE HG23 H 1 0.235 0.05 . 1 . . . . 56 ILE MG . 27040 1 633 . 1 1 56 56 ILE HD11 H 1 0.757 0.05 . 1 . . . . 56 ILE MD . 27040 1 634 . 1 1 56 56 ILE HD12 H 1 0.757 0.05 . 1 . . . . 56 ILE MD . 27040 1 635 . 1 1 56 56 ILE HD13 H 1 0.757 0.05 . 1 . . . . 56 ILE MD . 27040 1 636 . 1 1 56 56 ILE C C 13 173.652 0.1 . 1 . . . . 56 ILE C . 27040 1 637 . 1 1 56 56 ILE CA C 13 60.549 0.15 . 1 . . . . 56 ILE CA . 27040 1 638 . 1 1 56 56 ILE CB C 13 38.307 0.15 . 1 . . . . 56 ILE CB . 27040 1 639 . 1 1 56 56 ILE CG1 C 13 28.624 0.2 . 1 . . . . 56 ILE CG1 . 27040 1 640 . 1 1 56 56 ILE CG2 C 13 19.161 0.2 . 1 . . . . 56 ILE CG2 . 27040 1 641 . 1 1 56 56 ILE CD1 C 13 14.369 0.2 . 1 . . . . 56 ILE CD1 . 27040 1 642 . 1 1 56 56 ILE N N 15 128.643 0.05 . 1 . . . . 56 ILE N . 27040 1 643 . 1 1 57 57 ASN H H 1 8.342 0.01 . 1 . . . . 57 ASN H . 27040 1 644 . 1 1 57 57 ASN HA H 1 5.134 0.05 . 1 . . . . 57 ASN HA . 27040 1 645 . 1 1 57 57 ASN HB2 H 1 2.687 0.05 . 1 . . . . 57 ASN HB2 . 27040 1 646 . 1 1 57 57 ASN HB3 H 1 2.687 0.05 . 1 . . . . 57 ASN HB3 . 27040 1 647 . 1 1 57 57 ASN HD21 H 1 7.107 0.05 . 1 . . . . 57 ASN HD21 . 27040 1 648 . 1 1 57 57 ASN HD22 H 1 6.956 0.05 . 1 . . . . 57 ASN HD22 . 27040 1 649 . 1 1 57 57 ASN C C 13 174.614 0.1 . 1 . . . . 57 ASN C . 27040 1 650 . 1 1 57 57 ASN CA C 13 52.649 0.15 . 1 . . . . 57 ASN CA . 27040 1 651 . 1 1 57 57 ASN CB C 13 40.781 0.15 . 1 . . . . 57 ASN CB . 27040 1 652 . 1 1 57 57 ASN CG C 13 176.112 0.2 . 1 . . . . 57 ASN CG . 27040 1 653 . 1 1 57 57 ASN N N 15 122.353 0.05 . 1 . . . . 57 ASN N . 27040 1 654 . 1 1 57 57 ASN ND2 N 15 114.622 0.05 . 1 . . . . 57 ASN ND2 . 27040 1 655 . 1 1 58 58 PHE H H 1 8.133 0.01 . 1 . . . . 58 PHE H . 27040 1 656 . 1 1 58 58 PHE HA H 1 4.173 0.05 . 1 . . . . 58 PHE HA . 27040 1 657 . 1 1 58 58 PHE HB2 H 1 2.908 0.05 . 1 . . . . 58 PHE HB2 . 27040 1 658 . 1 1 58 58 PHE HB3 H 1 2.908 0.05 . 1 . . . . 58 PHE HB3 . 27040 1 659 . 1 1 58 58 PHE CA C 13 56.422 0.15 . 1 . . . . 58 PHE CA . 27040 1 660 . 1 1 58 58 PHE CB C 13 39.086 0.15 . 1 . . . . 58 PHE CB . 27040 1 661 . 1 1 58 58 PHE N N 15 122.079 0.05 . 1 . . . . 58 PHE N . 27040 1 662 . 1 1 59 59 PRO HA H 1 4.522 0.05 . 1 . . . . 59 PRO HA . 27040 1 663 . 1 1 59 59 PRO HB2 H 1 2.003 0.05 . 2 . . . . 59 PRO HB2 . 27040 1 664 . 1 1 59 59 PRO HB3 H 1 2.362 0.05 . 2 . . . . 59 PRO HB3 . 27040 1 665 . 1 1 59 59 PRO HG2 H 1 1.733 0.05 . 1 . . . . 59 PRO HG2 . 27040 1 666 . 1 1 59 59 PRO HG3 H 1 1.733 0.05 . 1 . . . . 59 PRO HG3 . 27040 1 667 . 1 1 59 59 PRO HD2 H 1 3.109 0.05 . 2 . . . . 59 PRO HD2 . 27040 1 668 . 1 1 59 59 PRO HD3 H 1 3.454 0.05 . 2 . . . . 59 PRO HD3 . 27040 1 669 . 1 1 59 59 PRO C C 13 176.018 0.1 . 1 . . . . 59 PRO C . 27040 1 670 . 1 1 59 59 PRO CA C 13 62.344 0.15 . 1 . . . . 59 PRO CA . 27040 1 671 . 1 1 59 59 PRO CB C 13 32.604 0.15 . 1 . . . . 59 PRO CB . 27040 1 672 . 1 1 59 59 PRO CG C 13 27.138 0.2 . 1 . . . . 59 PRO CG . 27040 1 673 . 1 1 59 59 PRO CD C 13 50.877 0.2 . 1 . . . . 59 PRO CD . 27040 1 674 . 1 1 60 60 GLU H H 1 8.475 0.01 . 1 . . . . 60 GLU H . 27040 1 675 . 1 1 60 60 GLU HA H 1 4.136 0.05 . 1 . . . . 60 GLU HA . 27040 1 676 . 1 1 60 60 GLU HB2 H 1 2.364 0.05 . 1 . . . . 60 GLU HB2 . 27040 1 677 . 1 1 60 60 GLU HB3 H 1 2.364 0.05 . 1 . . . . 60 GLU HB3 . 27040 1 678 . 1 1 60 60 GLU HG2 H 1 2.364 0.05 . 1 . . . . 60 GLU HG2 . 27040 1 679 . 1 1 60 60 GLU HG3 H 1 2.364 0.05 . 1 . . . . 60 GLU HG3 . 27040 1 680 . 1 1 60 60 GLU C C 13 177.414 0.1 . 1 . . . . 60 GLU C . 27040 1 681 . 1 1 60 60 GLU CA C 13 58.182 0.15 . 1 . . . . 60 GLU CA . 27040 1 682 . 1 1 60 60 GLU CB C 13 29.704 0.15 . 1 . . . . 60 GLU CB . 27040 1 683 . 1 1 60 60 GLU CG C 13 36.163 0.2 . 1 . . . . 60 GLU CG . 27040 1 684 . 1 1 60 60 GLU N N 15 120.253 0.05 . 1 . . . . 60 GLU N . 27040 1 685 . 1 1 61 61 GLY H H 1 8.833 0.01 . 1 . . . . 61 GLY H . 27040 1 686 . 1 1 61 61 GLY HA2 H 1 3.668 0.05 . 2 . . . . 61 GLY HA2 . 27040 1 687 . 1 1 61 61 GLY HA3 H 1 4.336 0.05 . 2 . . . . 61 GLY HA3 . 27040 1 688 . 1 1 61 61 GLY C C 13 174.450 0.1 . 1 . . . . 61 GLY C . 27040 1 689 . 1 1 61 61 GLY CA C 13 44.988 0.15 . 1 . . . . 61 GLY CA . 27040 1 690 . 1 1 61 61 GLY N N 15 112.523 0.05 . 1 . . . . 61 GLY N . 27040 1 691 . 1 1 62 62 PHE H H 1 7.826 0.01 . 1 . . . . 62 PHE H . 27040 1 692 . 1 1 62 62 PHE HA H 1 4.612 0.05 . 1 . . . . 62 PHE HA . 27040 1 693 . 1 1 62 62 PHE HB2 H 1 2.882 0.05 . 2 . . . . 62 PHE HB2 . 27040 1 694 . 1 1 62 62 PHE HB3 H 1 3.271 0.05 . 2 . . . . 62 PHE HB3 . 27040 1 695 . 1 1 62 62 PHE CA C 13 57.298 0.15 . 1 . . . . 62 PHE CA . 27040 1 696 . 1 1 62 62 PHE CB C 13 39.721 0.15 . 1 . . . . 62 PHE CB . 27040 1 697 . 1 1 62 62 PHE N N 15 123.620 0.05 . 1 . . . . 62 PHE N . 27040 1 698 . 1 1 63 63 PRO HA H 1 4.116 0.05 . 1 . . . . 63 PRO HA . 27040 1 699 . 1 1 63 63 PRO HB2 H 1 1.258 0.05 . 2 . . . . 63 PRO HB2 . 27040 1 700 . 1 1 63 63 PRO HB3 H 1 2.036 0.05 . 2 . . . . 63 PRO HB3 . 27040 1 701 . 1 1 63 63 PRO HG2 H 1 1.611 0.05 . 1 . . . . 63 PRO HG2 . 27040 1 702 . 1 1 63 63 PRO HG3 H 1 1.611 0.05 . 1 . . . . 63 PRO HG3 . 27040 1 703 . 1 1 63 63 PRO HD2 H 1 3.258 0.05 . 1 . . . . 63 PRO HD2 . 27040 1 704 . 1 1 63 63 PRO HD3 H 1 3.258 0.05 . 1 . . . . 63 PRO HD3 . 27040 1 705 . 1 1 63 63 PRO C C 13 175.093 0.1 . 1 . . . . 63 PRO C . 27040 1 706 . 1 1 63 63 PRO CA C 13 64.608 0.15 . 1 . . . . 63 PRO CA . 27040 1 707 . 1 1 63 63 PRO CB C 13 31.504 0.15 . 1 . . . . 63 PRO CB . 27040 1 708 . 1 1 63 63 PRO CG C 13 27.214 0.2 . 1 . . . . 63 PRO CG . 27040 1 709 . 1 1 63 63 PRO CD C 13 50.300 0.2 . 1 . . . . 63 PRO CD . 27040 1 710 . 1 1 64 64 PHE H H 1 6.478 0.01 . 1 . . . . 64 PHE H . 27040 1 711 . 1 1 64 64 PHE HA H 1 5.075 0.05 . 1 . . . . 64 PHE HA . 27040 1 712 . 1 1 64 64 PHE HB2 H 1 2.901 0.05 . 2 . . . . 64 PHE HB2 . 27040 1 713 . 1 1 64 64 PHE HB3 H 1 3.325 0.05 . 2 . . . . 64 PHE HB3 . 27040 1 714 . 1 1 64 64 PHE C C 13 175.095 0.1 . 1 . . . . 64 PHE C . 27040 1 715 . 1 1 64 64 PHE CA C 13 53.640 0.15 . 1 . . . . 64 PHE CA . 27040 1 716 . 1 1 64 64 PHE CB C 13 40.764 0.15 . 1 . . . . 64 PHE CB . 27040 1 717 . 1 1 64 64 PHE N N 15 112.377 0.05 . 1 . . . . 64 PHE N . 27040 1 718 . 1 1 65 65 LYS H H 1 9.042 0.01 . 1 . . . . 65 LYS H . 27040 1 719 . 1 1 65 65 LYS HA H 1 4.756 0.05 . 1 . . . . 65 LYS HA . 27040 1 720 . 1 1 65 65 LYS HB2 H 1 1.991 0.05 . 2 . . . . 65 LYS HB2 . 27040 1 721 . 1 1 65 65 LYS HB3 H 1 2.242 0.05 . 2 . . . . 65 LYS HB3 . 27040 1 722 . 1 1 65 65 LYS HG2 H 1 1.783 0.05 . 1 . . . . 65 LYS HG2 . 27040 1 723 . 1 1 65 65 LYS HG3 H 1 1.783 0.05 . 1 . . . . 65 LYS HG3 . 27040 1 724 . 1 1 65 65 LYS HD2 H 1 1.878 0.05 . 1 . . . . 65 LYS HD2 . 27040 1 725 . 1 1 65 65 LYS HD3 H 1 1.878 0.05 . 1 . . . . 65 LYS HD3 . 27040 1 726 . 1 1 65 65 LYS HE2 H 1 3.132 0.05 . 1 . . . . 65 LYS HE2 . 27040 1 727 . 1 1 65 65 LYS HE3 H 1 3.132 0.05 . 1 . . . . 65 LYS HE3 . 27040 1 728 . 1 1 65 65 LYS C C 13 177.821 0.1 . 1 . . . . 65 LYS C . 27040 1 729 . 1 1 65 65 LYS CA C 13 58.569 0.15 . 1 . . . . 65 LYS CA . 27040 1 730 . 1 1 65 65 LYS CB C 13 34.002 0.15 . 1 . . . . 65 LYS CB . 27040 1 731 . 1 1 65 65 LYS CG C 13 25.456 0.2 . 1 . . . . 65 LYS CG . 27040 1 732 . 1 1 65 65 LYS CD C 13 28.803 0.2 . 1 . . . . 65 LYS CD . 27040 1 733 . 1 1 65 65 LYS CE C 13 42.351 0.2 . 1 . . . . 65 LYS CE . 27040 1 734 . 1 1 65 65 LYS N N 15 118.927 0.05 . 1 . . . . 65 LYS N . 27040 1 735 . 1 1 66 66 TYR H H 1 7.654 0.01 . 1 . . . . 66 TYR H . 27040 1 736 . 1 1 66 66 TYR HA H 1 5.981 0.05 . 1 . . . . 66 TYR HA . 27040 1 737 . 1 1 66 66 TYR HB2 H 1 2.915 0.05 . 2 . . . . 66 TYR HB2 . 27040 1 738 . 1 1 66 66 TYR HB3 H 1 3.336 0.05 . 2 . . . . 66 TYR HB3 . 27040 1 739 . 1 1 66 66 TYR C C 13 174.834 0.1 . 1 . . . . 66 TYR C . 27040 1 740 . 1 1 66 66 TYR CA C 13 56.786 0.15 . 1 . . . . 66 TYR CA . 27040 1 741 . 1 1 66 66 TYR CB C 13 41.145 0.15 . 1 . . . . 66 TYR CB . 27040 1 742 . 1 1 66 66 TYR N N 15 113.808 0.05 . 1 . . . . 66 TYR N . 27040 1 743 . 1 1 67 67 VAL H H 1 8.546 0.01 . 1 . . . . 67 VAL H . 27040 1 744 . 1 1 67 67 VAL HA H 1 4.841 0.05 . 1 . . . . 67 VAL HA . 27040 1 745 . 1 1 67 67 VAL HB H 1 2.353 0.05 . 1 . . . . 67 VAL HB . 27040 1 746 . 1 1 67 67 VAL HG11 H 1 0.965 0.05 . 2 . . . . 67 VAL MG1 . 27040 1 747 . 1 1 67 67 VAL HG12 H 1 0.965 0.05 . 2 . . . . 67 VAL MG1 . 27040 1 748 . 1 1 67 67 VAL HG13 H 1 0.965 0.05 . 2 . . . . 67 VAL MG1 . 27040 1 749 . 1 1 67 67 VAL HG21 H 1 1.007 0.05 . 2 . . . . 67 VAL MG2 . 27040 1 750 . 1 1 67 67 VAL HG22 H 1 1.007 0.05 . 2 . . . . 67 VAL MG2 . 27040 1 751 . 1 1 67 67 VAL HG23 H 1 1.007 0.05 . 2 . . . . 67 VAL MG2 . 27040 1 752 . 1 1 67 67 VAL C C 13 175.182 0.1 . 1 . . . . 67 VAL C . 27040 1 753 . 1 1 67 67 VAL CA C 13 60.535 0.15 . 1 . . . . 67 VAL CA . 27040 1 754 . 1 1 67 67 VAL CB C 13 36.365 0.15 . 1 . . . . 67 VAL CB . 27040 1 755 . 1 1 67 67 VAL CG1 C 13 22.446 0.2 . 2 . . . . 67 VAL CG1 . 27040 1 756 . 1 1 67 67 VAL CG2 C 13 19.921 0.2 . 2 . . . . 67 VAL CG2 . 27040 1 757 . 1 1 67 67 VAL N N 15 110.246 0.05 . 1 . . . . 67 VAL N . 27040 1 758 . 1 1 68 68 LYS H H 1 8.856 0.01 . 1 . . . . 68 LYS H . 27040 1 759 . 1 1 68 68 LYS HA H 1 5.639 0.05 . 1 . . . . 68 LYS HA . 27040 1 760 . 1 1 68 68 LYS HB2 H 1 1.631 0.05 . 1 . . . . 68 LYS HB2 . 27040 1 761 . 1 1 68 68 LYS HB3 H 1 1.631 0.05 . 1 . . . . 68 LYS HB3 . 27040 1 762 . 1 1 68 68 LYS HG2 H 1 0.901 0.05 . 1 . . . . 68 LYS HG2 . 27040 1 763 . 1 1 68 68 LYS HG3 H 1 0.901 0.05 . 1 . . . . 68 LYS HG3 . 27040 1 764 . 1 1 68 68 LYS HD2 H 1 1.574 0.05 . 1 . . . . 68 LYS HD2 . 27040 1 765 . 1 1 68 68 LYS HD3 H 1 1.574 0.05 . 1 . . . . 68 LYS HD3 . 27040 1 766 . 1 1 68 68 LYS HE2 H 1 2.684 0.05 . 1 . . . . 68 LYS HE2 . 27040 1 767 . 1 1 68 68 LYS HE3 H 1 2.684 0.05 . 1 . . . . 68 LYS HE3 . 27040 1 768 . 1 1 68 68 LYS C C 13 174.561 0.1 . 1 . . . . 68 LYS C . 27040 1 769 . 1 1 68 68 LYS CA C 13 55.329 0.15 . 1 . . . . 68 LYS CA . 27040 1 770 . 1 1 68 68 LYS CB C 13 36.118 0.15 . 1 . . . . 68 LYS CB . 27040 1 771 . 1 1 68 68 LYS CG C 13 26.053 0.2 . 1 . . . . 68 LYS CG . 27040 1 772 . 1 1 68 68 LYS CD C 13 29.730 0.2 . 1 . . . . 68 LYS CD . 27040 1 773 . 1 1 68 68 LYS CE C 13 41.133 0.2 . 1 . . . . 68 LYS CE . 27040 1 774 . 1 1 68 68 LYS N N 15 119.774 0.05 . 1 . . . . 68 LYS N . 27040 1 775 . 1 1 69 69 ASP H H 1 9.282 0.01 . 1 . . . . 69 ASP H . 27040 1 776 . 1 1 69 69 ASP HA H 1 5.982 0.05 . 1 . . . . 69 ASP HA . 27040 1 777 . 1 1 69 69 ASP HB2 H 1 2.555 0.05 . 1 . . . . 69 ASP HB2 . 27040 1 778 . 1 1 69 69 ASP HB3 H 1 2.555 0.05 . 1 . . . . 69 ASP HB3 . 27040 1 779 . 1 1 69 69 ASP C C 13 173.397 0.1 . 1 . . . . 69 ASP C . 27040 1 780 . 1 1 69 69 ASP CA C 13 50.204 0.15 . 1 . . . . 69 ASP CA . 27040 1 781 . 1 1 69 69 ASP CB C 13 40.946 0.15 . 1 . . . . 69 ASP CB . 27040 1 782 . 1 1 69 69 ASP N N 15 121.077 0.05 . 1 . . . . 69 ASP N . 27040 1 783 . 1 1 70 70 ARG H H 1 9.554 0.01 . 1 . . . . 70 ARG H . 27040 1 784 . 1 1 70 70 ARG HA H 1 5.507 0.05 . 1 . . . . 70 ARG HA . 27040 1 785 . 1 1 70 70 ARG HB2 H 1 1.402 0.05 . 1 . . . . 70 ARG HB2 . 27040 1 786 . 1 1 70 70 ARG HB3 H 1 1.402 0.05 . 1 . . . . 70 ARG HB3 . 27040 1 787 . 1 1 70 70 ARG HG2 H 1 1.360 0.05 . 1 . . . . 70 ARG HG2 . 27040 1 788 . 1 1 70 70 ARG HG3 H 1 1.360 0.05 . 1 . . . . 70 ARG HG3 . 27040 1 789 . 1 1 70 70 ARG HD2 H 1 3.145 0.05 . 1 . . . . 70 ARG HD2 . 27040 1 790 . 1 1 70 70 ARG HD3 H 1 3.145 0.05 . 1 . . . . 70 ARG HD3 . 27040 1 791 . 1 1 70 70 ARG C C 13 175.846 0.1 . 1 . . . . 70 ARG C . 27040 1 792 . 1 1 70 70 ARG CA C 13 53.451 0.15 . 1 . . . . 70 ARG CA . 27040 1 793 . 1 1 70 70 ARG CB C 13 34.187 0.15 . 1 . . . . 70 ARG CB . 27040 1 794 . 1 1 70 70 ARG CG C 13 27.319 0.2 . 1 . . . . 70 ARG CG . 27040 1 795 . 1 1 70 70 ARG CD C 13 43.494 0.2 . 1 . . . . 70 ARG CD . 27040 1 796 . 1 1 70 70 ARG N N 15 122.195 0.05 . 1 . . . . 70 ARG N . 27040 1 797 . 1 1 71 71 VAL H H 1 9.091 0.01 . 1 . . . . 71 VAL H . 27040 1 798 . 1 1 71 71 VAL HA H 1 3.657 0.05 . 1 . . . . 71 VAL HA . 27040 1 799 . 1 1 71 71 VAL HB H 1 2.069 0.05 . 1 . . . . 71 VAL HB . 27040 1 800 . 1 1 71 71 VAL HG11 H 1 0.944 0.05 . 2 . . . . 71 VAL MG1 . 27040 1 801 . 1 1 71 71 VAL HG12 H 1 0.944 0.05 . 2 . . . . 71 VAL MG1 . 27040 1 802 . 1 1 71 71 VAL HG13 H 1 0.944 0.05 . 2 . . . . 71 VAL MG1 . 27040 1 803 . 1 1 71 71 VAL HG21 H 1 0.725 0.05 . 2 . . . . 71 VAL MG2 . 27040 1 804 . 1 1 71 71 VAL HG22 H 1 0.725 0.05 . 2 . . . . 71 VAL MG2 . 27040 1 805 . 1 1 71 71 VAL HG23 H 1 0.725 0.05 . 2 . . . . 71 VAL MG2 . 27040 1 806 . 1 1 71 71 VAL C C 13 174.982 0.1 . 1 . . . . 71 VAL C . 27040 1 807 . 1 1 71 71 VAL CA C 13 64.057 0.15 . 1 . . . . 71 VAL CA . 27040 1 808 . 1 1 71 71 VAL CB C 13 31.988 0.15 . 1 . . . . 71 VAL CB . 27040 1 809 . 1 1 71 71 VAL CG1 C 13 21.221 0.2 . 2 . . . . 71 VAL CG1 . 27040 1 810 . 1 1 71 71 VAL CG2 C 13 21.221 0.2 . 2 . . . . 71 VAL CG2 . 27040 1 811 . 1 1 71 71 VAL N N 15 127.188 0.05 . 1 . . . . 71 VAL N . 27040 1 812 . 1 1 72 72 ASP H H 1 9.178 0.01 . 1 . . . . 72 ASP H . 27040 1 813 . 1 1 72 72 ASP HA H 1 4.958 0.05 . 1 . . . . 72 ASP HA . 27040 1 814 . 1 1 72 72 ASP HB2 H 1 2.147 0.05 . 2 . . . . 72 ASP HB2 . 27040 1 815 . 1 1 72 72 ASP HB3 H 1 2.712 0.05 . 2 . . . . 72 ASP HB3 . 27040 1 816 . 1 1 72 72 ASP C C 13 176.069 0.1 . 1 . . . . 72 ASP C . 27040 1 817 . 1 1 72 72 ASP CA C 13 56.227 0.15 . 1 . . . . 72 ASP CA . 27040 1 818 . 1 1 72 72 ASP CB C 13 43.309 0.15 . 1 . . . . 72 ASP CB . 27040 1 819 . 1 1 72 72 ASP N N 15 130.263 0.05 . 1 . . . . 72 ASP N . 27040 1 820 . 1 1 73 73 GLU H H 1 7.966 0.01 . 1 . . . . 73 GLU H . 27040 1 821 . 1 1 73 73 GLU HA H 1 4.542 0.05 . 1 . . . . 73 GLU HA . 27040 1 822 . 1 1 73 73 GLU HB2 H 1 2.155 0.05 . 1 . . . . 73 GLU HB2 . 27040 1 823 . 1 1 73 73 GLU HB3 H 1 2.155 0.05 . 1 . . . . 73 GLU HB3 . 27040 1 824 . 1 1 73 73 GLU HG2 H 1 2.233 0.05 . 1 . . . . 73 GLU HG2 . 27040 1 825 . 1 1 73 73 GLU HG3 H 1 2.233 0.05 . 1 . . . . 73 GLU HG3 . 27040 1 826 . 1 1 73 73 GLU C C 13 173.739 0.1 . 1 . . . . 73 GLU C . 27040 1 827 . 1 1 73 73 GLU CA C 13 56.872 0.15 . 1 . . . . 73 GLU CA . 27040 1 828 . 1 1 73 73 GLU CB C 13 34.044 0.15 . 1 . . . . 73 GLU CB . 27040 1 829 . 1 1 73 73 GLU CG C 13 36.620 0.2 . 1 . . . . 73 GLU CG . 27040 1 830 . 1 1 73 73 GLU N N 15 117.744 0.05 . 1 . . . . 73 GLU N . 27040 1 831 . 1 1 74 74 VAL H H 1 8.725 0.01 . 1 . . . . 74 VAL H . 27040 1 832 . 1 1 74 74 VAL HA H 1 4.764 0.05 . 1 . . . . 74 VAL HA . 27040 1 833 . 1 1 74 74 VAL HB H 1 2.223 0.05 . 1 . . . . 74 VAL HB . 27040 1 834 . 1 1 74 74 VAL HG11 H 1 1.115 0.05 . 2 . . . . 74 VAL MG1 . 27040 1 835 . 1 1 74 74 VAL HG12 H 1 1.115 0.05 . 2 . . . . 74 VAL MG1 . 27040 1 836 . 1 1 74 74 VAL HG13 H 1 1.115 0.05 . 2 . . . . 74 VAL MG1 . 27040 1 837 . 1 1 74 74 VAL HG21 H 1 0.944 0.05 . 2 . . . . 74 VAL MG2 . 27040 1 838 . 1 1 74 74 VAL HG22 H 1 0.944 0.05 . 2 . . . . 74 VAL MG2 . 27040 1 839 . 1 1 74 74 VAL HG23 H 1 0.944 0.05 . 2 . . . . 74 VAL MG2 . 27040 1 840 . 1 1 74 74 VAL C C 13 173.883 0.1 . 1 . . . . 74 VAL C . 27040 1 841 . 1 1 74 74 VAL CA C 13 62.315 0.15 . 1 . . . . 74 VAL CA . 27040 1 842 . 1 1 74 74 VAL CB C 13 34.388 0.15 . 1 . . . . 74 VAL CB . 27040 1 843 . 1 1 74 74 VAL CG1 C 13 21.162 0.2 . 1 . . . . 74 VAL CG1 . 27040 1 844 . 1 1 74 74 VAL CG2 C 13 21.162 0.2 . 1 . . . . 74 VAL CG2 . 27040 1 845 . 1 1 74 74 VAL N N 15 122.744 0.05 . 1 . . . . 74 VAL N . 27040 1 846 . 1 1 75 75 ASP H H 1 9.205 0.01 . 1 . . . . 75 ASP H . 27040 1 847 . 1 1 75 75 ASP HA H 1 5.206 0.05 . 1 . . . . 75 ASP HA . 27040 1 848 . 1 1 75 75 ASP HB2 H 1 2.987 0.05 . 1 . . . . 75 ASP HB2 . 27040 1 849 . 1 1 75 75 ASP HB3 H 1 2.987 0.05 . 1 . . . . 75 ASP HB3 . 27040 1 850 . 1 1 75 75 ASP C C 13 176.684 0.1 . 1 . . . . 75 ASP C . 27040 1 851 . 1 1 75 75 ASP CA C 13 52.317 0.15 . 1 . . . . 75 ASP CA . 27040 1 852 . 1 1 75 75 ASP CB C 13 42.753 0.15 . 1 . . . . 75 ASP CB . 27040 1 853 . 1 1 75 75 ASP N N 15 126.844 0.05 . 1 . . . . 75 ASP N . 27040 1 854 . 1 1 76 76 HIS H H 1 8.978 0.01 . 1 . . . . 76 HIS H . 27040 1 855 . 1 1 76 76 HIS HA H 1 4.814 0.05 . 1 . . . . 76 HIS HA . 27040 1 856 . 1 1 76 76 HIS HB2 H 1 3.256 0.05 . 2 . . . . 76 HIS HB2 . 27040 1 857 . 1 1 76 76 HIS HB3 H 1 3.344 0.05 . 2 . . . . 76 HIS HB3 . 27040 1 858 . 1 1 76 76 HIS C C 13 176.454 0.1 . 1 . . . . 76 HIS C . 27040 1 859 . 1 1 76 76 HIS CA C 13 59.141 0.15 . 1 . . . . 76 HIS CA . 27040 1 860 . 1 1 76 76 HIS CB C 13 31.166 0.15 . 1 . . . . 76 HIS CB . 27040 1 861 . 1 1 76 76 HIS N N 15 122.639 0.05 . 1 . . . . 76 HIS N . 27040 1 862 . 1 1 77 77 THR H H 1 8.223 0.01 . 1 . . . . 77 THR H . 27040 1 863 . 1 1 77 77 THR HA H 1 3.982 0.05 . 1 . . . . 77 THR HA . 27040 1 864 . 1 1 77 77 THR HB H 1 3.881 0.05 . 1 . . . . 77 THR HB . 27040 1 865 . 1 1 77 77 THR HG21 H 1 1.066 0.05 . 1 . . . . 77 THR MG . 27040 1 866 . 1 1 77 77 THR HG22 H 1 1.066 0.05 . 1 . . . . 77 THR MG . 27040 1 867 . 1 1 77 77 THR HG23 H 1 1.066 0.05 . 1 . . . . 77 THR MG . 27040 1 868 . 1 1 77 77 THR C C 13 174.213 0.1 . 1 . . . . 77 THR C . 27040 1 869 . 1 1 77 77 THR CA C 13 64.732 0.15 . 1 . . . . 77 THR CA . 27040 1 870 . 1 1 77 77 THR CB C 13 68.827 0.15 . 1 . . . . 77 THR CB . 27040 1 871 . 1 1 77 77 THR CG2 C 13 21.694 0.2 . 1 . . . . 77 THR CG2 . 27040 1 872 . 1 1 77 77 THR N N 15 114.305 0.05 . 1 . . . . 77 THR N . 27040 1 873 . 1 1 78 78 ASN H H 1 7.561 0.01 . 1 . . . . 78 ASN H . 27040 1 874 . 1 1 78 78 ASN HA H 1 4.324 0.05 . 1 . . . . 78 ASN HA . 27040 1 875 . 1 1 78 78 ASN HB2 H 1 2.177 0.05 . 2 . . . . 78 ASN HB2 . 27040 1 876 . 1 1 78 78 ASN HB3 H 1 2.644 0.05 . 2 . . . . 78 ASN HB3 . 27040 1 877 . 1 1 78 78 ASN HD21 H 1 8.631 0.05 . 1 . . . . 78 ASN HD21 . 27040 1 878 . 1 1 78 78 ASN HD22 H 1 6.964 0.05 . 1 . . . . 78 ASN HD22 . 27040 1 879 . 1 1 78 78 ASN C C 13 172.745 0.1 . 1 . . . . 78 ASN C . 27040 1 880 . 1 1 78 78 ASN CA C 13 52.277 0.15 . 1 . . . . 78 ASN CA . 27040 1 881 . 1 1 78 78 ASN CB C 13 39.305 0.15 . 1 . . . . 78 ASN CB . 27040 1 882 . 1 1 78 78 ASN CG C 13 177.250 0.2 . 1 . . . . 78 ASN CG . 27040 1 883 . 1 1 78 78 ASN N N 15 116.179 0.05 . 1 . . . . 78 ASN N . 27040 1 884 . 1 1 78 78 ASN ND2 N 15 118.152 0.05 . 1 . . . . 78 ASN ND2 . 27040 1 885 . 1 1 79 79 PHE H H 1 6.762 0.01 . 1 . . . . 79 PHE H . 27040 1 886 . 1 1 79 79 PHE HA H 1 3.913 0.05 . 1 . . . . 79 PHE HA . 27040 1 887 . 1 1 79 79 PHE HB2 H 1 2.441 0.05 . 2 . . . . 79 PHE HB2 . 27040 1 888 . 1 1 79 79 PHE HB3 H 1 2.792 0.05 . 2 . . . . 79 PHE HB3 . 27040 1 889 . 1 1 79 79 PHE C C 13 173.168 0.1 . 1 . . . . 79 PHE C . 27040 1 890 . 1 1 79 79 PHE CA C 13 55.389 0.15 . 1 . . . . 79 PHE CA . 27040 1 891 . 1 1 79 79 PHE CB C 13 35.349 0.15 . 1 . . . . 79 PHE CB . 27040 1 892 . 1 1 79 79 PHE N N 15 116.293 0.05 . 1 . . . . 79 PHE N . 27040 1 893 . 1 1 80 80 LYS H H 1 7.853 0.01 . 1 . . . . 80 LYS H . 27040 1 894 . 1 1 80 80 LYS HA H 1 5.631 0.05 . 1 . . . . 80 LYS HA . 27040 1 895 . 1 1 80 80 LYS HB2 H 1 1.935 0.05 . 1 . . . . 80 LYS HB2 . 27040 1 896 . 1 1 80 80 LYS HB3 H 1 1.935 0.05 . 1 . . . . 80 LYS HB3 . 27040 1 897 . 1 1 80 80 LYS HG2 H 1 1.389 0.05 . 1 . . . . 80 LYS HG2 . 27040 1 898 . 1 1 80 80 LYS HG3 H 1 1.389 0.05 . 1 . . . . 80 LYS HG3 . 27040 1 899 . 1 1 80 80 LYS HD2 H 1 1.452 0.05 . 1 . . . . 80 LYS HD2 . 27040 1 900 . 1 1 80 80 LYS HD3 H 1 1.452 0.05 . 1 . . . . 80 LYS HD3 . 27040 1 901 . 1 1 80 80 LYS HE2 H 1 2.912 0.05 . 1 . . . . 80 LYS HE2 . 27040 1 902 . 1 1 80 80 LYS HE3 H 1 2.912 0.05 . 1 . . . . 80 LYS HE3 . 27040 1 903 . 1 1 80 80 LYS C C 13 174.721 0.1 . 1 . . . . 80 LYS C . 27040 1 904 . 1 1 80 80 LYS CA C 13 54.582 0.15 . 1 . . . . 80 LYS CA . 27040 1 905 . 1 1 80 80 LYS CB C 13 36.939 0.15 . 1 . . . . 80 LYS CB . 27040 1 906 . 1 1 80 80 LYS CG C 13 24.922 0.2 . 1 . . . . 80 LYS CG . 27040 1 907 . 1 1 80 80 LYS CD C 13 29.581 0.2 . 1 . . . . 80 LYS CD . 27040 1 908 . 1 1 80 80 LYS CE C 13 41.773 0.2 . 1 . . . . 80 LYS CE . 27040 1 909 . 1 1 80 80 LYS N N 15 117.612 0.05 . 1 . . . . 80 LYS N . 27040 1 910 . 1 1 81 81 TYR H H 1 9.317 0.01 . 1 . . . . 81 TYR H . 27040 1 911 . 1 1 81 81 TYR HA H 1 5.233 0.05 . 1 . . . . 81 TYR HA . 27040 1 912 . 1 1 81 81 TYR HB2 H 1 2.910 0.05 . 1 . . . . 81 TYR HB2 . 27040 1 913 . 1 1 81 81 TYR HB3 H 1 2.910 0.05 . 1 . . . . 81 TYR HB3 . 27040 1 914 . 1 1 81 81 TYR C C 13 172.824 0.1 . 1 . . . . 81 TYR C . 27040 1 915 . 1 1 81 81 TYR CA C 13 57.571 0.15 . 1 . . . . 81 TYR CA . 27040 1 916 . 1 1 81 81 TYR CB C 13 44.230 0.15 . 1 . . . . 81 TYR CB . 27040 1 917 . 1 1 81 81 TYR N N 15 127.361 0.05 . 1 . . . . 81 TYR N . 27040 1 918 . 1 1 82 82 ASN H H 1 8.911 0.01 . 1 . . . . 82 ASN H . 27040 1 919 . 1 1 82 82 ASN HA H 1 5.890 0.05 . 1 . . . . 82 ASN HA . 27040 1 920 . 1 1 82 82 ASN HB2 H 1 3.076 0.05 . 2 . . . . 82 ASN HB2 . 27040 1 921 . 1 1 82 82 ASN HB3 H 1 2.585 0.05 . 2 . . . . 82 ASN HB3 . 27040 1 922 . 1 1 82 82 ASN HD22 H 1 7.301 0.05 . 1 . . . . 82 ASN HD22 . 27040 1 923 . 1 1 82 82 ASN C C 13 174.218 0.1 . 1 . . . . 82 ASN C . 27040 1 924 . 1 1 82 82 ASN CA C 13 51.597 0.15 . 1 . . . . 82 ASN CA . 27040 1 925 . 1 1 82 82 ASN CB C 13 40.333 0.15 . 1 . . . . 82 ASN CB . 27040 1 926 . 1 1 82 82 ASN CG C 13 175.058 0.2 . 1 . . . . 82 ASN CG . 27040 1 927 . 1 1 82 82 ASN N N 15 125.337 0.05 . 1 . . . . 82 ASN N . 27040 1 928 . 1 1 82 82 ASN ND2 N 15 110.461 0.05 . 1 . . . . 82 ASN ND2 . 27040 1 929 . 1 1 83 83 TYR H H 1 8.671 0.01 . 1 . . . . 83 TYR H . 27040 1 930 . 1 1 83 83 TYR HA H 1 5.374 0.05 . 1 . . . . 83 TYR HA . 27040 1 931 . 1 1 83 83 TYR HB2 H 1 2.702 0.05 . 1 . . . . 83 TYR HB2 . 27040 1 932 . 1 1 83 83 TYR HB3 H 1 2.702 0.05 . 1 . . . . 83 TYR HB3 . 27040 1 933 . 1 1 83 83 TYR C C 13 173.299 0.1 . 1 . . . . 83 TYR C . 27040 1 934 . 1 1 83 83 TYR CA C 13 56.611 0.15 . 1 . . . . 83 TYR CA . 27040 1 935 . 1 1 83 83 TYR CB C 13 40.324 0.15 . 1 . . . . 83 TYR CB . 27040 1 936 . 1 1 83 83 TYR N N 15 120.784 0.05 . 1 . . . . 83 TYR N . 27040 1 937 . 1 1 84 84 SER H H 1 9.624 0.01 . 1 . . . . 84 SER H . 27040 1 938 . 1 1 84 84 SER HA H 1 5.623 0.05 . 1 . . . . 84 SER HA . 27040 1 939 . 1 1 84 84 SER HB2 H 1 3.452 0.05 . 2 . . . . 84 SER HB2 . 27040 1 940 . 1 1 84 84 SER HB3 H 1 3.686 0.05 . 2 . . . . 84 SER HB3 . 27040 1 941 . 1 1 84 84 SER C C 13 173.579 0.1 . 1 . . . . 84 SER C . 27040 1 942 . 1 1 84 84 SER CA C 13 57.457 0.15 . 1 . . . . 84 SER CA . 27040 1 943 . 1 1 84 84 SER CB C 13 66.127 0.15 . 1 . . . . 84 SER CB . 27040 1 944 . 1 1 84 84 SER N N 15 117.866 0.05 . 1 . . . . 84 SER N . 27040 1 945 . 1 1 85 85 VAL H H 1 9.637 0.01 . 1 . . . . 85 VAL H . 27040 1 946 . 1 1 85 85 VAL HA H 1 4.667 0.05 . 1 . . . . 85 VAL HA . 27040 1 947 . 1 1 85 85 VAL HB H 1 2.081 0.05 . 1 . . . . 85 VAL HB . 27040 1 948 . 1 1 85 85 VAL HG11 H 1 1.056 0.05 . 1 . . . . 85 VAL MG1 . 27040 1 949 . 1 1 85 85 VAL HG12 H 1 1.056 0.05 . 1 . . . . 85 VAL MG1 . 27040 1 950 . 1 1 85 85 VAL HG13 H 1 1.056 0.05 . 1 . . . . 85 VAL MG1 . 27040 1 951 . 1 1 85 85 VAL HG21 H 1 1.056 0.05 . 1 . . . . 85 VAL MG2 . 27040 1 952 . 1 1 85 85 VAL HG22 H 1 1.056 0.05 . 1 . . . . 85 VAL MG2 . 27040 1 953 . 1 1 85 85 VAL HG23 H 1 1.056 0.05 . 1 . . . . 85 VAL MG2 . 27040 1 954 . 1 1 85 85 VAL C C 13 176.971 0.1 . 1 . . . . 85 VAL C . 27040 1 955 . 1 1 85 85 VAL CA C 13 62.430 0.15 . 1 . . . . 85 VAL CA . 27040 1 956 . 1 1 85 85 VAL CB C 13 32.074 0.15 . 1 . . . . 85 VAL CB . 27040 1 957 . 1 1 85 85 VAL CG1 C 13 20.666 0.2 . 1 . . . . 85 VAL CG1 . 27040 1 958 . 1 1 85 85 VAL CG2 C 13 20.666 0.2 . 1 . . . . 85 VAL CG2 . 27040 1 959 . 1 1 85 85 VAL N N 15 127.106 0.05 . 1 . . . . 85 VAL N . 27040 1 960 . 1 1 86 86 ILE H H 1 8.573 0.01 . 1 . . . . 86 ILE H . 27040 1 961 . 1 1 86 86 ILE HA H 1 4.883 0.05 . 1 . . . . 86 ILE HA . 27040 1 962 . 1 1 86 86 ILE HB H 1 2.250 0.05 . 1 . . . . 86 ILE HB . 27040 1 963 . 1 1 86 86 ILE HG12 H 1 1.276 0.05 . 1 . . . . 86 ILE HG12 . 27040 1 964 . 1 1 86 86 ILE HG13 H 1 1.276 0.05 . 1 . . . . 86 ILE HG13 . 27040 1 965 . 1 1 86 86 ILE HG21 H 1 0.836 0.05 . 1 . . . . 86 ILE MG . 27040 1 966 . 1 1 86 86 ILE HG22 H 1 0.836 0.05 . 1 . . . . 86 ILE MG . 27040 1 967 . 1 1 86 86 ILE HG23 H 1 0.836 0.05 . 1 . . . . 86 ILE MG . 27040 1 968 . 1 1 86 86 ILE HD11 H 1 0.872 0.05 . 1 . . . . 86 ILE MD . 27040 1 969 . 1 1 86 86 ILE HD12 H 1 0.872 0.05 . 1 . . . . 86 ILE MD . 27040 1 970 . 1 1 86 86 ILE HD13 H 1 0.872 0.05 . 1 . . . . 86 ILE MD . 27040 1 971 . 1 1 86 86 ILE C C 13 176.160 0.1 . 1 . . . . 86 ILE C . 27040 1 972 . 1 1 86 86 ILE CA C 13 61.011 0.15 . 1 . . . . 86 ILE CA . 27040 1 973 . 1 1 86 86 ILE CB C 13 40.584 0.15 . 1 . . . . 86 ILE CB . 27040 1 974 . 1 1 86 86 ILE CG1 C 13 26.120 0.2 . 1 . . . . 86 ILE CG1 . 27040 1 975 . 1 1 86 86 ILE CG2 C 13 18.639 0.2 . 1 . . . . 86 ILE CG2 . 27040 1 976 . 1 1 86 86 ILE CD1 C 13 14.290 0.2 . 1 . . . . 86 ILE CD1 . 27040 1 977 . 1 1 86 86 ILE N N 15 116.958 0.05 . 1 . . . . 86 ILE N . 27040 1 978 . 1 1 87 87 GLU H H 1 7.846 0.01 . 1 . . . . 87 GLU H . 27040 1 979 . 1 1 87 87 GLU HA H 1 4.239 0.05 . 1 . . . . 87 GLU HA . 27040 1 980 . 1 1 87 87 GLU HB2 H 1 2.262 0.05 . 1 . . . . 87 GLU HB2 . 27040 1 981 . 1 1 87 87 GLU HB3 H 1 2.262 0.05 . 1 . . . . 87 GLU HB3 . 27040 1 982 . 1 1 87 87 GLU HG2 H 1 2.475 0.05 . 1 . . . . 87 GLU HG2 . 27040 1 983 . 1 1 87 87 GLU HG3 H 1 2.475 0.05 . 1 . . . . 87 GLU HG3 . 27040 1 984 . 1 1 87 87 GLU C C 13 174.158 0.1 . 1 . . . . 87 GLU C . 27040 1 985 . 1 1 87 87 GLU CA C 13 57.180 0.15 . 1 . . . . 87 GLU CA . 27040 1 986 . 1 1 87 87 GLU CB C 13 34.610 0.15 . 1 . . . . 87 GLU CB . 27040 1 987 . 1 1 87 87 GLU CG C 13 37.373 0.2 . 1 . . . . 87 GLU CG . 27040 1 988 . 1 1 87 87 GLU N N 15 122.177 0.05 . 1 . . . . 87 GLU N . 27040 1 989 . 1 1 88 88 GLY H H 1 8.433 0.01 . 1 . . . . 88 GLY H . 27040 1 990 . 1 1 88 88 GLY CA C 13 43.659 0.15 . 1 . . . . 88 GLY CA . 27040 1 991 . 1 1 88 88 GLY N N 15 113.099 0.05 . 1 . . . . 88 GLY N . 27040 1 992 . 1 1 93 93 ASP HA H 1 4.700 0.05 . 1 . . . . 93 ASP HA . 27040 1 993 . 1 1 93 93 ASP HB2 H 1 2.693 0.05 . 1 . . . . 93 ASP HB2 . 27040 1 994 . 1 1 93 93 ASP HB3 H 1 2.693 0.05 . 1 . . . . 93 ASP HB3 . 27040 1 995 . 1 1 93 93 ASP C C 13 175.508 0.1 . 1 . . . . 93 ASP C . 27040 1 996 . 1 1 93 93 ASP CA C 13 55.685 0.15 . 1 . . . . 93 ASP CA . 27040 1 997 . 1 1 93 93 ASP CB C 13 41.720 0.15 . 1 . . . . 93 ASP CB . 27040 1 998 . 1 1 94 94 THR H H 1 7.761 0.01 . 1 . . . . 94 THR H . 27040 1 999 . 1 1 94 94 THR HA H 1 4.830 0.05 . 1 . . . . 94 THR HA . 27040 1 1000 . 1 1 94 94 THR HB H 1 4.169 0.05 . 1 . . . . 94 THR HB . 27040 1 1001 . 1 1 94 94 THR HG21 H 1 0.644 0.05 . 1 . . . . 94 THR MG . 27040 1 1002 . 1 1 94 94 THR HG22 H 1 0.644 0.05 . 1 . . . . 94 THR MG . 27040 1 1003 . 1 1 94 94 THR HG23 H 1 0.644 0.05 . 1 . . . . 94 THR MG . 27040 1 1004 . 1 1 94 94 THR C C 13 174.611 0.1 . 1 . . . . 94 THR C . 27040 1 1005 . 1 1 94 94 THR CA C 13 61.740 0.15 . 1 . . . . 94 THR CA . 27040 1 1006 . 1 1 94 94 THR CB C 13 69.638 0.15 . 1 . . . . 94 THR CB . 27040 1 1007 . 1 1 94 94 THR CG2 C 13 21.796 0.2 . 1 . . . . 94 THR CG2 . 27040 1 1008 . 1 1 94 94 THR N N 15 105.513 0.05 . 1 . . . . 94 THR N . 27040 1 1009 . 1 1 95 95 LEU H H 1 7.418 0.01 . 1 . . . . 95 LEU H . 27040 1 1010 . 1 1 95 95 LEU HA H 1 5.013 0.05 . 1 . . . . 95 LEU HA . 27040 1 1011 . 1 1 95 95 LEU HB2 H 1 1.507 0.05 . 1 . . . . 95 LEU HB2 . 27040 1 1012 . 1 1 95 95 LEU HB3 H 1 1.507 0.05 . 1 . . . . 95 LEU HB3 . 27040 1 1013 . 1 1 95 95 LEU HG H 1 1.507 0.05 . 1 . . . . 95 LEU HG . 27040 1 1014 . 1 1 95 95 LEU C C 13 175.307 0.1 . 1 . . . . 95 LEU C . 27040 1 1015 . 1 1 95 95 LEU CA C 13 53.955 0.15 . 1 . . . . 95 LEU CA . 27040 1 1016 . 1 1 95 95 LEU CB C 13 45.300 0.15 . 1 . . . . 95 LEU CB . 27040 1 1017 . 1 1 95 95 LEU CG C 13 26.662 0.2 . 1 . . . . 95 LEU CG . 27040 1 1018 . 1 1 95 95 LEU N N 15 120.769 0.05 . 1 . . . . 95 LEU N . 27040 1 1019 . 1 1 96 96 GLU H H 1 9.332 0.01 . 1 . . . . 96 GLU H . 27040 1 1020 . 1 1 96 96 GLU HA H 1 4.294 0.05 . 1 . . . . 96 GLU HA . 27040 1 1021 . 1 1 96 96 GLU HB2 H 1 2.111 0.05 . 1 . . . . 96 GLU HB2 . 27040 1 1022 . 1 1 96 96 GLU HB3 H 1 2.111 0.05 . 1 . . . . 96 GLU HB3 . 27040 1 1023 . 1 1 96 96 GLU HG2 H 1 2.206 0.05 . 1 . . . . 96 GLU HG2 . 27040 1 1024 . 1 1 96 96 GLU HG3 H 1 2.206 0.05 . 1 . . . . 96 GLU HG3 . 27040 1 1025 . 1 1 96 96 GLU C C 13 176.049 0.1 . 1 . . . . 96 GLU C . 27040 1 1026 . 1 1 96 96 GLU CA C 13 57.958 0.15 . 1 . . . . 96 GLU CA . 27040 1 1027 . 1 1 96 96 GLU CB C 13 30.968 0.15 . 1 . . . . 96 GLU CB . 27040 1 1028 . 1 1 96 96 GLU CG C 13 36.282 0.2 . 1 . . . . 96 GLU CG . 27040 1 1029 . 1 1 96 96 GLU N N 15 124.272 0.05 . 1 . . . . 96 GLU N . 27040 1 1030 . 1 1 97 97 LYS H H 1 7.644 0.01 . 1 . . . . 97 LYS H . 27040 1 1031 . 1 1 97 97 LYS HA H 1 4.713 0.05 . 1 . . . . 97 LYS HA . 27040 1 1032 . 1 1 97 97 LYS HB2 H 1 2.053 0.05 . 1 . . . . 97 LYS HB2 . 27040 1 1033 . 1 1 97 97 LYS HB3 H 1 2.053 0.05 . 1 . . . . 97 LYS HB3 . 27040 1 1034 . 1 1 97 97 LYS HG2 H 1 1.288 0.05 . 2 . . . . 97 LYS HG2 . 27040 1 1035 . 1 1 97 97 LYS HG3 H 1 0.944 0.05 . 2 . . . . 97 LYS HG3 . 27040 1 1036 . 1 1 97 97 LYS HD2 H 1 1.646 0.05 . 1 . . . . 97 LYS HD2 . 27040 1 1037 . 1 1 97 97 LYS HD3 H 1 1.646 0.05 . 1 . . . . 97 LYS HD3 . 27040 1 1038 . 1 1 97 97 LYS C C 13 174.126 0.1 . 1 . . . . 97 LYS C . 27040 1 1039 . 1 1 97 97 LYS CA C 13 55.952 0.15 . 1 . . . . 97 LYS CA . 27040 1 1040 . 1 1 97 97 LYS CB C 13 34.685 0.15 . 1 . . . . 97 LYS CB . 27040 1 1041 . 1 1 97 97 LYS CG C 13 23.624 0.2 . 1 . . . . 97 LYS CG . 27040 1 1042 . 1 1 97 97 LYS CD C 13 29.683 0.2 . 1 . . . . 97 LYS CD . 27040 1 1043 . 1 1 97 97 LYS CE C 13 41.144 0.2 . 1 . . . . 97 LYS CE . 27040 1 1044 . 1 1 97 97 LYS N N 15 110.232 0.05 . 1 . . . . 97 LYS N . 27040 1 1045 . 1 1 98 98 ILE H H 1 7.818 0.01 . 1 . . . . 98 ILE H . 27040 1 1046 . 1 1 98 98 ILE HA H 1 5.010 0.05 . 1 . . . . 98 ILE HA . 27040 1 1047 . 1 1 98 98 ILE HB H 1 1.487 0.05 . 1 . . . . 98 ILE HB . 27040 1 1048 . 1 1 98 98 ILE HG12 H 1 1.487 0.05 . 1 . . . . 98 ILE HG12 . 27040 1 1049 . 1 1 98 98 ILE HG13 H 1 1.487 0.05 . 1 . . . . 98 ILE HG13 . 27040 1 1050 . 1 1 98 98 ILE HG21 H 1 0.297 0.05 . 1 . . . . 98 ILE MG . 27040 1 1051 . 1 1 98 98 ILE HG22 H 1 0.297 0.05 . 1 . . . . 98 ILE MG . 27040 1 1052 . 1 1 98 98 ILE HG23 H 1 0.297 0.05 . 1 . . . . 98 ILE MG . 27040 1 1053 . 1 1 98 98 ILE HD11 H 1 0.712 0.05 . 1 . . . . 98 ILE MD . 27040 1 1054 . 1 1 98 98 ILE HD12 H 1 0.712 0.05 . 1 . . . . 98 ILE MD . 27040 1 1055 . 1 1 98 98 ILE HD13 H 1 0.712 0.05 . 1 . . . . 98 ILE MD . 27040 1 1056 . 1 1 98 98 ILE C C 13 176.175 0.1 . 1 . . . . 98 ILE C . 27040 1 1057 . 1 1 98 98 ILE CA C 13 60.663 0.15 . 1 . . . . 98 ILE CA . 27040 1 1058 . 1 1 98 98 ILE CB C 13 41.617 0.15 . 1 . . . . 98 ILE CB . 27040 1 1059 . 1 1 98 98 ILE CG1 C 13 27.337 0.2 . 1 . . . . 98 ILE CG1 . 27040 1 1060 . 1 1 98 98 ILE CG2 C 13 16.865 0.2 . 1 . . . . 98 ILE CG2 . 27040 1 1061 . 1 1 98 98 ILE CD1 C 13 14.549 0.2 . 1 . . . . 98 ILE CD1 . 27040 1 1062 . 1 1 98 98 ILE N N 15 119.328 0.05 . 1 . . . . 98 ILE N . 27040 1 1063 . 1 1 99 99 SER H H 1 9.810 0.01 . 1 . . . . 99 SER H . 27040 1 1064 . 1 1 99 99 SER HA H 1 4.957 0.05 . 1 . . . . 99 SER HA . 27040 1 1065 . 1 1 99 99 SER HB2 H 1 3.848 0.05 . 1 . . . . 99 SER HB2 . 27040 1 1066 . 1 1 99 99 SER HB3 H 1 3.848 0.05 . 1 . . . . 99 SER HB3 . 27040 1 1067 . 1 1 99 99 SER C C 13 173.194 0.1 . 1 . . . . 99 SER C . 27040 1 1068 . 1 1 99 99 SER CA C 13 58.245 0.15 . 1 . . . . 99 SER CA . 27040 1 1069 . 1 1 99 99 SER CB C 13 64.470 0.15 . 1 . . . . 99 SER CB . 27040 1 1070 . 1 1 99 99 SER N N 15 124.692 0.05 . 1 . . . . 99 SER N . 27040 1 1071 . 1 1 100 100 ASN H H 1 8.967 0.01 . 1 . . . . 100 ASN H . 27040 1 1072 . 1 1 100 100 ASN HA H 1 5.886 0.05 . 1 . . . . 100 ASN HA . 27040 1 1073 . 1 1 100 100 ASN HB2 H 1 1.584 0.05 . 2 . . . . 100 ASN HB2 . 27040 1 1074 . 1 1 100 100 ASN HB3 H 1 2.044 0.05 . 2 . . . . 100 ASN HB3 . 27040 1 1075 . 1 1 100 100 ASN C C 13 174.281 0.1 . 1 . . . . 100 ASN C . 27040 1 1076 . 1 1 100 100 ASN CA C 13 52.462 0.15 . 1 . . . . 100 ASN CA . 27040 1 1077 . 1 1 100 100 ASN CB C 13 42.894 0.15 . 1 . . . . 100 ASN CB . 27040 1 1078 . 1 1 100 100 ASN N N 15 123.708 0.05 . 1 . . . . 100 ASN N . 27040 1 1079 . 1 1 101 101 GLU H H 1 8.942 0.01 . 1 . . . . 101 GLU H . 27040 1 1080 . 1 1 101 101 GLU HA H 1 5.194 0.05 . 1 . . . . 101 GLU HA . 27040 1 1081 . 1 1 101 101 GLU HB2 H 1 1.922 0.05 . 1 . . . . 101 GLU HB2 . 27040 1 1082 . 1 1 101 101 GLU HB3 H 1 1.922 0.05 . 1 . . . . 101 GLU HB3 . 27040 1 1083 . 1 1 101 101 GLU HG2 H 1 2.175 0.05 . 1 . . . . 101 GLU HG2 . 27040 1 1084 . 1 1 101 101 GLU HG3 H 1 2.175 0.05 . 1 . . . . 101 GLU HG3 . 27040 1 1085 . 1 1 101 101 GLU C C 13 174.668 0.1 . 1 . . . . 101 GLU C . 27040 1 1086 . 1 1 101 101 GLU CA C 13 55.579 0.15 . 1 . . . . 101 GLU CA . 27040 1 1087 . 1 1 101 101 GLU CB C 13 34.190 0.15 . 1 . . . . 101 GLU CB . 27040 1 1088 . 1 1 101 101 GLU CG C 13 36.986 0.2 . 1 . . . . 101 GLU CG . 27040 1 1089 . 1 1 101 101 GLU N N 15 122.923 0.05 . 1 . . . . 101 GLU N . 27040 1 1090 . 1 1 102 102 ILE H H 1 9.208 0.01 . 1 . . . . 102 ILE H . 27040 1 1091 . 1 1 102 102 ILE HA H 1 4.882 0.05 . 1 . . . . 102 ILE HA . 27040 1 1092 . 1 1 102 102 ILE HB H 1 2.355 0.05 . 1 . . . . 102 ILE HB . 27040 1 1093 . 1 1 102 102 ILE HG12 H 1 1.925 0.05 . 1 . . . . 102 ILE HG12 . 27040 1 1094 . 1 1 102 102 ILE HG13 H 1 1.925 0.05 . 1 . . . . 102 ILE HG13 . 27040 1 1095 . 1 1 102 102 ILE HG21 H 1 0.922 0.05 . 1 . . . . 102 ILE MG . 27040 1 1096 . 1 1 102 102 ILE HG22 H 1 0.922 0.05 . 1 . . . . 102 ILE MG . 27040 1 1097 . 1 1 102 102 ILE HG23 H 1 0.922 0.05 . 1 . . . . 102 ILE MG . 27040 1 1098 . 1 1 102 102 ILE HD11 H 1 0.999 0.05 . 1 . . . . 102 ILE MD . 27040 1 1099 . 1 1 102 102 ILE HD12 H 1 0.999 0.05 . 1 . . . . 102 ILE MD . 27040 1 1100 . 1 1 102 102 ILE HD13 H 1 0.999 0.05 . 1 . . . . 102 ILE MD . 27040 1 1101 . 1 1 102 102 ILE C C 13 174.730 0.1 . 1 . . . . 102 ILE C . 27040 1 1102 . 1 1 102 102 ILE CA C 13 60.803 0.15 . 1 . . . . 102 ILE CA . 27040 1 1103 . 1 1 102 102 ILE CB C 13 40.839 0.15 . 1 . . . . 102 ILE CB . 27040 1 1104 . 1 1 102 102 ILE CG1 C 13 27.957 0.2 . 1 . . . . 102 ILE CG1 . 27040 1 1105 . 1 1 102 102 ILE CG2 C 13 16.981 0.2 . 1 . . . . 102 ILE CG2 . 27040 1 1106 . 1 1 102 102 ILE CD1 C 13 15.063 0.2 . 1 . . . . 102 ILE CD1 . 27040 1 1107 . 1 1 102 102 ILE N N 15 124.834 0.05 . 1 . . . . 102 ILE N . 27040 1 1108 . 1 1 103 103 LYS H H 1 8.999 0.01 . 1 . . . . 103 LYS H . 27040 1 1109 . 1 1 103 103 LYS HA H 1 5.441 0.05 . 1 . . . . 103 LYS HA . 27040 1 1110 . 1 1 103 103 LYS HB2 H 1 1.888 0.05 . 1 . . . . 103 LYS HB2 . 27040 1 1111 . 1 1 103 103 LYS HB3 H 1 1.888 0.05 . 1 . . . . 103 LYS HB3 . 27040 1 1112 . 1 1 103 103 LYS HG2 H 1 1.408 0.05 . 1 . . . . 103 LYS HG2 . 27040 1 1113 . 1 1 103 103 LYS HG3 H 1 1.408 0.05 . 1 . . . . 103 LYS HG3 . 27040 1 1114 . 1 1 103 103 LYS HD2 H 1 1.707 0.05 . 1 . . . . 103 LYS HD2 . 27040 1 1115 . 1 1 103 103 LYS HD3 H 1 1.707 0.05 . 1 . . . . 103 LYS HD3 . 27040 1 1116 . 1 1 103 103 LYS HE2 H 1 2.913 0.05 . 1 . . . . 103 LYS HE2 . 27040 1 1117 . 1 1 103 103 LYS HE3 H 1 2.913 0.05 . 1 . . . . 103 LYS HE3 . 27040 1 1118 . 1 1 103 103 LYS C C 13 174.710 0.1 . 1 . . . . 103 LYS C . 27040 1 1119 . 1 1 103 103 LYS CA C 13 55.253 0.15 . 1 . . . . 103 LYS CA . 27040 1 1120 . 1 1 103 103 LYS CB C 13 36.161 0.15 . 1 . . . . 103 LYS CB . 27040 1 1121 . 1 1 103 103 LYS CG C 13 25.626 0.2 . 1 . . . . 103 LYS CG . 27040 1 1122 . 1 1 103 103 LYS CD C 13 29.704 0.2 . 1 . . . . 103 LYS CD . 27040 1 1123 . 1 1 103 103 LYS CE C 13 42.253 0.2 . 1 . . . . 103 LYS CE . 27040 1 1124 . 1 1 103 103 LYS N N 15 128.962 0.05 . 1 . . . . 103 LYS N . 27040 1 1125 . 1 1 104 104 ILE H H 1 8.646 0.01 . 1 . . . . 104 ILE H . 27040 1 1126 . 1 1 104 104 ILE HA H 1 5.001 0.05 . 1 . . . . 104 ILE HA . 27040 1 1127 . 1 1 104 104 ILE HB H 1 1.995 0.05 . 1 . . . . 104 ILE HB . 27040 1 1128 . 1 1 104 104 ILE HG12 H 1 1.925 0.05 . 1 . . . . 104 ILE HG12 . 27040 1 1129 . 1 1 104 104 ILE HG13 H 1 1.925 0.05 . 1 . . . . 104 ILE HG13 . 27040 1 1130 . 1 1 104 104 ILE HG21 H 1 1.029 0.05 . 1 . . . . 104 ILE MG . 27040 1 1131 . 1 1 104 104 ILE HG22 H 1 1.029 0.05 . 1 . . . . 104 ILE MG . 27040 1 1132 . 1 1 104 104 ILE HG23 H 1 1.029 0.05 . 1 . . . . 104 ILE MG . 27040 1 1133 . 1 1 104 104 ILE HD11 H 1 0.949 0.05 . 1 . . . . 104 ILE MD . 27040 1 1134 . 1 1 104 104 ILE HD12 H 1 0.949 0.05 . 1 . . . . 104 ILE MD . 27040 1 1135 . 1 1 104 104 ILE HD13 H 1 0.949 0.05 . 1 . . . . 104 ILE MD . 27040 1 1136 . 1 1 104 104 ILE C C 13 175.031 0.1 . 1 . . . . 104 ILE C . 27040 1 1137 . 1 1 104 104 ILE CA C 13 61.612 0.15 . 1 . . . . 104 ILE CA . 27040 1 1138 . 1 1 104 104 ILE CB C 13 38.663 0.15 . 1 . . . . 104 ILE CB . 27040 1 1139 . 1 1 104 104 ILE CG1 C 13 27.916 0.2 . 1 . . . . 104 ILE CG1 . 27040 1 1140 . 1 1 104 104 ILE CG2 C 13 19.566 0.2 . 1 . . . . 104 ILE CG2 . 27040 1 1141 . 1 1 104 104 ILE CD1 C 13 13.428 0.2 . 1 . . . . 104 ILE CD1 . 27040 1 1142 . 1 1 104 104 ILE N N 15 125.757 0.05 . 1 . . . . 104 ILE N . 27040 1 1143 . 1 1 105 105 VAL H H 1 9.282 0.01 . 1 . . . . 105 VAL H . 27040 1 1144 . 1 1 105 105 VAL HA H 1 4.415 0.05 . 1 . . . . 105 VAL HA . 27040 1 1145 . 1 1 105 105 VAL HB H 1 2.085 0.05 . 1 . . . . 105 VAL HB . 27040 1 1146 . 1 1 105 105 VAL HG11 H 1 0.991 0.05 . 1 . . . . 105 VAL MG1 . 27040 1 1147 . 1 1 105 105 VAL HG12 H 1 0.991 0.05 . 1 . . . . 105 VAL MG1 . 27040 1 1148 . 1 1 105 105 VAL HG13 H 1 0.991 0.05 . 1 . . . . 105 VAL MG1 . 27040 1 1149 . 1 1 105 105 VAL HG21 H 1 0.991 0.05 . 1 . . . . 105 VAL MG2 . 27040 1 1150 . 1 1 105 105 VAL HG22 H 1 0.991 0.05 . 1 . . . . 105 VAL MG2 . 27040 1 1151 . 1 1 105 105 VAL HG23 H 1 0.991 0.05 . 1 . . . . 105 VAL MG2 . 27040 1 1152 . 1 1 105 105 VAL C C 13 175.302 0.1 . 1 . . . . 105 VAL C . 27040 1 1153 . 1 1 105 105 VAL CA C 13 61.173 0.15 . 1 . . . . 105 VAL CA . 27040 1 1154 . 1 1 105 105 VAL CB C 13 34.762 0.15 . 1 . . . . 105 VAL CB . 27040 1 1155 . 1 1 105 105 VAL CG1 C 13 21.101 0.2 . 1 . . . . 105 VAL CG1 . 27040 1 1156 . 1 1 105 105 VAL CG2 C 13 21.101 0.2 . 1 . . . . 105 VAL CG2 . 27040 1 1157 . 1 1 105 105 VAL N N 15 127.160 0.05 . 1 . . . . 105 VAL N . 27040 1 1158 . 1 1 106 106 ALA H H 1 8.945 0.01 . 1 . . . . 106 ALA H . 27040 1 1159 . 1 1 106 106 ALA HA H 1 4.650 0.05 . 1 . . . . 106 ALA HA . 27040 1 1160 . 1 1 106 106 ALA HB1 H 1 1.560 0.05 . 1 . . . . 106 ALA MB . 27040 1 1161 . 1 1 106 106 ALA HB2 H 1 1.560 0.05 . 1 . . . . 106 ALA MB . 27040 1 1162 . 1 1 106 106 ALA HB3 H 1 1.560 0.05 . 1 . . . . 106 ALA MB . 27040 1 1163 . 1 1 106 106 ALA C C 13 178.159 0.1 . 1 . . . . 106 ALA C . 27040 1 1164 . 1 1 106 106 ALA CA C 13 53.417 0.15 . 1 . . . . 106 ALA CA . 27040 1 1165 . 1 1 106 106 ALA CB C 13 20.222 0.15 . 1 . . . . 106 ALA CB . 27040 1 1166 . 1 1 106 106 ALA N N 15 129.275 0.05 . 1 . . . . 106 ALA N . 27040 1 1167 . 1 1 107 107 THR H H 1 8.124 0.01 . 1 . . . . 107 THR H . 27040 1 1168 . 1 1 107 107 THR HA H 1 5.035 0.05 . 1 . . . . 107 THR HA . 27040 1 1169 . 1 1 107 107 THR HB H 1 4.812 0.05 . 1 . . . . 107 THR HB . 27040 1 1170 . 1 1 107 107 THR CA C 13 59.002 0.15 . 1 . . . . 107 THR CA . 27040 1 1171 . 1 1 107 107 THR CB C 13 68.324 0.15 . 1 . . . . 107 THR CB . 27040 1 1172 . 1 1 107 107 THR N N 15 113.317 0.05 . 1 . . . . 107 THR N . 27040 1 1173 . 1 1 108 108 PRO HA H 1 4.419 0.05 . 1 . . . . 108 PRO HA . 27040 1 1174 . 1 1 108 108 PRO HB2 H 1 2.398 0.05 . 1 . . . . 108 PRO HB2 . 27040 1 1175 . 1 1 108 108 PRO HB3 H 1 2.398 0.05 . 1 . . . . 108 PRO HB3 . 27040 1 1176 . 1 1 108 108 PRO HG2 H 1 2.052 0.05 . 1 . . . . 108 PRO HG2 . 27040 1 1177 . 1 1 108 108 PRO HG3 H 1 2.052 0.05 . 1 . . . . 108 PRO HG3 . 27040 1 1178 . 1 1 108 108 PRO HD2 H 1 3.817 0.05 . 1 . . . . 108 PRO HD2 . 27040 1 1179 . 1 1 108 108 PRO HD3 H 1 3.817 0.05 . 1 . . . . 108 PRO HD3 . 27040 1 1180 . 1 1 108 108 PRO C C 13 176.659 0.1 . 1 . . . . 108 PRO C . 27040 1 1181 . 1 1 108 108 PRO CA C 13 65.212 0.15 . 1 . . . . 108 PRO CA . 27040 1 1182 . 1 1 108 108 PRO CB C 13 31.745 0.15 . 1 . . . . 108 PRO CB . 27040 1 1183 . 1 1 108 108 PRO CG C 13 27.490 0.2 . 1 . . . . 108 PRO CG . 27040 1 1184 . 1 1 108 108 PRO CD C 13 51.271 0.2 . 1 . . . . 108 PRO CD . 27040 1 1185 . 1 1 109 109 ASP H H 1 7.899 0.01 . 1 . . . . 109 ASP H . 27040 1 1186 . 1 1 109 109 ASP HA H 1 4.542 0.05 . 1 . . . . 109 ASP HA . 27040 1 1187 . 1 1 109 109 ASP HB2 H 1 2.715 0.05 . 2 . . . . 109 ASP HB2 . 27040 1 1188 . 1 1 109 109 ASP HB3 H 1 2.884 0.05 . 2 . . . . 109 ASP HB3 . 27040 1 1189 . 1 1 109 109 ASP C C 13 176.536 0.1 . 1 . . . . 109 ASP C . 27040 1 1190 . 1 1 109 109 ASP CA C 13 54.062 0.15 . 1 . . . . 109 ASP CA . 27040 1 1191 . 1 1 109 109 ASP CB C 13 40.373 0.15 . 1 . . . . 109 ASP CB . 27040 1 1192 . 1 1 109 109 ASP N N 15 114.848 0.05 . 1 . . . . 109 ASP N . 27040 1 1193 . 1 1 110 110 GLY H H 1 7.989 0.01 . 1 . . . . 110 GLY H . 27040 1 1194 . 1 1 110 110 GLY HA2 H 1 3.788 0.05 . 2 . . . . 110 GLY HA2 . 27040 1 1195 . 1 1 110 110 GLY HA3 H 1 4.447 0.05 . 2 . . . . 110 GLY HA3 . 27040 1 1196 . 1 1 110 110 GLY C C 13 174.465 0.1 . 1 . . . . 110 GLY C . 27040 1 1197 . 1 1 110 110 GLY CA C 13 45.363 0.15 . 1 . . . . 110 GLY CA . 27040 1 1198 . 1 1 110 110 GLY N N 15 108.268 0.05 . 1 . . . . 110 GLY N . 27040 1 1199 . 1 1 111 111 GLY H H 1 7.475 0.01 . 1 . . . . 111 GLY H . 27040 1 1200 . 1 1 111 111 GLY HA2 H 1 3.716 0.05 . 2 . . . . 111 GLY HA2 . 27040 1 1201 . 1 1 111 111 GLY HA3 H 1 4.069 0.05 . 2 . . . . 111 GLY HA3 . 27040 1 1202 . 1 1 111 111 GLY C C 13 173.855 0.1 . 1 . . . . 111 GLY C . 27040 1 1203 . 1 1 111 111 GLY CA C 13 43.581 0.15 . 1 . . . . 111 GLY CA . 27040 1 1204 . 1 1 111 111 GLY N N 15 108.890 0.05 . 1 . . . . 111 GLY N . 27040 1 1205 . 1 1 112 112 CYS H H 1 8.989 0.01 . 1 . . . . 112 CYS H . 27040 1 1206 . 1 1 112 112 CYS HA H 1 5.602 0.05 . 1 . . . . 112 CYS HA . 27040 1 1207 . 1 1 112 112 CYS HB2 H 1 2.574 0.05 . 2 . . . . 112 CYS HB2 . 27040 1 1208 . 1 1 112 112 CYS HB3 H 1 3.015 0.05 . 2 . . . . 112 CYS HB3 . 27040 1 1209 . 1 1 112 112 CYS C C 13 172.798 0.1 . 1 . . . . 112 CYS C . 27040 1 1210 . 1 1 112 112 CYS CA C 13 57.240 0.15 . 1 . . . . 112 CYS CA . 27040 1 1211 . 1 1 112 112 CYS CB C 13 31.791 0.15 . 1 . . . . 112 CYS CB . 27040 1 1212 . 1 1 112 112 CYS N N 15 117.264 0.05 . 1 . . . . 112 CYS N . 27040 1 1213 . 1 1 113 113 VAL H H 1 9.235 0.01 . 1 . . . . 113 VAL H . 27040 1 1214 . 1 1 113 113 VAL HA H 1 4.764 0.05 . 1 . . . . 113 VAL HA . 27040 1 1215 . 1 1 113 113 VAL HB H 1 1.913 0.05 . 1 . . . . 113 VAL HB . 27040 1 1216 . 1 1 113 113 VAL HG11 H 1 0.946 0.05 . 1 . . . . 113 VAL MG1 . 27040 1 1217 . 1 1 113 113 VAL HG12 H 1 0.946 0.05 . 1 . . . . 113 VAL MG1 . 27040 1 1218 . 1 1 113 113 VAL HG13 H 1 0.946 0.05 . 1 . . . . 113 VAL MG1 . 27040 1 1219 . 1 1 113 113 VAL HG21 H 1 0.946 0.05 . 1 . . . . 113 VAL MG2 . 27040 1 1220 . 1 1 113 113 VAL HG22 H 1 0.946 0.05 . 1 . . . . 113 VAL MG2 . 27040 1 1221 . 1 1 113 113 VAL HG23 H 1 0.946 0.05 . 1 . . . . 113 VAL MG2 . 27040 1 1222 . 1 1 113 113 VAL C C 13 173.704 0.1 . 1 . . . . 113 VAL C . 27040 1 1223 . 1 1 113 113 VAL CA C 13 60.280 0.15 . 1 . . . . 113 VAL CA . 27040 1 1224 . 1 1 113 113 VAL CB C 13 35.534 0.15 . 1 . . . . 113 VAL CB . 27040 1 1225 . 1 1 113 113 VAL CG1 C 13 21.159 0.2 . 1 . . . . 113 VAL CG1 . 27040 1 1226 . 1 1 113 113 VAL CG2 C 13 21.159 0.2 . 1 . . . . 113 VAL CG2 . 27040 1 1227 . 1 1 113 113 VAL N N 15 119.406 0.05 . 1 . . . . 113 VAL N . 27040 1 1228 . 1 1 114 114 LEU H H 1 9.198 0.01 . 1 . . . . 114 LEU H . 27040 1 1229 . 1 1 114 114 LEU HA H 1 5.139 0.05 . 1 . . . . 114 LEU HA . 27040 1 1230 . 1 1 114 114 LEU HB2 H 1 1.607 0.05 . 1 . . . . 114 LEU HB2 . 27040 1 1231 . 1 1 114 114 LEU HB3 H 1 1.607 0.05 . 1 . . . . 114 LEU HB3 . 27040 1 1232 . 1 1 114 114 LEU HG H 1 1.607 0.05 . 1 . . . . 114 LEU HG . 27040 1 1233 . 1 1 114 114 LEU HD11 H 1 0.875 0.05 . 2 . . . . 114 LEU MD1 . 27040 1 1234 . 1 1 114 114 LEU HD12 H 1 0.875 0.05 . 2 . . . . 114 LEU MD1 . 27040 1 1235 . 1 1 114 114 LEU HD13 H 1 0.875 0.05 . 2 . . . . 114 LEU MD1 . 27040 1 1236 . 1 1 114 114 LEU HD21 H 1 0.845 0.05 . 2 . . . . 114 LEU MD2 . 27040 1 1237 . 1 1 114 114 LEU HD22 H 1 0.845 0.05 . 2 . . . . 114 LEU MD2 . 27040 1 1238 . 1 1 114 114 LEU HD23 H 1 0.845 0.05 . 2 . . . . 114 LEU MD2 . 27040 1 1239 . 1 1 114 114 LEU C C 13 174.895 0.1 . 1 . . . . 114 LEU C . 27040 1 1240 . 1 1 114 114 LEU CA C 13 55.786 0.15 . 1 . . . . 114 LEU CA . 27040 1 1241 . 1 1 114 114 LEU CB C 13 42.844 0.15 . 1 . . . . 114 LEU CB . 27040 1 1242 . 1 1 114 114 LEU CG C 13 30.324 0.2 . 1 . . . . 114 LEU CG . 27040 1 1243 . 1 1 114 114 LEU CD1 C 13 25.992 0.2 . 2 . . . . 114 LEU CD1 . 27040 1 1244 . 1 1 114 114 LEU CD2 C 13 27.474 0.2 . 2 . . . . 114 LEU CD2 . 27040 1 1245 . 1 1 114 114 LEU N N 15 126.370 0.05 . 1 . . . . 114 LEU N . 27040 1 1246 . 1 1 115 115 LYS H H 1 9.277 0.01 . 1 . . . . 115 LYS H . 27040 1 1247 . 1 1 115 115 LYS HA H 1 4.912 0.05 . 1 . . . . 115 LYS HA . 27040 1 1248 . 1 1 115 115 LYS HB2 H 1 1.939 0.05 . 1 . . . . 115 LYS HB2 . 27040 1 1249 . 1 1 115 115 LYS HB3 H 1 1.939 0.05 . 1 . . . . 115 LYS HB3 . 27040 1 1250 . 1 1 115 115 LYS HG2 H 1 1.380 0.05 . 1 . . . . 115 LYS HG2 . 27040 1 1251 . 1 1 115 115 LYS HG3 H 1 1.380 0.05 . 1 . . . . 115 LYS HG3 . 27040 1 1252 . 1 1 115 115 LYS HD2 H 1 1.665 0.05 . 1 . . . . 115 LYS HD2 . 27040 1 1253 . 1 1 115 115 LYS HD3 H 1 1.665 0.05 . 1 . . . . 115 LYS HD3 . 27040 1 1254 . 1 1 115 115 LYS HE2 H 1 2.906 0.05 . 1 . . . . 115 LYS HE2 . 27040 1 1255 . 1 1 115 115 LYS HE3 H 1 2.906 0.05 . 1 . . . . 115 LYS HE3 . 27040 1 1256 . 1 1 115 115 LYS C C 13 175.921 0.1 . 1 . . . . 115 LYS C . 27040 1 1257 . 1 1 115 115 LYS CA C 13 55.478 0.15 . 1 . . . . 115 LYS CA . 27040 1 1258 . 1 1 115 115 LYS CB C 13 33.036 0.15 . 1 . . . . 115 LYS CB . 27040 1 1259 . 1 1 115 115 LYS CG C 13 25.450 0.2 . 1 . . . . 115 LYS CG . 27040 1 1260 . 1 1 115 115 LYS CD C 13 29.534 0.2 . 1 . . . . 115 LYS CD . 27040 1 1261 . 1 1 115 115 LYS CE C 13 42.209 0.2 . 1 . . . . 115 LYS CE . 27040 1 1262 . 1 1 115 115 LYS N N 15 123.708 0.05 . 1 . . . . 115 LYS N . 27040 1 1263 . 1 1 116 116 ILE H H 1 9.060 0.01 . 1 . . . . 116 ILE H . 27040 1 1264 . 1 1 116 116 ILE HA H 1 5.204 0.05 . 1 . . . . 116 ILE HA . 27040 1 1265 . 1 1 116 116 ILE HB H 1 1.830 0.05 . 1 . . . . 116 ILE HB . 27040 1 1266 . 1 1 116 116 ILE HG12 H 1 1.171 0.05 . 2 . . . . 116 ILE HG12 . 27040 1 1267 . 1 1 116 116 ILE HG13 H 1 1.526 0.05 . 2 . . . . 116 ILE HG13 . 27040 1 1268 . 1 1 116 116 ILE HG21 H 1 0.963 0.05 . 1 . . . . 116 ILE MG . 27040 1 1269 . 1 1 116 116 ILE HG22 H 1 0.963 0.05 . 1 . . . . 116 ILE MG . 27040 1 1270 . 1 1 116 116 ILE HG23 H 1 0.963 0.05 . 1 . . . . 116 ILE MG . 27040 1 1271 . 1 1 116 116 ILE HD11 H 1 0.908 0.05 . 1 . . . . 116 ILE MD . 27040 1 1272 . 1 1 116 116 ILE HD12 H 1 0.908 0.05 . 1 . . . . 116 ILE MD . 27040 1 1273 . 1 1 116 116 ILE HD13 H 1 0.908 0.05 . 1 . . . . 116 ILE MD . 27040 1 1274 . 1 1 116 116 ILE C C 13 175.012 0.1 . 1 . . . . 116 ILE C . 27040 1 1275 . 1 1 116 116 ILE CA C 13 60.067 0.15 . 1 . . . . 116 ILE CA . 27040 1 1276 . 1 1 116 116 ILE CB C 13 41.491 0.15 . 1 . . . . 116 ILE CB . 27040 1 1277 . 1 1 116 116 ILE CG1 C 13 28.346 0.2 . 1 . . . . 116 ILE CG1 . 27040 1 1278 . 1 1 116 116 ILE CG2 C 13 18.085 0.2 . 1 . . . . 116 ILE CG2 . 27040 1 1279 . 1 1 116 116 ILE CD1 C 13 15.148 0.2 . 1 . . . . 116 ILE CD1 . 27040 1 1280 . 1 1 116 116 ILE N N 15 127.463 0.05 . 1 . . . . 116 ILE N . 27040 1 1281 . 1 1 117 117 SER H H 1 9.006 0.01 . 1 . . . . 117 SER H . 27040 1 1282 . 1 1 117 117 SER HA H 1 5.461 0.05 . 1 . . . . 117 SER HA . 27040 1 1283 . 1 1 117 117 SER HB2 H 1 3.883 0.05 . 1 . . . . 117 SER HB2 . 27040 1 1284 . 1 1 117 117 SER HB3 H 1 3.883 0.05 . 1 . . . . 117 SER HB3 . 27040 1 1285 . 1 1 117 117 SER C C 13 174.235 0.1 . 1 . . . . 117 SER C . 27040 1 1286 . 1 1 117 117 SER CA C 13 56.261 0.15 . 1 . . . . 117 SER CA . 27040 1 1287 . 1 1 117 117 SER CB C 13 64.834 0.15 . 1 . . . . 117 SER CB . 27040 1 1288 . 1 1 117 117 SER N N 15 121.533 0.05 . 1 . . . . 117 SER N . 27040 1 1289 . 1 1 118 118 ASN H H 1 9.372 0.01 . 1 . . . . 118 ASN H . 27040 1 1290 . 1 1 118 118 ASN HA H 1 5.344 0.05 . 1 . . . . 118 ASN HA . 27040 1 1291 . 1 1 118 118 ASN HB2 H 1 2.478 0.05 . 2 . . . . 118 ASN HB2 . 27040 1 1292 . 1 1 118 118 ASN HB3 H 1 2.912 0.05 . 2 . . . . 118 ASN HB3 . 27040 1 1293 . 1 1 118 118 ASN C C 13 172.788 0.1 . 1 . . . . 118 ASN C . 27040 1 1294 . 1 1 118 118 ASN CA C 13 52.199 0.15 . 1 . . . . 118 ASN CA . 27040 1 1295 . 1 1 118 118 ASN CB C 13 43.173 0.15 . 1 . . . . 118 ASN CB . 27040 1 1296 . 1 1 118 118 ASN N N 15 125.382 0.05 . 1 . . . . 118 ASN N . 27040 1 1297 . 1 1 119 119 LYS H H 1 8.996 0.01 . 1 . . . . 119 LYS H . 27040 1 1298 . 1 1 119 119 LYS HA H 1 5.207 0.05 . 1 . . . . 119 LYS HA . 27040 1 1299 . 1 1 119 119 LYS HB2 H 1 1.546 0.05 . 1 . . . . 119 LYS HB2 . 27040 1 1300 . 1 1 119 119 LYS HB3 H 1 1.546 0.05 . 1 . . . . 119 LYS HB3 . 27040 1 1301 . 1 1 119 119 LYS HG2 H 1 1.075 0.05 . 1 . . . . 119 LYS HG2 . 27040 1 1302 . 1 1 119 119 LYS HG3 H 1 1.075 0.05 . 1 . . . . 119 LYS HG3 . 27040 1 1303 . 1 1 119 119 LYS HD2 H 1 1.276 0.05 . 2 . . . . 119 LYS HD2 . 27040 1 1304 . 1 1 119 119 LYS HD3 H 1 1.493 0.05 . 2 . . . . 119 LYS HD3 . 27040 1 1305 . 1 1 119 119 LYS HE2 H 1 2.806 0.05 . 1 . . . . 119 LYS HE2 . 27040 1 1306 . 1 1 119 119 LYS HE3 H 1 2.806 0.05 . 1 . . . . 119 LYS HE3 . 27040 1 1307 . 1 1 119 119 LYS C C 13 174.937 0.1 . 1 . . . . 119 LYS C . 27040 1 1308 . 1 1 119 119 LYS CA C 13 55.419 0.15 . 1 . . . . 119 LYS CA . 27040 1 1309 . 1 1 119 119 LYS CB C 13 33.672 0.15 . 1 . . . . 119 LYS CB . 27040 1 1310 . 1 1 119 119 LYS CG C 13 25.409 0.2 . 1 . . . . 119 LYS CG . 27040 1 1311 . 1 1 119 119 LYS CD C 13 29.476 0.2 . 1 . . . . 119 LYS CD . 27040 1 1312 . 1 1 119 119 LYS CE C 13 42.127 0.2 . 1 . . . . 119 LYS CE . 27040 1 1313 . 1 1 119 119 LYS N N 15 123.447 0.05 . 1 . . . . 119 LYS N . 27040 1 1314 . 1 1 120 120 TYR H H 1 9.617 0.01 . 1 . . . . 120 TYR H . 27040 1 1315 . 1 1 120 120 TYR HA H 1 4.473 0.05 . 1 . . . . 120 TYR HA . 27040 1 1316 . 1 1 120 120 TYR HB2 H 1 2.773 0.05 . 2 . . . . 120 TYR HB2 . 27040 1 1317 . 1 1 120 120 TYR HB3 H 1 3.443 0.05 . 2 . . . . 120 TYR HB3 . 27040 1 1318 . 1 1 120 120 TYR C C 13 174.836 0.1 . 1 . . . . 120 TYR C . 27040 1 1319 . 1 1 120 120 TYR CA C 13 58.318 0.15 . 1 . . . . 120 TYR CA . 27040 1 1320 . 1 1 120 120 TYR CB C 13 39.903 0.15 . 1 . . . . 120 TYR CB . 27040 1 1321 . 1 1 120 120 TYR N N 15 126.013 0.05 . 1 . . . . 120 TYR N . 27040 1 1322 . 1 1 121 121 HIS H H 1 8.522 0.01 . 1 . . . . 121 HIS H . 27040 1 1323 . 1 1 121 121 HIS HA H 1 5.178 0.05 . 1 . . . . 121 HIS HA . 27040 1 1324 . 1 1 121 121 HIS HB2 H 1 3.255 0.05 . 1 . . . . 121 HIS HB2 . 27040 1 1325 . 1 1 121 121 HIS HB3 H 1 3.255 0.05 . 1 . . . . 121 HIS HB3 . 27040 1 1326 . 1 1 121 121 HIS C C 13 175.794 0.1 . 1 . . . . 121 HIS C . 27040 1 1327 . 1 1 121 121 HIS CA C 13 55.171 0.15 . 1 . . . . 121 HIS CA . 27040 1 1328 . 1 1 121 121 HIS CB C 13 29.845 0.15 . 1 . . . . 121 HIS CB . 27040 1 1329 . 1 1 121 121 HIS N N 15 124.218 0.05 . 1 . . . . 121 HIS N . 27040 1 1330 . 1 1 122 122 THR H H 1 9.356 0.01 . 1 . . . . 122 THR H . 27040 1 1331 . 1 1 122 122 THR HA H 1 5.021 0.05 . 1 . . . . 122 THR HA . 27040 1 1332 . 1 1 122 122 THR HB H 1 4.441 0.05 . 1 . . . . 122 THR HB . 27040 1 1333 . 1 1 122 122 THR HG21 H 1 1.230 0.05 . 1 . . . . 122 THR MG . 27040 1 1334 . 1 1 122 122 THR HG22 H 1 1.230 0.05 . 1 . . . . 122 THR MG . 27040 1 1335 . 1 1 122 122 THR HG23 H 1 1.230 0.05 . 1 . . . . 122 THR MG . 27040 1 1336 . 1 1 122 122 THR C C 13 174.926 0.1 . 1 . . . . 122 THR C . 27040 1 1337 . 1 1 122 122 THR CA C 13 60.346 0.15 . 1 . . . . 122 THR CA . 27040 1 1338 . 1 1 122 122 THR CB C 13 70.579 0.15 . 1 . . . . 122 THR CB . 27040 1 1339 . 1 1 122 122 THR CG2 C 13 22.982 0.2 . 1 . . . . 122 THR CG2 . 27040 1 1340 . 1 1 122 122 THR N N 15 116.294 0.05 . 1 . . . . 122 THR N . 27040 1 1341 . 1 1 123 123 LYS H H 1 8.347 0.01 . 1 . . . . 123 LYS H . 27040 1 1342 . 1 1 123 123 LYS HA H 1 4.554 0.05 . 1 . . . . 123 LYS HA . 27040 1 1343 . 1 1 123 123 LYS HB2 H 1 1.664 0.05 . 1 . . . . 123 LYS HB2 . 27040 1 1344 . 1 1 123 123 LYS HB3 H 1 1.664 0.05 . 1 . . . . 123 LYS HB3 . 27040 1 1345 . 1 1 123 123 LYS HG2 H 1 1.416 0.05 . 1 . . . . 123 LYS HG2 . 27040 1 1346 . 1 1 123 123 LYS HG3 H 1 1.416 0.05 . 1 . . . . 123 LYS HG3 . 27040 1 1347 . 1 1 123 123 LYS HD2 H 1 1.605 0.05 . 1 . . . . 123 LYS HD2 . 27040 1 1348 . 1 1 123 123 LYS HD3 H 1 1.605 0.05 . 1 . . . . 123 LYS HD3 . 27040 1 1349 . 1 1 123 123 LYS HE2 H 1 2.970 0.05 . 1 . . . . 123 LYS HE2 . 27040 1 1350 . 1 1 123 123 LYS HE3 H 1 2.970 0.05 . 1 . . . . 123 LYS HE3 . 27040 1 1351 . 1 1 123 123 LYS C C 13 176.542 0.1 . 1 . . . . 123 LYS C . 27040 1 1352 . 1 1 123 123 LYS CA C 13 55.686 0.15 . 1 . . . . 123 LYS CA . 27040 1 1353 . 1 1 123 123 LYS CB C 13 33.940 0.15 . 1 . . . . 123 LYS CB . 27040 1 1354 . 1 1 123 123 LYS CG C 13 25.698 0.2 . 1 . . . . 123 LYS CG . 27040 1 1355 . 1 1 123 123 LYS CD C 13 29.282 0.2 . 1 . . . . 123 LYS CD . 27040 1 1356 . 1 1 123 123 LYS CE C 13 41.819 0.2 . 1 . . . . 123 LYS CE . 27040 1 1357 . 1 1 123 123 LYS N N 15 121.493 0.05 . 1 . . . . 123 LYS N . 27040 1 1358 . 1 1 124 124 GLY H H 1 8.819 0.01 . 1 . . . . 124 GLY H . 27040 1 1359 . 1 1 124 124 GLY HA2 H 1 4.808 0.05 . 1 . . . . 124 GLY HA2 . 27040 1 1360 . 1 1 124 124 GLY HA3 H 1 4.808 0.05 . 1 . . . . 124 GLY HA3 . 27040 1 1361 . 1 1 124 124 GLY CA C 13 46.937 0.15 . 1 . . . . 124 GLY CA . 27040 1 1362 . 1 1 124 124 GLY N N 15 111.831 0.05 . 1 . . . . 124 GLY N . 27040 1 1363 . 1 1 125 125 ASN H H 1 8.733 0.01 . 1 . . . . 125 ASN H . 27040 1 1364 . 1 1 125 125 ASN HA H 1 4.917 0.05 . 1 . . . . 125 ASN HA . 27040 1 1365 . 1 1 125 125 ASN HB2 H 1 2.694 0.05 . 2 . . . . 125 ASN HB2 . 27040 1 1366 . 1 1 125 125 ASN HB3 H 1 2.919 0.05 . 2 . . . . 125 ASN HB3 . 27040 1 1367 . 1 1 125 125 ASN HD21 H 1 6.849 0.05 . 1 . . . . 125 ASN HD21 . 27040 1 1368 . 1 1 125 125 ASN HD22 H 1 7.550 0.05 . 1 . . . . 125 ASN HD22 . 27040 1 1369 . 1 1 125 125 ASN C C 13 175.701 0.1 . 1 . . . . 125 ASN C . 27040 1 1370 . 1 1 125 125 ASN CA C 13 52.492 0.15 . 1 . . . . 125 ASN CA . 27040 1 1371 . 1 1 125 125 ASN CB C 13 38.267 0.15 . 1 . . . . 125 ASN CB . 27040 1 1372 . 1 1 125 125 ASN CG C 13 177.763 0.2 . 1 . . . . 125 ASN CG . 27040 1 1373 . 1 1 125 125 ASN N N 15 123.321 0.05 . 1 . . . . 125 ASN N . 27040 1 1374 . 1 1 125 125 ASN ND2 N 15 112.399 0.05 . 1 . . . . 125 ASN ND2 . 27040 1 1375 . 1 1 126 126 HIS H H 1 8.047 0.01 . 1 . . . . 126 HIS H . 27040 1 1376 . 1 1 126 126 HIS HA H 1 4.694 0.05 . 1 . . . . 126 HIS HA . 27040 1 1377 . 1 1 126 126 HIS HB2 H 1 3.140 0.05 . 2 . . . . 126 HIS HB2 . 27040 1 1378 . 1 1 126 126 HIS HB3 H 1 3.424 0.05 . 2 . . . . 126 HIS HB3 . 27040 1 1379 . 1 1 126 126 HIS C C 13 175.556 0.1 . 1 . . . . 126 HIS C . 27040 1 1380 . 1 1 126 126 HIS CA C 13 58.270 0.15 . 1 . . . . 126 HIS CA . 27040 1 1381 . 1 1 126 126 HIS CB C 13 31.148 0.15 . 1 . . . . 126 HIS CB . 27040 1 1382 . 1 1 126 126 HIS N N 15 119.273 0.05 . 1 . . . . 126 HIS N . 27040 1 1383 . 1 1 127 127 GLU H H 1 8.611 0.01 . 1 . . . . 127 GLU H . 27040 1 1384 . 1 1 127 127 GLU HA H 1 4.443 0.05 . 1 . . . . 127 GLU HA . 27040 1 1385 . 1 1 127 127 GLU HB2 H 1 2.156 0.05 . 1 . . . . 127 GLU HB2 . 27040 1 1386 . 1 1 127 127 GLU HB3 H 1 2.156 0.05 . 1 . . . . 127 GLU HB3 . 27040 1 1387 . 1 1 127 127 GLU HG2 H 1 2.156 0.05 . 1 . . . . 127 GLU HG2 . 27040 1 1388 . 1 1 127 127 GLU HG3 H 1 2.156 0.05 . 1 . . . . 127 GLU HG3 . 27040 1 1389 . 1 1 127 127 GLU C C 13 175.974 0.1 . 1 . . . . 127 GLU C . 27040 1 1390 . 1 1 127 127 GLU CA C 13 54.680 0.15 . 1 . . . . 127 GLU CA . 27040 1 1391 . 1 1 127 127 GLU CB C 13 31.555 0.15 . 1 . . . . 127 GLU CB . 27040 1 1392 . 1 1 127 127 GLU CG C 13 36.240 0.2 . 1 . . . . 127 GLU CG . 27040 1 1393 . 1 1 127 127 GLU N N 15 122.042 0.05 . 1 . . . . 127 GLU N . 27040 1 1394 . 1 1 128 128 VAL H H 1 7.455 0.01 . 1 . . . . 128 VAL H . 27040 1 1395 . 1 1 128 128 VAL HA H 1 3.793 0.05 . 1 . . . . 128 VAL HA . 27040 1 1396 . 1 1 128 128 VAL HB H 1 1.360 0.05 . 1 . . . . 128 VAL HB . 27040 1 1397 . 1 1 128 128 VAL HG11 H 1 0.518 0.05 . 2 . . . . 128 VAL MG1 . 27040 1 1398 . 1 1 128 128 VAL HG12 H 1 0.518 0.05 . 2 . . . . 128 VAL MG1 . 27040 1 1399 . 1 1 128 128 VAL HG13 H 1 0.518 0.05 . 2 . . . . 128 VAL MG1 . 27040 1 1400 . 1 1 128 128 VAL HG21 H 1 0.178 0.05 . 2 . . . . 128 VAL MG2 . 27040 1 1401 . 1 1 128 128 VAL HG22 H 1 0.178 0.05 . 2 . . . . 128 VAL MG2 . 27040 1 1402 . 1 1 128 128 VAL HG23 H 1 0.178 0.05 . 2 . . . . 128 VAL MG2 . 27040 1 1403 . 1 1 128 128 VAL C C 13 175.635 0.1 . 1 . . . . 128 VAL C . 27040 1 1404 . 1 1 128 128 VAL CA C 13 62.270 0.15 . 1 . . . . 128 VAL CA . 27040 1 1405 . 1 1 128 128 VAL CB C 13 32.003 0.15 . 1 . . . . 128 VAL CB . 27040 1 1406 . 1 1 128 128 VAL CG1 C 13 22.383 0.2 . 2 . . . . 128 VAL CG1 . 27040 1 1407 . 1 1 128 128 VAL CG2 C 13 20.903 0.2 . 2 . . . . 128 VAL CG2 . 27040 1 1408 . 1 1 128 128 VAL N N 15 121.370 0.05 . 1 . . . . 128 VAL N . 27040 1 1409 . 1 1 129 129 LYS H H 1 8.542 0.01 . 1 . . . . 129 LYS H . 27040 1 1410 . 1 1 129 129 LYS HA H 1 4.331 0.05 . 1 . . . . 129 LYS HA . 27040 1 1411 . 1 1 129 129 LYS HB2 H 1 1.682 0.05 . 1 . . . . 129 LYS HB2 . 27040 1 1412 . 1 1 129 129 LYS HB3 H 1 1.682 0.05 . 1 . . . . 129 LYS HB3 . 27040 1 1413 . 1 1 129 129 LYS HG2 H 1 1.513 0.05 . 1 . . . . 129 LYS HG2 . 27040 1 1414 . 1 1 129 129 LYS HG3 H 1 1.513 0.05 . 1 . . . . 129 LYS HG3 . 27040 1 1415 . 1 1 129 129 LYS HD2 H 1 1.587 0.05 . 1 . . . . 129 LYS HD2 . 27040 1 1416 . 1 1 129 129 LYS HD3 H 1 1.587 0.05 . 1 . . . . 129 LYS HD3 . 27040 1 1417 . 1 1 129 129 LYS HE2 H 1 3.022 0.05 . 1 . . . . 129 LYS HE2 . 27040 1 1418 . 1 1 129 129 LYS HE3 H 1 3.022 0.05 . 1 . . . . 129 LYS HE3 . 27040 1 1419 . 1 1 129 129 LYS C C 13 177.889 0.1 . 1 . . . . 129 LYS C . 27040 1 1420 . 1 1 129 129 LYS CA C 13 55.669 0.15 . 1 . . . . 129 LYS CA . 27040 1 1421 . 1 1 129 129 LYS CB C 13 32.617 0.15 . 1 . . . . 129 LYS CB . 27040 1 1422 . 1 1 129 129 LYS CG C 13 25.011 0.2 . 1 . . . . 129 LYS CG . 27040 1 1423 . 1 1 129 129 LYS CD C 13 28.807 0.2 . 1 . . . . 129 LYS CD . 27040 1 1424 . 1 1 129 129 LYS CE C 13 42.339 0.2 . 1 . . . . 129 LYS CE . 27040 1 1425 . 1 1 129 129 LYS N N 15 127.118 0.05 . 1 . . . . 129 LYS N . 27040 1 1426 . 1 1 130 130 ALA H H 1 8.920 0.01 . 1 . . . . 130 ALA H . 27040 1 1427 . 1 1 130 130 ALA HA H 1 4.806 0.05 . 1 . . . . 130 ALA HA . 27040 1 1428 . 1 1 130 130 ALA HB1 H 1 1.438 0.05 . 1 . . . . 130 ALA MB . 27040 1 1429 . 1 1 130 130 ALA HB2 H 1 1.438 0.05 . 1 . . . . 130 ALA MB . 27040 1 1430 . 1 1 130 130 ALA HB3 H 1 1.438 0.05 . 1 . . . . 130 ALA MB . 27040 1 1431 . 1 1 130 130 ALA C C 13 180.405 0.1 . 1 . . . . 130 ALA C . 27040 1 1432 . 1 1 130 130 ALA CA C 13 55.489 0.15 . 1 . . . . 130 ALA CA . 27040 1 1433 . 1 1 130 130 ALA CB C 13 18.092 0.15 . 1 . . . . 130 ALA CB . 27040 1 1434 . 1 1 130 130 ALA N N 15 128.554 0.05 . 1 . . . . 130 ALA N . 27040 1 1435 . 1 1 131 131 GLU H H 1 9.504 0.01 . 1 . . . . 131 GLU H . 27040 1 1436 . 1 1 131 131 GLU HA H 1 4.008 0.05 . 1 . . . . 131 GLU HA . 27040 1 1437 . 1 1 131 131 GLU HB2 H 1 2.282 0.05 . 1 . . . . 131 GLU HB2 . 27040 1 1438 . 1 1 131 131 GLU HB3 H 1 2.282 0.05 . 1 . . . . 131 GLU HB3 . 27040 1 1439 . 1 1 131 131 GLU HG2 H 1 2.354 0.05 . 1 . . . . 131 GLU HG2 . 27040 1 1440 . 1 1 131 131 GLU HG3 H 1 2.354 0.05 . 1 . . . . 131 GLU HG3 . 27040 1 1441 . 1 1 131 131 GLU C C 13 179.241 0.1 . 1 . . . . 131 GLU C . 27040 1 1442 . 1 1 131 131 GLU CA C 13 59.670 0.15 . 1 . . . . 131 GLU CA . 27040 1 1443 . 1 1 131 131 GLU CB C 13 28.882 0.15 . 1 . . . . 131 GLU CB . 27040 1 1444 . 1 1 131 131 GLU CG C 13 36.389 0.2 . 1 . . . . 131 GLU CG . 27040 1 1445 . 1 1 131 131 GLU N N 15 116.267 0.05 . 1 . . . . 131 GLU N . 27040 1 1446 . 1 1 132 132 GLN H H 1 7.402 0.01 . 1 . . . . 132 GLN H . 27040 1 1447 . 1 1 132 132 GLN HA H 1 4.130 0.05 . 1 . . . . 132 GLN HA . 27040 1 1448 . 1 1 132 132 GLN HB2 H 1 2.368 0.05 . 1 . . . . 132 GLN HB2 . 27040 1 1449 . 1 1 132 132 GLN HB3 H 1 2.368 0.05 . 1 . . . . 132 GLN HB3 . 27040 1 1450 . 1 1 132 132 GLN HG2 H 1 2.368 0.05 . 1 . . . . 132 GLN HG2 . 27040 1 1451 . 1 1 132 132 GLN HG3 H 1 2.368 0.05 . 1 . . . . 132 GLN HG3 . 27040 1 1452 . 1 1 132 132 GLN C C 13 178.116 0.1 . 1 . . . . 132 GLN C . 27040 1 1453 . 1 1 132 132 GLN CA C 13 58.313 0.15 . 1 . . . . 132 GLN CA . 27040 1 1454 . 1 1 132 132 GLN CB C 13 28.471 0.15 . 1 . . . . 132 GLN CB . 27040 1 1455 . 1 1 132 132 GLN CG C 13 34.284 0.2 . 1 . . . . 132 GLN CG . 27040 1 1456 . 1 1 132 132 GLN N N 15 119.690 0.05 . 1 . . . . 132 GLN N . 27040 1 1457 . 1 1 133 133 VAL H H 1 7.060 0.01 . 1 . . . . 133 VAL H . 27040 1 1458 . 1 1 133 133 VAL HA H 1 3.481 0.05 . 1 . . . . 133 VAL HA . 27040 1 1459 . 1 1 133 133 VAL HB H 1 1.490 0.05 . 1 . . . . 133 VAL HB . 27040 1 1460 . 1 1 133 133 VAL HG11 H 1 0.192 0.05 . 2 . . . . 133 VAL MG1 . 27040 1 1461 . 1 1 133 133 VAL HG12 H 1 0.192 0.05 . 2 . . . . 133 VAL MG1 . 27040 1 1462 . 1 1 133 133 VAL HG13 H 1 0.192 0.05 . 2 . . . . 133 VAL MG1 . 27040 1 1463 . 1 1 133 133 VAL HG21 H 1 0.404 0.05 . 2 . . . . 133 VAL MG2 . 27040 1 1464 . 1 1 133 133 VAL HG22 H 1 0.404 0.05 . 2 . . . . 133 VAL MG2 . 27040 1 1465 . 1 1 133 133 VAL HG23 H 1 0.404 0.05 . 2 . . . . 133 VAL MG2 . 27040 1 1466 . 1 1 133 133 VAL C C 13 178.919 0.1 . 1 . . . . 133 VAL C . 27040 1 1467 . 1 1 133 133 VAL CA C 13 65.611 0.15 . 1 . . . . 133 VAL CA . 27040 1 1468 . 1 1 133 133 VAL CB C 13 31.561 0.15 . 1 . . . . 133 VAL CB . 27040 1 1469 . 1 1 133 133 VAL CG1 C 13 20.954 0.2 . 1 . . . . 133 VAL CG1 . 27040 1 1470 . 1 1 133 133 VAL CG2 C 13 20.954 0.2 . 1 . . . . 133 VAL CG2 . 27040 1 1471 . 1 1 133 133 VAL N N 15 121.087 0.05 . 1 . . . . 133 VAL N . 27040 1 1472 . 1 1 134 134 LYS H H 1 7.948 0.01 . 1 . . . . 134 LYS H . 27040 1 1473 . 1 1 134 134 LYS HA H 1 4.001 0.05 . 1 . . . . 134 LYS HA . 27040 1 1474 . 1 1 134 134 LYS HB2 H 1 1.770 0.05 . 1 . . . . 134 LYS HB2 . 27040 1 1475 . 1 1 134 134 LYS HB3 H 1 1.770 0.05 . 1 . . . . 134 LYS HB3 . 27040 1 1476 . 1 1 134 134 LYS HG2 H 1 1.393 0.05 . 1 . . . . 134 LYS HG2 . 27040 1 1477 . 1 1 134 134 LYS HG3 H 1 1.393 0.05 . 1 . . . . 134 LYS HG3 . 27040 1 1478 . 1 1 134 134 LYS HD2 H 1 1.698 0.05 . 1 . . . . 134 LYS HD2 . 27040 1 1479 . 1 1 134 134 LYS HD3 H 1 1.698 0.05 . 1 . . . . 134 LYS HD3 . 27040 1 1480 . 1 1 134 134 LYS HE2 H 1 3.003 0.05 . 1 . . . . 134 LYS HE2 . 27040 1 1481 . 1 1 134 134 LYS HE3 H 1 3.003 0.05 . 1 . . . . 134 LYS HE3 . 27040 1 1482 . 1 1 134 134 LYS C C 13 178.089 0.1 . 1 . . . . 134 LYS C . 27040 1 1483 . 1 1 134 134 LYS CA C 13 59.592 0.15 . 1 . . . . 134 LYS CA . 27040 1 1484 . 1 1 134 134 LYS CB C 13 33.001 0.15 . 1 . . . . 134 LYS CB . 27040 1 1485 . 1 1 134 134 LYS CG C 13 24.863 0.2 . 1 . . . . 134 LYS CG . 27040 1 1486 . 1 1 134 134 LYS CD C 13 29.686 0.2 . 1 . . . . 134 LYS CD . 27040 1 1487 . 1 1 134 134 LYS CE C 13 42.126 0.2 . 1 . . . . 134 LYS CE . 27040 1 1488 . 1 1 134 134 LYS N N 15 120.765 0.05 . 1 . . . . 134 LYS N . 27040 1 1489 . 1 1 135 135 ALA H H 1 7.820 0.01 . 1 . . . . 135 ALA H . 27040 1 1490 . 1 1 135 135 ALA HA H 1 4.184 0.05 . 1 . . . . 135 ALA HA . 27040 1 1491 . 1 1 135 135 ALA HB1 H 1 1.525 0.05 . 1 . . . . 135 ALA MB . 27040 1 1492 . 1 1 135 135 ALA HB2 H 1 1.525 0.05 . 1 . . . . 135 ALA MB . 27040 1 1493 . 1 1 135 135 ALA HB3 H 1 1.525 0.05 . 1 . . . . 135 ALA MB . 27040 1 1494 . 1 1 135 135 ALA CA C 13 55.066 0.15 . 1 . . . . 135 ALA CA . 27040 1 1495 . 1 1 135 135 ALA CB C 13 18.181 0.15 . 1 . . . . 135 ALA CB . 27040 1 1496 . 1 1 135 135 ALA N N 15 120.431 0.05 . 1 . . . . 135 ALA N . 27040 1 1497 . 1 1 137 137 LYS HA H 1 4.111 0.05 . 1 . . . . 137 LYS HA . 27040 1 1498 . 1 1 137 137 LYS HB2 H 1 2.043 0.05 . 1 . . . . 137 LYS HB2 . 27040 1 1499 . 1 1 137 137 LYS HB3 H 1 2.043 0.05 . 1 . . . . 137 LYS HB3 . 27040 1 1500 . 1 1 137 137 LYS HG2 H 1 1.498 0.05 . 1 . . . . 137 LYS HG2 . 27040 1 1501 . 1 1 137 137 LYS HG3 H 1 1.498 0.05 . 1 . . . . 137 LYS HG3 . 27040 1 1502 . 1 1 137 137 LYS HD2 H 1 1.810 0.05 . 1 . . . . 137 LYS HD2 . 27040 1 1503 . 1 1 137 137 LYS HD3 H 1 1.810 0.05 . 1 . . . . 137 LYS HD3 . 27040 1 1504 . 1 1 137 137 LYS C C 13 179.278 0.1 . 1 . . . . 137 LYS C . 27040 1 1505 . 1 1 137 137 LYS CA C 13 59.532 0.15 . 1 . . . . 137 LYS CA . 27040 1 1506 . 1 1 137 137 LYS CB C 13 32.595 0.15 . 1 . . . . 137 LYS CB . 27040 1 1507 . 1 1 137 137 LYS CG C 13 25.130 0.2 . 1 . . . . 137 LYS CG . 27040 1 1508 . 1 1 137 137 LYS CD C 13 30.077 0.2 . 1 . . . . 137 LYS CD . 27040 1 1509 . 1 1 138 138 GLU H H 1 8.432 0.01 . 1 . . . . 138 GLU H . 27040 1 1510 . 1 1 138 138 GLU HA H 1 4.118 0.05 . 1 . . . . 138 GLU HA . 27040 1 1511 . 1 1 138 138 GLU HB2 H 1 2.281 0.05 . 1 . . . . 138 GLU HB2 . 27040 1 1512 . 1 1 138 138 GLU HB3 H 1 2.281 0.05 . 1 . . . . 138 GLU HB3 . 27040 1 1513 . 1 1 138 138 GLU HG2 H 1 2.563 0.05 . 1 . . . . 138 GLU HG2 . 27040 1 1514 . 1 1 138 138 GLU HG3 H 1 2.563 0.05 . 1 . . . . 138 GLU HG3 . 27040 1 1515 . 1 1 138 138 GLU C C 13 179.633 0.1 . 1 . . . . 138 GLU C . 27040 1 1516 . 1 1 138 138 GLU CA C 13 59.327 0.15 . 1 . . . . 138 GLU CA . 27040 1 1517 . 1 1 138 138 GLU CB C 13 29.464 0.15 . 1 . . . . 138 GLU CB . 27040 1 1518 . 1 1 138 138 GLU CG C 13 36.780 0.2 . 1 . . . . 138 GLU CG . 27040 1 1519 . 1 1 138 138 GLU N N 15 118.770 0.05 . 1 . . . . 138 GLU N . 27040 1 1520 . 1 1 139 139 MET H H 1 8.256 0.01 . 1 . . . . 139 MET H . 27040 1 1521 . 1 1 139 139 MET HA H 1 4.113 0.05 . 1 . . . . 139 MET HA . 27040 1 1522 . 1 1 139 139 MET HB2 H 1 2.035 0.05 . 1 . . . . 139 MET HB2 . 27040 1 1523 . 1 1 139 139 MET HB3 H 1 2.035 0.05 . 1 . . . . 139 MET HB3 . 27040 1 1524 . 1 1 139 139 MET HG2 H 1 2.585 0.05 . 1 . . . . 139 MET HG2 . 27040 1 1525 . 1 1 139 139 MET HG3 H 1 2.585 0.05 . 1 . . . . 139 MET HG3 . 27040 1 1526 . 1 1 139 139 MET HE1 H 1 2.134 0.05 . 1 . . . . 139 MET ME . 27040 1 1527 . 1 1 139 139 MET HE2 H 1 2.134 0.05 . 1 . . . . 139 MET ME . 27040 1 1528 . 1 1 139 139 MET HE3 H 1 2.134 0.05 . 1 . . . . 139 MET ME . 27040 1 1529 . 1 1 139 139 MET C C 13 178.359 0.1 . 1 . . . . 139 MET C . 27040 1 1530 . 1 1 139 139 MET CA C 13 59.025 0.15 . 1 . . . . 139 MET CA . 27040 1 1531 . 1 1 139 139 MET CB C 13 32.562 0.15 . 1 . . . . 139 MET CB . 27040 1 1532 . 1 1 139 139 MET CG C 13 32.527 0.2 . 1 . . . . 139 MET CG . 27040 1 1533 . 1 1 139 139 MET CE C 13 16.874 0.2 . 1 . . . . 139 MET CE . 27040 1 1534 . 1 1 139 139 MET N N 15 120.177 0.05 . 1 . . . . 139 MET N . 27040 1 1535 . 1 1 140 140 GLY H H 1 8.396 0.01 . 1 . . . . 140 GLY H . 27040 1 1536 . 1 1 140 140 GLY HA2 H 1 3.679 0.05 . 2 . . . . 140 GLY HA2 . 27040 1 1537 . 1 1 140 140 GLY HA3 H 1 4.124 0.05 . 2 . . . . 140 GLY HA3 . 27040 1 1538 . 1 1 140 140 GLY C C 13 176.056 0.1 . 1 . . . . 140 GLY C . 27040 1 1539 . 1 1 140 140 GLY CA C 13 48.536 0.15 . 1 . . . . 140 GLY CA . 27040 1 1540 . 1 1 140 140 GLY N N 15 106.233 0.05 . 1 . . . . 140 GLY N . 27040 1 1541 . 1 1 141 141 GLU H H 1 8.243 0.01 . 1 . . . . 141 GLU H . 27040 1 1542 . 1 1 141 141 GLU HA H 1 4.057 0.05 . 1 . . . . 141 GLU HA . 27040 1 1543 . 1 1 141 141 GLU HB2 H 1 2.365 0.05 . 1 . . . . 141 GLU HB2 . 27040 1 1544 . 1 1 141 141 GLU HB3 H 1 2.365 0.05 . 1 . . . . 141 GLU HB3 . 27040 1 1545 . 1 1 141 141 GLU HG2 H 1 2.435 0.05 . 1 . . . . 141 GLU HG2 . 27040 1 1546 . 1 1 141 141 GLU HG3 H 1 2.435 0.05 . 1 . . . . 141 GLU HG3 . 27040 1 1547 . 1 1 141 141 GLU C C 13 178.232 0.1 . 1 . . . . 141 GLU C . 27040 1 1548 . 1 1 141 141 GLU CA C 13 60.008 0.15 . 1 . . . . 141 GLU CA . 27040 1 1549 . 1 1 141 141 GLU CB C 13 29.438 0.15 . 1 . . . . 141 GLU CB . 27040 1 1550 . 1 1 141 141 GLU CG C 13 36.122 0.2 . 1 . . . . 141 GLU CG . 27040 1 1551 . 1 1 141 141 GLU N N 15 121.505 0.05 . 1 . . . . 141 GLU N . 27040 1 1552 . 1 1 142 142 THR H H 1 8.344 0.01 . 1 . . . . 142 THR H . 27040 1 1553 . 1 1 142 142 THR HA H 1 3.890 0.05 . 1 . . . . 142 THR HA . 27040 1 1554 . 1 1 142 142 THR HB H 1 3.890 0.05 . 1 . . . . 142 THR HB . 27040 1 1555 . 1 1 142 142 THR HG21 H 1 1.224 0.05 . 1 . . . . 142 THR MG . 27040 1 1556 . 1 1 142 142 THR HG22 H 1 1.224 0.05 . 1 . . . . 142 THR MG . 27040 1 1557 . 1 1 142 142 THR HG23 H 1 1.224 0.05 . 1 . . . . 142 THR MG . 27040 1 1558 . 1 1 142 142 THR C C 13 177.475 0.1 . 1 . . . . 142 THR C . 27040 1 1559 . 1 1 142 142 THR CA C 13 66.880 0.15 . 1 . . . . 142 THR CA . 27040 1 1560 . 1 1 142 142 THR CB C 13 68.449 0.15 . 1 . . . . 142 THR CB . 27040 1 1561 . 1 1 142 142 THR CG2 C 13 21.059 0.2 . 1 . . . . 142 THR CG2 . 27040 1 1562 . 1 1 142 142 THR N N 15 117.061 0.05 . 1 . . . . 142 THR N . 27040 1 1563 . 1 1 143 143 LEU H H 1 8.204 0.01 . 1 . . . . 143 LEU H . 27040 1 1564 . 1 1 143 143 LEU HA H 1 3.898 0.05 . 1 . . . . 143 LEU HA . 27040 1 1565 . 1 1 143 143 LEU HB2 H 1 1.375 0.05 . 1 . . . . 143 LEU HB2 . 27040 1 1566 . 1 1 143 143 LEU HB3 H 1 1.375 0.05 . 1 . . . . 143 LEU HB3 . 27040 1 1567 . 1 1 143 143 LEU HG H 1 1.710 0.05 . 1 . . . . 143 LEU HG . 27040 1 1568 . 1 1 143 143 LEU HD11 H 1 0.876 0.05 . 2 . . . . 143 LEU MD1 . 27040 1 1569 . 1 1 143 143 LEU HD12 H 1 0.876 0.05 . 2 . . . . 143 LEU MD1 . 27040 1 1570 . 1 1 143 143 LEU HD13 H 1 0.876 0.05 . 2 . . . . 143 LEU MD1 . 27040 1 1571 . 1 1 143 143 LEU HD21 H 1 0.757 0.05 . 2 . . . . 143 LEU MD2 . 27040 1 1572 . 1 1 143 143 LEU HD22 H 1 0.757 0.05 . 2 . . . . 143 LEU MD2 . 27040 1 1573 . 1 1 143 143 LEU HD23 H 1 0.757 0.05 . 2 . . . . 143 LEU MD2 . 27040 1 1574 . 1 1 143 143 LEU C C 13 177.466 0.1 . 1 . . . . 143 LEU C . 27040 1 1575 . 1 1 143 143 LEU CA C 13 58.144 0.15 . 1 . . . . 143 LEU CA . 27040 1 1576 . 1 1 143 143 LEU CB C 13 41.834 0.15 . 1 . . . . 143 LEU CB . 27040 1 1577 . 1 1 143 143 LEU CG C 13 26.007 0.2 . 1 . . . . 143 LEU CG . 27040 1 1578 . 1 1 143 143 LEU CD1 C 13 26.007 0.2 . 2 . . . . 143 LEU CD1 . 27040 1 1579 . 1 1 143 143 LEU CD2 C 13 22.681 0.2 . 2 . . . . 143 LEU CD2 . 27040 1 1580 . 1 1 143 143 LEU N N 15 119.476 0.05 . 1 . . . . 143 LEU N . 27040 1 1581 . 1 1 144 144 LEU H H 1 8.258 0.01 . 1 . . . . 144 LEU H . 27040 1 1582 . 1 1 144 144 LEU HA H 1 3.367 0.05 . 1 . . . . 144 LEU HA . 27040 1 1583 . 1 1 144 144 LEU HB2 H 1 1.380 0.05 . 1 . . . . 144 LEU HB2 . 27040 1 1584 . 1 1 144 144 LEU HB3 H 1 1.380 0.05 . 1 . . . . 144 LEU HB3 . 27040 1 1585 . 1 1 144 144 LEU HG H 1 1.380 0.05 . 1 . . . . 144 LEU HG . 27040 1 1586 . 1 1 144 144 LEU HD11 H 1 0.801 0.05 . 2 . . . . 144 LEU MD1 . 27040 1 1587 . 1 1 144 144 LEU HD12 H 1 0.801 0.05 . 2 . . . . 144 LEU MD1 . 27040 1 1588 . 1 1 144 144 LEU HD13 H 1 0.801 0.05 . 2 . . . . 144 LEU MD1 . 27040 1 1589 . 1 1 144 144 LEU HD21 H 1 0.664 0.05 . 2 . . . . 144 LEU MD2 . 27040 1 1590 . 1 1 144 144 LEU HD22 H 1 0.664 0.05 . 2 . . . . 144 LEU MD2 . 27040 1 1591 . 1 1 144 144 LEU HD23 H 1 0.664 0.05 . 2 . . . . 144 LEU MD2 . 27040 1 1592 . 1 1 144 144 LEU C C 13 178.455 0.1 . 1 . . . . 144 LEU C . 27040 1 1593 . 1 1 144 144 LEU CA C 13 57.959 0.15 . 1 . . . . 144 LEU CA . 27040 1 1594 . 1 1 144 144 LEU CB C 13 41.796 0.15 . 1 . . . . 144 LEU CB . 27040 1 1595 . 1 1 144 144 LEU CG C 13 27.619 0.2 . 1 . . . . 144 LEU CG . 27040 1 1596 . 1 1 144 144 LEU CD1 C 13 27.602 0.2 . 2 . . . . 144 LEU CD1 . 27040 1 1597 . 1 1 144 144 LEU CD2 C 13 23.022 0.2 . 2 . . . . 144 LEU CD2 . 27040 1 1598 . 1 1 144 144 LEU N N 15 118.689 0.05 . 1 . . . . 144 LEU N . 27040 1 1599 . 1 1 145 145 ARG H H 1 8.722 0.01 . 1 . . . . 145 ARG H . 27040 1 1600 . 1 1 145 145 ARG HA H 1 4.136 0.05 . 1 . . . . 145 ARG HA . 27040 1 1601 . 1 1 145 145 ARG HB2 H 1 2.041 0.05 . 1 . . . . 145 ARG HB2 . 27040 1 1602 . 1 1 145 145 ARG HB3 H 1 2.041 0.05 . 1 . . . . 145 ARG HB3 . 27040 1 1603 . 1 1 145 145 ARG HG2 H 1 1.992 0.05 . 1 . . . . 145 ARG HG2 . 27040 1 1604 . 1 1 145 145 ARG HG3 H 1 1.992 0.05 . 1 . . . . 145 ARG HG3 . 27040 1 1605 . 1 1 145 145 ARG HD2 H 1 3.087 0.05 . 1 . . . . 145 ARG HD2 . 27040 1 1606 . 1 1 145 145 ARG HD3 H 1 3.087 0.05 . 1 . . . . 145 ARG HD3 . 27040 1 1607 . 1 1 145 145 ARG C C 13 179.427 0.1 . 1 . . . . 145 ARG C . 27040 1 1608 . 1 1 145 145 ARG CA C 13 57.621 0.15 . 1 . . . . 145 ARG CA . 27040 1 1609 . 1 1 145 145 ARG CB C 13 28.236 0.15 . 1 . . . . 145 ARG CB . 27040 1 1610 . 1 1 145 145 ARG CG C 13 26.670 0.2 . 1 . . . . 145 ARG CG . 27040 1 1611 . 1 1 145 145 ARG CD C 13 42.285 0.2 . 1 . . . . 145 ARG CD . 27040 1 1612 . 1 1 145 145 ARG N N 15 115.193 0.05 . 1 . . . . 145 ARG N . 27040 1 1613 . 1 1 146 146 ALA H H 1 7.867 0.01 . 1 . . . . 146 ALA H . 27040 1 1614 . 1 1 146 146 ALA HA H 1 4.029 0.05 . 1 . . . . 146 ALA HA . 27040 1 1615 . 1 1 146 146 ALA HB1 H 1 1.565 0.05 . 1 . . . . 146 ALA MB . 27040 1 1616 . 1 1 146 146 ALA HB2 H 1 1.565 0.05 . 1 . . . . 146 ALA MB . 27040 1 1617 . 1 1 146 146 ALA HB3 H 1 1.565 0.05 . 1 . . . . 146 ALA MB . 27040 1 1618 . 1 1 146 146 ALA C C 13 180.838 0.1 . 1 . . . . 146 ALA C . 27040 1 1619 . 1 1 146 146 ALA CA C 13 55.198 0.15 . 1 . . . . 146 ALA CA . 27040 1 1620 . 1 1 146 146 ALA CB C 13 18.220 0.15 . 1 . . . . 146 ALA CB . 27040 1 1621 . 1 1 146 146 ALA N N 15 123.035 0.05 . 1 . . . . 146 ALA N . 27040 1 1622 . 1 1 147 147 VAL H H 1 7.986 0.01 . 1 . . . . 147 VAL H . 27040 1 1623 . 1 1 147 147 VAL HA H 1 3.486 0.05 . 1 . . . . 147 VAL HA . 27040 1 1624 . 1 1 147 147 VAL HB H 1 1.887 0.05 . 1 . . . . 147 VAL HB . 27040 1 1625 . 1 1 147 147 VAL HG11 H 1 0.630 0.05 . 2 . . . . 147 VAL MG1 . 27040 1 1626 . 1 1 147 147 VAL HG12 H 1 0.630 0.05 . 2 . . . . 147 VAL MG1 . 27040 1 1627 . 1 1 147 147 VAL HG13 H 1 0.630 0.05 . 2 . . . . 147 VAL MG1 . 27040 1 1628 . 1 1 147 147 VAL HG21 H 1 0.807 0.05 . 2 . . . . 147 VAL MG2 . 27040 1 1629 . 1 1 147 147 VAL HG22 H 1 0.807 0.05 . 2 . . . . 147 VAL MG2 . 27040 1 1630 . 1 1 147 147 VAL HG23 H 1 0.807 0.05 . 2 . . . . 147 VAL MG2 . 27040 1 1631 . 1 1 147 147 VAL C C 13 177.132 0.1 . 1 . . . . 147 VAL C . 27040 1 1632 . 1 1 147 147 VAL CA C 13 67.097 0.15 . 1 . . . . 147 VAL CA . 27040 1 1633 . 1 1 147 147 VAL CB C 13 31.362 0.15 . 1 . . . . 147 VAL CB . 27040 1 1634 . 1 1 147 147 VAL CG1 C 13 21.672 0.2 . 2 . . . . 147 VAL CG1 . 27040 1 1635 . 1 1 147 147 VAL CG2 C 13 24.216 0.2 . 2 . . . . 147 VAL CG2 . 27040 1 1636 . 1 1 147 147 VAL N N 15 120.233 0.05 . 1 . . . . 147 VAL N . 27040 1 1637 . 1 1 148 148 GLU H H 1 9.123 0.01 . 1 . . . . 148 GLU H . 27040 1 1638 . 1 1 148 148 GLU HA H 1 3.652 0.05 . 1 . . . . 148 GLU HA . 27040 1 1639 . 1 1 148 148 GLU HB2 H 1 2.083 0.05 . 1 . . . . 148 GLU HB2 . 27040 1 1640 . 1 1 148 148 GLU HB3 H 1 2.083 0.05 . 1 . . . . 148 GLU HB3 . 27040 1 1641 . 1 1 148 148 GLU HG2 H 1 2.180 0.05 . 1 . . . . 148 GLU HG2 . 27040 1 1642 . 1 1 148 148 GLU HG3 H 1 2.180 0.05 . 1 . . . . 148 GLU HG3 . 27040 1 1643 . 1 1 148 148 GLU C C 13 177.447 0.1 . 1 . . . . 148 GLU C . 27040 1 1644 . 1 1 148 148 GLU CA C 13 60.670 0.15 . 1 . . . . 148 GLU CA . 27040 1 1645 . 1 1 148 148 GLU CB C 13 31.660 0.15 . 1 . . . . 148 GLU CB . 27040 1 1646 . 1 1 148 148 GLU CG C 13 37.868 0.2 . 1 . . . . 148 GLU CG . 27040 1 1647 . 1 1 148 148 GLU N N 15 120.816 0.05 . 1 . . . . 148 GLU N . 27040 1 1648 . 1 1 149 149 SER H H 1 8.390 0.01 . 1 . . . . 149 SER H . 27040 1 1649 . 1 1 149 149 SER HA H 1 4.124 0.05 . 1 . . . . 149 SER HA . 27040 1 1650 . 1 1 149 149 SER C C 13 177.341 0.1 . 1 . . . . 149 SER C . 27040 1 1651 . 1 1 149 149 SER CA C 13 62.530 0.15 . 1 . . . . 149 SER CA . 27040 1 1652 . 1 1 149 149 SER N N 15 112.384 0.05 . 1 . . . . 149 SER N . 27040 1 1653 . 1 1 150 150 TYR H H 1 7.699 0.01 . 1 . . . . 150 TYR H . 27040 1 1654 . 1 1 150 150 TYR HA H 1 4.020 0.05 . 1 . . . . 150 TYR HA . 27040 1 1655 . 1 1 150 150 TYR HB2 H 1 3.262 0.05 . 1 . . . . 150 TYR HB2 . 27040 1 1656 . 1 1 150 150 TYR HB3 H 1 3.262 0.05 . 1 . . . . 150 TYR HB3 . 27040 1 1657 . 1 1 150 150 TYR C C 13 178.471 0.1 . 1 . . . . 150 TYR C . 27040 1 1658 . 1 1 150 150 TYR CA C 13 62.384 0.15 . 1 . . . . 150 TYR CA . 27040 1 1659 . 1 1 150 150 TYR CB C 13 38.916 0.15 . 1 . . . . 150 TYR CB . 27040 1 1660 . 1 1 150 150 TYR N N 15 122.749 0.05 . 1 . . . . 150 TYR N . 27040 1 1661 . 1 1 151 151 LEU H H 1 8.718 0.01 . 1 . . . . 151 LEU H . 27040 1 1662 . 1 1 151 151 LEU HA H 1 4.060 0.05 . 1 . . . . 151 LEU HA . 27040 1 1663 . 1 1 151 151 LEU HB2 H 1 1.397 0.05 . 1 . . . . 151 LEU HB2 . 27040 1 1664 . 1 1 151 151 LEU HB3 H 1 1.397 0.05 . 1 . . . . 151 LEU HB3 . 27040 1 1665 . 1 1 151 151 LEU HG H 1 2.042 0.05 . 1 . . . . 151 LEU HG . 27040 1 1666 . 1 1 151 151 LEU HD11 H 1 0.686 0.05 . 2 . . . . 151 LEU MD1 . 27040 1 1667 . 1 1 151 151 LEU HD12 H 1 0.686 0.05 . 2 . . . . 151 LEU MD1 . 27040 1 1668 . 1 1 151 151 LEU HD13 H 1 0.686 0.05 . 2 . . . . 151 LEU MD1 . 27040 1 1669 . 1 1 151 151 LEU HD21 H 1 0.975 0.05 . 2 . . . . 151 LEU MD2 . 27040 1 1670 . 1 1 151 151 LEU HD22 H 1 0.975 0.05 . 2 . . . . 151 LEU MD2 . 27040 1 1671 . 1 1 151 151 LEU HD23 H 1 0.975 0.05 . 2 . . . . 151 LEU MD2 . 27040 1 1672 . 1 1 151 151 LEU C C 13 179.774 0.1 . 1 . . . . 151 LEU C . 27040 1 1673 . 1 1 151 151 LEU CA C 13 57.355 0.15 . 1 . . . . 151 LEU CA . 27040 1 1674 . 1 1 151 151 LEU CB C 13 41.136 0.15 . 1 . . . . 151 LEU CB . 27040 1 1675 . 1 1 151 151 LEU CG C 13 27.869 0.2 . 1 . . . . 151 LEU CG . 27040 1 1676 . 1 1 151 151 LEU CD1 C 13 27.904 0.2 . 2 . . . . 151 LEU CD1 . 27040 1 1677 . 1 1 151 151 LEU CD2 C 13 22.858 0.2 . 2 . . . . 151 LEU CD2 . 27040 1 1678 . 1 1 151 151 LEU N N 15 120.659 0.05 . 1 . . . . 151 LEU N . 27040 1 1679 . 1 1 152 152 LEU H H 1 8.348 0.01 . 1 . . . . 152 LEU H . 27040 1 1680 . 1 1 152 152 LEU HA H 1 4.130 0.05 . 1 . . . . 152 LEU HA . 27040 1 1681 . 1 1 152 152 LEU HB2 H 1 1.828 0.05 . 2 . . . . 152 LEU HB2 . 27040 1 1682 . 1 1 152 152 LEU HB3 H 1 1.643 0.05 . 2 . . . . 152 LEU HB3 . 27040 1 1683 . 1 1 152 152 LEU HG H 1 1.407 0.05 . 1 . . . . 152 LEU HG . 27040 1 1684 . 1 1 152 152 LEU HD11 H 1 0.808 0.05 . 2 . . . . 152 LEU MD1 . 27040 1 1685 . 1 1 152 152 LEU HD12 H 1 0.808 0.05 . 2 . . . . 152 LEU MD1 . 27040 1 1686 . 1 1 152 152 LEU HD13 H 1 0.808 0.05 . 2 . . . . 152 LEU MD1 . 27040 1 1687 . 1 1 152 152 LEU HD21 H 1 0.821 0.05 . 2 . . . . 152 LEU MD2 . 27040 1 1688 . 1 1 152 152 LEU HD22 H 1 0.821 0.05 . 2 . . . . 152 LEU MD2 . 27040 1 1689 . 1 1 152 152 LEU HD23 H 1 0.821 0.05 . 2 . . . . 152 LEU MD2 . 27040 1 1690 . 1 1 152 152 LEU C C 13 178.477 0.1 . 1 . . . . 152 LEU C . 27040 1 1691 . 1 1 152 152 LEU CA C 13 57.224 0.15 . 1 . . . . 152 LEU CA . 27040 1 1692 . 1 1 152 152 LEU CB C 13 42.191 0.15 . 1 . . . . 152 LEU CB . 27040 1 1693 . 1 1 152 152 LEU CG C 13 25.512 0.2 . 1 . . . . 152 LEU CG . 27040 1 1694 . 1 1 152 152 LEU CD1 C 13 22.459 0.2 . 2 . . . . 152 LEU CD1 . 27040 1 1695 . 1 1 152 152 LEU CD2 C 13 25.504 0.2 . 2 . . . . 152 LEU CD2 . 27040 1 1696 . 1 1 152 152 LEU N N 15 119.819 0.05 . 1 . . . . 152 LEU N . 27040 1 1697 . 1 1 153 153 ALA H H 1 7.308 0.01 . 1 . . . . 153 ALA H . 27040 1 1698 . 1 1 153 153 ALA HA H 1 4.201 0.05 . 1 . . . . 153 ALA HA . 27040 1 1699 . 1 1 153 153 ALA HB1 H 1 1.239 0.05 . 1 . . . . 153 ALA MB . 27040 1 1700 . 1 1 153 153 ALA HB2 H 1 1.239 0.05 . 1 . . . . 153 ALA MB . 27040 1 1701 . 1 1 153 153 ALA HB3 H 1 1.239 0.05 . 1 . . . . 153 ALA MB . 27040 1 1702 . 1 1 153 153 ALA C C 13 177.043 0.1 . 1 . . . . 153 ALA C . 27040 1 1703 . 1 1 153 153 ALA CA C 13 52.828 0.15 . 1 . . . . 153 ALA CA . 27040 1 1704 . 1 1 153 153 ALA CB C 13 19.085 0.15 . 1 . . . . 153 ALA CB . 27040 1 1705 . 1 1 153 153 ALA N N 15 119.369 0.05 . 1 . . . . 153 ALA N . 27040 1 1706 . 1 1 154 154 HIS H H 1 7.513 0.01 . 1 . . . . 154 HIS H . 27040 1 1707 . 1 1 154 154 HIS HA H 1 4.765 0.05 . 1 . . . . 154 HIS HA . 27040 1 1708 . 1 1 154 154 HIS HB2 H 1 2.602 0.05 . 2 . . . . 154 HIS HB2 . 27040 1 1709 . 1 1 154 154 HIS HB3 H 1 2.964 0.05 . 2 . . . . 154 HIS HB3 . 27040 1 1710 . 1 1 154 154 HIS C C 13 175.220 0.1 . 1 . . . . 154 HIS C . 27040 1 1711 . 1 1 154 154 HIS CA C 13 53.858 0.15 . 1 . . . . 154 HIS CA . 27040 1 1712 . 1 1 154 154 HIS CB C 13 27.394 0.15 . 1 . . . . 154 HIS CB . 27040 1 1713 . 1 1 154 154 HIS N N 15 118.028 0.05 . 1 . . . . 154 HIS N . 27040 1 1714 . 1 1 155 155 SER H H 1 8.457 0.01 . 1 . . . . 155 SER H . 27040 1 1715 . 1 1 155 155 SER HA H 1 4.220 0.05 . 1 . . . . 155 SER HA . 27040 1 1716 . 1 1 155 155 SER HB2 H 1 3.948 0.05 . 1 . . . . 155 SER HB2 . 27040 1 1717 . 1 1 155 155 SER HB3 H 1 3.948 0.05 . 1 . . . . 155 SER HB3 . 27040 1 1718 . 1 1 155 155 SER C C 13 174.056 0.1 . 1 . . . . 155 SER C . 27040 1 1719 . 1 1 155 155 SER CA C 13 61.555 0.15 . 1 . . . . 155 SER CA . 27040 1 1720 . 1 1 155 155 SER CB C 13 63.018 0.15 . 1 . . . . 155 SER CB . 27040 1 1721 . 1 1 155 155 SER N N 15 117.709 0.05 . 1 . . . . 155 SER N . 27040 1 1722 . 1 1 156 156 ASP H H 1 8.759 0.01 . 1 . . . . 156 ASP H . 27040 1 1723 . 1 1 156 156 ASP HA H 1 4.572 0.05 . 1 . . . . 156 ASP HA . 27040 1 1724 . 1 1 156 156 ASP HB2 H 1 2.693 0.05 . 1 . . . . 156 ASP HB2 . 27040 1 1725 . 1 1 156 156 ASP HB3 H 1 2.693 0.05 . 1 . . . . 156 ASP HB3 . 27040 1 1726 . 1 1 156 156 ASP C C 13 176.202 0.1 . 1 . . . . 156 ASP C . 27040 1 1727 . 1 1 156 156 ASP CA C 13 53.729 0.15 . 1 . . . . 156 ASP CA . 27040 1 1728 . 1 1 156 156 ASP CB C 13 40.591 0.15 . 1 . . . . 156 ASP CB . 27040 1 1729 . 1 1 156 156 ASP N N 15 117.324 0.05 . 1 . . . . 156 ASP N . 27040 1 1730 . 1 1 157 157 ALA H H 1 7.524 0.01 . 1 . . . . 157 ALA H . 27040 1 1731 . 1 1 157 157 ALA HA H 1 4.240 0.05 . 1 . . . . 157 ALA HA . 27040 1 1732 . 1 1 157 157 ALA HB1 H 1 1.503 0.05 . 1 . . . . 157 ALA MB . 27040 1 1733 . 1 1 157 157 ALA HB2 H 1 1.503 0.05 . 1 . . . . 157 ALA MB . 27040 1 1734 . 1 1 157 157 ALA HB3 H 1 1.503 0.05 . 1 . . . . 157 ALA MB . 27040 1 1735 . 1 1 157 157 ALA C C 13 177.894 0.1 . 1 . . . . 157 ALA C . 27040 1 1736 . 1 1 157 157 ALA CA C 13 52.553 0.15 . 1 . . . . 157 ALA CA . 27040 1 1737 . 1 1 157 157 ALA CB C 13 20.011 0.15 . 1 . . . . 157 ALA CB . 27040 1 1738 . 1 1 157 157 ALA N N 15 124.004 0.05 . 1 . . . . 157 ALA N . 27040 1 1739 . 1 1 158 158 TYR H H 1 8.799 0.01 . 1 . . . . 158 TYR H . 27040 1 1740 . 1 1 158 158 TYR HA H 1 4.085 0.05 . 1 . . . . 158 TYR HA . 27040 1 1741 . 1 1 158 158 TYR HB2 H 1 3.075 0.05 . 2 . . . . 158 TYR HB2 . 27040 1 1742 . 1 1 158 158 TYR HB3 H 1 3.202 0.05 . 2 . . . . 158 TYR HB3 . 27040 1 1743 . 1 1 158 158 TYR C C 13 173.499 0.1 . 1 . . . . 158 TYR C . 27040 1 1744 . 1 1 158 158 TYR CA C 13 60.127 0.15 . 1 . . . . 158 TYR CA . 27040 1 1745 . 1 1 158 158 TYR CB C 13 35.050 0.15 . 1 . . . . 158 TYR CB . 27040 1 1746 . 1 1 158 158 TYR N N 15 118.154 0.05 . 1 . . . . 158 TYR N . 27040 1 1747 . 1 1 159 159 ASN H H 1 7.697 0.01 . 1 . . . . 159 ASN H . 27040 1 1748 . 1 1 159 159 ASN HA H 1 4.694 0.05 . 1 . . . . 159 ASN HA . 27040 1 1749 . 1 1 159 159 ASN HB2 H 1 2.589 0.05 . 2 . . . . 159 ASN HB2 . 27040 1 1750 . 1 1 159 159 ASN HB3 H 1 2.743 0.05 . 2 . . . . 159 ASN HB3 . 27040 1 1751 . 1 1 159 159 ASN HD21 H 1 7.237 0.05 . 1 . . . . 159 ASN HD21 . 27040 1 1752 . 1 1 159 159 ASN HD22 H 1 6.842 0.05 . 1 . . . . 159 ASN HD22 . 27040 1 1753 . 1 1 159 159 ASN CA C 13 54.351 0.15 . 1 . . . . 159 ASN CA . 27040 1 1754 . 1 1 159 159 ASN CB C 13 40.602 0.15 . 1 . . . . 159 ASN CB . 27040 1 1755 . 1 1 159 159 ASN CG C 13 177.876 0.2 . 1 . . . . 159 ASN CG . 27040 1 1756 . 1 1 159 159 ASN N N 15 121.390 0.05 . 1 . . . . 159 ASN N . 27040 1 1757 . 1 1 159 159 ASN ND2 N 15 111.703 0.05 . 1 . . . . 159 ASN ND2 . 27040 1 stop_ save_