data_34423 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 34423 _Entry.Title ; NMR structure of MLP124017 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2019-08-05 _Entry.Accession_date 2019-08-05 _Entry.Last_release_date 2019-12-09 _Entry.Original_release_date 2019-12-09 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.1.32 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_experimental_methods.ID _Entry_experimental_methods.Method _Entry_experimental_methods.Subtype _Entry_experimental_methods.Entry_ID 1 'SOLUTION NMR' 'SOLUTION NMR' 34423 stop_ 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 P. Barthe P. . . . 34423 2 K. 'de Guillen' K. . . . 34423 3 A. Padilla A. . . . 34423 4 A. Hecker A. . . . 34423 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Structure from MOLMOL' . 34423 'UNKNOWN FUNCTION' . 34423 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 34423 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 344 34423 '15N chemical shifts' 127 34423 '1H chemical shifts' 852 34423 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 . . 2019-12-13 . original BMRB . 34423 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6SGO . 34423 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 34423 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1038/s41598-019-53816-9 _Citation.PubMed_ID 31792250 _Citation.Full_citation . _Citation.Title ; Structural genomics applied to the rust fungus Melampsora larici-populina reveals two candidate effector proteins adopting cystine knot and NTF2-like protein folds. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Sci. Rep.' _Citation.Journal_name_full . _Citation.Journal_volume 9 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2045-2322 _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 18084 _Citation.Page_last 18084 _Citation.Year 2019 _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 K. 'de Guillen' K. . . . 34423 1 2 C. Lorrain C. . . . 34423 1 3 P. Tsan P. . . . 34423 1 4 P. Barthe P. . . . 34423 1 5 B. Petre B. . . . 34423 1 6 N. Saveleva N. . . . 34423 1 7 N. Rouhier N. . . . 34423 1 8 S. Duplessis S. . . . 34423 1 9 A. Padilla A. . . . 34423 1 10 A. Hecker A. . . . 34423 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 34423 _Assembly.ID 1 _Assembly.Name 'Secreted protein' _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 entity_1 1 $entity_1 A A yes . . . . . . 34423 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 34423 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MELPESFEFILTEDMVTDLD VKGLGYDFIDLVTKSPDSVN SEHELAHFLGPHDPEIYVNG KIQTTTAFLQFFRQGLFKKL KDAEFAINVSGKVKEGEGYK LVWKSAAQRSHDQKIRWDEA EAYIWRRKDGSCWLHSVKFI MSKAAPYVAIDHHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 157 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 18200.594 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID MLP124017 na 34423 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 34423 1 2 . GLU . 34423 1 3 . LEU . 34423 1 4 . PRO . 34423 1 5 . GLU . 34423 1 6 . SER . 34423 1 7 . PHE . 34423 1 8 . GLU . 34423 1 9 . PHE . 34423 1 10 . ILE . 34423 1 11 . LEU . 34423 1 12 . THR . 34423 1 13 . GLU . 34423 1 14 . ASP . 34423 1 15 . MET . 34423 1 16 . VAL . 34423 1 17 . THR . 34423 1 18 . ASP . 34423 1 19 . LEU . 34423 1 20 . ASP . 34423 1 21 . VAL . 34423 1 22 . LYS . 34423 1 23 . GLY . 34423 1 24 . LEU . 34423 1 25 . GLY . 34423 1 26 . TYR . 34423 1 27 . ASP . 34423 1 28 . PHE . 34423 1 29 . ILE . 34423 1 30 . ASP . 34423 1 31 . LEU . 34423 1 32 . VAL . 34423 1 33 . THR . 34423 1 34 . LYS . 34423 1 35 . SER . 34423 1 36 . PRO . 34423 1 37 . ASP . 34423 1 38 . SER . 34423 1 39 . VAL . 34423 1 40 . ASN . 34423 1 41 . SER . 34423 1 42 . GLU . 34423 1 43 . HIS . 34423 1 44 . GLU . 34423 1 45 . LEU . 34423 1 46 . ALA . 34423 1 47 . HIS . 34423 1 48 . PHE . 34423 1 49 . LEU . 34423 1 50 . GLY . 34423 1 51 . PRO . 34423 1 52 . HIS . 34423 1 53 . ASP . 34423 1 54 . PRO . 34423 1 55 . GLU . 34423 1 56 . ILE . 34423 1 57 . TYR . 34423 1 58 . VAL . 34423 1 59 . ASN . 34423 1 60 . GLY . 34423 1 61 . LYS . 34423 1 62 . ILE . 34423 1 63 . GLN . 34423 1 64 . THR . 34423 1 65 . THR . 34423 1 66 . THR . 34423 1 67 . ALA . 34423 1 68 . PHE . 34423 1 69 . LEU . 34423 1 70 . GLN . 34423 1 71 . PHE . 34423 1 72 . PHE . 34423 1 73 . ARG . 34423 1 74 . GLN . 34423 1 75 . GLY . 34423 1 76 . LEU . 34423 1 77 . PHE . 34423 1 78 . LYS . 34423 1 79 . LYS . 34423 1 80 . LEU . 34423 1 81 . LYS . 34423 1 82 . ASP . 34423 1 83 . ALA . 34423 1 84 . GLU . 34423 1 85 . PHE . 34423 1 86 . ALA . 34423 1 87 . ILE . 34423 1 88 . ASN . 34423 1 89 . VAL . 34423 1 90 . SER . 34423 1 91 . GLY . 34423 1 92 . LYS . 34423 1 93 . VAL . 34423 1 94 . LYS . 34423 1 95 . GLU . 34423 1 96 . GLY . 34423 1 97 . GLU . 34423 1 98 . GLY . 34423 1 99 . TYR . 34423 1 100 . LYS . 34423 1 101 . LEU . 34423 1 102 . VAL . 34423 1 103 . TRP . 34423 1 104 . LYS . 34423 1 105 . SER . 34423 1 106 . ALA . 34423 1 107 . ALA . 34423 1 108 . GLN . 34423 1 109 . ARG . 34423 1 110 . SER . 34423 1 111 . HIS . 34423 1 112 . ASP . 34423 1 113 . GLN . 34423 1 114 . LYS . 34423 1 115 . ILE . 34423 1 116 . ARG . 34423 1 117 . TRP . 34423 1 118 . ASP . 34423 1 119 . GLU . 34423 1 120 . ALA . 34423 1 121 . GLU . 34423 1 122 . ALA . 34423 1 123 . TYR . 34423 1 124 . ILE . 34423 1 125 . TRP . 34423 1 126 . ARG . 34423 1 127 . ARG . 34423 1 128 . LYS . 34423 1 129 . ASP . 34423 1 130 . GLY . 34423 1 131 . SER . 34423 1 132 . CYS . 34423 1 133 . TRP . 34423 1 134 . LEU . 34423 1 135 . HIS . 34423 1 136 . SER . 34423 1 137 . VAL . 34423 1 138 . LYS . 34423 1 139 . PHE . 34423 1 140 . ILE . 34423 1 141 . MET . 34423 1 142 . SER . 34423 1 143 . LYS . 34423 1 144 . ALA . 34423 1 145 . ALA . 34423 1 146 . PRO . 34423 1 147 . TYR . 34423 1 148 . VAL . 34423 1 149 . ALA . 34423 1 150 . ILE . 34423 1 151 . ASP . 34423 1 152 . HIS . 34423 1 153 . HIS . 34423 1 154 . HIS . 34423 1 155 . HIS . 34423 1 156 . HIS . 34423 1 157 . HIS . 34423 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 34423 1 . GLU 2 2 34423 1 . LEU 3 3 34423 1 . PRO 4 4 34423 1 . GLU 5 5 34423 1 . SER 6 6 34423 1 . PHE 7 7 34423 1 . GLU 8 8 34423 1 . PHE 9 9 34423 1 . ILE 10 10 34423 1 . LEU 11 11 34423 1 . THR 12 12 34423 1 . GLU 13 13 34423 1 . ASP 14 14 34423 1 . MET 15 15 34423 1 . VAL 16 16 34423 1 . THR 17 17 34423 1 . ASP 18 18 34423 1 . LEU 19 19 34423 1 . ASP 20 20 34423 1 . VAL 21 21 34423 1 . LYS 22 22 34423 1 . GLY 23 23 34423 1 . LEU 24 24 34423 1 . GLY 25 25 34423 1 . TYR 26 26 34423 1 . ASP 27 27 34423 1 . PHE 28 28 34423 1 . ILE 29 29 34423 1 . ASP 30 30 34423 1 . LEU 31 31 34423 1 . VAL 32 32 34423 1 . THR 33 33 34423 1 . LYS 34 34 34423 1 . SER 35 35 34423 1 . PRO 36 36 34423 1 . ASP 37 37 34423 1 . SER 38 38 34423 1 . VAL 39 39 34423 1 . ASN 40 40 34423 1 . SER 41 41 34423 1 . GLU 42 42 34423 1 . HIS 43 43 34423 1 . GLU 44 44 34423 1 . LEU 45 45 34423 1 . ALA 46 46 34423 1 . HIS 47 47 34423 1 . PHE 48 48 34423 1 . LEU 49 49 34423 1 . GLY 50 50 34423 1 . PRO 51 51 34423 1 . HIS 52 52 34423 1 . ASP 53 53 34423 1 . PRO 54 54 34423 1 . GLU 55 55 34423 1 . ILE 56 56 34423 1 . TYR 57 57 34423 1 . VAL 58 58 34423 1 . ASN 59 59 34423 1 . GLY 60 60 34423 1 . LYS 61 61 34423 1 . ILE 62 62 34423 1 . GLN 63 63 34423 1 . THR 64 64 34423 1 . THR 65 65 34423 1 . THR 66 66 34423 1 . ALA 67 67 34423 1 . PHE 68 68 34423 1 . LEU 69 69 34423 1 . GLN 70 70 34423 1 . PHE 71 71 34423 1 . PHE 72 72 34423 1 . ARG 73 73 34423 1 . GLN 74 74 34423 1 . GLY 75 75 34423 1 . LEU 76 76 34423 1 . PHE 77 77 34423 1 . LYS 78 78 34423 1 . LYS 79 79 34423 1 . LEU 80 80 34423 1 . LYS 81 81 34423 1 . ASP 82 82 34423 1 . ALA 83 83 34423 1 . GLU 84 84 34423 1 . PHE 85 85 34423 1 . ALA 86 86 34423 1 . ILE 87 87 34423 1 . ASN 88 88 34423 1 . VAL 89 89 34423 1 . SER 90 90 34423 1 . GLY 91 91 34423 1 . LYS 92 92 34423 1 . VAL 93 93 34423 1 . LYS 94 94 34423 1 . GLU 95 95 34423 1 . GLY 96 96 34423 1 . GLU 97 97 34423 1 . GLY 98 98 34423 1 . TYR 99 99 34423 1 . LYS 100 100 34423 1 . LEU 101 101 34423 1 . VAL 102 102 34423 1 . TRP 103 103 34423 1 . LYS 104 104 34423 1 . SER 105 105 34423 1 . ALA 106 106 34423 1 . ALA 107 107 34423 1 . GLN 108 108 34423 1 . ARG 109 109 34423 1 . SER 110 110 34423 1 . HIS 111 111 34423 1 . ASP 112 112 34423 1 . GLN 113 113 34423 1 . LYS 114 114 34423 1 . ILE 115 115 34423 1 . ARG 116 116 34423 1 . TRP 117 117 34423 1 . ASP 118 118 34423 1 . GLU 119 119 34423 1 . ALA 120 120 34423 1 . GLU 121 121 34423 1 . ALA 122 122 34423 1 . TYR 123 123 34423 1 . ILE 124 124 34423 1 . TRP 125 125 34423 1 . ARG 126 126 34423 1 . ARG 127 127 34423 1 . LYS 128 128 34423 1 . ASP 129 129 34423 1 . GLY 130 130 34423 1 . SER 131 131 34423 1 . CYS 132 132 34423 1 . TRP 133 133 34423 1 . LEU 134 134 34423 1 . HIS 135 135 34423 1 . SER 136 136 34423 1 . VAL 137 137 34423 1 . LYS 138 138 34423 1 . PHE 139 139 34423 1 . ILE 140 140 34423 1 . MET 141 141 34423 1 . SER 142 142 34423 1 . LYS 143 143 34423 1 . ALA 144 144 34423 1 . ALA 145 145 34423 1 . PRO 146 146 34423 1 . TYR 147 147 34423 1 . VAL 148 148 34423 1 . ALA 149 149 34423 1 . ILE 150 150 34423 1 . ASP 151 151 34423 1 . HIS 152 152 34423 1 . HIS 153 153 34423 1 . HIS 154 154 34423 1 . HIS 155 155 34423 1 . HIS 156 156 34423 1 . HIS 157 157 34423 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 34423 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 203908 organism . 'Melampsora larici-populina' 'Poplar leaf rust fungus' . . Eukaryota Fungi Melampsora larici-populina '98AG31 / pathotype 3-4-7' . . . . . . . . . . MELLADRAFT_124017 . 34423 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 34423 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . . . . . . . . 34423 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 34423 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '1 mM [U-15N] MLP124017, 90% H2O/10% D2O' _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 MLP124017 [U-15N] . . 1 $entity_1 . . 1 . . mM . . . . 34423 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 34423 _Sample.ID 2 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '0.6 mM [U-13C; U-15N] MLP124017, 90% H2O/10% D2O' _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 MLP124017 '[U-13C; U-15N]' . . 1 $entity_1 . . 0.6 . . mM . . . . 34423 2 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 34423 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 200 . mM 34423 1 pH 6.8 . pH 34423 1 pressure 1 . atm 34423 1 temperature 298 . K 34423 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 34423 _Software.ID 1 _Software.Type . _Software.Name CNS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 34423 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . refinement 34423 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 34423 _Software.ID 2 _Software.Type . _Software.Name CYANA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 34423 2 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'structure calculation' 34423 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 34423 _Software.ID 3 _Software.Type . _Software.Name CINDY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Padilla . . 34423 3 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 34423 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 34423 _Software.ID 4 _Software.Type . _Software.Name Gifa _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Delsuc . . 34423 4 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'peak picking' 34423 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 34423 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 34423 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 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 34423 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker 'AVANCE III' . 800 . . . 34423 1 2 NMR_spectrometer_2 Bruker 'AVANCE III' . 700 . . . 34423 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 34423 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34423 1 2 '3D 1H-15N TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34423 1 3 '3D HNCA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34423 1 4 '3D HNCACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34423 1 5 '3D HBHA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34423 1 6 '3D HCACO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34423 1 7 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34423 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 34423 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.25144953 . . . . . 34423 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 34423 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.10132912 . . . . . 34423 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 34423 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 1H-15N NOESY' . . . 34423 1 2 '3D 1H-15N TOCSY' . . . 34423 1 3 '3D HNCA' . . . 34423 1 4 '3D HNCACB' . . . 34423 1 5 '3D HBHA(CO)NH' . . . 34423 1 6 '3D HCACO' . . . 34423 1 7 '3D HNCO' . . . 34423 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.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 14 14 ASP H H 1 8.493 0.000 . . . . . . A 14 ASP H . 34423 1 2 . 1 1 14 14 ASP HA H 1 4.581 0.000 . . . . . . A 14 ASP HA . 34423 1 3 . 1 1 14 14 ASP HB2 H 1 2.601 0.000 . . . . . . A 14 ASP HB2 . 34423 1 4 . 1 1 14 14 ASP HB3 H 1 2.695 0.000 . . . . . . A 14 ASP HB3 . 34423 1 5 . 1 1 14 14 ASP C C 13 176.100 0.000 . . . . . . A 14 ASP C . 34423 1 6 . 1 1 14 14 ASP CA C 13 54.600 0.000 . . . . . . A 14 ASP CA . 34423 1 7 . 1 1 14 14 ASP CB C 13 41.480 0.000 . . . . . . A 14 ASP CB . 34423 1 8 . 1 1 14 14 ASP N N 15 121.670 0.000 . . . . . . A 14 ASP N . 34423 1 9 . 1 1 15 15 MET H H 1 8.358 0.000 . . . . . . A 15 MET H . 34423 1 10 . 1 1 15 15 MET HA H 1 4.517 0.000 . . . . . . A 15 MET HA . 34423 1 11 . 1 1 15 15 MET HB2 H 1 2.044 0.000 . . . . . . A 15 MET HB2 . 34423 1 12 . 1 1 15 15 MET HB3 H 1 2.120 0.000 . . . . . . A 15 MET HB3 . 34423 1 13 . 1 1 15 15 MET HG2 H 1 2.550 0.000 . . . . . . A 15 MET HG2 . 34423 1 14 . 1 1 15 15 MET HG3 H 1 2.601 0.000 . . . . . . A 15 MET HG3 . 34423 1 15 . 1 1 15 15 MET C C 13 176.150 0.000 . . . . . . A 15 MET C . 34423 1 16 . 1 1 15 15 MET CA C 13 55.760 0.000 . . . . . . A 15 MET CA . 34423 1 17 . 1 1 15 15 MET CB C 13 33.150 0.000 . . . . . . A 15 MET CB . 34423 1 18 . 1 1 15 15 MET N N 15 120.700 0.000 . . . . . . A 15 MET N . 34423 1 19 . 1 1 16 16 VAL H H 1 8.258 0.000 . . . . . . A 16 VAL H . 34423 1 20 . 1 1 16 16 VAL HA H 1 4.239 0.000 . . . . . . A 16 VAL HA . 34423 1 21 . 1 1 16 16 VAL HB H 1 2.156 0.000 . . . . . . A 16 VAL HB . 34423 1 22 . 1 1 16 16 VAL HG11 H 1 0.989 0.000 . . . . . . A 16 VAL HG11 . 34423 1 23 . 1 1 16 16 VAL HG12 H 1 0.989 0.000 . . . . . . A 16 VAL HG12 . 34423 1 24 . 1 1 16 16 VAL HG13 H 1 0.989 0.000 . . . . . . A 16 VAL HG13 . 34423 1 25 . 1 1 16 16 VAL HG21 H 1 0.960 0.000 . . . . . . A 16 VAL HG21 . 34423 1 26 . 1 1 16 16 VAL HG22 H 1 0.960 0.000 . . . . . . A 16 VAL HG22 . 34423 1 27 . 1 1 16 16 VAL HG23 H 1 0.960 0.000 . . . . . . A 16 VAL HG23 . 34423 1 28 . 1 1 16 16 VAL C C 13 176.290 0.000 . . . . . . A 16 VAL C . 34423 1 29 . 1 1 16 16 VAL CA C 13 62.610 0.000 . . . . . . A 16 VAL CA . 34423 1 30 . 1 1 16 16 VAL CB C 13 32.830 0.000 . . . . . . A 16 VAL CB . 34423 1 31 . 1 1 16 16 VAL N N 15 121.310 0.000 . . . . . . A 16 VAL N . 34423 1 32 . 1 1 17 17 THR H H 1 8.285 0.000 . . . . . . A 17 THR H . 34423 1 33 . 1 1 17 17 THR HA H 1 4.401 0.000 . . . . . . A 17 THR HA . 34423 1 34 . 1 1 17 17 THR HB H 1 4.268 0.000 . . . . . . A 17 THR HB . 34423 1 35 . 1 1 17 17 THR HG21 H 1 1.198 0.000 . . . . . . A 17 THR HG21 . 34423 1 36 . 1 1 17 17 THR HG22 H 1 1.198 0.000 . . . . . . A 17 THR HG22 . 34423 1 37 . 1 1 17 17 THR HG23 H 1 1.198 0.000 . . . . . . A 17 THR HG23 . 34423 1 38 . 1 1 17 17 THR C C 13 174.090 0.000 . . . . . . A 17 THR C . 34423 1 39 . 1 1 17 17 THR CA C 13 61.740 0.000 . . . . . . A 17 THR CA . 34423 1 40 . 1 1 17 17 THR CB C 13 70.270 0.000 . . . . . . A 17 THR CB . 34423 1 41 . 1 1 17 17 THR N N 15 117.040 0.000 . . . . . . A 17 THR N . 34423 1 42 . 1 1 18 18 ASP H H 1 8.285 0.000 . . . . . . A 18 ASP H . 34423 1 43 . 1 1 18 18 ASP HA H 1 4.365 0.000 . . . . . . A 18 ASP HA . 34423 1 44 . 1 1 18 18 ASP HB2 H 1 2.437 0.000 . . . . . . A 18 ASP HB2 . 34423 1 45 . 1 1 18 18 ASP HB3 H 1 2.616 0.000 . . . . . . A 18 ASP HB3 . 34423 1 46 . 1 1 18 18 ASP C C 13 176.240 0.000 . . . . . . A 18 ASP C . 34423 1 47 . 1 1 18 18 ASP CA C 13 54.770 0.000 . . . . . . A 18 ASP CA . 34423 1 48 . 1 1 18 18 ASP CB C 13 41.050 0.000 . . . . . . A 18 ASP CB . 34423 1 49 . 1 1 18 18 ASP N N 15 119.620 0.000 . . . . . . A 18 ASP N . 34423 1 50 . 1 1 19 19 LEU H H 1 8.190 0.000 . . . . . . A 19 LEU H . 34423 1 51 . 1 1 19 19 LEU HA H 1 3.914 0.000 . . . . . . A 19 LEU HA . 34423 1 52 . 1 1 19 19 LEU HB2 H 1 1.564 0.000 . . . . . . A 19 LEU HB2 . 34423 1 53 . 1 1 19 19 LEU HB3 H 1 1.728 0.000 . . . . . . A 19 LEU HB3 . 34423 1 54 . 1 1 19 19 LEU HG H 1 1.191 0.000 . . . . . . A 19 LEU HG . 34423 1 55 . 1 1 19 19 LEU HD11 H 1 0.946 0.000 . . . . . . A 19 LEU HD11 . 34423 1 56 . 1 1 19 19 LEU HD12 H 1 0.946 0.000 . . . . . . A 19 LEU HD12 . 34423 1 57 . 1 1 19 19 LEU HD13 H 1 0.946 0.000 . . . . . . A 19 LEU HD13 . 34423 1 58 . 1 1 19 19 LEU HD21 H 1 0.865 0.000 . . . . . . A 19 LEU HD21 . 34423 1 59 . 1 1 19 19 LEU HD22 H 1 0.865 0.000 . . . . . . A 19 LEU HD22 . 34423 1 60 . 1 1 19 19 LEU HD23 H 1 0.865 0.000 . . . . . . A 19 LEU HD23 . 34423 1 61 . 1 1 19 19 LEU C C 13 179.510 0.000 . . . . . . A 19 LEU C . 34423 1 62 . 1 1 19 19 LEU CA C 13 58.180 0.000 . . . . . . A 19 LEU CA . 34423 1 63 . 1 1 19 19 LEU CB C 13 41.930 0.000 . . . . . . A 19 LEU CB . 34423 1 64 . 1 1 19 19 LEU N N 15 120.260 0.000 . . . . . . A 19 LEU N . 34423 1 65 . 1 1 20 20 ASP H H 1 8.806 0.000 . . . . . . A 20 ASP H . 34423 1 66 . 1 1 20 20 ASP HA H 1 4.281 0.000 . . . . . . A 20 ASP HA . 34423 1 67 . 1 1 20 20 ASP HB2 H 1 2.759 0.000 . . . . . . A 20 ASP HB2 . 34423 1 68 . 1 1 20 20 ASP HB3 H 1 2.830 0.000 . . . . . . A 20 ASP HB3 . 34423 1 69 . 1 1 20 20 ASP C C 13 178.370 0.000 . . . . . . A 20 ASP C . 34423 1 70 . 1 1 20 20 ASP CA C 13 56.120 0.000 . . . . . . A 20 ASP CA . 34423 1 71 . 1 1 20 20 ASP CB C 13 38.670 0.000 . . . . . . A 20 ASP CB . 34423 1 72 . 1 1 20 20 ASP N N 15 120.400 0.000 . . . . . . A 20 ASP N . 34423 1 73 . 1 1 21 21 VAL H H 1 7.975 0.000 . . . . . . A 21 VAL H . 34423 1 74 . 1 1 21 21 VAL HA H 1 3.438 0.000 . . . . . . A 21 VAL HA . 34423 1 75 . 1 1 21 21 VAL HB H 1 1.567 0.000 . . . . . . A 21 VAL HB . 34423 1 76 . 1 1 21 21 VAL HG11 H 1 0.506 0.000 . . . . . . A 21 VAL HG11 . 34423 1 77 . 1 1 21 21 VAL HG12 H 1 0.506 0.000 . . . . . . A 21 VAL HG12 . 34423 1 78 . 1 1 21 21 VAL HG13 H 1 0.506 0.000 . . . . . . A 21 VAL HG13 . 34423 1 79 . 1 1 21 21 VAL HG21 H 1 0.412 0.000 . . . . . . A 21 VAL HG21 . 34423 1 80 . 1 1 21 21 VAL HG22 H 1 0.412 0.000 . . . . . . A 21 VAL HG22 . 34423 1 81 . 1 1 21 21 VAL HG23 H 1 0.412 0.000 . . . . . . A 21 VAL HG23 . 34423 1 82 . 1 1 21 21 VAL C C 13 177.320 0.000 . . . . . . A 21 VAL C . 34423 1 83 . 1 1 21 21 VAL CA C 13 66.110 0.000 . . . . . . A 21 VAL CA . 34423 1 84 . 1 1 21 21 VAL CB C 13 32.520 0.000 . . . . . . A 21 VAL CB . 34423 1 85 . 1 1 21 21 VAL N N 15 124.360 0.000 . . . . . . A 21 VAL N . 34423 1 86 . 1 1 22 22 LYS H H 1 7.966 0.000 . . . . . . A 22 LYS H . 34423 1 87 . 1 1 22 22 LYS HA H 1 3.606 0.000 . . . . . . A 22 LYS HA . 34423 1 88 . 1 1 22 22 LYS HB2 H 1 1.594 0.000 . . . . . . A 22 LYS HB2 . 34423 1 89 . 1 1 22 22 LYS HB3 H 1 1.668 0.000 . . . . . . A 22 LYS HB3 . 34423 1 90 . 1 1 22 22 LYS HG2 H 1 1.167 0.000 . . . . . . A 22 LYS HG2 . 34423 1 91 . 1 1 22 22 LYS HG3 H 1 1.426 0.000 . . . . . . A 22 LYS HG3 . 34423 1 92 . 1 1 22 22 LYS HD2 H 1 1.493 0.000 . . . . . . A 22 LYS HD2 . 34423 1 93 . 1 1 22 22 LYS HD3 H 1 1.493 0.000 . . . . . . A 22 LYS HD3 . 34423 1 94 . 1 1 22 22 LYS C C 13 177.640 0.000 . . . . . . A 22 LYS C . 34423 1 95 . 1 1 22 22 LYS CA C 13 60.490 0.000 . . . . . . A 22 LYS CA . 34423 1 96 . 1 1 22 22 LYS CB C 13 33.020 0.000 . . . . . . A 22 LYS CB . 34423 1 97 . 1 1 22 22 LYS N N 15 117.540 0.000 . . . . . . A 22 LYS N . 34423 1 98 . 1 1 23 23 GLY H H 1 8.139 0.000 . . . . . . A 23 GLY H . 34423 1 99 . 1 1 23 23 GLY HA2 H 1 3.880 0.000 . . . . . . A 23 GLY HA2 . 34423 1 100 . 1 1 23 23 GLY HA3 H 1 3.769 0.000 . . . . . . A 23 GLY HA3 . 34423 1 101 . 1 1 23 23 GLY C C 13 175.360 0.000 . . . . . . A 23 GLY C . 34423 1 102 . 1 1 23 23 GLY CA C 13 47.420 0.000 . . . . . . A 23 GLY CA . 34423 1 103 . 1 1 23 23 GLY N N 15 105.270 0.000 . . . . . . A 23 GLY N . 34423 1 104 . 1 1 24 24 LEU H H 1 7.413 0.000 . . . . . . A 24 LEU H . 34423 1 105 . 1 1 24 24 LEU HA H 1 4.539 0.000 . . . . . . A 24 LEU HA . 34423 1 106 . 1 1 24 24 LEU HB2 H 1 1.689 0.000 . . . . . . A 24 LEU HB2 . 34423 1 107 . 1 1 24 24 LEU HB3 H 1 1.891 0.000 . . . . . . A 24 LEU HB3 . 34423 1 108 . 1 1 24 24 LEU HG H 1 1.548 0.000 . . . . . . A 24 LEU HG . 34423 1 109 . 1 1 24 24 LEU HD11 H 1 1.119 0.000 . . . . . . A 24 LEU HD11 . 34423 1 110 . 1 1 24 24 LEU HD12 H 1 1.119 0.000 . . . . . . A 24 LEU HD12 . 34423 1 111 . 1 1 24 24 LEU HD13 H 1 1.119 0.000 . . . . . . A 24 LEU HD13 . 34423 1 112 . 1 1 24 24 LEU HD21 H 1 0.785 0.000 . . . . . . A 24 LEU HD21 . 34423 1 113 . 1 1 24 24 LEU HD22 H 1 0.785 0.000 . . . . . . A 24 LEU HD22 . 34423 1 114 . 1 1 24 24 LEU HD23 H 1 0.785 0.000 . . . . . . A 24 LEU HD23 . 34423 1 115 . 1 1 24 24 LEU C C 13 178.830 0.000 . . . . . . A 24 LEU C . 34423 1 116 . 1 1 24 24 LEU CA C 13 58.060 0.000 . . . . . . A 24 LEU CA . 34423 1 117 . 1 1 24 24 LEU CB C 13 41.610 0.000 . . . . . . A 24 LEU CB . 34423 1 118 . 1 1 24 24 LEU N N 15 122.550 0.000 . . . . . . A 24 LEU N . 34423 1 119 . 1 1 25 25 GLY H H 1 8.067 0.000 . . . . . . A 25 GLY H . 34423 1 120 . 1 1 25 25 GLY HA2 H 1 3.781 0.000 . . . . . . A 25 GLY HA2 . 34423 1 121 . 1 1 25 25 GLY HA3 H 1 3.743 0.000 . . . . . . A 25 GLY HA3 . 34423 1 122 . 1 1 25 25 GLY C C 13 174.480 0.000 . . . . . . A 25 GLY C . 34423 1 123 . 1 1 25 25 GLY CA C 13 48.260 0.000 . . . . . . A 25 GLY CA . 34423 1 124 . 1 1 25 25 GLY N N 15 104.530 0.000 . . . . . . A 25 GLY N . 34423 1 125 . 1 1 26 26 TYR H H 1 9.092 0.000 . . . . . . A 26 TYR H . 34423 1 126 . 1 1 26 26 TYR HA H 1 4.339 0.000 . . . . . . A 26 TYR HA . 34423 1 127 . 1 1 26 26 TYR HB2 H 1 3.081 0.000 . . . . . . A 26 TYR HB2 . 34423 1 128 . 1 1 26 26 TYR HB3 H 1 3.128 0.000 . . . . . . A 26 TYR HB3 . 34423 1 129 . 1 1 26 26 TYR HD1 H 1 7.102 0.000 . . . . . . A 26 TYR HD1 . 34423 1 130 . 1 1 26 26 TYR HD2 H 1 7.102 0.000 . . . . . . A 26 TYR HD2 . 34423 1 131 . 1 1 26 26 TYR HE1 H 1 6.262 0.000 . . . . . . A 26 TYR HE1 . 34423 1 132 . 1 1 26 26 TYR HE2 H 1 6.262 0.000 . . . . . . A 26 TYR HE2 . 34423 1 133 . 1 1 26 26 TYR C C 13 178.440 0.000 . . . . . . A 26 TYR C . 34423 1 134 . 1 1 26 26 TYR CA C 13 60.460 0.000 . . . . . . A 26 TYR CA . 34423 1 135 . 1 1 26 26 TYR N N 15 120.790 0.000 . . . . . . A 26 TYR N . 34423 1 136 . 1 1 27 27 ASP H H 1 8.367 0.000 . . . . . . A 27 ASP H . 34423 1 137 . 1 1 27 27 ASP HA H 1 4.297 0.000 . . . . . . A 27 ASP HA . 34423 1 138 . 1 1 27 27 ASP HB2 H 1 2.446 0.000 . . . . . . A 27 ASP HB2 . 34423 1 139 . 1 1 27 27 ASP HB3 H 1 3.051 0.000 . . . . . . A 27 ASP HB3 . 34423 1 140 . 1 1 27 27 ASP C C 13 177.840 0.000 . . . . . . A 27 ASP C . 34423 1 141 . 1 1 27 27 ASP CA C 13 57.530 0.000 . . . . . . A 27 ASP CA . 34423 1 142 . 1 1 27 27 ASP CB C 13 40.420 0.000 . . . . . . A 27 ASP CB . 34423 1 143 . 1 1 27 27 ASP N N 15 121.530 0.000 . . . . . . A 27 ASP N . 34423 1 144 . 1 1 28 28 PHE H H 1 7.771 0.000 . . . . . . A 28 PHE H . 34423 1 145 . 1 1 28 28 PHE HA H 1 3.508 0.000 . . . . . . A 28 PHE HA . 34423 1 146 . 1 1 28 28 PHE HB2 H 1 3.163 0.000 . . . . . . A 28 PHE HB2 . 34423 1 147 . 1 1 28 28 PHE HB3 H 1 3.248 0.000 . . . . . . A 28 PHE HB3 . 34423 1 148 . 1 1 28 28 PHE HD1 H 1 6.930 0.000 . . . . . . A 28 PHE HD1 . 34423 1 149 . 1 1 28 28 PHE HD2 H 1 6.930 0.000 . . . . . . A 28 PHE HD2 . 34423 1 150 . 1 1 28 28 PHE HE1 H 1 7.070 0.000 . . . . . . A 28 PHE HE1 . 34423 1 151 . 1 1 28 28 PHE HE2 H 1 7.070 0.000 . . . . . . A 28 PHE HE2 . 34423 1 152 . 1 1 28 28 PHE C C 13 175.930 0.000 . . . . . . A 28 PHE C . 34423 1 153 . 1 1 28 28 PHE CA C 13 60.340 0.000 . . . . . . A 28 PHE CA . 34423 1 154 . 1 1 28 28 PHE CB C 13 41.360 0.000 . . . . . . A 28 PHE CB . 34423 1 155 . 1 1 28 28 PHE N N 15 117.670 0.000 . . . . . . A 28 PHE N . 34423 1 156 . 1 1 29 29 ILE H H 1 8.150 0.000 . . . . . . A 29 ILE H . 34423 1 157 . 1 1 29 29 ILE HA H 1 3.142 0.000 . . . . . . A 29 ILE HA . 34423 1 158 . 1 1 29 29 ILE HB H 1 0.625 0.000 . . . . . . A 29 ILE HB . 34423 1 159 . 1 1 29 29 ILE HG12 H 1 0.251 0.000 . . . . . . A 29 ILE HG12 . 34423 1 160 . 1 1 29 29 ILE HG13 H 1 -0.130 0.000 . . . . . . A 29 ILE HG13 . 34423 1 161 . 1 1 29 29 ILE HG21 H 1 0.528 0.000 . . . . . . A 29 ILE HG21 . 34423 1 162 . 1 1 29 29 ILE HG22 H 1 0.528 0.000 . . . . . . A 29 ILE HG22 . 34423 1 163 . 1 1 29 29 ILE HG23 H 1 0.528 0.000 . . . . . . A 29 ILE HG23 . 34423 1 164 . 1 1 29 29 ILE HD11 H 1 -0.290 0.000 . . . . . . A 29 ILE HD11 . 34423 1 165 . 1 1 29 29 ILE HD12 H 1 -0.290 0.000 . . . . . . A 29 ILE HD12 . 34423 1 166 . 1 1 29 29 ILE HD13 H 1 -0.290 0.000 . . . . . . A 29 ILE HD13 . 34423 1 167 . 1 1 29 29 ILE C C 13 178.110 0.000 . . . . . . A 29 ILE C . 34423 1 168 . 1 1 29 29 ILE CA C 13 59.860 0.000 . . . . . . A 29 ILE CA . 34423 1 169 . 1 1 29 29 ILE N N 15 119.960 0.000 . . . . . . A 29 ILE N . 34423 1 170 . 1 1 30 30 ASP H H 1 8.091 0.000 . . . . . . A 30 ASP H . 34423 1 171 . 1 1 30 30 ASP HA H 1 4.044 0.000 . . . . . . A 30 ASP HA . 34423 1 172 . 1 1 30 30 ASP HB2 H 1 2.498 0.000 . . . . . . A 30 ASP HB2 . 34423 1 173 . 1 1 30 30 ASP HB3 H 1 2.698 0.000 . . . . . . A 30 ASP HB3 . 34423 1 174 . 1 1 30 30 ASP C C 13 177.600 0.000 . . . . . . A 30 ASP C . 34423 1 175 . 1 1 30 30 ASP CA C 13 57.020 0.000 . . . . . . A 30 ASP CA . 34423 1 176 . 1 1 30 30 ASP CB C 13 41.420 0.000 . . . . . . A 30 ASP CB . 34423 1 177 . 1 1 30 30 ASP N N 15 123.530 0.000 . . . . . . A 30 ASP N . 34423 1 178 . 1 1 31 31 LEU H H 1 7.073 0.000 . . . . . . A 31 LEU H . 34423 1 179 . 1 1 31 31 LEU HA H 1 3.921 0.000 . . . . . . A 31 LEU HA . 34423 1 180 . 1 1 31 31 LEU HB2 H 1 1.545 0.000 . . . . . . A 31 LEU HB2 . 34423 1 181 . 1 1 31 31 LEU HB3 H 1 1.669 0.000 . . . . . . A 31 LEU HB3 . 34423 1 182 . 1 1 31 31 LEU HG H 1 1.001 0.000 . . . . . . A 31 LEU HG . 34423 1 183 . 1 1 31 31 LEU HD11 H 1 0.713 0.000 . . . . . . A 31 LEU HD11 . 34423 1 184 . 1 1 31 31 LEU HD12 H 1 0.713 0.000 . . . . . . A 31 LEU HD12 . 34423 1 185 . 1 1 31 31 LEU HD13 H 1 0.713 0.000 . . . . . . A 31 LEU HD13 . 34423 1 186 . 1 1 31 31 LEU HD21 H 1 0.433 0.000 . . . . . . A 31 LEU HD21 . 34423 1 187 . 1 1 31 31 LEU HD22 H 1 0.433 0.000 . . . . . . A 31 LEU HD22 . 34423 1 188 . 1 1 31 31 LEU HD23 H 1 0.433 0.000 . . . . . . A 31 LEU HD23 . 34423 1 189 . 1 1 31 31 LEU C C 13 179.760 0.000 . . . . . . A 31 LEU C . 34423 1 190 . 1 1 31 31 LEU CA C 13 57.260 0.000 . . . . . . A 31 LEU CA . 34423 1 191 . 1 1 31 31 LEU CB C 13 43.180 0.000 . . . . . . A 31 LEU CB . 34423 1 192 . 1 1 31 31 LEU N N 15 116.350 0.000 . . . . . . A 31 LEU N . 34423 1 193 . 1 1 32 32 VAL H H 1 7.744 0.000 . . . . . . A 32 VAL H . 34423 1 194 . 1 1 32 32 VAL HA H 1 3.730 0.000 . . . . . . A 32 VAL HA . 34423 1 195 . 1 1 32 32 VAL HB H 1 1.429 0.000 . . . . . . A 32 VAL HB . 34423 1 196 . 1 1 32 32 VAL HG11 H 1 0.601 0.000 . . . . . . A 32 VAL HG11 . 34423 1 197 . 1 1 32 32 VAL HG12 H 1 0.601 0.000 . . . . . . A 32 VAL HG12 . 34423 1 198 . 1 1 32 32 VAL HG13 H 1 0.601 0.000 . . . . . . A 32 VAL HG13 . 34423 1 199 . 1 1 32 32 VAL HG21 H 1 0.520 0.000 . . . . . . A 32 VAL HG21 . 34423 1 200 . 1 1 32 32 VAL HG22 H 1 0.520 0.000 . . . . . . A 32 VAL HG22 . 34423 1 201 . 1 1 32 32 VAL HG23 H 1 0.520 0.000 . . . . . . A 32 VAL HG23 . 34423 1 202 . 1 1 32 32 VAL C C 13 175.360 0.000 . . . . . . A 32 VAL C . 34423 1 203 . 1 1 32 32 VAL CA C 13 64.100 0.000 . . . . . . A 32 VAL CA . 34423 1 204 . 1 1 32 32 VAL CB C 13 32.080 0.000 . . . . . . A 32 VAL CB . 34423 1 205 . 1 1 32 32 VAL N N 15 116.250 0.000 . . . . . . A 32 VAL N . 34423 1 206 . 1 1 33 33 THR H H 1 7.168 0.000 . . . . . . A 33 THR H . 34423 1 207 . 1 1 33 33 THR HA H 1 4.263 0.000 . . . . . . A 33 THR HA . 34423 1 208 . 1 1 33 33 THR HB H 1 4.304 0.000 . . . . . . A 33 THR HB . 34423 1 209 . 1 1 33 33 THR HG1 H 1 4.990 0.000 . . . . . . A 33 THR HG1 . 34423 1 210 . 1 1 33 33 THR HG21 H 1 1.021 0.000 . . . . . . A 33 THR HG21 . 34423 1 211 . 1 1 33 33 THR HG22 H 1 1.021 0.000 . . . . . . A 33 THR HG22 . 34423 1 212 . 1 1 33 33 THR HG23 H 1 1.021 0.000 . . . . . . A 33 THR HG23 . 34423 1 213 . 1 1 33 33 THR C C 13 173.770 0.000 . . . . . . A 33 THR C . 34423 1 214 . 1 1 33 33 THR CA C 13 61.590 0.000 . . . . . . A 33 THR CA . 34423 1 215 . 1 1 33 33 THR CB C 13 70.010 0.000 . . . . . . A 33 THR CB . 34423 1 216 . 1 1 33 33 THR N N 15 105.510 0.000 . . . . . . A 33 THR N . 34423 1 217 . 1 1 34 34 LYS H H 1 6.794 0.000 . . . . . . A 34 LYS H . 34423 1 218 . 1 1 34 34 LYS HA H 1 4.149 0.000 . . . . . . A 34 LYS HA . 34423 1 219 . 1 1 34 34 LYS HB2 H 1 1.870 0.000 . . . . . . A 34 LYS HB2 . 34423 1 220 . 1 1 34 34 LYS HB3 H 1 1.965 0.000 . . . . . . A 34 LYS HB3 . 34423 1 221 . 1 1 34 34 LYS HG2 H 1 1.411 0.000 . . . . . . A 34 LYS HG2 . 34423 1 222 . 1 1 34 34 LYS HG3 H 1 1.466 0.000 . . . . . . A 34 LYS HG3 . 34423 1 223 . 1 1 34 34 LYS HD2 H 1 1.748 0.000 . . . . . . A 34 LYS HD2 . 34423 1 224 . 1 1 34 34 LYS HD3 H 1 1.748 0.000 . . . . . . A 34 LYS HD3 . 34423 1 225 . 1 1 34 34 LYS HE2 H 1 2.934 0.000 . . . . . . A 34 LYS HE2 . 34423 1 226 . 1 1 34 34 LYS HE3 H 1 2.934 0.000 . . . . . . A 34 LYS HE3 . 34423 1 227 . 1 1 34 34 LYS C C 13 176.020 0.000 . . . . . . A 34 LYS C . 34423 1 228 . 1 1 34 34 LYS CA C 13 55.490 0.000 . . . . . . A 34 LYS CA . 34423 1 229 . 1 1 34 34 LYS CB C 13 33.270 0.000 . . . . . . A 34 LYS CB . 34423 1 230 . 1 1 34 34 LYS N N 15 122.650 0.000 . . . . . . A 34 LYS N . 34423 1 231 . 1 1 35 35 SER H H 1 8.516 0.000 . . . . . . A 35 SER H . 34423 1 232 . 1 1 35 35 SER HA H 1 4.407 0.000 . . . . . . A 35 SER HA . 34423 1 233 . 1 1 35 35 SER HB2 H 1 3.936 0.000 . . . . . . A 35 SER HB2 . 34423 1 234 . 1 1 35 35 SER HB3 H 1 4.005 0.000 . . . . . . A 35 SER HB3 . 34423 1 235 . 1 1 35 35 SER C C 13 175.840 0.000 . . . . . . A 35 SER C . 34423 1 236 . 1 1 35 35 SER CA C 13 56.660 0.000 . . . . . . A 35 SER CA . 34423 1 237 . 1 1 35 35 SER CB C 13 63.740 0.000 . . . . . . A 35 SER CB . 34423 1 238 . 1 1 35 35 SER N N 15 116.450 0.000 . . . . . . A 35 SER N . 34423 1 239 . 1 1 36 36 PRO HA H 1 4.373 0.000 . . . . . . A 36 PRO HA . 34423 1 240 . 1 1 36 36 PRO HB2 H 1 1.424 0.000 . . . . . . A 36 PRO HB2 . 34423 1 241 . 1 1 36 36 PRO HB3 H 1 1.781 0.000 . . . . . . A 36 PRO HB3 . 34423 1 242 . 1 1 36 36 PRO HG2 H 1 1.661 0.000 . . . . . . A 36 PRO HG2 . 34423 1 243 . 1 1 36 36 PRO HG3 H 1 1.686 0.000 . . . . . . A 36 PRO HG3 . 34423 1 244 . 1 1 36 36 PRO HD2 H 1 3.532 0.000 . . . . . . A 36 PRO HD2 . 34423 1 245 . 1 1 36 36 PRO HD3 H 1 3.731 0.000 . . . . . . A 36 PRO HD3 . 34423 1 246 . 1 1 36 36 PRO C C 13 176.240 0.000 . . . . . . A 36 PRO C . 34423 1 247 . 1 1 36 36 PRO CA C 13 63.890 0.000 . . . . . . A 36 PRO CA . 34423 1 248 . 1 1 36 36 PRO CB C 13 32.210 0.000 . . . . . . A 36 PRO CB . 34423 1 249 . 1 1 37 37 ASP H H 1 7.890 0.000 . . . . . . A 37 ASP H . 34423 1 250 . 1 1 37 37 ASP HA H 1 4.504 0.000 . . . . . . A 37 ASP HA . 34423 1 251 . 1 1 37 37 ASP HB2 H 1 2.609 0.000 . . . . . . A 37 ASP HB2 . 34423 1 252 . 1 1 37 37 ASP HB3 H 1 2.682 0.000 . . . . . . A 37 ASP HB3 . 34423 1 253 . 1 1 37 37 ASP C C 13 176.690 0.000 . . . . . . A 37 ASP C . 34423 1 254 . 1 1 37 37 ASP CA C 13 54.420 0.000 . . . . . . A 37 ASP CA . 34423 1 255 . 1 1 37 37 ASP CB C 13 40.670 0.000 . . . . . . A 37 ASP CB . 34423 1 256 . 1 1 37 37 ASP N N 15 116.160 0.000 . . . . . . A 37 ASP N . 34423 1 257 . 1 1 38 38 SER H H 1 7.812 0.000 . . . . . . A 38 SER H . 34423 1 258 . 1 1 38 38 SER HA H 1 4.531 0.000 . . . . . . A 38 SER HA . 34423 1 259 . 1 1 38 38 SER HB2 H 1 3.995 0.000 . . . . . . A 38 SER HB2 . 34423 1 260 . 1 1 38 38 SER HB3 H 1 4.051 0.000 . . . . . . A 38 SER HB3 . 34423 1 261 . 1 1 38 38 SER C C 13 175.900 0.000 . . . . . . A 38 SER C . 34423 1 262 . 1 1 38 38 SER CA C 13 58.330 0.000 . . . . . . A 38 SER CA . 34423 1 263 . 1 1 38 38 SER CB C 13 63.930 0.000 . . . . . . A 38 SER CB . 34423 1 264 . 1 1 38 38 SER N N 15 116.210 0.000 . . . . . . A 38 SER N . 34423 1 265 . 1 1 39 39 VAL H H 1 8.656 0.000 . . . . . . A 39 VAL H . 34423 1 266 . 1 1 39 39 VAL HA H 1 3.904 0.000 . . . . . . A 39 VAL HA . 34423 1 267 . 1 1 39 39 VAL HB H 1 2.080 0.000 . . . . . . A 39 VAL HB . 34423 1 268 . 1 1 39 39 VAL HG11 H 1 1.064 0.000 . . . . . . A 39 VAL HG11 . 34423 1 269 . 1 1 39 39 VAL HG12 H 1 1.064 0.000 . . . . . . A 39 VAL HG12 . 34423 1 270 . 1 1 39 39 VAL HG13 H 1 1.064 0.000 . . . . . . A 39 VAL HG13 . 34423 1 271 . 1 1 39 39 VAL HG21 H 1 1.001 0.000 . . . . . . A 39 VAL HG21 . 34423 1 272 . 1 1 39 39 VAL HG22 H 1 1.001 0.000 . . . . . . A 39 VAL HG22 . 34423 1 273 . 1 1 39 39 VAL HG23 H 1 1.001 0.000 . . . . . . A 39 VAL HG23 . 34423 1 274 . 1 1 39 39 VAL C C 13 177.100 0.000 . . . . . . A 39 VAL C . 34423 1 275 . 1 1 39 39 VAL CA C 13 65.000 0.000 . . . . . . A 39 VAL CA . 34423 1 276 . 1 1 39 39 VAL CB C 13 32.140 0.000 . . . . . . A 39 VAL CB . 34423 1 277 . 1 1 39 39 VAL N N 15 127.190 0.000 . . . . . . A 39 VAL N . 34423 1 278 . 1 1 40 40 ASN HA H 1 4.128 0.000 . . . . . . A 40 ASN HA . 34423 1 279 . 1 1 40 40 ASN HB2 H 1 2.939 0.000 . . . . . . A 40 ASN HB2 . 34423 1 280 . 1 1 40 40 ASN HB3 H 1 3.134 0.000 . . . . . . A 40 ASN HB3 . 34423 1 281 . 1 1 40 40 ASN HD21 H 1 7.794 0.000 . . . . . . A 40 ASN HD21 . 34423 1 282 . 1 1 40 40 ASN HD22 H 1 6.897 0.000 . . . . . . A 40 ASN HD22 . 34423 1 283 . 1 1 40 40 ASN CA C 13 54.980 0.000 . . . . . . A 40 ASN CA . 34423 1 284 . 1 1 40 40 ASN CB C 13 38.920 0.000 . . . . . . A 40 ASN CB . 34423 1 285 . 1 1 40 40 ASN ND2 N 15 113.600 0.000 . . . . . . A 40 ASN ND2 . 34423 1 286 . 1 1 41 41 SER H H 1 8.002 0.000 . . . . . . A 41 SER H . 34423 1 287 . 1 1 41 41 SER HA H 1 4.182 0.000 . . . . . . A 41 SER HA . 34423 1 288 . 1 1 41 41 SER HB2 H 1 3.742 0.000 . . . . . . A 41 SER HB2 . 34423 1 289 . 1 1 41 41 SER HB3 H 1 3.779 0.000 . . . . . . A 41 SER HB3 . 34423 1 290 . 1 1 41 41 SER CA C 13 62.130 0.000 . . . . . . A 41 SER CA . 34423 1 291 . 1 1 41 41 SER CB C 13 63.680 0.000 . . . . . . A 41 SER CB . 34423 1 292 . 1 1 41 41 SER N N 15 116.600 0.000 . . . . . . A 41 SER N . 34423 1 293 . 1 1 42 42 GLU H H 1 8.622 0.000 . . . . . . A 42 GLU H . 34423 1 294 . 1 1 42 42 GLU HA H 1 3.768 0.000 . . . . . . A 42 GLU HA . 34423 1 295 . 1 1 42 42 GLU HB2 H 1 2.129 0.000 . . . . . . A 42 GLU HB2 . 34423 1 296 . 1 1 42 42 GLU HB3 H 1 2.201 0.000 . . . . . . A 42 GLU HB3 . 34423 1 297 . 1 1 42 42 GLU HG2 H 1 2.312 0.000 . . . . . . A 42 GLU HG2 . 34423 1 298 . 1 1 42 42 GLU HG3 H 1 2.344 0.000 . . . . . . A 42 GLU HG3 . 34423 1 299 . 1 1 42 42 GLU CA C 13 60.100 0.000 . . . . . . A 42 GLU CA . 34423 1 300 . 1 1 42 42 GLU CB C 13 29.830 0.000 . . . . . . A 42 GLU CB . 34423 1 301 . 1 1 42 42 GLU N N 15 124.310 0.000 . . . . . . A 42 GLU N . 34423 1 302 . 1 1 43 43 HIS H H 1 7.861 0.000 . . . . . . A 43 HIS H . 34423 1 303 . 1 1 43 43 HIS HA H 1 4.360 0.000 . . . . . . A 43 HIS HA . 34423 1 304 . 1 1 43 43 HIS HB2 H 1 3.085 0.000 . . . . . . A 43 HIS HB2 . 34423 1 305 . 1 1 43 43 HIS HB3 H 1 3.186 0.000 . . . . . . A 43 HIS HB3 . 34423 1 306 . 1 1 43 43 HIS C C 13 178.310 0.000 . . . . . . A 43 HIS C . 34423 1 307 . 1 1 43 43 HIS CA C 13 59.140 0.000 . . . . . . A 43 HIS CA . 34423 1 308 . 1 1 43 43 HIS CB C 13 30.450 0.000 . . . . . . A 43 HIS CB . 34423 1 309 . 1 1 43 43 HIS N N 15 119.290 0.000 . . . . . . A 43 HIS N . 34423 1 310 . 1 1 44 44 GLU H H 1 8.527 0.000 . . . . . . A 44 GLU H . 34423 1 311 . 1 1 44 44 GLU HA H 1 4.028 0.000 . . . . . . A 44 GLU HA . 34423 1 312 . 1 1 44 44 GLU HB2 H 1 2.031 0.000 . . . . . . A 44 GLU HB2 . 34423 1 313 . 1 1 44 44 GLU HB3 H 1 2.079 0.000 . . . . . . A 44 GLU HB3 . 34423 1 314 . 1 1 44 44 GLU HG2 H 1 2.351 0.000 . . . . . . A 44 GLU HG2 . 34423 1 315 . 1 1 44 44 GLU HG3 H 1 2.590 0.000 . . . . . . A 44 GLU HG3 . 34423 1 316 . 1 1 44 44 GLU C C 13 179.850 0.000 . . . . . . A 44 GLU C . 34423 1 317 . 1 1 44 44 GLU CA C 13 59.860 0.000 . . . . . . A 44 GLU CA . 34423 1 318 . 1 1 44 44 GLU CB C 13 29.700 0.000 . . . . . . A 44 GLU CB . 34423 1 319 . 1 1 44 44 GLU N N 15 118.840 0.000 . . . . . . A 44 GLU N . 34423 1 320 . 1 1 45 45 LEU H H 1 7.556 0.000 . . . . . . A 45 LEU H . 34423 1 321 . 1 1 45 45 LEU HA H 1 4.157 0.000 . . . . . . A 45 LEU HA . 34423 1 322 . 1 1 45 45 LEU HB2 H 1 1.111 0.000 . . . . . . A 45 LEU HB2 . 34423 1 323 . 1 1 45 45 LEU HB3 H 1 1.703 0.000 . . . . . . A 45 LEU HB3 . 34423 1 324 . 1 1 45 45 LEU HG H 1 1.376 0.000 . . . . . . A 45 LEU HG . 34423 1 325 . 1 1 45 45 LEU HD11 H 1 0.722 0.000 . . . . . . A 45 LEU HD11 . 34423 1 326 . 1 1 45 45 LEU HD12 H 1 0.722 0.000 . . . . . . A 45 LEU HD12 . 34423 1 327 . 1 1 45 45 LEU HD13 H 1 0.722 0.000 . . . . . . A 45 LEU HD13 . 34423 1 328 . 1 1 45 45 LEU HD21 H 1 0.176 0.000 . . . . . . A 45 LEU HD21 . 34423 1 329 . 1 1 45 45 LEU HD22 H 1 0.176 0.000 . . . . . . A 45 LEU HD22 . 34423 1 330 . 1 1 45 45 LEU HD23 H 1 0.176 0.000 . . . . . . A 45 LEU HD23 . 34423 1 331 . 1 1 45 45 LEU C C 13 177.410 0.000 . . . . . . A 45 LEU C . 34423 1 332 . 1 1 45 45 LEU CA C 13 58.330 0.000 . . . . . . A 45 LEU CA . 34423 1 333 . 1 1 45 45 LEU CB C 13 41.990 0.000 . . . . . . A 45 LEU CB . 34423 1 334 . 1 1 45 45 LEU N N 15 121.430 0.000 . . . . . . A 45 LEU N . 34423 1 335 . 1 1 46 46 ALA H H 1 8.459 0.000 . . . . . . A 46 ALA H . 34423 1 336 . 1 1 46 46 ALA HA H 1 4.030 0.000 . . . . . . A 46 ALA HA . 34423 1 337 . 1 1 46 46 ALA HB1 H 1 1.572 0.000 . . . . . . A 46 ALA HB1 . 34423 1 338 . 1 1 46 46 ALA HB2 H 1 1.572 0.000 . . . . . . A 46 ALA HB2 . 34423 1 339 . 1 1 46 46 ALA HB3 H 1 1.572 0.000 . . . . . . A 46 ALA HB3 . 34423 1 340 . 1 1 46 46 ALA C C 13 181.220 0.000 . . . . . . A 46 ALA C . 34423 1 341 . 1 1 46 46 ALA CA C 13 55.790 0.000 . . . . . . A 46 ALA CA . 34423 1 342 . 1 1 46 46 ALA CB C 13 18.480 0.000 . . . . . . A 46 ALA CB . 34423 1 343 . 1 1 46 46 ALA N N 15 120.840 0.000 . . . . . . A 46 ALA N . 34423 1 344 . 1 1 47 47 HIS H H 1 8.755 0.000 . . . . . . A 47 HIS H . 34423 1 345 . 1 1 47 47 HIS HA H 1 4.334 0.000 . . . . . . A 47 HIS HA . 34423 1 346 . 1 1 47 47 HIS HB2 H 1 3.085 0.000 . . . . . . A 47 HIS HB2 . 34423 1 347 . 1 1 47 47 HIS HB3 H 1 3.181 0.000 . . . . . . A 47 HIS HB3 . 34423 1 348 . 1 1 47 47 HIS C C 13 178.000 0.000 . . . . . . A 47 HIS C . 34423 1 349 . 1 1 47 47 HIS CA C 13 59.290 0.000 . . . . . . A 47 HIS CA . 34423 1 350 . 1 1 47 47 HIS CB C 13 30.140 0.000 . . . . . . A 47 HIS CB . 34423 1 351 . 1 1 47 47 HIS N N 15 117.770 0.000 . . . . . . A 47 HIS N . 34423 1 352 . 1 1 48 48 PHE H H 1 8.043 0.000 . . . . . . A 48 PHE H . 34423 1 353 . 1 1 48 48 PHE HA H 1 4.261 0.000 . . . . . . A 48 PHE HA . 34423 1 354 . 1 1 48 48 PHE HB2 H 1 3.360 0.000 . . . . . . A 48 PHE HB2 . 34423 1 355 . 1 1 48 48 PHE HB3 H 1 3.400 0.000 . . . . . . A 48 PHE HB3 . 34423 1 356 . 1 1 48 48 PHE HD1 H 1 7.260 0.000 . . . . . . A 48 PHE HD1 . 34423 1 357 . 1 1 48 48 PHE HD2 H 1 7.260 0.000 . . . . . . A 48 PHE HD2 . 34423 1 358 . 1 1 48 48 PHE HE1 H 1 7.340 0.000 . . . . . . A 48 PHE HE1 . 34423 1 359 . 1 1 48 48 PHE HE2 H 1 7.340 0.000 . . . . . . A 48 PHE HE2 . 34423 1 360 . 1 1 48 48 PHE C C 13 176.960 0.000 . . . . . . A 48 PHE C . 34423 1 361 . 1 1 48 48 PHE CA C 13 60.900 0.000 . . . . . . A 48 PHE CA . 34423 1 362 . 1 1 48 48 PHE CB C 13 40.670 0.000 . . . . . . A 48 PHE CB . 34423 1 363 . 1 1 48 48 PHE N N 15 120.700 0.000 . . . . . . A 48 PHE N . 34423 1 364 . 1 1 49 49 LEU H H 1 7.999 0.000 . . . . . . A 49 LEU H . 34423 1 365 . 1 1 49 49 LEU HA H 1 3.948 0.000 . . . . . . A 49 LEU HA . 34423 1 366 . 1 1 49 49 LEU HB2 H 1 1.644 0.000 . . . . . . A 49 LEU HB2 . 34423 1 367 . 1 1 49 49 LEU HB3 H 1 2.043 0.000 . . . . . . A 49 LEU HB3 . 34423 1 368 . 1 1 49 49 LEU HG H 1 1.564 0.000 . . . . . . A 49 LEU HG . 34423 1 369 . 1 1 49 49 LEU HD11 H 1 1.001 0.000 . . . . . . A 49 LEU HD11 . 34423 1 370 . 1 1 49 49 LEU HD12 H 1 1.001 0.000 . . . . . . A 49 LEU HD12 . 34423 1 371 . 1 1 49 49 LEU HD13 H 1 1.001 0.000 . . . . . . A 49 LEU HD13 . 34423 1 372 . 1 1 49 49 LEU HD21 H 1 0.932 0.000 . . . . . . A 49 LEU HD21 . 34423 1 373 . 1 1 49 49 LEU HD22 H 1 0.932 0.000 . . . . . . A 49 LEU HD22 . 34423 1 374 . 1 1 49 49 LEU HD23 H 1 0.932 0.000 . . . . . . A 49 LEU HD23 . 34423 1 375 . 1 1 49 49 LEU C C 13 178.910 0.000 . . . . . . A 49 LEU C . 34423 1 376 . 1 1 49 49 LEU CA C 13 57.110 0.000 . . . . . . A 49 LEU CA . 34423 1 377 . 1 1 49 49 LEU CB C 13 43.310 0.000 . . . . . . A 49 LEU CB . 34423 1 378 . 1 1 49 49 LEU N N 15 114.990 0.000 . . . . . . A 49 LEU N . 34423 1 379 . 1 1 50 50 GLY H H 1 7.628 0.000 . . . . . . A 50 GLY H . 34423 1 380 . 1 1 50 50 GLY HA2 H 1 4.191 0.000 . . . . . . A 50 GLY HA2 . 34423 1 381 . 1 1 50 50 GLY HA3 H 1 3.927 0.000 . . . . . . A 50 GLY HA3 . 34423 1 382 . 1 1 50 50 GLY C C 13 174.170 0.000 . . . . . . A 50 GLY C . 34423 1 383 . 1 1 50 50 GLY CA C 13 48.970 0.000 . . . . . . A 50 GLY CA . 34423 1 384 . 1 1 50 50 GLY N N 15 105.270 0.000 . . . . . . A 50 GLY N . 34423 1 385 . 1 1 51 51 PRO HA H 1 4.261 0.000 . . . . . . A 51 PRO HA . 34423 1 386 . 1 1 51 51 PRO HB2 H 1 1.782 0.000 . . . . . . A 51 PRO HB2 . 34423 1 387 . 1 1 51 51 PRO HB3 H 1 2.180 0.000 . . . . . . A 51 PRO HB3 . 34423 1 388 . 1 1 51 51 PRO HG2 H 1 1.993 0.000 . . . . . . A 51 PRO HG2 . 34423 1 389 . 1 1 51 51 PRO HG3 H 1 2.021 0.000 . . . . . . A 51 PRO HG3 . 34423 1 390 . 1 1 51 51 PRO HD2 H 1 3.532 0.000 . . . . . . A 51 PRO HD2 . 34423 1 391 . 1 1 51 51 PRO HD3 H 1 3.655 0.000 . . . . . . A 51 PRO HD3 . 34423 1 392 . 1 1 51 51 PRO C C 13 177.090 0.000 . . . . . . A 51 PRO C . 34423 1 393 . 1 1 51 51 PRO CA C 13 64.460 0.000 . . . . . . A 51 PRO CA . 34423 1 394 . 1 1 51 51 PRO CB C 13 32.460 0.000 . . . . . . A 51 PRO CB . 34423 1 395 . 1 1 52 52 HIS H H 1 7.141 0.000 . . . . . . A 52 HIS H . 34423 1 396 . 1 1 52 52 HIS HA H 1 4.434 0.000 . . . . . . A 52 HIS HA . 34423 1 397 . 1 1 52 52 HIS HB2 H 1 2.874 0.000 . . . . . . A 52 HIS HB2 . 34423 1 398 . 1 1 52 52 HIS HB3 H 1 4.022 0.000 . . . . . . A 52 HIS HB3 . 34423 1 399 . 1 1 52 52 HIS HD2 H 1 6.980 0.000 . . . . . . A 52 HIS HD2 . 34423 1 400 . 1 1 52 52 HIS C C 13 175.040 0.000 . . . . . . A 52 HIS C . 34423 1 401 . 1 1 52 52 HIS CA C 13 58.570 0.000 . . . . . . A 52 HIS CA . 34423 1 402 . 1 1 52 52 HIS CB C 13 33.590 0.000 . . . . . . A 52 HIS CB . 34423 1 403 . 1 1 52 52 HIS N N 15 115.330 0.000 . . . . . . A 52 HIS N . 34423 1 404 . 1 1 53 53 ASP H H 1 8.394 0.000 . . . . . . A 53 ASP H . 34423 1 405 . 1 1 53 53 ASP HA H 1 4.456 0.000 . . . . . . A 53 ASP HA . 34423 1 406 . 1 1 53 53 ASP HB2 H 1 2.407 0.000 . . . . . . A 53 ASP HB2 . 34423 1 407 . 1 1 53 53 ASP HB3 H 1 3.198 0.000 . . . . . . A 53 ASP HB3 . 34423 1 408 . 1 1 53 53 ASP C C 13 172.470 0.000 . . . . . . A 53 ASP C . 34423 1 409 . 1 1 53 53 ASP CA C 13 54.270 0.000 . . . . . . A 53 ASP CA . 34423 1 410 . 1 1 53 53 ASP CB C 13 41.050 0.000 . . . . . . A 53 ASP CB . 34423 1 411 . 1 1 53 53 ASP N N 15 115.420 0.000 . . . . . . A 53 ASP N . 34423 1 412 . 1 1 54 54 PRO HA H 1 4.376 0.000 . . . . . . A 54 PRO HA . 34423 1 413 . 1 1 54 54 PRO HD2 H 1 3.686 0.000 . . . . . . A 54 PRO HD2 . 34423 1 414 . 1 1 54 54 PRO HD3 H 1 3.746 0.000 . . . . . . A 54 PRO HD3 . 34423 1 415 . 1 1 54 54 PRO C C 13 177.550 0.000 . . . . . . A 54 PRO C . 34423 1 416 . 1 1 54 54 PRO CA C 13 62.700 0.000 . . . . . . A 54 PRO CA . 34423 1 417 . 1 1 54 54 PRO CB C 13 31.020 0.000 . . . . . . A 54 PRO CB . 34423 1 418 . 1 1 55 55 GLU H H 1 7.629 0.000 . . . . . . A 55 GLU H . 34423 1 419 . 1 1 55 55 GLU HA H 1 4.279 0.000 . . . . . . A 55 GLU HA . 34423 1 420 . 1 1 55 55 GLU HB2 H 1 1.910 0.000 . . . . . . A 55 GLU HB2 . 34423 1 421 . 1 1 55 55 GLU HB3 H 1 2.003 0.000 . . . . . . A 55 GLU HB3 . 34423 1 422 . 1 1 55 55 GLU HG2 H 1 2.237 0.000 . . . . . . A 55 GLU HG2 . 34423 1 423 . 1 1 55 55 GLU HG3 H 1 2.431 0.000 . . . . . . A 55 GLU HG3 . 34423 1 424 . 1 1 55 55 GLU C C 13 175.500 0.000 . . . . . . A 55 GLU C . 34423 1 425 . 1 1 55 55 GLU CA C 13 56.750 0.000 . . . . . . A 55 GLU CA . 34423 1 426 . 1 1 55 55 GLU CB C 13 31.580 0.000 . . . . . . A 55 GLU CB . 34423 1 427 . 1 1 55 55 GLU N N 15 119.250 0.000 . . . . . . A 55 GLU N . 34423 1 428 . 1 1 56 56 ILE H H 1 8.745 0.000 . . . . . . A 56 ILE H . 34423 1 429 . 1 1 56 56 ILE HA H 1 4.795 0.000 . . . . . . A 56 ILE HA . 34423 1 430 . 1 1 56 56 ILE HB H 1 1.626 0.000 . . . . . . A 56 ILE HB . 34423 1 431 . 1 1 56 56 ILE HG12 H 1 1.476 0.000 . . . . . . A 56 ILE HG12 . 34423 1 432 . 1 1 56 56 ILE HG13 H 1 0.831 0.000 . . . . . . A 56 ILE HG13 . 34423 1 433 . 1 1 56 56 ILE HG21 H 1 0.562 0.000 . . . . . . A 56 ILE HG21 . 34423 1 434 . 1 1 56 56 ILE HG22 H 1 0.562 0.000 . . . . . . A 56 ILE HG22 . 34423 1 435 . 1 1 56 56 ILE HG23 H 1 0.562 0.000 . . . . . . A 56 ILE HG23 . 34423 1 436 . 1 1 56 56 ILE HD11 H 1 0.330 0.000 . . . . . . A 56 ILE HD11 . 34423 1 437 . 1 1 56 56 ILE HD12 H 1 0.330 0.000 . . . . . . A 56 ILE HD12 . 34423 1 438 . 1 1 56 56 ILE HD13 H 1 0.330 0.000 . . . . . . A 56 ILE HD13 . 34423 1 439 . 1 1 56 56 ILE C C 13 173.910 0.000 . . . . . . A 56 ILE C . 34423 1 440 . 1 1 56 56 ILE CA C 13 60.610 0.000 . . . . . . A 56 ILE CA . 34423 1 441 . 1 1 56 56 ILE CB C 13 40.170 0.000 . . . . . . A 56 ILE CB . 34423 1 442 . 1 1 56 56 ILE N N 15 125.580 0.000 . . . . . . A 56 ILE N . 34423 1 443 . 1 1 57 57 TYR H H 1 9.153 0.000 . . . . . . A 57 TYR H . 34423 1 444 . 1 1 57 57 TYR HA H 1 5.303 0.000 . . . . . . A 57 TYR HA . 34423 1 445 . 1 1 57 57 TYR HB2 H 1 2.766 0.000 . . . . . . A 57 TYR HB2 . 34423 1 446 . 1 1 57 57 TYR HB3 H 1 3.004 0.000 . . . . . . A 57 TYR HB3 . 34423 1 447 . 1 1 57 57 TYR HD1 H 1 6.850 0.000 . . . . . . A 57 TYR HD1 . 34423 1 448 . 1 1 57 57 TYR HD2 H 1 6.850 0.000 . . . . . . A 57 TYR HD2 . 34423 1 449 . 1 1 57 57 TYR HE1 H 1 6.781 0.000 . . . . . . A 57 TYR HE1 . 34423 1 450 . 1 1 57 57 TYR HE2 H 1 6.781 0.000 . . . . . . A 57 TYR HE2 . 34423 1 451 . 1 1 57 57 TYR C C 13 176.620 0.000 . . . . . . A 57 TYR C . 34423 1 452 . 1 1 57 57 TYR CA C 13 56.270 0.000 . . . . . . A 57 TYR CA . 34423 1 453 . 1 1 57 57 TYR CB C 13 42.240 0.000 . . . . . . A 57 TYR CB . 34423 1 454 . 1 1 57 57 TYR N N 15 124.510 0.000 . . . . . . A 57 TYR N . 34423 1 455 . 1 1 58 58 VAL H H 1 8.780 0.000 . . . . . . A 58 VAL H . 34423 1 456 . 1 1 58 58 VAL HA H 1 4.839 0.000 . . . . . . A 58 VAL HA . 34423 1 457 . 1 1 58 58 VAL HB H 1 2.060 0.000 . . . . . . A 58 VAL HB . 34423 1 458 . 1 1 58 58 VAL HG11 H 1 1.172 0.000 . . . . . . A 58 VAL HG11 . 34423 1 459 . 1 1 58 58 VAL HG12 H 1 1.172 0.000 . . . . . . A 58 VAL HG12 . 34423 1 460 . 1 1 58 58 VAL HG13 H 1 1.172 0.000 . . . . . . A 58 VAL HG13 . 34423 1 461 . 1 1 58 58 VAL HG21 H 1 0.575 0.000 . . . . . . A 58 VAL HG21 . 34423 1 462 . 1 1 58 58 VAL HG22 H 1 0.575 0.000 . . . . . . A 58 VAL HG22 . 34423 1 463 . 1 1 58 58 VAL HG23 H 1 0.575 0.000 . . . . . . A 58 VAL HG23 . 34423 1 464 . 1 1 58 58 VAL C C 13 175.780 0.000 . . . . . . A 58 VAL C . 34423 1 465 . 1 1 58 58 VAL CA C 13 62.310 0.000 . . . . . . A 58 VAL CA . 34423 1 466 . 1 1 58 58 VAL CB C 13 34.590 0.000 . . . . . . A 58 VAL CB . 34423 1 467 . 1 1 58 58 VAL N N 15 119.750 0.000 . . . . . . A 58 VAL N . 34423 1 468 . 1 1 59 59 ASN H H 1 9.773 0.000 . . . . . . A 59 ASN H . 34423 1 469 . 1 1 59 59 ASN HA H 1 4.568 0.000 . . . . . . A 59 ASN HA . 34423 1 470 . 1 1 59 59 ASN HB2 H 1 2.927 0.000 . . . . . . A 59 ASN HB2 . 34423 1 471 . 1 1 59 59 ASN HB3 H 1 3.192 0.000 . . . . . . A 59 ASN HB3 . 34423 1 472 . 1 1 59 59 ASN HD21 H 1 7.556 0.000 . . . . . . A 59 ASN HD21 . 34423 1 473 . 1 1 59 59 ASN HD22 H 1 6.492 0.000 . . . . . . A 59 ASN HD22 . 34423 1 474 . 1 1 59 59 ASN C C 13 175.300 0.000 . . . . . . A 59 ASN C . 34423 1 475 . 1 1 59 59 ASN CA C 13 54.650 0.000 . . . . . . A 59 ASN CA . 34423 1 476 . 1 1 59 59 ASN CB C 13 36.970 0.000 . . . . . . A 59 ASN CB . 34423 1 477 . 1 1 59 59 ASN N N 15 128.660 0.000 . . . . . . A 59 ASN N . 34423 1 478 . 1 1 59 59 ASN ND2 N 15 110.780 0.000 . . . . . . A 59 ASN ND2 . 34423 1 479 . 1 1 60 60 GLY H H 1 9.827 0.000 . . . . . . A 60 GLY H . 34423 1 480 . 1 1 60 60 GLY HA2 H 1 4.305 0.000 . . . . . . A 60 GLY HA2 . 34423 1 481 . 1 1 60 60 GLY HA3 H 1 3.660 0.000 . . . . . . A 60 GLY HA3 . 34423 1 482 . 1 1 60 60 GLY C C 13 173.910 0.000 . . . . . . A 60 GLY C . 34423 1 483 . 1 1 60 60 GLY CA C 13 45.500 0.000 . . . . . . A 60 GLY CA . 34423 1 484 . 1 1 60 60 GLY N N 15 103.850 0.000 . . . . . . A 60 GLY N . 34423 1 485 . 1 1 61 61 LYS H H 1 7.812 0.000 . . . . . . A 61 LYS H . 34423 1 486 . 1 1 61 61 LYS HA H 1 4.968 0.000 . . . . . . A 61 LYS HA . 34423 1 487 . 1 1 61 61 LYS HB2 H 1 1.861 0.000 . . . . . . A 61 LYS HB2 . 34423 1 488 . 1 1 61 61 LYS HB3 H 1 1.994 0.000 . . . . . . A 61 LYS HB3 . 34423 1 489 . 1 1 61 61 LYS HG2 H 1 1.572 0.000 . . . . . . A 61 LYS HG2 . 34423 1 490 . 1 1 61 61 LYS HG3 H 1 1.607 0.000 . . . . . . A 61 LYS HG3 . 34423 1 491 . 1 1 61 61 LYS HD2 H 1 1.834 0.000 . . . . . . A 61 LYS HD2 . 34423 1 492 . 1 1 61 61 LYS HD3 H 1 1.834 0.000 . . . . . . A 61 LYS HD3 . 34423 1 493 . 1 1 61 61 LYS HE2 H 1 3.130 0.000 . . . . . . A 61 LYS HE2 . 34423 1 494 . 1 1 61 61 LYS HE3 H 1 3.130 0.000 . . . . . . A 61 LYS HE3 . 34423 1 495 . 1 1 61 61 LYS C C 13 176.390 0.000 . . . . . . A 61 LYS C . 34423 1 496 . 1 1 61 61 LYS CA C 13 54.450 0.000 . . . . . . A 61 LYS CA . 34423 1 497 . 1 1 61 61 LYS CB C 13 34.720 0.000 . . . . . . A 61 LYS CB . 34423 1 498 . 1 1 61 61 LYS N N 15 120.750 0.000 . . . . . . A 61 LYS N . 34423 1 499 . 1 1 62 62 ILE H H 1 8.877 0.000 . . . . . . A 62 ILE H . 34423 1 500 . 1 1 62 62 ILE HA H 1 4.055 0.000 . . . . . . A 62 ILE HA . 34423 1 501 . 1 1 62 62 ILE HB H 1 1.536 0.000 . . . . . . A 62 ILE HB . 34423 1 502 . 1 1 62 62 ILE HG12 H 1 1.027 0.000 . . . . . . A 62 ILE HG12 . 34423 1 503 . 1 1 62 62 ILE HG13 H 1 0.966 0.000 . . . . . . A 62 ILE HG13 . 34423 1 504 . 1 1 62 62 ILE HG21 H 1 0.846 0.000 . . . . . . A 62 ILE HG21 . 34423 1 505 . 1 1 62 62 ILE HG22 H 1 0.846 0.000 . . . . . . A 62 ILE HG22 . 34423 1 506 . 1 1 62 62 ILE HG23 H 1 0.846 0.000 . . . . . . A 62 ILE HG23 . 34423 1 507 . 1 1 62 62 ILE HD11 H 1 0.572 0.000 . . . . . . A 62 ILE HD11 . 34423 1 508 . 1 1 62 62 ILE HD12 H 1 0.572 0.000 . . . . . . A 62 ILE HD12 . 34423 1 509 . 1 1 62 62 ILE HD13 H 1 0.572 0.000 . . . . . . A 62 ILE HD13 . 34423 1 510 . 1 1 62 62 ILE C C 13 174.390 0.000 . . . . . . A 62 ILE C . 34423 1 511 . 1 1 62 62 ILE CA C 13 60.990 0.000 . . . . . . A 62 ILE CA . 34423 1 512 . 1 1 62 62 ILE CB C 13 38.540 0.000 . . . . . . A 62 ILE CB . 34423 1 513 . 1 1 62 62 ILE N N 15 129.880 0.000 . . . . . . A 62 ILE N . 34423 1 514 . 1 1 63 63 GLN H H 1 8.792 0.000 . . . . . . A 63 GLN H . 34423 1 515 . 1 1 63 63 GLN HA H 1 4.927 0.000 . . . . . . A 63 GLN HA . 34423 1 516 . 1 1 63 63 GLN HB2 H 1 1.545 0.000 . . . . . . A 63 GLN HB2 . 34423 1 517 . 1 1 63 63 GLN HB3 H 1 2.599 0.000 . . . . . . A 63 GLN HB3 . 34423 1 518 . 1 1 63 63 GLN HG2 H 1 2.269 0.000 . . . . . . A 63 GLN HG2 . 34423 1 519 . 1 1 63 63 GLN HG3 H 1 2.923 0.000 . . . . . . A 63 GLN HG3 . 34423 1 520 . 1 1 63 63 GLN HE21 H 1 7.121 0.000 . . . . . . A 63 GLN HE21 . 34423 1 521 . 1 1 63 63 GLN HE22 H 1 6.805 0.000 . . . . . . A 63 GLN HE22 . 34423 1 522 . 1 1 63 63 GLN C C 13 176.350 0.000 . . . . . . A 63 GLN C . 34423 1 523 . 1 1 63 63 GLN CA C 13 52.680 0.000 . . . . . . A 63 GLN CA . 34423 1 524 . 1 1 63 63 GLN CB C 13 31.830 0.000 . . . . . . A 63 GLN CB . 34423 1 525 . 1 1 63 63 GLN N N 15 124.410 0.000 . . . . . . A 63 GLN N . 34423 1 526 . 1 1 63 63 GLN NE2 N 15 111.540 0.000 . . . . . . A 63 GLN NE2 . 34423 1 527 . 1 1 64 64 THR H H 1 7.836 0.000 . . . . . . A 64 THR H . 34423 1 528 . 1 1 64 64 THR HA H 1 4.629 0.000 . . . . . . A 64 THR HA . 34423 1 529 . 1 1 64 64 THR HB H 1 4.823 0.000 . . . . . . A 64 THR HB . 34423 1 530 . 1 1 64 64 THR HG21 H 1 1.413 0.000 . . . . . . A 64 THR HG21 . 34423 1 531 . 1 1 64 64 THR HG22 H 1 1.413 0.000 . . . . . . A 64 THR HG22 . 34423 1 532 . 1 1 64 64 THR HG23 H 1 1.413 0.000 . . . . . . A 64 THR HG23 . 34423 1 533 . 1 1 64 64 THR C C 13 175.930 0.000 . . . . . . A 64 THR C . 34423 1 534 . 1 1 64 64 THR CA C 13 60.610 0.000 . . . . . . A 64 THR CA . 34423 1 535 . 1 1 64 64 THR CB C 13 71.330 0.000 . . . . . . A 64 THR CB . 34423 1 536 . 1 1 64 64 THR N N 15 110.790 0.000 . . . . . . A 64 THR N . 34423 1 537 . 1 1 65 65 THR H H 1 9.000 0.000 . . . . . . A 65 THR H . 34423 1 538 . 1 1 65 65 THR HA H 1 4.241 0.000 . . . . . . A 65 THR HA . 34423 1 539 . 1 1 65 65 THR HB H 1 3.923 0.000 . . . . . . A 65 THR HB . 34423 1 540 . 1 1 65 65 THR HG21 H 1 1.377 0.000 . . . . . . A 65 THR HG21 . 34423 1 541 . 1 1 65 65 THR HG22 H 1 1.377 0.000 . . . . . . A 65 THR HG22 . 34423 1 542 . 1 1 65 65 THR HG23 H 1 1.377 0.000 . . . . . . A 65 THR HG23 . 34423 1 543 . 1 1 65 65 THR C C 13 176.420 0.000 . . . . . . A 65 THR C . 34423 1 544 . 1 1 65 65 THR CA C 13 67.960 0.000 . . . . . . A 65 THR CA . 34423 1 545 . 1 1 65 65 THR N N 15 118.350 0.000 . . . . . . A 65 THR N . 34423 1 546 . 1 1 66 66 THR H H 1 8.060 0.000 . . . . . . A 66 THR H . 34423 1 547 . 1 1 66 66 THR HA H 1 3.896 0.000 . . . . . . A 66 THR HA . 34423 1 548 . 1 1 66 66 THR HB H 1 4.081 0.000 . . . . . . A 66 THR HB . 34423 1 549 . 1 1 66 66 THR HG21 H 1 1.252 0.000 . . . . . . A 66 THR HG21 . 34423 1 550 . 1 1 66 66 THR HG22 H 1 1.252 0.000 . . . . . . A 66 THR HG22 . 34423 1 551 . 1 1 66 66 THR HG23 H 1 1.252 0.000 . . . . . . A 66 THR HG23 . 34423 1 552 . 1 1 66 66 THR C C 13 176.520 0.000 . . . . . . A 66 THR C . 34423 1 553 . 1 1 66 66 THR CA C 13 66.680 0.000 . . . . . . A 66 THR CA . 34423 1 554 . 1 1 66 66 THR CB C 13 69.070 0.000 . . . . . . A 66 THR CB . 34423 1 555 . 1 1 66 66 THR N N 15 114.640 0.000 . . . . . . A 66 THR N . 34423 1 556 . 1 1 67 67 ALA H H 1 7.972 0.000 . . . . . . A 67 ALA H . 34423 1 557 . 1 1 67 67 ALA HA H 1 3.979 0.000 . . . . . . A 67 ALA HA . 34423 1 558 . 1 1 67 67 ALA HB1 H 1 1.543 0.000 . . . . . . A 67 ALA HB1 . 34423 1 559 . 1 1 67 67 ALA HB2 H 1 1.543 0.000 . . . . . . A 67 ALA HB2 . 34423 1 560 . 1 1 67 67 ALA HB3 H 1 1.543 0.000 . . . . . . A 67 ALA HB3 . 34423 1 561 . 1 1 67 67 ALA C C 13 179.960 0.000 . . . . . . A 67 ALA C . 34423 1 562 . 1 1 67 67 ALA CA C 13 55.190 0.000 . . . . . . A 67 ALA CA . 34423 1 563 . 1 1 67 67 ALA CB C 13 19.170 0.000 . . . . . . A 67 ALA CB . 34423 1 564 . 1 1 67 67 ALA N N 15 126.210 0.000 . . . . . . A 67 ALA N . 34423 1 565 . 1 1 68 68 PHE H H 1 8.631 0.000 . . . . . . A 68 PHE H . 34423 1 566 . 1 1 68 68 PHE HA H 1 4.503 0.000 . . . . . . A 68 PHE HA . 34423 1 567 . 1 1 68 68 PHE HB2 H 1 3.189 0.000 . . . . . . A 68 PHE HB2 . 34423 1 568 . 1 1 68 68 PHE HB3 H 1 3.509 0.000 . . . . . . A 68 PHE HB3 . 34423 1 569 . 1 1 68 68 PHE HD1 H 1 7.090 0.000 . . . . . . A 68 PHE HD1 . 34423 1 570 . 1 1 68 68 PHE HD2 H 1 7.090 0.000 . . . . . . A 68 PHE HD2 . 34423 1 571 . 1 1 68 68 PHE HE1 H 1 6.830 0.000 . . . . . . A 68 PHE HE1 . 34423 1 572 . 1 1 68 68 PHE HE2 H 1 6.830 0.000 . . . . . . A 68 PHE HE2 . 34423 1 573 . 1 1 68 68 PHE HZ H 1 6.870 0.000 . . . . . . A 68 PHE HZ . 34423 1 574 . 1 1 68 68 PHE C C 13 176.870 0.000 . . . . . . A 68 PHE C . 34423 1 575 . 1 1 68 68 PHE CA C 13 61.560 0.000 . . . . . . A 68 PHE CA . 34423 1 576 . 1 1 68 68 PHE CB C 13 39.860 0.000 . . . . . . A 68 PHE CB . 34423 1 577 . 1 1 68 68 PHE N N 15 119.030 0.000 . . . . . . A 68 PHE N . 34423 1 578 . 1 1 69 69 LEU H H 1 8.616 0.000 . . . . . . A 69 LEU H . 34423 1 579 . 1 1 69 69 LEU HA H 1 3.910 0.000 . . . . . . A 69 LEU HA . 34423 1 580 . 1 1 69 69 LEU HB2 H 1 1.550 0.000 . . . . . . A 69 LEU HB2 . 34423 1 581 . 1 1 69 69 LEU HB3 H 1 1.659 0.000 . . . . . . A 69 LEU HB3 . 34423 1 582 . 1 1 69 69 LEU HG H 1 1.270 0.000 . . . . . . A 69 LEU HG . 34423 1 583 . 1 1 69 69 LEU HD11 H 1 0.991 0.000 . . . . . . A 69 LEU HD11 . 34423 1 584 . 1 1 69 69 LEU HD12 H 1 0.991 0.000 . . . . . . A 69 LEU HD12 . 34423 1 585 . 1 1 69 69 LEU HD13 H 1 0.991 0.000 . . . . . . A 69 LEU HD13 . 34423 1 586 . 1 1 69 69 LEU HD21 H 1 0.802 0.000 . . . . . . A 69 LEU HD21 . 34423 1 587 . 1 1 69 69 LEU HD22 H 1 0.802 0.000 . . . . . . A 69 LEU HD22 . 34423 1 588 . 1 1 69 69 LEU HD23 H 1 0.802 0.000 . . . . . . A 69 LEU HD23 . 34423 1 589 . 1 1 69 69 LEU C C 13 178.890 0.000 . . . . . . A 69 LEU C . 34423 1 590 . 1 1 69 69 LEU CA C 13 57.650 0.000 . . . . . . A 69 LEU CA . 34423 1 591 . 1 1 69 69 LEU CB C 13 40.990 0.000 . . . . . . A 69 LEU CB . 34423 1 592 . 1 1 69 69 LEU N N 15 118.950 0.000 . . . . . . A 69 LEU N . 34423 1 593 . 1 1 70 70 GLN H H 1 7.716 0.000 . . . . . . A 70 GLN H . 34423 1 594 . 1 1 70 70 GLN HA H 1 4.008 0.000 . . . . . . A 70 GLN HA . 34423 1 595 . 1 1 70 70 GLN HB2 H 1 2.007 0.000 . . . . . . A 70 GLN HB2 . 34423 1 596 . 1 1 70 70 GLN HB3 H 1 2.098 0.000 . . . . . . A 70 GLN HB3 . 34423 1 597 . 1 1 70 70 GLN HG2 H 1 2.232 0.000 . . . . . . A 70 GLN HG2 . 34423 1 598 . 1 1 70 70 GLN HG3 H 1 2.335 0.000 . . . . . . A 70 GLN HG3 . 34423 1 599 . 1 1 70 70 GLN HE21 H 1 7.350 0.000 . . . . . . A 70 GLN HE21 . 34423 1 600 . 1 1 70 70 GLN HE22 H 1 6.789 0.000 . . . . . . A 70 GLN HE22 . 34423 1 601 . 1 1 70 70 GLN C C 13 178.610 0.000 . . . . . . A 70 GLN C . 34423 1 602 . 1 1 70 70 GLN CA C 13 59.350 0.000 . . . . . . A 70 GLN CA . 34423 1 603 . 1 1 70 70 GLN CB C 13 27.760 0.000 . . . . . . A 70 GLN CB . 34423 1 604 . 1 1 70 70 GLN N N 15 119.770 0.000 . . . . . . A 70 GLN N . 34423 1 605 . 1 1 70 70 GLN NE2 N 15 111.800 0.000 . . . . . . A 70 GLN NE2 . 34423 1 606 . 1 1 71 71 PHE H H 1 7.897 0.000 . . . . . . A 71 PHE H . 34423 1 607 . 1 1 71 71 PHE HA H 1 4.337 0.000 . . . . . . A 71 PHE HA . 34423 1 608 . 1 1 71 71 PHE HB2 H 1 2.694 0.000 . . . . . . A 71 PHE HB2 . 34423 1 609 . 1 1 71 71 PHE HB3 H 1 3.281 0.000 . . . . . . A 71 PHE HB3 . 34423 1 610 . 1 1 71 71 PHE HD1 H 1 7.190 0.000 . . . . . . A 71 PHE HD1 . 34423 1 611 . 1 1 71 71 PHE HD2 H 1 7.190 0.000 . . . . . . A 71 PHE HD2 . 34423 1 612 . 1 1 71 71 PHE HE1 H 1 7.290 0.000 . . . . . . A 71 PHE HE1 . 34423 1 613 . 1 1 71 71 PHE HE2 H 1 7.290 0.000 . . . . . . A 71 PHE HE2 . 34423 1 614 . 1 1 71 71 PHE C C 13 178.230 0.000 . . . . . . A 71 PHE C . 34423 1 615 . 1 1 71 71 PHE CA C 13 59.770 0.000 . . . . . . A 71 PHE CA . 34423 1 616 . 1 1 71 71 PHE CB C 13 38.540 0.000 . . . . . . A 71 PHE CB . 34423 1 617 . 1 1 71 71 PHE N N 15 119.220 0.000 . . . . . . A 71 PHE N . 34423 1 618 . 1 1 72 72 PHE H H 1 8.292 0.000 . . . . . . A 72 PHE H . 34423 1 619 . 1 1 72 72 PHE HA H 1 4.323 0.000 . . . . . . A 72 PHE HA . 34423 1 620 . 1 1 72 72 PHE HB2 H 1 2.662 0.000 . . . . . . A 72 PHE HB2 . 34423 1 621 . 1 1 72 72 PHE HB3 H 1 3.360 0.000 . . . . . . A 72 PHE HB3 . 34423 1 622 . 1 1 72 72 PHE HD1 H 1 7.150 0.000 . . . . . . A 72 PHE HD1 . 34423 1 623 . 1 1 72 72 PHE HD2 H 1 7.150 0.000 . . . . . . A 72 PHE HD2 . 34423 1 624 . 1 1 72 72 PHE HE1 H 1 6.865 0.000 . . . . . . A 72 PHE HE1 . 34423 1 625 . 1 1 72 72 PHE HE2 H 1 6.865 0.000 . . . . . . A 72 PHE HE2 . 34423 1 626 . 1 1 72 72 PHE HZ H 1 6.900 0.000 . . . . . . A 72 PHE HZ . 34423 1 627 . 1 1 72 72 PHE C C 13 179.150 0.000 . . . . . . A 72 PHE C . 34423 1 628 . 1 1 72 72 PHE CA C 13 60.940 0.000 . . . . . . A 72 PHE CA . 34423 1 629 . 1 1 72 72 PHE CB C 13 38.480 0.000 . . . . . . A 72 PHE CB . 34423 1 630 . 1 1 72 72 PHE N N 15 120.010 0.000 . . . . . . A 72 PHE N . 34423 1 631 . 1 1 73 73 ARG H H 1 8.646 0.000 . . . . . . A 73 ARG H . 34423 1 632 . 1 1 73 73 ARG HA H 1 3.700 0.000 . . . . . . A 73 ARG HA . 34423 1 633 . 1 1 73 73 ARG HB2 H 1 1.930 0.000 . . . . . . A 73 ARG HB2 . 34423 1 634 . 1 1 73 73 ARG HB3 H 1 2.125 0.000 . . . . . . A 73 ARG HB3 . 34423 1 635 . 1 1 73 73 ARG HG2 H 1 1.749 0.000 . . . . . . A 73 ARG HG2 . 34423 1 636 . 1 1 73 73 ARG HG3 H 1 1.950 0.000 . . . . . . A 73 ARG HG3 . 34423 1 637 . 1 1 73 73 ARG HD2 H 1 3.202 0.000 . . . . . . A 73 ARG HD2 . 34423 1 638 . 1 1 73 73 ARG HD3 H 1 3.363 0.000 . . . . . . A 73 ARG HD3 . 34423 1 639 . 1 1 73 73 ARG C C 13 177.630 0.000 . . . . . . A 73 ARG C . 34423 1 640 . 1 1 73 73 ARG CA C 13 59.110 0.000 . . . . . . A 73 ARG CA . 34423 1 641 . 1 1 73 73 ARG CB C 13 30.510 0.000 . . . . . . A 73 ARG CB . 34423 1 642 . 1 1 73 73 ARG N N 15 121.530 0.000 . . . . . . A 73 ARG N . 34423 1 643 . 1 1 74 74 GLN H H 1 7.635 0.000 . . . . . . A 74 GLN H . 34423 1 644 . 1 1 74 74 GLN HA H 1 4.144 0.000 . . . . . . A 74 GLN HA . 34423 1 645 . 1 1 74 74 GLN HB2 H 1 2.165 0.000 . . . . . . A 74 GLN HB2 . 34423 1 646 . 1 1 74 74 GLN HB3 H 1 2.191 0.000 . . . . . . A 74 GLN HB3 . 34423 1 647 . 1 1 74 74 GLN HG2 H 1 2.443 0.000 . . . . . . A 74 GLN HG2 . 34423 1 648 . 1 1 74 74 GLN HG3 H 1 2.585 0.000 . . . . . . A 74 GLN HG3 . 34423 1 649 . 1 1 74 74 GLN HE21 H 1 7.284 0.000 . . . . . . A 74 GLN HE21 . 34423 1 650 . 1 1 74 74 GLN HE22 H 1 6.707 0.000 . . . . . . A 74 GLN HE22 . 34423 1 651 . 1 1 74 74 GLN C C 13 176.780 0.000 . . . . . . A 74 GLN C . 34423 1 652 . 1 1 74 74 GLN CA C 13 56.150 0.000 . . . . . . A 74 GLN CA . 34423 1 653 . 1 1 74 74 GLN CB C 13 29.260 0.000 . . . . . . A 74 GLN CB . 34423 1 654 . 1 1 74 74 GLN N N 15 115.720 0.000 . . . . . . A 74 GLN N . 34423 1 655 . 1 1 74 74 GLN NE2 N 15 110.180 0.000 . . . . . . A 74 GLN NE2 . 34423 1 656 . 1 1 75 75 GLY H H 1 7.982 0.000 . . . . . . A 75 GLY H . 34423 1 657 . 1 1 75 75 GLY HA2 H 1 4.044 0.000 . . . . . . A 75 GLY HA2 . 34423 1 658 . 1 1 75 75 GLY HA3 H 1 3.689 0.000 . . . . . . A 75 GLY HA3 . 34423 1 659 . 1 1 75 75 GLY C C 13 176.320 0.000 . . . . . . A 75 GLY C . 34423 1 660 . 1 1 75 75 GLY CA C 13 46.070 0.000 . . . . . . A 75 GLY CA . 34423 1 661 . 1 1 75 75 GLY N N 15 107.660 0.000 . . . . . . A 75 GLY N . 34423 1 662 . 1 1 76 76 LEU H H 1 7.236 0.000 . . . . . . A 76 LEU H . 34423 1 663 . 1 1 76 76 LEU HA H 1 3.676 0.000 . . . . . . A 76 LEU HA . 34423 1 664 . 1 1 76 76 LEU HB2 H 1 0.216 0.000 . . . . . . A 76 LEU HB2 . 34423 1 665 . 1 1 76 76 LEU HB3 H 1 0.257 0.000 . . . . . . A 76 LEU HB3 . 34423 1 666 . 1 1 76 76 LEU HG H 1 1.183 0.000 . . . . . . A 76 LEU HG . 34423 1 667 . 1 1 76 76 LEU HD11 H 1 0.825 0.000 . . . . . . A 76 LEU HD11 . 34423 1 668 . 1 1 76 76 LEU HD12 H 1 0.825 0.000 . . . . . . A 76 LEU HD12 . 34423 1 669 . 1 1 76 76 LEU HD13 H 1 0.825 0.000 . . . . . . A 76 LEU HD13 . 34423 1 670 . 1 1 76 76 LEU HD21 H 1 0.644 0.000 . . . . . . A 76 LEU HD21 . 34423 1 671 . 1 1 76 76 LEU HD22 H 1 0.644 0.000 . . . . . . A 76 LEU HD22 . 34423 1 672 . 1 1 76 76 LEU HD23 H 1 0.644 0.000 . . . . . . A 76 LEU HD23 . 34423 1 673 . 1 1 76 76 LEU C C 13 177.610 0.000 . . . . . . A 76 LEU C . 34423 1 674 . 1 1 76 76 LEU CA C 13 57.230 0.000 . . . . . . A 76 LEU CA . 34423 1 675 . 1 1 76 76 LEU CB C 13 41.990 0.000 . . . . . . A 76 LEU CB . 34423 1 676 . 1 1 76 76 LEU N N 15 119.230 0.000 . . . . . . A 76 LEU N . 34423 1 677 . 1 1 77 77 PHE H H 1 8.200 0.000 . . . . . . A 77 PHE H . 34423 1 678 . 1 1 77 77 PHE HA H 1 4.655 0.000 . . . . . . A 77 PHE HA . 34423 1 679 . 1 1 77 77 PHE HB2 H 1 2.820 0.000 . . . . . . A 77 PHE HB2 . 34423 1 680 . 1 1 77 77 PHE HB3 H 1 3.219 0.000 . . . . . . A 77 PHE HB3 . 34423 1 681 . 1 1 77 77 PHE HD1 H 1 6.860 0.000 . . . . . . A 77 PHE HD1 . 34423 1 682 . 1 1 77 77 PHE HD2 H 1 6.860 0.000 . . . . . . A 77 PHE HD2 . 34423 1 683 . 1 1 77 77 PHE HE1 H 1 6.480 0.000 . . . . . . A 77 PHE HE1 . 34423 1 684 . 1 1 77 77 PHE HE2 H 1 6.480 0.000 . . . . . . A 77 PHE HE2 . 34423 1 685 . 1 1 77 77 PHE HZ H 1 6.560 0.000 . . . . . . A 77 PHE HZ . 34423 1 686 . 1 1 77 77 PHE C C 13 175.980 0.000 . . . . . . A 77 PHE C . 34423 1 687 . 1 1 77 77 PHE CA C 13 56.840 0.000 . . . . . . A 77 PHE CA . 34423 1 688 . 1 1 77 77 PHE CB C 13 39.040 0.000 . . . . . . A 77 PHE CB . 34423 1 689 . 1 1 77 77 PHE N N 15 113.080 0.000 . . . . . . A 77 PHE N . 34423 1 690 . 1 1 78 78 LYS H H 1 6.896 0.000 . . . . . . A 78 LYS H . 34423 1 691 . 1 1 78 78 LYS HA H 1 3.939 0.000 . . . . . . A 78 LYS HA . 34423 1 692 . 1 1 78 78 LYS HB2 H 1 1.710 0.000 . . . . . . A 78 LYS HB2 . 34423 1 693 . 1 1 78 78 LYS HB3 H 1 1.785 0.000 . . . . . . A 78 LYS HB3 . 34423 1 694 . 1 1 78 78 LYS HG2 H 1 1.433 0.000 . . . . . . A 78 LYS HG2 . 34423 1 695 . 1 1 78 78 LYS HG3 H 1 1.480 0.000 . . . . . . A 78 LYS HG3 . 34423 1 696 . 1 1 78 78 LYS HD2 H 1 1.630 0.000 . . . . . . A 78 LYS HD2 . 34423 1 697 . 1 1 78 78 LYS HD3 H 1 1.630 0.000 . . . . . . A 78 LYS HD3 . 34423 1 698 . 1 1 78 78 LYS C C 13 179.510 0.000 . . . . . . A 78 LYS C . 34423 1 699 . 1 1 78 78 LYS CA C 13 59.740 0.000 . . . . . . A 78 LYS CA . 34423 1 700 . 1 1 78 78 LYS CB C 13 33.210 0.000 . . . . . . A 78 LYS CB . 34423 1 701 . 1 1 78 78 LYS N N 15 117.230 0.000 . . . . . . A 78 LYS N . 34423 1 702 . 1 1 79 79 LYS H H 1 8.299 0.000 . . . . . . A 79 LYS H . 34423 1 703 . 1 1 79 79 LYS HA H 1 4.293 0.000 . . . . . . A 79 LYS HA . 34423 1 704 . 1 1 79 79 LYS HB2 H 1 1.982 0.000 . . . . . . A 79 LYS HB2 . 34423 1 705 . 1 1 79 79 LYS HB3 H 1 2.058 0.000 . . . . . . A 79 LYS HB3 . 34423 1 706 . 1 1 79 79 LYS HG2 H 1 1.505 0.000 . . . . . . A 79 LYS HG2 . 34423 1 707 . 1 1 79 79 LYS HG3 H 1 1.585 0.000 . . . . . . A 79 LYS HG3 . 34423 1 708 . 1 1 79 79 LYS HD2 H 1 1.630 0.000 . . . . . . A 79 LYS HD2 . 34423 1 709 . 1 1 79 79 LYS HD3 H 1 1.630 0.000 . . . . . . A 79 LYS HD3 . 34423 1 710 . 1 1 79 79 LYS C C 13 177.440 0.000 . . . . . . A 79 LYS C . 34423 1 711 . 1 1 79 79 LYS CA C 13 58.030 0.000 . . . . . . A 79 LYS CA . 34423 1 712 . 1 1 79 79 LYS CB C 13 31.640 0.000 . . . . . . A 79 LYS CB . 34423 1 713 . 1 1 79 79 LYS N N 15 116.650 0.000 . . . . . . A 79 LYS N . 34423 1 714 . 1 1 80 80 LEU H H 1 7.458 0.000 . . . . . . A 80 LEU H . 34423 1 715 . 1 1 80 80 LEU HA H 1 4.094 0.000 . . . . . . A 80 LEU HA . 34423 1 716 . 1 1 80 80 LEU HB2 H 1 1.440 0.000 . . . . . . A 80 LEU HB2 . 34423 1 717 . 1 1 80 80 LEU HB3 H 1 1.909 0.000 . . . . . . A 80 LEU HB3 . 34423 1 718 . 1 1 80 80 LEU HG H 1 1.571 0.000 . . . . . . A 80 LEU HG . 34423 1 719 . 1 1 80 80 LEU HD11 H 1 1.140 0.000 . . . . . . A 80 LEU HD11 . 34423 1 720 . 1 1 80 80 LEU HD12 H 1 1.140 0.000 . . . . . . A 80 LEU HD12 . 34423 1 721 . 1 1 80 80 LEU HD13 H 1 1.140 0.000 . . . . . . A 80 LEU HD13 . 34423 1 722 . 1 1 80 80 LEU HD21 H 1 0.890 0.000 . . . . . . A 80 LEU HD21 . 34423 1 723 . 1 1 80 80 LEU HD22 H 1 0.890 0.000 . . . . . . A 80 LEU HD22 . 34423 1 724 . 1 1 80 80 LEU HD23 H 1 0.890 0.000 . . . . . . A 80 LEU HD23 . 34423 1 725 . 1 1 80 80 LEU C C 13 175.190 0.000 . . . . . . A 80 LEU C . 34423 1 726 . 1 1 80 80 LEU CA C 13 55.730 0.000 . . . . . . A 80 LEU CA . 34423 1 727 . 1 1 80 80 LEU CB C 13 42.620 0.000 . . . . . . A 80 LEU CB . 34423 1 728 . 1 1 80 80 LEU N N 15 117.620 0.000 . . . . . . A 80 LEU N . 34423 1 729 . 1 1 81 81 LYS H H 1 7.260 0.000 . . . . . . A 81 LYS H . 34423 1 730 . 1 1 81 81 LYS HA H 1 3.885 0.000 . . . . . . A 81 LYS HA . 34423 1 731 . 1 1 81 81 LYS HB2 H 1 1.771 0.000 . . . . . . A 81 LYS HB2 . 34423 1 732 . 1 1 81 81 LYS HB3 H 1 1.854 0.000 . . . . . . A 81 LYS HB3 . 34423 1 733 . 1 1 81 81 LYS HG2 H 1 1.414 0.000 . . . . . . A 81 LYS HG2 . 34423 1 734 . 1 1 81 81 LYS HG3 H 1 1.471 0.000 . . . . . . A 81 LYS HG3 . 34423 1 735 . 1 1 81 81 LYS C C 13 176.760 0.000 . . . . . . A 81 LYS C . 34423 1 736 . 1 1 81 81 LYS CA C 13 58.120 0.000 . . . . . . A 81 LYS CA . 34423 1 737 . 1 1 81 81 LYS CB C 13 32.650 0.000 . . . . . . A 81 LYS CB . 34423 1 738 . 1 1 81 81 LYS N N 15 120.840 0.000 . . . . . . A 81 LYS N . 34423 1 739 . 1 1 82 82 ASP HA H 1 4.530 0.000 . . . . . . A 82 ASP HA . 34423 1 740 . 1 1 82 82 ASP HB2 H 1 2.836 0.000 . . . . . . A 82 ASP HB2 . 34423 1 741 . 1 1 82 82 ASP HB3 H 1 2.975 0.000 . . . . . . A 82 ASP HB3 . 34423 1 742 . 1 1 82 82 ASP C C 13 175.050 0.000 . . . . . . A 82 ASP C . 34423 1 743 . 1 1 82 82 ASP CA C 13 55.580 0.000 . . . . . . A 82 ASP CA . 34423 1 744 . 1 1 82 82 ASP CB C 13 39.610 0.000 . . . . . . A 82 ASP CB . 34423 1 745 . 1 1 83 83 ALA H H 1 7.720 0.000 . . . . . . A 83 ALA H . 34423 1 746 . 1 1 83 83 ALA HA H 1 4.406 0.000 . . . . . . A 83 ALA HA . 34423 1 747 . 1 1 83 83 ALA HB1 H 1 1.577 0.000 . . . . . . A 83 ALA HB1 . 34423 1 748 . 1 1 83 83 ALA HB2 H 1 1.577 0.000 . . . . . . A 83 ALA HB2 . 34423 1 749 . 1 1 83 83 ALA HB3 H 1 1.577 0.000 . . . . . . A 83 ALA HB3 . 34423 1 750 . 1 1 83 83 ALA C C 13 177.600 0.000 . . . . . . A 83 ALA C . 34423 1 751 . 1 1 83 83 ALA CA C 13 52.650 0.000 . . . . . . A 83 ALA CA . 34423 1 752 . 1 1 83 83 ALA CB C 13 21.170 0.000 . . . . . . A 83 ALA CB . 34423 1 753 . 1 1 83 83 ALA N N 15 121.230 0.000 . . . . . . A 83 ALA N . 34423 1 754 . 1 1 84 84 GLU H H 1 8.329 0.000 . . . . . . A 84 GLU H . 34423 1 755 . 1 1 84 84 GLU HA H 1 4.495 0.000 . . . . . . A 84 GLU HA . 34423 1 756 . 1 1 84 84 GLU HB2 H 1 2.096 0.000 . . . . . . A 84 GLU HB2 . 34423 1 757 . 1 1 84 84 GLU HB3 H 1 2.126 0.000 . . . . . . A 84 GLU HB3 . 34423 1 758 . 1 1 84 84 GLU HG2 H 1 2.319 0.000 . . . . . . A 84 GLU HG2 . 34423 1 759 . 1 1 84 84 GLU HG3 H 1 2.389 0.000 . . . . . . A 84 GLU HG3 . 34423 1 760 . 1 1 84 84 GLU C C 13 175.980 0.000 . . . . . . A 84 GLU C . 34423 1 761 . 1 1 84 84 GLU CA C 13 56.690 0.000 . . . . . . A 84 GLU CA . 34423 1 762 . 1 1 84 84 GLU N N 15 121.380 0.000 . . . . . . A 84 GLU N . 34423 1 763 . 1 1 85 85 PHE H H 1 8.571 0.000 . . . . . . A 85 PHE H . 34423 1 764 . 1 1 85 85 PHE HA H 1 5.180 0.000 . . . . . . A 85 PHE HA . 34423 1 765 . 1 1 85 85 PHE HB2 H 1 2.703 0.000 . . . . . . A 85 PHE HB2 . 34423 1 766 . 1 1 85 85 PHE HB3 H 1 3.057 0.000 . . . . . . A 85 PHE HB3 . 34423 1 767 . 1 1 85 85 PHE HD1 H 1 6.370 0.000 . . . . . . A 85 PHE HD1 . 34423 1 768 . 1 1 85 85 PHE HD2 H 1 6.370 0.000 . . . . . . A 85 PHE HD2 . 34423 1 769 . 1 1 85 85 PHE HE1 H 1 6.700 0.000 . . . . . . A 85 PHE HE1 . 34423 1 770 . 1 1 85 85 PHE HE2 H 1 6.700 0.000 . . . . . . A 85 PHE HE2 . 34423 1 771 . 1 1 85 85 PHE HZ H 1 6.730 0.000 . . . . . . A 85 PHE HZ . 34423 1 772 . 1 1 85 85 PHE N N 15 125.770 0.000 . . . . . . A 85 PHE N . 34423 1 773 . 1 1 88 88 ASN HB2 H 1 2.603 0.000 . . . . . . A 88 ASN HB2 . 34423 1 774 . 1 1 88 88 ASN HB3 H 1 2.659 0.000 . . . . . . A 88 ASN HB3 . 34423 1 775 . 1 1 88 88 ASN HD21 H 1 7.266 0.000 . . . . . . A 88 ASN HD21 . 34423 1 776 . 1 1 88 88 ASN HD22 H 1 6.828 0.000 . . . . . . A 88 ASN HD22 . 34423 1 777 . 1 1 88 88 ASN ND2 N 15 112.700 0.000 . . . . . . A 88 ASN ND2 . 34423 1 778 . 1 1 95 95 GLU HA H 1 4.259 0.000 . . . . . . A 95 GLU HA . 34423 1 779 . 1 1 95 95 GLU HB2 H 1 1.773 0.000 . . . . . . A 95 GLU HB2 . 34423 1 780 . 1 1 95 95 GLU HB3 H 1 1.839 0.000 . . . . . . A 95 GLU HB3 . 34423 1 781 . 1 1 95 95 GLU HG2 H 1 2.100 0.000 . . . . . . A 95 GLU HG2 . 34423 1 782 . 1 1 95 95 GLU HG3 H 1 2.217 0.000 . . . . . . A 95 GLU HG3 . 34423 1 783 . 1 1 95 95 GLU C C 13 175.650 0.000 . . . . . . A 95 GLU C . 34423 1 784 . 1 1 95 95 GLU CA C 13 56.870 0.000 . . . . . . A 95 GLU CA . 34423 1 785 . 1 1 95 95 GLU CB C 13 30.010 0.000 . . . . . . A 95 GLU CB . 34423 1 786 . 1 1 96 96 GLY H H 1 7.841 0.000 . . . . . . A 96 GLY H . 34423 1 787 . 1 1 96 96 GLY HA2 H 1 4.391 0.000 . . . . . . A 96 GLY HA2 . 34423 1 788 . 1 1 96 96 GLY HA3 H 1 3.883 0.000 . . . . . . A 96 GLY HA3 . 34423 1 789 . 1 1 96 96 GLY C C 13 172.310 0.000 . . . . . . A 96 GLY C . 34423 1 790 . 1 1 96 96 GLY CA C 13 45.390 0.000 . . . . . . A 96 GLY CA . 34423 1 791 . 1 1 96 96 GLY N N 15 108.460 0.000 . . . . . . A 96 GLY N . 34423 1 792 . 1 1 97 97 GLU H H 1 8.278 0.000 . . . . . . A 97 GLU H . 34423 1 793 . 1 1 97 97 GLU HA H 1 4.515 0.000 . . . . . . A 97 GLU HA . 34423 1 794 . 1 1 97 97 GLU HB2 H 1 1.880 0.000 . . . . . . A 97 GLU HB2 . 34423 1 795 . 1 1 97 97 GLU HB3 H 1 1.968 0.000 . . . . . . A 97 GLU HB3 . 34423 1 796 . 1 1 97 97 GLU HG2 H 1 2.143 0.000 . . . . . . A 97 GLU HG2 . 34423 1 797 . 1 1 97 97 GLU HG3 H 1 2.184 0.000 . . . . . . A 97 GLU HG3 . 34423 1 798 . 1 1 97 97 GLU C C 13 176.240 0.000 . . . . . . A 97 GLU C . 34423 1 799 . 1 1 97 97 GLU CA C 13 55.790 0.000 . . . . . . A 97 GLU CA . 34423 1 800 . 1 1 97 97 GLU CB C 13 32.960 0.000 . . . . . . A 97 GLU CB . 34423 1 801 . 1 1 97 97 GLU N N 15 121.120 0.000 . . . . . . A 97 GLU N . 34423 1 802 . 1 1 98 98 GLY C C 13 172.880 0.000 . . . . . . A 98 GLY C . 34423 1 803 . 1 1 98 98 GLY CA C 13 45.150 0.000 . . . . . . A 98 GLY CA . 34423 1 804 . 1 1 99 99 TYR H H 1 9.078 0.000 . . . . . . A 99 TYR H . 34423 1 805 . 1 1 99 99 TYR HA H 1 4.900 0.000 . . . . . . A 99 TYR HA . 34423 1 806 . 1 1 99 99 TYR HB2 H 1 2.627 0.000 . . . . . . A 99 TYR HB2 . 34423 1 807 . 1 1 99 99 TYR HB3 H 1 2.667 0.000 . . . . . . A 99 TYR HB3 . 34423 1 808 . 1 1 99 99 TYR HD1 H 1 6.940 0.000 . . . . . . A 99 TYR HD1 . 34423 1 809 . 1 1 99 99 TYR HD2 H 1 6.940 0.000 . . . . . . A 99 TYR HD2 . 34423 1 810 . 1 1 99 99 TYR HE1 H 1 6.755 0.000 . . . . . . A 99 TYR HE1 . 34423 1 811 . 1 1 99 99 TYR HE2 H 1 6.755 0.000 . . . . . . A 99 TYR HE2 . 34423 1 812 . 1 1 99 99 TYR C C 13 174.110 0.000 . . . . . . A 99 TYR C . 34423 1 813 . 1 1 99 99 TYR CA C 13 57.730 0.000 . . . . . . A 99 TYR CA . 34423 1 814 . 1 1 99 99 TYR CB C 13 43.490 0.000 . . . . . . A 99 TYR CB . 34423 1 815 . 1 1 99 99 TYR N N 15 120.160 0.000 . . . . . . A 99 TYR N . 34423 1 816 . 1 1 100 100 LYS H H 1 8.857 0.000 . . . . . . A 100 LYS H . 34423 1 817 . 1 1 100 100 LYS HA H 1 4.695 0.000 . . . . . . A 100 LYS HA . 34423 1 818 . 1 1 100 100 LYS HB2 H 1 1.527 0.000 . . . . . . A 100 LYS HB2 . 34423 1 819 . 1 1 100 100 LYS HB3 H 1 1.559 0.000 . . . . . . A 100 LYS HB3 . 34423 1 820 . 1 1 100 100 LYS HG2 H 1 1.337 0.000 . . . . . . A 100 LYS HG2 . 34423 1 821 . 1 1 100 100 LYS HG3 H 1 1.369 0.000 . . . . . . A 100 LYS HG3 . 34423 1 822 . 1 1 100 100 LYS HD2 H 1 1.450 0.000 . . . . . . A 100 LYS HD2 . 34423 1 823 . 1 1 100 100 LYS HD3 H 1 1.450 0.000 . . . . . . A 100 LYS HD3 . 34423 1 824 . 1 1 100 100 LYS C C 13 173.850 0.000 . . . . . . A 100 LYS C . 34423 1 825 . 1 1 100 100 LYS CA C 13 55.160 0.000 . . . . . . A 100 LYS CA . 34423 1 826 . 1 1 100 100 LYS CB C 13 35.280 0.000 . . . . . . A 100 LYS CB . 34423 1 827 . 1 1 100 100 LYS N N 15 122.890 0.000 . . . . . . A 100 LYS N . 34423 1 828 . 1 1 101 101 LEU H H 1 9.281 0.000 . . . . . . A 101 LEU H . 34423 1 829 . 1 1 101 101 LEU HA H 1 4.670 0.000 . . . . . . A 101 LEU HA . 34423 1 830 . 1 1 101 101 LEU HB2 H 1 1.153 0.000 . . . . . . A 101 LEU HB2 . 34423 1 831 . 1 1 101 101 LEU HB3 H 1 1.515 0.000 . . . . . . A 101 LEU HB3 . 34423 1 832 . 1 1 101 101 LEU HG H 1 0.958 0.000 . . . . . . A 101 LEU HG . 34423 1 833 . 1 1 101 101 LEU HD11 H 1 0.697 0.000 . . . . . . A 101 LEU HD11 . 34423 1 834 . 1 1 101 101 LEU HD12 H 1 0.697 0.000 . . . . . . A 101 LEU HD12 . 34423 1 835 . 1 1 101 101 LEU HD13 H 1 0.697 0.000 . . . . . . A 101 LEU HD13 . 34423 1 836 . 1 1 101 101 LEU HD21 H 1 0.558 0.000 . . . . . . A 101 LEU HD21 . 34423 1 837 . 1 1 101 101 LEU HD22 H 1 0.558 0.000 . . . . . . A 101 LEU HD22 . 34423 1 838 . 1 1 101 101 LEU HD23 H 1 0.558 0.000 . . . . . . A 101 LEU HD23 . 34423 1 839 . 1 1 101 101 LEU N N 15 132.810 0.000 . . . . . . A 101 LEU N . 34423 1 840 . 1 1 102 102 VAL HA H 1 5.170 0.000 . . . . . . A 102 VAL HA . 34423 1 841 . 1 1 102 102 VAL HB H 1 1.584 0.000 . . . . . . A 102 VAL HB . 34423 1 842 . 1 1 102 102 VAL HG11 H 1 0.864 0.000 . . . . . . A 102 VAL HG11 . 34423 1 843 . 1 1 102 102 VAL HG12 H 1 0.864 0.000 . . . . . . A 102 VAL HG12 . 34423 1 844 . 1 1 102 102 VAL HG13 H 1 0.864 0.000 . . . . . . A 102 VAL HG13 . 34423 1 845 . 1 1 102 102 VAL HG21 H 1 0.728 0.000 . . . . . . A 102 VAL HG21 . 34423 1 846 . 1 1 102 102 VAL HG22 H 1 0.728 0.000 . . . . . . A 102 VAL HG22 . 34423 1 847 . 1 1 102 102 VAL HG23 H 1 0.728 0.000 . . . . . . A 102 VAL HG23 . 34423 1 848 . 1 1 102 102 VAL C C 13 174.400 0.000 . . . . . . A 102 VAL C . 34423 1 849 . 1 1 103 103 TRP H H 1 9.630 0.000 . . . . . . A 103 TRP H . 34423 1 850 . 1 1 103 103 TRP HA H 1 5.730 0.000 . . . . . . A 103 TRP HA . 34423 1 851 . 1 1 103 103 TRP HB2 H 1 3.020 0.000 . . . . . . A 103 TRP HB2 . 34423 1 852 . 1 1 103 103 TRP HB3 H 1 3.164 0.000 . . . . . . A 103 TRP HB3 . 34423 1 853 . 1 1 103 103 TRP HD1 H 1 7.122 0.000 . . . . . . A 103 TRP HD1 . 34423 1 854 . 1 1 103 103 TRP HE1 H 1 9.341 0.000 . . . . . . A 103 TRP HE1 . 34423 1 855 . 1 1 103 103 TRP HE3 H 1 7.660 0.000 . . . . . . A 103 TRP HE3 . 34423 1 856 . 1 1 103 103 TRP HZ2 H 1 6.650 0.000 . . . . . . A 103 TRP HZ2 . 34423 1 857 . 1 1 103 103 TRP HZ3 H 1 6.820 0.000 . . . . . . A 103 TRP HZ3 . 34423 1 858 . 1 1 103 103 TRP HH2 H 1 6.770 0.000 . . . . . . A 103 TRP HH2 . 34423 1 859 . 1 1 103 103 TRP C C 13 175.410 0.000 . . . . . . A 103 TRP C . 34423 1 860 . 1 1 103 103 TRP CA C 13 57.880 0.000 . . . . . . A 103 TRP CA . 34423 1 861 . 1 1 103 103 TRP N N 15 127.630 0.000 . . . . . . A 103 TRP N . 34423 1 862 . 1 1 103 103 TRP NE1 N 15 129.440 0.000 . . . . . . A 103 TRP NE1 . 34423 1 863 . 1 1 104 104 LYS H H 1 8.608 0.000 . . . . . . A 104 LYS H . 34423 1 864 . 1 1 104 104 LYS HA H 1 5.556 0.000 . . . . . . A 104 LYS HA . 34423 1 865 . 1 1 104 104 LYS HB2 H 1 1.658 0.000 . . . . . . A 104 LYS HB2 . 34423 1 866 . 1 1 104 104 LYS HB3 H 1 1.785 0.000 . . . . . . A 104 LYS HB3 . 34423 1 867 . 1 1 104 104 LYS HG2 H 1 1.323 0.000 . . . . . . A 104 LYS HG2 . 34423 1 868 . 1 1 104 104 LYS HG3 H 1 1.480 0.000 . . . . . . A 104 LYS HG3 . 34423 1 869 . 1 1 104 104 LYS HD2 H 1 1.576 0.000 . . . . . . A 104 LYS HD2 . 34423 1 870 . 1 1 104 104 LYS HD3 H 1 1.576 0.000 . . . . . . A 104 LYS HD3 . 34423 1 871 . 1 1 104 104 LYS C C 13 176.390 0.000 . . . . . . A 104 LYS C . 34423 1 872 . 1 1 104 104 LYS CA C 13 54.830 0.000 . . . . . . A 104 LYS CA . 34423 1 873 . 1 1 104 104 LYS CB C 13 36.780 0.000 . . . . . . A 104 LYS CB . 34423 1 874 . 1 1 104 104 LYS N N 15 119.570 0.000 . . . . . . A 104 LYS N . 34423 1 875 . 1 1 105 105 SER H H 1 9.599 0.000 . . . . . . A 105 SER H . 34423 1 876 . 1 1 105 105 SER HA H 1 4.714 0.000 . . . . . . A 105 SER HA . 34423 1 877 . 1 1 105 105 SER HB2 H 1 3.854 0.000 . . . . . . A 105 SER HB2 . 34423 1 878 . 1 1 105 105 SER HB3 H 1 4.481 0.000 . . . . . . A 105 SER HB3 . 34423 1 879 . 1 1 105 105 SER C C 13 172.510 0.000 . . . . . . A 105 SER C . 34423 1 880 . 1 1 105 105 SER CA C 13 58.360 0.000 . . . . . . A 105 SER CA . 34423 1 881 . 1 1 105 105 SER CB C 13 65.500 0.000 . . . . . . A 105 SER CB . 34423 1 882 . 1 1 105 105 SER N N 15 122.020 0.000 . . . . . . A 105 SER N . 34423 1 883 . 1 1 106 106 ALA H H 1 8.533 0.000 . . . . . . A 106 ALA H . 34423 1 884 . 1 1 106 106 ALA HA H 1 4.241 0.000 . . . . . . A 106 ALA HA . 34423 1 885 . 1 1 106 106 ALA HB1 H 1 1.435 0.000 . . . . . . A 106 ALA HB1 . 34423 1 886 . 1 1 106 106 ALA HB2 H 1 1.435 0.000 . . . . . . A 106 ALA HB2 . 34423 1 887 . 1 1 106 106 ALA HB3 H 1 1.435 0.000 . . . . . . A 106 ALA HB3 . 34423 1 888 . 1 1 106 106 ALA C C 13 178.270 0.000 . . . . . . A 106 ALA C . 34423 1 889 . 1 1 106 106 ALA CA C 13 52.830 0.000 . . . . . . A 106 ALA CA . 34423 1 890 . 1 1 106 106 ALA CB C 13 18.850 0.000 . . . . . . A 106 ALA CB . 34423 1 891 . 1 1 106 106 ALA N N 15 122.030 0.000 . . . . . . A 106 ALA N . 34423 1 892 . 1 1 107 107 ALA H H 1 8.486 0.000 . . . . . . A 107 ALA H . 34423 1 893 . 1 1 107 107 ALA HA H 1 4.691 0.000 . . . . . . A 107 ALA HA . 34423 1 894 . 1 1 107 107 ALA HB1 H 1 1.321 0.000 . . . . . . A 107 ALA HB1 . 34423 1 895 . 1 1 107 107 ALA HB2 H 1 1.321 0.000 . . . . . . A 107 ALA HB2 . 34423 1 896 . 1 1 107 107 ALA HB3 H 1 1.321 0.000 . . . . . . A 107 ALA HB3 . 34423 1 897 . 1 1 107 107 ALA C C 13 177.800 0.000 . . . . . . A 107 ALA C . 34423 1 898 . 1 1 107 107 ALA CA C 13 52.440 0.000 . . . . . . A 107 ALA CA . 34423 1 899 . 1 1 107 107 ALA CB C 13 19.730 0.000 . . . . . . A 107 ALA CB . 34423 1 900 . 1 1 107 107 ALA N N 15 126.360 0.000 . . . . . . A 107 ALA N . 34423 1 901 . 1 1 108 108 GLN H H 1 8.891 0.000 . . . . . . A 108 GLN H . 34423 1 902 . 1 1 108 108 GLN HA H 1 4.729 0.000 . . . . . . A 108 GLN HA . 34423 1 903 . 1 1 108 108 GLN HB2 H 1 1.980 0.000 . . . . . . A 108 GLN HB2 . 34423 1 904 . 1 1 108 108 GLN HB3 H 1 2.128 0.000 . . . . . . A 108 GLN HB3 . 34423 1 905 . 1 1 108 108 GLN HG2 H 1 2.418 0.000 . . . . . . A 108 GLN HG2 . 34423 1 906 . 1 1 108 108 GLN HG3 H 1 2.451 0.000 . . . . . . A 108 GLN HG3 . 34423 1 907 . 1 1 108 108 GLN HE21 H 1 7.457 0.000 . . . . . . A 108 GLN HE21 . 34423 1 908 . 1 1 108 108 GLN HE22 H 1 6.943 0.000 . . . . . . A 108 GLN HE22 . 34423 1 909 . 1 1 108 108 GLN C C 13 175.540 0.000 . . . . . . A 108 GLN C . 34423 1 910 . 1 1 108 108 GLN CA C 13 54.510 0.000 . . . . . . A 108 GLN CA . 34423 1 911 . 1 1 108 108 GLN CB C 13 32.140 0.000 . . . . . . A 108 GLN CB . 34423 1 912 . 1 1 108 108 GLN N N 15 120.890 0.000 . . . . . . A 108 GLN N . 34423 1 913 . 1 1 108 108 GLN NE2 N 15 112.380 0.000 . . . . . . A 108 GLN NE2 . 34423 1 914 . 1 1 109 109 ARG HA H 1 4.600 0.000 . . . . . . A 109 ARG HA . 34423 1 915 . 1 1 109 109 ARG HB2 H 1 1.690 0.000 . . . . . . A 109 ARG HB2 . 34423 1 916 . 1 1 109 109 ARG HB3 H 1 1.801 0.000 . . . . . . A 109 ARG HB3 . 34423 1 917 . 1 1 109 109 ARG HG2 H 1 1.472 0.000 . . . . . . A 109 ARG HG2 . 34423 1 918 . 1 1 109 109 ARG HG3 H 1 1.501 0.000 . . . . . . A 109 ARG HG3 . 34423 1 919 . 1 1 109 109 ARG HD2 H 1 2.927 0.000 . . . . . . A 109 ARG HD2 . 34423 1 920 . 1 1 109 109 ARG HD3 H 1 2.949 0.000 . . . . . . A 109 ARG HD3 . 34423 1 921 . 1 1 109 109 ARG C C 13 176.290 0.000 . . . . . . A 109 ARG C . 34423 1 922 . 1 1 109 109 ARG CA C 13 56.570 0.000 . . . . . . A 109 ARG CA . 34423 1 923 . 1 1 109 109 ARG CB C 13 31.200 0.000 . . . . . . A 109 ARG CB . 34423 1 924 . 1 1 110 110 SER H H 1 8.656 0.000 . . . . . . A 110 SER H . 34423 1 925 . 1 1 110 110 SER HA H 1 4.760 0.000 . . . . . . A 110 SER HA . 34423 1 926 . 1 1 110 110 SER HB2 H 1 3.860 0.000 . . . . . . A 110 SER HB2 . 34423 1 927 . 1 1 110 110 SER HB3 H 1 3.977 0.000 . . . . . . A 110 SER HB3 . 34423 1 928 . 1 1 110 110 SER C C 13 175.450 0.000 . . . . . . A 110 SER C . 34423 1 929 . 1 1 110 110 SER CA C 13 57.200 0.000 . . . . . . A 110 SER CA . 34423 1 930 . 1 1 110 110 SER CB C 13 64.870 0.000 . . . . . . A 110 SER CB . 34423 1 931 . 1 1 110 110 SER N N 15 120.210 0.000 . . . . . . A 110 SER N . 34423 1 932 . 1 1 111 111 HIS CA C 13 58.390 0.000 . . . . . . A 111 HIS CA . 34423 1 933 . 1 1 111 111 HIS CB C 13 30.580 0.000 . . . . . . A 111 HIS CB . 34423 1 934 . 1 1 112 112 ASP H H 1 8.006 0.000 . . . . . . A 112 ASP H . 34423 1 935 . 1 1 112 112 ASP HA H 1 4.520 0.000 . . . . . . A 112 ASP HA . 34423 1 936 . 1 1 112 112 ASP HB2 H 1 2.402 0.000 . . . . . . A 112 ASP HB2 . 34423 1 937 . 1 1 112 112 ASP HB3 H 1 2.874 0.000 . . . . . . A 112 ASP HB3 . 34423 1 938 . 1 1 112 112 ASP C C 13 175.530 0.000 . . . . . . A 112 ASP C . 34423 1 939 . 1 1 112 112 ASP CA C 13 53.310 0.000 . . . . . . A 112 ASP CA . 34423 1 940 . 1 1 112 112 ASP CB C 13 39.540 0.000 . . . . . . A 112 ASP CB . 34423 1 941 . 1 1 112 112 ASP N N 15 118.450 0.000 . . . . . . A 112 ASP N . 34423 1 942 . 1 1 113 113 GLN H H 1 8.122 0.000 . . . . . . A 113 GLN H . 34423 1 943 . 1 1 113 113 GLN HA H 1 3.870 0.000 . . . . . . A 113 GLN HA . 34423 1 944 . 1 1 113 113 GLN HB2 H 1 2.300 0.000 . . . . . . A 113 GLN HB2 . 34423 1 945 . 1 1 113 113 GLN HB3 H 1 2.360 0.000 . . . . . . A 113 GLN HB3 . 34423 1 946 . 1 1 113 113 GLN HG2 H 1 2.290 0.000 . . . . . . A 113 GLN HG2 . 34423 1 947 . 1 1 113 113 GLN HG3 H 1 2.350 0.000 . . . . . . A 113 GLN HG3 . 34423 1 948 . 1 1 113 113 GLN HE21 H 1 7.472 0.000 . . . . . . A 113 GLN HE21 . 34423 1 949 . 1 1 113 113 GLN HE22 H 1 6.820 0.000 . . . . . . A 113 GLN HE22 . 34423 1 950 . 1 1 113 113 GLN C C 13 175.270 0.000 . . . . . . A 113 GLN C . 34423 1 951 . 1 1 113 113 GLN CA C 13 57.200 0.000 . . . . . . A 113 GLN CA . 34423 1 952 . 1 1 113 113 GLN CB C 13 26.690 0.000 . . . . . . A 113 GLN CB . 34423 1 953 . 1 1 113 113 GLN N N 15 112.060 0.000 . . . . . . A 113 GLN N . 34423 1 954 . 1 1 113 113 GLN NE2 N 15 112.670 0.000 . . . . . . A 113 GLN NE2 . 34423 1 955 . 1 1 114 114 LYS H H 1 7.529 0.000 . . . . . . A 114 LYS H . 34423 1 956 . 1 1 114 114 LYS HB2 H 1 1.686 0.000 . . . . . . A 114 LYS HB2 . 34423 1 957 . 1 1 114 114 LYS HB3 H 1 1.714 0.000 . . . . . . A 114 LYS HB3 . 34423 1 958 . 1 1 114 114 LYS HG2 H 1 1.219 0.000 . . . . . . A 114 LYS HG2 . 34423 1 959 . 1 1 114 114 LYS HG3 H 1 1.328 0.000 . . . . . . A 114 LYS HG3 . 34423 1 960 . 1 1 114 114 LYS HD2 H 1 1.504 0.000 . . . . . . A 114 LYS HD2 . 34423 1 961 . 1 1 114 114 LYS HD3 H 1 1.504 0.000 . . . . . . A 114 LYS HD3 . 34423 1 962 . 1 1 114 114 LYS C C 13 176.180 0.000 . . . . . . A 114 LYS C . 34423 1 963 . 1 1 114 114 LYS CA C 13 55.520 0.000 . . . . . . A 114 LYS CA . 34423 1 964 . 1 1 114 114 LYS CB C 13 34.720 0.000 . . . . . . A 114 LYS CB . 34423 1 965 . 1 1 114 114 LYS N N 15 118.550 0.000 . . . . . . A 114 LYS N . 34423 1 966 . 1 1 115 115 ILE H H 1 8.795 0.000 . . . . . . A 115 ILE H . 34423 1 967 . 1 1 115 115 ILE HA H 1 4.750 0.000 . . . . . . A 115 ILE HA . 34423 1 968 . 1 1 115 115 ILE HB H 1 1.806 0.000 . . . . . . A 115 ILE HB . 34423 1 969 . 1 1 115 115 ILE HG12 H 1 1.528 0.000 . . . . . . A 115 ILE HG12 . 34423 1 970 . 1 1 115 115 ILE HG13 H 1 1.321 0.000 . . . . . . A 115 ILE HG13 . 34423 1 971 . 1 1 115 115 ILE HG21 H 1 0.918 0.000 . . . . . . A 115 ILE HG21 . 34423 1 972 . 1 1 115 115 ILE HG22 H 1 0.918 0.000 . . . . . . A 115 ILE HG22 . 34423 1 973 . 1 1 115 115 ILE HG23 H 1 0.918 0.000 . . . . . . A 115 ILE HG23 . 34423 1 974 . 1 1 115 115 ILE HD11 H 1 0.812 0.000 . . . . . . A 115 ILE HD11 . 34423 1 975 . 1 1 115 115 ILE HD12 H 1 0.812 0.000 . . . . . . A 115 ILE HD12 . 34423 1 976 . 1 1 115 115 ILE HD13 H 1 0.812 0.000 . . . . . . A 115 ILE HD13 . 34423 1 977 . 1 1 115 115 ILE CA C 13 60.460 0.000 . . . . . . A 115 ILE CA . 34423 1 978 . 1 1 115 115 ILE N N 15 119.830 0.000 . . . . . . A 115 ILE N . 34423 1 979 . 1 1 116 116 ARG H H 1 8.466 0.000 . . . . . . A 116 ARG H . 34423 1 980 . 1 1 116 116 ARG N N 15 121.850 0.000 . . . . . . A 116 ARG N . 34423 1 981 . 1 1 117 117 TRP H H 1 8.539 0.000 . . . . . . A 117 TRP H . 34423 1 982 . 1 1 117 117 TRP HA H 1 4.800 0.000 . . . . . . A 117 TRP HA . 34423 1 983 . 1 1 117 117 TRP HB2 H 1 3.136 0.000 . . . . . . A 117 TRP HB2 . 34423 1 984 . 1 1 117 117 TRP HB3 H 1 3.390 0.000 . . . . . . A 117 TRP HB3 . 34423 1 985 . 1 1 117 117 TRP HD1 H 1 7.245 0.000 . . . . . . A 117 TRP HD1 . 34423 1 986 . 1 1 117 117 TRP HE1 H 1 10.060 0.000 . . . . . . A 117 TRP HE1 . 34423 1 987 . 1 1 117 117 TRP HE3 H 1 7.350 0.000 . . . . . . A 117 TRP HE3 . 34423 1 988 . 1 1 117 117 TRP HZ2 H 1 6.910 0.000 . . . . . . A 117 TRP HZ2 . 34423 1 989 . 1 1 117 117 TRP HZ3 H 1 7.010 0.000 . . . . . . A 117 TRP HZ3 . 34423 1 990 . 1 1 117 117 TRP HH2 H 1 7.150 0.000 . . . . . . A 117 TRP HH2 . 34423 1 991 . 1 1 117 117 TRP C C 13 176.640 0.000 . . . . . . A 117 TRP C . 34423 1 992 . 1 1 117 117 TRP CA C 13 56.330 0.000 . . . . . . A 117 TRP CA . 34423 1 993 . 1 1 117 117 TRP N N 15 122.130 0.000 . . . . . . A 117 TRP N . 34423 1 994 . 1 1 117 117 TRP NE1 N 15 128.680 0.000 . . . . . . A 117 TRP NE1 . 34423 1 995 . 1 1 118 118 ASP H H 1 8.775 0.000 . . . . . . A 118 ASP H . 34423 1 996 . 1 1 118 118 ASP HA H 1 5.592 0.000 . . . . . . A 118 ASP HA . 34423 1 997 . 1 1 118 118 ASP HB2 H 1 2.507 0.000 . . . . . . A 118 ASP HB2 . 34423 1 998 . 1 1 118 118 ASP HB3 H 1 2.935 0.000 . . . . . . A 118 ASP HB3 . 34423 1 999 . 1 1 118 118 ASP C C 13 175.560 0.000 . . . . . . A 118 ASP C . 34423 1 1000 . 1 1 118 118 ASP CA C 13 53.070 0.000 . . . . . . A 118 ASP CA . 34423 1 1001 . 1 1 118 118 ASP CB C 13 44.560 0.000 . . . . . . A 118 ASP CB . 34423 1 1002 . 1 1 118 118 ASP N N 15 119.130 0.000 . . . . . . A 118 ASP N . 34423 1 1003 . 1 1 119 119 GLU H H 1 9.316 0.000 . . . . . . A 119 GLU H . 34423 1 1004 . 1 1 119 119 GLU HA H 1 5.830 0.000 . . . . . . A 119 GLU HA . 34423 1 1005 . 1 1 119 119 GLU HB2 H 1 2.150 0.000 . . . . . . A 119 GLU HB2 . 34423 1 1006 . 1 1 119 119 GLU HB3 H 1 2.227 0.000 . . . . . . A 119 GLU HB3 . 34423 1 1007 . 1 1 119 119 GLU HG2 H 1 2.431 0.000 . . . . . . A 119 GLU HG2 . 34423 1 1008 . 1 1 119 119 GLU HG3 H 1 2.508 0.000 . . . . . . A 119 GLU HG3 . 34423 1 1009 . 1 1 119 119 GLU C C 13 174.620 0.000 . . . . . . A 119 GLU C . 34423 1 1010 . 1 1 119 119 GLU CA C 13 54.980 0.000 . . . . . . A 119 GLU CA . 34423 1 1011 . 1 1 119 119 GLU CB C 13 35.530 0.000 . . . . . . A 119 GLU CB . 34423 1 1012 . 1 1 119 119 GLU N N 15 120.700 0.000 . . . . . . A 119 GLU N . 34423 1 1013 . 1 1 120 120 ALA H H 1 9.313 0.000 . . . . . . A 120 ALA H . 34423 1 1014 . 1 1 120 120 ALA HA H 1 5.313 0.000 . . . . . . A 120 ALA HA . 34423 1 1015 . 1 1 120 120 ALA HB1 H 1 1.301 0.000 . . . . . . A 120 ALA HB1 . 34423 1 1016 . 1 1 120 120 ALA HB2 H 1 1.301 0.000 . . . . . . A 120 ALA HB2 . 34423 1 1017 . 1 1 120 120 ALA HB3 H 1 1.301 0.000 . . . . . . A 120 ALA HB3 . 34423 1 1018 . 1 1 120 120 ALA C C 13 175.040 0.000 . . . . . . A 120 ALA C . 34423 1 1019 . 1 1 120 120 ALA CA C 13 50.440 0.000 . . . . . . A 120 ALA CA . 34423 1 1020 . 1 1 120 120 ALA CB C 13 23.740 0.000 . . . . . . A 120 ALA CB . 34423 1 1021 . 1 1 120 120 ALA N N 15 123.920 0.000 . . . . . . A 120 ALA N . 34423 1 1022 . 1 1 121 121 GLU H H 1 9.262 0.000 . . . . . . A 121 GLU H . 34423 1 1023 . 1 1 121 121 GLU HA H 1 5.676 0.000 . . . . . . A 121 GLU HA . 34423 1 1024 . 1 1 121 121 GLU HB2 H 1 2.040 0.000 . . . . . . A 121 GLU HB2 . 34423 1 1025 . 1 1 121 121 GLU HB3 H 1 2.095 0.000 . . . . . . A 121 GLU HB3 . 34423 1 1026 . 1 1 121 121 GLU HG2 H 1 2.163 0.000 . . . . . . A 121 GLU HG2 . 34423 1 1027 . 1 1 121 121 GLU HG3 H 1 2.214 0.000 . . . . . . A 121 GLU HG3 . 34423 1 1028 . 1 1 121 121 GLU C C 13 175.310 0.000 . . . . . . A 121 GLU C . 34423 1 1029 . 1 1 121 121 GLU CA C 13 53.400 0.000 . . . . . . A 121 GLU CA . 34423 1 1030 . 1 1 121 121 GLU CB C 13 34.280 0.000 . . . . . . A 121 GLU CB . 34423 1 1031 . 1 1 121 121 GLU N N 15 119.670 0.000 . . . . . . A 121 GLU N . 34423 1 1032 . 1 1 122 122 ALA H H 1 9.783 0.000 . . . . . . A 122 ALA H . 34423 1 1033 . 1 1 122 122 ALA HA H 1 5.168 0.000 . . . . . . A 122 ALA HA . 34423 1 1034 . 1 1 122 122 ALA HB1 H 1 1.349 0.000 . . . . . . A 122 ALA HB1 . 34423 1 1035 . 1 1 122 122 ALA HB2 H 1 1.349 0.000 . . . . . . A 122 ALA HB2 . 34423 1 1036 . 1 1 122 122 ALA HB3 H 1 1.349 0.000 . . . . . . A 122 ALA HB3 . 34423 1 1037 . 1 1 122 122 ALA C C 13 174.480 0.000 . . . . . . A 122 ALA C . 34423 1 1038 . 1 1 122 122 ALA CA C 13 50.380 0.000 . . . . . . A 122 ALA CA . 34423 1 1039 . 1 1 122 122 ALA CB C 13 21.990 0.000 . . . . . . A 122 ALA CB . 34423 1 1040 . 1 1 122 122 ALA N N 15 125.190 0.000 . . . . . . A 122 ALA N . 34423 1 1041 . 1 1 123 123 TYR H H 1 8.792 0.000 . . . . . . A 123 TYR H . 34423 1 1042 . 1 1 123 123 TYR HA H 1 5.293 0.000 . . . . . . A 123 TYR HA . 34423 1 1043 . 1 1 123 123 TYR HB2 H 1 2.746 0.000 . . . . . . A 123 TYR HB2 . 34423 1 1044 . 1 1 123 123 TYR HB3 H 1 2.886 0.000 . . . . . . A 123 TYR HB3 . 34423 1 1045 . 1 1 123 123 TYR HD1 H 1 7.000 0.000 . . . . . . A 123 TYR HD1 . 34423 1 1046 . 1 1 123 123 TYR HD2 H 1 7.000 0.000 . . . . . . A 123 TYR HD2 . 34423 1 1047 . 1 1 123 123 TYR HE1 H 1 6.620 0.000 . . . . . . A 123 TYR HE1 . 34423 1 1048 . 1 1 123 123 TYR HE2 H 1 6.620 0.000 . . . . . . A 123 TYR HE2 . 34423 1 1049 . 1 1 123 123 TYR C C 13 174.930 0.000 . . . . . . A 123 TYR C . 34423 1 1050 . 1 1 123 123 TYR CA C 13 56.750 0.000 . . . . . . A 123 TYR CA . 34423 1 1051 . 1 1 123 123 TYR CB C 13 38.600 0.000 . . . . . . A 123 TYR CB . 34423 1 1052 . 1 1 123 123 TYR N N 15 122.650 0.000 . . . . . . A 123 TYR N . 34423 1 1053 . 1 1 124 124 ILE H H 1 8.527 0.000 . . . . . . A 124 ILE H . 34423 1 1054 . 1 1 124 124 ILE HA H 1 5.248 0.000 . . . . . . A 124 ILE HA . 34423 1 1055 . 1 1 124 124 ILE HB H 1 1.481 0.000 . . . . . . A 124 ILE HB . 34423 1 1056 . 1 1 124 124 ILE HG12 H 1 0.913 0.000 . . . . . . A 124 ILE HG12 . 34423 1 1057 . 1 1 124 124 ILE HG13 H 1 0.868 0.000 . . . . . . A 124 ILE HG13 . 34423 1 1058 . 1 1 124 124 ILE HG21 H 1 0.429 0.000 . . . . . . A 124 ILE HG21 . 34423 1 1059 . 1 1 124 124 ILE HG22 H 1 0.429 0.000 . . . . . . A 124 ILE HG22 . 34423 1 1060 . 1 1 124 124 ILE HG23 H 1 0.429 0.000 . . . . . . A 124 ILE HG23 . 34423 1 1061 . 1 1 124 124 ILE HD11 H 1 0.513 0.000 . . . . . . A 124 ILE HD11 . 34423 1 1062 . 1 1 124 124 ILE HD12 H 1 0.513 0.000 . . . . . . A 124 ILE HD12 . 34423 1 1063 . 1 1 124 124 ILE HD13 H 1 0.513 0.000 . . . . . . A 124 ILE HD13 . 34423 1 1064 . 1 1 124 124 ILE C C 13 174.310 0.000 . . . . . . A 124 ILE C . 34423 1 1065 . 1 1 124 124 ILE CA C 13 59.230 0.000 . . . . . . A 124 ILE CA . 34423 1 1066 . 1 1 124 124 ILE CB C 13 42.550 0.000 . . . . . . A 124 ILE CB . 34423 1 1067 . 1 1 124 124 ILE N N 15 124.020 0.000 . . . . . . A 124 ILE N . 34423 1 1068 . 1 1 125 125 TRP H H 1 9.480 0.000 . . . . . . A 125 TRP H . 34423 1 1069 . 1 1 125 125 TRP HA H 1 5.722 0.000 . . . . . . A 125 TRP HA . 34423 1 1070 . 1 1 125 125 TRP HB2 H 1 3.203 0.000 . . . . . . A 125 TRP HB2 . 34423 1 1071 . 1 1 125 125 TRP HB3 H 1 3.270 0.000 . . . . . . A 125 TRP HB3 . 34423 1 1072 . 1 1 125 125 TRP HD1 H 1 6.970 0.000 . . . . . . A 125 TRP HD1 . 34423 1 1073 . 1 1 125 125 TRP HE1 H 1 9.650 0.000 . . . . . . A 125 TRP HE1 . 34423 1 1074 . 1 1 125 125 TRP HE3 H 1 7.430 0.000 . . . . . . A 125 TRP HE3 . 34423 1 1075 . 1 1 125 125 TRP HZ2 H 1 7.080 0.000 . . . . . . A 125 TRP HZ2 . 34423 1 1076 . 1 1 125 125 TRP HZ3 H 1 7.920 0.000 . . . . . . A 125 TRP HZ3 . 34423 1 1077 . 1 1 125 125 TRP HH2 H 1 6.960 0.000 . . . . . . A 125 TRP HH2 . 34423 1 1078 . 1 1 125 125 TRP C C 13 175.250 0.000 . . . . . . A 125 TRP C . 34423 1 1079 . 1 1 125 125 TRP CA C 13 54.510 0.000 . . . . . . A 125 TRP CA . 34423 1 1080 . 1 1 125 125 TRP CB C 13 32.830 0.000 . . . . . . A 125 TRP CB . 34423 1 1081 . 1 1 125 125 TRP N N 15 128.260 0.000 . . . . . . A 125 TRP N . 34423 1 1082 . 1 1 125 125 TRP NE1 N 15 127.920 0.000 . . . . . . A 125 TRP NE1 . 34423 1 1083 . 1 1 126 126 ARG H H 1 9.497 0.000 . . . . . . A 126 ARG H . 34423 1 1084 . 1 1 126 126 ARG HA H 1 5.215 0.000 . . . . . . A 126 ARG HA . 34423 1 1085 . 1 1 126 126 ARG HB2 H 1 2.010 0.000 . . . . . . A 126 ARG HB2 . 34423 1 1086 . 1 1 126 126 ARG HB3 H 1 2.059 0.000 . . . . . . A 126 ARG HB3 . 34423 1 1087 . 1 1 126 126 ARG HG2 H 1 1.636 0.000 . . . . . . A 126 ARG HG2 . 34423 1 1088 . 1 1 126 126 ARG HG3 H 1 1.713 0.000 . . . . . . A 126 ARG HG3 . 34423 1 1089 . 1 1 126 126 ARG C C 13 176.990 0.000 . . . . . . A 126 ARG C . 34423 1 1090 . 1 1 126 126 ARG N N 15 125.370 0.000 . . . . . . A 126 ARG N . 34423 1 1091 . 1 1 127 127 ARG H H 1 9.214 0.000 . . . . . . A 127 ARG H . 34423 1 1092 . 1 1 127 127 ARG HA H 1 4.556 0.000 . . . . . . A 127 ARG HA . 34423 1 1093 . 1 1 127 127 ARG HB2 H 1 1.811 0.000 . . . . . . A 127 ARG HB2 . 34423 1 1094 . 1 1 127 127 ARG HB3 H 1 2.084 0.000 . . . . . . A 127 ARG HB3 . 34423 1 1095 . 1 1 127 127 ARG HG2 H 1 1.612 0.000 . . . . . . A 127 ARG HG2 . 34423 1 1096 . 1 1 127 127 ARG HG3 H 1 1.703 0.000 . . . . . . A 127 ARG HG3 . 34423 1 1097 . 1 1 127 127 ARG C C 13 178.460 0.000 . . . . . . A 127 ARG C . 34423 1 1098 . 1 1 127 127 ARG N N 15 126.460 0.000 . . . . . . A 127 ARG N . 34423 1 1099 . 1 1 128 128 LYS HB2 H 1 1.918 0.000 . . . . . . A 128 LYS HB2 . 34423 1 1100 . 1 1 128 128 LYS HB3 H 1 2.078 0.000 . . . . . . A 128 LYS HB3 . 34423 1 1101 . 1 1 128 128 LYS HG2 H 1 1.541 0.000 . . . . . . A 128 LYS HG2 . 34423 1 1102 . 1 1 128 128 LYS HG3 H 1 1.583 0.000 . . . . . . A 128 LYS HG3 . 34423 1 1103 . 1 1 128 128 LYS C C 13 177.150 0.000 . . . . . . A 128 LYS C . 34423 1 1104 . 1 1 128 128 LYS CA C 13 59.260 0.000 . . . . . . A 128 LYS CA . 34423 1 1105 . 1 1 128 128 LYS CB C 13 32.210 0.000 . . . . . . A 128 LYS CB . 34423 1 1106 . 1 1 129 129 ASP H H 1 7.682 0.000 . . . . . . A 129 ASP H . 34423 1 1107 . 1 1 129 129 ASP HA H 1 4.524 0.000 . . . . . . A 129 ASP HA . 34423 1 1108 . 1 1 129 129 ASP HB2 H 1 2.624 0.000 . . . . . . A 129 ASP HB2 . 34423 1 1109 . 1 1 129 129 ASP HB3 H 1 3.128 0.000 . . . . . . A 129 ASP HB3 . 34423 1 1110 . 1 1 129 129 ASP C C 13 176.990 0.000 . . . . . . A 129 ASP C . 34423 1 1111 . 1 1 129 129 ASP CA C 13 53.730 0.000 . . . . . . A 129 ASP CA . 34423 1 1112 . 1 1 129 129 ASP CB C 13 39.980 0.000 . . . . . . A 129 ASP CB . 34423 1 1113 . 1 1 129 129 ASP N N 15 115.330 0.000 . . . . . . A 129 ASP N . 34423 1 1114 . 1 1 130 130 GLY H H 1 8.353 0.000 . . . . . . A 130 GLY H . 34423 1 1115 . 1 1 130 130 GLY HA2 H 1 4.430 0.000 . . . . . . A 130 GLY HA2 . 34423 1 1116 . 1 1 130 130 GLY HA3 H 1 3.589 0.000 . . . . . . A 130 GLY HA3 . 34423 1 1117 . 1 1 130 130 GLY C C 13 173.940 0.000 . . . . . . A 130 GLY C . 34423 1 1118 . 1 1 130 130 GLY CA C 13 45.240 0.000 . . . . . . A 130 GLY CA . 34423 1 1119 . 1 1 130 130 GLY N N 15 109.370 0.000 . . . . . . A 130 GLY N . 34423 1 1120 . 1 1 131 131 SER H H 1 8.353 0.000 . . . . . . A 131 SER H . 34423 1 1121 . 1 1 131 131 SER HA H 1 4.416 0.000 . . . . . . A 131 SER HA . 34423 1 1122 . 1 1 131 131 SER HB2 H 1 3.922 0.000 . . . . . . A 131 SER HB2 . 34423 1 1123 . 1 1 131 131 SER HB3 H 1 3.998 0.000 . . . . . . A 131 SER HB3 . 34423 1 1124 . 1 1 131 131 SER C C 13 173.520 0.000 . . . . . . A 131 SER C . 34423 1 1125 . 1 1 131 131 SER CA C 13 58.600 0.000 . . . . . . A 131 SER CA . 34423 1 1126 . 1 1 131 131 SER CB C 13 64.430 0.000 . . . . . . A 131 SER CB . 34423 1 1127 . 1 1 131 131 SER N N 15 117.670 0.000 . . . . . . A 131 SER N . 34423 1 1128 . 1 1 132 132 CYS H H 1 8.486 0.000 . . . . . . A 132 CYS H . 34423 1 1129 . 1 1 132 132 CYS HA H 1 5.464 0.000 . . . . . . A 132 CYS HA . 34423 1 1130 . 1 1 132 132 CYS HB2 H 1 2.320 0.000 . . . . . . A 132 CYS HB2 . 34423 1 1131 . 1 1 132 132 CYS HB3 H 1 2.950 0.000 . . . . . . A 132 CYS HB3 . 34423 1 1132 . 1 1 132 132 CYS C C 13 173.920 0.000 . . . . . . A 132 CYS C . 34423 1 1133 . 1 1 132 132 CYS CA C 13 59.320 0.000 . . . . . . A 132 CYS CA . 34423 1 1134 . 1 1 132 132 CYS CB C 13 30.580 0.000 . . . . . . A 132 CYS CB . 34423 1 1135 . 1 1 132 132 CYS N N 15 117.720 0.000 . . . . . . A 132 CYS N . 34423 1 1136 . 1 1 133 133 TRP H H 1 9.446 0.000 . . . . . . A 133 TRP H . 34423 1 1137 . 1 1 133 133 TRP HA H 1 5.431 0.000 . . . . . . A 133 TRP HA . 34423 1 1138 . 1 1 133 133 TRP HB2 H 1 2.914 0.000 . . . . . . A 133 TRP HB2 . 34423 1 1139 . 1 1 133 133 TRP HB3 H 1 3.610 0.000 . . . . . . A 133 TRP HB3 . 34423 1 1140 . 1 1 133 133 TRP HD1 H 1 7.493 0.000 . . . . . . A 133 TRP HD1 . 34423 1 1141 . 1 1 133 133 TRP HE1 H 1 10.700 0.000 . . . . . . A 133 TRP HE1 . 34423 1 1142 . 1 1 133 133 TRP HE3 H 1 7.470 0.000 . . . . . . A 133 TRP HE3 . 34423 1 1143 . 1 1 133 133 TRP HZ2 H 1 7.620 0.000 . . . . . . A 133 TRP HZ2 . 34423 1 1144 . 1 1 133 133 TRP HZ3 H 1 6.810 0.000 . . . . . . A 133 TRP HZ3 . 34423 1 1145 . 1 1 133 133 TRP HH2 H 1 7.170 0.000 . . . . . . A 133 TRP HH2 . 34423 1 1146 . 1 1 133 133 TRP C C 13 174.400 0.000 . . . . . . A 133 TRP C . 34423 1 1147 . 1 1 133 133 TRP CA C 13 54.420 0.000 . . . . . . A 133 TRP CA . 34423 1 1148 . 1 1 133 133 TRP N N 15 124.750 0.000 . . . . . . A 133 TRP N . 34423 1 1149 . 1 1 133 133 TRP NE1 N 15 130.250 0.000 . . . . . . A 133 TRP NE1 . 34423 1 1150 . 1 1 134 134 LEU H H 1 9.650 0.000 . . . . . . A 134 LEU H . 34423 1 1151 . 1 1 134 134 LEU HA H 1 4.394 0.000 . . . . . . A 134 LEU HA . 34423 1 1152 . 1 1 134 134 LEU HB2 H 1 0.926 0.000 . . . . . . A 134 LEU HB2 . 34423 1 1153 . 1 1 134 134 LEU HB3 H 1 1.376 0.000 . . . . . . A 134 LEU HB3 . 34423 1 1154 . 1 1 134 134 LEU HG H 1 0.785 0.000 . . . . . . A 134 LEU HG . 34423 1 1155 . 1 1 134 134 LEU HD11 H 1 0.422 0.000 . . . . . . A 134 LEU HD11 . 34423 1 1156 . 1 1 134 134 LEU HD12 H 1 0.422 0.000 . . . . . . A 134 LEU HD12 . 34423 1 1157 . 1 1 134 134 LEU HD13 H 1 0.422 0.000 . . . . . . A 134 LEU HD13 . 34423 1 1158 . 1 1 134 134 LEU HD21 H 1 0.208 0.000 . . . . . . A 134 LEU HD21 . 34423 1 1159 . 1 1 134 134 LEU HD22 H 1 0.208 0.000 . . . . . . A 134 LEU HD22 . 34423 1 1160 . 1 1 134 134 LEU HD23 H 1 0.208 0.000 . . . . . . A 134 LEU HD23 . 34423 1 1161 . 1 1 134 134 LEU CA C 13 54.300 0.000 . . . . . . A 134 LEU CA . 34423 1 1162 . 1 1 134 134 LEU CB C 13 39.480 0.000 . . . . . . A 134 LEU CB . 34423 1 1163 . 1 1 134 134 LEU N N 15 132.590 0.000 . . . . . . A 134 LEU N . 34423 1 1164 . 1 1 135 135 HIS H H 1 7.876 0.000 . . . . . . A 135 HIS H . 34423 1 1165 . 1 1 135 135 HIS HA H 1 4.381 0.000 . . . . . . A 135 HIS HA . 34423 1 1166 . 1 1 135 135 HIS HB2 H 1 3.687 0.000 . . . . . . A 135 HIS HB2 . 34423 1 1167 . 1 1 135 135 HIS HB3 H 1 3.742 0.000 . . . . . . A 135 HIS HB3 . 34423 1 1168 . 1 1 135 135 HIS C C 13 176.760 0.000 . . . . . . A 135 HIS C . 34423 1 1169 . 1 1 135 135 HIS CA C 13 57.910 0.000 . . . . . . A 135 HIS CA . 34423 1 1170 . 1 1 135 135 HIS CB C 13 31.080 0.000 . . . . . . A 135 HIS CB . 34423 1 1171 . 1 1 135 135 HIS N N 15 125.380 0.000 . . . . . . A 135 HIS N . 34423 1 1172 . 1 1 136 136 SER H H 1 7.447 0.000 . . . . . . A 136 SER H . 34423 1 1173 . 1 1 136 136 SER HA H 1 5.330 0.000 . . . . . . A 136 SER HA . 34423 1 1174 . 1 1 136 136 SER HB2 H 1 3.665 0.000 . . . . . . A 136 SER HB2 . 34423 1 1175 . 1 1 136 136 SER HB3 H 1 3.701 0.000 . . . . . . A 136 SER HB3 . 34423 1 1176 . 1 1 136 136 SER C C 13 172.550 0.000 . . . . . . A 136 SER C . 34423 1 1177 . 1 1 136 136 SER CA C 13 57.080 0.000 . . . . . . A 136 SER CA . 34423 1 1178 . 1 1 136 136 SER CB C 13 65.250 0.000 . . . . . . A 136 SER CB . 34423 1 1179 . 1 1 136 136 SER N N 15 110.720 0.000 . . . . . . A 136 SER N . 34423 1 1180 . 1 1 137 137 VAL H H 1 8.973 0.000 . . . . . . A 137 VAL H . 34423 1 1181 . 1 1 137 137 VAL HA H 1 5.154 0.000 . . . . . . A 137 VAL HA . 34423 1 1182 . 1 1 137 137 VAL HB H 1 1.792 0.000 . . . . . . A 137 VAL HB . 34423 1 1183 . 1 1 137 137 VAL HG11 H 1 0.558 0.000 . . . . . . A 137 VAL HG11 . 34423 1 1184 . 1 1 137 137 VAL HG12 H 1 0.558 0.000 . . . . . . A 137 VAL HG12 . 34423 1 1185 . 1 1 137 137 VAL HG13 H 1 0.558 0.000 . . . . . . A 137 VAL HG13 . 34423 1 1186 . 1 1 137 137 VAL HG21 H 1 0.456 0.000 . . . . . . A 137 VAL HG21 . 34423 1 1187 . 1 1 137 137 VAL HG22 H 1 0.456 0.000 . . . . . . A 137 VAL HG22 . 34423 1 1188 . 1 1 137 137 VAL HG23 H 1 0.456 0.000 . . . . . . A 137 VAL HG23 . 34423 1 1189 . 1 1 137 137 VAL C C 13 173.740 0.000 . . . . . . A 137 VAL C . 34423 1 1190 . 1 1 137 137 VAL CA C 13 59.920 0.000 . . . . . . A 137 VAL CA . 34423 1 1191 . 1 1 137 137 VAL CB C 13 35.410 0.000 . . . . . . A 137 VAL CB . 34423 1 1192 . 1 1 137 137 VAL N N 15 120.060 0.000 . . . . . . A 137 VAL N . 34423 1 1193 . 1 1 138 138 LYS H H 1 9.313 0.000 . . . . . . A 138 LYS H . 34423 1 1194 . 1 1 138 138 LYS HA H 1 5.465 0.000 . . . . . . A 138 LYS HA . 34423 1 1195 . 1 1 138 138 LYS HB2 H 1 1.773 0.000 . . . . . . A 138 LYS HB2 . 34423 1 1196 . 1 1 138 138 LYS HB3 H 1 1.907 0.000 . . . . . . A 138 LYS HB3 . 34423 1 1197 . 1 1 138 138 LYS HG2 H 1 1.215 0.000 . . . . . . A 138 LYS HG2 . 34423 1 1198 . 1 1 138 138 LYS HG3 H 1 1.363 0.000 . . . . . . A 138 LYS HG3 . 34423 1 1199 . 1 1 138 138 LYS C C 13 174.770 0.000 . . . . . . A 138 LYS C . 34423 1 1200 . 1 1 138 138 LYS CA C 13 54.950 0.000 . . . . . . A 138 LYS CA . 34423 1 1201 . 1 1 138 138 LYS CB C 13 35.590 0.000 . . . . . . A 138 LYS CB . 34423 1 1202 . 1 1 138 138 LYS N N 15 122.700 0.000 . . . . . . A 138 LYS N . 34423 1 1203 . 1 1 139 139 PHE H H 1 8.986 0.000 . . . . . . A 139 PHE H . 34423 1 1204 . 1 1 139 139 PHE HA H 1 5.497 0.000 . . . . . . A 139 PHE HA . 34423 1 1205 . 1 1 139 139 PHE HB2 H 1 3.199 0.000 . . . . . . A 139 PHE HB2 . 34423 1 1206 . 1 1 139 139 PHE HB3 H 1 3.581 0.000 . . . . . . A 139 PHE HB3 . 34423 1 1207 . 1 1 139 139 PHE HD1 H 1 7.417 0.000 . . . . . . A 139 PHE HD1 . 34423 1 1208 . 1 1 139 139 PHE HD2 H 1 7.417 0.000 . . . . . . A 139 PHE HD2 . 34423 1 1209 . 1 1 139 139 PHE HE1 H 1 6.860 0.000 . . . . . . A 139 PHE HE1 . 34423 1 1210 . 1 1 139 139 PHE HE2 H 1 6.860 0.000 . . . . . . A 139 PHE HE2 . 34423 1 1211 . 1 1 139 139 PHE HZ H 1 6.830 0.000 . . . . . . A 139 PHE HZ . 34423 1 1212 . 1 1 139 139 PHE C C 13 176.500 0.000 . . . . . . A 139 PHE C . 34423 1 1213 . 1 1 139 139 PHE CA C 13 57.670 0.000 . . . . . . A 139 PHE CA . 34423 1 1214 . 1 1 139 139 PHE CB C 13 42.110 0.000 . . . . . . A 139 PHE CB . 34423 1 1215 . 1 1 139 139 PHE N N 15 120.790 0.000 . . . . . . A 139 PHE N . 34423 1 1216 . 1 1 140 140 ILE H H 1 9.817 0.000 . . . . . . A 140 ILE H . 34423 1 1217 . 1 1 140 140 ILE HA H 1 4.579 0.000 . . . . . . A 140 ILE HA . 34423 1 1218 . 1 1 140 140 ILE HB H 1 1.923 0.000 . . . . . . A 140 ILE HB . 34423 1 1219 . 1 1 140 140 ILE HG12 H 1 1.400 0.000 . . . . . . A 140 ILE HG12 . 34423 1 1220 . 1 1 140 140 ILE HG13 H 1 1.165 0.000 . . . . . . A 140 ILE HG13 . 34423 1 1221 . 1 1 140 140 ILE HG21 H 1 0.851 0.000 . . . . . . A 140 ILE HG21 . 34423 1 1222 . 1 1 140 140 ILE HG22 H 1 0.851 0.000 . . . . . . A 140 ILE HG22 . 34423 1 1223 . 1 1 140 140 ILE HG23 H 1 0.851 0.000 . . . . . . A 140 ILE HG23 . 34423 1 1224 . 1 1 140 140 ILE HD11 H 1 0.567 0.000 . . . . . . A 140 ILE HD11 . 34423 1 1225 . 1 1 140 140 ILE HD12 H 1 0.567 0.000 . . . . . . A 140 ILE HD12 . 34423 1 1226 . 1 1 140 140 ILE HD13 H 1 0.567 0.000 . . . . . . A 140 ILE HD13 . 34423 1 1227 . 1 1 140 140 ILE C C 13 173.790 0.000 . . . . . . A 140 ILE C . 34423 1 1228 . 1 1 140 140 ILE CA C 13 62.220 0.000 . . . . . . A 140 ILE CA . 34423 1 1229 . 1 1 140 140 ILE CB C 13 39.790 0.000 . . . . . . A 140 ILE CB . 34423 1 1230 . 1 1 140 140 ILE N N 15 129.530 0.000 . . . . . . A 140 ILE N . 34423 1 1231 . 1 1 141 141 MET H H 1 8.956 0.000 . . . . . . A 141 MET H . 34423 1 1232 . 1 1 141 141 MET HA H 1 5.168 0.000 . . . . . . A 141 MET HA . 34423 1 1233 . 1 1 141 141 MET HB2 H 1 2.014 0.000 . . . . . . A 141 MET HB2 . 34423 1 1234 . 1 1 141 141 MET HB3 H 1 2.129 0.000 . . . . . . A 141 MET HB3 . 34423 1 1235 . 1 1 141 141 MET HG2 H 1 2.492 0.000 . . . . . . A 141 MET HG2 . 34423 1 1236 . 1 1 141 141 MET HG3 H 1 2.543 0.000 . . . . . . A 141 MET HG3 . 34423 1 1237 . 1 1 141 141 MET HE1 H 1 2.040 0.000 . . . . . . A 141 MET HE1 . 34423 1 1238 . 1 1 141 141 MET HE2 H 1 2.040 0.000 . . . . . . A 141 MET HE2 . 34423 1 1239 . 1 1 141 141 MET HE3 H 1 2.040 0.000 . . . . . . A 141 MET HE3 . 34423 1 1240 . 1 1 141 141 MET C C 13 177.160 0.000 . . . . . . A 141 MET C . 34423 1 1241 . 1 1 141 141 MET CA C 13 52.920 0.000 . . . . . . A 141 MET CA . 34423 1 1242 . 1 1 141 141 MET CB C 13 31.520 0.000 . . . . . . A 141 MET CB . 34423 1 1243 . 1 1 141 141 MET N N 15 123.330 0.000 . . . . . . A 141 MET N . 34423 1 1244 . 1 1 142 142 SER H H 1 9.722 0.000 . . . . . . A 142 SER H . 34423 1 1245 . 1 1 142 142 SER HA H 1 3.990 0.000 . . . . . . A 142 SER HA . 34423 1 1246 . 1 1 142 142 SER HB2 H 1 3.710 0.000 . . . . . . A 142 SER HB2 . 34423 1 1247 . 1 1 142 142 SER HB3 H 1 3.772 0.000 . . . . . . A 142 SER HB3 . 34423 1 1248 . 1 1 142 142 SER C C 13 175.530 0.000 . . . . . . A 142 SER C . 34423 1 1249 . 1 1 142 142 SER CA C 13 58.990 0.000 . . . . . . A 142 SER CA . 34423 1 1250 . 1 1 142 142 SER CB C 13 62.550 0.000 . . . . . . A 142 SER CB . 34423 1 1251 . 1 1 142 142 SER N N 15 120.060 0.000 . . . . . . A 142 SER N . 34423 1 1252 . 1 1 143 143 LYS H H 1 8.435 0.000 . . . . . . A 143 LYS H . 34423 1 1253 . 1 1 143 143 LYS HA H 1 3.742 0.000 . . . . . . A 143 LYS HA . 34423 1 1254 . 1 1 143 143 LYS HB2 H 1 0.704 0.000 . . . . . . A 143 LYS HB2 . 34423 1 1255 . 1 1 143 143 LYS HB3 H 1 1.055 0.000 . . . . . . A 143 LYS HB3 . 34423 1 1256 . 1 1 143 143 LYS HG2 H 1 1.418 0.000 . . . . . . A 143 LYS HG2 . 34423 1 1257 . 1 1 143 143 LYS HG3 H 1 1.511 0.000 . . . . . . A 143 LYS HG3 . 34423 1 1258 . 1 1 143 143 LYS C C 13 174.250 0.000 . . . . . . A 143 LYS C . 34423 1 1259 . 1 1 143 143 LYS CA C 13 57.230 0.000 . . . . . . A 143 LYS CA . 34423 1 1260 . 1 1 143 143 LYS CB C 13 32.520 0.000 . . . . . . A 143 LYS CB . 34423 1 1261 . 1 1 143 143 LYS N N 15 122.940 0.000 . . . . . . A 143 LYS N . 34423 1 1262 . 1 1 144 144 ALA H H 1 7.625 0.000 . . . . . . A 144 ALA H . 34423 1 1263 . 1 1 144 144 ALA HA H 1 5.159 0.000 . . . . . . A 144 ALA HA . 34423 1 1264 . 1 1 144 144 ALA HB1 H 1 1.219 0.000 . . . . . . A 144 ALA HB1 . 34423 1 1265 . 1 1 144 144 ALA HB2 H 1 1.219 0.000 . . . . . . A 144 ALA HB2 . 34423 1 1266 . 1 1 144 144 ALA HB3 H 1 1.219 0.000 . . . . . . A 144 ALA HB3 . 34423 1 1267 . 1 1 144 144 ALA C C 13 177.320 0.000 . . . . . . A 144 ALA C . 34423 1 1268 . 1 1 144 144 ALA CA C 13 50.500 0.000 . . . . . . A 144 ALA CA . 34423 1 1269 . 1 1 144 144 ALA CB C 13 22.550 0.000 . . . . . . A 144 ALA CB . 34423 1 1270 . 1 1 144 144 ALA N N 15 121.920 0.000 . . . . . . A 144 ALA N . 34423 1 1271 . 1 1 145 145 ALA H H 1 8.629 0.000 . . . . . . A 145 ALA H . 34423 1 1272 . 1 1 145 145 ALA HA H 1 4.754 0.000 . . . . . . A 145 ALA HA . 34423 1 1273 . 1 1 145 145 ALA HB1 H 1 1.520 0.000 . . . . . . A 145 ALA HB1 . 34423 1 1274 . 1 1 145 145 ALA HB2 H 1 1.520 0.000 . . . . . . A 145 ALA HB2 . 34423 1 1275 . 1 1 145 145 ALA HB3 H 1 1.520 0.000 . . . . . . A 145 ALA HB3 . 34423 1 1276 . 1 1 145 145 ALA C C 13 174.670 0.000 . . . . . . A 145 ALA C . 34423 1 1277 . 1 1 145 145 ALA CA C 13 50.590 0.000 . . . . . . A 145 ALA CA . 34423 1 1278 . 1 1 145 145 ALA CB C 13 19.670 0.000 . . . . . . A 145 ALA CB . 34423 1 1279 . 1 1 145 145 ALA N N 15 123.480 0.000 . . . . . . A 145 ALA N . 34423 1 1280 . 1 1 146 146 PRO HA H 1 4.535 0.000 . . . . . . A 146 PRO HA . 34423 1 1281 . 1 1 146 146 PRO HB2 H 1 1.824 0.000 . . . . . . A 146 PRO HB2 . 34423 1 1282 . 1 1 146 146 PRO HB3 H 1 2.350 0.000 . . . . . . A 146 PRO HB3 . 34423 1 1283 . 1 1 146 146 PRO HG2 H 1 2.022 0.000 . . . . . . A 146 PRO HG2 . 34423 1 1284 . 1 1 146 146 PRO HG3 H 1 2.056 0.000 . . . . . . A 146 PRO HG3 . 34423 1 1285 . 1 1 146 146 PRO HD2 H 1 3.694 0.000 . . . . . . A 146 PRO HD2 . 34423 1 1286 . 1 1 146 146 PRO HD3 H 1 3.842 0.000 . . . . . . A 146 PRO HD3 . 34423 1 1287 . 1 1 146 146 PRO C C 13 176.240 0.000 . . . . . . A 146 PRO C . 34423 1 1288 . 1 1 146 146 PRO CA C 13 63.300 0.000 . . . . . . A 146 PRO CA . 34423 1 1289 . 1 1 146 146 PRO CB C 13 32.400 0.000 . . . . . . A 146 PRO CB . 34423 1 1290 . 1 1 147 147 TYR H H 1 8.128 0.000 . . . . . . A 147 TYR H . 34423 1 1291 . 1 1 147 147 TYR HA H 1 4.586 0.000 . . . . . . A 147 TYR HA . 34423 1 1292 . 1 1 147 147 TYR HB2 H 1 2.826 0.000 . . . . . . A 147 TYR HB2 . 34423 1 1293 . 1 1 147 147 TYR HB3 H 1 2.908 0.000 . . . . . . A 147 TYR HB3 . 34423 1 1294 . 1 1 147 147 TYR HD1 H 1 7.019 0.000 . . . . . . A 147 TYR HD1 . 34423 1 1295 . 1 1 147 147 TYR HD2 H 1 7.019 0.000 . . . . . . A 147 TYR HD2 . 34423 1 1296 . 1 1 147 147 TYR HE1 H 1 6.776 0.000 . . . . . . A 147 TYR HE1 . 34423 1 1297 . 1 1 147 147 TYR HE2 H 1 6.776 0.000 . . . . . . A 147 TYR HE2 . 34423 1 1298 . 1 1 147 147 TYR C C 13 174.900 0.000 . . . . . . A 147 TYR C . 34423 1 1299 . 1 1 147 147 TYR CA C 13 57.920 0.000 . . . . . . A 147 TYR CA . 34423 1 1300 . 1 1 147 147 TYR CB C 13 39.290 0.000 . . . . . . A 147 TYR CB . 34423 1 1301 . 1 1 147 147 TYR N N 15 120.750 0.000 . . . . . . A 147 TYR N . 34423 1 1302 . 1 1 148 148 VAL H H 1 7.900 0.000 . . . . . . A 148 VAL H . 34423 1 1303 . 1 1 148 148 VAL HA H 1 3.957 0.000 . . . . . . A 148 VAL HA . 34423 1 1304 . 1 1 148 148 VAL HB H 1 1.915 0.000 . . . . . . A 148 VAL HB . 34423 1 1305 . 1 1 148 148 VAL HG11 H 1 0.851 0.000 . . . . . . A 148 VAL HG11 . 34423 1 1306 . 1 1 148 148 VAL HG12 H 1 0.851 0.000 . . . . . . A 148 VAL HG12 . 34423 1 1307 . 1 1 148 148 VAL HG13 H 1 0.851 0.000 . . . . . . A 148 VAL HG13 . 34423 1 1308 . 1 1 148 148 VAL HG21 H 1 0.823 0.000 . . . . . . A 148 VAL HG21 . 34423 1 1309 . 1 1 148 148 VAL HG22 H 1 0.823 0.000 . . . . . . A 148 VAL HG22 . 34423 1 1310 . 1 1 148 148 VAL HG23 H 1 0.823 0.000 . . . . . . A 148 VAL HG23 . 34423 1 1311 . 1 1 148 148 VAL C C 13 174.600 0.000 . . . . . . A 148 VAL C . 34423 1 1312 . 1 1 148 148 VAL CA C 13 61.590 0.000 . . . . . . A 148 VAL CA . 34423 1 1313 . 1 1 148 148 VAL CB C 13 33.510 0.000 . . . . . . A 148 VAL CB . 34423 1 1314 . 1 1 148 148 VAL N N 15 125.920 0.000 . . . . . . A 148 VAL N . 34423 1 1315 . 1 1 149 149 ALA H H 1 7.812 0.000 . . . . . . A 149 ALA H . 34423 1 1316 . 1 1 149 149 ALA HA H 1 3.985 0.000 . . . . . . A 149 ALA HA . 34423 1 1317 . 1 1 149 149 ALA HB1 H 1 1.303 0.000 . . . . . . A 149 ALA HB1 . 34423 1 1318 . 1 1 149 149 ALA HB2 H 1 1.303 0.000 . . . . . . A 149 ALA HB2 . 34423 1 1319 . 1 1 149 149 ALA HB3 H 1 1.303 0.000 . . . . . . A 149 ALA HB3 . 34423 1 1320 . 1 1 149 149 ALA C C 13 177.410 0.000 . . . . . . A 149 ALA C . 34423 1 1321 . 1 1 149 149 ALA CA C 13 52.490 0.000 . . . . . . A 149 ALA CA . 34423 1 1322 . 1 1 149 149 ALA CB C 13 19.370 0.000 . . . . . . A 149 ALA CB . 34423 1 1323 . 1 1 149 149 ALA N N 15 133.880 0.000 . . . . . . A 149 ALA N . 34423 1 stop_ save_