data_17943 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17943 _Entry.Title ; 1H, 13C and 15N NMR assignment of CGC-19, a single domain proteic constituent of a non ribosomal peptide synthetase. ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-09-15 _Entry.Accession_date 2011-09-15 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Sophie Nogaret . . . 17943 2 Eric Guittet . . . 17943 3 Nicolas Birlirakis . . . 17943 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . CNRS . 17943 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17943 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 540 17943 '15N chemical shifts' 135 17943 '1H chemical shifts' 829 17943 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2013-03-25 2011-09-15 update BMRB 'update entry citation' 17943 1 . . 2012-03-23 2011-09-15 original author 'original release' 17943 stop_ save_ ############### # Citations # ############### save_CGC-19_citation _Citation.Sf_category citations _Citation.Sf_framecode CGC-19_citation _Citation.Entry_ID 17943 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22419055 _Citation.Full_citation . _Citation.Title '(1)H, (13)C and (15)N NMR assignment of CGC-19, a single domain proteic constituent of a non ribosomal peptide synthetase.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 7 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 1 _Citation.Page_last 4 _Citation.Year 2013 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Sophie Nogaret . . . 17943 1 2 Eric Guittet . . . 17943 1 3 Nicolas Birlirakis . . . 17943 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17943 _Assembly.ID 1 _Assembly.Name CGC-19 _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 13790 _Assembly.Enzyme_commission_number . _Assembly.Details 'Monomeric protein' _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 'CGC-19 major form' 1 $CGC-19 A . yes native yes yes . . . 17943 1 2 'CGC-19 minor form' 1 $CGC-19 A . no native yes yes . . . 17943 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_CGC-19 _Entity.Sf_category entity _Entity.Sf_framecode CGC-19 _Entity.Entry_ID 17943 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name CGC-19 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GIDPFTMTNHADNPTTHVWA TLADREAEHLTGDAEAAAEV VRGIWAEVLEADAESIDVHR GDFFELGGYSLLALQAIGRI LTEYGVGEVESVEWEGELLN RLFENATPMGQAEFLAEKGY GRPNETP ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Residues 1-6 originate from a non-native extended affinity tag' _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 127 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 13790 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no EMBL CAJ88609 . "putative nonribosomal peptide synthetase [Streptomyces ambofaciens ATCC 23877]" . . . . . 95.28 121 100.00 100.00 9.79e-80 . . . . 17943 1 2 no GB AKZ59720 . "putative nonribosomal peptide synthetase PCP domain [Streptomyces ambofaciens ATCC 23877]" . . . . . 95.28 121 100.00 100.00 9.79e-80 . . . . 17943 1 3 no REF WP_053140600 . "hypothetical protein [Streptomyces ambofaciens]" . . . . . 95.28 121 100.00 100.00 9.79e-80 . . . . 17943 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 17943 1 2 . ILE . 17943 1 3 . ASP . 17943 1 4 . PRO . 17943 1 5 . PHE . 17943 1 6 . THR . 17943 1 7 . MET . 17943 1 8 . THR . 17943 1 9 . ASN . 17943 1 10 . HIS . 17943 1 11 . ALA . 17943 1 12 . ASP . 17943 1 13 . ASN . 17943 1 14 . PRO . 17943 1 15 . THR . 17943 1 16 . THR . 17943 1 17 . HIS . 17943 1 18 . VAL . 17943 1 19 . TRP . 17943 1 20 . ALA . 17943 1 21 . THR . 17943 1 22 . LEU . 17943 1 23 . ALA . 17943 1 24 . ASP . 17943 1 25 . ARG . 17943 1 26 . GLU . 17943 1 27 . ALA . 17943 1 28 . GLU . 17943 1 29 . HIS . 17943 1 30 . LEU . 17943 1 31 . THR . 17943 1 32 . GLY . 17943 1 33 . ASP . 17943 1 34 . ALA . 17943 1 35 . GLU . 17943 1 36 . ALA . 17943 1 37 . ALA . 17943 1 38 . ALA . 17943 1 39 . GLU . 17943 1 40 . VAL . 17943 1 41 . VAL . 17943 1 42 . ARG . 17943 1 43 . GLY . 17943 1 44 . ILE . 17943 1 45 . TRP . 17943 1 46 . ALA . 17943 1 47 . GLU . 17943 1 48 . VAL . 17943 1 49 . LEU . 17943 1 50 . GLU . 17943 1 51 . ALA . 17943 1 52 . ASP . 17943 1 53 . ALA . 17943 1 54 . GLU . 17943 1 55 . SER . 17943 1 56 . ILE . 17943 1 57 . ASP . 17943 1 58 . VAL . 17943 1 59 . HIS . 17943 1 60 . ARG . 17943 1 61 . GLY . 17943 1 62 . ASP . 17943 1 63 . PHE . 17943 1 64 . PHE . 17943 1 65 . GLU . 17943 1 66 . LEU . 17943 1 67 . GLY . 17943 1 68 . GLY . 17943 1 69 . TYR . 17943 1 70 . SER . 17943 1 71 . LEU . 17943 1 72 . LEU . 17943 1 73 . ALA . 17943 1 74 . LEU . 17943 1 75 . GLN . 17943 1 76 . ALA . 17943 1 77 . ILE . 17943 1 78 . GLY . 17943 1 79 . ARG . 17943 1 80 . ILE . 17943 1 81 . LEU . 17943 1 82 . THR . 17943 1 83 . GLU . 17943 1 84 . TYR . 17943 1 85 . GLY . 17943 1 86 . VAL . 17943 1 87 . GLY . 17943 1 88 . GLU . 17943 1 89 . VAL . 17943 1 90 . GLU . 17943 1 91 . SER . 17943 1 92 . VAL . 17943 1 93 . GLU . 17943 1 94 . TRP . 17943 1 95 . GLU . 17943 1 96 . GLY . 17943 1 97 . GLU . 17943 1 98 . LEU . 17943 1 99 . LEU . 17943 1 100 . ASN . 17943 1 101 . ARG . 17943 1 102 . LEU . 17943 1 103 . PHE . 17943 1 104 . GLU . 17943 1 105 . ASN . 17943 1 106 . ALA . 17943 1 107 . THR . 17943 1 108 . PRO . 17943 1 109 . MET . 17943 1 110 . GLY . 17943 1 111 . GLN . 17943 1 112 . ALA . 17943 1 113 . GLU . 17943 1 114 . PHE . 17943 1 115 . LEU . 17943 1 116 . ALA . 17943 1 117 . GLU . 17943 1 118 . LYS . 17943 1 119 . GLY . 17943 1 120 . TYR . 17943 1 121 . GLY . 17943 1 122 . ARG . 17943 1 123 . PRO . 17943 1 124 . ASN . 17943 1 125 . GLU . 17943 1 126 . THR . 17943 1 127 . PRO . 17943 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 17943 1 . ILE 2 2 17943 1 . ASP 3 3 17943 1 . PRO 4 4 17943 1 . PHE 5 5 17943 1 . THR 6 6 17943 1 . MET 7 7 17943 1 . THR 8 8 17943 1 . ASN 9 9 17943 1 . HIS 10 10 17943 1 . ALA 11 11 17943 1 . ASP 12 12 17943 1 . ASN 13 13 17943 1 . PRO 14 14 17943 1 . THR 15 15 17943 1 . THR 16 16 17943 1 . HIS 17 17 17943 1 . VAL 18 18 17943 1 . TRP 19 19 17943 1 . ALA 20 20 17943 1 . THR 21 21 17943 1 . LEU 22 22 17943 1 . ALA 23 23 17943 1 . ASP 24 24 17943 1 . ARG 25 25 17943 1 . GLU 26 26 17943 1 . ALA 27 27 17943 1 . GLU 28 28 17943 1 . HIS 29 29 17943 1 . LEU 30 30 17943 1 . THR 31 31 17943 1 . GLY 32 32 17943 1 . ASP 33 33 17943 1 . ALA 34 34 17943 1 . GLU 35 35 17943 1 . ALA 36 36 17943 1 . ALA 37 37 17943 1 . ALA 38 38 17943 1 . GLU 39 39 17943 1 . VAL 40 40 17943 1 . VAL 41 41 17943 1 . ARG 42 42 17943 1 . GLY 43 43 17943 1 . ILE 44 44 17943 1 . TRP 45 45 17943 1 . ALA 46 46 17943 1 . GLU 47 47 17943 1 . VAL 48 48 17943 1 . LEU 49 49 17943 1 . GLU 50 50 17943 1 . ALA 51 51 17943 1 . ASP 52 52 17943 1 . ALA 53 53 17943 1 . GLU 54 54 17943 1 . SER 55 55 17943 1 . ILE 56 56 17943 1 . ASP 57 57 17943 1 . VAL 58 58 17943 1 . HIS 59 59 17943 1 . ARG 60 60 17943 1 . GLY 61 61 17943 1 . ASP 62 62 17943 1 . PHE 63 63 17943 1 . PHE 64 64 17943 1 . GLU 65 65 17943 1 . LEU 66 66 17943 1 . GLY 67 67 17943 1 . GLY 68 68 17943 1 . TYR 69 69 17943 1 . SER 70 70 17943 1 . LEU 71 71 17943 1 . LEU 72 72 17943 1 . ALA 73 73 17943 1 . LEU 74 74 17943 1 . GLN 75 75 17943 1 . ALA 76 76 17943 1 . ILE 77 77 17943 1 . GLY 78 78 17943 1 . ARG 79 79 17943 1 . ILE 80 80 17943 1 . LEU 81 81 17943 1 . THR 82 82 17943 1 . GLU 83 83 17943 1 . TYR 84 84 17943 1 . GLY 85 85 17943 1 . VAL 86 86 17943 1 . GLY 87 87 17943 1 . GLU 88 88 17943 1 . VAL 89 89 17943 1 . GLU 90 90 17943 1 . SER 91 91 17943 1 . VAL 92 92 17943 1 . GLU 93 93 17943 1 . TRP 94 94 17943 1 . GLU 95 95 17943 1 . GLY 96 96 17943 1 . GLU 97 97 17943 1 . LEU 98 98 17943 1 . LEU 99 99 17943 1 . ASN 100 100 17943 1 . ARG 101 101 17943 1 . LEU 102 102 17943 1 . PHE 103 103 17943 1 . GLU 104 104 17943 1 . ASN 105 105 17943 1 . ALA 106 106 17943 1 . THR 107 107 17943 1 . PRO 108 108 17943 1 . MET 109 109 17943 1 . GLY 110 110 17943 1 . GLN 111 111 17943 1 . ALA 112 112 17943 1 . GLU 113 113 17943 1 . PHE 114 114 17943 1 . LEU 115 115 17943 1 . ALA 116 116 17943 1 . GLU 117 117 17943 1 . LYS 118 118 17943 1 . GLY 119 119 17943 1 . TYR 120 120 17943 1 . GLY 121 121 17943 1 . ARG 122 122 17943 1 . PRO 123 123 17943 1 . ASN 124 124 17943 1 . GLU 125 125 17943 1 . THR 126 126 17943 1 . PRO 127 127 17943 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 17943 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $CGC-19 . 1889 organism . 'Streptomyces ambofaciens' 'Streptomyces ambofaciens' . . Bacteria . Streptomyces ambofaciens . . . . . . . . . . . . . . . . . . . . . 17943 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 17943 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $CGC-19 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21 star . . . . . . . . . . . . . . pET151/D-TOPO . . . . . . 17943 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_CGC-19 _Sample.Sf_category sample _Sample.Sf_framecode sample_CGC-19 _Sample.Entry_ID 17943 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 CGC-19 '[U-13C; U-15N]' . . 1 $CGC-19 . . 0.5 . . mM . . . . 17943 1 stop_ save_ save_sample_CGC-19a _Sample.Sf_category sample _Sample.Sf_framecode sample_CGC-19a _Sample.Entry_ID 17943 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 CGC-19 '[U-13C; U-15N]' . . 1 $CGC-19 . . 0.5 . . mM . . . . 17943 2 stop_ save_ ####################### # Sample conditions # ####################### save_CGC-19_sample_conditions _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode CGC-19_sample_conditions _Sample_condition_list.Entry_ID 17943 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 90 . mM 17943 1 pH 5.6 . pH 17943 1 pressure 1 . atm 17943 1 temperature 298 . K 17943 1 stop_ save_ save_CGC-19a_sample_conditions _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode CGC-19a_sample_conditions _Sample_condition_list.Entry_ID 17943 _Sample_condition_list.ID 2 _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' 90 . mM 17943 2 pH 5.6 . pH 17943 2 pressure 1 . atm 17943 2 temperature 298 . K 17943 2 stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 17943 _Software.ID 1 _Software.Name SPARKY _Software.Version 3.114 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 17943 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17943 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 17943 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details '5mm TCI z-gradient cryoprobe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'Avance III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 17943 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer Bruker 'Avance III' . 800 '5mm TCI z-gradient cryoprobe' . . 17943 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 17943 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_CGC-19 isotropic . . 1 $CGC-19_sample_conditions . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17943 1 2 '2D 1H-13C HSQC' no 1 $NMR_spectrometer_expt . . . . . . . . 2 $sample_CGC-19a isotropic . . 2 $CGC-19a_sample_conditions . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17943 1 3 '3D HNCO' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_CGC-19 isotropic . . 1 $CGC-19_sample_conditions . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17943 1 4 '3D HN(CA)CO' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_CGC-19 isotropic . . 1 $CGC-19_sample_conditions . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17943 1 5 '3D HNCA' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_CGC-19 isotropic . . 1 $CGC-19_sample_conditions . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17943 1 6 '3D HN(CO)CA' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_CGC-19 isotropic . . 1 $CGC-19_sample_conditions . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17943 1 7 '3D HNCACB' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_CGC-19 isotropic . . 1 $CGC-19_sample_conditions . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17943 1 8 '3D CBCA(CO)NH' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_CGC-19 isotropic . . 1 $CGC-19_sample_conditions . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17943 1 9 '3D HNHA' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_CGC-19 isotropic . . 1 $CGC-19_sample_conditions . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17943 1 10 '3D HBHA(CO)NH' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_CGC-19 isotropic . . 1 $CGC-19_sample_conditions . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17943 1 11 '3D H(CCO)NH' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_CGC-19 isotropic . . 1 $CGC-19_sample_conditions . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17943 1 12 '3D (H)C(CO)NH' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_CGC-19 isotropic . . 1 $CGC-19_sample_conditions . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17943 1 13 '3D HCCH-TOCSY' no 1 $NMR_spectrometer_expt . . . . . . . . 2 $sample_CGC-19a isotropic . . 2 $CGC-19a_sample_conditions . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17943 1 14 '3D 1H-15N NOESY' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_CGC-19 isotropic . . 1 $CGC-19_sample_conditions . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17943 1 15 '3D 1H-13C NOESY aliphatic' no 1 $NMR_spectrometer_expt . . . . . . . . 2 $sample_CGC-19a isotropic . . 2 $CGC-19a_sample_conditions . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17943 1 stop_ save_ save_NMR_spectrometer_expt _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt _NMR_spec_expt.Entry_ID 17943 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name . _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $SPARKY _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_Chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode Chemical_shift_reference _Chem_shift_reference.Entry_ID 17943 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 17943 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 'separate tube (no insert) similar to the experimental sample tube' cylindrical . . . . . . . 17943 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 17943 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_Assigned_chem_shift_list _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode Assigned_chem_shift_list _Assigned_chem_shift_list.Entry_ID 17943 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $CGC-19_sample_conditions _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $Chemical_shift_reference _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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 3 '3D HNCO' . . . 17943 1 5 '3D HNCA' . . . 17943 1 8 '3D CBCA(CO)NH' . . . 17943 1 11 '3D H(CCO)NH' . . . 17943 1 12 '3D (H)C(CO)NH' . . . 17943 1 13 '3D HCCH-TOCSY' . . . 17943 1 14 '3D 1H-15N NOESY' . . . 17943 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 GLY HA2 H 1 3.860 0.020 . 2 . . . . 1 GLY HA2 . 17943 1 2 . 1 1 1 1 GLY HA3 H 1 3.210 0.020 . 2 . . . . 1 GLY HA3 . 17943 1 3 . 1 1 1 1 GLY C C 13 170.000 0.200 . 1 . . . . 1 GLY C . 17943 1 4 . 1 1 1 1 GLY CA C 13 43.300 0.200 . 1 . . . . 1 GLY CA . 17943 1 5 . 1 1 2 2 ILE H H 1 8.450 0.020 . 1 . . . . 2 ILE H . 17943 1 6 . 1 1 2 2 ILE HA H 1 4.200 0.020 . 1 . . . . 2 ILE HA . 17943 1 7 . 1 1 2 2 ILE HB H 1 1.800 0.020 . 1 . . . . 2 ILE HB . 17943 1 8 . 1 1 2 2 ILE HG12 H 1 1.430 0.020 . 2 . . . . 2 ILE HG12 . 17943 1 9 . 1 1 2 2 ILE HG13 H 1 1.140 0.020 . 2 . . . . 2 ILE HG13 . 17943 1 10 . 1 1 2 2 ILE HG21 H 1 0.850 0.020 . 1 . . . . 2 ILE HG2 . 17943 1 11 . 1 1 2 2 ILE HG22 H 1 0.850 0.020 . 1 . . . . 2 ILE HG2 . 17943 1 12 . 1 1 2 2 ILE HG23 H 1 0.850 0.020 . 1 . . . . 2 ILE HG2 . 17943 1 13 . 1 1 2 2 ILE HD11 H 1 0.850 0.020 . 1 . . . . 2 ILE HD1 . 17943 1 14 . 1 1 2 2 ILE HD12 H 1 0.850 0.020 . 1 . . . . 2 ILE HD1 . 17943 1 15 . 1 1 2 2 ILE HD13 H 1 0.850 0.020 . 1 . . . . 2 ILE HD1 . 17943 1 16 . 1 1 2 2 ILE C C 13 175.700 0.200 . 1 . . . . 2 ILE C . 17943 1 17 . 1 1 2 2 ILE CA C 13 61.000 0.200 . 1 . . . . 2 ILE CA . 17943 1 18 . 1 1 2 2 ILE CB C 13 39.100 0.200 . 1 . . . . 2 ILE CB . 17943 1 19 . 1 1 2 2 ILE CG1 C 13 27.000 0.200 . 1 . . . . 2 ILE CG1 . 17943 1 20 . 1 1 2 2 ILE CG2 C 13 17.600 0.200 . 1 . . . . 2 ILE CG2 . 17943 1 21 . 1 1 2 2 ILE CD1 C 13 13.400 0.200 . 1 . . . . 2 ILE CD1 . 17943 1 22 . 1 1 2 2 ILE N N 15 119.800 0.200 . 1 . . . . 2 ILE N . 17943 1 23 . 1 1 3 3 ASP H H 1 8.460 0.020 . 1 . . . . 3 ASP H . 17943 1 24 . 1 1 3 3 ASP HA H 1 4.890 0.020 . 1 . . . . 3 ASP HA . 17943 1 25 . 1 1 3 3 ASP HB2 H 1 2.790 0.020 . 2 . . . . 3 ASP HB2 . 17943 1 26 . 1 1 3 3 ASP HB3 H 1 2.580 0.020 . 2 . . . . 3 ASP HB3 . 17943 1 27 . 1 1 3 3 ASP C C 13 175.000 0.200 . 1 . . . . 3 ASP C . 17943 1 28 . 1 1 3 3 ASP CA C 13 52.000 0.200 . 1 . . . . 3 ASP CA . 17943 1 29 . 1 1 3 3 ASP CB C 13 41.500 0.200 . 1 . . . . 3 ASP CB . 17943 1 30 . 1 1 3 3 ASP CG C 13 180.200 0.200 . 1 . . . . 3 ASP CG . 17943 1 31 . 1 1 3 3 ASP N N 15 126.600 0.200 . 1 . . . . 3 ASP N . 17943 1 32 . 1 1 4 4 PRO HA H 1 4.330 0.020 . 1 . . . . 4 PRO HA . 17943 1 33 . 1 1 4 4 PRO HB2 H 1 2.170 0.020 . 2 . . . . 4 PRO HB2 . 17943 1 34 . 1 1 4 4 PRO HB3 H 1 1.650 0.020 . 2 . . . . 4 PRO HB3 . 17943 1 35 . 1 1 4 4 PRO HG2 H 1 1.910 0.020 . 2 . . . . 4 PRO HG2 . 17943 1 36 . 1 1 4 4 PRO HG3 H 1 1.750 0.020 . 2 . . . . 4 PRO HG3 . 17943 1 37 . 1 1 4 4 PRO HD2 H 1 3.890 0.020 . 2 . . . . 4 PRO HD2 . 17943 1 38 . 1 1 4 4 PRO HD3 H 1 3.780 0.020 . 2 . . . . 4 PRO HD3 . 17943 1 39 . 1 1 4 4 PRO C C 13 177.200 0.200 . 1 . . . . 4 PRO C . 17943 1 40 . 1 1 4 4 PRO CA C 13 63.800 0.200 . 1 . . . . 4 PRO CA . 17943 1 41 . 1 1 4 4 PRO CB C 13 32.000 0.200 . 1 . . . . 4 PRO CB . 17943 1 42 . 1 1 4 4 PRO CG C 13 27.200 0.200 . 1 . . . . 4 PRO CG . 17943 1 43 . 1 1 4 4 PRO CD C 13 51.000 0.200 . 1 . . . . 4 PRO CD . 17943 1 44 . 1 1 4 4 PRO N N 15 136.700 0.200 . 1 . . . . 4 PRO N . 17943 1 45 . 1 1 5 5 PHE H H 1 8.270 0.020 . 1 . . . . 5 PHE H . 17943 1 46 . 1 1 5 5 PHE HA H 1 4.590 0.020 . 1 . . . . 5 PHE HA . 17943 1 47 . 1 1 5 5 PHE HB2 H 1 3.200 0.020 . 2 . . . . 5 PHE HB2 . 17943 1 48 . 1 1 5 5 PHE HB3 H 1 3.120 0.020 . 2 . . . . 5 PHE HB3 . 17943 1 49 . 1 1 5 5 PHE HD1 H 1 7.280 0.020 . 3 . . . . 5 PHE HD1 . 17943 1 50 . 1 1 5 5 PHE HD2 H 1 7.280 0.020 . 3 . . . . 5 PHE HD2 . 17943 1 51 . 1 1 5 5 PHE HE1 H 1 7.380 0.020 . 3 . . . . 5 PHE HE1 . 17943 1 52 . 1 1 5 5 PHE HE2 H 1 7.380 0.020 . 3 . . . . 5 PHE HE2 . 17943 1 53 . 1 1 5 5 PHE C C 13 176.400 0.200 . 1 . . . . 5 PHE C . 17943 1 54 . 1 1 5 5 PHE CA C 13 58.500 0.200 . 1 . . . . 5 PHE CA . 17943 1 55 . 1 1 5 5 PHE CB C 13 38.900 0.200 . 1 . . . . 5 PHE CB . 17943 1 56 . 1 1 5 5 PHE CD1 C 13 131.500 0.200 . 3 . . . . 5 PHE CD1 . 17943 1 57 . 1 1 5 5 PHE CD2 C 13 131.500 0.200 . 3 . . . . 5 PHE CD2 . 17943 1 58 . 1 1 5 5 PHE N N 15 118.500 0.200 . 1 . . . . 5 PHE N . 17943 1 59 . 1 1 6 6 THR H H 1 7.810 0.020 . 1 . . . . 6 THR H . 17943 1 60 . 1 1 6 6 THR HA H 1 4.290 0.020 . 1 . . . . 6 THR HA . 17943 1 61 . 1 1 6 6 THR HB H 1 4.220 0.020 . 1 . . . . 6 THR HB . 17943 1 62 . 1 1 6 6 THR HG21 H 1 1.220 0.020 . 1 . . . . 6 THR HG2 . 17943 1 63 . 1 1 6 6 THR HG22 H 1 1.220 0.020 . 1 . . . . 6 THR HG2 . 17943 1 64 . 1 1 6 6 THR HG23 H 1 1.220 0.020 . 1 . . . . 6 THR HG2 . 17943 1 65 . 1 1 6 6 THR C C 13 174.600 0.200 . 1 . . . . 6 THR C . 17943 1 66 . 1 1 6 6 THR CA C 13 62.300 0.200 . 1 . . . . 6 THR CA . 17943 1 67 . 1 1 6 6 THR CB C 13 69.900 0.200 . 1 . . . . 6 THR CB . 17943 1 68 . 1 1 6 6 THR CG2 C 13 21.700 0.200 . 1 . . . . 6 THR CG2 . 17943 1 69 . 1 1 6 6 THR N N 15 113.900 0.200 . 1 . . . . 6 THR N . 17943 1 70 . 1 1 7 7 MET H H 1 8.170 0.020 . 1 . . . . 7 MET H . 17943 1 71 . 1 1 7 7 MET HA H 1 4.490 0.020 . 1 . . . . 7 MET HA . 17943 1 72 . 1 1 7 7 MET HB2 H 1 2.120 0.020 . 2 . . . . 7 MET HB2 . 17943 1 73 . 1 1 7 7 MET HB3 H 1 2.040 0.020 . 2 . . . . 7 MET HB3 . 17943 1 74 . 1 1 7 7 MET HG2 H 1 2.610 0.020 . 2 . . . . 7 MET HG2 . 17943 1 75 . 1 1 7 7 MET HG3 H 1 2.520 0.020 . 2 . . . . 7 MET HG3 . 17943 1 76 . 1 1 7 7 MET HE1 H 1 2.060 0.020 . 1 . . . . 7 MET HE . 17943 1 77 . 1 1 7 7 MET HE2 H 1 2.060 0.020 . 1 . . . . 7 MET HE . 17943 1 78 . 1 1 7 7 MET HE3 H 1 2.060 0.020 . 1 . . . . 7 MET HE . 17943 1 79 . 1 1 7 7 MET C C 13 176.300 0.200 . 1 . . . . 7 MET C . 17943 1 80 . 1 1 7 7 MET CA C 13 55.800 0.200 . 1 . . . . 7 MET CA . 17943 1 81 . 1 1 7 7 MET CB C 13 32.600 0.200 . 1 . . . . 7 MET CB . 17943 1 82 . 1 1 7 7 MET CG C 13 32.100 0.200 . 1 . . . . 7 MET CG . 17943 1 83 . 1 1 7 7 MET CE C 13 17.000 0.200 . 1 . . . . 7 MET CE . 17943 1 84 . 1 1 7 7 MET N N 15 122.100 0.200 . 1 . . . . 7 MET N . 17943 1 85 . 1 1 8 8 THR H H 1 8.030 0.020 . 1 . . . . 8 THR H . 17943 1 86 . 1 1 8 8 THR HA H 1 4.310 0.020 . 1 . . . . 8 THR HA . 17943 1 87 . 1 1 8 8 THR HB H 1 4.160 0.020 . 1 . . . . 8 THR HB . 17943 1 88 . 1 1 8 8 THR HG21 H 1 1.150 0.020 . 1 . . . . 8 THR HG2 . 17943 1 89 . 1 1 8 8 THR HG22 H 1 1.150 0.020 . 1 . . . . 8 THR HG2 . 17943 1 90 . 1 1 8 8 THR HG23 H 1 1.150 0.020 . 1 . . . . 8 THR HG2 . 17943 1 91 . 1 1 8 8 THR C C 13 174.100 0.200 . 1 . . . . 8 THR C . 17943 1 92 . 1 1 8 8 THR CA C 13 62.000 0.200 . 1 . . . . 8 THR CA . 17943 1 93 . 1 1 8 8 THR CB C 13 69.900 0.200 . 1 . . . . 8 THR CB . 17943 1 94 . 1 1 8 8 THR CG2 C 13 21.500 0.200 . 1 . . . . 8 THR CG2 . 17943 1 95 . 1 1 8 8 THR N N 15 114.400 0.200 . 1 . . . . 8 THR N . 17943 1 96 . 1 1 9 9 ASN H H 1 8.380 0.020 . 1 . . . . 9 ASN H . 17943 1 97 . 1 1 9 9 ASN HA H 1 4.690 0.020 . 1 . . . . 9 ASN HA . 17943 1 98 . 1 1 9 9 ASN HB2 H 1 2.780 0.020 . 2 . . . . 9 ASN HB2 . 17943 1 99 . 1 1 9 9 ASN HB3 H 1 2.720 0.020 . 2 . . . . 9 ASN HB3 . 17943 1 100 . 1 1 9 9 ASN HD21 H 1 7.540 0.020 . 2 . . . . 9 ASN HD21 . 17943 1 101 . 1 1 9 9 ASN HD22 H 1 6.870 0.020 . 2 . . . . 9 ASN HD22 . 17943 1 102 . 1 1 9 9 ASN C C 13 175.000 0.200 . 1 . . . . 9 ASN C . 17943 1 103 . 1 1 9 9 ASN CA C 13 53.200 0.200 . 1 . . . . 9 ASN CA . 17943 1 104 . 1 1 9 9 ASN CB C 13 38.800 0.200 . 1 . . . . 9 ASN CB . 17943 1 105 . 1 1 9 9 ASN CG C 13 177.000 0.200 . 1 . . . . 9 ASN CG . 17943 1 106 . 1 1 9 9 ASN N N 15 120.900 0.200 . 1 . . . . 9 ASN N . 17943 1 107 . 1 1 9 9 ASN ND2 N 15 112.600 0.200 . 1 . . . . 9 ASN ND2 . 17943 1 108 . 1 1 10 10 HIS H H 1 8.410 0.020 . 1 . . . . 10 HIS H . 17943 1 109 . 1 1 10 10 HIS HA H 1 4.610 0.020 . 1 . . . . 10 HIS HA . 17943 1 110 . 1 1 10 10 HIS HB2 H 1 3.240 0.020 . 2 . . . . 10 HIS HB2 . 17943 1 111 . 1 1 10 10 HIS HB3 H 1 3.120 0.020 . 2 . . . . 10 HIS HB3 . 17943 1 112 . 1 1 10 10 HIS C C 13 174.300 0.200 . 1 . . . . 10 HIS C . 17943 1 113 . 1 1 10 10 HIS CA C 13 55.800 0.200 . 1 . . . . 10 HIS CA . 17943 1 114 . 1 1 10 10 HIS CB C 13 29.500 0.200 . 1 . . . . 10 HIS CB . 17943 1 115 . 1 1 10 10 HIS N N 15 119.800 0.200 . 1 . . . . 10 HIS N . 17943 1 116 . 1 1 11 11 ALA H H 1 8.300 0.020 . 1 . . . . 11 ALA H . 17943 1 117 . 1 1 11 11 ALA HA H 1 4.300 0.020 . 1 . . . . 11 ALA HA . 17943 1 118 . 1 1 11 11 ALA HB1 H 1 1.360 0.020 . 1 . . . . 11 ALA HB . 17943 1 119 . 1 1 11 11 ALA HB2 H 1 1.360 0.020 . 1 . . . . 11 ALA HB . 17943 1 120 . 1 1 11 11 ALA HB3 H 1 1.360 0.020 . 1 . . . . 11 ALA HB . 17943 1 121 . 1 1 11 11 ALA C C 13 177.200 0.200 . 1 . . . . 11 ALA C . 17943 1 122 . 1 1 11 11 ALA CA C 13 52.600 0.200 . 1 . . . . 11 ALA CA . 17943 1 123 . 1 1 11 11 ALA CB C 13 19.300 0.200 . 1 . . . . 11 ALA CB . 17943 1 124 . 1 1 11 11 ALA N N 15 125.100 0.200 . 1 . . . . 11 ALA N . 17943 1 125 . 1 1 12 12 ASP H H 1 8.320 0.020 . 1 . . . . 12 ASP H . 17943 1 126 . 1 1 12 12 ASP HA H 1 4.570 0.020 . 1 . . . . 12 ASP HA . 17943 1 127 . 1 1 12 12 ASP HB2 H 1 2.670 0.020 . 2 . . . . 12 ASP HB2 . 17943 1 128 . 1 1 12 12 ASP HB3 H 1 2.580 0.020 . 2 . . . . 12 ASP HB3 . 17943 1 129 . 1 1 12 12 ASP C C 13 175.600 0.200 . 1 . . . . 12 ASP C . 17943 1 130 . 1 1 12 12 ASP CA C 13 54.300 0.200 . 1 . . . . 12 ASP CA . 17943 1 131 . 1 1 12 12 ASP CB C 13 41.200 0.200 . 1 . . . . 12 ASP CB . 17943 1 132 . 1 1 12 12 ASP CG C 13 180.100 0.200 . 1 . . . . 12 ASP CG . 17943 1 133 . 1 1 12 12 ASP N N 15 119.400 0.200 . 1 . . . . 12 ASP N . 17943 1 134 . 1 1 13 13 ASN H H 1 8.250 0.020 . 1 . . . . 13 ASN H . 17943 1 135 . 1 1 13 13 ASN HA H 1 4.980 0.020 . 1 . . . . 13 ASN HA . 17943 1 136 . 1 1 13 13 ASN HB2 H 1 2.830 0.020 . 2 . . . . 13 ASN HB2 . 17943 1 137 . 1 1 13 13 ASN HB3 H 1 2.660 0.020 . 2 . . . . 13 ASN HB3 . 17943 1 138 . 1 1 13 13 ASN HD21 H 1 7.600 0.020 . 2 . . . . 13 ASN HD21 . 17943 1 139 . 1 1 13 13 ASN HD22 H 1 6.900 0.020 . 2 . . . . 13 ASN HD22 . 17943 1 140 . 1 1 13 13 ASN C C 13 173.300 0.200 . 1 . . . . 13 ASN C . 17943 1 141 . 1 1 13 13 ASN CA C 13 51.400 0.200 . 1 . . . . 13 ASN CA . 17943 1 142 . 1 1 13 13 ASN CB C 13 38.800 0.200 . 1 . . . . 13 ASN CB . 17943 1 143 . 1 1 13 13 ASN CG C 13 177.200 0.200 . 1 . . . . 13 ASN CG . 17943 1 144 . 1 1 13 13 ASN N N 15 119.400 0.200 . 1 . . . . 13 ASN N . 17943 1 145 . 1 1 13 13 ASN ND2 N 15 113.400 0.200 . 1 . . . . 13 ASN ND2 . 17943 1 146 . 1 1 14 14 PRO HA H 1 4.460 0.020 . 1 . . . . 14 PRO HA . 17943 1 147 . 1 1 14 14 PRO HB2 H 1 2.290 0.020 . 2 . . . . 14 PRO HB2 . 17943 1 148 . 1 1 14 14 PRO HB3 H 1 1.970 0.020 . 2 . . . . 14 PRO HB3 . 17943 1 149 . 1 1 14 14 PRO HG2 H 1 2.000 0.020 . 2 . . . . 14 PRO HG2 . 17943 1 150 . 1 1 14 14 PRO HG3 H 1 2.000 0.020 . 2 . . . . 14 PRO HG3 . 17943 1 151 . 1 1 14 14 PRO HD2 H 1 3.760 0.020 . 2 . . . . 14 PRO HD2 . 17943 1 152 . 1 1 14 14 PRO HD3 H 1 3.720 0.020 . 2 . . . . 14 PRO HD3 . 17943 1 153 . 1 1 14 14 PRO C C 13 177.400 0.200 . 1 . . . . 14 PRO C . 17943 1 154 . 1 1 14 14 PRO CA C 13 63.700 0.200 . 1 . . . . 14 PRO CA . 17943 1 155 . 1 1 14 14 PRO CB C 13 32.300 0.200 . 1 . . . . 14 PRO CB . 17943 1 156 . 1 1 14 14 PRO CG C 13 27.500 0.200 . 1 . . . . 14 PRO CG . 17943 1 157 . 1 1 14 14 PRO CD C 13 50.800 0.200 . 1 . . . . 14 PRO CD . 17943 1 158 . 1 1 14 14 PRO N N 15 136.500 0.200 . 1 . . . . 14 PRO N . 17943 1 159 . 1 1 15 15 THR H H 1 8.240 0.020 . 1 . . . . 15 THR H . 17943 1 160 . 1 1 15 15 THR HA H 1 4.330 0.020 . 1 . . . . 15 THR HA . 17943 1 161 . 1 1 15 15 THR HB H 1 4.220 0.020 . 1 . . . . 15 THR HB . 17943 1 162 . 1 1 15 15 THR HG21 H 1 1.190 0.020 . 1 . . . . 15 THR HG2 . 17943 1 163 . 1 1 15 15 THR HG22 H 1 1.190 0.020 . 1 . . . . 15 THR HG2 . 17943 1 164 . 1 1 15 15 THR HG23 H 1 1.190 0.020 . 1 . . . . 15 THR HG2 . 17943 1 165 . 1 1 15 15 THR C C 13 174.800 0.200 . 1 . . . . 15 THR C . 17943 1 166 . 1 1 15 15 THR CA C 13 62.400 0.200 . 1 . . . . 15 THR CA . 17943 1 167 . 1 1 15 15 THR CB C 13 69.700 0.200 . 1 . . . . 15 THR CB . 17943 1 168 . 1 1 15 15 THR CG2 C 13 21.700 0.200 . 1 . . . . 15 THR CG2 . 17943 1 169 . 1 1 15 15 THR N N 15 113.500 0.200 . 1 . . . . 15 THR N . 17943 1 170 . 1 1 16 16 THR H H 1 7.930 0.020 . 1 . . . . 16 THR H . 17943 1 171 . 1 1 16 16 THR HA H 1 4.280 0.020 . 1 . . . . 16 THR HA . 17943 1 172 . 1 1 16 16 THR HB H 1 4.170 0.020 . 1 . . . . 16 THR HB . 17943 1 173 . 1 1 16 16 THR HG21 H 1 1.130 0.020 . 1 . . . . 16 THR HG2 . 17943 1 174 . 1 1 16 16 THR HG22 H 1 1.130 0.020 . 1 . . . . 16 THR HG2 . 17943 1 175 . 1 1 16 16 THR HG23 H 1 1.130 0.020 . 1 . . . . 16 THR HG2 . 17943 1 176 . 1 1 16 16 THR C C 13 174.200 0.200 . 1 . . . . 16 THR C . 17943 1 177 . 1 1 16 16 THR CA C 13 62.000 0.200 . 1 . . . . 16 THR CA . 17943 1 178 . 1 1 16 16 THR CB C 13 69.900 0.200 . 1 . . . . 16 THR CB . 17943 1 179 . 1 1 16 16 THR CG2 C 13 21.600 0.200 . 1 . . . . 16 THR CG2 . 17943 1 180 . 1 1 16 16 THR N N 15 115.600 0.200 . 1 . . . . 16 THR N . 17943 1 181 . 1 1 17 17 HIS H H 1 8.310 0.020 . 1 . . . . 17 HIS H . 17943 1 182 . 1 1 17 17 HIS HA H 1 4.540 0.020 . 1 . . . . 17 HIS HA . 17943 1 183 . 1 1 17 17 HIS HB2 H 1 2.880 0.020 . 2 . . . . 17 HIS HB2 . 17943 1 184 . 1 1 17 17 HIS HB3 H 1 2.880 0.020 . 2 . . . . 17 HIS HB3 . 17943 1 185 . 1 1 17 17 HIS C C 13 174.300 0.200 . 1 . . . . 17 HIS C . 17943 1 186 . 1 1 17 17 HIS CA C 13 55.400 0.200 . 1 . . . . 17 HIS CA . 17943 1 187 . 1 1 17 17 HIS CB C 13 29.400 0.200 . 1 . . . . 17 HIS CB . 17943 1 188 . 1 1 17 17 HIS N N 15 121.300 0.200 . 1 . . . . 17 HIS N . 17943 1 189 . 1 1 18 18 VAL H H 1 8.040 0.020 . 1 . . . . 18 VAL H . 17943 1 190 . 1 1 18 18 VAL HA H 1 3.990 0.020 . 1 . . . . 18 VAL HA . 17943 1 191 . 1 1 18 18 VAL HB H 1 1.940 0.020 . 1 . . . . 18 VAL HB . 17943 1 192 . 1 1 18 18 VAL HG11 H 1 0.800 0.020 . 2 . . . . 18 VAL HG1 . 17943 1 193 . 1 1 18 18 VAL HG12 H 1 0.800 0.020 . 2 . . . . 18 VAL HG1 . 17943 1 194 . 1 1 18 18 VAL HG13 H 1 0.800 0.020 . 2 . . . . 18 VAL HG1 . 17943 1 195 . 1 1 18 18 VAL HG21 H 1 0.820 0.020 . 2 . . . . 18 VAL HG2 . 17943 1 196 . 1 1 18 18 VAL HG22 H 1 0.820 0.020 . 2 . . . . 18 VAL HG2 . 17943 1 197 . 1 1 18 18 VAL HG23 H 1 0.820 0.020 . 2 . . . . 18 VAL HG2 . 17943 1 198 . 1 1 18 18 VAL C C 13 175.700 0.200 . 1 . . . . 18 VAL C . 17943 1 199 . 1 1 18 18 VAL CA C 13 62.400 0.200 . 1 . . . . 18 VAL CA . 17943 1 200 . 1 1 18 18 VAL CB C 13 32.700 0.200 . 1 . . . . 18 VAL CB . 17943 1 201 . 1 1 18 18 VAL CG1 C 13 21.300 0.200 . 2 . . . . 18 VAL CG1 . 17943 1 202 . 1 1 18 18 VAL CG2 C 13 20.600 0.200 . 2 . . . . 18 VAL CG2 . 17943 1 203 . 1 1 18 18 VAL N N 15 121.800 0.200 . 1 . . . . 18 VAL N . 17943 1 204 . 1 1 19 19 TRP H H 1 8.140 0.020 . 1 . . . . 19 TRP H . 17943 1 205 . 1 1 19 19 TRP HA H 1 4.670 0.020 . 1 . . . . 19 TRP HA . 17943 1 206 . 1 1 19 19 TRP HB2 H 1 3.300 0.020 . 2 . . . . 19 TRP HB2 . 17943 1 207 . 1 1 19 19 TRP HB3 H 1 3.180 0.020 . 2 . . . . 19 TRP HB3 . 17943 1 208 . 1 1 19 19 TRP HD1 H 1 7.230 0.020 . 1 . . . . 19 TRP HD1 . 17943 1 209 . 1 1 19 19 TRP HE1 H 1 10.160 0.020 . 1 . . . . 19 TRP HE1 . 17943 1 210 . 1 1 19 19 TRP HZ2 H 1 7.380 0.020 . 1 . . . . 19 TRP HZ2 . 17943 1 211 . 1 1 19 19 TRP HH2 H 1 7.150 0.020 . 1 . . . . 19 TRP HH2 . 17943 1 212 . 1 1 19 19 TRP C C 13 176.000 0.200 . 1 . . . . 19 TRP C . 17943 1 213 . 1 1 19 19 TRP CA C 13 57.000 0.200 . 1 . . . . 19 TRP CA . 17943 1 214 . 1 1 19 19 TRP CB C 13 29.800 0.200 . 1 . . . . 19 TRP CB . 17943 1 215 . 1 1 19 19 TRP CD1 C 13 127.600 0.200 . 1 . . . . 19 TRP CD1 . 17943 1 216 . 1 1 19 19 TRP CZ2 C 13 114.900 0.200 . 1 . . . . 19 TRP CZ2 . 17943 1 217 . 1 1 19 19 TRP CH2 C 13 124.000 0.200 . 1 . . . . 19 TRP CH2 . 17943 1 218 . 1 1 19 19 TRP N N 15 124.600 0.200 . 1 . . . . 19 TRP N . 17943 1 219 . 1 1 19 19 TRP NE1 N 15 129.400 0.200 . 1 . . . . 19 TRP NE1 . 17943 1 220 . 1 1 20 20 ALA H H 1 8.230 0.020 . 1 . . . . 20 ALA H . 17943 1 221 . 1 1 20 20 ALA HA H 1 4.340 0.020 . 1 . . . . 20 ALA HA . 17943 1 222 . 1 1 20 20 ALA HB1 H 1 1.360 0.020 . 1 . . . . 20 ALA HB . 17943 1 223 . 1 1 20 20 ALA HB2 H 1 1.360 0.020 . 1 . . . . 20 ALA HB . 17943 1 224 . 1 1 20 20 ALA HB3 H 1 1.360 0.020 . 1 . . . . 20 ALA HB . 17943 1 225 . 1 1 20 20 ALA C C 13 177.700 0.200 . 1 . . . . 20 ALA C . 17943 1 226 . 1 1 20 20 ALA CA C 13 52.900 0.200 . 1 . . . . 20 ALA CA . 17943 1 227 . 1 1 20 20 ALA CB C 13 19.700 0.200 . 1 . . . . 20 ALA CB . 17943 1 228 . 1 1 20 20 ALA N N 15 125.400 0.200 . 1 . . . . 20 ALA N . 17943 1 229 . 1 1 21 21 THR H H 1 8.080 0.020 . 1 . . . . 21 THR H . 17943 1 230 . 1 1 21 21 THR HA H 1 4.330 0.020 . 1 . . . . 21 THR HA . 17943 1 231 . 1 1 21 21 THR HB H 1 4.250 0.020 . 1 . . . . 21 THR HB . 17943 1 232 . 1 1 21 21 THR HG21 H 1 1.220 0.020 . 1 . . . . 21 THR HG2 . 17943 1 233 . 1 1 21 21 THR HG22 H 1 1.220 0.020 . 1 . . . . 21 THR HG2 . 17943 1 234 . 1 1 21 21 THR HG23 H 1 1.220 0.020 . 1 . . . . 21 THR HG2 . 17943 1 235 . 1 1 21 21 THR C C 13 174.700 0.200 . 1 . . . . 21 THR C . 17943 1 236 . 1 1 21 21 THR CA C 13 61.700 0.200 . 1 . . . . 21 THR CA . 17943 1 237 . 1 1 21 21 THR CB C 13 70.400 0.200 . 1 . . . . 21 THR CB . 17943 1 238 . 1 1 21 21 THR CG2 C 13 21.700 0.200 . 1 . . . . 21 THR CG2 . 17943 1 239 . 1 1 21 21 THR N N 15 112.700 0.200 . 1 . . . . 21 THR N . 17943 1 240 . 1 1 22 22 LEU H H 1 8.250 0.020 . 1 . . . . 22 LEU H . 17943 1 241 . 1 1 22 22 LEU HA H 1 4.280 0.020 . 1 . . . . 22 LEU HA . 17943 1 242 . 1 1 22 22 LEU HB2 H 1 1.640 0.020 . 2 . . . . 22 LEU HB2 . 17943 1 243 . 1 1 22 22 LEU HB3 H 1 1.640 0.020 . 2 . . . . 22 LEU HB3 . 17943 1 244 . 1 1 22 22 LEU HG H 1 1.590 0.020 . 1 . . . . 22 LEU HG . 17943 1 245 . 1 1 22 22 LEU HD11 H 1 0.900 0.020 . 2 . . . . 22 LEU HD1 . 17943 1 246 . 1 1 22 22 LEU HD12 H 1 0.900 0.020 . 2 . . . . 22 LEU HD1 . 17943 1 247 . 1 1 22 22 LEU HD13 H 1 0.900 0.020 . 2 . . . . 22 LEU HD1 . 17943 1 248 . 1 1 22 22 LEU HD21 H 1 0.860 0.020 . 2 . . . . 22 LEU HD2 . 17943 1 249 . 1 1 22 22 LEU HD22 H 1 0.860 0.020 . 2 . . . . 22 LEU HD2 . 17943 1 250 . 1 1 22 22 LEU HD23 H 1 0.860 0.020 . 2 . . . . 22 LEU HD2 . 17943 1 251 . 1 1 22 22 LEU C C 13 177.500 0.200 . 1 . . . . 22 LEU C . 17943 1 252 . 1 1 22 22 LEU CA C 13 55.800 0.200 . 1 . . . . 22 LEU CA . 17943 1 253 . 1 1 22 22 LEU CB C 13 42.300 0.200 . 1 . . . . 22 LEU CB . 17943 1 254 . 1 1 22 22 LEU CG C 13 27.000 0.200 . 1 . . . . 22 LEU CG . 17943 1 255 . 1 1 22 22 LEU CD1 C 13 24.900 0.200 . 2 . . . . 22 LEU CD1 . 17943 1 256 . 1 1 22 22 LEU CD2 C 13 23.800 0.200 . 2 . . . . 22 LEU CD2 . 17943 1 257 . 1 1 22 22 LEU N N 15 124.100 0.200 . 1 . . . . 22 LEU N . 17943 1 258 . 1 1 23 23 ALA H H 1 8.190 0.020 . 1 . . . . 23 ALA H . 17943 1 259 . 1 1 23 23 ALA HA H 1 4.240 0.020 . 1 . . . . 23 ALA HA . 17943 1 260 . 1 1 23 23 ALA HB1 H 1 1.370 0.020 . 1 . . . . 23 ALA HB . 17943 1 261 . 1 1 23 23 ALA HB2 H 1 1.370 0.020 . 1 . . . . 23 ALA HB . 17943 1 262 . 1 1 23 23 ALA HB3 H 1 1.370 0.020 . 1 . . . . 23 ALA HB . 17943 1 263 . 1 1 23 23 ALA C C 13 178.000 0.200 . 1 . . . . 23 ALA C . 17943 1 264 . 1 1 23 23 ALA CA C 13 53.100 0.200 . 1 . . . . 23 ALA CA . 17943 1 265 . 1 1 23 23 ALA CB C 13 19.400 0.200 . 1 . . . . 23 ALA CB . 17943 1 266 . 1 1 23 23 ALA N N 15 123.700 0.200 . 1 . . . . 23 ALA N . 17943 1 267 . 1 1 24 24 ASP H H 1 8.110 0.020 . 1 . . . . 24 ASP H . 17943 1 268 . 1 1 24 24 ASP HA H 1 4.530 0.020 . 1 . . . . 24 ASP HA . 17943 1 269 . 1 1 24 24 ASP HB2 H 1 2.730 0.020 . 2 . . . . 24 ASP HB2 . 17943 1 270 . 1 1 24 24 ASP HB3 H 1 2.680 0.020 . 2 . . . . 24 ASP HB3 . 17943 1 271 . 1 1 24 24 ASP C C 13 176.600 0.200 . 1 . . . . 24 ASP C . 17943 1 272 . 1 1 24 24 ASP CA C 13 54.900 0.200 . 1 . . . . 24 ASP CA . 17943 1 273 . 1 1 24 24 ASP CB C 13 41.200 0.200 . 1 . . . . 24 ASP CB . 17943 1 274 . 1 1 24 24 ASP CG C 13 180.200 0.200 . 1 . . . . 24 ASP CG . 17943 1 275 . 1 1 24 24 ASP N N 15 119.000 0.200 . 1 . . . . 24 ASP N . 17943 1 276 . 1 1 25 25 ARG H H 1 8.060 0.020 . 1 . . . . 25 ARG H . 17943 1 277 . 1 1 25 25 ARG HA H 1 4.190 0.020 . 1 . . . . 25 ARG HA . 17943 1 278 . 1 1 25 25 ARG HB2 H 1 1.850 0.020 . 2 . . . . 25 ARG HB2 . 17943 1 279 . 1 1 25 25 ARG HB3 H 1 1.740 0.020 . 2 . . . . 25 ARG HB3 . 17943 1 280 . 1 1 25 25 ARG HG2 H 1 1.570 0.020 . 2 . . . . 25 ARG HG2 . 17943 1 281 . 1 1 25 25 ARG HG3 H 1 1.570 0.020 . 2 . . . . 25 ARG HG3 . 17943 1 282 . 1 1 25 25 ARG HD2 H 1 3.120 0.020 . 2 . . . . 25 ARG HD2 . 17943 1 283 . 1 1 25 25 ARG HD3 H 1 3.120 0.020 . 2 . . . . 25 ARG HD3 . 17943 1 284 . 1 1 25 25 ARG C C 13 176.900 0.200 . 1 . . . . 25 ARG C . 17943 1 285 . 1 1 25 25 ARG CA C 13 56.800 0.200 . 1 . . . . 25 ARG CA . 17943 1 286 . 1 1 25 25 ARG CB C 13 30.600 0.200 . 1 . . . . 25 ARG CB . 17943 1 287 . 1 1 25 25 ARG CG C 13 27.200 0.200 . 1 . . . . 25 ARG CG . 17943 1 288 . 1 1 25 25 ARG CD C 13 43.600 0.200 . 1 . . . . 25 ARG CD . 17943 1 289 . 1 1 25 25 ARG N N 15 120.600 0.200 . 1 . . . . 25 ARG N . 17943 1 290 . 1 1 26 26 GLU H H 1 8.320 0.020 . 1 . . . . 26 GLU H . 17943 1 291 . 1 1 26 26 GLU HA H 1 4.200 0.020 . 1 . . . . 26 GLU HA . 17943 1 292 . 1 1 26 26 GLU HB2 H 1 2.060 0.020 . 2 . . . . 26 GLU HB2 . 17943 1 293 . 1 1 26 26 GLU HB3 H 1 1.970 0.020 . 2 . . . . 26 GLU HB3 . 17943 1 294 . 1 1 26 26 GLU HG2 H 1 2.320 0.020 . 2 . . . . 26 GLU HG2 . 17943 1 295 . 1 1 26 26 GLU HG3 H 1 2.260 0.020 . 2 . . . . 26 GLU HG3 . 17943 1 296 . 1 1 26 26 GLU C C 13 176.800 0.200 . 1 . . . . 26 GLU C . 17943 1 297 . 1 1 26 26 GLU CA C 13 57.100 0.200 . 1 . . . . 26 GLU CA . 17943 1 298 . 1 1 26 26 GLU CB C 13 30.300 0.200 . 1 . . . . 26 GLU CB . 17943 1 299 . 1 1 26 26 GLU CG C 13 36.400 0.200 . 1 . . . . 26 GLU CG . 17943 1 300 . 1 1 26 26 GLU N N 15 121.000 0.200 . 1 . . . . 26 GLU N . 17943 1 301 . 1 1 27 27 ALA H H 1 8.090 0.020 . 1 . . . . 27 ALA H . 17943 1 302 . 1 1 27 27 ALA HA H 1 4.230 0.020 . 1 . . . . 27 ALA HA . 17943 1 303 . 1 1 27 27 ALA HB1 H 1 1.360 0.020 . 1 . . . . 27 ALA HB . 17943 1 304 . 1 1 27 27 ALA HB2 H 1 1.360 0.020 . 1 . . . . 27 ALA HB . 17943 1 305 . 1 1 27 27 ALA HB3 H 1 1.360 0.020 . 1 . . . . 27 ALA HB . 17943 1 306 . 1 1 27 27 ALA C C 13 177.800 0.200 . 1 . . . . 27 ALA C . 17943 1 307 . 1 1 27 27 ALA CA C 13 53.100 0.200 . 1 . . . . 27 ALA CA . 17943 1 308 . 1 1 27 27 ALA CB C 13 19.400 0.200 . 1 . . . . 27 ALA CB . 17943 1 309 . 1 1 27 27 ALA N N 15 123.700 0.200 . 1 . . . . 27 ALA N . 17943 1 310 . 1 1 28 28 GLU H H 1 8.180 0.020 . 1 . . . . 28 GLU H . 17943 1 311 . 1 1 28 28 GLU HA H 1 4.170 0.020 . 1 . . . . 28 GLU HA . 17943 1 312 . 1 1 28 28 GLU HB2 H 1 1.410 0.020 . 2 . . . . 28 GLU HB2 . 17943 1 313 . 1 1 28 28 GLU HB3 H 1 1.410 0.020 . 2 . . . . 28 GLU HB3 . 17943 1 314 . 1 1 28 28 GLU HG2 H 1 2.260 0.020 . 2 . . . . 28 GLU HG2 . 17943 1 315 . 1 1 28 28 GLU HG3 H 1 2.180 0.020 . 2 . . . . 28 GLU HG3 . 17943 1 316 . 1 1 28 28 GLU C C 13 176.300 0.200 . 1 . . . . 28 GLU C . 17943 1 317 . 1 1 28 28 GLU CA C 13 56.900 0.200 . 1 . . . . 28 GLU CA . 17943 1 318 . 1 1 28 28 GLU CB C 13 30.500 0.200 . 1 . . . . 28 GLU CB . 17943 1 319 . 1 1 28 28 GLU CG C 13 36.300 0.200 . 1 . . . . 28 GLU CG . 17943 1 320 . 1 1 28 28 GLU N N 15 119.200 0.200 . 1 . . . . 28 GLU N . 17943 1 321 . 1 1 29 29 HIS H H 1 8.340 0.020 . 1 . . . . 29 HIS H . 17943 1 322 . 1 1 29 29 HIS HA H 1 4.700 0.020 . 1 . . . . 29 HIS HA . 17943 1 323 . 1 1 29 29 HIS HB2 H 1 3.240 0.020 . 2 . . . . 29 HIS HB2 . 17943 1 324 . 1 1 29 29 HIS HB3 H 1 3.160 0.020 . 2 . . . . 29 HIS HB3 . 17943 1 325 . 1 1 29 29 HIS HD2 H 1 7.230 0.020 . 1 . . . . 29 HIS HD2 . 17943 1 326 . 1 1 29 29 HIS C C 13 174.300 0.200 . 1 . . . . 29 HIS C . 17943 1 327 . 1 1 29 29 HIS CA C 13 55.000 0.200 . 1 . . . . 29 HIS CA . 17943 1 328 . 1 1 29 29 HIS CB C 13 29.000 0.200 . 1 . . . . 29 HIS CB . 17943 1 329 . 1 1 29 29 HIS N N 15 118.900 0.200 . 1 . . . . 29 HIS N . 17943 1 330 . 1 1 30 30 LEU H H 1 8.340 0.020 . 1 . . . . 30 LEU H . 17943 1 331 . 1 1 30 30 LEU HA H 1 4.420 0.020 . 1 . . . . 30 LEU HA . 17943 1 332 . 1 1 30 30 LEU HB2 H 1 1.640 0.020 . 2 . . . . 30 LEU HB2 . 17943 1 333 . 1 1 30 30 LEU HB3 H 1 1.530 0.020 . 2 . . . . 30 LEU HB3 . 17943 1 334 . 1 1 30 30 LEU HG H 1 1.570 0.020 . 1 . . . . 30 LEU HG . 17943 1 335 . 1 1 30 30 LEU HD11 H 1 0.870 0.020 . 2 . . . . 30 LEU HD1 . 17943 1 336 . 1 1 30 30 LEU HD12 H 1 0.870 0.020 . 2 . . . . 30 LEU HD1 . 17943 1 337 . 1 1 30 30 LEU HD13 H 1 0.870 0.020 . 2 . . . . 30 LEU HD1 . 17943 1 338 . 1 1 30 30 LEU HD21 H 1 0.820 0.020 . 2 . . . . 30 LEU HD2 . 17943 1 339 . 1 1 30 30 LEU HD22 H 1 0.820 0.020 . 2 . . . . 30 LEU HD2 . 17943 1 340 . 1 1 30 30 LEU HD23 H 1 0.820 0.020 . 2 . . . . 30 LEU HD2 . 17943 1 341 . 1 1 30 30 LEU C C 13 177.400 0.200 . 1 . . . . 30 LEU C . 17943 1 342 . 1 1 30 30 LEU CA C 13 55.300 0.200 . 1 . . . . 30 LEU CA . 17943 1 343 . 1 1 30 30 LEU CB C 13 42.400 0.200 . 1 . . . . 30 LEU CB . 17943 1 344 . 1 1 30 30 LEU CG C 13 27.000 0.200 . 1 . . . . 30 LEU CG . 17943 1 345 . 1 1 30 30 LEU CD1 C 13 25.200 0.200 . 2 . . . . 30 LEU CD1 . 17943 1 346 . 1 1 30 30 LEU CD2 C 13 23.400 0.200 . 2 . . . . 30 LEU CD2 . 17943 1 347 . 1 1 30 30 LEU N N 15 123.600 0.200 . 1 . . . . 30 LEU N . 17943 1 348 . 1 1 31 31 THR H H 1 8.120 0.020 . 1 . . . . 31 THR H . 17943 1 349 . 1 1 31 31 THR HA H 1 4.320 0.020 . 1 . . . . 31 THR HA . 17943 1 350 . 1 1 31 31 THR HB H 1 4.190 0.020 . 1 . . . . 31 THR HB . 17943 1 351 . 1 1 31 31 THR HG21 H 1 1.190 0.020 . 1 . . . . 31 THR HG2 . 17943 1 352 . 1 1 31 31 THR HG22 H 1 1.190 0.020 . 1 . . . . 31 THR HG2 . 17943 1 353 . 1 1 31 31 THR HG23 H 1 1.190 0.020 . 1 . . . . 31 THR HG2 . 17943 1 354 . 1 1 31 31 THR C C 13 175.200 0.200 . 1 . . . . 31 THR C . 17943 1 355 . 1 1 31 31 THR CA C 13 62.000 0.200 . 1 . . . . 31 THR CA . 17943 1 356 . 1 1 31 31 THR CB C 13 70.100 0.200 . 1 . . . . 31 THR CB . 17943 1 357 . 1 1 31 31 THR CG2 C 13 21.700 0.200 . 1 . . . . 31 THR CG2 . 17943 1 358 . 1 1 31 31 THR N N 15 114.200 0.200 . 1 . . . . 31 THR N . 17943 1 359 . 1 1 32 32 GLY H H 1 8.310 0.020 . 1 . . . . 32 GLY H . 17943 1 360 . 1 1 32 32 GLY HA2 H 1 3.890 0.020 . 2 . . . . 32 GLY HA2 . 17943 1 361 . 1 1 32 32 GLY HA3 H 1 3.820 0.020 . 2 . . . . 32 GLY HA3 . 17943 1 362 . 1 1 32 32 GLY C C 13 173.300 0.200 . 1 . . . . 32 GLY C . 17943 1 363 . 1 1 32 32 GLY CA C 13 44.600 0.200 . 1 . . . . 32 GLY CA . 17943 1 364 . 1 1 32 32 GLY N N 15 110.500 0.200 . 1 . . . . 32 GLY N . 17943 1 365 . 1 1 33 33 ASP H H 1 7.950 0.020 . 1 . . . . 33 ASP H . 17943 1 366 . 1 1 33 33 ASP HA H 1 4.720 0.020 . 1 . . . . 33 ASP HA . 17943 1 367 . 1 1 33 33 ASP HB2 H 1 2.790 0.020 . 2 . . . . 33 ASP HB2 . 17943 1 368 . 1 1 33 33 ASP HB3 H 1 2.550 0.020 . 2 . . . . 33 ASP HB3 . 17943 1 369 . 1 1 33 33 ASP C C 13 175.700 0.200 . 1 . . . . 33 ASP C . 17943 1 370 . 1 1 33 33 ASP CA C 13 54.000 0.200 . 1 . . . . 33 ASP CA . 17943 1 371 . 1 1 33 33 ASP CB C 13 41.800 0.200 . 1 . . . . 33 ASP CB . 17943 1 372 . 1 1 33 33 ASP N N 15 119.900 0.200 . 1 . . . . 33 ASP N . 17943 1 373 . 1 1 34 34 ALA H H 1 8.940 0.020 . 1 . . . . 34 ALA H . 17943 1 374 . 1 1 34 34 ALA HA H 1 3.850 0.020 . 1 . . . . 34 ALA HA . 17943 1 375 . 1 1 34 34 ALA HB1 H 1 1.330 0.020 . 1 . . . . 34 ALA HB . 17943 1 376 . 1 1 34 34 ALA HB2 H 1 1.330 0.020 . 1 . . . . 34 ALA HB . 17943 1 377 . 1 1 34 34 ALA HB3 H 1 1.330 0.020 . 1 . . . . 34 ALA HB . 17943 1 378 . 1 1 34 34 ALA C C 13 179.000 0.200 . 1 . . . . 34 ALA C . 17943 1 379 . 1 1 34 34 ALA CA C 13 55.200 0.200 . 1 . . . . 34 ALA CA . 17943 1 380 . 1 1 34 34 ALA CB C 13 18.300 0.200 . 1 . . . . 34 ALA CB . 17943 1 381 . 1 1 34 34 ALA N N 15 127.000 0.200 . 1 . . . . 34 ALA N . 17943 1 382 . 1 1 35 35 GLU H H 1 8.080 0.020 . 1 . . . . 35 GLU H . 17943 1 383 . 1 1 35 35 GLU HA H 1 3.820 0.020 . 1 . . . . 35 GLU HA . 17943 1 384 . 1 1 35 35 GLU HB2 H 1 2.110 0.020 . 2 . . . . 35 GLU HB2 . 17943 1 385 . 1 1 35 35 GLU HB3 H 1 2.110 0.020 . 2 . . . . 35 GLU HB3 . 17943 1 386 . 1 1 35 35 GLU HG2 H 1 2.410 0.020 . 2 . . . . 35 GLU HG2 . 17943 1 387 . 1 1 35 35 GLU HG3 H 1 2.280 0.020 . 2 . . . . 35 GLU HG3 . 17943 1 388 . 1 1 35 35 GLU C C 13 179.300 0.200 . 1 . . . . 35 GLU C . 17943 1 389 . 1 1 35 35 GLU CA C 13 60.000 0.200 . 1 . . . . 35 GLU CA . 17943 1 390 . 1 1 35 35 GLU CB C 13 28.700 0.200 . 1 . . . . 35 GLU CB . 17943 1 391 . 1 1 35 35 GLU CG C 13 36.400 0.200 . 1 . . . . 35 GLU CG . 17943 1 392 . 1 1 35 35 GLU CD C 13 183.400 0.200 . 1 . . . . 35 GLU CD . 17943 1 393 . 1 1 35 35 GLU N N 15 116.700 0.200 . 1 . . . . 35 GLU N . 17943 1 394 . 1 1 36 36 ALA H H 1 7.690 0.020 . 1 . . . . 36 ALA H . 17943 1 395 . 1 1 36 36 ALA HA H 1 4.110 0.020 . 1 . . . . 36 ALA HA . 17943 1 396 . 1 1 36 36 ALA HB1 H 1 1.360 0.020 . 1 . . . . 36 ALA HB . 17943 1 397 . 1 1 36 36 ALA HB2 H 1 1.360 0.020 . 1 . . . . 36 ALA HB . 17943 1 398 . 1 1 36 36 ALA HB3 H 1 1.360 0.020 . 1 . . . . 36 ALA HB . 17943 1 399 . 1 1 36 36 ALA C C 13 180.900 0.200 . 1 . . . . 36 ALA C . 17943 1 400 . 1 1 36 36 ALA CA C 13 54.600 0.200 . 1 . . . . 36 ALA CA . 17943 1 401 . 1 1 36 36 ALA CB C 13 18.800 0.200 . 1 . . . . 36 ALA CB . 17943 1 402 . 1 1 36 36 ALA N N 15 122.300 0.200 . 1 . . . . 36 ALA N . 17943 1 403 . 1 1 37 37 ALA H H 1 8.300 0.020 . 1 . . . . 37 ALA H . 17943 1 404 . 1 1 37 37 ALA HA H 1 4.220 0.020 . 1 . . . . 37 ALA HA . 17943 1 405 . 1 1 37 37 ALA HB1 H 1 1.450 0.020 . 1 . . . . 37 ALA HB . 17943 1 406 . 1 1 37 37 ALA HB2 H 1 1.450 0.020 . 1 . . . . 37 ALA HB . 17943 1 407 . 1 1 37 37 ALA HB3 H 1 1.450 0.020 . 1 . . . . 37 ALA HB . 17943 1 408 . 1 1 37 37 ALA C C 13 179.600 0.200 . 1 . . . . 37 ALA C . 17943 1 409 . 1 1 37 37 ALA CA C 13 54.800 0.200 . 1 . . . . 37 ALA CA . 17943 1 410 . 1 1 37 37 ALA CB C 13 17.800 0.200 . 1 . . . . 37 ALA CB . 17943 1 411 . 1 1 37 37 ALA N N 15 120.200 0.200 . 1 . . . . 37 ALA N . 17943 1 412 . 1 1 38 38 ALA H H 1 8.570 0.020 . 1 . . . . 38 ALA H . 17943 1 413 . 1 1 38 38 ALA HA H 1 3.550 0.020 . 1 . . . . 38 ALA HA . 17943 1 414 . 1 1 38 38 ALA HB1 H 1 1.280 0.020 . 1 . . . . 38 ALA HB . 17943 1 415 . 1 1 38 38 ALA HB2 H 1 1.280 0.020 . 1 . . . . 38 ALA HB . 17943 1 416 . 1 1 38 38 ALA HB3 H 1 1.280 0.020 . 1 . . . . 38 ALA HB . 17943 1 417 . 1 1 38 38 ALA C C 13 179.100 0.200 . 1 . . . . 38 ALA C . 17943 1 418 . 1 1 38 38 ALA CA C 13 55.600 0.200 . 1 . . . . 38 ALA CA . 17943 1 419 . 1 1 38 38 ALA CB C 13 17.400 0.200 . 1 . . . . 38 ALA CB . 17943 1 420 . 1 1 38 38 ALA N N 15 120.800 0.200 . 1 . . . . 38 ALA N . 17943 1 421 . 1 1 39 39 GLU H H 1 7.200 0.020 . 1 . . . . 39 GLU H . 17943 1 422 . 1 1 39 39 GLU HA H 1 3.950 0.020 . 1 . . . . 39 GLU HA . 17943 1 423 . 1 1 39 39 GLU HB2 H 1 2.150 0.020 . 2 . . . . 39 GLU HB2 . 17943 1 424 . 1 1 39 39 GLU HB3 H 1 2.150 0.020 . 2 . . . . 39 GLU HB3 . 17943 1 425 . 1 1 39 39 GLU HG2 H 1 2.420 0.020 . 2 . . . . 39 GLU HG2 . 17943 1 426 . 1 1 39 39 GLU HG3 H 1 2.290 0.020 . 2 . . . . 39 GLU HG3 . 17943 1 427 . 1 1 39 39 GLU C C 13 179.600 0.200 . 1 . . . . 39 GLU C . 17943 1 428 . 1 1 39 39 GLU CA C 13 59.100 0.200 . 1 . . . . 39 GLU CA . 17943 1 429 . 1 1 39 39 GLU CB C 13 29.300 0.200 . 1 . . . . 39 GLU CB . 17943 1 430 . 1 1 39 39 GLU CG C 13 35.800 0.200 . 1 . . . . 39 GLU CG . 17943 1 431 . 1 1 39 39 GLU CD C 13 183.200 0.200 . 1 . . . . 39 GLU CD . 17943 1 432 . 1 1 39 39 GLU N N 15 116.500 0.200 . 1 . . . . 39 GLU N . 17943 1 433 . 1 1 40 40 VAL H H 1 7.260 0.020 . 1 . . . . 40 VAL H . 17943 1 434 . 1 1 40 40 VAL HA H 1 3.690 0.020 . 1 . . . . 40 VAL HA . 17943 1 435 . 1 1 40 40 VAL HB H 1 1.100 0.020 . 1 . . . . 40 VAL HB . 17943 1 436 . 1 1 40 40 VAL HG11 H 1 0.880 0.020 . 2 . . . . 40 VAL HG1 . 17943 1 437 . 1 1 40 40 VAL HG12 H 1 0.880 0.020 . 2 . . . . 40 VAL HG1 . 17943 1 438 . 1 1 40 40 VAL HG13 H 1 0.880 0.020 . 2 . . . . 40 VAL HG1 . 17943 1 439 . 1 1 40 40 VAL HG21 H 1 0.880 0.020 . 2 . . . . 40 VAL HG2 . 17943 1 440 . 1 1 40 40 VAL HG22 H 1 0.880 0.020 . 2 . . . . 40 VAL HG2 . 17943 1 441 . 1 1 40 40 VAL HG23 H 1 0.880 0.020 . 2 . . . . 40 VAL HG2 . 17943 1 442 . 1 1 40 40 VAL C C 13 179.700 0.200 . 1 . . . . 40 VAL C . 17943 1 443 . 1 1 40 40 VAL CA C 13 65.800 0.200 . 1 . . . . 40 VAL CA . 17943 1 444 . 1 1 40 40 VAL CB C 13 31.300 0.200 . 1 . . . . 40 VAL CB . 17943 1 445 . 1 1 40 40 VAL CG1 C 13 22.600 0.200 . 2 . . . . 40 VAL CG1 . 17943 1 446 . 1 1 40 40 VAL CG2 C 13 22.600 0.200 . 2 . . . . 40 VAL CG2 . 17943 1 447 . 1 1 40 40 VAL N N 15 122.300 0.200 . 1 . . . . 40 VAL N . 17943 1 448 . 1 1 41 41 VAL H H 1 8.430 0.020 . 1 . . . . 41 VAL H . 17943 1 449 . 1 1 41 41 VAL HA H 1 3.200 0.020 . 1 . . . . 41 VAL HA . 17943 1 450 . 1 1 41 41 VAL HB H 1 1.780 0.020 . 1 . . . . 41 VAL HB . 17943 1 451 . 1 1 41 41 VAL HG11 H 1 0.870 0.020 . 2 . . . . 41 VAL HG1 . 17943 1 452 . 1 1 41 41 VAL HG12 H 1 0.870 0.020 . 2 . . . . 41 VAL HG1 . 17943 1 453 . 1 1 41 41 VAL HG13 H 1 0.870 0.020 . 2 . . . . 41 VAL HG1 . 17943 1 454 . 1 1 41 41 VAL HG21 H 1 0.150 0.020 . 2 . . . . 41 VAL HG2 . 17943 1 455 . 1 1 41 41 VAL HG22 H 1 0.150 0.020 . 2 . . . . 41 VAL HG2 . 17943 1 456 . 1 1 41 41 VAL HG23 H 1 0.150 0.020 . 2 . . . . 41 VAL HG2 . 17943 1 457 . 1 1 41 41 VAL C C 13 176.500 0.200 . 1 . . . . 41 VAL C . 17943 1 458 . 1 1 41 41 VAL CA C 13 67.200 0.200 . 1 . . . . 41 VAL CA . 17943 1 459 . 1 1 41 41 VAL CB C 13 31.400 0.200 . 1 . . . . 41 VAL CB . 17943 1 460 . 1 1 41 41 VAL CG1 C 13 22.100 0.200 . 2 . . . . 41 VAL CG1 . 17943 1 461 . 1 1 41 41 VAL CG2 C 13 20.700 0.200 . 2 . . . . 41 VAL CG2 . 17943 1 462 . 1 1 41 41 VAL N N 15 119.900 0.200 . 1 . . . . 41 VAL N . 17943 1 463 . 1 1 42 42 ARG H H 1 8.460 0.020 . 1 . . . . 42 ARG H . 17943 1 464 . 1 1 42 42 ARG HA H 1 3.440 0.020 . 1 . . . . 42 ARG HA . 17943 1 465 . 1 1 42 42 ARG HB2 H 1 1.860 0.020 . 2 . . . . 42 ARG HB2 . 17943 1 466 . 1 1 42 42 ARG HB3 H 1 1.650 0.020 . 2 . . . . 42 ARG HB3 . 17943 1 467 . 1 1 42 42 ARG HG2 H 1 1.570 0.020 . 2 . . . . 42 ARG HG2 . 17943 1 468 . 1 1 42 42 ARG HG3 H 1 1.570 0.020 . 2 . . . . 42 ARG HG3 . 17943 1 469 . 1 1 42 42 ARG HD2 H 1 3.350 0.020 . 2 . . . . 42 ARG HD2 . 17943 1 470 . 1 1 42 42 ARG HD3 H 1 3.140 0.020 . 2 . . . . 42 ARG HD3 . 17943 1 471 . 1 1 42 42 ARG C C 13 177.500 0.200 . 1 . . . . 42 ARG C . 17943 1 472 . 1 1 42 42 ARG CA C 13 60.200 0.200 . 1 . . . . 42 ARG CA . 17943 1 473 . 1 1 42 42 ARG CB C 13 30.300 0.200 . 1 . . . . 42 ARG CB . 17943 1 474 . 1 1 42 42 ARG CG C 13 26.500 0.200 . 1 . . . . 42 ARG CG . 17943 1 475 . 1 1 42 42 ARG CD C 13 44.000 0.200 . 1 . . . . 42 ARG CD . 17943 1 476 . 1 1 42 42 ARG N N 15 117.900 0.200 . 1 . . . . 42 ARG N . 17943 1 477 . 1 1 43 43 GLY H H 1 7.710 0.020 . 1 . . . . 43 GLY H . 17943 1 478 . 1 1 43 43 GLY HA2 H 1 4.080 0.020 . 2 . . . . 43 GLY HA2 . 17943 1 479 . 1 1 43 43 GLY HA3 H 1 3.830 0.020 . 2 . . . . 43 GLY HA3 . 17943 1 480 . 1 1 43 43 GLY C C 13 176.800 0.200 . 1 . . . . 43 GLY C . 17943 1 481 . 1 1 43 43 GLY CA C 13 47.300 0.200 . 1 . . . . 43 GLY CA . 17943 1 482 . 1 1 43 43 GLY N N 15 105.300 0.200 . 1 . . . . 43 GLY N . 17943 1 483 . 1 1 44 44 ILE H H 1 7.710 0.020 . 1 . . . . 44 ILE H . 17943 1 484 . 1 1 44 44 ILE HA H 1 3.950 0.020 . 1 . . . . 44 ILE HA . 17943 1 485 . 1 1 44 44 ILE HB H 1 2.070 0.020 . 1 . . . . 44 ILE HB . 17943 1 486 . 1 1 44 44 ILE HG12 H 1 1.780 0.020 . 2 . . . . 44 ILE HG12 . 17943 1 487 . 1 1 44 44 ILE HG13 H 1 1.150 0.020 . 2 . . . . 44 ILE HG13 . 17943 1 488 . 1 1 44 44 ILE HG21 H 1 1.160 0.020 . 1 . . . . 44 ILE HG2 . 17943 1 489 . 1 1 44 44 ILE HG22 H 1 1.160 0.020 . 1 . . . . 44 ILE HG2 . 17943 1 490 . 1 1 44 44 ILE HG23 H 1 1.160 0.020 . 1 . . . . 44 ILE HG2 . 17943 1 491 . 1 1 44 44 ILE HD11 H 1 0.770 0.020 . 1 . . . . 44 ILE HD1 . 17943 1 492 . 1 1 44 44 ILE HD12 H 1 0.770 0.020 . 1 . . . . 44 ILE HD1 . 17943 1 493 . 1 1 44 44 ILE HD13 H 1 0.770 0.020 . 1 . . . . 44 ILE HD1 . 17943 1 494 . 1 1 44 44 ILE C C 13 178.500 0.200 . 1 . . . . 44 ILE C . 17943 1 495 . 1 1 44 44 ILE CA C 13 64.900 0.200 . 1 . . . . 44 ILE CA . 17943 1 496 . 1 1 44 44 ILE CB C 13 38.100 0.200 . 1 . . . . 44 ILE CB . 17943 1 497 . 1 1 44 44 ILE CG1 C 13 29.800 0.200 . 1 . . . . 44 ILE CG1 . 17943 1 498 . 1 1 44 44 ILE CG2 C 13 18.100 0.200 . 1 . . . . 44 ILE CG2 . 17943 1 499 . 1 1 44 44 ILE CD1 C 13 14.000 0.200 . 1 . . . . 44 ILE CD1 . 17943 1 500 . 1 1 44 44 ILE N N 15 123.800 0.200 . 1 . . . . 44 ILE N . 17943 1 501 . 1 1 45 45 TRP H H 1 9.450 0.020 . 1 . . . . 45 TRP H . 17943 1 502 . 1 1 45 45 TRP HA H 1 4.340 0.020 . 1 . . . . 45 TRP HA . 17943 1 503 . 1 1 45 45 TRP HB2 H 1 3.400 0.020 . 2 . . . . 45 TRP HB2 . 17943 1 504 . 1 1 45 45 TRP HB3 H 1 3.150 0.020 . 2 . . . . 45 TRP HB3 . 17943 1 505 . 1 1 45 45 TRP HD1 H 1 6.760 0.020 . 1 . . . . 45 TRP HD1 . 17943 1 506 . 1 1 45 45 TRP HE1 H 1 10.220 0.020 . 1 . . . . 45 TRP HE1 . 17943 1 507 . 1 1 45 45 TRP HZ2 H 1 7.130 0.020 . 1 . . . . 45 TRP HZ2 . 17943 1 508 . 1 1 45 45 TRP HH2 H 1 7.370 0.020 . 1 . . . . 45 TRP HH2 . 17943 1 509 . 1 1 45 45 TRP C C 13 177.700 0.200 . 1 . . . . 45 TRP C . 17943 1 510 . 1 1 45 45 TRP CA C 13 60.200 0.200 . 1 . . . . 45 TRP CA . 17943 1 511 . 1 1 45 45 TRP CB C 13 28.500 0.200 . 1 . . . . 45 TRP CB . 17943 1 512 . 1 1 45 45 TRP CD1 C 13 122.600 0.200 . 1 . . . . 45 TRP CD1 . 17943 1 513 . 1 1 45 45 TRP CZ2 C 13 114.500 0.200 . 1 . . . . 45 TRP CZ2 . 17943 1 514 . 1 1 45 45 TRP CH2 C 13 124.500 0.200 . 1 . . . . 45 TRP CH2 . 17943 1 515 . 1 1 45 45 TRP N N 15 121.400 0.200 . 1 . . . . 45 TRP N . 17943 1 516 . 1 1 45 45 TRP NE1 N 15 127.400 0.200 . 1 . . . . 45 TRP NE1 . 17943 1 517 . 1 1 46 46 ALA H H 1 8.520 0.020 . 1 . . . . 46 ALA H . 17943 1 518 . 1 1 46 46 ALA HA H 1 3.900 0.020 . 1 . . . . 46 ALA HA . 17943 1 519 . 1 1 46 46 ALA HB1 H 1 1.620 0.020 . 1 . . . . 46 ALA HB . 17943 1 520 . 1 1 46 46 ALA HB2 H 1 1.620 0.020 . 1 . . . . 46 ALA HB . 17943 1 521 . 1 1 46 46 ALA HB3 H 1 1.620 0.020 . 1 . . . . 46 ALA HB . 17943 1 522 . 1 1 46 46 ALA C C 13 179.500 0.200 . 1 . . . . 46 ALA C . 17943 1 523 . 1 1 46 46 ALA CA C 13 56.100 0.200 . 1 . . . . 46 ALA CA . 17943 1 524 . 1 1 46 46 ALA CB C 13 17.600 0.200 . 1 . . . . 46 ALA CB . 17943 1 525 . 1 1 46 46 ALA N N 15 120.100 0.200 . 1 . . . . 46 ALA N . 17943 1 526 . 1 1 47 47 GLU H H 1 7.440 0.020 . 1 . . . . 47 GLU H . 17943 1 527 . 1 1 47 47 GLU HA H 1 4.160 0.020 . 1 . . . . 47 GLU HA . 17943 1 528 . 1 1 47 47 GLU HB2 H 1 2.330 0.020 . 2 . . . . 47 GLU HB2 . 17943 1 529 . 1 1 47 47 GLU HB3 H 1 2.260 0.020 . 2 . . . . 47 GLU HB3 . 17943 1 530 . 1 1 47 47 GLU HG2 H 1 2.590 0.020 . 2 . . . . 47 GLU HG2 . 17943 1 531 . 1 1 47 47 GLU HG3 H 1 2.590 0.020 . 2 . . . . 47 GLU HG3 . 17943 1 532 . 1 1 47 47 GLU C C 13 180.000 0.200 . 1 . . . . 47 GLU C . 17943 1 533 . 1 1 47 47 GLU CA C 13 59.400 0.200 . 1 . . . . 47 GLU CA . 17943 1 534 . 1 1 47 47 GLU CB C 13 30.100 0.200 . 1 . . . . 47 GLU CB . 17943 1 535 . 1 1 47 47 GLU CG C 13 36.400 0.200 . 1 . . . . 47 GLU CG . 17943 1 536 . 1 1 47 47 GLU N N 15 116.100 0.200 . 1 . . . . 47 GLU N . 17943 1 537 . 1 1 48 48 VAL H H 1 8.320 0.020 . 1 . . . . 48 VAL H . 17943 1 538 . 1 1 48 48 VAL HA H 1 3.960 0.020 . 1 . . . . 48 VAL HA . 17943 1 539 . 1 1 48 48 VAL HB H 1 2.160 0.020 . 1 . . . . 48 VAL HB . 17943 1 540 . 1 1 48 48 VAL HG11 H 1 1.100 0.020 . 2 . . . . 48 VAL HG1 . 17943 1 541 . 1 1 48 48 VAL HG12 H 1 1.100 0.020 . 2 . . . . 48 VAL HG1 . 17943 1 542 . 1 1 48 48 VAL HG13 H 1 1.100 0.020 . 2 . . . . 48 VAL HG1 . 17943 1 543 . 1 1 48 48 VAL HG21 H 1 1.000 0.020 . 2 . . . . 48 VAL HG2 . 17943 1 544 . 1 1 48 48 VAL HG22 H 1 1.000 0.020 . 2 . . . . 48 VAL HG2 . 17943 1 545 . 1 1 48 48 VAL HG23 H 1 1.000 0.020 . 2 . . . . 48 VAL HG2 . 17943 1 546 . 1 1 48 48 VAL C C 13 177.300 0.200 . 1 . . . . 48 VAL C . 17943 1 547 . 1 1 48 48 VAL CA C 13 65.200 0.200 . 1 . . . . 48 VAL CA . 17943 1 548 . 1 1 48 48 VAL CB C 13 32.200 0.200 . 1 . . . . 48 VAL CB . 17943 1 549 . 1 1 48 48 VAL CG1 C 13 21.800 0.200 . 2 . . . . 48 VAL CG1 . 17943 1 550 . 1 1 48 48 VAL CG2 C 13 21.800 0.200 . 2 . . . . 48 VAL CG2 . 17943 1 551 . 1 1 48 48 VAL N N 15 116.400 0.200 . 1 . . . . 48 VAL N . 17943 1 552 . 1 1 49 49 LEU H H 1 8.610 0.020 . 1 . . . . 49 LEU H . 17943 1 553 . 1 1 49 49 LEU HA H 1 3.980 0.020 . 1 . . . . 49 LEU HA . 17943 1 554 . 1 1 49 49 LEU HB2 H 1 1.650 0.020 . 2 . . . . 49 LEU HB2 . 17943 1 555 . 1 1 49 49 LEU HB3 H 1 1.270 0.020 . 2 . . . . 49 LEU HB3 . 17943 1 556 . 1 1 49 49 LEU HG H 1 1.310 0.020 . 1 . . . . 49 LEU HG . 17943 1 557 . 1 1 49 49 LEU HD11 H 1 0.370 0.020 . 2 . . . . 49 LEU HD1 . 17943 1 558 . 1 1 49 49 LEU HD12 H 1 0.370 0.020 . 2 . . . . 49 LEU HD1 . 17943 1 559 . 1 1 49 49 LEU HD13 H 1 0.370 0.020 . 2 . . . . 49 LEU HD1 . 17943 1 560 . 1 1 49 49 LEU HD21 H 1 -0.080 0.020 . 2 . . . . 49 LEU HD2 . 17943 1 561 . 1 1 49 49 LEU HD22 H 1 -0.080 0.020 . 2 . . . . 49 LEU HD2 . 17943 1 562 . 1 1 49 49 LEU HD23 H 1 -0.080 0.020 . 2 . . . . 49 LEU HD2 . 17943 1 563 . 1 1 49 49 LEU C C 13 176.000 0.200 . 1 . . . . 49 LEU C . 17943 1 564 . 1 1 49 49 LEU CA C 13 55.000 0.200 . 1 . . . . 49 LEU CA . 17943 1 565 . 1 1 49 49 LEU CB C 13 42.000 0.200 . 1 . . . . 49 LEU CB . 17943 1 566 . 1 1 49 49 LEU CG C 13 26.700 0.200 . 1 . . . . 49 LEU CG . 17943 1 567 . 1 1 49 49 LEU CD1 C 13 25.700 0.200 . 2 . . . . 49 LEU CD1 . 17943 1 568 . 1 1 49 49 LEU CD2 C 13 21.300 0.200 . 2 . . . . 49 LEU CD2 . 17943 1 569 . 1 1 49 49 LEU N N 15 117.600 0.200 . 1 . . . . 49 LEU N . 17943 1 570 . 1 1 50 50 GLU H H 1 7.590 0.020 . 1 . . . . 50 GLU H . 17943 1 571 . 1 1 50 50 GLU HA H 1 3.880 0.020 . 1 . . . . 50 GLU HA . 17943 1 572 . 1 1 50 50 GLU HB2 H 1 2.090 0.020 . 2 . . . . 50 GLU HB2 . 17943 1 573 . 1 1 50 50 GLU HB3 H 1 2.090 0.020 . 2 . . . . 50 GLU HB3 . 17943 1 574 . 1 1 50 50 GLU HG2 H 1 2.220 0.020 . 2 . . . . 50 GLU HG2 . 17943 1 575 . 1 1 50 50 GLU HG3 H 1 2.160 0.020 . 2 . . . . 50 GLU HG3 . 17943 1 576 . 1 1 50 50 GLU C C 13 174.600 0.200 . 1 . . . . 50 GLU C . 17943 1 577 . 1 1 50 50 GLU CA C 13 57.200 0.200 . 1 . . . . 50 GLU CA . 17943 1 578 . 1 1 50 50 GLU CB C 13 26.800 0.200 . 1 . . . . 50 GLU CB . 17943 1 579 . 1 1 50 50 GLU CG C 13 36.500 0.200 . 1 . . . . 50 GLU CG . 17943 1 580 . 1 1 50 50 GLU N N 15 117.200 0.200 . 1 . . . . 50 GLU N . 17943 1 581 . 1 1 51 51 ALA H H 1 8.400 0.020 . 1 . . . . 51 ALA H . 17943 1 582 . 1 1 51 51 ALA HA H 1 4.720 0.020 . 1 . . . . 51 ALA HA . 17943 1 583 . 1 1 51 51 ALA HB1 H 1 1.200 0.020 . 1 . . . . 51 ALA HB . 17943 1 584 . 1 1 51 51 ALA HB2 H 1 1.200 0.020 . 1 . . . . 51 ALA HB . 17943 1 585 . 1 1 51 51 ALA HB3 H 1 1.200 0.020 . 1 . . . . 51 ALA HB . 17943 1 586 . 1 1 51 51 ALA C C 13 175.900 0.200 . 1 . . . . 51 ALA C . 17943 1 587 . 1 1 51 51 ALA CA C 13 50.000 0.200 . 1 . . . . 51 ALA CA . 17943 1 588 . 1 1 51 51 ALA CB C 13 22.700 0.200 . 1 . . . . 51 ALA CB . 17943 1 589 . 1 1 51 51 ALA N N 15 121.800 0.200 . 1 . . . . 51 ALA N . 17943 1 590 . 1 1 52 52 ASP H H 1 8.380 0.020 . 1 . . . . 52 ASP H . 17943 1 591 . 1 1 52 52 ASP HA H 1 4.610 0.020 . 1 . . . . 52 ASP HA . 17943 1 592 . 1 1 52 52 ASP HB2 H 1 2.730 0.020 . 2 . . . . 52 ASP HB2 . 17943 1 593 . 1 1 52 52 ASP HB3 H 1 2.630 0.020 . 2 . . . . 52 ASP HB3 . 17943 1 594 . 1 1 52 52 ASP C C 13 178.600 0.200 . 1 . . . . 52 ASP C . 17943 1 595 . 1 1 52 52 ASP CA C 13 53.800 0.200 . 1 . . . . 52 ASP CA . 17943 1 596 . 1 1 52 52 ASP CB C 13 41.500 0.200 . 1 . . . . 52 ASP CB . 17943 1 597 . 1 1 52 52 ASP CG C 13 179.800 0.200 . 1 . . . . 52 ASP CG . 17943 1 598 . 1 1 52 52 ASP N N 15 119.000 0.200 . 1 . . . . 52 ASP N . 17943 1 599 . 1 1 53 53 ALA H H 1 9.250 0.020 . 1 . . . . 53 ALA H . 17943 1 600 . 1 1 53 53 ALA HA H 1 3.790 0.020 . 1 . . . . 53 ALA HA . 17943 1 601 . 1 1 53 53 ALA HB1 H 1 1.380 0.020 . 1 . . . . 53 ALA HB . 17943 1 602 . 1 1 53 53 ALA HB2 H 1 1.380 0.020 . 1 . . . . 53 ALA HB . 17943 1 603 . 1 1 53 53 ALA HB3 H 1 1.380 0.020 . 1 . . . . 53 ALA HB . 17943 1 604 . 1 1 53 53 ALA C C 13 179.200 0.200 . 1 . . . . 53 ALA C . 17943 1 605 . 1 1 53 53 ALA CA C 13 56.300 0.200 . 1 . . . . 53 ALA CA . 17943 1 606 . 1 1 53 53 ALA CB C 13 18.200 0.200 . 1 . . . . 53 ALA CB . 17943 1 607 . 1 1 53 53 ALA N N 15 130.700 0.200 . 1 . . . . 53 ALA N . 17943 1 608 . 1 1 54 54 GLU H H 1 8.520 0.020 . 1 . . . . 54 GLU H . 17943 1 609 . 1 1 54 54 GLU HA H 1 3.970 0.020 . 1 . . . . 54 GLU HA . 17943 1 610 . 1 1 54 54 GLU HB2 H 1 2.060 0.020 . 2 . . . . 54 GLU HB2 . 17943 1 611 . 1 1 54 54 GLU HB3 H 1 2.010 0.020 . 2 . . . . 54 GLU HB3 . 17943 1 612 . 1 1 54 54 GLU HG2 H 1 2.340 0.020 . 2 . . . . 54 GLU HG2 . 17943 1 613 . 1 1 54 54 GLU HG3 H 1 2.300 0.020 . 2 . . . . 54 GLU HG3 . 17943 1 614 . 1 1 54 54 GLU C C 13 177.700 0.200 . 1 . . . . 54 GLU C . 17943 1 615 . 1 1 54 54 GLU CA C 13 58.400 0.200 . 1 . . . . 54 GLU CA . 17943 1 616 . 1 1 54 54 GLU CB C 13 29.200 0.200 . 1 . . . . 54 GLU CB . 17943 1 617 . 1 1 54 54 GLU CG C 13 36.700 0.200 . 1 . . . . 54 GLU CG . 17943 1 618 . 1 1 54 54 GLU N N 15 113.300 0.200 . 1 . . . . 54 GLU N . 17943 1 619 . 1 1 55 55 SER H H 1 7.880 0.020 . 1 . . . . 55 SER H . 17943 1 620 . 1 1 55 55 SER HA H 1 4.430 0.020 . 1 . . . . 55 SER HA . 17943 1 621 . 1 1 55 55 SER HB2 H 1 4.090 0.020 . 2 . . . . 55 SER HB2 . 17943 1 622 . 1 1 55 55 SER HB3 H 1 3.990 0.020 . 2 . . . . 55 SER HB3 . 17943 1 623 . 1 1 55 55 SER C C 13 173.500 0.200 . 1 . . . . 55 SER C . 17943 1 624 . 1 1 55 55 SER CA C 13 59.400 0.200 . 1 . . . . 55 SER CA . 17943 1 625 . 1 1 55 55 SER CB C 13 64.200 0.200 . 1 . . . . 55 SER CB . 17943 1 626 . 1 1 55 55 SER N N 15 113.700 0.200 . 1 . . . . 55 SER N . 17943 1 627 . 1 1 56 56 ILE H H 1 7.640 0.020 . 1 . . . . 56 ILE H . 17943 1 628 . 1 1 56 56 ILE HA H 1 4.000 0.020 . 1 . . . . 56 ILE HA . 17943 1 629 . 1 1 56 56 ILE HB H 1 2.020 0.020 . 1 . . . . 56 ILE HB . 17943 1 630 . 1 1 56 56 ILE HG12 H 1 1.780 0.020 . 2 . . . . 56 ILE HG12 . 17943 1 631 . 1 1 56 56 ILE HG13 H 1 1.780 0.020 . 2 . . . . 56 ILE HG13 . 17943 1 632 . 1 1 56 56 ILE HG21 H 1 0.780 0.020 . 1 . . . . 56 ILE HG2 . 17943 1 633 . 1 1 56 56 ILE HG22 H 1 0.780 0.020 . 1 . . . . 56 ILE HG2 . 17943 1 634 . 1 1 56 56 ILE HG23 H 1 0.780 0.020 . 1 . . . . 56 ILE HG2 . 17943 1 635 . 1 1 56 56 ILE HD11 H 1 0.900 0.020 . 1 . . . . 56 ILE HD1 . 17943 1 636 . 1 1 56 56 ILE HD12 H 1 0.900 0.020 . 1 . . . . 56 ILE HD1 . 17943 1 637 . 1 1 56 56 ILE HD13 H 1 0.900 0.020 . 1 . . . . 56 ILE HD1 . 17943 1 638 . 1 1 56 56 ILE C C 13 173.400 0.200 . 1 . . . . 56 ILE C . 17943 1 639 . 1 1 56 56 ILE CA C 13 60.900 0.200 . 1 . . . . 56 ILE CA . 17943 1 640 . 1 1 56 56 ILE CB C 13 38.100 0.200 . 1 . . . . 56 ILE CB . 17943 1 641 . 1 1 56 56 ILE CG1 C 13 26.000 0.200 . 1 . . . . 56 ILE CG1 . 17943 1 642 . 1 1 56 56 ILE CG2 C 13 17.500 0.200 . 1 . . . . 56 ILE CG2 . 17943 1 643 . 1 1 56 56 ILE CD1 C 13 13.900 0.200 . 1 . . . . 56 ILE CD1 . 17943 1 644 . 1 1 56 56 ILE N N 15 123.500 0.200 . 1 . . . . 56 ILE N . 17943 1 645 . 1 1 57 57 ASP H H 1 8.520 0.020 . 1 . . . . 57 ASP H . 17943 1 646 . 1 1 57 57 ASP HA H 1 4.660 0.020 . 1 . . . . 57 ASP HA . 17943 1 647 . 1 1 57 57 ASP HB2 H 1 2.640 0.020 . 2 . . . . 57 ASP HB2 . 17943 1 648 . 1 1 57 57 ASP HB3 H 1 2.640 0.020 . 2 . . . . 57 ASP HB3 . 17943 1 649 . 1 1 57 57 ASP C C 13 178.700 0.200 . 1 . . . . 57 ASP C . 17943 1 650 . 1 1 57 57 ASP CA C 13 54.100 0.200 . 1 . . . . 57 ASP CA . 17943 1 651 . 1 1 57 57 ASP CB C 13 43.300 0.200 . 1 . . . . 57 ASP CB . 17943 1 652 . 1 1 57 57 ASP CG C 13 180.300 0.200 . 1 . . . . 57 ASP CG . 17943 1 653 . 1 1 57 57 ASP N N 15 128.700 0.200 . 1 . . . . 57 ASP N . 17943 1 654 . 1 1 58 58 VAL H H 1 8.790 0.020 . 1 . . . . 58 VAL H . 17943 1 655 . 1 1 58 58 VAL HA H 1 3.460 0.020 . 1 . . . . 58 VAL HA . 17943 1 656 . 1 1 58 58 VAL HB H 1 1.770 0.020 . 1 . . . . 58 VAL HB . 17943 1 657 . 1 1 58 58 VAL HG11 H 1 0.660 0.020 . 2 . . . . 58 VAL HG1 . 17943 1 658 . 1 1 58 58 VAL HG12 H 1 0.660 0.020 . 2 . . . . 58 VAL HG1 . 17943 1 659 . 1 1 58 58 VAL HG13 H 1 0.660 0.020 . 2 . . . . 58 VAL HG1 . 17943 1 660 . 1 1 58 58 VAL HG21 H 1 0.570 0.020 . 2 . . . . 58 VAL HG2 . 17943 1 661 . 1 1 58 58 VAL HG22 H 1 0.570 0.020 . 2 . . . . 58 VAL HG2 . 17943 1 662 . 1 1 58 58 VAL HG23 H 1 0.570 0.020 . 2 . . . . 58 VAL HG2 . 17943 1 663 . 1 1 58 58 VAL C C 13 174.800 0.200 . 1 . . . . 58 VAL C . 17943 1 664 . 1 1 58 58 VAL CA C 13 65.500 0.200 . 1 . . . . 58 VAL CA . 17943 1 665 . 1 1 58 58 VAL CB C 13 32.000 0.200 . 1 . . . . 58 VAL CB . 17943 1 666 . 1 1 58 58 VAL CG1 C 13 21.700 0.200 . 2 . . . . 58 VAL CG1 . 17943 1 667 . 1 1 58 58 VAL CG2 C 13 19.000 0.200 . 2 . . . . 58 VAL CG2 . 17943 1 668 . 1 1 58 58 VAL N N 15 121.700 0.200 . 1 . . . . 58 VAL N . 17943 1 669 . 1 1 59 59 HIS H H 1 8.190 0.020 . 1 . . . . 59 HIS H . 17943 1 670 . 1 1 59 59 HIS HA H 1 4.610 0.020 . 1 . . . . 59 HIS HA . 17943 1 671 . 1 1 59 59 HIS HB2 H 1 3.320 0.020 . 2 . . . . 59 HIS HB2 . 17943 1 672 . 1 1 59 59 HIS HB3 H 1 3.170 0.020 . 2 . . . . 59 HIS HB3 . 17943 1 673 . 1 1 59 59 HIS C C 13 176.500 0.200 . 1 . . . . 59 HIS C . 17943 1 674 . 1 1 59 59 HIS CA C 13 58.200 0.200 . 1 . . . . 59 HIS CA . 17943 1 675 . 1 1 59 59 HIS CB C 13 30.300 0.200 . 1 . . . . 59 HIS CB . 17943 1 676 . 1 1 59 59 HIS N N 15 113.500 0.200 . 1 . . . . 59 HIS N . 17943 1 677 . 1 1 60 60 ARG H H 1 8.680 0.020 . 1 . . . . 60 ARG H . 17943 1 678 . 1 1 60 60 ARG HA H 1 4.690 0.020 . 1 . . . . 60 ARG HA . 17943 1 679 . 1 1 60 60 ARG HB2 H 1 2.050 0.020 . 2 . . . . 60 ARG HB2 . 17943 1 680 . 1 1 60 60 ARG HB3 H 1 1.610 0.020 . 2 . . . . 60 ARG HB3 . 17943 1 681 . 1 1 60 60 ARG HG2 H 1 1.610 0.020 . 2 . . . . 60 ARG HG2 . 17943 1 682 . 1 1 60 60 ARG HG3 H 1 1.610 0.020 . 2 . . . . 60 ARG HG3 . 17943 1 683 . 1 1 60 60 ARG HD2 H 1 3.220 0.020 . 2 . . . . 60 ARG HD2 . 17943 1 684 . 1 1 60 60 ARG HD3 H 1 3.220 0.020 . 2 . . . . 60 ARG HD3 . 17943 1 685 . 1 1 60 60 ARG C C 13 177.000 0.200 . 1 . . . . 60 ARG C . 17943 1 686 . 1 1 60 60 ARG CA C 13 55.500 0.200 . 1 . . . . 60 ARG CA . 17943 1 687 . 1 1 60 60 ARG CB C 13 32.700 0.200 . 1 . . . . 60 ARG CB . 17943 1 688 . 1 1 60 60 ARG CG C 13 27.500 0.200 . 1 . . . . 60 ARG CG . 17943 1 689 . 1 1 60 60 ARG CD C 13 43.200 0.200 . 1 . . . . 60 ARG CD . 17943 1 690 . 1 1 60 60 ARG N N 15 116.100 0.200 . 1 . . . . 60 ARG N . 17943 1 691 . 1 1 61 61 GLY H H 1 8.620 0.020 . 1 . . . . 61 GLY H . 17943 1 692 . 1 1 61 61 GLY HA2 H 1 4.130 0.020 . 2 . . . . 61 GLY HA2 . 17943 1 693 . 1 1 61 61 GLY HA3 H 1 3.660 0.020 . 2 . . . . 61 GLY HA3 . 17943 1 694 . 1 1 61 61 GLY C C 13 170.100 0.200 . 1 . . . . 61 GLY C . 17943 1 695 . 1 1 61 61 GLY CA C 13 46.900 0.200 . 1 . . . . 61 GLY CA . 17943 1 696 . 1 1 61 61 GLY N N 15 112.900 0.200 . 1 . . . . 61 GLY N . 17943 1 697 . 1 1 62 62 ASP H H 1 8.090 0.020 . 1 . . . . 62 ASP H . 17943 1 698 . 1 1 62 62 ASP HA H 1 5.260 0.020 . 1 . . . . 62 ASP HA . 17943 1 699 . 1 1 62 62 ASP HB2 H 1 2.910 0.020 . 2 . . . . 62 ASP HB2 . 17943 1 700 . 1 1 62 62 ASP HB3 H 1 2.440 0.020 . 2 . . . . 62 ASP HB3 . 17943 1 701 . 1 1 62 62 ASP C C 13 175.900 0.200 . 1 . . . . 62 ASP C . 17943 1 702 . 1 1 62 62 ASP CA C 13 52.400 0.200 . 1 . . . . 62 ASP CA . 17943 1 703 . 1 1 62 62 ASP CB C 13 44.400 0.200 . 1 . . . . 62 ASP CB . 17943 1 704 . 1 1 62 62 ASP N N 15 123.300 0.200 . 1 . . . . 62 ASP N . 17943 1 705 . 1 1 63 63 PHE H H 1 9.210 0.020 . 1 . . . . 63 PHE H . 17943 1 706 . 1 1 63 63 PHE HA H 1 3.180 0.020 . 1 . . . . 63 PHE HA . 17943 1 707 . 1 1 63 63 PHE HB2 H 1 2.570 0.020 . 2 . . . . 63 PHE HB2 . 17943 1 708 . 1 1 63 63 PHE HB3 H 1 2.320 0.020 . 2 . . . . 63 PHE HB3 . 17943 1 709 . 1 1 63 63 PHE C C 13 175.600 0.200 . 1 . . . . 63 PHE C . 17943 1 710 . 1 1 63 63 PHE CA C 13 62.400 0.200 . 1 . . . . 63 PHE CA . 17943 1 711 . 1 1 63 63 PHE CB C 13 40.900 0.200 . 1 . . . . 63 PHE CB . 17943 1 712 . 1 1 63 63 PHE N N 15 124.700 0.200 . 1 . . . . 63 PHE N . 17943 1 713 . 1 1 64 64 PHE H H 1 7.770 0.020 . 1 . . . . 64 PHE H . 17943 1 714 . 1 1 64 64 PHE HA H 1 4.090 0.020 . 1 . . . . 64 PHE HA . 17943 1 715 . 1 1 64 64 PHE HB2 H 1 3.190 0.020 . 2 . . . . 64 PHE HB2 . 17943 1 716 . 1 1 64 64 PHE HB3 H 1 3.190 0.020 . 2 . . . . 64 PHE HB3 . 17943 1 717 . 1 1 64 64 PHE HD1 H 1 7.370 0.020 . 3 . . . . 64 PHE HD1 . 17943 1 718 . 1 1 64 64 PHE HD2 H 1 7.370 0.020 . 3 . . . . 64 PHE HD2 . 17943 1 719 . 1 1 64 64 PHE C C 13 180.300 0.200 . 1 . . . . 64 PHE C . 17943 1 720 . 1 1 64 64 PHE CA C 13 60.100 0.200 . 1 . . . . 64 PHE CA . 17943 1 721 . 1 1 64 64 PHE CB C 13 37.800 0.200 . 1 . . . . 64 PHE CB . 17943 1 722 . 1 1 64 64 PHE CD1 C 13 132.400 0.200 . 3 . . . . 64 PHE CD1 . 17943 1 723 . 1 1 64 64 PHE CD2 C 13 132.400 0.200 . 3 . . . . 64 PHE CD2 . 17943 1 724 . 1 1 64 64 PHE N N 15 113.700 0.200 . 1 . . . . 64 PHE N . 17943 1 725 . 1 1 65 65 GLU H H 1 8.950 0.020 . 1 . . . . 65 GLU H . 17943 1 726 . 1 1 65 65 GLU HA H 1 4.110 0.020 . 1 . . . . 65 GLU HA . 17943 1 727 . 1 1 65 65 GLU HB2 H 1 2.200 0.020 . 2 . . . . 65 GLU HB2 . 17943 1 728 . 1 1 65 65 GLU HB3 H 1 2.200 0.020 . 2 . . . . 65 GLU HB3 . 17943 1 729 . 1 1 65 65 GLU HG2 H 1 2.350 0.020 . 2 . . . . 65 GLU HG2 . 17943 1 730 . 1 1 65 65 GLU HG3 H 1 2.470 0.020 . 2 . . . . 65 GLU HG3 . 17943 1 731 . 1 1 65 65 GLU C C 13 179.300 0.200 . 1 . . . . 65 GLU C . 17943 1 732 . 1 1 65 65 GLU CA C 13 59.400 0.200 . 1 . . . . 65 GLU CA . 17943 1 733 . 1 1 65 65 GLU CB C 13 29.700 0.200 . 1 . . . . 65 GLU CB . 17943 1 734 . 1 1 65 65 GLU CG C 13 36.400 0.200 . 1 . . . . 65 GLU CG . 17943 1 735 . 1 1 65 65 GLU CD C 13 183.400 0.200 . 1 . . . . 65 GLU CD . 17943 1 736 . 1 1 65 65 GLU N N 15 126.000 0.200 . 1 . . . . 65 GLU N . 17943 1 737 . 1 1 66 66 LEU H H 1 7.910 0.020 . 1 . . . . 66 LEU H . 17943 1 738 . 1 1 66 66 LEU HA H 1 4.180 0.020 . 1 . . . . 66 LEU HA . 17943 1 739 . 1 1 66 66 LEU HB2 H 1 1.750 0.020 . 2 . . . . 66 LEU HB2 . 17943 1 740 . 1 1 66 66 LEU HB3 H 1 1.530 0.020 . 2 . . . . 66 LEU HB3 . 17943 1 741 . 1 1 66 66 LEU HG H 1 1.560 0.020 . 1 . . . . 66 LEU HG . 17943 1 742 . 1 1 66 66 LEU HD11 H 1 0.890 0.020 . 2 . . . . 66 LEU HD1 . 17943 1 743 . 1 1 66 66 LEU HD12 H 1 0.890 0.020 . 2 . . . . 66 LEU HD1 . 17943 1 744 . 1 1 66 66 LEU HD13 H 1 0.890 0.020 . 2 . . . . 66 LEU HD1 . 17943 1 745 . 1 1 66 66 LEU HD21 H 1 0.810 0.020 . 2 . . . . 66 LEU HD2 . 17943 1 746 . 1 1 66 66 LEU HD22 H 1 0.810 0.020 . 2 . . . . 66 LEU HD2 . 17943 1 747 . 1 1 66 66 LEU HD23 H 1 0.810 0.020 . 2 . . . . 66 LEU HD2 . 17943 1 748 . 1 1 66 66 LEU C C 13 176.000 0.200 . 1 . . . . 66 LEU C . 17943 1 749 . 1 1 66 66 LEU CA C 13 55.500 0.200 . 1 . . . . 66 LEU CA . 17943 1 750 . 1 1 66 66 LEU CB C 13 43.000 0.200 . 1 . . . . 66 LEU CB . 17943 1 751 . 1 1 66 66 LEU CG C 13 26.500 0.200 . 1 . . . . 66 LEU CG . 17943 1 752 . 1 1 66 66 LEU CD1 C 13 23.000 0.200 . 2 . . . . 66 LEU CD1 . 17943 1 753 . 1 1 66 66 LEU CD2 C 13 23.100 0.200 . 2 . . . . 66 LEU CD2 . 17943 1 754 . 1 1 66 66 LEU N N 15 116.900 0.200 . 1 . . . . 66 LEU N . 17943 1 755 . 1 1 67 67 GLY H H 1 7.500 0.020 . 1 . . . . 67 GLY H . 17943 1 756 . 1 1 67 67 GLY HA2 H 1 4.370 0.020 . 2 . . . . 67 GLY HA2 . 17943 1 757 . 1 1 67 67 GLY HA3 H 1 3.670 0.020 . 2 . . . . 67 GLY HA3 . 17943 1 758 . 1 1 67 67 GLY C C 13 175.000 0.200 . 1 . . . . 67 GLY C . 17943 1 759 . 1 1 67 67 GLY CA C 13 44.500 0.200 . 1 . . . . 67 GLY CA . 17943 1 760 . 1 1 67 67 GLY N N 15 105.200 0.200 . 1 . . . . 67 GLY N . 17943 1 761 . 1 1 68 68 GLY H H 1 8.140 0.020 . 1 . . . . 68 GLY H . 17943 1 762 . 1 1 68 68 GLY HA2 H 1 3.090 0.020 . 2 . . . . 68 GLY HA2 . 17943 1 763 . 1 1 68 68 GLY HA3 H 1 2.250 0.020 . 2 . . . . 68 GLY HA3 . 17943 1 764 . 1 1 68 68 GLY C C 13 170.300 0.200 . 1 . . . . 68 GLY C . 17943 1 765 . 1 1 68 68 GLY CA C 13 45.300 0.200 . 1 . . . . 68 GLY CA . 17943 1 766 . 1 1 68 68 GLY N N 15 108.800 0.200 . 1 . . . . 68 GLY N . 17943 1 767 . 1 1 69 69 TYR H H 1 6.070 0.020 . 1 . . . . 69 TYR H . 17943 1 768 . 1 1 69 69 TYR HA H 1 5.170 0.020 . 1 . . . . 69 TYR HA . 17943 1 769 . 1 1 69 69 TYR HB2 H 1 3.510 0.020 . 2 . . . . 69 TYR HB2 . 17943 1 770 . 1 1 69 69 TYR HB3 H 1 3.350 0.020 . 2 . . . . 69 TYR HB3 . 17943 1 771 . 1 1 69 69 TYR HD1 H 1 7.320 0.020 . 3 . . . . 69 TYR HD1 . 17943 1 772 . 1 1 69 69 TYR HD2 H 1 7.320 0.020 . 3 . . . . 69 TYR HD2 . 17943 1 773 . 1 1 69 69 TYR HE1 H 1 6.900 0.020 . 3 . . . . 69 TYR HE1 . 17943 1 774 . 1 1 69 69 TYR HE2 H 1 6.900 0.020 . 3 . . . . 69 TYR HE2 . 17943 1 775 . 1 1 69 69 TYR C C 13 177.100 0.200 . 1 . . . . 69 TYR C . 17943 1 776 . 1 1 69 69 TYR CA C 13 55.700 0.200 . 1 . . . . 69 TYR CA . 17943 1 777 . 1 1 69 69 TYR CB C 13 38.500 0.200 . 1 . . . . 69 TYR CB . 17943 1 778 . 1 1 69 69 TYR CD1 C 13 134.300 0.200 . 3 . . . . 69 TYR CD1 . 17943 1 779 . 1 1 69 69 TYR CD2 C 13 134.300 0.200 . 3 . . . . 69 TYR CD2 . 17943 1 780 . 1 1 69 69 TYR CE1 C 13 118.600 0.200 . 3 . . . . 69 TYR CE1 . 17943 1 781 . 1 1 69 69 TYR CE2 C 13 118.600 0.200 . 3 . . . . 69 TYR CE2 . 17943 1 782 . 1 1 69 69 TYR N N 15 110.900 0.200 . 1 . . . . 69 TYR N . 17943 1 783 . 1 1 70 70 SER H H 1 9.700 0.020 . 1 . . . . 70 SER H . 17943 1 784 . 1 1 70 70 SER HA H 1 4.120 0.020 . 1 . . . . 70 SER HA . 17943 1 785 . 1 1 70 70 SER HB2 H 1 4.180 0.020 . 2 . . . . 70 SER HB2 . 17943 1 786 . 1 1 70 70 SER HB3 H 1 4.180 0.020 . 2 . . . . 70 SER HB3 . 17943 1 787 . 1 1 70 70 SER C C 13 175.900 0.200 . 1 . . . . 70 SER C . 17943 1 788 . 1 1 70 70 SER CA C 13 64.200 0.200 . 1 . . . . 70 SER CA . 17943 1 789 . 1 1 70 70 SER CB C 13 62.400 0.200 . 1 . . . . 70 SER CB . 17943 1 790 . 1 1 70 70 SER N N 15 119.300 0.200 . 1 . . . . 70 SER N . 17943 1 791 . 1 1 71 71 LEU H H 1 8.200 0.020 . 1 . . . . 71 LEU H . 17943 1 792 . 1 1 71 71 LEU HA H 1 4.170 0.020 . 1 . . . . 71 LEU HA . 17943 1 793 . 1 1 71 71 LEU HB2 H 1 1.860 0.020 . 2 . . . . 71 LEU HB2 . 17943 1 794 . 1 1 71 71 LEU HB3 H 1 1.680 0.020 . 2 . . . . 71 LEU HB3 . 17943 1 795 . 1 1 71 71 LEU HG H 1 1.770 0.020 . 1 . . . . 71 LEU HG . 17943 1 796 . 1 1 71 71 LEU HD11 H 1 1.070 0.020 . 2 . . . . 71 LEU HD1 . 17943 1 797 . 1 1 71 71 LEU HD12 H 1 1.070 0.020 . 2 . . . . 71 LEU HD1 . 17943 1 798 . 1 1 71 71 LEU HD13 H 1 1.070 0.020 . 2 . . . . 71 LEU HD1 . 17943 1 799 . 1 1 71 71 LEU HD21 H 1 1.010 0.020 . 2 . . . . 71 LEU HD2 . 17943 1 800 . 1 1 71 71 LEU HD22 H 1 1.010 0.020 . 2 . . . . 71 LEU HD2 . 17943 1 801 . 1 1 71 71 LEU HD23 H 1 1.010 0.020 . 2 . . . . 71 LEU HD2 . 17943 1 802 . 1 1 71 71 LEU C C 13 179.400 0.200 . 1 . . . . 71 LEU C . 17943 1 803 . 1 1 71 71 LEU CA C 13 58.900 0.200 . 1 . . . . 71 LEU CA . 17943 1 804 . 1 1 71 71 LEU CB C 13 42.300 0.200 . 1 . . . . 71 LEU CB . 17943 1 805 . 1 1 71 71 LEU CG C 13 27.200 0.200 . 1 . . . . 71 LEU CG . 17943 1 806 . 1 1 71 71 LEU CD1 C 13 24.400 0.200 . 2 . . . . 71 LEU CD1 . 17943 1 807 . 1 1 71 71 LEU CD2 C 13 24.400 0.200 . 2 . . . . 71 LEU CD2 . 17943 1 808 . 1 1 71 71 LEU N N 15 119.600 0.200 . 1 . . . . 71 LEU N . 17943 1 809 . 1 1 72 72 LEU H H 1 6.260 0.020 . 1 . . . . 72 LEU H . 17943 1 810 . 1 1 72 72 LEU HA H 1 3.980 0.020 . 1 . . . . 72 LEU HA . 17943 1 811 . 1 1 72 72 LEU HB2 H 1 1.210 0.020 . 2 . . . . 72 LEU HB2 . 17943 1 812 . 1 1 72 72 LEU HB3 H 1 0.820 0.020 . 2 . . . . 72 LEU HB3 . 17943 1 813 . 1 1 72 72 LEU HG H 1 1.000 0.020 . 1 . . . . 72 LEU HG . 17943 1 814 . 1 1 72 72 LEU HD11 H 1 0.760 0.020 . 2 . . . . 72 LEU HD1 . 17943 1 815 . 1 1 72 72 LEU HD12 H 1 0.760 0.020 . 2 . . . . 72 LEU HD1 . 17943 1 816 . 1 1 72 72 LEU HD13 H 1 0.760 0.020 . 2 . . . . 72 LEU HD1 . 17943 1 817 . 1 1 72 72 LEU HD21 H 1 0.640 0.020 . 2 . . . . 72 LEU HD2 . 17943 1 818 . 1 1 72 72 LEU HD22 H 1 0.640 0.020 . 2 . . . . 72 LEU HD2 . 17943 1 819 . 1 1 72 72 LEU HD23 H 1 0.640 0.020 . 2 . . . . 72 LEU HD2 . 17943 1 820 . 1 1 72 72 LEU C C 13 178.700 0.200 . 1 . . . . 72 LEU C . 17943 1 821 . 1 1 72 72 LEU CA C 13 56.300 0.200 . 1 . . . . 72 LEU CA . 17943 1 822 . 1 1 72 72 LEU CB C 13 41.900 0.200 . 1 . . . . 72 LEU CB . 17943 1 823 . 1 1 72 72 LEU CG C 13 26.400 0.200 . 1 . . . . 72 LEU CG . 17943 1 824 . 1 1 72 72 LEU CD1 C 13 25.400 0.200 . 2 . . . . 72 LEU CD1 . 17943 1 825 . 1 1 72 72 LEU CD2 C 13 23.300 0.200 . 2 . . . . 72 LEU CD2 . 17943 1 826 . 1 1 72 72 LEU N N 15 117.200 0.200 . 1 . . . . 72 LEU N . 17943 1 827 . 1 1 73 73 ALA H H 1 8.080 0.020 . 1 . . . . 73 ALA H . 17943 1 828 . 1 1 73 73 ALA HA H 1 3.350 0.020 . 1 . . . . 73 ALA HA . 17943 1 829 . 1 1 73 73 ALA HB1 H 1 1.040 0.020 . 1 . . . . 73 ALA HB . 17943 1 830 . 1 1 73 73 ALA HB2 H 1 1.040 0.020 . 1 . . . . 73 ALA HB . 17943 1 831 . 1 1 73 73 ALA HB3 H 1 1.040 0.020 . 1 . . . . 73 ALA HB . 17943 1 832 . 1 1 73 73 ALA C C 13 179.300 0.200 . 1 . . . . 73 ALA C . 17943 1 833 . 1 1 73 73 ALA CA C 13 55.000 0.200 . 1 . . . . 73 ALA CA . 17943 1 834 . 1 1 73 73 ALA CB C 13 17.400 0.200 . 1 . . . . 73 ALA CB . 17943 1 835 . 1 1 73 73 ALA N N 15 121.900 0.200 . 1 . . . . 73 ALA N . 17943 1 836 . 1 1 74 74 LEU H H 1 7.700 0.020 . 1 . . . . 74 LEU H . 17943 1 837 . 1 1 74 74 LEU HA H 1 3.980 0.020 . 1 . . . . 74 LEU HA . 17943 1 838 . 1 1 74 74 LEU HB2 H 1 1.920 0.020 . 2 . . . . 74 LEU HB2 . 17943 1 839 . 1 1 74 74 LEU HB3 H 1 1.580 0.020 . 2 . . . . 74 LEU HB3 . 17943 1 840 . 1 1 74 74 LEU HG H 1 1.750 0.020 . 1 . . . . 74 LEU HG . 17943 1 841 . 1 1 74 74 LEU HD11 H 1 0.950 0.020 . 2 . . . . 74 LEU HD1 . 17943 1 842 . 1 1 74 74 LEU HD12 H 1 0.950 0.020 . 2 . . . . 74 LEU HD1 . 17943 1 843 . 1 1 74 74 LEU HD13 H 1 0.950 0.020 . 2 . . . . 74 LEU HD1 . 17943 1 844 . 1 1 74 74 LEU HD21 H 1 0.880 0.020 . 2 . . . . 74 LEU HD2 . 17943 1 845 . 1 1 74 74 LEU HD22 H 1 0.880 0.020 . 2 . . . . 74 LEU HD2 . 17943 1 846 . 1 1 74 74 LEU HD23 H 1 0.880 0.020 . 2 . . . . 74 LEU HD2 . 17943 1 847 . 1 1 74 74 LEU C C 13 180.400 0.200 . 1 . . . . 74 LEU C . 17943 1 848 . 1 1 74 74 LEU CA C 13 58.000 0.200 . 1 . . . . 74 LEU CA . 17943 1 849 . 1 1 74 74 LEU CB C 13 41.400 0.200 . 1 . . . . 74 LEU CB . 17943 1 850 . 1 1 74 74 LEU CG C 13 27.500 0.200 . 1 . . . . 74 LEU CG . 17943 1 851 . 1 1 74 74 LEU CD1 C 13 25.000 0.200 . 2 . . . . 74 LEU CD1 . 17943 1 852 . 1 1 74 74 LEU CD2 C 13 23.200 0.200 . 2 . . . . 74 LEU CD2 . 17943 1 853 . 1 1 74 74 LEU N N 15 116.800 0.200 . 1 . . . . 74 LEU N . 17943 1 854 . 1 1 75 75 GLN H H 1 7.640 0.020 . 1 . . . . 75 GLN H . 17943 1 855 . 1 1 75 75 GLN HA H 1 4.120 0.020 . 1 . . . . 75 GLN HA . 17943 1 856 . 1 1 75 75 GLN HB2 H 1 2.280 0.020 . 2 . . . . 75 GLN HB2 . 17943 1 857 . 1 1 75 75 GLN HB3 H 1 2.160 0.020 . 2 . . . . 75 GLN HB3 . 17943 1 858 . 1 1 75 75 GLN HG2 H 1 2.580 0.020 . 2 . . . . 75 GLN HG2 . 17943 1 859 . 1 1 75 75 GLN HG3 H 1 2.280 0.020 . 2 . . . . 75 GLN HG3 . 17943 1 860 . 1 1 75 75 GLN HE21 H 1 7.310 0.020 . 2 . . . . 75 GLN HE21 . 17943 1 861 . 1 1 75 75 GLN HE22 H 1 6.790 0.020 . 2 . . . . 75 GLN HE22 . 17943 1 862 . 1 1 75 75 GLN C C 13 179.100 0.200 . 1 . . . . 75 GLN C . 17943 1 863 . 1 1 75 75 GLN CA C 13 59.000 0.200 . 1 . . . . 75 GLN CA . 17943 1 864 . 1 1 75 75 GLN CB C 13 28.400 0.200 . 1 . . . . 75 GLN CB . 17943 1 865 . 1 1 75 75 GLN CG C 13 33.900 0.200 . 1 . . . . 75 GLN CG . 17943 1 866 . 1 1 75 75 GLN CD C 13 179.000 0.200 . 1 . . . . 75 GLN CD . 17943 1 867 . 1 1 75 75 GLN N N 15 120.700 0.200 . 1 . . . . 75 GLN N . 17943 1 868 . 1 1 75 75 GLN NE2 N 15 109.700 0.200 . 1 . . . . 75 GLN NE2 . 17943 1 869 . 1 1 76 76 ALA H H 1 8.400 0.020 . 1 . . . . 76 ALA H . 17943 1 870 . 1 1 76 76 ALA HA H 1 3.940 0.020 . 1 . . . . 76 ALA HA . 17943 1 871 . 1 1 76 76 ALA HB1 H 1 1.420 0.020 . 1 . . . . 76 ALA HB . 17943 1 872 . 1 1 76 76 ALA HB2 H 1 1.420 0.020 . 1 . . . . 76 ALA HB . 17943 1 873 . 1 1 76 76 ALA HB3 H 1 1.420 0.020 . 1 . . . . 76 ALA HB . 17943 1 874 . 1 1 76 76 ALA C C 13 178.800 0.200 . 1 . . . . 76 ALA C . 17943 1 875 . 1 1 76 76 ALA CA C 13 55.400 0.200 . 1 . . . . 76 ALA CA . 17943 1 876 . 1 1 76 76 ALA CB C 13 17.800 0.200 . 1 . . . . 76 ALA CB . 17943 1 877 . 1 1 76 76 ALA N N 15 121.800 0.200 . 1 . . . . 76 ALA N . 17943 1 878 . 1 1 77 77 ILE H H 1 8.540 0.020 . 1 . . . . 77 ILE H . 17943 1 879 . 1 1 77 77 ILE HA H 1 3.610 0.020 . 1 . . . . 77 ILE HA . 17943 1 880 . 1 1 77 77 ILE HB H 1 1.820 0.020 . 1 . . . . 77 ILE HB . 17943 1 881 . 1 1 77 77 ILE HG12 H 1 1.740 0.020 . 2 . . . . 77 ILE HG12 . 17943 1 882 . 1 1 77 77 ILE HG13 H 1 1.050 0.020 . 2 . . . . 77 ILE HG13 . 17943 1 883 . 1 1 77 77 ILE HG21 H 1 1.040 0.020 . 1 . . . . 77 ILE HG2 . 17943 1 884 . 1 1 77 77 ILE HG22 H 1 1.040 0.020 . 1 . . . . 77 ILE HG2 . 17943 1 885 . 1 1 77 77 ILE HG23 H 1 1.040 0.020 . 1 . . . . 77 ILE HG2 . 17943 1 886 . 1 1 77 77 ILE HD11 H 1 0.680 0.020 . 1 . . . . 77 ILE HD1 . 17943 1 887 . 1 1 77 77 ILE HD12 H 1 0.680 0.020 . 1 . . . . 77 ILE HD1 . 17943 1 888 . 1 1 77 77 ILE HD13 H 1 0.680 0.020 . 1 . . . . 77 ILE HD1 . 17943 1 889 . 1 1 77 77 ILE C C 13 177.600 0.200 . 1 . . . . 77 ILE C . 17943 1 890 . 1 1 77 77 ILE CA C 13 66.300 0.200 . 1 . . . . 77 ILE CA . 17943 1 891 . 1 1 77 77 ILE CB C 13 38.500 0.200 . 1 . . . . 77 ILE CB . 17943 1 892 . 1 1 77 77 ILE CG1 C 13 31.000 0.200 . 1 . . . . 77 ILE CG1 . 17943 1 893 . 1 1 77 77 ILE CG2 C 13 18.000 0.200 . 1 . . . . 77 ILE CG2 . 17943 1 894 . 1 1 77 77 ILE CD1 C 13 14.000 0.200 . 1 . . . . 77 ILE CD1 . 17943 1 895 . 1 1 77 77 ILE N N 15 118.400 0.200 . 1 . . . . 77 ILE N . 17943 1 896 . 1 1 78 78 GLY H H 1 8.290 0.020 . 1 . . . . 78 GLY H . 17943 1 897 . 1 1 78 78 GLY HA2 H 1 3.960 0.020 . 2 . . . . 78 GLY HA2 . 17943 1 898 . 1 1 78 78 GLY HA3 H 1 3.880 0.020 . 2 . . . . 78 GLY HA3 . 17943 1 899 . 1 1 78 78 GLY C C 13 177.000 0.200 . 1 . . . . 78 GLY C . 17943 1 900 . 1 1 78 78 GLY CA C 13 47.700 0.200 . 1 . . . . 78 GLY CA . 17943 1 901 . 1 1 78 78 GLY N N 15 106.700 0.200 . 1 . . . . 78 GLY N . 17943 1 902 . 1 1 79 79 ARG H H 1 7.790 0.020 . 1 . . . . 79 ARG H . 17943 1 903 . 1 1 79 79 ARG HA H 1 4.220 0.020 . 1 . . . . 79 ARG HA . 17943 1 904 . 1 1 79 79 ARG HB2 H 1 2.210 0.020 . 2 . . . . 79 ARG HB2 . 17943 1 905 . 1 1 79 79 ARG HB3 H 1 1.930 0.020 . 2 . . . . 79 ARG HB3 . 17943 1 906 . 1 1 79 79 ARG HG2 H 1 1.770 0.020 . 2 . . . . 79 ARG HG2 . 17943 1 907 . 1 1 79 79 ARG HG3 H 1 1.770 0.020 . 2 . . . . 79 ARG HG3 . 17943 1 908 . 1 1 79 79 ARG HD2 H 1 3.220 0.020 . 2 . . . . 79 ARG HD2 . 17943 1 909 . 1 1 79 79 ARG HD3 H 1 3.220 0.020 . 2 . . . . 79 ARG HD3 . 17943 1 910 . 1 1 79 79 ARG C C 13 179.100 0.200 . 1 . . . . 79 ARG C . 17943 1 911 . 1 1 79 79 ARG CA C 13 58.600 0.200 . 1 . . . . 79 ARG CA . 17943 1 912 . 1 1 79 79 ARG CB C 13 29.700 0.200 . 1 . . . . 79 ARG CB . 17943 1 913 . 1 1 79 79 ARG CG C 13 27.700 0.200 . 1 . . . . 79 ARG CG . 17943 1 914 . 1 1 79 79 ARG CD C 13 42.000 0.200 . 1 . . . . 79 ARG CD . 17943 1 915 . 1 1 79 79 ARG N N 15 121.300 0.200 . 1 . . . . 79 ARG N . 17943 1 916 . 1 1 80 80 ILE H H 1 8.330 0.020 . 1 . . . . 80 ILE H . 17943 1 917 . 1 1 80 80 ILE HA H 1 3.540 0.020 . 1 . . . . 80 ILE HA . 17943 1 918 . 1 1 80 80 ILE HB H 1 2.320 0.020 . 1 . . . . 80 ILE HB . 17943 1 919 . 1 1 80 80 ILE HG12 H 1 2.190 0.020 . 2 . . . . 80 ILE HG12 . 17943 1 920 . 1 1 80 80 ILE HG13 H 1 0.910 0.020 . 2 . . . . 80 ILE HG13 . 17943 1 921 . 1 1 80 80 ILE HG21 H 1 1.020 0.020 . 1 . . . . 80 ILE HG2 . 17943 1 922 . 1 1 80 80 ILE HG22 H 1 1.020 0.020 . 1 . . . . 80 ILE HG2 . 17943 1 923 . 1 1 80 80 ILE HG23 H 1 1.020 0.020 . 1 . . . . 80 ILE HG2 . 17943 1 924 . 1 1 80 80 ILE HD11 H 1 1.050 0.020 . 1 . . . . 80 ILE HD1 . 17943 1 925 . 1 1 80 80 ILE HD12 H 1 1.050 0.020 . 1 . . . . 80 ILE HD1 . 17943 1 926 . 1 1 80 80 ILE HD13 H 1 1.050 0.020 . 1 . . . . 80 ILE HD1 . 17943 1 927 . 1 1 80 80 ILE C C 13 177.200 0.200 . 1 . . . . 80 ILE C . 17943 1 928 . 1 1 80 80 ILE CA C 13 66.400 0.200 . 1 . . . . 80 ILE CA . 17943 1 929 . 1 1 80 80 ILE CB C 13 38.400 0.200 . 1 . . . . 80 ILE CB . 17943 1 930 . 1 1 80 80 ILE CG1 C 13 30.700 0.200 . 1 . . . . 80 ILE CG1 . 17943 1 931 . 1 1 80 80 ILE CG2 C 13 18.500 0.200 . 1 . . . . 80 ILE CG2 . 17943 1 932 . 1 1 80 80 ILE CD1 C 13 15.500 0.200 . 1 . . . . 80 ILE CD1 . 17943 1 933 . 1 1 80 80 ILE N N 15 122.200 0.200 . 1 . . . . 80 ILE N . 17943 1 934 . 1 1 81 81 LEU H H 1 8.340 0.020 . 1 . . . . 81 LEU H . 17943 1 935 . 1 1 81 81 LEU HA H 1 3.930 0.020 . 1 . . . . 81 LEU HA . 17943 1 936 . 1 1 81 81 LEU HB2 H 1 2.060 0.020 . 2 . . . . 81 LEU HB2 . 17943 1 937 . 1 1 81 81 LEU HB3 H 1 1.420 0.020 . 2 . . . . 81 LEU HB3 . 17943 1 938 . 1 1 81 81 LEU HG H 1 2.020 0.020 . 1 . . . . 81 LEU HG . 17943 1 939 . 1 1 81 81 LEU HD11 H 1 0.990 0.020 . 2 . . . . 81 LEU HD1 . 17943 1 940 . 1 1 81 81 LEU HD12 H 1 0.990 0.020 . 2 . . . . 81 LEU HD1 . 17943 1 941 . 1 1 81 81 LEU HD13 H 1 0.990 0.020 . 2 . . . . 81 LEU HD1 . 17943 1 942 . 1 1 81 81 LEU HD21 H 1 0.950 0.020 . 2 . . . . 81 LEU HD2 . 17943 1 943 . 1 1 81 81 LEU HD22 H 1 0.950 0.020 . 2 . . . . 81 LEU HD2 . 17943 1 944 . 1 1 81 81 LEU HD23 H 1 0.950 0.020 . 2 . . . . 81 LEU HD2 . 17943 1 945 . 1 1 81 81 LEU C C 13 179.800 0.200 . 1 . . . . 81 LEU C . 17943 1 946 . 1 1 81 81 LEU CA C 13 58.500 0.200 . 1 . . . . 81 LEU CA . 17943 1 947 . 1 1 81 81 LEU CB C 13 40.400 0.200 . 1 . . . . 81 LEU CB . 17943 1 948 . 1 1 81 81 LEU CG C 13 27.200 0.200 . 1 . . . . 81 LEU CG . 17943 1 949 . 1 1 81 81 LEU CD1 C 13 26.500 0.200 . 2 . . . . 81 LEU CD1 . 17943 1 950 . 1 1 81 81 LEU CD2 C 13 24.100 0.200 . 2 . . . . 81 LEU CD2 . 17943 1 951 . 1 1 81 81 LEU N N 15 118.000 0.200 . 1 . . . . 81 LEU N . 17943 1 952 . 1 1 82 82 THR H H 1 8.070 0.020 . 1 . . . . 82 THR H . 17943 1 953 . 1 1 82 82 THR HA H 1 4.100 0.020 . 1 . . . . 82 THR HA . 17943 1 954 . 1 1 82 82 THR HB H 1 4.270 0.020 . 1 . . . . 82 THR HB . 17943 1 955 . 1 1 82 82 THR HG21 H 1 1.260 0.020 . 1 . . . . 82 THR HG2 . 17943 1 956 . 1 1 82 82 THR HG22 H 1 1.260 0.020 . 1 . . . . 82 THR HG2 . 17943 1 957 . 1 1 82 82 THR HG23 H 1 1.260 0.020 . 1 . . . . 82 THR HG2 . 17943 1 958 . 1 1 82 82 THR C C 13 178.100 0.200 . 1 . . . . 82 THR C . 17943 1 959 . 1 1 82 82 THR CA C 13 66.400 0.200 . 1 . . . . 82 THR CA . 17943 1 960 . 1 1 82 82 THR CB C 13 68.900 0.200 . 1 . . . . 82 THR CB . 17943 1 961 . 1 1 82 82 THR CG2 C 13 21.900 0.200 . 1 . . . . 82 THR CG2 . 17943 1 962 . 1 1 82 82 THR N N 15 114.600 0.200 . 1 . . . . 82 THR N . 17943 1 963 . 1 1 83 83 GLU H H 1 8.520 0.020 . 1 . . . . 83 GLU H . 17943 1 964 . 1 1 83 83 GLU HA H 1 3.930 0.020 . 1 . . . . 83 GLU HA . 17943 1 965 . 1 1 83 83 GLU HB2 H 1 2.070 0.020 . 2 . . . . 83 GLU HB2 . 17943 1 966 . 1 1 83 83 GLU HB3 H 1 1.870 0.020 . 2 . . . . 83 GLU HB3 . 17943 1 967 . 1 1 83 83 GLU HG2 H 1 2.190 0.020 . 2 . . . . 83 GLU HG2 . 17943 1 968 . 1 1 83 83 GLU HG3 H 1 2.060 0.020 . 2 . . . . 83 GLU HG3 . 17943 1 969 . 1 1 83 83 GLU C C 13 178.200 0.200 . 1 . . . . 83 GLU C . 17943 1 970 . 1 1 83 83 GLU CA C 13 59.400 0.200 . 1 . . . . 83 GLU CA . 17943 1 971 . 1 1 83 83 GLU CB C 13 28.500 0.200 . 1 . . . . 83 GLU CB . 17943 1 972 . 1 1 83 83 GLU CG C 13 34.900 0.200 . 1 . . . . 83 GLU CG . 17943 1 973 . 1 1 83 83 GLU N N 15 124.600 0.200 . 1 . . . . 83 GLU N . 17943 1 974 . 1 1 84 84 TYR H H 1 7.670 0.020 . 1 . . . . 84 TYR H . 17943 1 975 . 1 1 84 84 TYR HA H 1 4.260 0.020 . 1 . . . . 84 TYR HA . 17943 1 976 . 1 1 84 84 TYR HB2 H 1 2.840 0.020 . 2 . . . . 84 TYR HB2 . 17943 1 977 . 1 1 84 84 TYR HB3 H 1 2.410 0.020 . 2 . . . . 84 TYR HB3 . 17943 1 978 . 1 1 84 84 TYR HD1 H 1 7.240 0.020 . 3 . . . . 84 TYR HD1 . 17943 1 979 . 1 1 84 84 TYR HD2 H 1 7.240 0.020 . 3 . . . . 84 TYR HD2 . 17943 1 980 . 1 1 84 84 TYR HE1 H 1 6.470 0.020 . 3 . . . . 84 TYR HE1 . 17943 1 981 . 1 1 84 84 TYR HE2 H 1 6.470 0.020 . 3 . . . . 84 TYR HE2 . 17943 1 982 . 1 1 84 84 TYR C C 13 176.000 0.200 . 1 . . . . 84 TYR C . 17943 1 983 . 1 1 84 84 TYR CA C 13 60.200 0.200 . 1 . . . . 84 TYR CA . 17943 1 984 . 1 1 84 84 TYR CB C 13 38.300 0.200 . 1 . . . . 84 TYR CB . 17943 1 985 . 1 1 84 84 TYR CD1 C 13 133.000 0.200 . 3 . . . . 84 TYR CD1 . 17943 1 986 . 1 1 84 84 TYR CD2 C 13 133.000 0.200 . 3 . . . . 84 TYR CD2 . 17943 1 987 . 1 1 84 84 TYR CE1 C 13 117.100 0.200 . 3 . . . . 84 TYR CE1 . 17943 1 988 . 1 1 84 84 TYR CE2 C 13 117.100 0.200 . 3 . . . . 84 TYR CE2 . 17943 1 989 . 1 1 84 84 TYR N N 15 113.200 0.200 . 1 . . . . 84 TYR N . 17943 1 990 . 1 1 85 85 GLY H H 1 7.800 0.020 . 1 . . . . 85 GLY H . 17943 1 991 . 1 1 85 85 GLY HA2 H 1 3.880 0.020 . 2 . . . . 85 GLY HA2 . 17943 1 992 . 1 1 85 85 GLY HA3 H 1 3.880 0.020 . 2 . . . . 85 GLY HA3 . 17943 1 993 . 1 1 85 85 GLY C C 13 174.800 0.200 . 1 . . . . 85 GLY C . 17943 1 994 . 1 1 85 85 GLY CA C 13 47.100 0.200 . 1 . . . . 85 GLY CA . 17943 1 995 . 1 1 85 85 GLY N N 15 110.200 0.200 . 1 . . . . 85 GLY N . 17943 1 996 . 1 1 86 86 VAL H H 1 7.520 0.020 . 1 . . . . 86 VAL H . 17943 1 997 . 1 1 86 86 VAL HA H 1 3.540 0.020 . 1 . . . . 86 VAL HA . 17943 1 998 . 1 1 86 86 VAL HB H 1 1.560 0.020 . 1 . . . . 86 VAL HB . 17943 1 999 . 1 1 86 86 VAL HG11 H 1 0.440 0.020 . 2 . . . . 86 VAL HG1 . 17943 1 1000 . 1 1 86 86 VAL HG12 H 1 0.440 0.020 . 2 . . . . 86 VAL HG1 . 17943 1 1001 . 1 1 86 86 VAL HG13 H 1 0.440 0.020 . 2 . . . . 86 VAL HG1 . 17943 1 1002 . 1 1 86 86 VAL HG21 H 1 0.440 0.020 . 2 . . . . 86 VAL HG2 . 17943 1 1003 . 1 1 86 86 VAL HG22 H 1 0.440 0.020 . 2 . . . . 86 VAL HG2 . 17943 1 1004 . 1 1 86 86 VAL HG23 H 1 0.440 0.020 . 2 . . . . 86 VAL HG2 . 17943 1 1005 . 1 1 86 86 VAL C C 13 176.800 0.200 . 1 . . . . 86 VAL C . 17943 1 1006 . 1 1 86 86 VAL CA C 13 63.800 0.200 . 1 . . . . 86 VAL CA . 17943 1 1007 . 1 1 86 86 VAL CB C 13 31.700 0.200 . 1 . . . . 86 VAL CB . 17943 1 1008 . 1 1 86 86 VAL CG1 C 13 21.500 0.200 . 2 . . . . 86 VAL CG1 . 17943 1 1009 . 1 1 86 86 VAL CG2 C 13 21.500 0.200 . 2 . . . . 86 VAL CG2 . 17943 1 1010 . 1 1 86 86 VAL N N 15 119.800 0.200 . 1 . . . . 86 VAL N . 17943 1 1011 . 1 1 87 87 GLY H H 1 8.570 0.020 . 1 . . . . 87 GLY H . 17943 1 1012 . 1 1 87 87 GLY HA2 H 1 4.110 0.020 . 2 . . . . 87 GLY HA2 . 17943 1 1013 . 1 1 87 87 GLY HA3 H 1 3.960 0.020 . 2 . . . . 87 GLY HA3 . 17943 1 1014 . 1 1 87 87 GLY C C 13 174.800 0.200 . 1 . . . . 87 GLY C . 17943 1 1015 . 1 1 87 87 GLY CA C 13 45.000 0.200 . 1 . . . . 87 GLY CA . 17943 1 1016 . 1 1 87 87 GLY N N 15 113.700 0.200 . 1 . . . . 87 GLY N . 17943 1 1017 . 1 1 88 88 GLU H H 1 8.600 0.020 . 1 . . . . 88 GLU H . 17943 1 1018 . 1 1 88 88 GLU HA H 1 3.950 0.020 . 1 . . . . 88 GLU HA . 17943 1 1019 . 1 1 88 88 GLU HB2 H 1 2.040 0.020 . 2 . . . . 88 GLU HB2 . 17943 1 1020 . 1 1 88 88 GLU HB3 H 1 2.010 0.020 . 2 . . . . 88 GLU HB3 . 17943 1 1021 . 1 1 88 88 GLU HG2 H 1 2.310 0.020 . 2 . . . . 88 GLU HG2 . 17943 1 1022 . 1 1 88 88 GLU HG3 H 1 2.250 0.020 . 2 . . . . 88 GLU HG3 . 17943 1 1023 . 1 1 88 88 GLU C C 13 178.900 0.200 . 1 . . . . 88 GLU C . 17943 1 1024 . 1 1 88 88 GLU CA C 13 60.200 0.200 . 1 . . . . 88 GLU CA . 17943 1 1025 . 1 1 88 88 GLU CB C 13 30.300 0.200 . 1 . . . . 88 GLU CB . 17943 1 1026 . 1 1 88 88 GLU CG C 13 36.300 0.200 . 1 . . . . 88 GLU CG . 17943 1 1027 . 1 1 88 88 GLU N N 15 120.800 0.200 . 1 . . . . 88 GLU N . 17943 1 1028 . 1 1 89 89 VAL H H 1 8.250 0.020 . 1 . . . . 89 VAL H . 17943 1 1029 . 1 1 89 89 VAL HA H 1 3.730 0.020 . 1 . . . . 89 VAL HA . 17943 1 1030 . 1 1 89 89 VAL HB H 1 2.000 0.020 . 1 . . . . 89 VAL HB . 17943 1 1031 . 1 1 89 89 VAL HG11 H 1 1.020 0.020 . 2 . . . . 89 VAL HG1 . 17943 1 1032 . 1 1 89 89 VAL HG12 H 1 1.020 0.020 . 2 . . . . 89 VAL HG1 . 17943 1 1033 . 1 1 89 89 VAL HG13 H 1 1.020 0.020 . 2 . . . . 89 VAL HG1 . 17943 1 1034 . 1 1 89 89 VAL HG21 H 1 0.910 0.020 . 2 . . . . 89 VAL HG2 . 17943 1 1035 . 1 1 89 89 VAL HG22 H 1 0.910 0.020 . 2 . . . . 89 VAL HG2 . 17943 1 1036 . 1 1 89 89 VAL HG23 H 1 0.910 0.020 . 2 . . . . 89 VAL HG2 . 17943 1 1037 . 1 1 89 89 VAL C C 13 178.700 0.200 . 1 . . . . 89 VAL C . 17943 1 1038 . 1 1 89 89 VAL CA C 13 66.300 0.200 . 1 . . . . 89 VAL CA . 17943 1 1039 . 1 1 89 89 VAL CB C 13 31.700 0.200 . 1 . . . . 89 VAL CB . 17943 1 1040 . 1 1 89 89 VAL CG1 C 13 22.500 0.200 . 2 . . . . 89 VAL CG1 . 17943 1 1041 . 1 1 89 89 VAL CG2 C 13 21.200 0.200 . 2 . . . . 89 VAL CG2 . 17943 1 1042 . 1 1 89 89 VAL N N 15 119.500 0.200 . 1 . . . . 89 VAL N . 17943 1 1043 . 1 1 90 90 GLU H H 1 8.350 0.020 . 1 . . . . 90 GLU H . 17943 1 1044 . 1 1 90 90 GLU HA H 1 3.850 0.020 . 1 . . . . 90 GLU HA . 17943 1 1045 . 1 1 90 90 GLU HB2 H 1 1.550 0.020 . 2 . . . . 90 GLU HB2 . 17943 1 1046 . 1 1 90 90 GLU HB3 H 1 0.840 0.020 . 2 . . . . 90 GLU HB3 . 17943 1 1047 . 1 1 90 90 GLU HG2 H 1 2.150 0.020 . 2 . . . . 90 GLU HG2 . 17943 1 1048 . 1 1 90 90 GLU HG3 H 1 2.060 0.020 . 2 . . . . 90 GLU HG3 . 17943 1 1049 . 1 1 90 90 GLU C C 13 177.500 0.200 . 1 . . . . 90 GLU C . 17943 1 1050 . 1 1 90 90 GLU CA C 13 59.400 0.200 . 1 . . . . 90 GLU CA . 17943 1 1051 . 1 1 90 90 GLU CB C 13 28.600 0.200 . 1 . . . . 90 GLU CB . 17943 1 1052 . 1 1 90 90 GLU CG C 13 37.600 0.200 . 1 . . . . 90 GLU CG . 17943 1 1053 . 1 1 90 90 GLU N N 15 120.100 0.200 . 1 . . . . 90 GLU N . 17943 1 1054 . 1 1 91 91 SER H H 1 8.150 0.020 . 1 . . . . 91 SER H . 17943 1 1055 . 1 1 91 91 SER HA H 1 3.740 0.020 . 1 . . . . 91 SER HA . 17943 1 1056 . 1 1 91 91 SER HB2 H 1 3.860 0.020 . 2 . . . . 91 SER HB2 . 17943 1 1057 . 1 1 91 91 SER HB3 H 1 3.860 0.020 . 2 . . . . 91 SER HB3 . 17943 1 1058 . 1 1 91 91 SER C C 13 175.400 0.200 . 1 . . . . 91 SER C . 17943 1 1059 . 1 1 91 91 SER CA C 13 63.000 0.200 . 1 . . . . 91 SER CA . 17943 1 1060 . 1 1 91 91 SER CB C 13 62.800 0.200 . 1 . . . . 91 SER CB . 17943 1 1061 . 1 1 91 91 SER N N 15 114.200 0.200 . 1 . . . . 91 SER N . 17943 1 1062 . 1 1 92 92 VAL H H 1 7.200 0.020 . 1 . . . . 92 VAL H . 17943 1 1063 . 1 1 92 92 VAL HA H 1 3.790 0.020 . 1 . . . . 92 VAL HA . 17943 1 1064 . 1 1 92 92 VAL HB H 1 2.130 0.020 . 1 . . . . 92 VAL HB . 17943 1 1065 . 1 1 92 92 VAL HG11 H 1 1.090 0.020 . 2 . . . . 92 VAL HG1 . 17943 1 1066 . 1 1 92 92 VAL HG12 H 1 1.090 0.020 . 2 . . . . 92 VAL HG1 . 17943 1 1067 . 1 1 92 92 VAL HG13 H 1 1.090 0.020 . 2 . . . . 92 VAL HG1 . 17943 1 1068 . 1 1 92 92 VAL HG21 H 1 0.990 0.020 . 2 . . . . 92 VAL HG2 . 17943 1 1069 . 1 1 92 92 VAL HG22 H 1 0.990 0.020 . 2 . . . . 92 VAL HG2 . 17943 1 1070 . 1 1 92 92 VAL HG23 H 1 0.990 0.020 . 2 . . . . 92 VAL HG2 . 17943 1 1071 . 1 1 92 92 VAL C C 13 178.800 0.200 . 1 . . . . 92 VAL C . 17943 1 1072 . 1 1 92 92 VAL CA C 13 66.000 0.200 . 1 . . . . 92 VAL CA . 17943 1 1073 . 1 1 92 92 VAL CB C 13 32.000 0.200 . 1 . . . . 92 VAL CB . 17943 1 1074 . 1 1 92 92 VAL CG1 C 13 22.200 0.200 . 2 . . . . 92 VAL CG1 . 17943 1 1075 . 1 1 92 92 VAL CG2 C 13 21.200 0.200 . 2 . . . . 92 VAL CG2 . 17943 1 1076 . 1 1 92 92 VAL N N 15 120.000 0.200 . 1 . . . . 92 VAL N . 17943 1 1077 . 1 1 93 93 GLU H H 1 7.490 0.020 . 1 . . . . 93 GLU H . 17943 1 1078 . 1 1 93 93 GLU HA H 1 4.230 0.020 . 1 . . . . 93 GLU HA . 17943 1 1079 . 1 1 93 93 GLU HB2 H 1 2.350 0.020 . 2 . . . . 93 GLU HB2 . 17943 1 1080 . 1 1 93 93 GLU HB3 H 1 2.240 0.020 . 2 . . . . 93 GLU HB3 . 17943 1 1081 . 1 1 93 93 GLU HG2 H 1 2.530 0.020 . 2 . . . . 93 GLU HG2 . 17943 1 1082 . 1 1 93 93 GLU HG3 H 1 2.530 0.020 . 2 . . . . 93 GLU HG3 . 17943 1 1083 . 1 1 93 93 GLU C C 13 179.600 0.200 . 1 . . . . 93 GLU C . 17943 1 1084 . 1 1 93 93 GLU CA C 13 59.000 0.200 . 1 . . . . 93 GLU CA . 17943 1 1085 . 1 1 93 93 GLU CB C 13 29.700 0.200 . 1 . . . . 93 GLU CB . 17943 1 1086 . 1 1 93 93 GLU CG C 13 36.100 0.200 . 1 . . . . 93 GLU CG . 17943 1 1087 . 1 1 93 93 GLU CD C 13 183.100 0.200 . 1 . . . . 93 GLU CD . 17943 1 1088 . 1 1 93 93 GLU N N 15 120.400 0.200 . 1 . . . . 93 GLU N . 17943 1 1089 . 1 1 94 94 TRP H H 1 9.110 0.020 . 1 . . . . 94 TRP H . 17943 1 1090 . 1 1 94 94 TRP HA H 1 4.490 0.020 . 1 . . . . 94 TRP HA . 17943 1 1091 . 1 1 94 94 TRP HB2 H 1 3.260 0.020 . 2 . . . . 94 TRP HB2 . 17943 1 1092 . 1 1 94 94 TRP HB3 H 1 3.260 0.020 . 2 . . . . 94 TRP HB3 . 17943 1 1093 . 1 1 94 94 TRP HD1 H 1 7.270 0.020 . 1 . . . . 94 TRP HD1 . 17943 1 1094 . 1 1 94 94 TRP HE1 H 1 10.390 0.020 . 1 . . . . 94 TRP HE1 . 17943 1 1095 . 1 1 94 94 TRP HZ2 H 1 7.470 0.020 . 1 . . . . 94 TRP HZ2 . 17943 1 1096 . 1 1 94 94 TRP HH2 H 1 6.890 0.020 . 1 . . . . 94 TRP HH2 . 17943 1 1097 . 1 1 94 94 TRP C C 13 177.900 0.200 . 1 . . . . 94 TRP C . 17943 1 1098 . 1 1 94 94 TRP CA C 13 59.500 0.200 . 1 . . . . 94 TRP CA . 17943 1 1099 . 1 1 94 94 TRP CB C 13 29.500 0.200 . 1 . . . . 94 TRP CB . 17943 1 1100 . 1 1 94 94 TRP CD1 C 13 125.300 0.200 . 1 . . . . 94 TRP CD1 . 17943 1 1101 . 1 1 94 94 TRP CZ2 C 13 114.600 0.200 . 1 . . . . 94 TRP CZ2 . 17943 1 1102 . 1 1 94 94 TRP CH2 C 13 124.100 0.200 . 1 . . . . 94 TRP CH2 . 17943 1 1103 . 1 1 94 94 TRP N N 15 119.500 0.200 . 1 . . . . 94 TRP N . 17943 1 1104 . 1 1 94 94 TRP NE1 N 15 128.200 0.200 . 1 . . . . 94 TRP NE1 . 17943 1 1105 . 1 1 95 95 GLU H H 1 8.520 0.020 . 1 . . . . 95 GLU H . 17943 1 1106 . 1 1 95 95 GLU HA H 1 3.890 0.020 . 1 . . . . 95 GLU HA . 17943 1 1107 . 1 1 95 95 GLU HB2 H 1 2.240 0.020 . 2 . . . . 95 GLU HB2 . 17943 1 1108 . 1 1 95 95 GLU HB3 H 1 2.240 0.020 . 2 . . . . 95 GLU HB3 . 17943 1 1109 . 1 1 95 95 GLU HG2 H 1 2.120 0.020 . 2 . . . . 95 GLU HG2 . 17943 1 1110 . 1 1 95 95 GLU HG3 H 1 2.120 0.020 . 2 . . . . 95 GLU HG3 . 17943 1 1111 . 1 1 95 95 GLU C C 13 177.800 0.200 . 1 . . . . 95 GLU C . 17943 1 1112 . 1 1 95 95 GLU CA C 13 60.300 0.200 . 1 . . . . 95 GLU CA . 17943 1 1113 . 1 1 95 95 GLU CB C 13 29.500 0.200 . 1 . . . . 95 GLU CB . 17943 1 1114 . 1 1 95 95 GLU CG C 13 36.100 0.200 . 1 . . . . 95 GLU CG . 17943 1 1115 . 1 1 95 95 GLU N N 15 119.500 0.200 . 1 . . . . 95 GLU N . 17943 1 1116 . 1 1 96 96 GLY H H 1 7.510 0.020 . 1 . . . . 96 GLY H . 17943 1 1117 . 1 1 96 96 GLY HA2 H 1 3.990 0.020 . 2 . . . . 96 GLY HA2 . 17943 1 1118 . 1 1 96 96 GLY HA3 H 1 3.840 0.020 . 2 . . . . 96 GLY HA3 . 17943 1 1119 . 1 1 96 96 GLY C C 13 176.600 0.200 . 1 . . . . 96 GLY C . 17943 1 1120 . 1 1 96 96 GLY CA C 13 47.200 0.200 . 1 . . . . 96 GLY CA . 17943 1 1121 . 1 1 96 96 GLY N N 15 103.100 0.200 . 1 . . . . 96 GLY N . 17943 1 1122 . 1 1 97 97 GLU H H 1 7.560 0.020 . 1 . . . . 97 GLU H . 17943 1 1123 . 1 1 97 97 GLU HA H 1 4.120 0.020 . 1 . . . . 97 GLU HA . 17943 1 1124 . 1 1 97 97 GLU HB2 H 1 1.680 0.020 . 2 . . . . 97 GLU HB2 . 17943 1 1125 . 1 1 97 97 GLU HB3 H 1 1.490 0.020 . 2 . . . . 97 GLU HB3 . 17943 1 1126 . 1 1 97 97 GLU HG2 H 1 2.310 0.020 . 2 . . . . 97 GLU HG2 . 17943 1 1127 . 1 1 97 97 GLU HG3 H 1 2.220 0.020 . 2 . . . . 97 GLU HG3 . 17943 1 1128 . 1 1 97 97 GLU C C 13 179.600 0.200 . 1 . . . . 97 GLU C . 17943 1 1129 . 1 1 97 97 GLU CA C 13 58.900 0.200 . 1 . . . . 97 GLU CA . 17943 1 1130 . 1 1 97 97 GLU CB C 13 29.500 0.200 . 1 . . . . 97 GLU CB . 17943 1 1131 . 1 1 97 97 GLU CG C 13 35.800 0.200 . 1 . . . . 97 GLU CG . 17943 1 1132 . 1 1 97 97 GLU CD C 13 182.900 0.200 . 1 . . . . 97 GLU CD . 17943 1 1133 . 1 1 97 97 GLU N N 15 121.200 0.200 . 1 . . . . 97 GLU N . 17943 1 1134 . 1 1 98 98 LEU H H 1 8.510 0.020 . 1 . . . . 98 LEU H . 17943 1 1135 . 1 1 98 98 LEU HA H 1 3.650 0.020 . 1 . . . . 98 LEU HA . 17943 1 1136 . 1 1 98 98 LEU HB2 H 1 1.800 0.020 . 2 . . . . 98 LEU HB2 . 17943 1 1137 . 1 1 98 98 LEU HB3 H 1 1.650 0.020 . 2 . . . . 98 LEU HB3 . 17943 1 1138 . 1 1 98 98 LEU HG H 1 1.060 0.020 . 1 . . . . 98 LEU HG . 17943 1 1139 . 1 1 98 98 LEU HD11 H 1 0.860 0.020 . 2 . . . . 98 LEU HD1 . 17943 1 1140 . 1 1 98 98 LEU HD12 H 1 0.860 0.020 . 2 . . . . 98 LEU HD1 . 17943 1 1141 . 1 1 98 98 LEU HD13 H 1 0.860 0.020 . 2 . . . . 98 LEU HD1 . 17943 1 1142 . 1 1 98 98 LEU HD21 H 1 0.710 0.020 . 2 . . . . 98 LEU HD2 . 17943 1 1143 . 1 1 98 98 LEU HD22 H 1 0.710 0.020 . 2 . . . . 98 LEU HD2 . 17943 1 1144 . 1 1 98 98 LEU HD23 H 1 0.710 0.020 . 2 . . . . 98 LEU HD2 . 17943 1 1145 . 1 1 98 98 LEU C C 13 179.800 0.200 . 1 . . . . 98 LEU C . 17943 1 1146 . 1 1 98 98 LEU CA C 13 58.500 0.200 . 1 . . . . 98 LEU CA . 17943 1 1147 . 1 1 98 98 LEU CB C 13 40.500 0.200 . 1 . . . . 98 LEU CB . 17943 1 1148 . 1 1 98 98 LEU CG C 13 27.700 0.200 . 1 . . . . 98 LEU CG . 17943 1 1149 . 1 1 98 98 LEU CD1 C 13 26.700 0.200 . 2 . . . . 98 LEU CD1 . 17943 1 1150 . 1 1 98 98 LEU CD2 C 13 23.500 0.200 . 2 . . . . 98 LEU CD2 . 17943 1 1151 . 1 1 98 98 LEU N N 15 120.300 0.200 . 1 . . . . 98 LEU N . 17943 1 1152 . 1 1 99 99 LEU H H 1 8.020 0.020 . 1 . . . . 99 LEU H . 17943 1 1153 . 1 1 99 99 LEU HA H 1 3.810 0.020 . 1 . . . . 99 LEU HA . 17943 1 1154 . 1 1 99 99 LEU HB2 H 1 1.750 0.020 . 2 . . . . 99 LEU HB2 . 17943 1 1155 . 1 1 99 99 LEU HB3 H 1 1.570 0.020 . 2 . . . . 99 LEU HB3 . 17943 1 1156 . 1 1 99 99 LEU HG H 1 1.550 0.020 . 1 . . . . 99 LEU HG . 17943 1 1157 . 1 1 99 99 LEU HD11 H 1 0.860 0.020 . 2 . . . . 99 LEU HD1 . 17943 1 1158 . 1 1 99 99 LEU HD12 H 1 0.860 0.020 . 2 . . . . 99 LEU HD1 . 17943 1 1159 . 1 1 99 99 LEU HD13 H 1 0.860 0.020 . 2 . . . . 99 LEU HD1 . 17943 1 1160 . 1 1 99 99 LEU HD21 H 1 0.740 0.020 . 2 . . . . 99 LEU HD2 . 17943 1 1161 . 1 1 99 99 LEU HD22 H 1 0.740 0.020 . 2 . . . . 99 LEU HD2 . 17943 1 1162 . 1 1 99 99 LEU HD23 H 1 0.740 0.020 . 2 . . . . 99 LEU HD2 . 17943 1 1163 . 1 1 99 99 LEU C C 13 177.900 0.200 . 1 . . . . 99 LEU C . 17943 1 1164 . 1 1 99 99 LEU CA C 13 58.200 0.200 . 1 . . . . 99 LEU CA . 17943 1 1165 . 1 1 99 99 LEU CB C 13 41.700 0.200 . 1 . . . . 99 LEU CB . 17943 1 1166 . 1 1 99 99 LEU CG C 13 26.800 0.200 . 1 . . . . 99 LEU CG . 17943 1 1167 . 1 1 99 99 LEU CD1 C 13 24.700 0.200 . 2 . . . . 99 LEU CD1 . 17943 1 1168 . 1 1 99 99 LEU CD2 C 13 24.200 0.200 . 2 . . . . 99 LEU CD2 . 17943 1 1169 . 1 1 99 99 LEU N N 15 121.900 0.200 . 1 . . . . 99 LEU N . 17943 1 1170 . 1 1 100 100 ASN H H 1 7.820 0.020 . 1 . . . . 100 ASN H . 17943 1 1171 . 1 1 100 100 ASN HA H 1 4.490 0.020 . 1 . . . . 100 ASN HA . 17943 1 1172 . 1 1 100 100 ASN HB2 H 1 2.910 0.020 . 2 . . . . 100 ASN HB2 . 17943 1 1173 . 1 1 100 100 ASN HB3 H 1 2.840 0.020 . 2 . . . . 100 ASN HB3 . 17943 1 1174 . 1 1 100 100 ASN HD21 H 1 7.570 0.020 . 2 . . . . 100 ASN HD21 . 17943 1 1175 . 1 1 100 100 ASN HD22 H 1 6.760 0.020 . 2 . . . . 100 ASN HD22 . 17943 1 1176 . 1 1 100 100 ASN C C 13 178.900 0.200 . 1 . . . . 100 ASN C . 17943 1 1177 . 1 1 100 100 ASN CA C 13 56.600 0.200 . 1 . . . . 100 ASN CA . 17943 1 1178 . 1 1 100 100 ASN CB C 13 38.100 0.200 . 1 . . . . 100 ASN CB . 17943 1 1179 . 1 1 100 100 ASN CG C 13 176.100 0.200 . 1 . . . . 100 ASN CG . 17943 1 1180 . 1 1 100 100 ASN N N 15 116.800 0.200 . 1 . . . . 100 ASN N . 17943 1 1181 . 1 1 100 100 ASN ND2 N 15 112.200 0.200 . 1 . . . . 100 ASN ND2 . 17943 1 1182 . 1 1 101 101 ARG H H 1 8.110 0.020 . 1 . . . . 101 ARG H . 17943 1 1183 . 1 1 101 101 ARG HA H 1 4.080 0.020 . 1 . . . . 101 ARG HA . 17943 1 1184 . 1 1 101 101 ARG HB2 H 1 1.820 0.020 . 2 . . . . 101 ARG HB2 . 17943 1 1185 . 1 1 101 101 ARG HB3 H 1 1.820 0.020 . 2 . . . . 101 ARG HB3 . 17943 1 1186 . 1 1 101 101 ARG HG2 H 1 1.680 0.020 . 2 . . . . 101 ARG HG2 . 17943 1 1187 . 1 1 101 101 ARG HG3 H 1 1.680 0.020 . 2 . . . . 101 ARG HG3 . 17943 1 1188 . 1 1 101 101 ARG HD2 H 1 3.280 0.020 . 2 . . . . 101 ARG HD2 . 17943 1 1189 . 1 1 101 101 ARG HD3 H 1 3.010 0.020 . 2 . . . . 101 ARG HD3 . 17943 1 1190 . 1 1 101 101 ARG C C 13 178.300 0.200 . 1 . . . . 101 ARG C . 17943 1 1191 . 1 1 101 101 ARG CA C 13 58.500 0.200 . 1 . . . . 101 ARG CA . 17943 1 1192 . 1 1 101 101 ARG CB C 13 29.300 0.200 . 1 . . . . 101 ARG CB . 17943 1 1193 . 1 1 101 101 ARG CG C 13 28.000 0.200 . 1 . . . . 101 ARG CG . 17943 1 1194 . 1 1 101 101 ARG CD C 13 42.500 0.200 . 1 . . . . 101 ARG CD . 17943 1 1195 . 1 1 101 101 ARG N N 15 118.000 0.200 . 1 . . . . 101 ARG N . 17943 1 1196 . 1 1 102 102 LEU H H 1 7.790 0.020 . 1 . . . . 102 LEU H . 17943 1 1197 . 1 1 102 102 LEU HA H 1 4.160 0.020 . 1 . . . . 102 LEU HA . 17943 1 1198 . 1 1 102 102 LEU HB2 H 1 1.750 0.020 . 2 . . . . 102 LEU HB2 . 17943 1 1199 . 1 1 102 102 LEU HB3 H 1 1.530 0.020 . 2 . . . . 102 LEU HB3 . 17943 1 1200 . 1 1 102 102 LEU HG H 1 1.350 0.020 . 1 . . . . 102 LEU HG . 17943 1 1201 . 1 1 102 102 LEU HD11 H 1 0.390 0.020 . 2 . . . . 102 LEU HD1 . 17943 1 1202 . 1 1 102 102 LEU HD12 H 1 0.390 0.020 . 2 . . . . 102 LEU HD1 . 17943 1 1203 . 1 1 102 102 LEU HD13 H 1 0.390 0.020 . 2 . . . . 102 LEU HD1 . 17943 1 1204 . 1 1 102 102 LEU HD21 H 1 0.120 0.020 . 2 . . . . 102 LEU HD2 . 17943 1 1205 . 1 1 102 102 LEU HD22 H 1 0.120 0.020 . 2 . . . . 102 LEU HD2 . 17943 1 1206 . 1 1 102 102 LEU HD23 H 1 0.120 0.020 . 2 . . . . 102 LEU HD2 . 17943 1 1207 . 1 1 102 102 LEU C C 13 177.600 0.200 . 1 . . . . 102 LEU C . 17943 1 1208 . 1 1 102 102 LEU CA C 13 57.400 0.200 . 1 . . . . 102 LEU CA . 17943 1 1209 . 1 1 102 102 LEU CB C 13 42.100 0.200 . 1 . . . . 102 LEU CB . 17943 1 1210 . 1 1 102 102 LEU CG C 13 26.800 0.200 . 1 . . . . 102 LEU CG . 17943 1 1211 . 1 1 102 102 LEU CD1 C 13 24.300 0.200 . 2 . . . . 102 LEU CD1 . 17943 1 1212 . 1 1 102 102 LEU CD2 C 13 26.400 0.200 . 2 . . . . 102 LEU CD2 . 17943 1 1213 . 1 1 102 102 LEU N N 15 121.600 0.200 . 1 . . . . 102 LEU N . 17943 1 1214 . 1 1 103 103 PHE H H 1 7.660 0.020 . 1 . . . . 103 PHE H . 17943 1 1215 . 1 1 103 103 PHE HA H 1 4.440 0.020 . 1 . . . . 103 PHE HA . 17943 1 1216 . 1 1 103 103 PHE HB2 H 1 3.240 0.020 . 2 . . . . 103 PHE HB2 . 17943 1 1217 . 1 1 103 103 PHE HB3 H 1 3.060 0.020 . 2 . . . . 103 PHE HB3 . 17943 1 1218 . 1 1 103 103 PHE HD1 H 1 7.350 0.020 . 3 . . . . 103 PHE HD1 . 17943 1 1219 . 1 1 103 103 PHE HD2 H 1 7.350 0.020 . 3 . . . . 103 PHE HD2 . 17943 1 1220 . 1 1 103 103 PHE C C 13 178.000 0.200 . 1 . . . . 103 PHE C . 17943 1 1221 . 1 1 103 103 PHE CA C 13 60.100 0.200 . 1 . . . . 103 PHE CA . 17943 1 1222 . 1 1 103 103 PHE CB C 13 38.500 0.200 . 1 . . . . 103 PHE CB . 17943 1 1223 . 1 1 103 103 PHE CD1 C 13 131.400 0.200 . 3 . . . . 103 PHE CD1 . 17943 1 1224 . 1 1 103 103 PHE N N 15 112.700 0.200 . 1 . . . . 103 PHE N . 17943 1 1225 . 1 1 104 104 GLU H H 1 7.720 0.020 . 1 . . . . 104 GLU H . 17943 1 1226 . 1 1 104 104 GLU HA H 1 4.290 0.020 . 1 . . . . 104 GLU HA . 17943 1 1227 . 1 1 104 104 GLU HB2 H 1 2.130 0.020 . 2 . . . . 104 GLU HB2 . 17943 1 1228 . 1 1 104 104 GLU HB3 H 1 2.130 0.020 . 2 . . . . 104 GLU HB3 . 17943 1 1229 . 1 1 104 104 GLU HG2 H 1 2.450 0.020 . 2 . . . . 104 GLU HG2 . 17943 1 1230 . 1 1 104 104 GLU HG3 H 1 2.310 0.020 . 2 . . . . 104 GLU HG3 . 17943 1 1231 . 1 1 104 104 GLU C C 13 176.800 0.200 . 1 . . . . 104 GLU C . 17943 1 1232 . 1 1 104 104 GLU CA C 13 58.300 0.200 . 1 . . . . 104 GLU CA . 17943 1 1233 . 1 1 104 104 GLU CB C 13 30.700 0.200 . 1 . . . . 104 GLU CB . 17943 1 1234 . 1 1 104 104 GLU CG C 13 36.200 0.200 . 1 . . . . 104 GLU CG . 17943 1 1235 . 1 1 104 104 GLU CD C 13 183.600 0.200 . 1 . . . . 104 GLU CD . 17943 1 1236 . 1 1 104 104 GLU N N 15 118.800 0.200 . 1 . . . . 104 GLU N . 17943 1 1237 . 1 1 105 105 ASN H H 1 8.140 0.020 . 1 . . . . 105 ASN H . 17943 1 1238 . 1 1 105 105 ASN HA H 1 4.810 0.020 . 1 . . . . 105 ASN HA . 17943 1 1239 . 1 1 105 105 ASN HB2 H 1 2.960 0.020 . 2 . . . . 105 ASN HB2 . 17943 1 1240 . 1 1 105 105 ASN HB3 H 1 2.960 0.020 . 2 . . . . 105 ASN HB3 . 17943 1 1241 . 1 1 105 105 ASN HD21 H 1 7.820 0.020 . 2 . . . . 105 ASN HD21 . 17943 1 1242 . 1 1 105 105 ASN HD22 H 1 6.900 0.020 . 2 . . . . 105 ASN HD22 . 17943 1 1243 . 1 1 105 105 ASN C C 13 174.700 0.200 . 1 . . . . 105 ASN C . 17943 1 1244 . 1 1 105 105 ASN CA C 13 53.600 0.200 . 1 . . . . 105 ASN CA . 17943 1 1245 . 1 1 105 105 ASN CB C 13 39.000 0.200 . 1 . . . . 105 ASN CB . 17943 1 1246 . 1 1 105 105 ASN N N 15 117.100 0.200 . 1 . . . . 105 ASN N . 17943 1 1247 . 1 1 105 105 ASN ND2 N 15 112.400 0.200 . 1 . . . . 105 ASN ND2 . 17943 1 1248 . 1 1 106 106 ALA H H 1 8.900 0.020 . 1 . . . . 106 ALA H . 17943 1 1249 . 1 1 106 106 ALA HA H 1 4.930 0.020 . 1 . . . . 106 ALA HA . 17943 1 1250 . 1 1 106 106 ALA HB1 H 1 1.800 0.020 . 1 . . . . 106 ALA HB . 17943 1 1251 . 1 1 106 106 ALA HB2 H 1 1.800 0.020 . 1 . . . . 106 ALA HB . 17943 1 1252 . 1 1 106 106 ALA HB3 H 1 1.800 0.020 . 1 . . . . 106 ALA HB . 17943 1 1253 . 1 1 106 106 ALA C C 13 176.400 0.200 . 1 . . . . 106 ALA C . 17943 1 1254 . 1 1 106 106 ALA CA C 13 54.000 0.200 . 1 . . . . 106 ALA CA . 17943 1 1255 . 1 1 106 106 ALA CB C 13 18.800 0.200 . 1 . . . . 106 ALA CB . 17943 1 1256 . 1 1 106 106 ALA N N 15 130.200 0.200 . 1 . . . . 106 ALA N . 17943 1 1257 . 1 1 107 107 THR H H 1 8.090 0.020 . 1 . . . . 107 THR H . 17943 1 1258 . 1 1 107 107 THR HA H 1 6.020 0.020 . 1 . . . . 107 THR HA . 17943 1 1259 . 1 1 107 107 THR HB H 1 4.220 0.020 . 1 . . . . 107 THR HB . 17943 1 1260 . 1 1 107 107 THR HG21 H 1 1.250 0.020 . 1 . . . . 107 THR HG2 . 17943 1 1261 . 1 1 107 107 THR HG22 H 1 1.250 0.020 . 1 . . . . 107 THR HG2 . 17943 1 1262 . 1 1 107 107 THR HG23 H 1 1.250 0.020 . 1 . . . . 107 THR HG2 . 17943 1 1263 . 1 1 107 107 THR C C 13 176.500 0.200 . 1 . . . . 107 THR C . 17943 1 1264 . 1 1 107 107 THR CA C 13 59.000 0.200 . 1 . . . . 107 THR CA . 17943 1 1265 . 1 1 107 107 THR CB C 13 70.700 0.200 . 1 . . . . 107 THR CB . 17943 1 1266 . 1 1 107 107 THR CG2 C 13 21.300 0.200 . 1 . . . . 107 THR CG2 . 17943 1 1267 . 1 1 107 107 THR N N 15 109.100 0.200 . 1 . . . . 107 THR N . 17943 1 1268 . 1 1 108 108 PRO HA H 1 3.230 0.020 . 1 . . . . 108 PRO HA . 17943 1 1269 . 1 1 108 108 PRO HB2 H 1 1.630 0.020 . 2 . . . . 108 PRO HB2 . 17943 1 1270 . 1 1 108 108 PRO HB3 H 1 1.400 0.020 . 2 . . . . 108 PRO HB3 . 17943 1 1271 . 1 1 108 108 PRO C C 13 179.200 0.200 . 1 . . . . 108 PRO C . 17943 1 1272 . 1 1 108 108 PRO CA C 13 65.000 0.200 . 1 . . . . 108 PRO CA . 17943 1 1273 . 1 1 108 108 PRO CB C 13 30.700 0.200 . 1 . . . . 108 PRO CB . 17943 1 1274 . 1 1 108 108 PRO CG C 13 27.500 0.200 . 1 . . . . 108 PRO CG . 17943 1 1275 . 1 1 108 108 PRO CD C 13 50.300 0.200 . 1 . . . . 108 PRO CD . 17943 1 1276 . 1 1 109 109 MET H H 1 7.640 0.020 . 1 . . . . 109 MET H . 17943 1 1277 . 1 1 109 109 MET HA H 1 4.350 0.020 . 1 . . . . 109 MET HA . 17943 1 1278 . 1 1 109 109 MET HB2 H 1 2.050 0.020 . 2 . . . . 109 MET HB2 . 17943 1 1279 . 1 1 109 109 MET HB3 H 1 1.860 0.020 . 2 . . . . 109 MET HB3 . 17943 1 1280 . 1 1 109 109 MET HG2 H 1 2.500 0.020 . 2 . . . . 109 MET HG2 . 17943 1 1281 . 1 1 109 109 MET HG3 H 1 2.470 0.020 . 2 . . . . 109 MET HG3 . 17943 1 1282 . 1 1 109 109 MET HE1 H 1 2.040 0.020 . 1 . . . . 109 MET HE . 17943 1 1283 . 1 1 109 109 MET HE2 H 1 2.040 0.020 . 1 . . . . 109 MET HE . 17943 1 1284 . 1 1 109 109 MET HE3 H 1 2.040 0.020 . 1 . . . . 109 MET HE . 17943 1 1285 . 1 1 109 109 MET C C 13 177.600 0.200 . 1 . . . . 109 MET C . 17943 1 1286 . 1 1 109 109 MET CA C 13 56.200 0.200 . 1 . . . . 109 MET CA . 17943 1 1287 . 1 1 109 109 MET CB C 13 30.300 0.200 . 1 . . . . 109 MET CB . 17943 1 1288 . 1 1 109 109 MET CG C 13 32.500 0.200 . 1 . . . . 109 MET CG . 17943 1 1289 . 1 1 109 109 MET CE C 13 17.100 0.200 . 1 . . . . 109 MET CE . 17943 1 1290 . 1 1 109 109 MET N N 15 113.700 0.200 . 1 . . . . 109 MET N . 17943 1 1291 . 1 1 110 110 GLY H H 1 8.060 0.020 . 1 . . . . 110 GLY H . 17943 1 1292 . 1 1 110 110 GLY HA2 H 1 4.070 0.020 . 2 . . . . 110 GLY HA2 . 17943 1 1293 . 1 1 110 110 GLY HA3 H 1 3.900 0.020 . 2 . . . . 110 GLY HA3 . 17943 1 1294 . 1 1 110 110 GLY C C 13 177.100 0.200 . 1 . . . . 110 GLY C . 17943 1 1295 . 1 1 110 110 GLY CA C 13 47.500 0.200 . 1 . . . . 110 GLY CA . 17943 1 1296 . 1 1 110 110 GLY N N 15 107.800 0.200 . 1 . . . . 110 GLY N . 17943 1 1297 . 1 1 111 111 GLN H H 1 6.930 0.020 . 1 . . . . 111 GLN H . 17943 1 1298 . 1 1 111 111 GLN HA H 1 4.140 0.020 . 1 . . . . 111 GLN HA . 17943 1 1299 . 1 1 111 111 GLN HB2 H 1 2.050 0.020 . 2 . . . . 111 GLN HB2 . 17943 1 1300 . 1 1 111 111 GLN HB3 H 1 1.910 0.020 . 2 . . . . 111 GLN HB3 . 17943 1 1301 . 1 1 111 111 GLN HG2 H 1 2.560 0.020 . 2 . . . . 111 GLN HG2 . 17943 1 1302 . 1 1 111 111 GLN HG3 H 1 2.200 0.020 . 2 . . . . 111 GLN HG3 . 17943 1 1303 . 1 1 111 111 GLN HE21 H 1 7.510 0.020 . 2 . . . . 111 GLN HE21 . 17943 1 1304 . 1 1 111 111 GLN HE22 H 1 6.850 0.020 . 2 . . . . 111 GLN HE22 . 17943 1 1305 . 1 1 111 111 GLN C C 13 177.700 0.200 . 1 . . . . 111 GLN C . 17943 1 1306 . 1 1 111 111 GLN CA C 13 56.900 0.200 . 1 . . . . 111 GLN CA . 17943 1 1307 . 1 1 111 111 GLN CB C 13 30.500 0.200 . 1 . . . . 111 GLN CB . 17943 1 1308 . 1 1 111 111 GLN CG C 13 34.400 0.200 . 1 . . . . 111 GLN CG . 17943 1 1309 . 1 1 111 111 GLN N N 15 117.600 0.200 . 1 . . . . 111 GLN N . 17943 1 1310 . 1 1 111 111 GLN NE2 N 15 111.300 0.200 . 1 . . . . 111 GLN NE2 . 17943 1 1311 . 1 1 112 112 ALA H H 1 8.280 0.020 . 1 . . . . 112 ALA H . 17943 1 1312 . 1 1 112 112 ALA HA H 1 3.760 0.020 . 1 . . . . 112 ALA HA . 17943 1 1313 . 1 1 112 112 ALA HB1 H 1 1.640 0.020 . 1 . . . . 112 ALA HB . 17943 1 1314 . 1 1 112 112 ALA HB2 H 1 1.640 0.020 . 1 . . . . 112 ALA HB . 17943 1 1315 . 1 1 112 112 ALA HB3 H 1 1.640 0.020 . 1 . . . . 112 ALA HB . 17943 1 1316 . 1 1 112 112 ALA C C 13 179.100 0.200 . 1 . . . . 112 ALA C . 17943 1 1317 . 1 1 112 112 ALA CA C 13 54.900 0.200 . 1 . . . . 112 ALA CA . 17943 1 1318 . 1 1 112 112 ALA CB C 13 19.700 0.200 . 1 . . . . 112 ALA CB . 17943 1 1319 . 1 1 112 112 ALA N N 15 121.300 0.200 . 1 . . . . 112 ALA N . 17943 1 1320 . 1 1 113 113 GLU H H 1 8.730 0.020 . 1 . . . . 113 GLU H . 17943 1 1321 . 1 1 113 113 GLU HA H 1 3.860 0.020 . 1 . . . . 113 GLU HA . 17943 1 1322 . 1 1 113 113 GLU HB2 H 1 2.060 0.020 . 2 . . . . 113 GLU HB2 . 17943 1 1323 . 1 1 113 113 GLU HB3 H 1 2.020 0.020 . 2 . . . . 113 GLU HB3 . 17943 1 1324 . 1 1 113 113 GLU HG2 H 1 2.520 0.020 . 2 . . . . 113 GLU HG2 . 17943 1 1325 . 1 1 113 113 GLU HG3 H 1 2.220 0.020 . 2 . . . . 113 GLU HG3 . 17943 1 1326 . 1 1 113 113 GLU C C 13 179.000 0.200 . 1 . . . . 113 GLU C . 17943 1 1327 . 1 1 113 113 GLU CA C 13 59.700 0.200 . 1 . . . . 113 GLU CA . 17943 1 1328 . 1 1 113 113 GLU CB C 13 29.500 0.200 . 1 . . . . 113 GLU CB . 17943 1 1329 . 1 1 113 113 GLU CG C 13 37.000 0.200 . 1 . . . . 113 GLU CG . 17943 1 1330 . 1 1 113 113 GLU N N 15 116.600 0.200 . 1 . . . . 113 GLU N . 17943 1 1331 . 1 1 114 114 PHE H H 1 6.840 0.020 . 1 . . . . 114 PHE H . 17943 1 1332 . 1 1 114 114 PHE HA H 1 4.020 0.020 . 1 . . . . 114 PHE HA . 17943 1 1333 . 1 1 114 114 PHE HB2 H 1 3.160 0.020 . 2 . . . . 114 PHE HB2 . 17943 1 1334 . 1 1 114 114 PHE HB3 H 1 2.800 0.020 . 2 . . . . 114 PHE HB3 . 17943 1 1335 . 1 1 114 114 PHE HD1 H 1 6.720 0.020 . 3 . . . . 114 PHE HD1 . 17943 1 1336 . 1 1 114 114 PHE HD2 H 1 6.720 0.020 . 3 . . . . 114 PHE HD2 . 17943 1 1337 . 1 1 114 114 PHE HE1 H 1 6.580 0.020 . 3 . . . . 114 PHE HE1 . 17943 1 1338 . 1 1 114 114 PHE HE2 H 1 6.580 0.020 . 3 . . . . 114 PHE HE2 . 17943 1 1339 . 1 1 114 114 PHE C C 13 175.900 0.200 . 1 . . . . 114 PHE C . 17943 1 1340 . 1 1 114 114 PHE CA C 13 61.100 0.200 . 1 . . . . 114 PHE CA . 17943 1 1341 . 1 1 114 114 PHE CB C 13 38.700 0.200 . 1 . . . . 114 PHE CB . 17943 1 1342 . 1 1 114 114 PHE CD1 C 13 131.300 0.200 . 3 . . . . 114 PHE CD1 . 17943 1 1343 . 1 1 114 114 PHE CD2 C 13 131.300 0.200 . 3 . . . . 114 PHE CD2 . 17943 1 1344 . 1 1 114 114 PHE CE1 C 13 131.100 0.200 . 3 . . . . 114 PHE CE1 . 17943 1 1345 . 1 1 114 114 PHE CE2 C 13 131.100 0.200 . 3 . . . . 114 PHE CE2 . 17943 1 1346 . 1 1 114 114 PHE N N 15 118.800 0.200 . 1 . . . . 114 PHE N . 17943 1 1347 . 1 1 115 115 LEU H H 1 7.180 0.020 . 1 . . . . 115 LEU H . 17943 1 1348 . 1 1 115 115 LEU HA H 1 3.360 0.020 . 1 . . . . 115 LEU HA . 17943 1 1349 . 1 1 115 115 LEU HB2 H 1 1.710 0.020 . 2 . . . . 115 LEU HB2 . 17943 1 1350 . 1 1 115 115 LEU HB3 H 1 0.950 0.020 . 2 . . . . 115 LEU HB3 . 17943 1 1351 . 1 1 115 115 LEU HG H 1 1.620 0.020 . 1 . . . . 115 LEU HG . 17943 1 1352 . 1 1 115 115 LEU HD11 H 1 0.610 0.020 . 2 . . . . 115 LEU HD1 . 17943 1 1353 . 1 1 115 115 LEU HD12 H 1 0.610 0.020 . 2 . . . . 115 LEU HD1 . 17943 1 1354 . 1 1 115 115 LEU HD13 H 1 0.610 0.020 . 2 . . . . 115 LEU HD1 . 17943 1 1355 . 1 1 115 115 LEU HD21 H 1 0.330 0.020 . 2 . . . . 115 LEU HD2 . 17943 1 1356 . 1 1 115 115 LEU HD22 H 1 0.330 0.020 . 2 . . . . 115 LEU HD2 . 17943 1 1357 . 1 1 115 115 LEU HD23 H 1 0.330 0.020 . 2 . . . . 115 LEU HD2 . 17943 1 1358 . 1 1 115 115 LEU C C 13 179.000 0.200 . 1 . . . . 115 LEU C . 17943 1 1359 . 1 1 115 115 LEU CA C 13 57.900 0.200 . 1 . . . . 115 LEU CA . 17943 1 1360 . 1 1 115 115 LEU CB C 13 40.600 0.200 . 1 . . . . 115 LEU CB . 17943 1 1361 . 1 1 115 115 LEU CG C 13 27.000 0.200 . 1 . . . . 115 LEU CG . 17943 1 1362 . 1 1 115 115 LEU CD1 C 13 25.500 0.200 . 2 . . . . 115 LEU CD1 . 17943 1 1363 . 1 1 115 115 LEU CD2 C 13 22.100 0.200 . 2 . . . . 115 LEU CD2 . 17943 1 1364 . 1 1 115 115 LEU N N 15 118.200 0.200 . 1 . . . . 115 LEU N . 17943 1 1365 . 1 1 116 116 ALA H H 1 8.660 0.020 . 1 . . . . 116 ALA H . 17943 1 1366 . 1 1 116 116 ALA HA H 1 4.570 0.020 . 1 . . . . 116 ALA HA . 17943 1 1367 . 1 1 116 116 ALA HB1 H 1 1.290 0.020 . 1 . . . . 116 ALA HB . 17943 1 1368 . 1 1 116 116 ALA HB2 H 1 1.290 0.020 . 1 . . . . 116 ALA HB . 17943 1 1369 . 1 1 116 116 ALA HB3 H 1 1.290 0.020 . 1 . . . . 116 ALA HB . 17943 1 1370 . 1 1 116 116 ALA C C 13 182.100 0.200 . 1 . . . . 116 ALA C . 17943 1 1371 . 1 1 116 116 ALA CA C 13 54.700 0.200 . 1 . . . . 116 ALA CA . 17943 1 1372 . 1 1 116 116 ALA CB C 13 17.900 0.200 . 1 . . . . 116 ALA CB . 17943 1 1373 . 1 1 116 116 ALA N N 15 121.200 0.200 . 1 . . . . 116 ALA N . 17943 1 1374 . 1 1 117 117 GLU H H 1 7.840 0.020 . 1 . . . . 117 GLU H . 17943 1 1375 . 1 1 117 117 GLU HA H 1 3.940 0.020 . 1 . . . . 117 GLU HA . 17943 1 1376 . 1 1 117 117 GLU HB2 H 1 2.090 0.020 . 2 . . . . 117 GLU HB2 . 17943 1 1377 . 1 1 117 117 GLU HB3 H 1 1.890 0.020 . 2 . . . . 117 GLU HB3 . 17943 1 1378 . 1 1 117 117 GLU HG2 H 1 2.380 0.020 . 2 . . . . 117 GLU HG2 . 17943 1 1379 . 1 1 117 117 GLU HG3 H 1 2.180 0.020 . 2 . . . . 117 GLU HG3 . 17943 1 1380 . 1 1 117 117 GLU C C 13 178.400 0.200 . 1 . . . . 117 GLU C . 17943 1 1381 . 1 1 117 117 GLU CA C 13 59.100 0.200 . 1 . . . . 117 GLU CA . 17943 1 1382 . 1 1 117 117 GLU CB C 13 28.800 0.200 . 1 . . . . 117 GLU CB . 17943 1 1383 . 1 1 117 117 GLU CG C 13 36.300 0.200 . 1 . . . . 117 GLU CG . 17943 1 1384 . 1 1 117 117 GLU CD C 13 183.500 0.200 . 1 . . . . 117 GLU CD . 17943 1 1385 . 1 1 117 117 GLU N N 15 121.900 0.200 . 1 . . . . 117 GLU N . 17943 1 1386 . 1 1 118 118 LYS H H 1 7.010 0.020 . 1 . . . . 118 LYS H . 17943 1 1387 . 1 1 118 118 LYS HA H 1 4.040 0.020 . 1 . . . . 118 LYS HA . 17943 1 1388 . 1 1 118 118 LYS HB2 H 1 1.900 0.020 . 2 . . . . 118 LYS HB2 . 17943 1 1389 . 1 1 118 118 LYS HB3 H 1 1.580 0.020 . 2 . . . . 118 LYS HB3 . 17943 1 1390 . 1 1 118 118 LYS HG2 H 1 0.380 0.020 . 2 . . . . 118 LYS HG2 . 17943 1 1391 . 1 1 118 118 LYS HG3 H 1 -0.210 0.020 . 2 . . . . 118 LYS HG3 . 17943 1 1392 . 1 1 118 118 LYS HD2 H 1 1.080 0.020 . 2 . . . . 118 LYS HD2 . 17943 1 1393 . 1 1 118 118 LYS HD3 H 1 1.080 0.020 . 2 . . . . 118 LYS HD3 . 17943 1 1394 . 1 1 118 118 LYS HE2 H 1 2.120 0.020 . 2 . . . . 118 LYS HE2 . 17943 1 1395 . 1 1 118 118 LYS HE3 H 1 1.960 0.020 . 2 . . . . 118 LYS HE3 . 17943 1 1396 . 1 1 118 118 LYS C C 13 176.000 0.200 . 1 . . . . 118 LYS C . 17943 1 1397 . 1 1 118 118 LYS CA C 13 54.100 0.200 . 1 . . . . 118 LYS CA . 17943 1 1398 . 1 1 118 118 LYS CB C 13 31.700 0.200 . 1 . . . . 118 LYS CB . 17943 1 1399 . 1 1 118 118 LYS CG C 13 22.700 0.200 . 1 . . . . 118 LYS CG . 17943 1 1400 . 1 1 118 118 LYS CD C 13 27.500 0.200 . 1 . . . . 118 LYS CD . 17943 1 1401 . 1 1 118 118 LYS CE C 13 42.300 0.200 . 1 . . . . 118 LYS CE . 17943 1 1402 . 1 1 118 118 LYS N N 15 115.400 0.200 . 1 . . . . 118 LYS N . 17943 1 1403 . 1 1 119 119 GLY H H 1 7.680 0.020 . 1 . . . . 119 GLY H . 17943 1 1404 . 1 1 119 119 GLY HA2 H 1 3.980 0.020 . 2 . . . . 119 GLY HA2 . 17943 1 1405 . 1 1 119 119 GLY HA3 H 1 3.430 0.020 . 2 . . . . 119 GLY HA3 . 17943 1 1406 . 1 1 119 119 GLY C C 13 174.000 0.200 . 1 . . . . 119 GLY C . 17943 1 1407 . 1 1 119 119 GLY CA C 13 44.900 0.200 . 1 . . . . 119 GLY CA . 17943 1 1408 . 1 1 119 119 GLY N N 15 105.900 0.200 . 1 . . . . 119 GLY N . 17943 1 1409 . 1 1 120 120 TYR H H 1 7.990 0.020 . 1 . . . . 120 TYR H . 17943 1 1410 . 1 1 120 120 TYR HA H 1 4.470 0.020 . 1 . . . . 120 TYR HA . 17943 1 1411 . 1 1 120 120 TYR HB2 H 1 2.670 0.020 . 2 . . . . 120 TYR HB2 . 17943 1 1412 . 1 1 120 120 TYR HB3 H 1 2.250 0.020 . 2 . . . . 120 TYR HB3 . 17943 1 1413 . 1 1 120 120 TYR HD1 H 1 7.080 0.020 . 3 . . . . 120 TYR HD1 . 17943 1 1414 . 1 1 120 120 TYR HD2 H 1 7.080 0.020 . 3 . . . . 120 TYR HD2 . 17943 1 1415 . 1 1 120 120 TYR HE1 H 1 6.960 0.020 . 3 . . . . 120 TYR HE1 . 17943 1 1416 . 1 1 120 120 TYR HE2 H 1 6.960 0.020 . 3 . . . . 120 TYR HE2 . 17943 1 1417 . 1 1 120 120 TYR C C 13 175.400 0.200 . 1 . . . . 120 TYR C . 17943 1 1418 . 1 1 120 120 TYR CA C 13 58.800 0.200 . 1 . . . . 120 TYR CA . 17943 1 1419 . 1 1 120 120 TYR CB C 13 40.000 0.200 . 1 . . . . 120 TYR CB . 17943 1 1420 . 1 1 120 120 TYR CD1 C 13 133.100 0.200 . 3 . . . . 120 TYR CD1 . 17943 1 1421 . 1 1 120 120 TYR CD2 C 13 133.100 0.200 . 3 . . . . 120 TYR CD2 . 17943 1 1422 . 1 1 120 120 TYR CE1 C 13 118.000 0.200 . 3 . . . . 120 TYR CE1 . 17943 1 1423 . 1 1 120 120 TYR CE2 C 13 118.000 0.200 . 3 . . . . 120 TYR CE2 . 17943 1 1424 . 1 1 120 120 TYR N N 15 120.300 0.200 . 1 . . . . 120 TYR N . 17943 1 1425 . 1 1 121 121 GLY H H 1 8.560 0.020 . 1 . . . . 121 GLY H . 17943 1 1426 . 1 1 121 121 GLY HA2 H 1 4.470 0.020 . 2 . . . . 121 GLY HA2 . 17943 1 1427 . 1 1 121 121 GLY HA3 H 1 3.850 0.020 . 2 . . . . 121 GLY HA3 . 17943 1 1428 . 1 1 121 121 GLY C C 13 173.100 0.200 . 1 . . . . 121 GLY C . 17943 1 1429 . 1 1 121 121 GLY CA C 13 46.500 0.200 . 1 . . . . 121 GLY CA . 17943 1 1430 . 1 1 121 121 GLY N N 15 107.800 0.200 . 1 . . . . 121 GLY N . 17943 1 1431 . 1 1 122 122 ARG H H 1 9.140 0.020 . 1 . . . . 122 ARG H . 17943 1 1432 . 1 1 122 122 ARG HA H 1 4.620 0.020 . 1 . . . . 122 ARG HA . 17943 1 1433 . 1 1 122 122 ARG HB2 H 1 1.870 0.020 . 2 . . . . 122 ARG HB2 . 17943 1 1434 . 1 1 122 122 ARG HB3 H 1 1.690 0.020 . 2 . . . . 122 ARG HB3 . 17943 1 1435 . 1 1 122 122 ARG HG2 H 1 1.620 0.020 . 2 . . . . 122 ARG HG2 . 17943 1 1436 . 1 1 122 122 ARG HG3 H 1 1.620 0.020 . 2 . . . . 122 ARG HG3 . 17943 1 1437 . 1 1 122 122 ARG HD2 H 1 3.210 0.020 . 2 . . . . 122 ARG HD2 . 17943 1 1438 . 1 1 122 122 ARG HD3 H 1 3.210 0.020 . 2 . . . . 122 ARG HD3 . 17943 1 1439 . 1 1 122 122 ARG C C 13 174.700 0.200 . 1 . . . . 122 ARG C . 17943 1 1440 . 1 1 122 122 ARG CA C 13 54.700 0.200 . 1 . . . . 122 ARG CA . 17943 1 1441 . 1 1 122 122 ARG CB C 13 30.100 0.200 . 1 . . . . 122 ARG CB . 17943 1 1442 . 1 1 122 122 ARG CG C 13 26.700 0.200 . 1 . . . . 122 ARG CG . 17943 1 1443 . 1 1 122 122 ARG CD C 13 43.100 0.200 . 1 . . . . 122 ARG CD . 17943 1 1444 . 1 1 122 122 ARG N N 15 129.500 0.200 . 1 . . . . 122 ARG N . 17943 1 1445 . 1 1 123 123 PRO HA H 1 4.330 0.020 . 1 . . . . 123 PRO HA . 17943 1 1446 . 1 1 123 123 PRO HB2 H 1 1.750 0.020 . 2 . . . . 123 PRO HB2 . 17943 1 1447 . 1 1 123 123 PRO HB3 H 1 1.750 0.020 . 2 . . . . 123 PRO HB3 . 17943 1 1448 . 1 1 123 123 PRO HG2 H 1 1.850 0.020 . 2 . . . . 123 PRO HG2 . 17943 1 1449 . 1 1 123 123 PRO HG3 H 1 1.190 0.020 . 2 . . . . 123 PRO HG3 . 17943 1 1450 . 1 1 123 123 PRO HD2 H 1 3.700 0.020 . 2 . . . . 123 PRO HD2 . 17943 1 1451 . 1 1 123 123 PRO HD3 H 1 3.560 0.020 . 2 . . . . 123 PRO HD3 . 17943 1 1452 . 1 1 123 123 PRO C C 13 176.300 0.200 . 1 . . . . 123 PRO C . 17943 1 1453 . 1 1 123 123 PRO CA C 13 63.600 0.200 . 1 . . . . 123 PRO CA . 17943 1 1454 . 1 1 123 123 PRO CB C 13 31.800 0.200 . 1 . . . . 123 PRO CB . 17943 1 1455 . 1 1 123 123 PRO CG C 13 27.300 0.200 . 1 . . . . 123 PRO CG . 17943 1 1456 . 1 1 123 123 PRO CD C 13 50.600 0.200 . 1 . . . . 123 PRO CD . 17943 1 1457 . 1 1 123 123 PRO N N 15 136.700 0.200 . 1 . . . . 123 PRO N . 17943 1 1458 . 1 1 124 124 ASN H H 1 8.690 0.020 . 1 . . . . 124 ASN H . 17943 1 1459 . 1 1 124 124 ASN HA H 1 4.630 0.020 . 1 . . . . 124 ASN HA . 17943 1 1460 . 1 1 124 124 ASN HB2 H 1 2.860 0.020 . 2 . . . . 124 ASN HB2 . 17943 1 1461 . 1 1 124 124 ASN HB3 H 1 2.760 0.020 . 2 . . . . 124 ASN HB3 . 17943 1 1462 . 1 1 124 124 ASN HD21 H 1 7.590 0.020 . 2 . . . . 124 ASN HD21 . 17943 1 1463 . 1 1 124 124 ASN HD22 H 1 6.900 0.020 . 2 . . . . 124 ASN HD22 . 17943 1 1464 . 1 1 124 124 ASN C C 13 175.100 0.200 . 1 . . . . 124 ASN C . 17943 1 1465 . 1 1 124 124 ASN CA C 13 53.700 0.200 . 1 . . . . 124 ASN CA . 17943 1 1466 . 1 1 124 124 ASN CB C 13 38.800 0.200 . 1 . . . . 124 ASN CB . 17943 1 1467 . 1 1 124 124 ASN CG C 13 177.200 0.200 . 1 . . . . 124 ASN CG . 17943 1 1468 . 1 1 124 124 ASN N N 15 118.300 0.200 . 1 . . . . 124 ASN N . 17943 1 1469 . 1 1 124 124 ASN ND2 N 15 113.100 0.200 . 1 . . . . 124 ASN ND2 . 17943 1 1470 . 1 1 125 125 GLU H H 1 8.320 0.020 . 1 . . . . 125 GLU H . 17943 1 1471 . 1 1 125 125 GLU HA H 1 4.360 0.020 . 1 . . . . 125 GLU HA . 17943 1 1472 . 1 1 125 125 GLU HB2 H 1 2.070 0.020 . 2 . . . . 125 GLU HB2 . 17943 1 1473 . 1 1 125 125 GLU HB3 H 1 1.930 0.020 . 2 . . . . 125 GLU HB3 . 17943 1 1474 . 1 1 125 125 GLU HG2 H 1 2.270 0.020 . 2 . . . . 125 GLU HG2 . 17943 1 1475 . 1 1 125 125 GLU HG3 H 1 2.220 0.020 . 2 . . . . 125 GLU HG3 . 17943 1 1476 . 1 1 125 125 GLU C C 13 176.200 0.200 . 1 . . . . 125 GLU C . 17943 1 1477 . 1 1 125 125 GLU CA C 13 56.500 0.200 . 1 . . . . 125 GLU CA . 17943 1 1478 . 1 1 125 125 GLU CB C 13 30.600 0.200 . 1 . . . . 125 GLU CB . 17943 1 1479 . 1 1 125 125 GLU CG C 13 36.300 0.200 . 1 . . . . 125 GLU CG . 17943 1 1480 . 1 1 125 125 GLU N N 15 121.200 0.200 . 1 . . . . 125 GLU N . 17943 1 1481 . 1 1 126 126 THR H H 1 8.220 0.020 . 1 . . . . 126 THR H . 17943 1 1482 . 1 1 126 126 THR HA H 1 4.610 0.020 . 1 . . . . 126 THR HA . 17943 1 1483 . 1 1 126 126 THR HB H 1 4.160 0.020 . 1 . . . . 126 THR HB . 17943 1 1484 . 1 1 126 126 THR HG21 H 1 1.240 0.020 . 1 . . . . 126 THR HG2 . 17943 1 1485 . 1 1 126 126 THR HG22 H 1 1.240 0.020 . 1 . . . . 126 THR HG2 . 17943 1 1486 . 1 1 126 126 THR HG23 H 1 1.240 0.020 . 1 . . . . 126 THR HG2 . 17943 1 1487 . 1 1 126 126 THR C C 13 172.100 0.200 . 1 . . . . 126 THR C . 17943 1 1488 . 1 1 126 126 THR CA C 13 59.500 0.200 . 1 . . . . 126 THR CA . 17943 1 1489 . 1 1 126 126 THR CB C 13 69.900 0.200 . 1 . . . . 126 THR CB . 17943 1 1490 . 1 1 126 126 THR CG2 C 13 21.200 0.200 . 1 . . . . 126 THR CG2 . 17943 1 1491 . 1 1 126 126 THR N N 15 117.700 0.200 . 1 . . . . 126 THR N . 17943 1 1492 . 1 1 127 127 PRO HA H 1 4.230 0.020 . 1 . . . . 127 PRO HA . 17943 1 1493 . 1 1 127 127 PRO HB2 H 1 2.220 0.020 . 2 . . . . 127 PRO HB2 . 17943 1 1494 . 1 1 127 127 PRO HB3 H 1 1.890 0.020 . 2 . . . . 127 PRO HB3 . 17943 1 1495 . 1 1 127 127 PRO HG2 H 1 1.970 0.020 . 2 . . . . 127 PRO HG2 . 17943 1 1496 . 1 1 127 127 PRO HG3 H 1 1.900 0.020 . 2 . . . . 127 PRO HG3 . 17943 1 1497 . 1 1 127 127 PRO HD2 H 1 3.750 0.020 . 2 . . . . 127 PRO HD2 . 17943 1 1498 . 1 1 127 127 PRO HD3 H 1 3.670 0.020 . 2 . . . . 127 PRO HD3 . 17943 1 1499 . 1 1 127 127 PRO C C 13 182.200 0.200 . 1 . . . . 127 PRO C . 17943 1 1500 . 1 1 127 127 PRO CA C 13 65.000 0.200 . 1 . . . . 127 PRO CA . 17943 1 1501 . 1 1 127 127 PRO CB C 13 32.100 0.200 . 1 . . . . 127 PRO CB . 17943 1 1502 . 1 1 127 127 PRO CG C 13 27.200 0.200 . 1 . . . . 127 PRO CG . 17943 1 1503 . 1 1 127 127 PRO CD C 13 50.800 0.200 . 1 . . . . 127 PRO CD . 17943 1 1504 . 1 1 127 127 PRO N N 15 143.500 0.200 . 1 . . . . 127 PRO N . 17943 1 stop_ save_