data_18188 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 18188 _Entry.Title ; CohA2 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2012-01-09 _Entry.Accession_date 2012-01-09 _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 Yingang Feng . . . 18188 2 Zhenling Cui . . . 18188 3 Yifei Li . . . 18188 4 Qiu Cui . . . 18188 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 18188 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 640 18188 '15N chemical shifts' 151 18188 '1H chemical shifts' 1024 18188 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 2012-01-09 update BMRB 'update entry citation' 18188 1 . . 2012-03-27 2012-01-09 original author 'original release' 18188 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 18188 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22446850 _Citation.Full_citation . _Citation.Title 'Resonance assignments of cohesin and dockerin domains from Clostridium acetobutylicum ATCC824.' _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 73 _Citation.Page_last 76 _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 Zhenling Cui . . . 18188 1 2 Yifei Li . . . 18188 1 3 Yan Xiao . . . 18188 1 4 Yingang Feng . . . 18188 1 5 Qui Cui . . . 18188 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 18188 _Assembly.ID 1 _Assembly.Name CohA2 _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 CohA2 1 $CohA2 A . yes native no no . . . 18188 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_CohA2 _Entity.Sf_category entity _Entity.Sf_framecode CohA2 _Entity.Entry_ID 18188 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name CohA2 _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 ; GSASVKNETVKLSVGTVSGN PGDTVKVPVTISQVSTPVGL ICMDISYDASKFTVKDVLPN TDLVKDTDNYSFIVNTSTPG KISITFTDPTLANYPISVDG ILAYLDFIINSNATAGDSAL TVDPATLIVADENDKDIKDA ASNGKITVTGSAPTS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 155 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 -3 GLY . 18188 1 2 -2 SER . 18188 1 3 -1 ALA . 18188 1 4 0 SER . 18188 1 5 1 VAL . 18188 1 6 2 LYS . 18188 1 7 3 ASN . 18188 1 8 4 GLU . 18188 1 9 5 THR . 18188 1 10 6 VAL . 18188 1 11 7 LYS . 18188 1 12 8 LEU . 18188 1 13 9 SER . 18188 1 14 10 VAL . 18188 1 15 11 GLY . 18188 1 16 12 THR . 18188 1 17 13 VAL . 18188 1 18 14 SER . 18188 1 19 15 GLY . 18188 1 20 16 ASN . 18188 1 21 17 PRO . 18188 1 22 18 GLY . 18188 1 23 19 ASP . 18188 1 24 20 THR . 18188 1 25 21 VAL . 18188 1 26 22 LYS . 18188 1 27 23 VAL . 18188 1 28 24 PRO . 18188 1 29 25 VAL . 18188 1 30 26 THR . 18188 1 31 27 ILE . 18188 1 32 28 SER . 18188 1 33 29 GLN . 18188 1 34 30 VAL . 18188 1 35 31 SER . 18188 1 36 32 THR . 18188 1 37 33 PRO . 18188 1 38 34 VAL . 18188 1 39 35 GLY . 18188 1 40 36 LEU . 18188 1 41 37 ILE . 18188 1 42 38 CYS . 18188 1 43 39 MET . 18188 1 44 40 ASP . 18188 1 45 41 ILE . 18188 1 46 42 SER . 18188 1 47 43 TYR . 18188 1 48 44 ASP . 18188 1 49 45 ALA . 18188 1 50 46 SER . 18188 1 51 47 LYS . 18188 1 52 48 PHE . 18188 1 53 49 THR . 18188 1 54 50 VAL . 18188 1 55 51 LYS . 18188 1 56 52 ASP . 18188 1 57 53 VAL . 18188 1 58 54 LEU . 18188 1 59 55 PRO . 18188 1 60 56 ASN . 18188 1 61 57 THR . 18188 1 62 58 ASP . 18188 1 63 59 LEU . 18188 1 64 60 VAL . 18188 1 65 61 LYS . 18188 1 66 62 ASP . 18188 1 67 63 THR . 18188 1 68 64 ASP . 18188 1 69 65 ASN . 18188 1 70 66 TYR . 18188 1 71 67 SER . 18188 1 72 68 PHE . 18188 1 73 69 ILE . 18188 1 74 70 VAL . 18188 1 75 71 ASN . 18188 1 76 72 THR . 18188 1 77 73 SER . 18188 1 78 74 THR . 18188 1 79 75 PRO . 18188 1 80 76 GLY . 18188 1 81 77 LYS . 18188 1 82 78 ILE . 18188 1 83 79 SER . 18188 1 84 80 ILE . 18188 1 85 81 THR . 18188 1 86 82 PHE . 18188 1 87 83 THR . 18188 1 88 84 ASP . 18188 1 89 85 PRO . 18188 1 90 86 THR . 18188 1 91 87 LEU . 18188 1 92 88 ALA . 18188 1 93 89 ASN . 18188 1 94 90 TYR . 18188 1 95 91 PRO . 18188 1 96 92 ILE . 18188 1 97 93 SER . 18188 1 98 94 VAL . 18188 1 99 95 ASP . 18188 1 100 96 GLY . 18188 1 101 97 ILE . 18188 1 102 98 LEU . 18188 1 103 99 ALA . 18188 1 104 100 TYR . 18188 1 105 101 LEU . 18188 1 106 102 ASP . 18188 1 107 103 PHE . 18188 1 108 104 ILE . 18188 1 109 105 ILE . 18188 1 110 106 ASN . 18188 1 111 107 SER . 18188 1 112 108 ASN . 18188 1 113 109 ALA . 18188 1 114 110 THR . 18188 1 115 111 ALA . 18188 1 116 112 GLY . 18188 1 117 113 ASP . 18188 1 118 114 SER . 18188 1 119 115 ALA . 18188 1 120 116 LEU . 18188 1 121 117 THR . 18188 1 122 118 VAL . 18188 1 123 119 ASP . 18188 1 124 120 PRO . 18188 1 125 121 ALA . 18188 1 126 122 THR . 18188 1 127 123 LEU . 18188 1 128 124 ILE . 18188 1 129 125 VAL . 18188 1 130 126 ALA . 18188 1 131 127 ASP . 18188 1 132 128 GLU . 18188 1 133 129 ASN . 18188 1 134 130 ASP . 18188 1 135 131 LYS . 18188 1 136 132 ASP . 18188 1 137 133 ILE . 18188 1 138 134 LYS . 18188 1 139 135 ASP . 18188 1 140 136 ALA . 18188 1 141 137 ALA . 18188 1 142 138 SER . 18188 1 143 139 ASN . 18188 1 144 140 GLY . 18188 1 145 141 LYS . 18188 1 146 142 ILE . 18188 1 147 143 THR . 18188 1 148 144 VAL . 18188 1 149 145 THR . 18188 1 150 146 GLY . 18188 1 151 147 SER . 18188 1 152 148 ALA . 18188 1 153 149 PRO . 18188 1 154 150 THR . 18188 1 155 151 SER . 18188 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 18188 1 . SER 2 2 18188 1 . ALA 3 3 18188 1 . SER 4 4 18188 1 . VAL 5 5 18188 1 . LYS 6 6 18188 1 . ASN 7 7 18188 1 . GLU 8 8 18188 1 . THR 9 9 18188 1 . VAL 10 10 18188 1 . LYS 11 11 18188 1 . LEU 12 12 18188 1 . SER 13 13 18188 1 . VAL 14 14 18188 1 . GLY 15 15 18188 1 . THR 16 16 18188 1 . VAL 17 17 18188 1 . SER 18 18 18188 1 . GLY 19 19 18188 1 . ASN 20 20 18188 1 . PRO 21 21 18188 1 . GLY 22 22 18188 1 . ASP 23 23 18188 1 . THR 24 24 18188 1 . VAL 25 25 18188 1 . LYS 26 26 18188 1 . VAL 27 27 18188 1 . PRO 28 28 18188 1 . VAL 29 29 18188 1 . THR 30 30 18188 1 . ILE 31 31 18188 1 . SER 32 32 18188 1 . GLN 33 33 18188 1 . VAL 34 34 18188 1 . SER 35 35 18188 1 . THR 36 36 18188 1 . PRO 37 37 18188 1 . VAL 38 38 18188 1 . GLY 39 39 18188 1 . LEU 40 40 18188 1 . ILE 41 41 18188 1 . CYS 42 42 18188 1 . MET 43 43 18188 1 . ASP 44 44 18188 1 . ILE 45 45 18188 1 . SER 46 46 18188 1 . TYR 47 47 18188 1 . ASP 48 48 18188 1 . ALA 49 49 18188 1 . SER 50 50 18188 1 . LYS 51 51 18188 1 . PHE 52 52 18188 1 . THR 53 53 18188 1 . VAL 54 54 18188 1 . LYS 55 55 18188 1 . ASP 56 56 18188 1 . VAL 57 57 18188 1 . LEU 58 58 18188 1 . PRO 59 59 18188 1 . ASN 60 60 18188 1 . THR 61 61 18188 1 . ASP 62 62 18188 1 . LEU 63 63 18188 1 . VAL 64 64 18188 1 . LYS 65 65 18188 1 . ASP 66 66 18188 1 . THR 67 67 18188 1 . ASP 68 68 18188 1 . ASN 69 69 18188 1 . TYR 70 70 18188 1 . SER 71 71 18188 1 . PHE 72 72 18188 1 . ILE 73 73 18188 1 . VAL 74 74 18188 1 . ASN 75 75 18188 1 . THR 76 76 18188 1 . SER 77 77 18188 1 . THR 78 78 18188 1 . PRO 79 79 18188 1 . GLY 80 80 18188 1 . LYS 81 81 18188 1 . ILE 82 82 18188 1 . SER 83 83 18188 1 . ILE 84 84 18188 1 . THR 85 85 18188 1 . PHE 86 86 18188 1 . THR 87 87 18188 1 . ASP 88 88 18188 1 . PRO 89 89 18188 1 . THR 90 90 18188 1 . LEU 91 91 18188 1 . ALA 92 92 18188 1 . ASN 93 93 18188 1 . TYR 94 94 18188 1 . PRO 95 95 18188 1 . ILE 96 96 18188 1 . SER 97 97 18188 1 . VAL 98 98 18188 1 . ASP 99 99 18188 1 . GLY 100 100 18188 1 . ILE 101 101 18188 1 . LEU 102 102 18188 1 . ALA 103 103 18188 1 . TYR 104 104 18188 1 . LEU 105 105 18188 1 . ASP 106 106 18188 1 . PHE 107 107 18188 1 . ILE 108 108 18188 1 . ILE 109 109 18188 1 . ASN 110 110 18188 1 . SER 111 111 18188 1 . ASN 112 112 18188 1 . ALA 113 113 18188 1 . THR 114 114 18188 1 . ALA 115 115 18188 1 . GLY 116 116 18188 1 . ASP 117 117 18188 1 . SER 118 118 18188 1 . ALA 119 119 18188 1 . LEU 120 120 18188 1 . THR 121 121 18188 1 . VAL 122 122 18188 1 . ASP 123 123 18188 1 . PRO 124 124 18188 1 . ALA 125 125 18188 1 . THR 126 126 18188 1 . LEU 127 127 18188 1 . ILE 128 128 18188 1 . VAL 129 129 18188 1 . ALA 130 130 18188 1 . ASP 131 131 18188 1 . GLU 132 132 18188 1 . ASN 133 133 18188 1 . ASP 134 134 18188 1 . LYS 135 135 18188 1 . ASP 136 136 18188 1 . ILE 137 137 18188 1 . LYS 138 138 18188 1 . ASP 139 139 18188 1 . ALA 140 140 18188 1 . ALA 141 141 18188 1 . SER 142 142 18188 1 . ASN 143 143 18188 1 . GLY 144 144 18188 1 . LYS 145 145 18188 1 . ILE 146 146 18188 1 . THR 147 147 18188 1 . VAL 148 148 18188 1 . THR 149 149 18188 1 . GLY 150 150 18188 1 . SER 151 151 18188 1 . ALA 152 152 18188 1 . PRO 153 153 18188 1 . THR 154 154 18188 1 . SER 155 155 18188 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 18188 _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 $CohA2 . 1488 organism . 'Clostridium acetobutylicum' 'Clostridium acetobutylicum' . . Bacteria . Clostridium acetobutylicum ATCC824 . . . . . . . . . . . . . . . . . . . . 18188 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 18188 _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 $CohA2 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET28aNS . . . . . . 18188 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 18188 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 CohA2 '[U-100% 13C; U-100% 15N]' . . 1 $CohA2 . . 0.6 . . mM . . . . 18188 1 2 'sodium acetate' 'natural abundance' . . . . . . 20 . . mM . . . . 18188 1 3 'potassium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 18188 1 4 'calcium chloride' 'natural abundance' . . . . . . 1 . . mM . . . . 18188 1 5 'sodium azide' 'natural abundance' . . . . . . 0.01 . . '% w/v' . . . . 18188 1 6 DSS 'natural abundance' . . . . . . 0.05 . . '% w/v' . . . . 18188 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 18188 _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' 121 . mM 18188 1 pH 4.8 . pH 18188 1 pressure 1 . atm 18188 1 temperature 298 . K 18188 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 18188 _Software.ID 1 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 18188 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 18188 1 'peak picking' 18188 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 18188 _Software.ID 2 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 18188 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 18188 2 processing 18188 2 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 18188 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 18188 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker DMX . 600 . . . 18188 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 18188 _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_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18188 1 2 '2D 1H-13C HSQC' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18188 1 3 '3D HNCACB' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18188 1 4 '3D CBCA(CO)NH' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18188 1 5 '3D HNCO' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18188 1 6 '3D HBHA(CO)NH' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18188 1 7 '3D HCCH-TOCSY' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18188 1 8 '3D 1H-13C NOESY' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18188 1 9 '3D 1H-15N NOESY' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18188 1 10 '3D 1H-13C NOESY aromatic' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18188 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 18188 _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 . _NMR_spec_expt.Software_label . _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_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 18188 _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 . . . . . . . . . 18188 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 18188 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 18188 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 18188 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 18188 1 3 '3D HNCACB' . . . 18188 1 4 '3D CBCA(CO)NH' . . . 18188 1 7 '3D HCCH-TOCSY' . . . 18188 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 3.9110 0.02 . 2 . . . . -3 GLY HA1 . 18188 1 2 . 1 1 1 1 GLY HA3 H 1 3.9110 0.02 . 2 . . . . -3 GLY HA2 . 18188 1 3 . 1 1 1 1 GLY C C 13 170.3610 0.3 . 1 . . . . -3 GLY C . 18188 1 4 . 1 1 1 1 GLY CA C 13 43.4870 0.3 . 1 . . . . -3 GLY CA . 18188 1 5 . 1 1 2 2 SER H H 1 8.6870 0.02 . 1 . . . . -2 SER HN . 18188 1 6 . 1 1 2 2 SER HA H 1 4.5100 0.02 . 1 . . . . -2 SER HA . 18188 1 7 . 1 1 2 2 SER HB2 H 1 3.8850 0.02 . 2 . . . . -2 SER HB1 . 18188 1 8 . 1 1 2 2 SER HB3 H 1 3.8850 0.02 . 2 . . . . -2 SER HB2 . 18188 1 9 . 1 1 2 2 SER C C 13 174.3350 0.3 . 1 . . . . -2 SER C . 18188 1 10 . 1 1 2 2 SER CA C 13 58.4270 0.3 . 1 . . . . -2 SER CA . 18188 1 11 . 1 1 2 2 SER CB C 13 64.1130 0.3 . 1 . . . . -2 SER CB . 18188 1 12 . 1 1 2 2 SER N N 15 116.0500 0.2 . 1 . . . . -2 SER N . 18188 1 13 . 1 1 3 3 ALA H H 1 8.5400 0.02 . 1 . . . . -1 ALA HN . 18188 1 14 . 1 1 3 3 ALA HA H 1 4.3990 0.02 . 1 . . . . -1 ALA HA . 18188 1 15 . 1 1 3 3 ALA HB1 H 1 1.4150 0.02 . 1 . . . . -1 ALA HB1 . 18188 1 16 . 1 1 3 3 ALA HB2 H 1 1.4150 0.02 . 1 . . . . -1 ALA HB1 . 18188 1 17 . 1 1 3 3 ALA HB3 H 1 1.4150 0.02 . 1 . . . . -1 ALA HB1 . 18188 1 18 . 1 1 3 3 ALA C C 13 177.8290 0.3 . 1 . . . . -1 ALA C . 18188 1 19 . 1 1 3 3 ALA CA C 13 52.6780 0.3 . 1 . . . . -1 ALA CA . 18188 1 20 . 1 1 3 3 ALA CB C 13 19.2930 0.3 . 1 . . . . -1 ALA CB . 18188 1 21 . 1 1 3 3 ALA N N 15 126.2110 0.2 . 1 . . . . -1 ALA N . 18188 1 22 . 1 1 4 4 SER H H 1 8.3060 0.02 . 1 . . . . 0 SER HN . 18188 1 23 . 1 1 4 4 SER HA H 1 4.4620 0.02 . 1 . . . . 0 SER HA . 18188 1 24 . 1 1 4 4 SER HB2 H 1 3.8540 0.02 . 2 . . . . 0 SER HB1 . 18188 1 25 . 1 1 4 4 SER HB3 H 1 3.8540 0.02 . 2 . . . . 0 SER HB2 . 18188 1 26 . 1 1 4 4 SER C C 13 174.5900 0.3 . 1 . . . . 0 SER C . 18188 1 27 . 1 1 4 4 SER CA C 13 58.2700 0.3 . 1 . . . . 0 SER CA . 18188 1 28 . 1 1 4 4 SER CB C 13 63.9300 0.3 . 1 . . . . 0 SER CB . 18188 1 29 . 1 1 4 4 SER N N 15 115.4550 0.2 . 1 . . . . 0 SER N . 18188 1 30 . 1 1 5 5 VAL H H 1 8.1470 0.02 . 1 . . . . 1 VAL HN . 18188 1 31 . 1 1 5 5 VAL HA H 1 4.1420 0.02 . 1 . . . . 1 VAL HA . 18188 1 32 . 1 1 5 5 VAL HB H 1 2.0870 0.02 . 1 . . . . 1 VAL HB . 18188 1 33 . 1 1 5 5 VAL HG11 H 1 0.9270 0.02 . 2 . . . . 1 VAL HG11 . 18188 1 34 . 1 1 5 5 VAL HG12 H 1 0.9270 0.02 . 2 . . . . 1 VAL HG11 . 18188 1 35 . 1 1 5 5 VAL HG13 H 1 0.9270 0.02 . 2 . . . . 1 VAL HG11 . 18188 1 36 . 1 1 5 5 VAL HG21 H 1 0.9270 0.02 . 2 . . . . 1 VAL HG21 . 18188 1 37 . 1 1 5 5 VAL HG22 H 1 0.9270 0.02 . 2 . . . . 1 VAL HG21 . 18188 1 38 . 1 1 5 5 VAL HG23 H 1 0.9270 0.02 . 2 . . . . 1 VAL HG21 . 18188 1 39 . 1 1 5 5 VAL C C 13 176.1160 0.3 . 1 . . . . 1 VAL C . 18188 1 40 . 1 1 5 5 VAL CA C 13 62.3390 0.3 . 1 . . . . 1 VAL CA . 18188 1 41 . 1 1 5 5 VAL CB C 13 32.6400 0.3 . 1 . . . . 1 VAL CB . 18188 1 42 . 1 1 5 5 VAL CG1 C 13 20.8520 0.3 . 2 . . . . 1 VAL CG1 . 18188 1 43 . 1 1 5 5 VAL CG2 C 13 20.8520 0.3 . 2 . . . . 1 VAL CG2 . 18188 1 44 . 1 1 5 5 VAL N N 15 122.1400 0.2 . 1 . . . . 1 VAL N . 18188 1 45 . 1 1 6 6 LYS H H 1 8.3940 0.02 . 1 . . . . 2 LYS HN . 18188 1 46 . 1 1 6 6 LYS HA H 1 4.3050 0.02 . 1 . . . . 2 LYS HA . 18188 1 47 . 1 1 6 6 LYS HB2 H 1 1.7480 0.02 . 2 . . . . 2 LYS HB1 . 18188 1 48 . 1 1 6 6 LYS HB3 H 1 1.7810 0.02 . 2 . . . . 2 LYS HB2 . 18188 1 49 . 1 1 6 6 LYS HG2 H 1 1.3750 0.02 . 2 . . . . 2 LYS HG1 . 18188 1 50 . 1 1 6 6 LYS HG3 H 1 1.4240 0.02 . 2 . . . . 2 LYS HG2 . 18188 1 51 . 1 1 6 6 LYS HD2 H 1 1.6660 0.02 . 2 . . . . 2 LYS HD1 . 18188 1 52 . 1 1 6 6 LYS HD3 H 1 1.6660 0.02 . 2 . . . . 2 LYS HD2 . 18188 1 53 . 1 1 6 6 LYS HE2 H 1 2.9810 0.02 . 2 . . . . 2 LYS HE1 . 18188 1 54 . 1 1 6 6 LYS HE3 H 1 2.9810 0.02 . 2 . . . . 2 LYS HE2 . 18188 1 55 . 1 1 6 6 LYS C C 13 176.1520 0.3 . 1 . . . . 2 LYS C . 18188 1 56 . 1 1 6 6 LYS CA C 13 56.4190 0.3 . 1 . . . . 2 LYS CA . 18188 1 57 . 1 1 6 6 LYS CB C 13 32.9890 0.3 . 1 . . . . 2 LYS CB . 18188 1 58 . 1 1 6 6 LYS CG C 13 24.7640 0.3 . 1 . . . . 2 LYS CG . 18188 1 59 . 1 1 6 6 LYS CD C 13 29.0620 0.3 . 1 . . . . 2 LYS CD . 18188 1 60 . 1 1 6 6 LYS CE C 13 42.2050 0.3 . 1 . . . . 2 LYS CE . 18188 1 61 . 1 1 6 6 LYS N N 15 124.9520 0.2 . 1 . . . . 2 LYS N . 18188 1 62 . 1 1 7 7 ASN H H 1 8.4780 0.02 . 1 . . . . 3 ASN HN . 18188 1 63 . 1 1 7 7 ASN HA H 1 4.7060 0.02 . 1 . . . . 3 ASN HA . 18188 1 64 . 1 1 7 7 ASN HB2 H 1 2.7100 0.02 . 2 . . . . 3 ASN HB1 . 18188 1 65 . 1 1 7 7 ASN HB3 H 1 2.8260 0.02 . 2 . . . . 3 ASN HB2 . 18188 1 66 . 1 1 7 7 ASN HD21 H 1 7.6010 0.02 . 2 . . . . 3 ASN HD21 . 18188 1 67 . 1 1 7 7 ASN HD22 H 1 6.9080 0.02 . 2 . . . . 3 ASN HD22 . 18188 1 68 . 1 1 7 7 ASN C C 13 174.9160 0.3 . 1 . . . . 3 ASN C . 18188 1 69 . 1 1 7 7 ASN CA C 13 53.1360 0.3 . 1 . . . . 3 ASN CA . 18188 1 70 . 1 1 7 7 ASN CB C 13 38.8200 0.3 . 1 . . . . 3 ASN CB . 18188 1 71 . 1 1 7 7 ASN N N 15 120.3500 0.2 . 1 . . . . 3 ASN N . 18188 1 72 . 1 1 7 7 ASN ND2 N 15 112.8100 0.2 . 1 . . . . 3 ASN ND2 . 18188 1 73 . 1 1 8 8 GLU H H 1 8.4320 0.02 . 1 . . . . 4 GLU HN . 18188 1 74 . 1 1 8 8 GLU HA H 1 4.3660 0.02 . 1 . . . . 4 GLU HA . 18188 1 75 . 1 1 8 8 GLU HB2 H 1 1.9430 0.02 . 2 . . . . 4 GLU HB1 . 18188 1 76 . 1 1 8 8 GLU HB3 H 1 2.0830 0.02 . 2 . . . . 4 GLU HB2 . 18188 1 77 . 1 1 8 8 GLU HG2 H 1 2.2540 0.02 . 2 . . . . 4 GLU HG1 . 18188 1 78 . 1 1 8 8 GLU HG3 H 1 2.3120 0.02 . 2 . . . . 4 GLU HG2 . 18188 1 79 . 1 1 8 8 GLU C C 13 176.0930 0.3 . 1 . . . . 4 GLU C . 18188 1 80 . 1 1 8 8 GLU CA C 13 56.3100 0.3 . 1 . . . . 4 GLU CA . 18188 1 81 . 1 1 8 8 GLU CB C 13 30.3770 0.3 . 1 . . . . 4 GLU CB . 18188 1 82 . 1 1 8 8 GLU CG C 13 35.4770 0.3 . 1 . . . . 4 GLU CG . 18188 1 83 . 1 1 8 8 GLU N N 15 121.9460 0.2 . 1 . . . . 4 GLU N . 18188 1 84 . 1 1 9 9 THR H H 1 8.2070 0.02 . 1 . . . . 5 THR HN . 18188 1 85 . 1 1 9 9 THR HA H 1 4.1450 0.02 . 1 . . . . 5 THR HA . 18188 1 86 . 1 1 9 9 THR HB H 1 3.8390 0.02 . 1 . . . . 5 THR HB . 18188 1 87 . 1 1 9 9 THR HG21 H 1 0.9120 0.02 . 1 . . . . 5 THR HG21 . 18188 1 88 . 1 1 9 9 THR HG22 H 1 0.9120 0.02 . 1 . . . . 5 THR HG21 . 18188 1 89 . 1 1 9 9 THR HG23 H 1 0.9120 0.02 . 1 . . . . 5 THR HG21 . 18188 1 90 . 1 1 9 9 THR CA C 13 62.4130 0.3 . 1 . . . . 5 THR CA . 18188 1 91 . 1 1 9 9 THR CB C 13 71.3000 0.3 . 1 . . . . 5 THR CB . 18188 1 92 . 1 1 9 9 THR N N 15 119.6400 0.2 . 1 . . . . 5 THR N . 18188 1 93 . 1 1 11 11 LYS HA H 1 5.2350 0.02 . 1 . . . . 7 LYS HA . 18188 1 94 . 1 1 11 11 LYS HB2 H 1 1.6100 0.02 . 2 . . . . 7 LYS HB1 . 18188 1 95 . 1 1 11 11 LYS HB3 H 1 1.6100 0.02 . 2 . . . . 7 LYS HB2 . 18188 1 96 . 1 1 11 11 LYS HG2 H 1 1.1140 0.02 . 2 . . . . 7 LYS HG1 . 18188 1 97 . 1 1 11 11 LYS HG3 H 1 1.2620 0.02 . 2 . . . . 7 LYS HG2 . 18188 1 98 . 1 1 11 11 LYS HD2 H 1 1.2520 0.02 . 2 . . . . 7 LYS HD1 . 18188 1 99 . 1 1 11 11 LYS HD3 H 1 1.3400 0.02 . 2 . . . . 7 LYS HD2 . 18188 1 100 . 1 1 11 11 LYS HE2 H 1 2.5180 0.02 . 2 . . . . 7 LYS HE1 . 18188 1 101 . 1 1 11 11 LYS HE3 H 1 2.5950 0.02 . 2 . . . . 7 LYS HE2 . 18188 1 102 . 1 1 11 11 LYS C C 13 175.7440 0.3 . 1 . . . . 7 LYS C . 18188 1 103 . 1 1 11 11 LYS CA C 13 54.6250 0.3 . 1 . . . . 7 LYS CA . 18188 1 104 . 1 1 11 11 LYS CB C 13 34.5440 0.3 . 1 . . . . 7 LYS CB . 18188 1 105 . 1 1 11 11 LYS CG C 13 23.9190 0.3 . 1 . . . . 7 LYS CG . 18188 1 106 . 1 1 11 11 LYS CD C 13 28.9310 0.3 . 1 . . . . 7 LYS CD . 18188 1 107 . 1 1 11 11 LYS CE C 13 40.4410 0.3 . 1 . . . . 7 LYS CE . 18188 1 108 . 1 1 12 12 LEU H H 1 8.6370 0.02 . 1 . . . . 8 LEU HN . 18188 1 109 . 1 1 12 12 LEU HA H 1 5.4170 0.02 . 1 . . . . 8 LEU HA . 18188 1 110 . 1 1 12 12 LEU HB2 H 1 1.3350 0.02 . 2 . . . . 8 LEU HB1 . 18188 1 111 . 1 1 12 12 LEU HB3 H 1 1.7350 0.02 . 2 . . . . 8 LEU HB2 . 18188 1 112 . 1 1 12 12 LEU HG H 1 1.7140 0.02 . 1 . . . . 8 LEU HG . 18188 1 113 . 1 1 12 12 LEU HD11 H 1 0.9020 0.02 . 2 . . . . 8 LEU HD11 . 18188 1 114 . 1 1 12 12 LEU HD12 H 1 0.9020 0.02 . 2 . . . . 8 LEU HD11 . 18188 1 115 . 1 1 12 12 LEU HD13 H 1 0.9020 0.02 . 2 . . . . 8 LEU HD11 . 18188 1 116 . 1 1 12 12 LEU HD21 H 1 0.8830 0.02 . 2 . . . . 8 LEU HD21 . 18188 1 117 . 1 1 12 12 LEU HD22 H 1 0.8830 0.02 . 2 . . . . 8 LEU HD21 . 18188 1 118 . 1 1 12 12 LEU HD23 H 1 0.8830 0.02 . 2 . . . . 8 LEU HD21 . 18188 1 119 . 1 1 12 12 LEU C C 13 175.9530 0.3 . 1 . . . . 8 LEU C . 18188 1 120 . 1 1 12 12 LEU CA C 13 52.2810 0.3 . 1 . . . . 8 LEU CA . 18188 1 121 . 1 1 12 12 LEU CB C 13 43.6370 0.3 . 1 . . . . 8 LEU CB . 18188 1 122 . 1 1 12 12 LEU CG C 13 28.5440 0.3 . 1 . . . . 8 LEU CG . 18188 1 123 . 1 1 12 12 LEU CD1 C 13 25.7600 0.3 . 2 . . . . 8 LEU CD1 . 18188 1 124 . 1 1 12 12 LEU CD2 C 13 24.4340 0.3 . 2 . . . . 8 LEU CD2 . 18188 1 125 . 1 1 12 12 LEU N N 15 128.6390 0.2 . 1 . . . . 8 LEU N . 18188 1 126 . 1 1 13 13 SER H H 1 8.9100 0.02 . 1 . . . . 9 SER HN . 18188 1 127 . 1 1 13 13 SER HA H 1 5.4380 0.02 . 1 . . . . 9 SER HA . 18188 1 128 . 1 1 13 13 SER HB2 H 1 3.5670 0.02 . 2 . . . . 9 SER HB1 . 18188 1 129 . 1 1 13 13 SER HB3 H 1 3.6970 0.02 . 2 . . . . 9 SER HB2 . 18188 1 130 . 1 1 13 13 SER C C 13 173.1070 0.3 . 1 . . . . 9 SER C . 18188 1 131 . 1 1 13 13 SER CA C 13 56.1900 0.3 . 1 . . . . 9 SER CA . 18188 1 132 . 1 1 13 13 SER CB C 13 64.8490 0.3 . 1 . . . . 9 SER CB . 18188 1 133 . 1 1 13 13 SER N N 15 115.2130 0.2 . 1 . . . . 9 SER N . 18188 1 134 . 1 1 14 14 VAL H H 1 7.9570 0.02 . 1 . . . . 10 VAL HN . 18188 1 135 . 1 1 14 14 VAL HA H 1 4.3280 0.02 . 1 . . . . 10 VAL HA . 18188 1 136 . 1 1 14 14 VAL HB H 1 1.9880 0.02 . 1 . . . . 10 VAL HB . 18188 1 137 . 1 1 14 14 VAL HG11 H 1 1.0660 0.02 . 2 . . . . 10 VAL HG11 . 18188 1 138 . 1 1 14 14 VAL HG12 H 1 1.0660 0.02 . 2 . . . . 10 VAL HG11 . 18188 1 139 . 1 1 14 14 VAL HG13 H 1 1.0660 0.02 . 2 . . . . 10 VAL HG11 . 18188 1 140 . 1 1 14 14 VAL HG21 H 1 0.8510 0.02 . 2 . . . . 10 VAL HG21 . 18188 1 141 . 1 1 14 14 VAL HG22 H 1 0.8510 0.02 . 2 . . . . 10 VAL HG21 . 18188 1 142 . 1 1 14 14 VAL HG23 H 1 0.8510 0.02 . 2 . . . . 10 VAL HG21 . 18188 1 143 . 1 1 14 14 VAL C C 13 175.4520 0.3 . 1 . . . . 10 VAL C . 18188 1 144 . 1 1 14 14 VAL CA C 13 61.7800 0.3 . 1 . . . . 10 VAL CA . 18188 1 145 . 1 1 14 14 VAL CB C 13 32.0640 0.3 . 1 . . . . 10 VAL CB . 18188 1 146 . 1 1 14 14 VAL CG1 C 13 23.3880 0.3 . 2 . . . . 10 VAL CG1 . 18188 1 147 . 1 1 14 14 VAL CG2 C 13 22.4020 0.3 . 2 . . . . 10 VAL CG2 . 18188 1 148 . 1 1 14 14 VAL N N 15 125.9190 0.2 . 1 . . . . 10 VAL N . 18188 1 149 . 1 1 15 15 GLY H H 1 8.2210 0.02 . 1 . . . . 11 GLY HN . 18188 1 150 . 1 1 15 15 GLY HA2 H 1 3.6590 0.02 . 2 . . . . 11 GLY HA1 . 18188 1 151 . 1 1 15 15 GLY HA3 H 1 4.2700 0.02 . 2 . . . . 11 GLY HA2 . 18188 1 152 . 1 1 15 15 GLY C C 13 170.3830 0.3 . 1 . . . . 11 GLY C . 18188 1 153 . 1 1 15 15 GLY CA C 13 45.4040 0.3 . 1 . . . . 11 GLY CA . 18188 1 154 . 1 1 15 15 GLY N N 15 111.8040 0.2 . 1 . . . . 11 GLY N . 18188 1 155 . 1 1 16 16 THR H H 1 7.8660 0.02 . 1 . . . . 12 THR HN . 18188 1 156 . 1 1 16 16 THR HA H 1 5.7060 0.02 . 1 . . . . 12 THR HA . 18188 1 157 . 1 1 16 16 THR HB H 1 3.9940 0.02 . 1 . . . . 12 THR HB . 18188 1 158 . 1 1 16 16 THR HG21 H 1 1.1340 0.02 . 1 . . . . 12 THR HG21 . 18188 1 159 . 1 1 16 16 THR HG22 H 1 1.1340 0.02 . 1 . . . . 12 THR HG21 . 18188 1 160 . 1 1 16 16 THR HG23 H 1 1.1340 0.02 . 1 . . . . 12 THR HG21 . 18188 1 161 . 1 1 16 16 THR C C 13 174.4180 0.3 . 1 . . . . 12 THR C . 18188 1 162 . 1 1 16 16 THR CA C 13 60.5020 0.3 . 1 . . . . 12 THR CA . 18188 1 163 . 1 1 16 16 THR CB C 13 72.2200 0.3 . 1 . . . . 12 THR CB . 18188 1 164 . 1 1 16 16 THR CG2 C 13 21.2590 0.3 . 1 . . . . 12 THR CG2 . 18188 1 165 . 1 1 16 16 THR N N 15 110.3040 0.2 . 1 . . . . 12 THR N . 18188 1 166 . 1 1 17 17 VAL H H 1 8.1710 0.02 . 1 . . . . 13 VAL HN . 18188 1 167 . 1 1 17 17 VAL HA H 1 4.7670 0.02 . 1 . . . . 13 VAL HA . 18188 1 168 . 1 1 17 17 VAL HB H 1 2.2570 0.02 . 1 . . . . 13 VAL HB . 18188 1 169 . 1 1 17 17 VAL HG11 H 1 0.9120 0.02 . 2 . . . . 13 VAL HG11 . 18188 1 170 . 1 1 17 17 VAL HG12 H 1 0.9120 0.02 . 2 . . . . 13 VAL HG11 . 18188 1 171 . 1 1 17 17 VAL HG13 H 1 0.9120 0.02 . 2 . . . . 13 VAL HG11 . 18188 1 172 . 1 1 17 17 VAL HG21 H 1 0.9910 0.02 . 2 . . . . 13 VAL HG21 . 18188 1 173 . 1 1 17 17 VAL HG22 H 1 0.9910 0.02 . 2 . . . . 13 VAL HG21 . 18188 1 174 . 1 1 17 17 VAL HG23 H 1 0.9910 0.02 . 2 . . . . 13 VAL HG21 . 18188 1 175 . 1 1 17 17 VAL C C 13 173.1470 0.3 . 1 . . . . 13 VAL C . 18188 1 176 . 1 1 17 17 VAL CA C 13 59.9660 0.3 . 1 . . . . 13 VAL CA . 18188 1 177 . 1 1 17 17 VAL CB C 13 36.3050 0.3 . 1 . . . . 13 VAL CB . 18188 1 178 . 1 1 17 17 VAL CG1 C 13 21.5480 0.3 . 2 . . . . 13 VAL CG1 . 18188 1 179 . 1 1 17 17 VAL CG2 C 13 21.5480 0.3 . 2 . . . . 13 VAL CG2 . 18188 1 180 . 1 1 17 17 VAL N N 15 119.8560 0.2 . 1 . . . . 13 VAL N . 18188 1 181 . 1 1 18 18 SER H H 1 8.2560 0.02 . 1 . . . . 14 SER HN . 18188 1 182 . 1 1 18 18 SER HA H 1 5.8620 0.02 . 1 . . . . 14 SER HA . 18188 1 183 . 1 1 18 18 SER HB2 H 1 3.7350 0.02 . 2 . . . . 14 SER HB1 . 18188 1 184 . 1 1 18 18 SER HB3 H 1 3.7350 0.02 . 2 . . . . 14 SER HB2 . 18188 1 185 . 1 1 18 18 SER C C 13 173.3780 0.3 . 1 . . . . 14 SER C . 18188 1 186 . 1 1 18 18 SER CA C 13 56.4310 0.3 . 1 . . . . 14 SER CA . 18188 1 187 . 1 1 18 18 SER CB C 13 66.2610 0.3 . 1 . . . . 14 SER CB . 18188 1 188 . 1 1 18 18 SER N N 15 116.6770 0.2 . 1 . . . . 14 SER N . 18188 1 189 . 1 1 19 19 GLY H H 1 8.5350 0.02 . 1 . . . . 15 GLY HN . 18188 1 190 . 1 1 19 19 GLY HA2 H 1 3.6440 0.02 . 2 . . . . 15 GLY HA1 . 18188 1 191 . 1 1 19 19 GLY HA3 H 1 4.2700 0.02 . 2 . . . . 15 GLY HA2 . 18188 1 192 . 1 1 19 19 GLY C C 13 170.5630 0.3 . 1 . . . . 15 GLY C . 18188 1 193 . 1 1 19 19 GLY CA C 13 45.6220 0.3 . 1 . . . . 15 GLY CA . 18188 1 194 . 1 1 19 19 GLY N N 15 106.4450 0.2 . 1 . . . . 15 GLY N . 18188 1 195 . 1 1 20 20 ASN H H 1 8.8580 0.02 . 1 . . . . 16 ASN HN . 18188 1 196 . 1 1 20 20 ASN HA H 1 5.3490 0.02 . 1 . . . . 16 ASN HA . 18188 1 197 . 1 1 20 20 ASN HB2 H 1 2.5140 0.02 . 2 . . . . 16 ASN HB1 . 18188 1 198 . 1 1 20 20 ASN HB3 H 1 2.6740 0.02 . 2 . . . . 16 ASN HB2 . 18188 1 199 . 1 1 20 20 ASN HD21 H 1 7.8960 0.02 . 2 . . . . 16 ASN HD21 . 18188 1 200 . 1 1 20 20 ASN HD22 H 1 6.9030 0.02 . 2 . . . . 16 ASN HD22 . 18188 1 201 . 1 1 20 20 ASN C C 13 173.1260 0.3 . 1 . . . . 16 ASN C . 18188 1 202 . 1 1 20 20 ASN CA C 13 50.8080 0.3 . 1 . . . . 16 ASN CA . 18188 1 203 . 1 1 20 20 ASN CB C 13 38.2170 0.3 . 1 . . . . 16 ASN CB . 18188 1 204 . 1 1 20 20 ASN N N 15 118.5730 0.2 . 1 . . . . 16 ASN N . 18188 1 205 . 1 1 20 20 ASN ND2 N 15 115.4740 0.2 . 1 . . . . 16 ASN ND2 . 18188 1 206 . 1 1 21 21 PRO HA H 1 3.9930 0.02 . 1 . . . . 17 PRO HA . 18188 1 207 . 1 1 21 21 PRO HB2 H 1 1.8600 0.02 . 2 . . . . 17 PRO HB1 . 18188 1 208 . 1 1 21 21 PRO HB3 H 1 2.5830 0.02 . 2 . . . . 17 PRO HB2 . 18188 1 209 . 1 1 21 21 PRO HG2 H 1 1.8280 0.02 . 2 . . . . 17 PRO HG1 . 18188 1 210 . 1 1 21 21 PRO HG3 H 1 2.2440 0.02 . 2 . . . . 17 PRO HG2 . 18188 1 211 . 1 1 21 21 PRO HD2 H 1 4.0590 0.02 . 2 . . . . 17 PRO HD1 . 18188 1 212 . 1 1 21 21 PRO HD3 H 1 3.5300 0.02 . 2 . . . . 17 PRO HD2 . 18188 1 213 . 1 1 21 21 PRO C C 13 177.0250 0.3 . 1 . . . . 17 PRO C . 18188 1 214 . 1 1 21 21 PRO CA C 13 65.1080 0.3 . 1 . . . . 17 PRO CA . 18188 1 215 . 1 1 21 21 PRO CB C 13 31.6690 0.3 . 1 . . . . 17 PRO CB . 18188 1 216 . 1 1 21 21 PRO CG C 13 28.7300 0.3 . 1 . . . . 17 PRO CG . 18188 1 217 . 1 1 21 21 PRO CD C 13 50.5520 0.3 . 1 . . . . 17 PRO CD . 18188 1 218 . 1 1 22 22 GLY H H 1 7.9300 0.02 . 1 . . . . 18 GLY HN . 18188 1 219 . 1 1 22 22 GLY HA2 H 1 3.7430 0.02 . 2 . . . . 18 GLY HA1 . 18188 1 220 . 1 1 22 22 GLY HA3 H 1 4.4440 0.02 . 2 . . . . 18 GLY HA2 . 18188 1 221 . 1 1 22 22 GLY C C 13 174.5490 0.3 . 1 . . . . 18 GLY C . 18188 1 222 . 1 1 22 22 GLY CA C 13 45.2490 0.3 . 1 . . . . 18 GLY CA . 18188 1 223 . 1 1 22 22 GLY N N 15 115.0570 0.2 . 1 . . . . 18 GLY N . 18188 1 224 . 1 1 23 23 ASP H H 1 8.3300 0.02 . 1 . . . . 19 ASP HN . 18188 1 225 . 1 1 23 23 ASP HA H 1 4.7460 0.02 . 1 . . . . 19 ASP HA . 18188 1 226 . 1 1 23 23 ASP HB2 H 1 2.6520 0.02 . 2 . . . . 19 ASP HB1 . 18188 1 227 . 1 1 23 23 ASP HB3 H 1 2.9970 0.02 . 2 . . . . 19 ASP HB2 . 18188 1 228 . 1 1 23 23 ASP C C 13 175.6750 0.3 . 1 . . . . 19 ASP C . 18188 1 229 . 1 1 23 23 ASP CA C 13 54.9200 0.3 . 1 . . . . 19 ASP CA . 18188 1 230 . 1 1 23 23 ASP CB C 13 41.6260 0.3 . 1 . . . . 19 ASP CB . 18188 1 231 . 1 1 23 23 ASP N N 15 121.1980 0.2 . 1 . . . . 19 ASP N . 18188 1 232 . 1 1 24 24 THR H H 1 8.4820 0.02 . 1 . . . . 20 THR HN . 18188 1 233 . 1 1 24 24 THR HA H 1 5.3930 0.02 . 1 . . . . 20 THR HA . 18188 1 234 . 1 1 24 24 THR HB H 1 3.9970 0.02 . 1 . . . . 20 THR HB . 18188 1 235 . 1 1 24 24 THR HG21 H 1 1.0110 0.02 . 1 . . . . 20 THR HG21 . 18188 1 236 . 1 1 24 24 THR HG22 H 1 1.0110 0.02 . 1 . . . . 20 THR HG21 . 18188 1 237 . 1 1 24 24 THR HG23 H 1 1.0110 0.02 . 1 . . . . 20 THR HG21 . 18188 1 238 . 1 1 24 24 THR C C 13 175.1110 0.3 . 1 . . . . 20 THR C . 18188 1 239 . 1 1 24 24 THR CA C 13 61.8150 0.3 . 1 . . . . 20 THR CA . 18188 1 240 . 1 1 24 24 THR CB C 13 69.5490 0.3 . 1 . . . . 20 THR CB . 18188 1 241 . 1 1 24 24 THR CG2 C 13 20.7090 0.3 . 1 . . . . 20 THR CG2 . 18188 1 242 . 1 1 24 24 THR N N 15 115.5820 0.2 . 1 . . . . 20 THR N . 18188 1 243 . 1 1 25 25 VAL H H 1 9.5050 0.02 . 1 . . . . 21 VAL HN . 18188 1 244 . 1 1 25 25 VAL HA H 1 4.8250 0.02 . 1 . . . . 21 VAL HA . 18188 1 245 . 1 1 25 25 VAL HB H 1 2.0670 0.02 . 1 . . . . 21 VAL HB . 18188 1 246 . 1 1 25 25 VAL HG11 H 1 0.7360 0.02 . 2 . . . . 21 VAL HG11 . 18188 1 247 . 1 1 25 25 VAL HG12 H 1 0.7360 0.02 . 2 . . . . 21 VAL HG11 . 18188 1 248 . 1 1 25 25 VAL HG13 H 1 0.7360 0.02 . 2 . . . . 21 VAL HG11 . 18188 1 249 . 1 1 25 25 VAL HG21 H 1 0.8260 0.02 . 2 . . . . 21 VAL HG21 . 18188 1 250 . 1 1 25 25 VAL HG22 H 1 0.8260 0.02 . 2 . . . . 21 VAL HG21 . 18188 1 251 . 1 1 25 25 VAL HG23 H 1 0.8260 0.02 . 2 . . . . 21 VAL HG21 . 18188 1 252 . 1 1 25 25 VAL C C 13 172.8330 0.3 . 1 . . . . 21 VAL C . 18188 1 253 . 1 1 25 25 VAL CA C 13 58.7730 0.3 . 1 . . . . 21 VAL CA . 18188 1 254 . 1 1 25 25 VAL CB C 13 34.8710 0.3 . 1 . . . . 21 VAL CB . 18188 1 255 . 1 1 25 25 VAL CG1 C 13 18.6220 0.3 . 2 . . . . 21 VAL CG1 . 18188 1 256 . 1 1 25 25 VAL CG2 C 13 22.4090 0.3 . 2 . . . . 21 VAL CG2 . 18188 1 257 . 1 1 25 25 VAL N N 15 120.0980 0.2 . 1 . . . . 21 VAL N . 18188 1 258 . 1 1 26 26 LYS H H 1 8.3940 0.02 . 1 . . . . 22 LYS HN . 18188 1 259 . 1 1 26 26 LYS HA H 1 5.2300 0.02 . 1 . . . . 22 LYS HA . 18188 1 260 . 1 1 26 26 LYS HB2 H 1 1.6110 0.02 . 2 . . . . 22 LYS HB1 . 18188 1 261 . 1 1 26 26 LYS HB3 H 1 1.6110 0.02 . 2 . . . . 22 LYS HB2 . 18188 1 262 . 1 1 26 26 LYS HG2 H 1 1.1130 0.02 . 2 . . . . 22 LYS HG1 . 18188 1 263 . 1 1 26 26 LYS HG3 H 1 1.2590 0.02 . 2 . . . . 22 LYS HG2 . 18188 1 264 . 1 1 26 26 LYS HD2 H 1 1.3390 0.02 . 2 . . . . 22 LYS HD1 . 18188 1 265 . 1 1 26 26 LYS HD3 H 1 1.3390 0.02 . 2 . . . . 22 LYS HD2 . 18188 1 266 . 1 1 26 26 LYS HE2 H 1 2.5160 0.02 . 2 . . . . 22 LYS HE1 . 18188 1 267 . 1 1 26 26 LYS HE3 H 1 2.5990 0.02 . 2 . . . . 22 LYS HE2 . 18188 1 268 . 1 1 26 26 LYS C C 13 175.2890 0.3 . 1 . . . . 22 LYS C . 18188 1 269 . 1 1 26 26 LYS CA C 13 54.6820 0.3 . 1 . . . . 22 LYS CA . 18188 1 270 . 1 1 26 26 LYS CB C 13 34.4350 0.3 . 1 . . . . 22 LYS CB . 18188 1 271 . 1 1 26 26 LYS CG C 13 23.9490 0.3 . 1 . . . . 22 LYS CG . 18188 1 272 . 1 1 26 26 LYS CD C 13 28.8170 0.3 . 1 . . . . 22 LYS CD . 18188 1 273 . 1 1 26 26 LYS CE C 13 40.5200 0.3 . 1 . . . . 22 LYS CE . 18188 1 274 . 1 1 26 26 LYS N N 15 124.1450 0.2 . 1 . . . . 22 LYS N . 18188 1 275 . 1 1 27 27 VAL H H 1 9.6070 0.02 . 1 . . . . 23 VAL HN . 18188 1 276 . 1 1 27 27 VAL HA H 1 4.5800 0.02 . 1 . . . . 23 VAL HA . 18188 1 277 . 1 1 27 27 VAL HB H 1 2.2300 0.02 . 1 . . . . 23 VAL HB . 18188 1 278 . 1 1 27 27 VAL HG11 H 1 0.8650 0.02 . 2 . . . . 23 VAL HG11 . 18188 1 279 . 1 1 27 27 VAL HG12 H 1 0.8650 0.02 . 2 . . . . 23 VAL HG11 . 18188 1 280 . 1 1 27 27 VAL HG13 H 1 0.8650 0.02 . 2 . . . . 23 VAL HG11 . 18188 1 281 . 1 1 27 27 VAL HG21 H 1 0.8650 0.02 . 2 . . . . 23 VAL HG21 . 18188 1 282 . 1 1 27 27 VAL HG22 H 1 0.8650 0.02 . 2 . . . . 23 VAL HG21 . 18188 1 283 . 1 1 27 27 VAL HG23 H 1 0.8650 0.02 . 2 . . . . 23 VAL HG21 . 18188 1 284 . 1 1 27 27 VAL C C 13 174.5100 0.3 . 1 . . . . 23 VAL C . 18188 1 285 . 1 1 27 27 VAL CA C 13 59.0290 0.3 . 1 . . . . 23 VAL CA . 18188 1 286 . 1 1 27 27 VAL CB C 13 35.1910 0.3 . 1 . . . . 23 VAL CB . 18188 1 287 . 1 1 27 27 VAL CG1 C 13 21.3120 0.3 . 2 . . . . 23 VAL CG1 . 18188 1 288 . 1 1 27 27 VAL CG2 C 13 21.3120 0.3 . 2 . . . . 23 VAL CG2 . 18188 1 289 . 1 1 27 27 VAL N N 15 126.4950 0.2 . 1 . . . . 23 VAL N . 18188 1 290 . 1 1 28 28 PRO HA H 1 4.8360 0.02 . 1 . . . . 24 PRO HA . 18188 1 291 . 1 1 28 28 PRO HB2 H 1 1.7540 0.02 . 2 . . . . 24 PRO HB1 . 18188 1 292 . 1 1 28 28 PRO HB3 H 1 2.0930 0.02 . 2 . . . . 24 PRO HB2 . 18188 1 293 . 1 1 28 28 PRO HG2 H 1 2.1950 0.02 . 2 . . . . 24 PRO HG1 . 18188 1 294 . 1 1 28 28 PRO HG3 H 1 2.2400 0.02 . 2 . . . . 24 PRO HG2 . 18188 1 295 . 1 1 28 28 PRO HD2 H 1 3.7600 0.02 . 2 . . . . 24 PRO HD1 . 18188 1 296 . 1 1 28 28 PRO HD3 H 1 4.1090 0.02 . 2 . . . . 24 PRO HD2 . 18188 1 297 . 1 1 28 28 PRO C C 13 176.1880 0.3 . 1 . . . . 24 PRO C . 18188 1 298 . 1 1 28 28 PRO CA C 13 62.3150 0.3 . 1 . . . . 24 PRO CA . 18188 1 299 . 1 1 28 28 PRO CB C 13 32.5790 0.3 . 1 . . . . 24 PRO CB . 18188 1 300 . 1 1 28 28 PRO CG C 13 27.1710 0.3 . 1 . . . . 24 PRO CG . 18188 1 301 . 1 1 28 28 PRO CD C 13 51.3120 0.3 . 1 . . . . 24 PRO CD . 18188 1 302 . 1 1 29 29 VAL H H 1 8.5770 0.02 . 1 . . . . 25 VAL HN . 18188 1 303 . 1 1 29 29 VAL HA H 1 4.8660 0.02 . 1 . . . . 25 VAL HA . 18188 1 304 . 1 1 29 29 VAL HB H 1 1.8100 0.02 . 1 . . . . 25 VAL HB . 18188 1 305 . 1 1 29 29 VAL HG11 H 1 0.8030 0.02 . 2 . . . . 25 VAL HG11 . 18188 1 306 . 1 1 29 29 VAL HG12 H 1 0.8030 0.02 . 2 . . . . 25 VAL HG11 . 18188 1 307 . 1 1 29 29 VAL HG13 H 1 0.8030 0.02 . 2 . . . . 25 VAL HG11 . 18188 1 308 . 1 1 29 29 VAL HG21 H 1 0.8030 0.02 . 2 . . . . 25 VAL HG21 . 18188 1 309 . 1 1 29 29 VAL HG22 H 1 0.8030 0.02 . 2 . . . . 25 VAL HG21 . 18188 1 310 . 1 1 29 29 VAL HG23 H 1 0.8030 0.02 . 2 . . . . 25 VAL HG21 . 18188 1 311 . 1 1 29 29 VAL C C 13 175.8110 0.3 . 1 . . . . 25 VAL C . 18188 1 312 . 1 1 29 29 VAL CA C 13 61.1890 0.3 . 1 . . . . 25 VAL CA . 18188 1 313 . 1 1 29 29 VAL CB C 13 33.3650 0.3 . 1 . . . . 25 VAL CB . 18188 1 314 . 1 1 29 29 VAL CG1 C 13 20.8100 0.3 . 2 . . . . 25 VAL CG1 . 18188 1 315 . 1 1 29 29 VAL CG2 C 13 20.8100 0.3 . 2 . . . . 25 VAL CG2 . 18188 1 316 . 1 1 29 29 VAL N N 15 122.3450 0.2 . 1 . . . . 25 VAL N . 18188 1 317 . 1 1 30 30 THR H H 1 9.3400 0.02 . 1 . . . . 26 THR HN . 18188 1 318 . 1 1 30 30 THR HA H 1 4.8500 0.02 . 1 . . . . 26 THR HA . 18188 1 319 . 1 1 30 30 THR HB H 1 3.9910 0.02 . 1 . . . . 26 THR HB . 18188 1 320 . 1 1 30 30 THR HG21 H 1 1.0120 0.02 . 1 . . . . 26 THR HG21 . 18188 1 321 . 1 1 30 30 THR HG22 H 1 1.0120 0.02 . 1 . . . . 26 THR HG21 . 18188 1 322 . 1 1 30 30 THR HG23 H 1 1.0120 0.02 . 1 . . . . 26 THR HG21 . 18188 1 323 . 1 1 30 30 THR C C 13 172.6910 0.3 . 1 . . . . 26 THR C . 18188 1 324 . 1 1 30 30 THR CA C 13 61.5120 0.3 . 1 . . . . 26 THR CA . 18188 1 325 . 1 1 30 30 THR CB C 13 71.1030 0.3 . 1 . . . . 26 THR CB . 18188 1 326 . 1 1 30 30 THR CG2 C 13 21.1170 0.3 . 1 . . . . 26 THR CG2 . 18188 1 327 . 1 1 30 30 THR N N 15 121.2070 0.2 . 1 . . . . 26 THR N . 18188 1 328 . 1 1 31 31 ILE H H 1 9.3560 0.02 . 1 . . . . 27 ILE HN . 18188 1 329 . 1 1 31 31 ILE HA H 1 5.4880 0.02 . 1 . . . . 27 ILE HA . 18188 1 330 . 1 1 31 31 ILE HB H 1 1.4410 0.02 . 1 . . . . 27 ILE HB . 18188 1 331 . 1 1 31 31 ILE HG12 H 1 0.9590 0.02 . 2 . . . . 27 ILE HG11 . 18188 1 332 . 1 1 31 31 ILE HG13 H 1 0.9590 0.02 . 2 . . . . 27 ILE HG12 . 18188 1 333 . 1 1 31 31 ILE HG21 H 1 0.9400 0.02 . 1 . . . . 27 ILE HG21 . 18188 1 334 . 1 1 31 31 ILE HG22 H 1 0.9400 0.02 . 1 . . . . 27 ILE HG21 . 18188 1 335 . 1 1 31 31 ILE HG23 H 1 0.9400 0.02 . 1 . . . . 27 ILE HG21 . 18188 1 336 . 1 1 31 31 ILE HD11 H 1 0.7640 0.02 . 1 . . . . 27 ILE HD11 . 18188 1 337 . 1 1 31 31 ILE HD12 H 1 0.7640 0.02 . 1 . . . . 27 ILE HD11 . 18188 1 338 . 1 1 31 31 ILE HD13 H 1 0.7640 0.02 . 1 . . . . 27 ILE HD11 . 18188 1 339 . 1 1 31 31 ILE C C 13 172.8970 0.3 . 1 . . . . 27 ILE C . 18188 1 340 . 1 1 31 31 ILE CA C 13 58.9520 0.3 . 1 . . . . 27 ILE CA . 18188 1 341 . 1 1 31 31 ILE CB C 13 42.9050 0.3 . 1 . . . . 27 ILE CB . 18188 1 342 . 1 1 31 31 ILE CG1 C 13 29.0170 0.3 . 1 . . . . 27 ILE CG1 . 18188 1 343 . 1 1 31 31 ILE CG2 C 13 15.2370 0.3 . 1 . . . . 27 ILE CG2 . 18188 1 344 . 1 1 31 31 ILE CD1 C 13 14.0570 0.3 . 1 . . . . 27 ILE CD1 . 18188 1 345 . 1 1 31 31 ILE N N 15 124.6800 0.2 . 1 . . . . 27 ILE N . 18188 1 346 . 1 1 32 32 SER H H 1 9.1510 0.02 . 1 . . . . 28 SER HN . 18188 1 347 . 1 1 32 32 SER HA H 1 4.7620 0.02 . 1 . . . . 28 SER HA . 18188 1 348 . 1 1 32 32 SER HB2 H 1 3.7440 0.02 . 2 . . . . 28 SER HB1 . 18188 1 349 . 1 1 32 32 SER HB3 H 1 3.8000 0.02 . 2 . . . . 28 SER HB2 . 18188 1 350 . 1 1 32 32 SER C C 13 172.3300 0.3 . 1 . . . . 28 SER C . 18188 1 351 . 1 1 32 32 SER CA C 13 56.4570 0.3 . 1 . . . . 28 SER CA . 18188 1 352 . 1 1 32 32 SER CB C 13 66.8130 0.3 . 1 . . . . 28 SER CB . 18188 1 353 . 1 1 32 32 SER N N 15 121.0300 0.2 . 1 . . . . 28 SER N . 18188 1 354 . 1 1 33 33 GLN H H 1 9.0920 0.02 . 1 . . . . 29 GLN HN . 18188 1 355 . 1 1 33 33 GLN HA H 1 3.7980 0.02 . 1 . . . . 29 GLN HA . 18188 1 356 . 1 1 33 33 GLN HB2 H 1 2.6950 0.02 . 2 . . . . 29 GLN HB1 . 18188 1 357 . 1 1 33 33 GLN HB3 H 1 2.2160 0.02 . 2 . . . . 29 GLN HB2 . 18188 1 358 . 1 1 33 33 GLN HG2 H 1 2.2970 0.02 . 2 . . . . 29 GLN HG1 . 18188 1 359 . 1 1 33 33 GLN HG3 H 1 2.2970 0.02 . 2 . . . . 29 GLN HG2 . 18188 1 360 . 1 1 33 33 GLN HE21 H 1 7.9320 0.02 . 2 . . . . 29 GLN HE21 . 18188 1 361 . 1 1 33 33 GLN HE22 H 1 7.0360 0.02 . 2 . . . . 29 GLN HE22 . 18188 1 362 . 1 1 33 33 GLN C C 13 175.0750 0.3 . 1 . . . . 29 GLN C . 18188 1 363 . 1 1 33 33 GLN CA C 13 56.8440 0.3 . 1 . . . . 29 GLN CA . 18188 1 364 . 1 1 33 33 GLN CB C 13 25.3900 0.3 . 1 . . . . 29 GLN CB . 18188 1 365 . 1 1 33 33 GLN CG C 13 35.3680 0.3 . 1 . . . . 29 GLN CG . 18188 1 366 . 1 1 33 33 GLN N N 15 113.8290 0.2 . 1 . . . . 29 GLN N . 18188 1 367 . 1 1 33 33 GLN NE2 N 15 112.9800 0.2 . 1 . . . . 29 GLN NE2 . 18188 1 368 . 1 1 34 34 VAL H H 1 8.8520 0.02 . 1 . . . . 30 VAL HN . 18188 1 369 . 1 1 34 34 VAL HA H 1 3.7010 0.02 . 1 . . . . 30 VAL HA . 18188 1 370 . 1 1 34 34 VAL HB H 1 1.7000 0.02 . 1 . . . . 30 VAL HB . 18188 1 371 . 1 1 34 34 VAL HG11 H 1 0.6500 0.02 . 2 . . . . 30 VAL HG11 . 18188 1 372 . 1 1 34 34 VAL HG12 H 1 0.6500 0.02 . 2 . . . . 30 VAL HG11 . 18188 1 373 . 1 1 34 34 VAL HG13 H 1 0.6500 0.02 . 2 . . . . 30 VAL HG11 . 18188 1 374 . 1 1 34 34 VAL HG21 H 1 0.5950 0.02 . 2 . . . . 30 VAL HG21 . 18188 1 375 . 1 1 34 34 VAL HG22 H 1 0.5950 0.02 . 2 . . . . 30 VAL HG21 . 18188 1 376 . 1 1 34 34 VAL HG23 H 1 0.5950 0.02 . 2 . . . . 30 VAL HG21 . 18188 1 377 . 1 1 34 34 VAL C C 13 177.4640 0.3 . 1 . . . . 30 VAL C . 18188 1 378 . 1 1 34 34 VAL CA C 13 63.8930 0.3 . 1 . . . . 30 VAL CA . 18188 1 379 . 1 1 34 34 VAL CB C 13 31.4410 0.3 . 1 . . . . 30 VAL CB . 18188 1 380 . 1 1 34 34 VAL CG1 C 13 23.1540 0.3 . 2 . . . . 30 VAL CG1 . 18188 1 381 . 1 1 34 34 VAL CG2 C 13 21.2610 0.3 . 2 . . . . 30 VAL CG2 . 18188 1 382 . 1 1 34 34 VAL N N 15 119.7470 0.2 . 1 . . . . 30 VAL N . 18188 1 383 . 1 1 35 35 SER H H 1 9.3020 0.02 . 1 . . . . 31 SER HN . 18188 1 384 . 1 1 35 35 SER HA H 1 4.4590 0.02 . 1 . . . . 31 SER HA . 18188 1 385 . 1 1 35 35 SER HB2 H 1 3.8420 0.02 . 2 . . . . 31 SER HB1 . 18188 1 386 . 1 1 35 35 SER HB3 H 1 3.8110 0.02 . 2 . . . . 31 SER HB2 . 18188 1 387 . 1 1 35 35 SER C C 13 173.8720 0.3 . 1 . . . . 31 SER C . 18188 1 388 . 1 1 35 35 SER CA C 13 58.3340 0.3 . 1 . . . . 31 SER CA . 18188 1 389 . 1 1 35 35 SER CB C 13 64.0010 0.3 . 1 . . . . 31 SER CB . 18188 1 390 . 1 1 35 35 SER N N 15 124.1260 0.2 . 1 . . . . 31 SER N . 18188 1 391 . 1 1 36 36 THR H H 1 8.5440 0.02 . 1 . . . . 32 THR HN . 18188 1 392 . 1 1 36 36 THR HA H 1 4.4520 0.02 . 1 . . . . 32 THR HA . 18188 1 393 . 1 1 36 36 THR HB H 1 3.9960 0.02 . 1 . . . . 32 THR HB . 18188 1 394 . 1 1 36 36 THR HG21 H 1 1.1520 0.02 . 1 . . . . 32 THR HG21 . 18188 1 395 . 1 1 36 36 THR HG22 H 1 1.1520 0.02 . 1 . . . . 32 THR HG21 . 18188 1 396 . 1 1 36 36 THR HG23 H 1 1.1520 0.02 . 1 . . . . 32 THR HG21 . 18188 1 397 . 1 1 36 36 THR CA C 13 61.6570 0.3 . 1 . . . . 32 THR CA . 18188 1 398 . 1 1 36 36 THR CB C 13 64.7200 0.3 . 1 . . . . 32 THR CB . 18188 1 399 . 1 1 36 36 THR CG2 C 13 21.4440 0.3 . 1 . . . . 32 THR CG2 . 18188 1 400 . 1 1 36 36 THR N N 15 123.4000 0.2 . 1 . . . . 32 THR N . 18188 1 401 . 1 1 37 37 PRO HA H 1 4.2330 0.02 . 1 . . . . 33 PRO HA . 18188 1 402 . 1 1 37 37 PRO HB2 H 1 1.7480 0.02 . 2 . . . . 33 PRO HB1 . 18188 1 403 . 1 1 37 37 PRO HB3 H 1 2.0990 0.02 . 2 . . . . 33 PRO HB2 . 18188 1 404 . 1 1 37 37 PRO HG2 H 1 2.2100 0.02 . 2 . . . . 33 PRO HG1 . 18188 1 405 . 1 1 37 37 PRO HG3 H 1 2.2100 0.02 . 2 . . . . 33 PRO HG2 . 18188 1 406 . 1 1 37 37 PRO HD2 H 1 3.7650 0.02 . 2 . . . . 33 PRO HD1 . 18188 1 407 . 1 1 37 37 PRO HD3 H 1 4.1310 0.02 . 2 . . . . 33 PRO HD2 . 18188 1 408 . 1 1 37 37 PRO C C 13 176.3690 0.3 . 1 . . . . 33 PRO C . 18188 1 409 . 1 1 37 37 PRO CA C 13 64.2000 0.3 . 1 . . . . 33 PRO CA . 18188 1 410 . 1 1 37 37 PRO CB C 13 32.3490 0.3 . 1 . . . . 33 PRO CB . 18188 1 411 . 1 1 37 37 PRO CG C 13 27.1560 0.3 . 1 . . . . 33 PRO CG . 18188 1 412 . 1 1 37 37 PRO CD C 13 51.4710 0.3 . 1 . . . . 33 PRO CD . 18188 1 413 . 1 1 38 38 VAL H H 1 8.7250 0.02 . 1 . . . . 34 VAL HN . 18188 1 414 . 1 1 38 38 VAL HA H 1 3.8840 0.02 . 1 . . . . 34 VAL HA . 18188 1 415 . 1 1 38 38 VAL HB H 1 2.2300 0.02 . 1 . . . . 34 VAL HB . 18188 1 416 . 1 1 38 38 VAL HG11 H 1 1.0140 0.02 . 2 . . . . 34 VAL HG11 . 18188 1 417 . 1 1 38 38 VAL HG12 H 1 1.0140 0.02 . 2 . . . . 34 VAL HG11 . 18188 1 418 . 1 1 38 38 VAL HG13 H 1 1.0140 0.02 . 2 . . . . 34 VAL HG11 . 18188 1 419 . 1 1 38 38 VAL HG21 H 1 1.1050 0.02 . 2 . . . . 34 VAL HG21 . 18188 1 420 . 1 1 38 38 VAL HG22 H 1 1.1050 0.02 . 2 . . . . 34 VAL HG21 . 18188 1 421 . 1 1 38 38 VAL HG23 H 1 1.1050 0.02 . 2 . . . . 34 VAL HG21 . 18188 1 422 . 1 1 38 38 VAL C C 13 175.9840 0.3 . 1 . . . . 34 VAL C . 18188 1 423 . 1 1 38 38 VAL CA C 13 63.3530 0.3 . 1 . . . . 34 VAL CA . 18188 1 424 . 1 1 38 38 VAL CB C 13 34.2840 0.3 . 1 . . . . 34 VAL CB . 18188 1 425 . 1 1 38 38 VAL CG1 C 13 21.6910 0.3 . 2 . . . . 34 VAL CG1 . 18188 1 426 . 1 1 38 38 VAL CG2 C 13 23.0560 0.3 . 2 . . . . 34 VAL CG2 . 18188 1 427 . 1 1 38 38 VAL N N 15 126.5350 0.2 . 1 . . . . 34 VAL N . 18188 1 428 . 1 1 39 39 GLY H H 1 9.1690 0.02 . 1 . . . . 35 GLY HN . 18188 1 429 . 1 1 39 39 GLY HA2 H 1 3.3110 0.02 . 2 . . . . 35 GLY HA1 . 18188 1 430 . 1 1 39 39 GLY HA3 H 1 4.5460 0.02 . 2 . . . . 35 GLY HA2 . 18188 1 431 . 1 1 39 39 GLY C C 13 172.0590 0.3 . 1 . . . . 35 GLY C . 18188 1 432 . 1 1 39 39 GLY CA C 13 45.0800 0.3 . 1 . . . . 35 GLY CA . 18188 1 433 . 1 1 39 39 GLY N N 15 112.1360 0.2 . 1 . . . . 35 GLY N . 18188 1 434 . 1 1 40 40 LEU H H 1 7.7900 0.02 . 1 . . . . 36 LEU HN . 18188 1 435 . 1 1 40 40 LEU HA H 1 5.4000 0.02 . 1 . . . . 36 LEU HA . 18188 1 436 . 1 1 40 40 LEU HB2 H 1 1.5850 0.02 . 2 . . . . 36 LEU HB1 . 18188 1 437 . 1 1 40 40 LEU HB3 H 1 1.6590 0.02 . 2 . . . . 36 LEU HB2 . 18188 1 438 . 1 1 40 40 LEU HG H 1 1.4760 0.02 . 1 . . . . 36 LEU HG . 18188 1 439 . 1 1 40 40 LEU HD11 H 1 0.7800 0.02 . 2 . . . . 36 LEU HD11 . 18188 1 440 . 1 1 40 40 LEU HD12 H 1 0.7800 0.02 . 2 . . . . 36 LEU HD11 . 18188 1 441 . 1 1 40 40 LEU HD13 H 1 0.7800 0.02 . 2 . . . . 36 LEU HD11 . 18188 1 442 . 1 1 40 40 LEU HD21 H 1 0.9170 0.02 . 2 . . . . 36 LEU HD21 . 18188 1 443 . 1 1 40 40 LEU HD22 H 1 0.9170 0.02 . 2 . . . . 36 LEU HD21 . 18188 1 444 . 1 1 40 40 LEU HD23 H 1 0.9170 0.02 . 2 . . . . 36 LEU HD21 . 18188 1 445 . 1 1 40 40 LEU C C 13 175.2070 0.3 . 1 . . . . 36 LEU C . 18188 1 446 . 1 1 40 40 LEU CA C 13 55.0940 0.3 . 1 . . . . 36 LEU CA . 18188 1 447 . 1 1 40 40 LEU CB C 13 45.7180 0.3 . 1 . . . . 36 LEU CB . 18188 1 448 . 1 1 40 40 LEU CG C 13 27.6340 0.3 . 1 . . . . 36 LEU CG . 18188 1 449 . 1 1 40 40 LEU CD1 C 13 26.0500 0.3 . 2 . . . . 36 LEU CD1 . 18188 1 450 . 1 1 40 40 LEU CD2 C 13 24.4340 0.3 . 2 . . . . 36 LEU CD2 . 18188 1 451 . 1 1 40 40 LEU N N 15 123.5670 0.2 . 1 . . . . 36 LEU N . 18188 1 452 . 1 1 41 41 ILE H H 1 9.6670 0.02 . 1 . . . . 37 ILE HN . 18188 1 453 . 1 1 41 41 ILE HA H 1 5.1950 0.02 . 1 . . . . 37 ILE HA . 18188 1 454 . 1 1 41 41 ILE HB H 1 1.7340 0.02 . 1 . . . . 37 ILE HB . 18188 1 455 . 1 1 41 41 ILE HG12 H 1 1.1480 0.02 . 2 . . . . 37 ILE HG11 . 18188 1 456 . 1 1 41 41 ILE HG13 H 1 1.8670 0.02 . 2 . . . . 37 ILE HG12 . 18188 1 457 . 1 1 41 41 ILE HG21 H 1 0.8250 0.02 . 1 . . . . 37 ILE HG21 . 18188 1 458 . 1 1 41 41 ILE HG22 H 1 0.8250 0.02 . 1 . . . . 37 ILE HG21 . 18188 1 459 . 1 1 41 41 ILE HG23 H 1 0.8250 0.02 . 1 . . . . 37 ILE HG21 . 18188 1 460 . 1 1 41 41 ILE HD11 H 1 0.8100 0.02 . 1 . . . . 37 ILE HD11 . 18188 1 461 . 1 1 41 41 ILE HD12 H 1 0.8100 0.02 . 1 . . . . 37 ILE HD11 . 18188 1 462 . 1 1 41 41 ILE HD13 H 1 0.8100 0.02 . 1 . . . . 37 ILE HD11 . 18188 1 463 . 1 1 41 41 ILE C C 13 175.2770 0.3 . 1 . . . . 37 ILE C . 18188 1 464 . 1 1 41 41 ILE CA C 13 60.6580 0.3 . 1 . . . . 37 ILE CA . 18188 1 465 . 1 1 41 41 ILE CB C 13 44.1980 0.3 . 1 . . . . 37 ILE CB . 18188 1 466 . 1 1 41 41 ILE CG1 C 13 28.6850 0.3 . 1 . . . . 37 ILE CG1 . 18188 1 467 . 1 1 41 41 ILE CG2 C 13 16.9030 0.3 . 1 . . . . 37 ILE CG2 . 18188 1 468 . 1 1 41 41 ILE CD1 C 13 16.0250 0.3 . 1 . . . . 37 ILE CD1 . 18188 1 469 . 1 1 41 41 ILE N N 15 125.0460 0.2 . 1 . . . . 37 ILE N . 18188 1 470 . 1 1 42 42 CYS H H 1 9.5160 0.02 . 1 . . . . 38 CYS HN . 18188 1 471 . 1 1 42 42 CYS HA H 1 5.4290 0.02 . 1 . . . . 38 CYS HA . 18188 1 472 . 1 1 42 42 CYS HB2 H 1 2.7240 0.02 . 2 . . . . 38 CYS HB1 . 18188 1 473 . 1 1 42 42 CYS HB3 H 1 3.1280 0.02 . 2 . . . . 38 CYS HB2 . 18188 1 474 . 1 1 42 42 CYS C C 13 173.0900 0.3 . 1 . . . . 38 CYS C . 18188 1 475 . 1 1 42 42 CYS CA C 13 57.4610 0.3 . 1 . . . . 38 CYS CA . 18188 1 476 . 1 1 42 42 CYS CB C 13 30.2660 0.3 . 1 . . . . 38 CYS CB . 18188 1 477 . 1 1 42 42 CYS N N 15 125.1340 0.2 . 1 . . . . 38 CYS N . 18188 1 478 . 1 1 43 43 MET H H 1 8.8000 0.02 . 1 . . . . 39 MET HN . 18188 1 479 . 1 1 43 43 MET HA H 1 4.9850 0.02 . 1 . . . . 39 MET HA . 18188 1 480 . 1 1 43 43 MET HB2 H 1 1.7580 0.02 . 2 . . . . 39 MET HB1 . 18188 1 481 . 1 1 43 43 MET HB3 H 1 1.7580 0.02 . 2 . . . . 39 MET HB2 . 18188 1 482 . 1 1 43 43 MET HG2 H 1 2.2190 0.02 . 2 . . . . 39 MET HG1 . 18188 1 483 . 1 1 43 43 MET HG3 H 1 2.2190 0.02 . 2 . . . . 39 MET HG2 . 18188 1 484 . 1 1 43 43 MET HE1 H 1 0.8710 0.02 . 1 . . . . 39 MET HE1 . 18188 1 485 . 1 1 43 43 MET HE2 H 1 0.8710 0.02 . 1 . . . . 39 MET HE1 . 18188 1 486 . 1 1 43 43 MET HE3 H 1 0.8710 0.02 . 1 . . . . 39 MET HE1 . 18188 1 487 . 1 1 43 43 MET C C 13 172.4130 0.3 . 1 . . . . 39 MET C . 18188 1 488 . 1 1 43 43 MET CA C 13 54.6250 0.3 . 1 . . . . 39 MET CA . 18188 1 489 . 1 1 43 43 MET CB C 13 37.7480 0.3 . 1 . . . . 39 MET CB . 18188 1 490 . 1 1 43 43 MET CG C 13 30.9310 0.3 . 1 . . . . 39 MET CG . 18188 1 491 . 1 1 43 43 MET CE C 13 21.6390 0.3 . 1 . . . . 39 MET CE . 18188 1 492 . 1 1 43 43 MET N N 15 119.4400 0.2 . 1 . . . . 39 MET N . 18188 1 493 . 1 1 44 44 ASP H H 1 9.7060 0.02 . 1 . . . . 40 ASP HN . 18188 1 494 . 1 1 44 44 ASP HA H 1 5.8180 0.02 . 1 . . . . 40 ASP HA . 18188 1 495 . 1 1 44 44 ASP HB2 H 1 2.4740 0.02 . 2 . . . . 40 ASP HB1 . 18188 1 496 . 1 1 44 44 ASP HB3 H 1 2.5830 0.02 . 2 . . . . 40 ASP HB2 . 18188 1 497 . 1 1 44 44 ASP C C 13 175.2420 0.3 . 1 . . . . 40 ASP C . 18188 1 498 . 1 1 44 44 ASP CA C 13 52.9270 0.3 . 1 . . . . 40 ASP CA . 18188 1 499 . 1 1 44 44 ASP CB C 13 44.4450 0.3 . 1 . . . . 40 ASP CB . 18188 1 500 . 1 1 44 44 ASP N N 15 123.9840 0.2 . 1 . . . . 40 ASP N . 18188 1 501 . 1 1 45 45 ILE H H 1 9.5620 0.02 . 1 . . . . 41 ILE HN . 18188 1 502 . 1 1 45 45 ILE HA H 1 5.0080 0.02 . 1 . . . . 41 ILE HA . 18188 1 503 . 1 1 45 45 ILE HB H 1 1.6910 0.02 . 1 . . . . 41 ILE HB . 18188 1 504 . 1 1 45 45 ILE HG12 H 1 0.8400 0.02 . 2 . . . . 41 ILE HG11 . 18188 1 505 . 1 1 45 45 ILE HG13 H 1 1.5410 0.02 . 2 . . . . 41 ILE HG12 . 18188 1 506 . 1 1 45 45 ILE HG21 H 1 0.8090 0.02 . 1 . . . . 41 ILE HG21 . 18188 1 507 . 1 1 45 45 ILE HG22 H 1 0.8090 0.02 . 1 . . . . 41 ILE HG21 . 18188 1 508 . 1 1 45 45 ILE HG23 H 1 0.8090 0.02 . 1 . . . . 41 ILE HG21 . 18188 1 509 . 1 1 45 45 ILE HD11 H 1 0.8420 0.02 . 1 . . . . 41 ILE HD11 . 18188 1 510 . 1 1 45 45 ILE HD12 H 1 0.8420 0.02 . 1 . . . . 41 ILE HD11 . 18188 1 511 . 1 1 45 45 ILE HD13 H 1 0.8420 0.02 . 1 . . . . 41 ILE HD11 . 18188 1 512 . 1 1 45 45 ILE C C 13 175.6420 0.3 . 1 . . . . 41 ILE C . 18188 1 513 . 1 1 45 45 ILE CA C 13 59.4050 0.3 . 1 . . . . 41 ILE CA . 18188 1 514 . 1 1 45 45 ILE CB C 13 41.9600 0.3 . 1 . . . . 41 ILE CB . 18188 1 515 . 1 1 45 45 ILE CG1 C 13 28.7850 0.3 . 1 . . . . 41 ILE CG1 . 18188 1 516 . 1 1 45 45 ILE CG2 C 13 17.5010 0.3 . 1 . . . . 41 ILE CG2 . 18188 1 517 . 1 1 45 45 ILE CD1 C 13 15.6130 0.3 . 1 . . . . 41 ILE CD1 . 18188 1 518 . 1 1 45 45 ILE N N 15 123.0060 0.2 . 1 . . . . 41 ILE N . 18188 1 519 . 1 1 46 46 SER H H 1 9.4900 0.02 . 1 . . . . 42 SER HN . 18188 1 520 . 1 1 46 46 SER HA H 1 5.6570 0.02 . 1 . . . . 42 SER HA . 18188 1 521 . 1 1 46 46 SER HB2 H 1 3.8810 0.02 . 2 . . . . 42 SER HB1 . 18188 1 522 . 1 1 46 46 SER HB3 H 1 3.8810 0.02 . 2 . . . . 42 SER HB2 . 18188 1 523 . 1 1 46 46 SER C C 13 172.6850 0.3 . 1 . . . . 42 SER C . 18188 1 524 . 1 1 46 46 SER CA C 13 57.2530 0.3 . 1 . . . . 42 SER CA . 18188 1 525 . 1 1 46 46 SER CB C 13 65.4080 0.3 . 1 . . . . 42 SER CB . 18188 1 526 . 1 1 46 46 SER N N 15 124.1100 0.2 . 1 . . . . 42 SER N . 18188 1 527 . 1 1 47 47 TYR H H 1 8.2700 0.02 . 1 . . . . 43 TYR HN . 18188 1 528 . 1 1 47 47 TYR HA H 1 4.9910 0.02 . 1 . . . . 43 TYR HA . 18188 1 529 . 1 1 47 47 TYR HB2 H 1 2.6250 0.02 . 2 . . . . 43 TYR HB1 . 18188 1 530 . 1 1 47 47 TYR HB3 H 1 2.6250 0.02 . 2 . . . . 43 TYR HB2 . 18188 1 531 . 1 1 47 47 TYR HD1 H 1 7.0830 0.02 . 3 . . . . 43 TYR HD1 . 18188 1 532 . 1 1 47 47 TYR HE1 H 1 6.9040 0.02 . 3 . . . . 43 TYR HE1 . 18188 1 533 . 1 1 47 47 TYR HD2 H 1 7.0830 0.02 . 3 . . . . 43 TYR HD2 . 18188 1 534 . 1 1 47 47 TYR HE2 H 1 6.9040 0.02 . 3 . . . . 43 TYR HE2 . 18188 1 535 . 1 1 47 47 TYR C C 13 173.2580 0.3 . 1 . . . . 43 TYR C . 18188 1 536 . 1 1 47 47 TYR CA C 13 54.6670 0.3 . 1 . . . . 43 TYR CA . 18188 1 537 . 1 1 47 47 TYR CB C 13 42.4360 0.3 . 1 . . . . 43 TYR CB . 18188 1 538 . 1 1 47 47 TYR CD1 C 13 133.2800 0.3 . 3 . . . . 43 TYR CD1 . 18188 1 539 . 1 1 47 47 TYR CE1 C 13 118.5300 0.3 . 3 . . . . 43 TYR CE1 . 18188 1 540 . 1 1 47 47 TYR CD2 C 13 133.2800 0.3 . 3 . . . . 43 TYR CD2 . 18188 1 541 . 1 1 47 47 TYR CE2 C 13 118.5300 0.3 . 3 . . . . 43 TYR CE2 . 18188 1 542 . 1 1 47 47 TYR N N 15 117.5350 0.2 . 1 . . . . 43 TYR N . 18188 1 543 . 1 1 48 48 ASP H H 1 9.4890 0.02 . 1 . . . . 44 ASP HN . 18188 1 544 . 1 1 48 48 ASP HA H 1 4.5830 0.02 . 1 . . . . 44 ASP HA . 18188 1 545 . 1 1 48 48 ASP HB2 H 1 2.6970 0.02 . 2 . . . . 44 ASP HB1 . 18188 1 546 . 1 1 48 48 ASP HB3 H 1 3.0010 0.02 . 2 . . . . 44 ASP HB2 . 18188 1 547 . 1 1 48 48 ASP C C 13 176.7390 0.3 . 1 . . . . 44 ASP C . 18188 1 548 . 1 1 48 48 ASP CA C 13 53.1900 0.3 . 1 . . . . 44 ASP CA . 18188 1 549 . 1 1 48 48 ASP CB C 13 39.7100 0.3 . 1 . . . . 44 ASP CB . 18188 1 550 . 1 1 48 48 ASP N N 15 118.7610 0.2 . 1 . . . . 44 ASP N . 18188 1 551 . 1 1 49 49 ALA H H 1 8.7270 0.02 . 1 . . . . 45 ALA HN . 18188 1 552 . 1 1 49 49 ALA HA H 1 4.9660 0.02 . 1 . . . . 45 ALA HA . 18188 1 553 . 1 1 49 49 ALA HB1 H 1 1.3880 0.02 . 1 . . . . 45 ALA HB1 . 18188 1 554 . 1 1 49 49 ALA HB2 H 1 1.3880 0.02 . 1 . . . . 45 ALA HB1 . 18188 1 555 . 1 1 49 49 ALA HB3 H 1 1.3880 0.02 . 1 . . . . 45 ALA HB1 . 18188 1 556 . 1 1 49 49 ALA C C 13 178.1170 0.3 . 1 . . . . 45 ALA C . 18188 1 557 . 1 1 49 49 ALA CA C 13 53.2340 0.3 . 1 . . . . 45 ALA CA . 18188 1 558 . 1 1 49 49 ALA CB C 13 18.0050 0.3 . 1 . . . . 45 ALA CB . 18188 1 559 . 1 1 49 49 ALA N N 15 131.5220 0.2 . 1 . . . . 45 ALA N . 18188 1 560 . 1 1 50 50 SER H H 1 8.7350 0.02 . 1 . . . . 46 SER HN . 18188 1 561 . 1 1 50 50 SER HA H 1 4.3770 0.02 . 1 . . . . 46 SER HA . 18188 1 562 . 1 1 50 50 SER HB2 H 1 3.8760 0.02 . 2 . . . . 46 SER HB1 . 18188 1 563 . 1 1 50 50 SER HB3 H 1 3.9460 0.02 . 2 . . . . 46 SER HB2 . 18188 1 564 . 1 1 50 50 SER C C 13 175.5060 0.3 . 1 . . . . 46 SER C . 18188 1 565 . 1 1 50 50 SER CA C 13 60.2510 0.3 . 1 . . . . 46 SER CA . 18188 1 566 . 1 1 50 50 SER CB C 13 63.2510 0.3 . 1 . . . . 46 SER CB . 18188 1 567 . 1 1 50 50 SER N N 15 113.8280 0.2 . 1 . . . . 46 SER N . 18188 1 568 . 1 1 51 51 LYS H H 1 7.1300 0.02 . 1 . . . . 47 LYS HN . 18188 1 569 . 1 1 51 51 LYS HA H 1 4.0320 0.02 . 1 . . . . 47 LYS HA . 18188 1 570 . 1 1 51 51 LYS HB2 H 1 0.5590 0.02 . 2 . . . . 47 LYS HB1 . 18188 1 571 . 1 1 51 51 LYS HB3 H 1 0.5590 0.02 . 2 . . . . 47 LYS HB2 . 18188 1 572 . 1 1 51 51 LYS HG2 H 1 0.8880 0.02 . 2 . . . . 47 LYS HG1 . 18188 1 573 . 1 1 51 51 LYS HG3 H 1 1.1170 0.02 . 2 . . . . 47 LYS HG2 . 18188 1 574 . 1 1 51 51 LYS HD2 H 1 1.2690 0.02 . 2 . . . . 47 LYS HD1 . 18188 1 575 . 1 1 51 51 LYS HD3 H 1 1.4450 0.02 . 2 . . . . 47 LYS HD2 . 18188 1 576 . 1 1 51 51 LYS HE2 H 1 2.8290 0.02 . 2 . . . . 47 LYS HE1 . 18188 1 577 . 1 1 51 51 LYS HE3 H 1 2.8290 0.02 . 2 . . . . 47 LYS HE2 . 18188 1 578 . 1 1 51 51 LYS C C 13 173.9820 0.3 . 1 . . . . 47 LYS C . 18188 1 579 . 1 1 51 51 LYS CA C 13 57.9490 0.3 . 1 . . . . 47 LYS CA . 18188 1 580 . 1 1 51 51 LYS CB C 13 35.4460 0.3 . 1 . . . . 47 LYS CB . 18188 1 581 . 1 1 51 51 LYS CG C 13 26.4000 0.3 . 1 . . . . 47 LYS CG . 18188 1 582 . 1 1 51 51 LYS CD C 13 29.7750 0.3 . 1 . . . . 47 LYS CD . 18188 1 583 . 1 1 51 51 LYS CE C 13 42.3520 0.3 . 1 . . . . 47 LYS CE . 18188 1 584 . 1 1 51 51 LYS N N 15 121.1560 0.2 . 1 . . . . 47 LYS N . 18188 1 585 . 1 1 52 52 PHE H H 1 7.6490 0.02 . 1 . . . . 48 PHE HN . 18188 1 586 . 1 1 52 52 PHE HA H 1 5.6690 0.02 . 1 . . . . 48 PHE HA . 18188 1 587 . 1 1 52 52 PHE HB2 H 1 2.5290 0.02 . 2 . . . . 48 PHE HB1 . 18188 1 588 . 1 1 52 52 PHE HB3 H 1 2.9000 0.02 . 2 . . . . 48 PHE HB2 . 18188 1 589 . 1 1 52 52 PHE HD1 H 1 6.5450 0.02 . 3 . . . . 48 PHE HD1 . 18188 1 590 . 1 1 52 52 PHE HD2 H 1 6.5450 0.02 . 3 . . . . 48 PHE HD2 . 18188 1 591 . 1 1 52 52 PHE HE1 H 1 6.1040 0.02 . 3 . . . . 48 PHE HE1 . 18188 1 592 . 1 1 52 52 PHE HE2 H 1 6.1040 0.02 . 3 . . . . 48 PHE HE2 . 18188 1 593 . 1 1 52 52 PHE HZ H 1 6.3650 0.02 . 1 . . . . 48 PHE HZ . 18188 1 594 . 1 1 52 52 PHE C C 13 174.6860 0.3 . 1 . . . . 48 PHE C . 18188 1 595 . 1 1 52 52 PHE CA C 13 54.6250 0.3 . 1 . . . . 48 PHE CA . 18188 1 596 . 1 1 52 52 PHE CB C 13 43.4430 0.3 . 1 . . . . 48 PHE CB . 18188 1 597 . 1 1 52 52 PHE CD1 C 13 131.0300 0.3 . 3 . . . . 48 PHE CD1 . 18188 1 598 . 1 1 52 52 PHE CD2 C 13 131.0300 0.3 . 3 . . . . 48 PHE CD2 . 18188 1 599 . 1 1 52 52 PHE CE1 C 13 131.0300 0.3 . 3 . . . . 48 PHE CE1 . 18188 1 600 . 1 1 52 52 PHE CE2 C 13 131.0300 0.3 . 3 . . . . 48 PHE CE2 . 18188 1 601 . 1 1 52 52 PHE CZ C 13 128.0300 0.3 . 1 . . . . 48 PHE CZ . 18188 1 602 . 1 1 52 52 PHE N N 15 115.4610 0.2 . 1 . . . . 48 PHE N . 18188 1 603 . 1 1 53 53 THR H H 1 8.9140 0.02 . 1 . . . . 49 THR HN . 18188 1 604 . 1 1 53 53 THR HA H 1 4.9220 0.02 . 1 . . . . 49 THR HA . 18188 1 605 . 1 1 53 53 THR HB H 1 4.0090 0.02 . 1 . . . . 49 THR HB . 18188 1 606 . 1 1 53 53 THR HG21 H 1 1.0210 0.02 . 1 . . . . 49 THR HG21 . 18188 1 607 . 1 1 53 53 THR HG22 H 1 1.0210 0.02 . 1 . . . . 49 THR HG21 . 18188 1 608 . 1 1 53 53 THR HG23 H 1 1.0210 0.02 . 1 . . . . 49 THR HG21 . 18188 1 609 . 1 1 53 53 THR C C 13 174.4770 0.3 . 1 . . . . 49 THR C . 18188 1 610 . 1 1 53 53 THR CA C 13 60.7860 0.3 . 1 . . . . 49 THR CA . 18188 1 611 . 1 1 53 53 THR CB C 13 71.9720 0.3 . 1 . . . . 49 THR CB . 18188 1 612 . 1 1 53 53 THR CG2 C 13 22.0750 0.3 . 1 . . . . 49 THR CG2 . 18188 1 613 . 1 1 53 53 THR N N 15 115.5980 0.2 . 1 . . . . 49 THR N . 18188 1 614 . 1 1 54 54 VAL H H 1 9.0850 0.02 . 1 . . . . 50 VAL HN . 18188 1 615 . 1 1 54 54 VAL HA H 1 3.6190 0.02 . 1 . . . . 50 VAL HA . 18188 1 616 . 1 1 54 54 VAL HB H 1 1.8530 0.02 . 1 . . . . 50 VAL HB . 18188 1 617 . 1 1 54 54 VAL HG11 H 1 0.5000 0.02 . 2 . . . . 50 VAL HG11 . 18188 1 618 . 1 1 54 54 VAL HG12 H 1 0.5000 0.02 . 2 . . . . 50 VAL HG11 . 18188 1 619 . 1 1 54 54 VAL HG13 H 1 0.5000 0.02 . 2 . . . . 50 VAL HG11 . 18188 1 620 . 1 1 54 54 VAL HG21 H 1 0.6260 0.02 . 2 . . . . 50 VAL HG21 . 18188 1 621 . 1 1 54 54 VAL HG22 H 1 0.6260 0.02 . 2 . . . . 50 VAL HG21 . 18188 1 622 . 1 1 54 54 VAL HG23 H 1 0.6260 0.02 . 2 . . . . 50 VAL HG21 . 18188 1 623 . 1 1 54 54 VAL C C 13 174.6570 0.3 . 1 . . . . 50 VAL C . 18188 1 624 . 1 1 54 54 VAL CA C 13 63.5600 0.3 . 1 . . . . 50 VAL CA . 18188 1 625 . 1 1 54 54 VAL CB C 13 32.0760 0.3 . 1 . . . . 50 VAL CB . 18188 1 626 . 1 1 54 54 VAL CG1 C 13 22.6740 0.3 . 2 . . . . 50 VAL CG1 . 18188 1 627 . 1 1 54 54 VAL CG2 C 13 20.6880 0.3 . 2 . . . . 50 VAL CG2 . 18188 1 628 . 1 1 54 54 VAL N N 15 127.1280 0.2 . 1 . . . . 50 VAL N . 18188 1 629 . 1 1 55 55 LYS H H 1 9.1730 0.02 . 1 . . . . 51 LYS HN . 18188 1 630 . 1 1 55 55 LYS HA H 1 4.3000 0.02 . 1 . . . . 51 LYS HA . 18188 1 631 . 1 1 55 55 LYS HB2 H 1 1.4770 0.02 . 2 . . . . 51 LYS HB1 . 18188 1 632 . 1 1 55 55 LYS HB3 H 1 1.4770 0.02 . 2 . . . . 51 LYS HB2 . 18188 1 633 . 1 1 55 55 LYS HG2 H 1 1.2910 0.02 . 2 . . . . 51 LYS HG1 . 18188 1 634 . 1 1 55 55 LYS HG3 H 1 1.2910 0.02 . 2 . . . . 51 LYS HG2 . 18188 1 635 . 1 1 55 55 LYS HD2 H 1 1.4560 0.02 . 2 . . . . 51 LYS HD1 . 18188 1 636 . 1 1 55 55 LYS HD3 H 1 1.5890 0.02 . 2 . . . . 51 LYS HD2 . 18188 1 637 . 1 1 55 55 LYS HE2 H 1 2.9320 0.02 . 2 . . . . 51 LYS HE1 . 18188 1 638 . 1 1 55 55 LYS HE3 H 1 2.9320 0.02 . 2 . . . . 51 LYS HE2 . 18188 1 639 . 1 1 55 55 LYS C C 13 176.0680 0.3 . 1 . . . . 51 LYS C . 18188 1 640 . 1 1 55 55 LYS CA C 13 57.4380 0.3 . 1 . . . . 51 LYS CA . 18188 1 641 . 1 1 55 55 LYS CB C 13 33.9980 0.3 . 1 . . . . 51 LYS CB . 18188 1 642 . 1 1 55 55 LYS CG C 13 24.8150 0.3 . 1 . . . . 51 LYS CG . 18188 1 643 . 1 1 55 55 LYS CD C 13 29.7140 0.3 . 1 . . . . 51 LYS CD . 18188 1 644 . 1 1 55 55 LYS CE C 13 42.1110 0.3 . 1 . . . . 51 LYS CE . 18188 1 645 . 1 1 55 55 LYS N N 15 131.1490 0.2 . 1 . . . . 51 LYS N . 18188 1 646 . 1 1 56 56 ASP H H 1 7.7670 0.02 . 1 . . . . 52 ASP HN . 18188 1 647 . 1 1 56 56 ASP HA H 1 4.4820 0.02 . 1 . . . . 52 ASP HA . 18188 1 648 . 1 1 56 56 ASP HB2 H 1 2.6210 0.02 . 2 . . . . 52 ASP HB1 . 18188 1 649 . 1 1 56 56 ASP HB3 H 1 2.9830 0.02 . 2 . . . . 52 ASP HB2 . 18188 1 650 . 1 1 56 56 ASP C C 13 172.8900 0.3 . 1 . . . . 52 ASP C . 18188 1 651 . 1 1 56 56 ASP CA C 13 53.4000 0.3 . 1 . . . . 52 ASP CA . 18188 1 652 . 1 1 56 56 ASP CB C 13 42.1910 0.3 . 1 . . . . 52 ASP CB . 18188 1 653 . 1 1 56 56 ASP N N 15 112.1690 0.2 . 1 . . . . 52 ASP N . 18188 1 654 . 1 1 57 57 VAL H H 1 8.1230 0.02 . 1 . . . . 53 VAL HN . 18188 1 655 . 1 1 57 57 VAL HA H 1 4.7480 0.02 . 1 . . . . 53 VAL HA . 18188 1 656 . 1 1 57 57 VAL HB H 1 2.0460 0.02 . 1 . . . . 53 VAL HB . 18188 1 657 . 1 1 57 57 VAL HG11 H 1 0.7390 0.02 . 2 . . . . 53 VAL HG11 . 18188 1 658 . 1 1 57 57 VAL HG12 H 1 0.7390 0.02 . 2 . . . . 53 VAL HG11 . 18188 1 659 . 1 1 57 57 VAL HG13 H 1 0.7390 0.02 . 2 . . . . 53 VAL HG11 . 18188 1 660 . 1 1 57 57 VAL HG21 H 1 0.7960 0.02 . 2 . . . . 53 VAL HG21 . 18188 1 661 . 1 1 57 57 VAL HG22 H 1 0.7960 0.02 . 2 . . . . 53 VAL HG21 . 18188 1 662 . 1 1 57 57 VAL HG23 H 1 0.7960 0.02 . 2 . . . . 53 VAL HG21 . 18188 1 663 . 1 1 57 57 VAL C C 13 174.5800 0.3 . 1 . . . . 53 VAL C . 18188 1 664 . 1 1 57 57 VAL CA C 13 62.2160 0.3 . 1 . . . . 53 VAL CA . 18188 1 665 . 1 1 57 57 VAL CB C 13 33.9720 0.3 . 1 . . . . 53 VAL CB . 18188 1 666 . 1 1 57 57 VAL CG1 C 13 20.9860 0.3 . 2 . . . . 53 VAL CG1 . 18188 1 667 . 1 1 57 57 VAL CG2 C 13 20.9860 0.3 . 2 . . . . 53 VAL CG2 . 18188 1 668 . 1 1 57 57 VAL N N 15 117.6000 0.2 . 1 . . . . 53 VAL N . 18188 1 669 . 1 1 58 58 LEU H H 1 8.8110 0.02 . 1 . . . . 54 LEU HN . 18188 1 670 . 1 1 58 58 LEU HA H 1 5.1360 0.02 . 1 . . . . 54 LEU HA . 18188 1 671 . 1 1 58 58 LEU HB2 H 1 1.5450 0.02 . 2 . . . . 54 LEU HB1 . 18188 1 672 . 1 1 58 58 LEU HB3 H 1 1.6400 0.02 . 2 . . . . 54 LEU HB2 . 18188 1 673 . 1 1 58 58 LEU HG H 1 1.6390 0.02 . 1 . . . . 54 LEU HG . 18188 1 674 . 1 1 58 58 LEU HD11 H 1 0.7980 0.02 . 2 . . . . 54 LEU HD11 . 18188 1 675 . 1 1 58 58 LEU HD12 H 1 0.7980 0.02 . 2 . . . . 54 LEU HD11 . 18188 1 676 . 1 1 58 58 LEU HD13 H 1 0.7980 0.02 . 2 . . . . 54 LEU HD11 . 18188 1 677 . 1 1 58 58 LEU HD21 H 1 0.8860 0.02 . 2 . . . . 54 LEU HD21 . 18188 1 678 . 1 1 58 58 LEU HD22 H 1 0.8860 0.02 . 2 . . . . 54 LEU HD21 . 18188 1 679 . 1 1 58 58 LEU HD23 H 1 0.8860 0.02 . 2 . . . . 54 LEU HD21 . 18188 1 680 . 1 1 58 58 LEU CA C 13 50.8670 0.3 . 1 . . . . 54 LEU CA . 18188 1 681 . 1 1 58 58 LEU CB C 13 44.2870 0.3 . 1 . . . . 54 LEU CB . 18188 1 682 . 1 1 58 58 LEU CG C 13 25.9390 0.3 . 1 . . . . 54 LEU CG . 18188 1 683 . 1 1 58 58 LEU CD1 C 13 25.9390 0.3 . 2 . . . . 54 LEU CD1 . 18188 1 684 . 1 1 58 58 LEU CD2 C 13 22.9210 0.3 . 2 . . . . 54 LEU CD2 . 18188 1 685 . 1 1 58 58 LEU N N 15 126.6510 0.2 . 1 . . . . 54 LEU N . 18188 1 686 . 1 1 59 59 PRO HA H 1 4.0350 0.02 . 1 . . . . 55 PRO HA . 18188 1 687 . 1 1 59 59 PRO HB2 H 1 0.1160 0.02 . 2 . . . . 55 PRO HB1 . 18188 1 688 . 1 1 59 59 PRO HB3 H 1 0.9290 0.02 . 2 . . . . 55 PRO HB2 . 18188 1 689 . 1 1 59 59 PRO HG2 H 1 1.7180 0.02 . 2 . . . . 55 PRO HG1 . 18188 1 690 . 1 1 59 59 PRO HG3 H 1 1.8540 0.02 . 2 . . . . 55 PRO HG2 . 18188 1 691 . 1 1 59 59 PRO HD2 H 1 3.6520 0.02 . 2 . . . . 55 PRO HD1 . 18188 1 692 . 1 1 59 59 PRO HD3 H 1 3.8420 0.02 . 2 . . . . 55 PRO HD2 . 18188 1 693 . 1 1 59 59 PRO C C 13 175.8770 0.3 . 1 . . . . 55 PRO C . 18188 1 694 . 1 1 59 59 PRO CA C 13 61.5330 0.3 . 1 . . . . 55 PRO CA . 18188 1 695 . 1 1 59 59 PRO CB C 13 29.9940 0.3 . 1 . . . . 55 PRO CB . 18188 1 696 . 1 1 59 59 PRO CG C 13 25.8550 0.3 . 1 . . . . 55 PRO CG . 18188 1 697 . 1 1 59 59 PRO CD C 13 49.8110 0.3 . 1 . . . . 55 PRO CD . 18188 1 698 . 1 1 60 60 ASN H H 1 7.5830 0.02 . 1 . . . . 56 ASN HN . 18188 1 699 . 1 1 60 60 ASN HA H 1 4.9580 0.02 . 1 . . . . 56 ASN HA . 18188 1 700 . 1 1 60 60 ASN HB2 H 1 2.0840 0.02 . 2 . . . . 56 ASN HB1 . 18188 1 701 . 1 1 60 60 ASN HB3 H 1 3.2400 0.02 . 2 . . . . 56 ASN HB2 . 18188 1 702 . 1 1 60 60 ASN HD21 H 1 7.3520 0.02 . 2 . . . . 56 ASN HD21 . 18188 1 703 . 1 1 60 60 ASN HD22 H 1 8.8220 0.02 . 2 . . . . 56 ASN HD22 . 18188 1 704 . 1 1 60 60 ASN C C 13 177.2390 0.3 . 1 . . . . 56 ASN C . 18188 1 705 . 1 1 60 60 ASN CA C 13 51.3620 0.3 . 1 . . . . 56 ASN CA . 18188 1 706 . 1 1 60 60 ASN CB C 13 37.1590 0.3 . 1 . . . . 56 ASN CB . 18188 1 707 . 1 1 60 60 ASN N N 15 117.0100 0.2 . 1 . . . . 56 ASN N . 18188 1 708 . 1 1 60 60 ASN ND2 N 15 114.0620 0.2 . 1 . . . . 56 ASN ND2 . 18188 1 709 . 1 1 61 61 THR H H 1 8.5810 0.02 . 1 . . . . 57 THR HN . 18188 1 710 . 1 1 61 61 THR HA H 1 4.5590 0.02 . 1 . . . . 57 THR HA . 18188 1 711 . 1 1 61 61 THR HB H 1 4.5730 0.02 . 1 . . . . 57 THR HB . 18188 1 712 . 1 1 61 61 THR HG21 H 1 1.1950 0.02 . 1 . . . . 57 THR HG21 . 18188 1 713 . 1 1 61 61 THR HG22 H 1 1.1950 0.02 . 1 . . . . 57 THR HG21 . 18188 1 714 . 1 1 61 61 THR HG23 H 1 1.1950 0.02 . 1 . . . . 57 THR HG21 . 18188 1 715 . 1 1 61 61 THR C C 13 174.7130 0.3 . 1 . . . . 57 THR C . 18188 1 716 . 1 1 61 61 THR CA C 13 64.0010 0.3 . 1 . . . . 57 THR CA . 18188 1 717 . 1 1 61 61 THR CB C 13 67.8790 0.3 . 1 . . . . 57 THR CB . 18188 1 718 . 1 1 61 61 THR CG2 C 13 21.7890 0.3 . 1 . . . . 57 THR CG2 . 18188 1 719 . 1 1 61 61 THR N N 15 119.5640 0.2 . 1 . . . . 57 THR N . 18188 1 720 . 1 1 62 62 ASP H H 1 7.6030 0.02 . 1 . . . . 58 ASP HN . 18188 1 721 . 1 1 62 62 ASP HA H 1 4.4550 0.02 . 1 . . . . 58 ASP HA . 18188 1 722 . 1 1 62 62 ASP HB2 H 1 2.6990 0.02 . 2 . . . . 58 ASP HB1 . 18188 1 723 . 1 1 62 62 ASP HB3 H 1 2.6540 0.02 . 2 . . . . 58 ASP HB2 . 18188 1 724 . 1 1 62 62 ASP C C 13 175.8710 0.3 . 1 . . . . 58 ASP C . 18188 1 725 . 1 1 62 62 ASP CA C 13 56.4480 0.3 . 1 . . . . 58 ASP CA . 18188 1 726 . 1 1 62 62 ASP CB C 13 40.0420 0.3 . 1 . . . . 58 ASP CB . 18188 1 727 . 1 1 62 62 ASP N N 15 119.5580 0.2 . 1 . . . . 58 ASP N . 18188 1 728 . 1 1 63 63 LEU H H 1 7.0650 0.02 . 1 . . . . 59 LEU HN . 18188 1 729 . 1 1 63 63 LEU HA H 1 4.3610 0.02 . 1 . . . . 59 LEU HA . 18188 1 730 . 1 1 63 63 LEU HB2 H 1 1.6140 0.02 . 2 . . . . 59 LEU HB1 . 18188 1 731 . 1 1 63 63 LEU HB3 H 1 1.3250 0.02 . 2 . . . . 59 LEU HB2 . 18188 1 732 . 1 1 63 63 LEU HG H 1 1.4630 0.02 . 1 . . . . 59 LEU HG . 18188 1 733 . 1 1 63 63 LEU HD11 H 1 0.5470 0.02 . 2 . . . . 59 LEU HD11 . 18188 1 734 . 1 1 63 63 LEU HD12 H 1 0.5470 0.02 . 2 . . . . 59 LEU HD11 . 18188 1 735 . 1 1 63 63 LEU HD13 H 1 0.5470 0.02 . 2 . . . . 59 LEU HD11 . 18188 1 736 . 1 1 63 63 LEU HD21 H 1 0.7100 0.02 . 2 . . . . 59 LEU HD21 . 18188 1 737 . 1 1 63 63 LEU HD22 H 1 0.7100 0.02 . 2 . . . . 59 LEU HD21 . 18188 1 738 . 1 1 63 63 LEU HD23 H 1 0.7100 0.02 . 2 . . . . 59 LEU HD21 . 18188 1 739 . 1 1 63 63 LEU C C 13 175.7860 0.3 . 1 . . . . 59 LEU C . 18188 1 740 . 1 1 63 63 LEU CA C 13 56.5000 0.3 . 1 . . . . 59 LEU CA . 18188 1 741 . 1 1 63 63 LEU CB C 13 45.9050 0.3 . 1 . . . . 59 LEU CB . 18188 1 742 . 1 1 63 63 LEU CG C 13 28.9830 0.3 . 1 . . . . 59 LEU CG . 18188 1 743 . 1 1 63 63 LEU CD1 C 13 24.9090 0.3 . 2 . . . . 59 LEU CD1 . 18188 1 744 . 1 1 63 63 LEU CD2 C 13 23.6680 0.3 . 2 . . . . 59 LEU CD2 . 18188 1 745 . 1 1 63 63 LEU N N 15 119.4670 0.2 . 1 . . . . 59 LEU N . 18188 1 746 . 1 1 64 64 VAL H H 1 8.3630 0.02 . 1 . . . . 60 VAL HN . 18188 1 747 . 1 1 64 64 VAL HA H 1 3.6260 0.02 . 1 . . . . 60 VAL HA . 18188 1 748 . 1 1 64 64 VAL HB H 1 1.5910 0.02 . 1 . . . . 60 VAL HB . 18188 1 749 . 1 1 64 64 VAL HG11 H 1 0.8280 0.02 . 2 . . . . 60 VAL HG11 . 18188 1 750 . 1 1 64 64 VAL HG12 H 1 0.8280 0.02 . 2 . . . . 60 VAL HG11 . 18188 1 751 . 1 1 64 64 VAL HG13 H 1 0.8280 0.02 . 2 . . . . 60 VAL HG11 . 18188 1 752 . 1 1 64 64 VAL HG21 H 1 0.7440 0.02 . 2 . . . . 60 VAL HG21 . 18188 1 753 . 1 1 64 64 VAL HG22 H 1 0.7440 0.02 . 2 . . . . 60 VAL HG21 . 18188 1 754 . 1 1 64 64 VAL HG23 H 1 0.7440 0.02 . 2 . . . . 60 VAL HG21 . 18188 1 755 . 1 1 64 64 VAL C C 13 174.0420 0.3 . 1 . . . . 60 VAL C . 18188 1 756 . 1 1 64 64 VAL CA C 13 62.0920 0.3 . 1 . . . . 60 VAL CA . 18188 1 757 . 1 1 64 64 VAL CB C 13 31.1850 0.3 . 1 . . . . 60 VAL CB . 18188 1 758 . 1 1 64 64 VAL CG1 C 13 21.5200 0.3 . 2 . . . . 60 VAL CG1 . 18188 1 759 . 1 1 64 64 VAL CG2 C 13 21.5200 0.3 . 2 . . . . 60 VAL CG2 . 18188 1 760 . 1 1 64 64 VAL N N 15 120.2190 0.2 . 1 . . . . 60 VAL N . 18188 1 761 . 1 1 65 65 LYS H H 1 8.5930 0.02 . 1 . . . . 61 LYS HN . 18188 1 762 . 1 1 65 65 LYS HA H 1 4.5380 0.02 . 1 . . . . 61 LYS HA . 18188 1 763 . 1 1 65 65 LYS HB2 H 1 1.7540 0.02 . 2 . . . . 61 LYS HB1 . 18188 1 764 . 1 1 65 65 LYS HB3 H 1 1.8130 0.02 . 2 . . . . 61 LYS HB2 . 18188 1 765 . 1 1 65 65 LYS HG2 H 1 1.3800 0.02 . 2 . . . . 61 LYS HG1 . 18188 1 766 . 1 1 65 65 LYS HG3 H 1 1.4810 0.02 . 2 . . . . 61 LYS HG2 . 18188 1 767 . 1 1 65 65 LYS HD2 H 1 1.6800 0.02 . 2 . . . . 61 LYS HD1 . 18188 1 768 . 1 1 65 65 LYS HD3 H 1 1.5820 0.02 . 2 . . . . 61 LYS HD2 . 18188 1 769 . 1 1 65 65 LYS HE2 H 1 2.8870 0.02 . 2 . . . . 61 LYS HE1 . 18188 1 770 . 1 1 65 65 LYS HE3 H 1 2.9940 0.02 . 2 . . . . 61 LYS HE2 . 18188 1 771 . 1 1 65 65 LYS C C 13 176.9190 0.3 . 1 . . . . 61 LYS C . 18188 1 772 . 1 1 65 65 LYS CA C 13 53.4950 0.3 . 1 . . . . 61 LYS CA . 18188 1 773 . 1 1 65 65 LYS CB C 13 33.7000 0.3 . 1 . . . . 61 LYS CB . 18188 1 774 . 1 1 65 65 LYS CG C 13 24.6860 0.3 . 1 . . . . 61 LYS CG . 18188 1 775 . 1 1 65 65 LYS CD C 13 28.1470 0.3 . 1 . . . . 61 LYS CD . 18188 1 776 . 1 1 65 65 LYS CE C 13 42.6660 0.3 . 1 . . . . 61 LYS CE . 18188 1 777 . 1 1 65 65 LYS N N 15 124.5930 0.2 . 1 . . . . 61 LYS N . 18188 1 778 . 1 1 66 66 ASP H H 1 8.8360 0.02 . 1 . . . . 62 ASP HN . 18188 1 779 . 1 1 66 66 ASP HA H 1 4.3530 0.02 . 1 . . . . 62 ASP HA . 18188 1 780 . 1 1 66 66 ASP HB2 H 1 1.2020 0.02 . 2 . . . . 62 ASP HB1 . 18188 1 781 . 1 1 66 66 ASP HB3 H 1 3.0250 0.02 . 2 . . . . 62 ASP HB2 . 18188 1 782 . 1 1 66 66 ASP C C 13 177.5850 0.3 . 1 . . . . 62 ASP C . 18188 1 783 . 1 1 66 66 ASP CA C 13 53.6880 0.3 . 1 . . . . 62 ASP CA . 18188 1 784 . 1 1 66 66 ASP CB C 13 38.1910 0.3 . 1 . . . . 62 ASP CB . 18188 1 785 . 1 1 66 66 ASP N N 15 117.1210 0.2 . 1 . . . . 62 ASP N . 18188 1 786 . 1 1 67 67 THR H H 1 7.9930 0.02 . 1 . . . . 63 THR HN . 18188 1 787 . 1 1 67 67 THR HA H 1 4.3210 0.02 . 1 . . . . 63 THR HA . 18188 1 788 . 1 1 67 67 THR HB H 1 4.3960 0.02 . 1 . . . . 63 THR HB . 18188 1 789 . 1 1 67 67 THR HG21 H 1 1.0470 0.02 . 1 . . . . 63 THR HG21 . 18188 1 790 . 1 1 67 67 THR HG22 H 1 1.0470 0.02 . 1 . . . . 63 THR HG21 . 18188 1 791 . 1 1 67 67 THR HG23 H 1 1.0470 0.02 . 1 . . . . 63 THR HG21 . 18188 1 792 . 1 1 67 67 THR C C 13 178.0530 0.3 . 1 . . . . 63 THR C . 18188 1 793 . 1 1 67 67 THR CA C 13 64.4700 0.3 . 1 . . . . 63 THR CA . 18188 1 794 . 1 1 67 67 THR CB C 13 68.6900 0.3 . 1 . . . . 63 THR CB . 18188 1 795 . 1 1 67 67 THR CG2 C 13 22.7240 0.3 . 1 . . . . 63 THR CG2 . 18188 1 796 . 1 1 67 67 THR N N 15 109.2570 0.2 . 1 . . . . 63 THR N . 18188 1 797 . 1 1 68 68 ASP H H 1 9.0090 0.02 . 1 . . . . 64 ASP HN . 18188 1 798 . 1 1 68 68 ASP HA H 1 4.3900 0.02 . 1 . . . . 64 ASP HA . 18188 1 799 . 1 1 68 68 ASP HB2 H 1 2.5460 0.02 . 2 . . . . 64 ASP HB1 . 18188 1 800 . 1 1 68 68 ASP HB3 H 1 2.6510 0.02 . 2 . . . . 64 ASP HB2 . 18188 1 801 . 1 1 68 68 ASP C C 13 175.7220 0.3 . 1 . . . . 64 ASP C . 18188 1 802 . 1 1 68 68 ASP CA C 13 55.4560 0.3 . 1 . . . . 64 ASP CA . 18188 1 803 . 1 1 68 68 ASP CB C 13 39.4480 0.3 . 1 . . . . 64 ASP CB . 18188 1 804 . 1 1 68 68 ASP N N 15 121.7600 0.2 . 1 . . . . 64 ASP N . 18188 1 805 . 1 1 69 69 ASN H H 1 7.5150 0.02 . 1 . . . . 65 ASN HN . 18188 1 806 . 1 1 69 69 ASN HA H 1 4.7470 0.02 . 1 . . . . 65 ASN HA . 18188 1 807 . 1 1 69 69 ASN HB2 H 1 2.2430 0.02 . 2 . . . . 65 ASN HB1 . 18188 1 808 . 1 1 69 69 ASN HB3 H 1 2.8940 0.02 . 2 . . . . 65 ASN HB2 . 18188 1 809 . 1 1 69 69 ASN HD21 H 1 7.4950 0.02 . 2 . . . . 65 ASN HD21 . 18188 1 810 . 1 1 69 69 ASN HD22 H 1 6.9080 0.02 . 2 . . . . 65 ASN HD22 . 18188 1 811 . 1 1 69 69 ASN C C 13 173.9540 0.3 . 1 . . . . 65 ASN C . 18188 1 812 . 1 1 69 69 ASN CA C 13 52.6550 0.3 . 1 . . . . 65 ASN CA . 18188 1 813 . 1 1 69 69 ASN CB C 13 38.7310 0.3 . 1 . . . . 65 ASN CB . 18188 1 814 . 1 1 69 69 ASN N N 15 116.8890 0.2 . 1 . . . . 65 ASN N . 18188 1 815 . 1 1 69 69 ASN ND2 N 15 114.6170 0.2 . 1 . . . . 65 ASN ND2 . 18188 1 816 . 1 1 70 70 TYR H H 1 7.2620 0.02 . 1 . . . . 66 TYR HN . 18188 1 817 . 1 1 70 70 TYR HA H 1 4.3540 0.02 . 1 . . . . 66 TYR HA . 18188 1 818 . 1 1 70 70 TYR HB2 H 1 3.1650 0.02 . 2 . . . . 66 TYR HB1 . 18188 1 819 . 1 1 70 70 TYR HB3 H 1 3.1650 0.02 . 2 . . . . 66 TYR HB2 . 18188 1 820 . 1 1 70 70 TYR HD1 H 1 7.0630 0.02 . 3 . . . . 66 TYR HD1 . 18188 1 821 . 1 1 70 70 TYR HE1 H 1 6.9110 0.02 . 3 . . . . 66 TYR HE1 . 18188 1 822 . 1 1 70 70 TYR C C 13 174.9710 0.3 . 1 . . . . 66 TYR C . 18188 1 823 . 1 1 70 70 TYR CA C 13 59.3930 0.3 . 1 . . . . 66 TYR CA . 18188 1 824 . 1 1 70 70 TYR CB C 13 33.9980 0.3 . 1 . . . . 66 TYR CB . 18188 1 825 . 1 1 70 70 TYR CD1 C 13 133.2800 0.3 . 3 . . . . 66 TYR CD1 . 18188 1 826 . 1 1 70 70 TYR CE1 C 13 118.2790 0.3 . 3 . . . . 66 TYR CE1 . 18188 1 827 . 1 1 70 70 TYR N N 15 110.2360 0.2 . 1 . . . . 66 TYR N . 18188 1 828 . 1 1 71 71 SER H H 1 7.1230 0.02 . 1 . . . . 67 SER HN . 18188 1 829 . 1 1 71 71 SER HA H 1 4.7540 0.02 . 1 . . . . 67 SER HA . 18188 1 830 . 1 1 71 71 SER HB2 H 1 3.6640 0.02 . 2 . . . . 67 SER HB1 . 18188 1 831 . 1 1 71 71 SER HB3 H 1 3.6640 0.02 . 2 . . . . 67 SER HB2 . 18188 1 832 . 1 1 71 71 SER C C 13 174.5990 0.3 . 1 . . . . 67 SER C . 18188 1 833 . 1 1 71 71 SER CA C 13 58.6000 0.3 . 1 . . . . 67 SER CA . 18188 1 834 . 1 1 71 71 SER CB C 13 64.9400 0.3 . 1 . . . . 67 SER CB . 18188 1 835 . 1 1 71 71 SER N N 15 111.5580 0.2 . 1 . . . . 67 SER N . 18188 1 836 . 1 1 72 72 PHE H H 1 8.1560 0.02 . 1 . . . . 68 PHE HN . 18188 1 837 . 1 1 72 72 PHE HA H 1 5.4930 0.02 . 1 . . . . 68 PHE HA . 18188 1 838 . 1 1 72 72 PHE HB2 H 1 2.7000 0.02 . 2 . . . . 68 PHE HB1 . 18188 1 839 . 1 1 72 72 PHE HB3 H 1 3.2450 0.02 . 2 . . . . 68 PHE HB2 . 18188 1 840 . 1 1 72 72 PHE HD1 H 1 7.2760 0.02 . 3 . . . . 68 PHE HD1 . 18188 1 841 . 1 1 72 72 PHE HD2 H 1 7.2760 0.02 . 3 . . . . 68 PHE HD2 . 18188 1 842 . 1 1 72 72 PHE HE1 H 1 6.8910 0.02 . 3 . . . . 68 PHE HE1 . 18188 1 843 . 1 1 72 72 PHE HE2 H 1 6.8910 0.02 . 3 . . . . 68 PHE HE2 . 18188 1 844 . 1 1 72 72 PHE HZ H 1 7.0630 0.02 . 1 . . . . 68 PHE HZ . 18188 1 845 . 1 1 72 72 PHE C C 13 173.8940 0.3 . 1 . . . . 68 PHE C . 18188 1 846 . 1 1 72 72 PHE CA C 13 57.6000 0.3 . 1 . . . . 68 PHE CA . 18188 1 847 . 1 1 72 72 PHE CB C 13 41.9520 0.3 . 1 . . . . 68 PHE CB . 18188 1 848 . 1 1 72 72 PHE CD1 C 13 132.1550 0.3 . 3 . . . . 68 PHE CD1 . 18188 1 849 . 1 1 72 72 PHE CD2 C 13 132.1550 0.3 . 3 . . . . 68 PHE CD2 . 18188 1 850 . 1 1 72 72 PHE CE1 C 13 130.8500 0.3 . 3 . . . . 68 PHE CE1 . 18188 1 851 . 1 1 72 72 PHE CE2 C 13 130.8500 0.3 . 3 . . . . 68 PHE CE2 . 18188 1 852 . 1 1 72 72 PHE CZ C 13 132.9050 0.3 . 1 . . . . 68 PHE CZ . 18188 1 853 . 1 1 72 72 PHE N N 15 122.6810 0.2 . 1 . . . . 68 PHE N . 18188 1 854 . 1 1 73 73 ILE H H 1 8.9020 0.02 . 1 . . . . 69 ILE HN . 18188 1 855 . 1 1 73 73 ILE HA H 1 4.3530 0.02 . 1 . . . . 69 ILE HA . 18188 1 856 . 1 1 73 73 ILE HB H 1 1.6650 0.02 . 1 . . . . 69 ILE HB . 18188 1 857 . 1 1 73 73 ILE HG12 H 1 1.0750 0.02 . 2 . . . . 69 ILE HG11 . 18188 1 858 . 1 1 73 73 ILE HG13 H 1 1.3930 0.02 . 2 . . . . 69 ILE HG12 . 18188 1 859 . 1 1 73 73 ILE HG21 H 1 0.4120 0.02 . 1 . . . . 69 ILE HG21 . 18188 1 860 . 1 1 73 73 ILE HG22 H 1 0.4120 0.02 . 1 . . . . 69 ILE HG21 . 18188 1 861 . 1 1 73 73 ILE HG23 H 1 0.4120 0.02 . 1 . . . . 69 ILE HG21 . 18188 1 862 . 1 1 73 73 ILE HD11 H 1 0.8480 0.02 . 1 . . . . 69 ILE HD11 . 18188 1 863 . 1 1 73 73 ILE HD12 H 1 0.8480 0.02 . 1 . . . . 69 ILE HD11 . 18188 1 864 . 1 1 73 73 ILE HD13 H 1 0.8480 0.02 . 1 . . . . 69 ILE HD11 . 18188 1 865 . 1 1 73 73 ILE C C 13 174.6230 0.3 . 1 . . . . 69 ILE C . 18188 1 866 . 1 1 73 73 ILE CA C 13 59.9980 0.3 . 1 . . . . 69 ILE CA . 18188 1 867 . 1 1 73 73 ILE CB C 13 40.5610 0.3 . 1 . . . . 69 ILE CB . 18188 1 868 . 1 1 73 73 ILE CG1 C 13 26.8040 0.3 . 1 . . . . 69 ILE CG1 . 18188 1 869 . 1 1 73 73 ILE CG2 C 13 17.5720 0.3 . 1 . . . . 69 ILE CG2 . 18188 1 870 . 1 1 73 73 ILE CD1 C 13 13.0580 0.3 . 1 . . . . 69 ILE CD1 . 18188 1 871 . 1 1 73 73 ILE N N 15 129.0570 0.2 . 1 . . . . 69 ILE N . 18188 1 872 . 1 1 74 74 VAL H H 1 8.6570 0.02 . 1 . . . . 70 VAL HN . 18188 1 873 . 1 1 74 74 VAL HA H 1 4.8820 0.02 . 1 . . . . 70 VAL HA . 18188 1 874 . 1 1 74 74 VAL HB H 1 1.9160 0.02 . 1 . . . . 70 VAL HB . 18188 1 875 . 1 1 74 74 VAL HG11 H 1 0.8220 0.02 . 2 . . . . 70 VAL HG11 . 18188 1 876 . 1 1 74 74 VAL HG12 H 1 0.8220 0.02 . 2 . . . . 70 VAL HG11 . 18188 1 877 . 1 1 74 74 VAL HG13 H 1 0.8220 0.02 . 2 . . . . 70 VAL HG11 . 18188 1 878 . 1 1 74 74 VAL HG21 H 1 0.7530 0.02 . 2 . . . . 70 VAL HG21 . 18188 1 879 . 1 1 74 74 VAL HG22 H 1 0.7530 0.02 . 2 . . . . 70 VAL HG21 . 18188 1 880 . 1 1 74 74 VAL HG23 H 1 0.7530 0.02 . 2 . . . . 70 VAL HG21 . 18188 1 881 . 1 1 74 74 VAL C C 13 175.0620 0.3 . 1 . . . . 70 VAL C . 18188 1 882 . 1 1 74 74 VAL CA C 13 59.5880 0.3 . 1 . . . . 70 VAL CA . 18188 1 883 . 1 1 74 74 VAL CB C 13 34.6010 0.3 . 1 . . . . 70 VAL CB . 18188 1 884 . 1 1 74 74 VAL CG1 C 13 21.9440 0.3 . 2 . . . . 70 VAL CG1 . 18188 1 885 . 1 1 74 74 VAL CG2 C 13 21.9440 0.3 . 2 . . . . 70 VAL CG2 . 18188 1 886 . 1 1 74 74 VAL N N 15 126.0190 0.2 . 1 . . . . 70 VAL N . 18188 1 887 . 1 1 75 75 ASN H H 1 9.1200 0.02 . 1 . . . . 71 ASN HN . 18188 1 888 . 1 1 75 75 ASN HA H 1 5.2630 0.02 . 1 . . . . 71 ASN HA . 18188 1 889 . 1 1 75 75 ASN HB2 H 1 2.7290 0.02 . 2 . . . . 71 ASN HB1 . 18188 1 890 . 1 1 75 75 ASN HB3 H 1 3.0270 0.02 . 2 . . . . 71 ASN HB2 . 18188 1 891 . 1 1 75 75 ASN HD21 H 1 7.7860 0.02 . 2 . . . . 71 ASN HD21 . 18188 1 892 . 1 1 75 75 ASN HD22 H 1 7.0880 0.02 . 2 . . . . 71 ASN HD22 . 18188 1 893 . 1 1 75 75 ASN C C 13 176.5520 0.3 . 1 . . . . 71 ASN C . 18188 1 894 . 1 1 75 75 ASN CA C 13 52.4780 0.3 . 1 . . . . 71 ASN CA . 18188 1 895 . 1 1 75 75 ASN CB C 13 40.7950 0.3 . 1 . . . . 71 ASN CB . 18188 1 896 . 1 1 75 75 ASN N N 15 125.0240 0.2 . 1 . . . . 71 ASN N . 18188 1 897 . 1 1 75 75 ASN ND2 N 15 113.5050 0.2 . 1 . . . . 71 ASN ND2 . 18188 1 898 . 1 1 76 76 THR H H 1 9.3830 0.02 . 1 . . . . 72 THR HN . 18188 1 899 . 1 1 76 76 THR HA H 1 4.9110 0.02 . 1 . . . . 72 THR HA . 18188 1 900 . 1 1 76 76 THR HB H 1 4.7850 0.02 . 1 . . . . 72 THR HB . 18188 1 901 . 1 1 76 76 THR C C 13 175.6210 0.3 . 1 . . . . 72 THR C . 18188 1 902 . 1 1 76 76 THR CA C 13 60.6840 0.3 . 1 . . . . 72 THR CA . 18188 1 903 . 1 1 76 76 THR CB C 13 68.2190 0.3 . 1 . . . . 72 THR CB . 18188 1 904 . 1 1 76 76 THR N N 15 118.4280 0.2 . 1 . . . . 72 THR N . 18188 1 905 . 1 1 77 77 SER H H 1 8.4480 0.02 . 1 . . . . 73 SER HN . 18188 1 906 . 1 1 77 77 SER HA H 1 4.2740 0.02 . 1 . . . . 73 SER HA . 18188 1 907 . 1 1 77 77 SER HB2 H 1 4.0700 0.02 . 2 . . . . 73 SER HB1 . 18188 1 908 . 1 1 77 77 SER HB3 H 1 4.0700 0.02 . 2 . . . . 73 SER HB2 . 18188 1 909 . 1 1 77 77 SER C C 13 174.9820 0.3 . 1 . . . . 73 SER C . 18188 1 910 . 1 1 77 77 SER CA C 13 61.5860 0.3 . 1 . . . . 73 SER CA . 18188 1 911 . 1 1 77 77 SER CB C 13 63.7710 0.3 . 1 . . . . 73 SER CB . 18188 1 912 . 1 1 77 77 SER N N 15 118.9540 0.2 . 1 . . . . 73 SER N . 18188 1 913 . 1 1 78 78 THR H H 1 8.9570 0.02 . 1 . . . . 74 THR HN . 18188 1 914 . 1 1 78 78 THR HA H 1 4.6960 0.02 . 1 . . . . 74 THR HA . 18188 1 915 . 1 1 78 78 THR HB H 1 4.1300 0.02 . 1 . . . . 74 THR HB . 18188 1 916 . 1 1 78 78 THR HG21 H 1 1.1540 0.02 . 1 . . . . 74 THR HG21 . 18188 1 917 . 1 1 78 78 THR HG22 H 1 1.1540 0.02 . 1 . . . . 74 THR HG21 . 18188 1 918 . 1 1 78 78 THR HG23 H 1 1.1540 0.02 . 1 . . . . 74 THR HG21 . 18188 1 919 . 1 1 78 78 THR C C 13 171.8810 0.3 . 1 . . . . 74 THR C . 18188 1 920 . 1 1 78 78 THR CA C 13 60.3230 0.3 . 1 . . . . 74 THR CA . 18188 1 921 . 1 1 78 78 THR CB C 13 69.5240 0.3 . 1 . . . . 74 THR CB . 18188 1 922 . 1 1 78 78 THR CG2 C 13 20.1930 0.3 . 1 . . . . 74 THR CG2 . 18188 1 923 . 1 1 78 78 THR N N 15 122.1890 0.2 . 1 . . . . 74 THR N . 18188 1 924 . 1 1 79 79 PRO HA H 1 4.3410 0.02 . 1 . . . . 75 PRO HA . 18188 1 925 . 1 1 79 79 PRO HB2 H 1 1.8720 0.02 . 2 . . . . 75 PRO HB1 . 18188 1 926 . 1 1 79 79 PRO HB3 H 1 2.3900 0.02 . 2 . . . . 75 PRO HB2 . 18188 1 927 . 1 1 79 79 PRO HG2 H 1 2.1750 0.02 . 2 . . . . 75 PRO HG1 . 18188 1 928 . 1 1 79 79 PRO HG3 H 1 2.1750 0.02 . 2 . . . . 75 PRO HG2 . 18188 1 929 . 1 1 79 79 PRO HD2 H 1 3.7670 0.02 . 2 . . . . 75 PRO HD1 . 18188 1 930 . 1 1 79 79 PRO HD3 H 1 4.2440 0.02 . 2 . . . . 75 PRO HD2 . 18188 1 931 . 1 1 79 79 PRO C C 13 178.0200 0.3 . 1 . . . . 75 PRO C . 18188 1 932 . 1 1 79 79 PRO CA C 13 63.8610 0.3 . 1 . . . . 75 PRO CA . 18188 1 933 . 1 1 79 79 PRO CB C 13 31.7410 0.3 . 1 . . . . 75 PRO CB . 18188 1 934 . 1 1 79 79 PRO CG C 13 27.7060 0.3 . 1 . . . . 75 PRO CG . 18188 1 935 . 1 1 79 79 PRO CD C 13 51.2320 0.3 . 1 . . . . 75 PRO CD . 18188 1 936 . 1 1 80 80 GLY H H 1 7.3990 0.02 . 1 . . . . 76 GLY HN . 18188 1 937 . 1 1 80 80 GLY HA2 H 1 4.1350 0.02 . 2 . . . . 76 GLY HA1 . 18188 1 938 . 1 1 80 80 GLY HA3 H 1 3.9920 0.02 . 2 . . . . 76 GLY HA2 . 18188 1 939 . 1 1 80 80 GLY C C 13 173.1590 0.3 . 1 . . . . 76 GLY C . 18188 1 940 . 1 1 80 80 GLY CA C 13 45.2490 0.3 . 1 . . . . 76 GLY CA . 18188 1 941 . 1 1 80 80 GLY N N 15 110.0780 0.2 . 1 . . . . 76 GLY N . 18188 1 942 . 1 1 81 81 LYS H H 1 8.1290 0.02 . 1 . . . . 77 LYS HN . 18188 1 943 . 1 1 81 81 LYS HA H 1 5.2770 0.02 . 1 . . . . 77 LYS HA . 18188 1 944 . 1 1 81 81 LYS HB2 H 1 1.6150 0.02 . 2 . . . . 77 LYS HB1 . 18188 1 945 . 1 1 81 81 LYS HB3 H 1 1.6530 0.02 . 2 . . . . 77 LYS HB2 . 18188 1 946 . 1 1 81 81 LYS HG2 H 1 1.1900 0.02 . 2 . . . . 77 LYS HG1 . 18188 1 947 . 1 1 81 81 LYS HG3 H 1 1.2950 0.02 . 2 . . . . 77 LYS HG2 . 18188 1 948 . 1 1 81 81 LYS HD2 H 1 1.5700 0.02 . 2 . . . . 77 LYS HD1 . 18188 1 949 . 1 1 81 81 LYS HD3 H 1 1.5700 0.02 . 2 . . . . 77 LYS HD2 . 18188 1 950 . 1 1 81 81 LYS HE2 H 1 2.8070 0.02 . 2 . . . . 77 LYS HE1 . 18188 1 951 . 1 1 81 81 LYS HE3 H 1 2.8070 0.02 . 2 . . . . 77 LYS HE2 . 18188 1 952 . 1 1 81 81 LYS C C 13 176.0020 0.3 . 1 . . . . 77 LYS C . 18188 1 953 . 1 1 81 81 LYS CA C 13 55.6120 0.3 . 1 . . . . 77 LYS CA . 18188 1 954 . 1 1 81 81 LYS CB C 13 35.8640 0.3 . 1 . . . . 77 LYS CB . 18188 1 955 . 1 1 81 81 LYS CG C 13 24.7930 0.3 . 1 . . . . 77 LYS CG . 18188 1 956 . 1 1 81 81 LYS CD C 13 29.3220 0.3 . 1 . . . . 77 LYS CD . 18188 1 957 . 1 1 81 81 LYS CE C 13 41.6200 0.3 . 1 . . . . 77 LYS CE . 18188 1 958 . 1 1 81 81 LYS N N 15 121.0120 0.2 . 1 . . . . 77 LYS N . 18188 1 959 . 1 1 82 82 ILE H H 1 9.7800 0.02 . 1 . . . . 78 ILE HN . 18188 1 960 . 1 1 82 82 ILE HA H 1 4.5500 0.02 . 1 . . . . 78 ILE HA . 18188 1 961 . 1 1 82 82 ILE HB H 1 1.8990 0.02 . 1 . . . . 78 ILE HB . 18188 1 962 . 1 1 82 82 ILE HG12 H 1 0.9670 0.02 . 2 . . . . 78 ILE HG11 . 18188 1 963 . 1 1 82 82 ILE HG13 H 1 0.9670 0.02 . 2 . . . . 78 ILE HG12 . 18188 1 964 . 1 1 82 82 ILE HG21 H 1 0.7880 0.02 . 1 . . . . 78 ILE HG21 . 18188 1 965 . 1 1 82 82 ILE HG22 H 1 0.7880 0.02 . 1 . . . . 78 ILE HG21 . 18188 1 966 . 1 1 82 82 ILE HG23 H 1 0.7880 0.02 . 1 . . . . 78 ILE HG21 . 18188 1 967 . 1 1 82 82 ILE HD11 H 1 0.6730 0.02 . 1 . . . . 78 ILE HD11 . 18188 1 968 . 1 1 82 82 ILE HD12 H 1 0.6730 0.02 . 1 . . . . 78 ILE HD11 . 18188 1 969 . 1 1 82 82 ILE HD13 H 1 0.6730 0.02 . 1 . . . . 78 ILE HD11 . 18188 1 970 . 1 1 82 82 ILE C C 13 174.7740 0.3 . 1 . . . . 78 ILE C . 18188 1 971 . 1 1 82 82 ILE CA C 13 60.6700 0.3 . 1 . . . . 78 ILE CA . 18188 1 972 . 1 1 82 82 ILE CB C 13 41.7570 0.3 . 1 . . . . 78 ILE CB . 18188 1 973 . 1 1 82 82 ILE CG1 C 13 27.9030 0.3 . 1 . . . . 78 ILE CG1 . 18188 1 974 . 1 1 82 82 ILE CG2 C 13 17.7810 0.3 . 1 . . . . 78 ILE CG2 . 18188 1 975 . 1 1 82 82 ILE CD1 C 13 15.5850 0.3 . 1 . . . . 78 ILE CD1 . 18188 1 976 . 1 1 82 82 ILE N N 15 129.1830 0.2 . 1 . . . . 78 ILE N . 18188 1 977 . 1 1 83 83 SER H H 1 8.5650 0.02 . 1 . . . . 79 SER HN . 18188 1 978 . 1 1 83 83 SER HA H 1 5.7510 0.02 . 1 . . . . 79 SER HA . 18188 1 979 . 1 1 83 83 SER HB2 H 1 3.7050 0.02 . 2 . . . . 79 SER HB1 . 18188 1 980 . 1 1 83 83 SER HB3 H 1 4.0260 0.02 . 2 . . . . 79 SER HB2 . 18188 1 981 . 1 1 83 83 SER C C 13 173.8720 0.3 . 1 . . . . 79 SER C . 18188 1 982 . 1 1 83 83 SER CA C 13 57.4740 0.3 . 1 . . . . 79 SER CA . 18188 1 983 . 1 1 83 83 SER CB C 13 64.6380 0.3 . 1 . . . . 79 SER CB . 18188 1 984 . 1 1 83 83 SER N N 15 123.0990 0.2 . 1 . . . . 79 SER N . 18188 1 985 . 1 1 84 84 ILE H H 1 9.2410 0.02 . 1 . . . . 80 ILE HN . 18188 1 986 . 1 1 84 84 ILE HA H 1 4.3730 0.02 . 1 . . . . 80 ILE HA . 18188 1 987 . 1 1 84 84 ILE HB H 1 1.4640 0.02 . 1 . . . . 80 ILE HB . 18188 1 988 . 1 1 84 84 ILE HG12 H 1 0.6790 0.02 . 2 . . . . 80 ILE HG11 . 18188 1 989 . 1 1 84 84 ILE HG13 H 1 0.6790 0.02 . 2 . . . . 80 ILE HG12 . 18188 1 990 . 1 1 84 84 ILE HG21 H 1 0.4080 0.02 . 1 . . . . 80 ILE HG21 . 18188 1 991 . 1 1 84 84 ILE HG22 H 1 0.4080 0.02 . 1 . . . . 80 ILE HG21 . 18188 1 992 . 1 1 84 84 ILE HG23 H 1 0.4080 0.02 . 1 . . . . 80 ILE HG21 . 18188 1 993 . 1 1 84 84 ILE HD11 H 1 0.6760 0.02 . 1 . . . . 80 ILE HD11 . 18188 1 994 . 1 1 84 84 ILE HD12 H 1 0.6760 0.02 . 1 . . . . 80 ILE HD11 . 18188 1 995 . 1 1 84 84 ILE HD13 H 1 0.6760 0.02 . 1 . . . . 80 ILE HD11 . 18188 1 996 . 1 1 84 84 ILE C C 13 174.6560 0.3 . 1 . . . . 80 ILE C . 18188 1 997 . 1 1 84 84 ILE CA C 13 61.0750 0.3 . 1 . . . . 80 ILE CA . 18188 1 998 . 1 1 84 84 ILE CB C 13 42.0050 0.3 . 1 . . . . 80 ILE CB . 18188 1 999 . 1 1 84 84 ILE CG1 C 13 28.0530 0.3 . 1 . . . . 80 ILE CG1 . 18188 1 1000 . 1 1 84 84 ILE CG2 C 13 17.0640 0.3 . 1 . . . . 80 ILE CG2 . 18188 1 1001 . 1 1 84 84 ILE CD1 C 13 13.7470 0.3 . 1 . . . . 80 ILE CD1 . 18188 1 1002 . 1 1 84 84 ILE N N 15 126.6520 0.2 . 1 . . . . 80 ILE N . 18188 1 1003 . 1 1 85 85 THR H H 1 8.6250 0.02 . 1 . . . . 81 THR HN . 18188 1 1004 . 1 1 85 85 THR HA H 1 5.4260 0.02 . 1 . . . . 81 THR HA . 18188 1 1005 . 1 1 85 85 THR HB H 1 3.8740 0.02 . 1 . . . . 81 THR HB . 18188 1 1006 . 1 1 85 85 THR HG21 H 1 1.0710 0.02 . 1 . . . . 81 THR HG21 . 18188 1 1007 . 1 1 85 85 THR HG22 H 1 1.0710 0.02 . 1 . . . . 81 THR HG21 . 18188 1 1008 . 1 1 85 85 THR HG23 H 1 1.0710 0.02 . 1 . . . . 81 THR HG21 . 18188 1 1009 . 1 1 85 85 THR C C 13 173.6570 0.3 . 1 . . . . 81 THR C . 18188 1 1010 . 1 1 85 85 THR CA C 13 61.5000 0.3 . 1 . . . . 81 THR CA . 18188 1 1011 . 1 1 85 85 THR CB C 13 71.7550 0.3 . 1 . . . . 81 THR CB . 18188 1 1012 . 1 1 85 85 THR CG2 C 13 20.7260 0.3 . 1 . . . . 81 THR CG2 . 18188 1 1013 . 1 1 85 85 THR N N 15 123.1290 0.2 . 1 . . . . 81 THR N . 18188 1 1014 . 1 1 86 86 PHE H H 1 9.8110 0.02 . 1 . . . . 82 PHE HN . 18188 1 1015 . 1 1 86 86 PHE HA H 1 6.0050 0.02 . 1 . . . . 82 PHE HA . 18188 1 1016 . 1 1 86 86 PHE HB2 H 1 2.8060 0.02 . 2 . . . . 82 PHE HB1 . 18188 1 1017 . 1 1 86 86 PHE HB3 H 1 3.0360 0.02 . 2 . . . . 82 PHE HB2 . 18188 1 1018 . 1 1 86 86 PHE HD1 H 1 7.2720 0.02 . 3 . . . . 82 PHE HD1 . 18188 1 1019 . 1 1 86 86 PHE HD2 H 1 7.2720 0.02 . 3 . . . . 82 PHE HD2 . 18188 1 1020 . 1 1 86 86 PHE HE1 H 1 6.8910 0.02 . 3 . . . . 82 PHE HE1 . 18188 1 1021 . 1 1 86 86 PHE HE2 H 1 6.8910 0.02 . 3 . . . . 82 PHE HE2 . 18188 1 1022 . 1 1 86 86 PHE HZ H 1 6.6450 0.02 . 1 . . . . 82 PHE HZ . 18188 1 1023 . 1 1 86 86 PHE C C 13 174.3670 0.3 . 1 . . . . 82 PHE C . 18188 1 1024 . 1 1 86 86 PHE CA C 13 55.0110 0.3 . 1 . . . . 82 PHE CA . 18188 1 1025 . 1 1 86 86 PHE CB C 13 41.9670 0.3 . 1 . . . . 82 PHE CB . 18188 1 1026 . 1 1 86 86 PHE CD1 C 13 132.2600 0.3 . 3 . . . . 82 PHE CD1 . 18188 1 1027 . 1 1 86 86 PHE CD2 C 13 132.2600 0.3 . 3 . . . . 82 PHE CD2 . 18188 1 1028 . 1 1 86 86 PHE CE1 C 13 130.8940 0.3 . 3 . . . . 82 PHE CE1 . 18188 1 1029 . 1 1 86 86 PHE CE2 C 13 130.8940 0.3 . 3 . . . . 82 PHE CE2 . 18188 1 1030 . 1 1 86 86 PHE CZ C 13 128.1530 0.3 . 1 . . . . 82 PHE CZ . 18188 1 1031 . 1 1 86 86 PHE N N 15 128.0170 0.2 . 1 . . . . 82 PHE N . 18188 1 1032 . 1 1 87 87 THR H H 1 8.7970 0.02 . 1 . . . . 83 THR HN . 18188 1 1033 . 1 1 87 87 THR HA H 1 4.4350 0.02 . 1 . . . . 83 THR HA . 18188 1 1034 . 1 1 87 87 THR HB H 1 3.7420 0.02 . 1 . . . . 83 THR HB . 18188 1 1035 . 1 1 87 87 THR HG21 H 1 0.9720 0.02 . 1 . . . . 83 THR HG21 . 18188 1 1036 . 1 1 87 87 THR HG22 H 1 0.9720 0.02 . 1 . . . . 83 THR HG21 . 18188 1 1037 . 1 1 87 87 THR HG23 H 1 0.9720 0.02 . 1 . . . . 83 THR HG21 . 18188 1 1038 . 1 1 87 87 THR C C 13 171.0990 0.3 . 1 . . . . 83 THR C . 18188 1 1039 . 1 1 87 87 THR CA C 13 59.2600 0.3 . 1 . . . . 83 THR CA . 18188 1 1040 . 1 1 87 87 THR CB C 13 71.6740 0.3 . 1 . . . . 83 THR CB . 18188 1 1041 . 1 1 87 87 THR CG2 C 13 19.4430 0.3 . 1 . . . . 83 THR CG2 . 18188 1 1042 . 1 1 87 87 THR N N 15 124.0740 0.2 . 1 . . . . 83 THR N . 18188 1 1043 . 1 1 88 88 ASP H H 1 7.3990 0.02 . 1 . . . . 84 ASP HN . 18188 1 1044 . 1 1 88 88 ASP HA H 1 4.8460 0.02 . 1 . . . . 84 ASP HA . 18188 1 1045 . 1 1 88 88 ASP HB2 H 1 2.6980 0.02 . 2 . . . . 84 ASP HB1 . 18188 1 1046 . 1 1 88 88 ASP HB3 H 1 3.3780 0.02 . 2 . . . . 84 ASP HB2 . 18188 1 1047 . 1 1 88 88 ASP C C 13 176.8340 0.3 . 1 . . . . 84 ASP C . 18188 1 1048 . 1 1 88 88 ASP CA C 13 50.3590 0.3 . 1 . . . . 84 ASP CA . 18188 1 1049 . 1 1 88 88 ASP CB C 13 40.4900 0.3 . 1 . . . . 84 ASP CB . 18188 1 1050 . 1 1 88 88 ASP N N 15 122.1510 0.2 . 1 . . . . 84 ASP N . 18188 1 1051 . 1 1 89 89 PRO HA H 1 4.4260 0.02 . 1 . . . . 85 PRO HA . 18188 1 1052 . 1 1 89 89 PRO HB2 H 1 1.9350 0.02 . 2 . . . . 85 PRO HB1 . 18188 1 1053 . 1 1 89 89 PRO HB3 H 1 2.5040 0.02 . 2 . . . . 85 PRO HB2 . 18188 1 1054 . 1 1 89 89 PRO HG2 H 1 1.7770 0.02 . 2 . . . . 85 PRO HG1 . 18188 1 1055 . 1 1 89 89 PRO HG3 H 1 1.7770 0.02 . 2 . . . . 85 PRO HG2 . 18188 1 1056 . 1 1 89 89 PRO HD2 H 1 3.7670 0.02 . 2 . . . . 85 PRO HD1 . 18188 1 1057 . 1 1 89 89 PRO HD3 H 1 4.1180 0.02 . 2 . . . . 85 PRO HD2 . 18188 1 1058 . 1 1 89 89 PRO C C 13 177.9460 0.3 . 1 . . . . 85 PRO C . 18188 1 1059 . 1 1 89 89 PRO CA C 13 64.0320 0.3 . 1 . . . . 85 PRO CA . 18188 1 1060 . 1 1 89 89 PRO CB C 13 32.6860 0.3 . 1 . . . . 85 PRO CB . 18188 1 1061 . 1 1 89 89 PRO CG C 13 27.6780 0.3 . 1 . . . . 85 PRO CG . 18188 1 1062 . 1 1 89 89 PRO CD C 13 51.2770 0.3 . 1 . . . . 85 PRO CD . 18188 1 1063 . 1 1 90 90 THR H H 1 8.2740 0.02 . 1 . . . . 86 THR HN . 18188 1 1064 . 1 1 90 90 THR HA H 1 4.3820 0.02 . 1 . . . . 86 THR HA . 18188 1 1065 . 1 1 90 90 THR HB H 1 4.4460 0.02 . 1 . . . . 86 THR HB . 18188 1 1066 . 1 1 90 90 THR HG21 H 1 1.4960 0.02 . 1 . . . . 86 THR HG21 . 18188 1 1067 . 1 1 90 90 THR HG22 H 1 1.4960 0.02 . 1 . . . . 86 THR HG21 . 18188 1 1068 . 1 1 90 90 THR HG23 H 1 1.4960 0.02 . 1 . . . . 86 THR HG21 . 18188 1 1069 . 1 1 90 90 THR C C 13 174.5060 0.3 . 1 . . . . 86 THR C . 18188 1 1070 . 1 1 90 90 THR CA C 13 61.6740 0.3 . 1 . . . . 86 THR CA . 18188 1 1071 . 1 1 90 90 THR CB C 13 71.5920 0.3 . 1 . . . . 86 THR CB . 18188 1 1072 . 1 1 90 90 THR CG2 C 13 22.8850 0.3 . 1 . . . . 86 THR CG2 . 18188 1 1073 . 1 1 90 90 THR N N 15 106.7450 0.2 . 1 . . . . 86 THR N . 18188 1 1074 . 1 1 91 91 LEU H H 1 7.7850 0.02 . 1 . . . . 87 LEU HN . 18188 1 1075 . 1 1 91 91 LEU HA H 1 4.1430 0.02 . 1 . . . . 87 LEU HA . 18188 1 1076 . 1 1 91 91 LEU HB2 H 1 1.7440 0.02 . 2 . . . . 87 LEU HB1 . 18188 1 1077 . 1 1 91 91 LEU HB3 H 1 1.8780 0.02 . 2 . . . . 87 LEU HB2 . 18188 1 1078 . 1 1 91 91 LEU HG H 1 1.5390 0.02 . 1 . . . . 87 LEU HG . 18188 1 1079 . 1 1 91 91 LEU HD11 H 1 0.8970 0.02 . 2 . . . . 87 LEU HD11 . 18188 1 1080 . 1 1 91 91 LEU HD12 H 1 0.8970 0.02 . 2 . . . . 87 LEU HD11 . 18188 1 1081 . 1 1 91 91 LEU HD13 H 1 0.8970 0.02 . 2 . . . . 87 LEU HD11 . 18188 1 1082 . 1 1 91 91 LEU HD21 H 1 0.9240 0.02 . 2 . . . . 87 LEU HD21 . 18188 1 1083 . 1 1 91 91 LEU HD22 H 1 0.9240 0.02 . 2 . . . . 87 LEU HD21 . 18188 1 1084 . 1 1 91 91 LEU HD23 H 1 0.9240 0.02 . 2 . . . . 87 LEU HD21 . 18188 1 1085 . 1 1 91 91 LEU C C 13 175.7770 0.3 . 1 . . . . 87 LEU C . 18188 1 1086 . 1 1 91 91 LEU CA C 13 56.3770 0.3 . 1 . . . . 87 LEU CA . 18188 1 1087 . 1 1 91 91 LEU CB C 13 39.2780 0.3 . 1 . . . . 87 LEU CB . 18188 1 1088 . 1 1 91 91 LEU CG C 13 26.9890 0.3 . 1 . . . . 87 LEU CG . 18188 1 1089 . 1 1 91 91 LEU CD1 C 13 25.6520 0.3 . 2 . . . . 87 LEU CD1 . 18188 1 1090 . 1 1 91 91 LEU CD2 C 13 23.1570 0.3 . 2 . . . . 87 LEU CD2 . 18188 1 1091 . 1 1 91 91 LEU N N 15 117.6830 0.2 . 1 . . . . 87 LEU N . 18188 1 1092 . 1 1 92 92 ALA H H 1 7.5550 0.02 . 1 . . . . 88 ALA HN . 18188 1 1093 . 1 1 92 92 ALA HA H 1 4.0590 0.02 . 1 . . . . 88 ALA HA . 18188 1 1094 . 1 1 92 92 ALA HB1 H 1 1.2620 0.02 . 1 . . . . 88 ALA HB1 . 18188 1 1095 . 1 1 92 92 ALA HB2 H 1 1.2620 0.02 . 1 . . . . 88 ALA HB1 . 18188 1 1096 . 1 1 92 92 ALA HB3 H 1 1.2620 0.02 . 1 . . . . 88 ALA HB1 . 18188 1 1097 . 1 1 92 92 ALA C C 13 177.1480 0.3 . 1 . . . . 88 ALA C . 18188 1 1098 . 1 1 92 92 ALA CA C 13 56.0320 0.3 . 1 . . . . 88 ALA CA . 18188 1 1099 . 1 1 92 92 ALA CB C 13 21.8090 0.3 . 1 . . . . 88 ALA CB . 18188 1 1100 . 1 1 92 92 ALA N N 15 114.6620 0.2 . 1 . . . . 88 ALA N . 18188 1 1101 . 1 1 93 93 ASN H H 1 8.5730 0.02 . 1 . . . . 89 ASN HN . 18188 1 1102 . 1 1 93 93 ASN HA H 1 4.3840 0.02 . 1 . . . . 89 ASN HA . 18188 1 1103 . 1 1 93 93 ASN HB2 H 1 2.0810 0.02 . 2 . . . . 89 ASN HB1 . 18188 1 1104 . 1 1 93 93 ASN HB3 H 1 2.1920 0.02 . 2 . . . . 89 ASN HB2 . 18188 1 1105 . 1 1 93 93 ASN HD21 H 1 6.9770 0.02 . 2 . . . . 89 ASN HD21 . 18188 1 1106 . 1 1 93 93 ASN HD22 H 1 6.9030 0.02 . 2 . . . . 89 ASN HD22 . 18188 1 1107 . 1 1 93 93 ASN C C 13 175.2260 0.3 . 1 . . . . 89 ASN C . 18188 1 1108 . 1 1 93 93 ASN CA C 13 55.2810 0.3 . 1 . . . . 89 ASN CA . 18188 1 1109 . 1 1 93 93 ASN CB C 13 39.1560 0.3 . 1 . . . . 89 ASN CB . 18188 1 1110 . 1 1 93 93 ASN N N 15 115.8700 0.2 . 1 . . . . 89 ASN N . 18188 1 1111 . 1 1 93 93 ASN ND2 N 15 110.7700 0.2 . 1 . . . . 89 ASN ND2 . 18188 1 1112 . 1 1 94 94 TYR H H 1 9.1470 0.02 . 1 . . . . 90 TYR HN . 18188 1 1113 . 1 1 94 94 TYR HA H 1 5.1570 0.02 . 1 . . . . 90 TYR HA . 18188 1 1114 . 1 1 94 94 TYR HB2 H 1 2.8160 0.02 . 2 . . . . 90 TYR HB1 . 18188 1 1115 . 1 1 94 94 TYR HB3 H 1 3.2830 0.02 . 2 . . . . 90 TYR HB2 . 18188 1 1116 . 1 1 94 94 TYR HD1 H 1 7.1810 0.02 . 3 . . . . 90 TYR HD1 . 18188 1 1117 . 1 1 94 94 TYR HD2 H 1 7.1810 0.02 . 3 . . . . 90 TYR HD2 . 18188 1 1118 . 1 1 94 94 TYR HE1 H 1 6.7920 0.02 . 3 . . . . 90 TYR HE1 . 18188 1 1119 . 1 1 94 94 TYR HE2 H 1 6.7920 0.02 . 3 . . . . 90 TYR HE2 . 18188 1 1120 . 1 1 94 94 TYR CA C 13 55.2280 0.3 . 1 . . . . 90 TYR CA . 18188 1 1121 . 1 1 94 94 TYR CB C 13 38.7990 0.3 . 1 . . . . 90 TYR CB . 18188 1 1122 . 1 1 94 94 TYR CD1 C 13 134.4060 0.3 . 3 . . . . 90 TYR CD1 . 18188 1 1123 . 1 1 94 94 TYR CD2 C 13 134.4060 0.3 . 3 . . . . 90 TYR CD2 . 18188 1 1124 . 1 1 94 94 TYR CE1 C 13 117.5850 0.3 . 3 . . . . 90 TYR CE1 . 18188 1 1125 . 1 1 94 94 TYR CE2 C 13 117.5850 0.3 . 3 . . . . 90 TYR CE2 . 18188 1 1126 . 1 1 94 94 TYR N N 15 120.3910 0.2 . 1 . . . . 90 TYR N . 18188 1 1127 . 1 1 95 95 PRO HA H 1 4.9690 0.02 . 1 . . . . 91 PRO HA . 18188 1 1128 . 1 1 95 95 PRO HB2 H 1 2.0030 0.02 . 2 . . . . 91 PRO HB1 . 18188 1 1129 . 1 1 95 95 PRO HB3 H 1 2.3520 0.02 . 2 . . . . 91 PRO HB2 . 18188 1 1130 . 1 1 95 95 PRO HG2 H 1 2.0530 0.02 . 2 . . . . 91 PRO HG1 . 18188 1 1131 . 1 1 95 95 PRO HG3 H 1 2.0530 0.02 . 2 . . . . 91 PRO HG2 . 18188 1 1132 . 1 1 95 95 PRO HD2 H 1 3.6940 0.02 . 2 . . . . 91 PRO HD1 . 18188 1 1133 . 1 1 95 95 PRO HD3 H 1 3.8410 0.02 . 2 . . . . 91 PRO HD2 . 18188 1 1134 . 1 1 95 95 PRO C C 13 178.4220 0.3 . 1 . . . . 91 PRO C . 18188 1 1135 . 1 1 95 95 PRO CA C 13 63.1440 0.3 . 1 . . . . 91 PRO CA . 18188 1 1136 . 1 1 95 95 PRO CB C 13 32.1220 0.3 . 1 . . . . 91 PRO CB . 18188 1 1137 . 1 1 95 95 PRO CG C 13 27.4570 0.3 . 1 . . . . 91 PRO CG . 18188 1 1138 . 1 1 95 95 PRO CD C 13 50.5710 0.3 . 1 . . . . 91 PRO CD . 18188 1 1139 . 1 1 96 96 ILE H H 1 8.8260 0.02 . 1 . . . . 92 ILE HN . 18188 1 1140 . 1 1 96 96 ILE HA H 1 4.1620 0.02 . 1 . . . . 92 ILE HA . 18188 1 1141 . 1 1 96 96 ILE HB H 1 1.4870 0.02 . 1 . . . . 92 ILE HB . 18188 1 1142 . 1 1 96 96 ILE HG12 H 1 0.6280 0.02 . 2 . . . . 92 ILE HG11 . 18188 1 1143 . 1 1 96 96 ILE HG13 H 1 1.1450 0.02 . 2 . . . . 92 ILE HG12 . 18188 1 1144 . 1 1 96 96 ILE HG21 H 1 0.8940 0.02 . 1 . . . . 92 ILE HG21 . 18188 1 1145 . 1 1 96 96 ILE HG22 H 1 0.8940 0.02 . 1 . . . . 92 ILE HG21 . 18188 1 1146 . 1 1 96 96 ILE HG23 H 1 0.8940 0.02 . 1 . . . . 92 ILE HG21 . 18188 1 1147 . 1 1 96 96 ILE HD11 H 1 -0.0880 0.02 . 1 . . . . 92 ILE HD11 . 18188 1 1148 . 1 1 96 96 ILE HD12 H 1 -0.0880 0.02 . 1 . . . . 92 ILE HD11 . 18188 1 1149 . 1 1 96 96 ILE HD13 H 1 -0.0880 0.02 . 1 . . . . 92 ILE HD11 . 18188 1 1150 . 1 1 96 96 ILE C C 13 175.0990 0.3 . 1 . . . . 92 ILE C . 18188 1 1151 . 1 1 96 96 ILE CA C 13 62.1260 0.3 . 1 . . . . 92 ILE CA . 18188 1 1152 . 1 1 96 96 ILE CB C 13 38.6860 0.3 . 1 . . . . 92 ILE CB . 18188 1 1153 . 1 1 96 96 ILE CG1 C 13 27.7750 0.3 . 1 . . . . 92 ILE CG1 . 18188 1 1154 . 1 1 96 96 ILE CG2 C 13 17.5400 0.3 . 1 . . . . 92 ILE CG2 . 18188 1 1155 . 1 1 96 96 ILE CD1 C 13 13.3090 0.3 . 1 . . . . 92 ILE CD1 . 18188 1 1156 . 1 1 96 96 ILE N N 15 120.1090 0.2 . 1 . . . . 92 ILE N . 18188 1 1157 . 1 1 97 97 SER H H 1 9.0320 0.02 . 1 . . . . 93 SER HN . 18188 1 1158 . 1 1 97 97 SER HA H 1 4.6240 0.02 . 1 . . . . 93 SER HA . 18188 1 1159 . 1 1 97 97 SER HB2 H 1 3.6370 0.02 . 2 . . . . 93 SER HB1 . 18188 1 1160 . 1 1 97 97 SER HB3 H 1 3.9000 0.02 . 2 . . . . 93 SER HB2 . 18188 1 1161 . 1 1 97 97 SER C C 13 173.1210 0.3 . 1 . . . . 93 SER C . 18188 1 1162 . 1 1 97 97 SER CA C 13 57.9170 0.3 . 1 . . . . 93 SER CA . 18188 1 1163 . 1 1 97 97 SER CB C 13 64.9390 0.3 . 1 . . . . 93 SER CB . 18188 1 1164 . 1 1 97 97 SER N N 15 121.0440 0.2 . 1 . . . . 93 SER N . 18188 1 1165 . 1 1 98 98 VAL H H 1 7.2970 0.02 . 1 . . . . 94 VAL HN . 18188 1 1166 . 1 1 98 98 VAL HA H 1 4.5220 0.02 . 1 . . . . 94 VAL HA . 18188 1 1167 . 1 1 98 98 VAL HB H 1 2.1660 0.02 . 1 . . . . 94 VAL HB . 18188 1 1168 . 1 1 98 98 VAL HG11 H 1 0.7680 0.02 . 2 . . . . 94 VAL HG11 . 18188 1 1169 . 1 1 98 98 VAL HG12 H 1 0.7680 0.02 . 2 . . . . 94 VAL HG11 . 18188 1 1170 . 1 1 98 98 VAL HG13 H 1 0.7680 0.02 . 2 . . . . 94 VAL HG11 . 18188 1 1171 . 1 1 98 98 VAL HG21 H 1 0.8610 0.02 . 2 . . . . 94 VAL HG21 . 18188 1 1172 . 1 1 98 98 VAL HG22 H 1 0.8610 0.02 . 2 . . . . 94 VAL HG21 . 18188 1 1173 . 1 1 98 98 VAL HG23 H 1 0.8610 0.02 . 2 . . . . 94 VAL HG21 . 18188 1 1174 . 1 1 98 98 VAL C C 13 171.4290 0.3 . 1 . . . . 94 VAL C . 18188 1 1175 . 1 1 98 98 VAL CA C 13 58.8530 0.3 . 1 . . . . 94 VAL CA . 18188 1 1176 . 1 1 98 98 VAL CB C 13 35.7620 0.3 . 1 . . . . 94 VAL CB . 18188 1 1177 . 1 1 98 98 VAL CG1 C 13 18.4330 0.3 . 2 . . . . 94 VAL CG1 . 18188 1 1178 . 1 1 98 98 VAL CG2 C 13 21.4500 0.3 . 2 . . . . 94 VAL CG2 . 18188 1 1179 . 1 1 98 98 VAL N N 15 116.2100 0.2 . 1 . . . . 94 VAL N . 18188 1 1180 . 1 1 99 99 ASP H H 1 7.4410 0.02 . 1 . . . . 95 ASP HN . 18188 1 1181 . 1 1 99 99 ASP HA H 1 4.4360 0.02 . 1 . . . . 95 ASP HA . 18188 1 1182 . 1 1 99 99 ASP HB2 H 1 2.8110 0.02 . 2 . . . . 95 ASP HB1 . 18188 1 1183 . 1 1 99 99 ASP HB3 H 1 2.5790 0.02 . 2 . . . . 95 ASP HB2 . 18188 1 1184 . 1 1 99 99 ASP C C 13 177.2190 0.3 . 1 . . . . 95 ASP C . 18188 1 1185 . 1 1 99 99 ASP CA C 13 53.6160 0.3 . 1 . . . . 95 ASP CA . 18188 1 1186 . 1 1 99 99 ASP CB C 13 40.7450 0.3 . 1 . . . . 95 ASP CB . 18188 1 1187 . 1 1 99 99 ASP N N 15 116.9220 0.2 . 1 . . . . 95 ASP N . 18188 1 1188 . 1 1 100 100 GLY H H 1 8.5280 0.02 . 1 . . . . 96 GLY HN . 18188 1 1189 . 1 1 100 100 GLY HA2 H 1 3.9350 0.02 . 2 . . . . 96 GLY HA1 . 18188 1 1190 . 1 1 100 100 GLY HA3 H 1 4.1500 0.02 . 2 . . . . 96 GLY HA2 . 18188 1 1191 . 1 1 100 100 GLY C C 13 171.3760 0.3 . 1 . . . . 96 GLY C . 18188 1 1192 . 1 1 100 100 GLY CA C 13 45.7180 0.3 . 1 . . . . 96 GLY CA . 18188 1 1193 . 1 1 100 100 GLY N N 15 106.0340 0.2 . 1 . . . . 96 GLY N . 18188 1 1194 . 1 1 101 101 ILE H H 1 8.6210 0.02 . 1 . . . . 97 ILE HN . 18188 1 1195 . 1 1 101 101 ILE HA H 1 3.9060 0.02 . 1 . . . . 97 ILE HA . 18188 1 1196 . 1 1 101 101 ILE HB H 1 1.4940 0.02 . 1 . . . . 97 ILE HB . 18188 1 1197 . 1 1 101 101 ILE HG12 H 1 1.6310 0.02 . 2 . . . . 97 ILE HG11 . 18188 1 1198 . 1 1 101 101 ILE HG13 H 1 0.8590 0.02 . 2 . . . . 97 ILE HG12 . 18188 1 1199 . 1 1 101 101 ILE HG21 H 1 0.2430 0.02 . 1 . . . . 97 ILE HG21 . 18188 1 1200 . 1 1 101 101 ILE HG22 H 1 0.2430 0.02 . 1 . . . . 97 ILE HG21 . 18188 1 1201 . 1 1 101 101 ILE HG23 H 1 0.2430 0.02 . 1 . . . . 97 ILE HG21 . 18188 1 1202 . 1 1 101 101 ILE HD11 H 1 -0.0770 0.02 . 1 . . . . 97 ILE HD11 . 18188 1 1203 . 1 1 101 101 ILE HD12 H 1 -0.0770 0.02 . 1 . . . . 97 ILE HD11 . 18188 1 1204 . 1 1 101 101 ILE HD13 H 1 -0.0770 0.02 . 1 . . . . 97 ILE HD11 . 18188 1 1205 . 1 1 101 101 ILE C C 13 174.8950 0.3 . 1 . . . . 97 ILE C . 18188 1 1206 . 1 1 101 101 ILE CA C 13 62.1910 0.3 . 1 . . . . 97 ILE CA . 18188 1 1207 . 1 1 101 101 ILE CB C 13 39.1550 0.3 . 1 . . . . 97 ILE CB . 18188 1 1208 . 1 1 101 101 ILE CG1 C 13 28.8530 0.3 . 1 . . . . 97 ILE CG1 . 18188 1 1209 . 1 1 101 101 ILE CG2 C 13 17.3950 0.3 . 1 . . . . 97 ILE CG2 . 18188 1 1210 . 1 1 101 101 ILE CD1 C 13 13.6240 0.3 . 1 . . . . 97 ILE CD1 . 18188 1 1211 . 1 1 101 101 ILE N N 15 120.9280 0.2 . 1 . . . . 97 ILE N . 18188 1 1212 . 1 1 102 102 LEU H H 1 9.3360 0.02 . 1 . . . . 98 LEU HN . 18188 1 1213 . 1 1 102 102 LEU HA H 1 4.1630 0.02 . 1 . . . . 98 LEU HA . 18188 1 1214 . 1 1 102 102 LEU HB2 H 1 1.1580 0.02 . 2 . . . . 98 LEU HB1 . 18188 1 1215 . 1 1 102 102 LEU HB3 H 1 1.3730 0.02 . 2 . . . . 98 LEU HB2 . 18188 1 1216 . 1 1 102 102 LEU HG H 1 1.4500 0.02 . 1 . . . . 98 LEU HG . 18188 1 1217 . 1 1 102 102 LEU HD11 H 1 0.6330 0.02 . 2 . . . . 98 LEU HD11 . 18188 1 1218 . 1 1 102 102 LEU HD12 H 1 0.6330 0.02 . 2 . . . . 98 LEU HD11 . 18188 1 1219 . 1 1 102 102 LEU HD13 H 1 0.6330 0.02 . 2 . . . . 98 LEU HD11 . 18188 1 1220 . 1 1 102 102 LEU HD21 H 1 0.6950 0.02 . 2 . . . . 98 LEU HD21 . 18188 1 1221 . 1 1 102 102 LEU HD22 H 1 0.6950 0.02 . 2 . . . . 98 LEU HD21 . 18188 1 1222 . 1 1 102 102 LEU HD23 H 1 0.6950 0.02 . 2 . . . . 98 LEU HD21 . 18188 1 1223 . 1 1 102 102 LEU C C 13 175.9930 0.3 . 1 . . . . 98 LEU C . 18188 1 1224 . 1 1 102 102 LEU CA C 13 56.3160 0.3 . 1 . . . . 98 LEU CA . 18188 1 1225 . 1 1 102 102 LEU CB C 13 44.7800 0.3 . 1 . . . . 98 LEU CB . 18188 1 1226 . 1 1 102 102 LEU CG C 13 24.8630 0.3 . 1 . . . . 98 LEU CG . 18188 1 1227 . 1 1 102 102 LEU CD1 C 13 24.8630 0.3 . 2 . . . . 98 LEU CD1 . 18188 1 1228 . 1 1 102 102 LEU CD2 C 13 26.3520 0.3 . 2 . . . . 98 LEU CD2 . 18188 1 1229 . 1 1 102 102 LEU N N 15 128.0610 0.2 . 1 . . . . 98 LEU N . 18188 1 1230 . 1 1 103 103 ALA H H 1 7.4140 0.02 . 1 . . . . 99 ALA HN . 18188 1 1231 . 1 1 103 103 ALA HA H 1 4.7250 0.02 . 1 . . . . 99 ALA HA . 18188 1 1232 . 1 1 103 103 ALA HB1 H 1 1.0710 0.02 . 1 . . . . 99 ALA HB1 . 18188 1 1233 . 1 1 103 103 ALA HB2 H 1 1.0710 0.02 . 1 . . . . 99 ALA HB1 . 18188 1 1234 . 1 1 103 103 ALA HB3 H 1 1.0710 0.02 . 1 . . . . 99 ALA HB1 . 18188 1 1235 . 1 1 103 103 ALA C C 13 173.2850 0.3 . 1 . . . . 99 ALA C . 18188 1 1236 . 1 1 103 103 ALA CA C 13 50.0580 0.3 . 1 . . . . 99 ALA CA . 18188 1 1237 . 1 1 103 103 ALA CB C 13 22.9360 0.3 . 1 . . . . 99 ALA CB . 18188 1 1238 . 1 1 103 103 ALA N N 15 115.0280 0.2 . 1 . . . . 99 ALA N . 18188 1 1239 . 1 1 104 104 TYR H H 1 8.9500 0.02 . 1 . . . . 100 TYR HN . 18188 1 1240 . 1 1 104 104 TYR HA H 1 4.8810 0.02 . 1 . . . . 100 TYR HA . 18188 1 1241 . 1 1 104 104 TYR HB2 H 1 2.5430 0.02 . 2 . . . . 100 TYR HB1 . 18188 1 1242 . 1 1 104 104 TYR HB3 H 1 2.5430 0.02 . 2 . . . . 100 TYR HB2 . 18188 1 1243 . 1 1 104 104 TYR HD1 H 1 6.7330 0.02 . 3 . . . . 100 TYR HD1 . 18188 1 1244 . 1 1 104 104 TYR HD2 H 1 6.7330 0.02 . 3 . . . . 100 TYR HD2 . 18188 1 1245 . 1 1 104 104 TYR HE1 H 1 6.6730 0.02 . 3 . . . . 100 TYR HE1 . 18188 1 1246 . 1 1 104 104 TYR HE2 H 1 6.6730 0.02 . 3 . . . . 100 TYR HE2 . 18188 1 1247 . 1 1 104 104 TYR C C 13 174.3070 0.3 . 1 . . . . 100 TYR C . 18188 1 1248 . 1 1 104 104 TYR CA C 13 56.5720 0.3 . 1 . . . . 100 TYR CA . 18188 1 1249 . 1 1 104 104 TYR CB C 13 41.1590 0.3 . 1 . . . . 100 TYR CB . 18188 1 1250 . 1 1 104 104 TYR CD1 C 13 133.2800 0.3 . 3 . . . . 100 TYR CD1 . 18188 1 1251 . 1 1 104 104 TYR CD2 C 13 133.2800 0.3 . 3 . . . . 100 TYR CD2 . 18188 1 1252 . 1 1 104 104 TYR CE1 C 13 117.5290 0.3 . 3 . . . . 100 TYR CE1 . 18188 1 1253 . 1 1 104 104 TYR CE2 C 13 117.5290 0.3 . 3 . . . . 100 TYR CE2 . 18188 1 1254 . 1 1 104 104 TYR N N 15 115.5620 0.2 . 1 . . . . 100 TYR N . 18188 1 1255 . 1 1 105 105 LEU H H 1 9.3320 0.02 . 1 . . . . 101 LEU HN . 18188 1 1256 . 1 1 105 105 LEU HA H 1 4.4810 0.02 . 1 . . . . 101 LEU HA . 18188 1 1257 . 1 1 105 105 LEU HB2 H 1 0.8260 0.02 . 2 . . . . 101 LEU HB1 . 18188 1 1258 . 1 1 105 105 LEU HB3 H 1 0.8260 0.02 . 2 . . . . 101 LEU HB2 . 18188 1 1259 . 1 1 105 105 LEU HG H 1 1.8270 0.02 . 1 . . . . 101 LEU HG . 18188 1 1260 . 1 1 105 105 LEU HD11 H 1 0.6990 0.02 . 2 . . . . 101 LEU HD11 . 18188 1 1261 . 1 1 105 105 LEU HD12 H 1 0.6990 0.02 . 2 . . . . 101 LEU HD11 . 18188 1 1262 . 1 1 105 105 LEU HD13 H 1 0.6990 0.02 . 2 . . . . 101 LEU HD11 . 18188 1 1263 . 1 1 105 105 LEU HD21 H 1 0.8110 0.02 . 2 . . . . 101 LEU HD21 . 18188 1 1264 . 1 1 105 105 LEU HD22 H 1 0.8110 0.02 . 2 . . . . 101 LEU HD21 . 18188 1 1265 . 1 1 105 105 LEU HD23 H 1 0.8110 0.02 . 2 . . . . 101 LEU HD21 . 18188 1 1266 . 1 1 105 105 LEU C C 13 174.8180 0.3 . 1 . . . . 101 LEU C . 18188 1 1267 . 1 1 105 105 LEU CA C 13 52.7800 0.3 . 1 . . . . 101 LEU CA . 18188 1 1268 . 1 1 105 105 LEU CB C 13 41.9670 0.3 . 1 . . . . 101 LEU CB . 18188 1 1269 . 1 1 105 105 LEU CG C 13 26.7110 0.3 . 1 . . . . 101 LEU CG . 18188 1 1270 . 1 1 105 105 LEU CD1 C 13 24.4370 0.3 . 2 . . . . 101 LEU CD1 . 18188 1 1271 . 1 1 105 105 LEU CD2 C 13 25.3410 0.3 . 2 . . . . 101 LEU CD2 . 18188 1 1272 . 1 1 105 105 LEU N N 15 121.5370 0.2 . 1 . . . . 101 LEU N . 18188 1 1273 . 1 1 106 106 ASP H H 1 8.3420 0.02 . 1 . . . . 102 ASP HN . 18188 1 1274 . 1 1 106 106 ASP HA H 1 5.8870 0.02 . 1 . . . . 102 ASP HA . 18188 1 1275 . 1 1 106 106 ASP HB2 H 1 2.1680 0.02 . 2 . . . . 102 ASP HB1 . 18188 1 1276 . 1 1 106 106 ASP HB3 H 1 2.8810 0.02 . 2 . . . . 102 ASP HB2 . 18188 1 1277 . 1 1 106 106 ASP C C 13 174.6120 0.3 . 1 . . . . 102 ASP C . 18188 1 1278 . 1 1 106 106 ASP CA C 13 52.7150 0.3 . 1 . . . . 102 ASP CA . 18188 1 1279 . 1 1 106 106 ASP CB C 13 39.7100 0.3 . 1 . . . . 102 ASP CB . 18188 1 1280 . 1 1 106 106 ASP N N 15 123.0350 0.2 . 1 . . . . 102 ASP N . 18188 1 1281 . 1 1 107 107 PHE H H 1 9.1870 0.02 . 1 . . . . 103 PHE HN . 18188 1 1282 . 1 1 107 107 PHE HA H 1 5.2000 0.02 . 1 . . . . 103 PHE HA . 18188 1 1283 . 1 1 107 107 PHE HB2 H 1 2.4370 0.02 . 2 . . . . 103 PHE HB1 . 18188 1 1284 . 1 1 107 107 PHE HB3 H 1 2.5990 0.02 . 2 . . . . 103 PHE HB2 . 18188 1 1285 . 1 1 107 107 PHE HD1 H 1 6.5440 0.02 . 3 . . . . 103 PHE HD1 . 18188 1 1286 . 1 1 107 107 PHE HD2 H 1 6.5440 0.02 . 3 . . . . 103 PHE HD2 . 18188 1 1287 . 1 1 107 107 PHE HE1 H 1 6.0940 0.02 . 3 . . . . 103 PHE HE1 . 18188 1 1288 . 1 1 107 107 PHE HE2 H 1 6.0940 0.02 . 3 . . . . 103 PHE HE2 . 18188 1 1289 . 1 1 107 107 PHE HZ H 1 6.3670 0.02 . 1 . . . . 103 PHE HZ . 18188 1 1290 . 1 1 107 107 PHE C C 13 174.6070 0.3 . 1 . . . . 103 PHE C . 18188 1 1291 . 1 1 107 107 PHE CA C 13 56.4740 0.3 . 1 . . . . 103 PHE CA . 18188 1 1292 . 1 1 107 107 PHE CB C 13 43.1900 0.3 . 1 . . . . 103 PHE CB . 18188 1 1293 . 1 1 107 107 PHE CD1 C 13 131.0300 0.3 . 3 . . . . 103 PHE CD1 . 18188 1 1294 . 1 1 107 107 PHE CD2 C 13 131.0300 0.3 . 3 . . . . 103 PHE CD2 . 18188 1 1295 . 1 1 107 107 PHE CE1 C 13 130.8120 0.3 . 3 . . . . 103 PHE CE1 . 18188 1 1296 . 1 1 107 107 PHE CE2 C 13 130.8120 0.3 . 3 . . . . 103 PHE CE2 . 18188 1 1297 . 1 1 107 107 PHE CZ C 13 128.0700 0.3 . 1 . . . . 103 PHE CZ . 18188 1 1298 . 1 1 107 107 PHE N N 15 121.7340 0.2 . 1 . . . . 103 PHE N . 18188 1 1299 . 1 1 108 108 ILE H H 1 9.4740 0.02 . 1 . . . . 104 ILE HN . 18188 1 1300 . 1 1 108 108 ILE HA H 1 4.6550 0.02 . 1 . . . . 104 ILE HA . 18188 1 1301 . 1 1 108 108 ILE HB H 1 1.6830 0.02 . 1 . . . . 104 ILE HB . 18188 1 1302 . 1 1 108 108 ILE HG12 H 1 1.1440 0.02 . 2 . . . . 104 ILE HG11 . 18188 1 1303 . 1 1 108 108 ILE HG13 H 1 1.4860 0.02 . 2 . . . . 104 ILE HG12 . 18188 1 1304 . 1 1 108 108 ILE HG21 H 1 0.7920 0.02 . 1 . . . . 104 ILE HG21 . 18188 1 1305 . 1 1 108 108 ILE HG22 H 1 0.7920 0.02 . 1 . . . . 104 ILE HG21 . 18188 1 1306 . 1 1 108 108 ILE HG23 H 1 0.7920 0.02 . 1 . . . . 104 ILE HG21 . 18188 1 1307 . 1 1 108 108 ILE HD11 H 1 0.8250 0.02 . 1 . . . . 104 ILE HD11 . 18188 1 1308 . 1 1 108 108 ILE HD12 H 1 0.8250 0.02 . 1 . . . . 104 ILE HD11 . 18188 1 1309 . 1 1 108 108 ILE HD13 H 1 0.8250 0.02 . 1 . . . . 104 ILE HD11 . 18188 1 1310 . 1 1 108 108 ILE C C 13 176.9990 0.3 . 1 . . . . 104 ILE C . 18188 1 1311 . 1 1 108 108 ILE CA C 13 60.8220 0.3 . 1 . . . . 104 ILE CA . 18188 1 1312 . 1 1 108 108 ILE CB C 13 40.3260 0.3 . 1 . . . . 104 ILE CB . 18188 1 1313 . 1 1 108 108 ILE CG1 C 13 28.0340 0.3 . 1 . . . . 104 ILE CG1 . 18188 1 1314 . 1 1 108 108 ILE CG2 C 13 17.5830 0.3 . 1 . . . . 104 ILE CG2 . 18188 1 1315 . 1 1 108 108 ILE CD1 C 13 14.0150 0.3 . 1 . . . . 104 ILE CD1 . 18188 1 1316 . 1 1 108 108 ILE N N 15 120.9880 0.2 . 1 . . . . 104 ILE N . 18188 1 1317 . 1 1 109 109 ILE H H 1 9.2100 0.02 . 1 . . . . 105 ILE HN . 18188 1 1318 . 1 1 109 109 ILE HA H 1 4.4870 0.02 . 1 . . . . 105 ILE HA . 18188 1 1319 . 1 1 109 109 ILE HB H 1 2.2030 0.02 . 1 . . . . 105 ILE HB . 18188 1 1320 . 1 1 109 109 ILE HG12 H 1 1.9430 0.02 . 2 . . . . 105 ILE HG11 . 18188 1 1321 . 1 1 109 109 ILE HG13 H 1 1.9430 0.02 . 2 . . . . 105 ILE HG12 . 18188 1 1322 . 1 1 109 109 ILE HG21 H 1 1.0780 0.02 . 1 . . . . 105 ILE HG21 . 18188 1 1323 . 1 1 109 109 ILE HG22 H 1 1.0780 0.02 . 1 . . . . 105 ILE HG21 . 18188 1 1324 . 1 1 109 109 ILE HG23 H 1 1.0780 0.02 . 1 . . . . 105 ILE HG21 . 18188 1 1325 . 1 1 109 109 ILE HD11 H 1 0.7380 0.02 . 1 . . . . 105 ILE HD11 . 18188 1 1326 . 1 1 109 109 ILE HD12 H 1 0.7380 0.02 . 1 . . . . 105 ILE HD11 . 18188 1 1327 . 1 1 109 109 ILE HD13 H 1 0.7380 0.02 . 1 . . . . 105 ILE HD11 . 18188 1 1328 . 1 1 109 109 ILE C C 13 176.4620 0.3 . 1 . . . . 105 ILE C . 18188 1 1329 . 1 1 109 109 ILE CA C 13 62.1970 0.3 . 1 . . . . 105 ILE CA . 18188 1 1330 . 1 1 109 109 ILE CB C 13 36.6260 0.3 . 1 . . . . 105 ILE CB . 18188 1 1331 . 1 1 109 109 ILE CG1 C 13 26.8840 0.3 . 1 . . . . 105 ILE CG1 . 18188 1 1332 . 1 1 109 109 ILE CG2 C 13 18.1460 0.3 . 1 . . . . 105 ILE CG2 . 18188 1 1333 . 1 1 109 109 ILE CD1 C 13 13.1560 0.3 . 1 . . . . 105 ILE CD1 . 18188 1 1334 . 1 1 109 109 ILE N N 15 128.7760 0.2 . 1 . . . . 105 ILE N . 18188 1 1335 . 1 1 110 110 ASN H H 1 9.1240 0.02 . 1 . . . . 106 ASN HN . 18188 1 1336 . 1 1 110 110 ASN HA H 1 4.4100 0.02 . 1 . . . . 106 ASN HA . 18188 1 1337 . 1 1 110 110 ASN HB2 H 1 2.6660 0.02 . 2 . . . . 106 ASN HB1 . 18188 1 1338 . 1 1 110 110 ASN HB3 H 1 2.8580 0.02 . 2 . . . . 106 ASN HB2 . 18188 1 1339 . 1 1 110 110 ASN HD21 H 1 6.9490 0.02 . 2 . . . . 106 ASN HD21 . 18188 1 1340 . 1 1 110 110 ASN HD22 H 1 6.6760 0.02 . 2 . . . . 106 ASN HD22 . 18188 1 1341 . 1 1 110 110 ASN C C 13 177.4310 0.3 . 1 . . . . 106 ASN C . 18188 1 1342 . 1 1 110 110 ASN CA C 13 54.3660 0.3 . 1 . . . . 106 ASN CA . 18188 1 1343 . 1 1 110 110 ASN CB C 13 38.0750 0.3 . 1 . . . . 106 ASN CB . 18188 1 1344 . 1 1 110 110 ASN N N 15 130.5640 0.2 . 1 . . . . 106 ASN N . 18188 1 1345 . 1 1 110 110 ASN ND2 N 15 110.6520 0.2 . 1 . . . . 106 ASN ND2 . 18188 1 1346 . 1 1 111 111 SER H H 1 8.8680 0.02 . 1 . . . . 107 SER HN . 18188 1 1347 . 1 1 111 111 SER HA H 1 3.8860 0.02 . 1 . . . . 107 SER HA . 18188 1 1348 . 1 1 111 111 SER HB2 H 1 3.6320 0.02 . 2 . . . . 107 SER HB1 . 18188 1 1349 . 1 1 111 111 SER HB3 H 1 3.6320 0.02 . 2 . . . . 107 SER HB2 . 18188 1 1350 . 1 1 111 111 SER C C 13 173.9740 0.3 . 1 . . . . 107 SER C . 18188 1 1351 . 1 1 111 111 SER CA C 13 62.4690 0.3 . 1 . . . . 107 SER CA . 18188 1 1352 . 1 1 111 111 SER CB C 13 62.6800 0.3 . 1 . . . . 107 SER CB . 18188 1 1353 . 1 1 111 111 SER N N 15 118.8010 0.2 . 1 . . . . 107 SER N . 18188 1 1354 . 1 1 112 112 ASN H H 1 8.3390 0.02 . 1 . . . . 108 ASN HN . 18188 1 1355 . 1 1 112 112 ASN HA H 1 4.7760 0.02 . 1 . . . . 108 ASN HA . 18188 1 1356 . 1 1 112 112 ASN HB2 H 1 2.7420 0.02 . 2 . . . . 108 ASN HB1 . 18188 1 1357 . 1 1 112 112 ASN HB3 H 1 2.9280 0.02 . 2 . . . . 108 ASN HB2 . 18188 1 1358 . 1 1 112 112 ASN HD21 H 1 7.5430 0.02 . 2 . . . . 108 ASN HD21 . 18188 1 1359 . 1 1 112 112 ASN HD22 H 1 6.9110 0.02 . 2 . . . . 108 ASN HD22 . 18188 1 1360 . 1 1 112 112 ASN C C 13 175.3890 0.3 . 1 . . . . 108 ASN C . 18188 1 1361 . 1 1 112 112 ASN CA C 13 51.8600 0.3 . 1 . . . . 108 ASN CA . 18188 1 1362 . 1 1 112 112 ASN CB C 13 38.1560 0.3 . 1 . . . . 108 ASN CB . 18188 1 1363 . 1 1 112 112 ASN N N 15 116.6790 0.2 . 1 . . . . 108 ASN N . 18188 1 1364 . 1 1 112 112 ASN ND2 N 15 112.2240 0.2 . 1 . . . . 108 ASN ND2 . 18188 1 1365 . 1 1 113 113 ALA H H 1 7.5180 0.02 . 1 . . . . 109 ALA HN . 18188 1 1366 . 1 1 113 113 ALA HA H 1 4.1880 0.02 . 1 . . . . 109 ALA HA . 18188 1 1367 . 1 1 113 113 ALA HB1 H 1 1.3150 0.02 . 1 . . . . 109 ALA HB1 . 18188 1 1368 . 1 1 113 113 ALA HB2 H 1 1.3150 0.02 . 1 . . . . 109 ALA HB1 . 18188 1 1369 . 1 1 113 113 ALA HB3 H 1 1.3150 0.02 . 1 . . . . 109 ALA HB1 . 18188 1 1370 . 1 1 113 113 ALA C C 13 177.0320 0.3 . 1 . . . . 109 ALA C . 18188 1 1371 . 1 1 113 113 ALA CA C 13 53.3300 0.3 . 1 . . . . 109 ALA CA . 18188 1 1372 . 1 1 113 113 ALA CB C 13 19.6770 0.3 . 1 . . . . 109 ALA CB . 18188 1 1373 . 1 1 113 113 ALA N N 15 123.0940 0.2 . 1 . . . . 109 ALA N . 18188 1 1374 . 1 1 114 114 THR H H 1 7.6840 0.02 . 1 . . . . 110 THR HN . 18188 1 1375 . 1 1 114 114 THR HA H 1 4.1960 0.02 . 1 . . . . 110 THR HA . 18188 1 1376 . 1 1 114 114 THR HB H 1 4.2270 0.02 . 1 . . . . 110 THR HB . 18188 1 1377 . 1 1 114 114 THR HG21 H 1 1.2970 0.02 . 1 . . . . 110 THR HG21 . 18188 1 1378 . 1 1 114 114 THR HG22 H 1 1.2970 0.02 . 1 . . . . 110 THR HG21 . 18188 1 1379 . 1 1 114 114 THR HG23 H 1 1.2970 0.02 . 1 . . . . 110 THR HG21 . 18188 1 1380 . 1 1 114 114 THR C C 13 174.0170 0.3 . 1 . . . . 110 THR C . 18188 1 1381 . 1 1 114 114 THR CA C 13 60.8460 0.3 . 1 . . . . 110 THR CA . 18188 1 1382 . 1 1 114 114 THR CB C 13 69.9880 0.3 . 1 . . . . 110 THR CB . 18188 1 1383 . 1 1 114 114 THR CG2 C 13 21.7460 0.3 . 1 . . . . 110 THR CG2 . 18188 1 1384 . 1 1 114 114 THR N N 15 113.8830 0.2 . 1 . . . . 110 THR N . 18188 1 1385 . 1 1 115 115 ALA H H 1 8.1860 0.02 . 1 . . . . 111 ALA HN . 18188 1 1386 . 1 1 115 115 ALA HA H 1 3.9560 0.02 . 1 . . . . 111 ALA HA . 18188 1 1387 . 1 1 115 115 ALA HB1 H 1 1.3040 0.02 . 1 . . . . 111 ALA HB1 . 18188 1 1388 . 1 1 115 115 ALA HB2 H 1 1.3040 0.02 . 1 . . . . 111 ALA HB1 . 18188 1 1389 . 1 1 115 115 ALA HB3 H 1 1.3040 0.02 . 1 . . . . 111 ALA HB1 . 18188 1 1390 . 1 1 115 115 ALA C C 13 178.2410 0.3 . 1 . . . . 111 ALA C . 18188 1 1391 . 1 1 115 115 ALA CA C 13 52.6810 0.3 . 1 . . . . 111 ALA CA . 18188 1 1392 . 1 1 115 115 ALA CB C 13 19.6060 0.3 . 1 . . . . 111 ALA CB . 18188 1 1393 . 1 1 115 115 ALA N N 15 123.5300 0.2 . 1 . . . . 111 ALA N . 18188 1 1394 . 1 1 116 116 GLY H H 1 8.8820 0.02 . 1 . . . . 112 GLY HN . 18188 1 1395 . 1 1 116 116 GLY HA2 H 1 3.8610 0.02 . 2 . . . . 112 GLY HA1 . 18188 1 1396 . 1 1 116 116 GLY HA3 H 1 4.7260 0.02 . 2 . . . . 112 GLY HA2 . 18188 1 1397 . 1 1 116 116 GLY C C 13 174.9680 0.3 . 1 . . . . 112 GLY C . 18188 1 1398 . 1 1 116 116 GLY CA C 13 43.9910 0.3 . 1 . . . . 112 GLY CA . 18188 1 1399 . 1 1 116 116 GLY N N 15 108.4850 0.2 . 1 . . . . 112 GLY N . 18188 1 1400 . 1 1 117 117 ASP H H 1 8.9730 0.02 . 1 . . . . 113 ASP HN . 18188 1 1401 . 1 1 117 117 ASP HA H 1 4.9730 0.02 . 1 . . . . 113 ASP HA . 18188 1 1402 . 1 1 117 117 ASP HB2 H 1 2.3900 0.02 . 2 . . . . 113 ASP HB1 . 18188 1 1403 . 1 1 117 117 ASP HB3 H 1 2.6890 0.02 . 2 . . . . 113 ASP HB2 . 18188 1 1404 . 1 1 117 117 ASP C C 13 176.8450 0.3 . 1 . . . . 113 ASP C . 18188 1 1405 . 1 1 117 117 ASP CA C 13 55.0570 0.3 . 1 . . . . 113 ASP CA . 18188 1 1406 . 1 1 117 117 ASP CB C 13 42.2790 0.3 . 1 . . . . 113 ASP CB . 18188 1 1407 . 1 1 117 117 ASP N N 15 122.8840 0.2 . 1 . . . . 113 ASP N . 18188 1 1408 . 1 1 118 118 SER H H 1 8.7830 0.02 . 1 . . . . 114 SER HN . 18188 1 1409 . 1 1 118 118 SER HA H 1 4.6860 0.02 . 1 . . . . 114 SER HA . 18188 1 1410 . 1 1 118 118 SER HB2 H 1 3.6880 0.02 . 2 . . . . 114 SER HB1 . 18188 1 1411 . 1 1 118 118 SER HB3 H 1 4.2110 0.02 . 2 . . . . 114 SER HB2 . 18188 1 1412 . 1 1 118 118 SER C C 13 173.6630 0.3 . 1 . . . . 114 SER C . 18188 1 1413 . 1 1 118 118 SER CA C 13 57.8740 0.3 . 1 . . . . 114 SER CA . 18188 1 1414 . 1 1 118 118 SER CB C 13 64.2930 0.3 . 1 . . . . 114 SER CB . 18188 1 1415 . 1 1 118 118 SER N N 15 117.1600 0.2 . 1 . . . . 114 SER N . 18188 1 1416 . 1 1 119 119 ALA H H 1 8.6960 0.02 . 1 . . . . 115 ALA HN . 18188 1 1417 . 1 1 119 119 ALA HA H 1 4.3960 0.02 . 1 . . . . 115 ALA HA . 18188 1 1418 . 1 1 119 119 ALA HB1 H 1 1.3780 0.02 . 1 . . . . 115 ALA HB1 . 18188 1 1419 . 1 1 119 119 ALA HB2 H 1 1.3780 0.02 . 1 . . . . 115 ALA HB1 . 18188 1 1420 . 1 1 119 119 ALA HB3 H 1 1.3780 0.02 . 1 . . . . 115 ALA HB1 . 18188 1 1421 . 1 1 119 119 ALA C C 13 177.5350 0.3 . 1 . . . . 115 ALA C . 18188 1 1422 . 1 1 119 119 ALA CA C 13 53.0890 0.3 . 1 . . . . 115 ALA CA . 18188 1 1423 . 1 1 119 119 ALA CB C 13 19.9970 0.3 . 1 . . . . 115 ALA CB . 18188 1 1424 . 1 1 119 119 ALA N N 15 129.2130 0.2 . 1 . . . . 115 ALA N . 18188 1 1425 . 1 1 120 120 LEU H H 1 7.9340 0.02 . 1 . . . . 116 LEU HN . 18188 1 1426 . 1 1 120 120 LEU HA H 1 5.2630 0.02 . 1 . . . . 116 LEU HA . 18188 1 1427 . 1 1 120 120 LEU HB2 H 1 0.9690 0.02 . 2 . . . . 116 LEU HB1 . 18188 1 1428 . 1 1 120 120 LEU HB3 H 1 1.4190 0.02 . 2 . . . . 116 LEU HB2 . 18188 1 1429 . 1 1 120 120 LEU HG H 1 1.3510 0.02 . 1 . . . . 116 LEU HG . 18188 1 1430 . 1 1 120 120 LEU HD11 H 1 0.6550 0.02 . 2 . . . . 116 LEU HD11 . 18188 1 1431 . 1 1 120 120 LEU HD12 H 1 0.6550 0.02 . 2 . . . . 116 LEU HD11 . 18188 1 1432 . 1 1 120 120 LEU HD13 H 1 0.6550 0.02 . 2 . . . . 116 LEU HD11 . 18188 1 1433 . 1 1 120 120 LEU HD21 H 1 0.5400 0.02 . 2 . . . . 116 LEU HD21 . 18188 1 1434 . 1 1 120 120 LEU HD22 H 1 0.5400 0.02 . 2 . . . . 116 LEU HD21 . 18188 1 1435 . 1 1 120 120 LEU HD23 H 1 0.5400 0.02 . 2 . . . . 116 LEU HD21 . 18188 1 1436 . 1 1 120 120 LEU C C 13 176.1670 0.3 . 1 . . . . 116 LEU C . 18188 1 1437 . 1 1 120 120 LEU CA C 13 53.4030 0.3 . 1 . . . . 116 LEU CA . 18188 1 1438 . 1 1 120 120 LEU CB C 13 44.2090 0.3 . 1 . . . . 116 LEU CB . 18188 1 1439 . 1 1 120 120 LEU CG C 13 27.0010 0.3 . 1 . . . . 116 LEU CG . 18188 1 1440 . 1 1 120 120 LEU CD1 C 13 27.0010 0.3 . 2 . . . . 116 LEU CD1 . 18188 1 1441 . 1 1 120 120 LEU CD2 C 13 24.6630 0.3 . 2 . . . . 116 LEU CD2 . 18188 1 1442 . 1 1 120 120 LEU N N 15 124.9120 0.2 . 1 . . . . 116 LEU N . 18188 1 1443 . 1 1 121 121 THR H H 1 7.9790 0.02 . 1 . . . . 117 THR HN . 18188 1 1444 . 1 1 121 121 THR HA H 1 4.4400 0.02 . 1 . . . . 117 THR HA . 18188 1 1445 . 1 1 121 121 THR HB H 1 4.0540 0.02 . 1 . . . . 117 THR HB . 18188 1 1446 . 1 1 121 121 THR HG21 H 1 0.8500 0.02 . 1 . . . . 117 THR HG21 . 18188 1 1447 . 1 1 121 121 THR HG22 H 1 0.8500 0.02 . 1 . . . . 117 THR HG21 . 18188 1 1448 . 1 1 121 121 THR HG23 H 1 0.8500 0.02 . 1 . . . . 117 THR HG21 . 18188 1 1449 . 1 1 121 121 THR C C 13 174.0050 0.3 . 1 . . . . 117 THR C . 18188 1 1450 . 1 1 121 121 THR CA C 13 61.2410 0.3 . 1 . . . . 117 THR CA . 18188 1 1451 . 1 1 121 121 THR CB C 13 70.1710 0.3 . 1 . . . . 117 THR CB . 18188 1 1452 . 1 1 121 121 THR CG2 C 13 22.7270 0.3 . 1 . . . . 117 THR CG2 . 18188 1 1453 . 1 1 121 121 THR N N 15 115.7700 0.2 . 1 . . . . 117 THR N . 18188 1 1454 . 1 1 122 122 VAL H H 1 8.4460 0.02 . 1 . . . . 118 VAL HN . 18188 1 1455 . 1 1 122 122 VAL HA H 1 4.7570 0.02 . 1 . . . . 118 VAL HA . 18188 1 1456 . 1 1 122 122 VAL HB H 1 1.9210 0.02 . 1 . . . . 118 VAL HB . 18188 1 1457 . 1 1 122 122 VAL HG11 H 1 0.8110 0.02 . 2 . . . . 118 VAL HG11 . 18188 1 1458 . 1 1 122 122 VAL HG12 H 1 0.8110 0.02 . 2 . . . . 118 VAL HG11 . 18188 1 1459 . 1 1 122 122 VAL HG13 H 1 0.8110 0.02 . 2 . . . . 118 VAL HG11 . 18188 1 1460 . 1 1 122 122 VAL HG21 H 1 0.8110 0.02 . 2 . . . . 118 VAL HG21 . 18188 1 1461 . 1 1 122 122 VAL HG22 H 1 0.8110 0.02 . 2 . . . . 118 VAL HG21 . 18188 1 1462 . 1 1 122 122 VAL HG23 H 1 0.8110 0.02 . 2 . . . . 118 VAL HG21 . 18188 1 1463 . 1 1 122 122 VAL C C 13 175.8130 0.3 . 1 . . . . 118 VAL C . 18188 1 1464 . 1 1 122 122 VAL CA C 13 60.6180 0.3 . 1 . . . . 118 VAL CA . 18188 1 1465 . 1 1 122 122 VAL CB C 13 32.6070 0.3 . 1 . . . . 118 VAL CB . 18188 1 1466 . 1 1 122 122 VAL CG1 C 13 21.8990 0.3 . 2 . . . . 118 VAL CG1 . 18188 1 1467 . 1 1 122 122 VAL CG2 C 13 21.8990 0.3 . 2 . . . . 118 VAL CG2 . 18188 1 1468 . 1 1 122 122 VAL N N 15 126.6370 0.2 . 1 . . . . 118 VAL N . 18188 1 1469 . 1 1 123 123 ASP H H 1 8.0340 0.02 . 1 . . . . 119 ASP HN . 18188 1 1470 . 1 1 123 123 ASP HA H 1 4.7930 0.02 . 1 . . . . 119 ASP HA . 18188 1 1471 . 1 1 123 123 ASP HB2 H 1 2.7640 0.02 . 2 . . . . 119 ASP HB1 . 18188 1 1472 . 1 1 123 123 ASP HB3 H 1 2.7640 0.02 . 2 . . . . 119 ASP HB2 . 18188 1 1473 . 1 1 123 123 ASP C C 13 176.0140 0.3 . 1 . . . . 119 ASP C . 18188 1 1474 . 1 1 123 123 ASP CA C 13 52.2490 0.3 . 1 . . . . 119 ASP CA . 18188 1 1475 . 1 1 123 123 ASP CB C 13 41.5220 0.3 . 1 . . . . 119 ASP CB . 18188 1 1476 . 1 1 123 123 ASP N N 15 128.7590 0.2 . 1 . . . . 119 ASP N . 18188 1 1477 . 1 1 124 124 PRO HA H 1 4.3140 0.02 . 1 . . . . 120 PRO HA . 18188 1 1478 . 1 1 124 124 PRO HB2 H 1 2.0820 0.02 . 2 . . . . 120 PRO HB1 . 18188 1 1479 . 1 1 124 124 PRO HB3 H 1 2.4130 0.02 . 2 . . . . 120 PRO HB2 . 18188 1 1480 . 1 1 124 124 PRO HG2 H 1 2.1560 0.02 . 2 . . . . 120 PRO HG1 . 18188 1 1481 . 1 1 124 124 PRO HG3 H 1 2.1560 0.02 . 2 . . . . 120 PRO HG2 . 18188 1 1482 . 1 1 124 124 PRO HD2 H 1 4.4360 0.02 . 2 . . . . 120 PRO HD1 . 18188 1 1483 . 1 1 124 124 PRO HD3 H 1 4.0510 0.02 . 2 . . . . 120 PRO HD2 . 18188 1 1484 . 1 1 124 124 PRO C C 13 178.5970 0.3 . 1 . . . . 120 PRO C . 18188 1 1485 . 1 1 124 124 PRO CA C 13 64.2190 0.3 . 1 . . . . 120 PRO CA . 18188 1 1486 . 1 1 124 124 PRO CB C 13 32.0460 0.3 . 1 . . . . 120 PRO CB . 18188 1 1487 . 1 1 124 124 PRO CG C 13 27.4260 0.3 . 1 . . . . 120 PRO CG . 18188 1 1488 . 1 1 124 124 PRO CD C 13 51.0350 0.3 . 1 . . . . 120 PRO CD . 18188 1 1489 . 1 1 125 125 ALA H H 1 8.5440 0.02 . 1 . . . . 121 ALA HN . 18188 1 1490 . 1 1 125 125 ALA HA H 1 4.2960 0.02 . 1 . . . . 121 ALA HA . 18188 1 1491 . 1 1 125 125 ALA HB1 H 1 1.5200 0.02 . 1 . . . . 121 ALA HB1 . 18188 1 1492 . 1 1 125 125 ALA HB2 H 1 1.5200 0.02 . 1 . . . . 121 ALA HB1 . 18188 1 1493 . 1 1 125 125 ALA HB3 H 1 1.5200 0.02 . 1 . . . . 121 ALA HB1 . 18188 1 1494 . 1 1 125 125 ALA C C 13 179.3290 0.3 . 1 . . . . 121 ALA C . 18188 1 1495 . 1 1 125 125 ALA CA C 13 54.1410 0.3 . 1 . . . . 121 ALA CA . 18188 1 1496 . 1 1 125 125 ALA CB C 13 19.2600 0.3 . 1 . . . . 121 ALA CB . 18188 1 1497 . 1 1 125 125 ALA N N 15 119.2000 0.2 . 1 . . . . 121 ALA N . 18188 1 1498 . 1 1 126 126 THR H H 1 6.8180 0.02 . 1 . . . . 122 THR HN . 18188 1 1499 . 1 1 126 126 THR HA H 1 4.4110 0.02 . 1 . . . . 122 THR HA . 18188 1 1500 . 1 1 126 126 THR HB H 1 4.4930 0.02 . 1 . . . . 122 THR HB . 18188 1 1501 . 1 1 126 126 THR HG21 H 1 1.0180 0.02 . 1 . . . . 122 THR HG21 . 18188 1 1502 . 1 1 126 126 THR HG22 H 1 1.0180 0.02 . 1 . . . . 122 THR HG21 . 18188 1 1503 . 1 1 126 126 THR HG23 H 1 1.0180 0.02 . 1 . . . . 122 THR HG21 . 18188 1 1504 . 1 1 126 126 THR C C 13 173.3050 0.3 . 1 . . . . 122 THR C . 18188 1 1505 . 1 1 126 126 THR CA C 13 60.2510 0.3 . 1 . . . . 122 THR CA . 18188 1 1506 . 1 1 126 126 THR CB C 13 68.6900 0.3 . 1 . . . . 122 THR CB . 18188 1 1507 . 1 1 126 126 THR CG2 C 13 21.3530 0.3 . 1 . . . . 122 THR CG2 . 18188 1 1508 . 1 1 126 126 THR N N 15 104.0570 0.2 . 1 . . . . 122 THR N . 18188 1 1509 . 1 1 127 127 LEU H H 1 6.4210 0.02 . 1 . . . . 123 LEU HN . 18188 1 1510 . 1 1 127 127 LEU HA H 1 4.7580 0.02 . 1 . . . . 123 LEU HA . 18188 1 1511 . 1 1 127 127 LEU HB2 H 1 1.7760 0.02 . 2 . . . . 123 LEU HB1 . 18188 1 1512 . 1 1 127 127 LEU HB3 H 1 1.4870 0.02 . 2 . . . . 123 LEU HB2 . 18188 1 1513 . 1 1 127 127 LEU HG H 1 1.3930 0.02 . 1 . . . . 123 LEU HG . 18188 1 1514 . 1 1 127 127 LEU HD11 H 1 0.7640 0.02 . 2 . . . . 123 LEU HD11 . 18188 1 1515 . 1 1 127 127 LEU HD12 H 1 0.7640 0.02 . 2 . . . . 123 LEU HD11 . 18188 1 1516 . 1 1 127 127 LEU HD13 H 1 0.7640 0.02 . 2 . . . . 123 LEU HD11 . 18188 1 1517 . 1 1 127 127 LEU HD21 H 1 0.9170 0.02 . 2 . . . . 123 LEU HD21 . 18188 1 1518 . 1 1 127 127 LEU HD22 H 1 0.9170 0.02 . 2 . . . . 123 LEU HD21 . 18188 1 1519 . 1 1 127 127 LEU HD23 H 1 0.9170 0.02 . 2 . . . . 123 LEU HD21 . 18188 1 1520 . 1 1 127 127 LEU C C 13 177.0160 0.3 . 1 . . . . 123 LEU C . 18188 1 1521 . 1 1 127 127 LEU CA C 13 55.1190 0.3 . 1 . . . . 123 LEU CA . 18188 1 1522 . 1 1 127 127 LEU CB C 13 42.4360 0.3 . 1 . . . . 123 LEU CB . 18188 1 1523 . 1 1 127 127 LEU CG C 13 26.7960 0.3 . 1 . . . . 123 LEU CG . 18188 1 1524 . 1 1 127 127 LEU CD1 C 13 26.7960 0.3 . 2 . . . . 123 LEU CD1 . 18188 1 1525 . 1 1 127 127 LEU CD2 C 13 23.4850 0.3 . 2 . . . . 123 LEU CD2 . 18188 1 1526 . 1 1 127 127 LEU N N 15 124.4840 0.2 . 1 . . . . 123 LEU N . 18188 1 1527 . 1 1 128 128 ILE H H 1 9.2360 0.02 . 1 . . . . 124 ILE HN . 18188 1 1528 . 1 1 128 128 ILE HA H 1 4.4220 0.02 . 1 . . . . 124 ILE HA . 18188 1 1529 . 1 1 128 128 ILE HB H 1 1.5750 0.02 . 1 . . . . 124 ILE HB . 18188 1 1530 . 1 1 128 128 ILE HG12 H 1 1.0770 0.02 . 2 . . . . 124 ILE HG11 . 18188 1 1531 . 1 1 128 128 ILE HG13 H 1 1.5140 0.02 . 2 . . . . 124 ILE HG12 . 18188 1 1532 . 1 1 128 128 ILE HG21 H 1 0.8190 0.02 . 1 . . . . 124 ILE HG21 . 18188 1 1533 . 1 1 128 128 ILE HG22 H 1 0.8190 0.02 . 1 . . . . 124 ILE HG21 . 18188 1 1534 . 1 1 128 128 ILE HG23 H 1 0.8190 0.02 . 1 . . . . 124 ILE HG21 . 18188 1 1535 . 1 1 128 128 ILE HD11 H 1 0.8160 0.02 . 1 . . . . 124 ILE HD11 . 18188 1 1536 . 1 1 128 128 ILE HD12 H 1 0.8160 0.02 . 1 . . . . 124 ILE HD11 . 18188 1 1537 . 1 1 128 128 ILE HD13 H 1 0.8160 0.02 . 1 . . . . 124 ILE HD11 . 18188 1 1538 . 1 1 128 128 ILE C C 13 174.0550 0.3 . 1 . . . . 124 ILE C . 18188 1 1539 . 1 1 128 128 ILE CA C 13 60.5520 0.3 . 1 . . . . 124 ILE CA . 18188 1 1540 . 1 1 128 128 ILE CB C 13 41.9670 0.3 . 1 . . . . 124 ILE CB . 18188 1 1541 . 1 1 128 128 ILE CG1 C 13 26.6060 0.3 . 1 . . . . 124 ILE CG1 . 18188 1 1542 . 1 1 128 128 ILE CG2 C 13 17.2010 0.3 . 1 . . . . 124 ILE CG2 . 18188 1 1543 . 1 1 128 128 ILE CD1 C 13 12.8350 0.3 . 1 . . . . 124 ILE CD1 . 18188 1 1544 . 1 1 128 128 ILE N N 15 132.6310 0.2 . 1 . . . . 124 ILE N . 18188 1 1545 . 1 1 129 129 VAL H H 1 8.1340 0.02 . 1 . . . . 125 VAL HN . 18188 1 1546 . 1 1 129 129 VAL HA H 1 4.8640 0.02 . 1 . . . . 125 VAL HA . 18188 1 1547 . 1 1 129 129 VAL HB H 1 2.0700 0.02 . 1 . . . . 125 VAL HB . 18188 1 1548 . 1 1 129 129 VAL HG11 H 1 1.0130 0.02 . 2 . . . . 125 VAL HG11 . 18188 1 1549 . 1 1 129 129 VAL HG12 H 1 1.0130 0.02 . 2 . . . . 125 VAL HG11 . 18188 1 1550 . 1 1 129 129 VAL HG13 H 1 1.0130 0.02 . 2 . . . . 125 VAL HG11 . 18188 1 1551 . 1 1 129 129 VAL HG21 H 1 1.0220 0.02 . 2 . . . . 125 VAL HG21 . 18188 1 1552 . 1 1 129 129 VAL HG22 H 1 1.0220 0.02 . 2 . . . . 125 VAL HG21 . 18188 1 1553 . 1 1 129 129 VAL HG23 H 1 1.0220 0.02 . 2 . . . . 125 VAL HG21 . 18188 1 1554 . 1 1 129 129 VAL C C 13 174.2110 0.3 . 1 . . . . 125 VAL C . 18188 1 1555 . 1 1 129 129 VAL CA C 13 61.8710 0.3 . 1 . . . . 125 VAL CA . 18188 1 1556 . 1 1 129 129 VAL CB C 13 33.9980 0.3 . 1 . . . . 125 VAL CB . 18188 1 1557 . 1 1 129 129 VAL CG1 C 13 21.2910 0.3 . 2 . . . . 125 VAL CG1 . 18188 1 1558 . 1 1 129 129 VAL CG2 C 13 22.6480 0.3 . 2 . . . . 125 VAL CG2 . 18188 1 1559 . 1 1 129 129 VAL N N 15 125.6000 0.2 . 1 . . . . 125 VAL N . 18188 1 1560 . 1 1 130 130 ALA H H 1 9.5350 0.02 . 1 . . . . 126 ALA HN . 18188 1 1561 . 1 1 130 130 ALA HA H 1 5.3590 0.02 . 1 . . . . 126 ALA HA . 18188 1 1562 . 1 1 130 130 ALA HB1 H 1 1.3010 0.02 . 1 . . . . 126 ALA HB1 . 18188 1 1563 . 1 1 130 130 ALA HB2 H 1 1.3010 0.02 . 1 . . . . 126 ALA HB1 . 18188 1 1564 . 1 1 130 130 ALA HB3 H 1 1.3010 0.02 . 1 . . . . 126 ALA HB1 . 18188 1 1565 . 1 1 130 130 ALA C C 13 176.7340 0.3 . 1 . . . . 126 ALA C . 18188 1 1566 . 1 1 130 130 ALA CA C 13 50.2640 0.3 . 1 . . . . 126 ALA CA . 18188 1 1567 . 1 1 130 130 ALA CB C 13 23.2030 0.3 . 1 . . . . 126 ALA CB . 18188 1 1568 . 1 1 130 130 ALA N N 15 128.1750 0.2 . 1 . . . . 126 ALA N . 18188 1 1569 . 1 1 131 131 ASP H H 1 8.7030 0.02 . 1 . . . . 127 ASP HN . 18188 1 1570 . 1 1 131 131 ASP HA H 1 5.0250 0.02 . 1 . . . . 127 ASP HA . 18188 1 1571 . 1 1 131 131 ASP HB2 H 1 2.6120 0.02 . 2 . . . . 127 ASP HB1 . 18188 1 1572 . 1 1 131 131 ASP HB3 H 1 3.5700 0.02 . 2 . . . . 127 ASP HB2 . 18188 1 1573 . 1 1 131 131 ASP C C 13 177.3130 0.3 . 1 . . . . 127 ASP C . 18188 1 1574 . 1 1 131 131 ASP CA C 13 52.7890 0.3 . 1 . . . . 127 ASP CA . 18188 1 1575 . 1 1 131 131 ASP CB C 13 41.7020 0.3 . 1 . . . . 127 ASP CB . 18188 1 1576 . 1 1 131 131 ASP N N 15 120.9710 0.2 . 1 . . . . 127 ASP N . 18188 1 1577 . 1 1 132 132 GLU H H 1 8.3630 0.02 . 1 . . . . 128 GLU HN . 18188 1 1578 . 1 1 132 132 GLU HA H 1 4.6370 0.02 . 1 . . . . 128 GLU HA . 18188 1 1579 . 1 1 132 132 GLU HB2 H 1 1.6820 0.02 . 2 . . . . 128 GLU HB1 . 18188 1 1580 . 1 1 132 132 GLU HB3 H 1 2.2450 0.02 . 2 . . . . 128 GLU HB2 . 18188 1 1581 . 1 1 132 132 GLU HG2 H 1 1.9670 0.02 . 2 . . . . 128 GLU HG1 . 18188 1 1582 . 1 1 132 132 GLU HG3 H 1 2.3690 0.02 . 2 . . . . 128 GLU HG2 . 18188 1 1583 . 1 1 132 132 GLU C C 13 176.0380 0.3 . 1 . . . . 128 GLU C . 18188 1 1584 . 1 1 132 132 GLU CA C 13 58.0620 0.3 . 1 . . . . 128 GLU CA . 18188 1 1585 . 1 1 132 132 GLU CB C 13 28.3320 0.3 . 1 . . . . 128 GLU CB . 18188 1 1586 . 1 1 132 132 GLU CG C 13 30.5600 0.3 . 1 . . . . 128 GLU CG . 18188 1 1587 . 1 1 132 132 GLU N N 15 113.8950 0.2 . 1 . . . . 128 GLU N . 18188 1 1588 . 1 1 133 133 ASN H H 1 8.5490 0.02 . 1 . . . . 129 ASN HN . 18188 1 1589 . 1 1 133 133 ASN HA H 1 4.9410 0.02 . 1 . . . . 129 ASN HA . 18188 1 1590 . 1 1 133 133 ASN HB2 H 1 2.7330 0.02 . 2 . . . . 129 ASN HB1 . 18188 1 1591 . 1 1 133 133 ASN HB3 H 1 2.9910 0.02 . 2 . . . . 129 ASN HB2 . 18188 1 1592 . 1 1 133 133 ASN HD21 H 1 7.7880 0.02 . 2 . . . . 129 ASN HD21 . 18188 1 1593 . 1 1 133 133 ASN HD22 H 1 6.9170 0.02 . 2 . . . . 129 ASN HD22 . 18188 1 1594 . 1 1 133 133 ASN C C 13 174.8930 0.3 . 1 . . . . 129 ASN C . 18188 1 1595 . 1 1 133 133 ASN CA C 13 52.5840 0.3 . 1 . . . . 129 ASN CA . 18188 1 1596 . 1 1 133 133 ASN CB C 13 39.4810 0.3 . 1 . . . . 129 ASN CB . 18188 1 1597 . 1 1 133 133 ASN N N 15 116.2000 0.2 . 1 . . . . 129 ASN N . 18188 1 1598 . 1 1 133 133 ASN ND2 N 15 114.5160 0.2 . 1 . . . . 129 ASN ND2 . 18188 1 1599 . 1 1 134 134 ASP H H 1 8.3260 0.02 . 1 . . . . 130 ASP HN . 18188 1 1600 . 1 1 134 134 ASP HA H 1 4.2400 0.02 . 1 . . . . 130 ASP HA . 18188 1 1601 . 1 1 134 134 ASP HB2 H 1 2.7360 0.02 . 2 . . . . 130 ASP HB1 . 18188 1 1602 . 1 1 134 134 ASP HB3 H 1 3.1830 0.02 . 2 . . . . 130 ASP HB2 . 18188 1 1603 . 1 1 134 134 ASP C C 13 174.0130 0.3 . 1 . . . . 130 ASP C . 18188 1 1604 . 1 1 134 134 ASP CA C 13 54.5970 0.3 . 1 . . . . 130 ASP CA . 18188 1 1605 . 1 1 134 134 ASP CB C 13 37.2790 0.3 . 1 . . . . 130 ASP CB . 18188 1 1606 . 1 1 134 134 ASP N N 15 115.2970 0.2 . 1 . . . . 130 ASP N . 18188 1 1607 . 1 1 135 135 LYS H H 1 8.6220 0.02 . 1 . . . . 131 LYS HN . 18188 1 1608 . 1 1 135 135 LYS HA H 1 4.5190 0.02 . 1 . . . . 131 LYS HA . 18188 1 1609 . 1 1 135 135 LYS HB2 H 1 1.8920 0.02 . 2 . . . . 131 LYS HB1 . 18188 1 1610 . 1 1 135 135 LYS HB3 H 1 1.9610 0.02 . 2 . . . . 131 LYS HB2 . 18188 1 1611 . 1 1 135 135 LYS HG2 H 1 1.3790 0.02 . 2 . . . . 131 LYS HG1 . 18188 1 1612 . 1 1 135 135 LYS HG3 H 1 1.4720 0.02 . 2 . . . . 131 LYS HG2 . 18188 1 1613 . 1 1 135 135 LYS HD2 H 1 1.6950 0.02 . 2 . . . . 131 LYS HD1 . 18188 1 1614 . 1 1 135 135 LYS HD3 H 1 1.6950 0.02 . 2 . . . . 131 LYS HD2 . 18188 1 1615 . 1 1 135 135 LYS HE2 H 1 3.0310 0.02 . 2 . . . . 131 LYS HE1 . 18188 1 1616 . 1 1 135 135 LYS HE3 H 1 3.0310 0.02 . 2 . . . . 131 LYS HE2 . 18188 1 1617 . 1 1 135 135 LYS C C 13 176.4900 0.3 . 1 . . . . 131 LYS C . 18188 1 1618 . 1 1 135 135 LYS CA C 13 54.9230 0.3 . 1 . . . . 131 LYS CA . 18188 1 1619 . 1 1 135 135 LYS CB C 13 32.1220 0.3 . 1 . . . . 131 LYS CB . 18188 1 1620 . 1 1 135 135 LYS CG C 13 24.6350 0.3 . 1 . . . . 131 LYS CG . 18188 1 1621 . 1 1 135 135 LYS CD C 13 28.7100 0.3 . 1 . . . . 131 LYS CD . 18188 1 1622 . 1 1 135 135 LYS CE C 13 42.2990 0.3 . 1 . . . . 131 LYS CE . 18188 1 1623 . 1 1 135 135 LYS N N 15 120.2190 0.2 . 1 . . . . 131 LYS N . 18188 1 1624 . 1 1 136 136 ASP H H 1 8.5170 0.02 . 1 . . . . 132 ASP HN . 18188 1 1625 . 1 1 136 136 ASP HA H 1 4.7100 0.02 . 1 . . . . 132 ASP HA . 18188 1 1626 . 1 1 136 136 ASP HB2 H 1 2.8150 0.02 . 2 . . . . 132 ASP HB1 . 18188 1 1627 . 1 1 136 136 ASP HB3 H 1 2.5910 0.02 . 2 . . . . 132 ASP HB2 . 18188 1 1628 . 1 1 136 136 ASP C C 13 175.8260 0.3 . 1 . . . . 132 ASP C . 18188 1 1629 . 1 1 136 136 ASP CA C 13 55.4480 0.3 . 1 . . . . 132 ASP CA . 18188 1 1630 . 1 1 136 136 ASP CB C 13 40.5610 0.3 . 1 . . . . 132 ASP CB . 18188 1 1631 . 1 1 136 136 ASP N N 15 123.9840 0.2 . 1 . . . . 132 ASP N . 18188 1 1632 . 1 1 137 137 ILE H H 1 8.8070 0.02 . 1 . . . . 133 ILE HN . 18188 1 1633 . 1 1 137 137 ILE HA H 1 4.6820 0.02 . 1 . . . . 133 ILE HA . 18188 1 1634 . 1 1 137 137 ILE HB H 1 1.6520 0.02 . 1 . . . . 133 ILE HB . 18188 1 1635 . 1 1 137 137 ILE HG12 H 1 1.0730 0.02 . 2 . . . . 133 ILE HG11 . 18188 1 1636 . 1 1 137 137 ILE HG13 H 1 1.3930 0.02 . 2 . . . . 133 ILE HG12 . 18188 1 1637 . 1 1 137 137 ILE HG21 H 1 0.8200 0.02 . 1 . . . . 133 ILE HG21 . 18188 1 1638 . 1 1 137 137 ILE HG22 H 1 0.8200 0.02 . 1 . . . . 133 ILE HG21 . 18188 1 1639 . 1 1 137 137 ILE HG23 H 1 0.8200 0.02 . 1 . . . . 133 ILE HG21 . 18188 1 1640 . 1 1 137 137 ILE HD11 H 1 0.8480 0.02 . 1 . . . . 133 ILE HD11 . 18188 1 1641 . 1 1 137 137 ILE HD12 H 1 0.8480 0.02 . 1 . . . . 133 ILE HD11 . 18188 1 1642 . 1 1 137 137 ILE HD13 H 1 0.8480 0.02 . 1 . . . . 133 ILE HD11 . 18188 1 1643 . 1 1 137 137 ILE CA C 13 59.7820 0.3 . 1 . . . . 133 ILE CA . 18188 1 1644 . 1 1 137 137 ILE CB C 13 40.6210 0.3 . 1 . . . . 133 ILE CB . 18188 1 1645 . 1 1 137 137 ILE CG1 C 13 26.8440 0.3 . 1 . . . . 133 ILE CG1 . 18188 1 1646 . 1 1 137 137 ILE CG2 C 13 17.5900 0.3 . 1 . . . . 133 ILE CG2 . 18188 1 1647 . 1 1 137 137 ILE CD1 C 13 12.9780 0.3 . 1 . . . . 133 ILE CD1 . 18188 1 1648 . 1 1 137 137 ILE N N 15 124.6310 0.2 . 1 . . . . 133 ILE N . 18188 1 1649 . 1 1 140 140 ALA HA H 1 4.4760 0.02 . 1 . . . . 136 ALA HA . 18188 1 1650 . 1 1 140 140 ALA HB1 H 1 1.3050 0.02 . 1 . . . . 136 ALA HB1 . 18188 1 1651 . 1 1 140 140 ALA HB2 H 1 1.3050 0.02 . 1 . . . . 136 ALA HB1 . 18188 1 1652 . 1 1 140 140 ALA HB3 H 1 1.3050 0.02 . 1 . . . . 136 ALA HB1 . 18188 1 1653 . 1 1 140 140 ALA C C 13 174.8210 0.3 . 1 . . . . 136 ALA C . 18188 1 1654 . 1 1 140 140 ALA CA C 13 51.8120 0.3 . 1 . . . . 136 ALA CA . 18188 1 1655 . 1 1 140 140 ALA CB C 13 22.6880 0.3 . 1 . . . . 136 ALA CB . 18188 1 1656 . 1 1 141 141 ALA H H 1 8.6680 0.02 . 1 . . . . 137 ALA HN . 18188 1 1657 . 1 1 141 141 ALA HA H 1 5.7340 0.02 . 1 . . . . 137 ALA HA . 18188 1 1658 . 1 1 141 141 ALA HB1 H 1 1.2810 0.02 . 1 . . . . 137 ALA HB1 . 18188 1 1659 . 1 1 141 141 ALA HB2 H 1 1.2810 0.02 . 1 . . . . 137 ALA HB1 . 18188 1 1660 . 1 1 141 141 ALA HB3 H 1 1.2810 0.02 . 1 . . . . 137 ALA HB1 . 18188 1 1661 . 1 1 141 141 ALA C C 13 177.2660 0.3 . 1 . . . . 137 ALA C . 18188 1 1662 . 1 1 141 141 ALA CA C 13 50.2640 0.3 . 1 . . . . 137 ALA CA . 18188 1 1663 . 1 1 141 141 ALA CB C 13 22.4180 0.3 . 1 . . . . 137 ALA CB . 18188 1 1664 . 1 1 141 141 ALA N N 15 121.2310 0.2 . 1 . . . . 137 ALA N . 18188 1 1665 . 1 1 142 142 SER H H 1 8.6820 0.02 . 1 . . . . 138 SER HN . 18188 1 1666 . 1 1 142 142 SER HA H 1 4.7740 0.02 . 1 . . . . 138 SER HA . 18188 1 1667 . 1 1 142 142 SER HB2 H 1 3.6990 0.02 . 2 . . . . 138 SER HB1 . 18188 1 1668 . 1 1 142 142 SER HB3 H 1 3.8410 0.02 . 2 . . . . 138 SER HB2 . 18188 1 1669 . 1 1 142 142 SER C C 13 173.1790 0.3 . 1 . . . . 138 SER C . 18188 1 1670 . 1 1 142 142 SER CA C 13 57.0390 0.3 . 1 . . . . 138 SER CA . 18188 1 1671 . 1 1 142 142 SER CB C 13 64.9220 0.3 . 1 . . . . 138 SER CB . 18188 1 1672 . 1 1 142 142 SER N N 15 116.1040 0.2 . 1 . . . . 138 SER N . 18188 1 1673 . 1 1 143 143 ASN H H 1 8.6200 0.02 . 1 . . . . 139 ASN HN . 18188 1 1674 . 1 1 143 143 ASN HA H 1 4.8470 0.02 . 1 . . . . 139 ASN HA . 18188 1 1675 . 1 1 143 143 ASN HB2 H 1 2.8510 0.02 . 2 . . . . 139 ASN HB1 . 18188 1 1676 . 1 1 143 143 ASN HB3 H 1 3.1210 0.02 . 2 . . . . 139 ASN HB2 . 18188 1 1677 . 1 1 143 143 ASN HD21 H 1 7.7840 0.02 . 2 . . . . 139 ASN HD21 . 18188 1 1678 . 1 1 143 143 ASN HD22 H 1 7.5390 0.02 . 2 . . . . 139 ASN HD22 . 18188 1 1679 . 1 1 143 143 ASN C C 13 175.3060 0.3 . 1 . . . . 139 ASN C . 18188 1 1680 . 1 1 143 143 ASN CA C 13 53.3110 0.3 . 1 . . . . 139 ASN CA . 18188 1 1681 . 1 1 143 143 ASN CB C 13 40.0180 0.3 . 1 . . . . 139 ASN CB . 18188 1 1682 . 1 1 143 143 ASN N N 15 123.5740 0.2 . 1 . . . . 139 ASN N . 18188 1 1683 . 1 1 143 143 ASN ND2 N 15 114.4610 0.2 . 1 . . . . 139 ASN ND2 . 18188 1 1684 . 1 1 144 144 GLY H H 1 8.4390 0.02 . 1 . . . . 140 GLY HN . 18188 1 1685 . 1 1 144 144 GLY HA2 H 1 3.8610 0.02 . 2 . . . . 140 GLY HA1 . 18188 1 1686 . 1 1 144 144 GLY HA3 H 1 4.5440 0.02 . 2 . . . . 140 GLY HA2 . 18188 1 1687 . 1 1 144 144 GLY C C 13 175.4850 0.3 . 1 . . . . 140 GLY C . 18188 1 1688 . 1 1 144 144 GLY CA C 13 44.5670 0.3 . 1 . . . . 140 GLY CA . 18188 1 1689 . 1 1 144 144 GLY N N 15 107.2290 0.2 . 1 . . . . 140 GLY N . 18188 1 1690 . 1 1 145 145 LYS H H 1 8.4060 0.02 . 1 . . . . 141 LYS HN . 18188 1 1691 . 1 1 145 145 LYS HA H 1 4.9960 0.02 . 1 . . . . 141 LYS HA . 18188 1 1692 . 1 1 145 145 LYS HB2 H 1 1.4700 0.02 . 2 . . . . 141 LYS HB1 . 18188 1 1693 . 1 1 145 145 LYS HB3 H 1 1.9410 0.02 . 2 . . . . 141 LYS HB2 . 18188 1 1694 . 1 1 145 145 LYS HG2 H 1 1.1170 0.02 . 2 . . . . 141 LYS HG1 . 18188 1 1695 . 1 1 145 145 LYS HG3 H 1 1.3160 0.02 . 2 . . . . 141 LYS HG2 . 18188 1 1696 . 1 1 145 145 LYS HD2 H 1 1.4500 0.02 . 2 . . . . 141 LYS HD1 . 18188 1 1697 . 1 1 145 145 LYS HD3 H 1 1.4500 0.02 . 2 . . . . 141 LYS HD2 . 18188 1 1698 . 1 1 145 145 LYS HE2 H 1 2.8320 0.02 . 2 . . . . 141 LYS HE1 . 18188 1 1699 . 1 1 145 145 LYS HE3 H 1 2.8320 0.02 . 2 . . . . 141 LYS HE2 . 18188 1 1700 . 1 1 145 145 LYS C C 13 173.1920 0.3 . 1 . . . . 141 LYS C . 18188 1 1701 . 1 1 145 145 LYS CA C 13 56.5000 0.3 . 1 . . . . 141 LYS CA . 18188 1 1702 . 1 1 145 145 LYS CB C 13 35.6170 0.3 . 1 . . . . 141 LYS CB . 18188 1 1703 . 1 1 145 145 LYS CG C 13 23.6610 0.3 . 1 . . . . 141 LYS CG . 18188 1 1704 . 1 1 145 145 LYS CD C 13 29.8970 0.3 . 1 . . . . 141 LYS CD . 18188 1 1705 . 1 1 145 145 LYS CE C 13 42.0180 0.3 . 1 . . . . 141 LYS CE . 18188 1 1706 . 1 1 145 145 LYS N N 15 120.6080 0.2 . 1 . . . . 141 LYS N . 18188 1 1707 . 1 1 146 146 ILE H H 1 8.5410 0.02 . 1 . . . . 142 ILE HN . 18188 1 1708 . 1 1 146 146 ILE HA H 1 4.5530 0.02 . 1 . . . . 142 ILE HA . 18188 1 1709 . 1 1 146 146 ILE HB H 1 1.1390 0.02 . 1 . . . . 142 ILE HB . 18188 1 1710 . 1 1 146 146 ILE HG12 H 1 0.2220 0.02 . 2 . . . . 142 ILE HG11 . 18188 1 1711 . 1 1 146 146 ILE HG13 H 1 1.0130 0.02 . 2 . . . . 142 ILE HG12 . 18188 1 1712 . 1 1 146 146 ILE HG21 H 1 0.4110 0.02 . 1 . . . . 142 ILE HG21 . 18188 1 1713 . 1 1 146 146 ILE HG22 H 1 0.4110 0.02 . 1 . . . . 142 ILE HG21 . 18188 1 1714 . 1 1 146 146 ILE HG23 H 1 0.4110 0.02 . 1 . . . . 142 ILE HG21 . 18188 1 1715 . 1 1 146 146 ILE HD11 H 1 -0.9800 0.02 . 1 . . . . 142 ILE HD11 . 18188 1 1716 . 1 1 146 146 ILE HD12 H 1 -0.9800 0.02 . 1 . . . . 142 ILE HD11 . 18188 1 1717 . 1 1 146 146 ILE HD13 H 1 -0.9800 0.02 . 1 . . . . 142 ILE HD11 . 18188 1 1718 . 1 1 146 146 ILE C C 13 175.9020 0.3 . 1 . . . . 142 ILE C . 18188 1 1719 . 1 1 146 146 ILE CA C 13 60.2510 0.3 . 1 . . . . 142 ILE CA . 18188 1 1720 . 1 1 146 146 ILE CB C 13 39.7670 0.3 . 1 . . . . 142 ILE CB . 18188 1 1721 . 1 1 146 146 ILE CG1 C 13 26.6900 0.3 . 1 . . . . 142 ILE CG1 . 18188 1 1722 . 1 1 146 146 ILE CG2 C 13 17.1200 0.3 . 1 . . . . 142 ILE CG2 . 18188 1 1723 . 1 1 146 146 ILE CD1 C 13 10.8620 0.3 . 1 . . . . 142 ILE CD1 . 18188 1 1724 . 1 1 146 146 ILE N N 15 119.6610 0.2 . 1 . . . . 142 ILE N . 18188 1 1725 . 1 1 147 147 THR H H 1 9.0810 0.02 . 1 . . . . 143 THR HN . 18188 1 1726 . 1 1 147 147 THR HA H 1 4.6970 0.02 . 1 . . . . 143 THR HA . 18188 1 1727 . 1 1 147 147 THR HB H 1 3.8830 0.02 . 1 . . . . 143 THR HB . 18188 1 1728 . 1 1 147 147 THR HG21 H 1 1.1030 0.02 . 1 . . . . 143 THR HG21 . 18188 1 1729 . 1 1 147 147 THR HG22 H 1 1.1030 0.02 . 1 . . . . 143 THR HG21 . 18188 1 1730 . 1 1 147 147 THR HG23 H 1 1.1030 0.02 . 1 . . . . 143 THR HG21 . 18188 1 1731 . 1 1 147 147 THR C C 13 173.4230 0.3 . 1 . . . . 143 THR C . 18188 1 1732 . 1 1 147 147 THR CA C 13 62.1970 0.3 . 1 . . . . 143 THR CA . 18188 1 1733 . 1 1 147 147 THR CB C 13 69.9990 0.3 . 1 . . . . 143 THR CB . 18188 1 1734 . 1 1 147 147 THR CG2 C 13 20.9930 0.3 . 1 . . . . 143 THR CG2 . 18188 1 1735 . 1 1 147 147 THR N N 15 126.0210 0.2 . 1 . . . . 143 THR N . 18188 1 1736 . 1 1 148 148 VAL H H 1 8.4780 0.02 . 1 . . . . 144 VAL HN . 18188 1 1737 . 1 1 148 148 VAL HA H 1 4.8850 0.02 . 1 . . . . 144 VAL HA . 18188 1 1738 . 1 1 148 148 VAL HB H 1 2.3830 0.02 . 1 . . . . 144 VAL HB . 18188 1 1739 . 1 1 148 148 VAL HG11 H 1 0.8800 0.02 . 2 . . . . 144 VAL HG11 . 18188 1 1740 . 1 1 148 148 VAL HG12 H 1 0.8800 0.02 . 2 . . . . 144 VAL HG11 . 18188 1 1741 . 1 1 148 148 VAL HG13 H 1 0.8800 0.02 . 2 . . . . 144 VAL HG11 . 18188 1 1742 . 1 1 148 148 VAL HG21 H 1 1.1300 0.02 . 2 . . . . 144 VAL HG21 . 18188 1 1743 . 1 1 148 148 VAL HG22 H 1 1.1300 0.02 . 2 . . . . 144 VAL HG21 . 18188 1 1744 . 1 1 148 148 VAL HG23 H 1 1.1300 0.02 . 2 . . . . 144 VAL HG21 . 18188 1 1745 . 1 1 148 148 VAL C C 13 177.5930 0.3 . 1 . . . . 144 VAL C . 18188 1 1746 . 1 1 148 148 VAL CA C 13 61.3100 0.3 . 1 . . . . 144 VAL CA . 18188 1 1747 . 1 1 148 148 VAL CB C 13 31.6240 0.3 . 1 . . . . 144 VAL CB . 18188 1 1748 . 1 1 148 148 VAL CG1 C 13 21.3370 0.3 . 2 . . . . 144 VAL CG1 . 18188 1 1749 . 1 1 148 148 VAL CG2 C 13 22.4810 0.3 . 2 . . . . 144 VAL CG2 . 18188 1 1750 . 1 1 148 148 VAL N N 15 128.5970 0.2 . 1 . . . . 144 VAL N . 18188 1 1751 . 1 1 149 149 THR H H 1 8.8930 0.02 . 1 . . . . 145 THR HN . 18188 1 1752 . 1 1 149 149 THR HA H 1 4.3760 0.02 . 1 . . . . 145 THR HA . 18188 1 1753 . 1 1 149 149 THR HB H 1 4.3310 0.02 . 1 . . . . 145 THR HB . 18188 1 1754 . 1 1 149 149 THR HG21 H 1 1.2320 0.02 . 1 . . . . 145 THR HG21 . 18188 1 1755 . 1 1 149 149 THR HG22 H 1 1.2320 0.02 . 1 . . . . 145 THR HG21 . 18188 1 1756 . 1 1 149 149 THR HG23 H 1 1.2320 0.02 . 1 . . . . 145 THR HG21 . 18188 1 1757 . 1 1 149 149 THR C C 13 173.7290 0.3 . 1 . . . . 145 THR C . 18188 1 1758 . 1 1 149 149 THR CA C 13 61.6150 0.3 . 1 . . . . 145 THR CA . 18188 1 1759 . 1 1 149 149 THR CB C 13 69.8430 0.3 . 1 . . . . 145 THR CB . 18188 1 1760 . 1 1 149 149 THR CG2 C 13 21.0000 0.3 . 1 . . . . 145 THR CG2 . 18188 1 1761 . 1 1 149 149 THR N N 15 123.2020 0.2 . 1 . . . . 145 THR N . 18188 1 1762 . 1 1 150 150 GLY H H 1 8.2480 0.02 . 1 . . . . 146 GLY HN . 18188 1 1763 . 1 1 150 150 GLY HA2 H 1 3.9980 0.02 . 2 . . . . 146 GLY HA1 . 18188 1 1764 . 1 1 150 150 GLY HA3 H 1 4.1250 0.02 . 2 . . . . 146 GLY HA2 . 18188 1 1765 . 1 1 150 150 GLY C C 13 173.8490 0.3 . 1 . . . . 146 GLY C . 18188 1 1766 . 1 1 150 150 GLY CA C 13 45.1490 0.3 . 1 . . . . 146 GLY CA . 18188 1 1767 . 1 1 150 150 GLY N N 15 107.0090 0.2 . 1 . . . . 146 GLY N . 18188 1 1768 . 1 1 151 151 SER H H 1 8.2640 0.02 . 1 . . . . 147 SER HN . 18188 1 1769 . 1 1 151 151 SER HA H 1 4.4880 0.02 . 1 . . . . 147 SER HA . 18188 1 1770 . 1 1 151 151 SER HB2 H 1 3.8680 0.02 . 2 . . . . 147 SER HB1 . 18188 1 1771 . 1 1 151 151 SER HB3 H 1 3.8680 0.02 . 2 . . . . 147 SER HB2 . 18188 1 1772 . 1 1 151 151 SER C C 13 173.8590 0.3 . 1 . . . . 147 SER C . 18188 1 1773 . 1 1 151 151 SER CA C 13 57.9190 0.3 . 1 . . . . 147 SER CA . 18188 1 1774 . 1 1 151 151 SER CB C 13 64.1950 0.3 . 1 . . . . 147 SER CB . 18188 1 1775 . 1 1 151 151 SER N N 15 115.2840 0.2 . 1 . . . . 147 SER N . 18188 1 1776 . 1 1 152 152 ALA H H 1 8.4210 0.02 . 1 . . . . 148 ALA HN . 18188 1 1777 . 1 1 152 152 ALA HA H 1 4.6250 0.02 . 1 . . . . 148 ALA HA . 18188 1 1778 . 1 1 152 152 ALA HB1 H 1 1.3820 0.02 . 1 . . . . 148 ALA HB1 . 18188 1 1779 . 1 1 152 152 ALA HB2 H 1 1.3820 0.02 . 1 . . . . 148 ALA HB1 . 18188 1 1780 . 1 1 152 152 ALA HB3 H 1 1.3820 0.02 . 1 . . . . 148 ALA HB1 . 18188 1 1781 . 1 1 152 152 ALA C C 13 175.6810 0.3 . 1 . . . . 148 ALA C . 18188 1 1782 . 1 1 152 152 ALA CA C 13 50.7250 0.3 . 1 . . . . 148 ALA CA . 18188 1 1783 . 1 1 152 152 ALA CB C 13 18.0710 0.3 . 1 . . . . 148 ALA CB . 18188 1 1784 . 1 1 152 152 ALA N N 15 127.1230 0.2 . 1 . . . . 148 ALA N . 18188 1 1785 . 1 1 153 153 PRO HA H 1 4.5460 0.02 . 1 . . . . 149 PRO HA . 18188 1 1786 . 1 1 153 153 PRO HB2 H 1 2.0080 0.02 . 2 . . . . 149 PRO HB1 . 18188 1 1787 . 1 1 153 153 PRO HB3 H 1 2.3480 0.02 . 2 . . . . 149 PRO HB2 . 18188 1 1788 . 1 1 153 153 PRO HG2 H 1 2.0570 0.02 . 2 . . . . 149 PRO HG1 . 18188 1 1789 . 1 1 153 153 PRO HG3 H 1 2.0570 0.02 . 2 . . . . 149 PRO HG2 . 18188 1 1790 . 1 1 153 153 PRO HD2 H 1 3.6980 0.02 . 2 . . . . 149 PRO HD1 . 18188 1 1791 . 1 1 153 153 PRO HD3 H 1 3.8470 0.02 . 2 . . . . 149 PRO HD2 . 18188 1 1792 . 1 1 153 153 PRO C C 13 177.3030 0.3 . 1 . . . . 149 PRO C . 18188 1 1793 . 1 1 153 153 PRO CA C 13 63.0690 0.3 . 1 . . . . 149 PRO CA . 18188 1 1794 . 1 1 153 153 PRO CB C 13 32.2080 0.3 . 1 . . . . 149 PRO CB . 18188 1 1795 . 1 1 153 153 PRO CG C 13 27.4420 0.3 . 1 . . . . 149 PRO CG . 18188 1 1796 . 1 1 153 153 PRO CD C 13 50.6580 0.3 . 1 . . . . 149 PRO CD . 18188 1 1797 . 1 1 154 154 THR H H 1 8.3570 0.02 . 1 . . . . 150 THR HN . 18188 1 1798 . 1 1 154 154 THR HA H 1 4.3770 0.02 . 1 . . . . 150 THR HA . 18188 1 1799 . 1 1 154 154 THR HB H 1 4.3290 0.02 . 1 . . . . 150 THR HB . 18188 1 1800 . 1 1 154 154 THR HG21 H 1 1.2390 0.02 . 1 . . . . 150 THR HG21 . 18188 1 1801 . 1 1 154 154 THR HG22 H 1 1.2390 0.02 . 1 . . . . 150 THR HG21 . 18188 1 1802 . 1 1 154 154 THR HG23 H 1 1.2390 0.02 . 1 . . . . 150 THR HG21 . 18188 1 1803 . 1 1 154 154 THR C C 13 174.0560 0.3 . 1 . . . . 150 THR C . 18188 1 1804 . 1 1 154 154 THR CA C 13 61.6780 0.3 . 1 . . . . 150 THR CA . 18188 1 1805 . 1 1 154 154 THR CB C 13 69.8440 0.3 . 1 . . . . 150 THR CB . 18188 1 1806 . 1 1 154 154 THR CG2 C 13 21.6000 0.3 . 1 . . . . 150 THR CG2 . 18188 1 1807 . 1 1 154 154 THR N N 15 114.0950 0.2 . 1 . . . . 150 THR N . 18188 1 1808 . 1 1 155 155 SER H H 1 7.9690 0.02 . 1 . . . . 151 SER HN . 18188 1 1809 . 1 1 155 155 SER HA H 1 4.2800 0.02 . 1 . . . . 151 SER HA . 18188 1 1810 . 1 1 155 155 SER HB2 H 1 3.8710 0.02 . 2 . . . . 151 SER HB1 . 18188 1 1811 . 1 1 155 155 SER HB3 H 1 3.8710 0.02 . 2 . . . . 151 SER HB2 . 18188 1 1812 . 1 1 155 155 SER C C 13 178.5620 0.3 . 1 . . . . 151 SER C . 18188 1 1813 . 1 1 155 155 SER CA C 13 60.1000 0.3 . 1 . . . . 151 SER CA . 18188 1 1814 . 1 1 155 155 SER CB C 13 64.9280 0.3 . 1 . . . . 151 SER CB . 18188 1 1815 . 1 1 155 155 SER N N 15 123.0630 0.2 . 1 . . . . 151 SER N . 18188 1 stop_ save_