data_5570 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 5570 _Entry.Title ; 1H, 13C, and 15N NMR assignments of the hypothetical Nudix protein DR0079 from the extremely radiation-resistant bacterium Deinococcus radiodurans ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2002-10-31 _Entry.Accession_date 2002-11-01 _Entry.Last_release_date 2003-02-18 _Entry.Original_release_date 2003-02-18 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _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 Garry Buchko . W. . 5570 2 Shusoing Ni . . . 5570 3 Stephen Holbrook . R. . 5570 4 Michael Kennedy . A. . 5570 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 5570 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 917 5570 '13C chemical shifts' 580 5570 '15N chemical shifts' 166 5570 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2003-02-18 2002-10-31 original author . 5570 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 5570 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Letter to the Editor: 1H, 13C, and 15N NMR assignments of the hypothetical Nudix protein DR0079 from the extremely radiation-resistant bacterium Deinococcus radiodurans ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 25 _Citation.Journal_issue 2 _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 169 _Citation.Page_last 170 _Citation.Year 2003 _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 Garry Buchko . W. . 5570 1 2 Shusoing Ni . . . 5570 1 3 Stephen Holbrook . R. . 5570 1 4 Michael Kennedy . A. . 5570 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'Deinococcus radiodurans' 5570 1 'DNA maintenance' 5570 1 'DNA repair' 5570 1 'Nudix hydrolase' 5570 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_DR0079 _Assembly.Sf_category assembly _Assembly.Sf_framecode system_DR0079 _Assembly.Entry_ID 5570 _Assembly.ID 1 _Assembly.Name DR0079 _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 'all free' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 5570 1 stop_ 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 DR0079 1 $DR0079 . . . native . . . . . 5570 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID DR0079 system 5570 1 DR0079 abbreviation 5570 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'hypothetical Nudix protein' 5570 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_DR0079 _Entity.Sf_category entity _Entity.Sf_framecode DR0079 _Entity.Entry_ID 5570 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name DR0079 _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 ; MGGVSDERLDLVNERDEVVG QILRTDPALRWERVRVVNAF LRNSQGQLWIPRRSPSKSLF PNALDVSVGGAVQSGETYEE AFRREAREELNVEIDALSWR PLASFSPFQTTLSSFMCVYE LRSDATPIFNPNDISGGEWL TPEHLLARIAAGEAAKGDLA ELVRRCYREEE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 171 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _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 19283 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1Q27 . "Nmr Solution Structure Of Dr0079: An Hypothetical Nudix Protein From D. Radiodurans" . . . . . 100.00 171 100.00 100.00 5.39e-119 . . . . 5570 1 2 no PDB 2O5F . "Crystal Structure Of Dr0079 From Deinococcus Radiodurans At 1.9 Angstrom Resolution" . . . . . 100.00 171 100.00 100.00 5.39e-119 . . . . 5570 1 3 no GB AAF09672 . "MutT/nudix family protein [Deinococcus radiodurans R1]" . . . . . 100.00 171 100.00 100.00 5.39e-119 . . . . 5570 1 4 no REF NP_293805 . "MutT/nudix family protein [Deinococcus radiodurans R1]" . . . . . 100.00 171 100.00 100.00 5.39e-119 . . . . 5570 1 5 no REF WP_010886727 . "NUDIX hydrolase [Deinococcus radiodurans]" . . . . . 100.00 171 100.00 100.00 5.39e-119 . . . . 5570 1 6 no SP Q9RY71 . "RecName: Full=Nudix hydrolase DR_0079 [Deinococcus radiodurans R1]" . . . . . 100.00 171 100.00 100.00 5.39e-119 . . . . 5570 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID DR0079 common 5570 1 DR0079 abbreviation 5570 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 5570 1 2 . GLY . 5570 1 3 . GLY . 5570 1 4 . VAL . 5570 1 5 . SER . 5570 1 6 . ASP . 5570 1 7 . GLU . 5570 1 8 . ARG . 5570 1 9 . LEU . 5570 1 10 . ASP . 5570 1 11 . LEU . 5570 1 12 . VAL . 5570 1 13 . ASN . 5570 1 14 . GLU . 5570 1 15 . ARG . 5570 1 16 . ASP . 5570 1 17 . GLU . 5570 1 18 . VAL . 5570 1 19 . VAL . 5570 1 20 . GLY . 5570 1 21 . GLN . 5570 1 22 . ILE . 5570 1 23 . LEU . 5570 1 24 . ARG . 5570 1 25 . THR . 5570 1 26 . ASP . 5570 1 27 . PRO . 5570 1 28 . ALA . 5570 1 29 . LEU . 5570 1 30 . ARG . 5570 1 31 . TRP . 5570 1 32 . GLU . 5570 1 33 . ARG . 5570 1 34 . VAL . 5570 1 35 . ARG . 5570 1 36 . VAL . 5570 1 37 . VAL . 5570 1 38 . ASN . 5570 1 39 . ALA . 5570 1 40 . PHE . 5570 1 41 . LEU . 5570 1 42 . ARG . 5570 1 43 . ASN . 5570 1 44 . SER . 5570 1 45 . GLN . 5570 1 46 . GLY . 5570 1 47 . GLN . 5570 1 48 . LEU . 5570 1 49 . TRP . 5570 1 50 . ILE . 5570 1 51 . PRO . 5570 1 52 . ARG . 5570 1 53 . ARG . 5570 1 54 . SER . 5570 1 55 . PRO . 5570 1 56 . SER . 5570 1 57 . LYS . 5570 1 58 . SER . 5570 1 59 . LEU . 5570 1 60 . PHE . 5570 1 61 . PRO . 5570 1 62 . ASN . 5570 1 63 . ALA . 5570 1 64 . LEU . 5570 1 65 . ASP . 5570 1 66 . VAL . 5570 1 67 . SER . 5570 1 68 . VAL . 5570 1 69 . GLY . 5570 1 70 . GLY . 5570 1 71 . ALA . 5570 1 72 . VAL . 5570 1 73 . GLN . 5570 1 74 . SER . 5570 1 75 . GLY . 5570 1 76 . GLU . 5570 1 77 . THR . 5570 1 78 . TYR . 5570 1 79 . GLU . 5570 1 80 . GLU . 5570 1 81 . ALA . 5570 1 82 . PHE . 5570 1 83 . ARG . 5570 1 84 . ARG . 5570 1 85 . GLU . 5570 1 86 . ALA . 5570 1 87 . ARG . 5570 1 88 . GLU . 5570 1 89 . GLU . 5570 1 90 . LEU . 5570 1 91 . ASN . 5570 1 92 . VAL . 5570 1 93 . GLU . 5570 1 94 . ILE . 5570 1 95 . ASP . 5570 1 96 . ALA . 5570 1 97 . LEU . 5570 1 98 . SER . 5570 1 99 . TRP . 5570 1 100 . ARG . 5570 1 101 . PRO . 5570 1 102 . LEU . 5570 1 103 . ALA . 5570 1 104 . SER . 5570 1 105 . PHE . 5570 1 106 . SER . 5570 1 107 . PRO . 5570 1 108 . PHE . 5570 1 109 . GLN . 5570 1 110 . THR . 5570 1 111 . THR . 5570 1 112 . LEU . 5570 1 113 . SER . 5570 1 114 . SER . 5570 1 115 . PHE . 5570 1 116 . MET . 5570 1 117 . CYS . 5570 1 118 . VAL . 5570 1 119 . TYR . 5570 1 120 . GLU . 5570 1 121 . LEU . 5570 1 122 . ARG . 5570 1 123 . SER . 5570 1 124 . ASP . 5570 1 125 . ALA . 5570 1 126 . THR . 5570 1 127 . PRO . 5570 1 128 . ILE . 5570 1 129 . PHE . 5570 1 130 . ASN . 5570 1 131 . PRO . 5570 1 132 . ASN . 5570 1 133 . ASP . 5570 1 134 . ILE . 5570 1 135 . SER . 5570 1 136 . GLY . 5570 1 137 . GLY . 5570 1 138 . GLU . 5570 1 139 . TRP . 5570 1 140 . LEU . 5570 1 141 . THR . 5570 1 142 . PRO . 5570 1 143 . GLU . 5570 1 144 . HIS . 5570 1 145 . LEU . 5570 1 146 . LEU . 5570 1 147 . ALA . 5570 1 148 . ARG . 5570 1 149 . ILE . 5570 1 150 . ALA . 5570 1 151 . ALA . 5570 1 152 . GLY . 5570 1 153 . GLU . 5570 1 154 . ALA . 5570 1 155 . ALA . 5570 1 156 . LYS . 5570 1 157 . GLY . 5570 1 158 . ASP . 5570 1 159 . LEU . 5570 1 160 . ALA . 5570 1 161 . GLU . 5570 1 162 . LEU . 5570 1 163 . VAL . 5570 1 164 . ARG . 5570 1 165 . ARG . 5570 1 166 . CYS . 5570 1 167 . TYR . 5570 1 168 . ARG . 5570 1 169 . GLU . 5570 1 170 . GLU . 5570 1 171 . GLU . 5570 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 5570 1 . GLY 2 2 5570 1 . GLY 3 3 5570 1 . VAL 4 4 5570 1 . SER 5 5 5570 1 . ASP 6 6 5570 1 . GLU 7 7 5570 1 . ARG 8 8 5570 1 . LEU 9 9 5570 1 . ASP 10 10 5570 1 . LEU 11 11 5570 1 . VAL 12 12 5570 1 . ASN 13 13 5570 1 . GLU 14 14 5570 1 . ARG 15 15 5570 1 . ASP 16 16 5570 1 . GLU 17 17 5570 1 . VAL 18 18 5570 1 . VAL 19 19 5570 1 . GLY 20 20 5570 1 . GLN 21 21 5570 1 . ILE 22 22 5570 1 . LEU 23 23 5570 1 . ARG 24 24 5570 1 . THR 25 25 5570 1 . ASP 26 26 5570 1 . PRO 27 27 5570 1 . ALA 28 28 5570 1 . LEU 29 29 5570 1 . ARG 30 30 5570 1 . TRP 31 31 5570 1 . GLU 32 32 5570 1 . ARG 33 33 5570 1 . VAL 34 34 5570 1 . ARG 35 35 5570 1 . VAL 36 36 5570 1 . VAL 37 37 5570 1 . ASN 38 38 5570 1 . ALA 39 39 5570 1 . PHE 40 40 5570 1 . LEU 41 41 5570 1 . ARG 42 42 5570 1 . ASN 43 43 5570 1 . SER 44 44 5570 1 . GLN 45 45 5570 1 . GLY 46 46 5570 1 . GLN 47 47 5570 1 . LEU 48 48 5570 1 . TRP 49 49 5570 1 . ILE 50 50 5570 1 . PRO 51 51 5570 1 . ARG 52 52 5570 1 . ARG 53 53 5570 1 . SER 54 54 5570 1 . PRO 55 55 5570 1 . SER 56 56 5570 1 . LYS 57 57 5570 1 . SER 58 58 5570 1 . LEU 59 59 5570 1 . PHE 60 60 5570 1 . PRO 61 61 5570 1 . ASN 62 62 5570 1 . ALA 63 63 5570 1 . LEU 64 64 5570 1 . ASP 65 65 5570 1 . VAL 66 66 5570 1 . SER 67 67 5570 1 . VAL 68 68 5570 1 . GLY 69 69 5570 1 . GLY 70 70 5570 1 . ALA 71 71 5570 1 . VAL 72 72 5570 1 . GLN 73 73 5570 1 . SER 74 74 5570 1 . GLY 75 75 5570 1 . GLU 76 76 5570 1 . THR 77 77 5570 1 . TYR 78 78 5570 1 . GLU 79 79 5570 1 . GLU 80 80 5570 1 . ALA 81 81 5570 1 . PHE 82 82 5570 1 . ARG 83 83 5570 1 . ARG 84 84 5570 1 . GLU 85 85 5570 1 . ALA 86 86 5570 1 . ARG 87 87 5570 1 . GLU 88 88 5570 1 . GLU 89 89 5570 1 . LEU 90 90 5570 1 . ASN 91 91 5570 1 . VAL 92 92 5570 1 . GLU 93 93 5570 1 . ILE 94 94 5570 1 . ASP 95 95 5570 1 . ALA 96 96 5570 1 . LEU 97 97 5570 1 . SER 98 98 5570 1 . TRP 99 99 5570 1 . ARG 100 100 5570 1 . PRO 101 101 5570 1 . LEU 102 102 5570 1 . ALA 103 103 5570 1 . SER 104 104 5570 1 . PHE 105 105 5570 1 . SER 106 106 5570 1 . PRO 107 107 5570 1 . PHE 108 108 5570 1 . GLN 109 109 5570 1 . THR 110 110 5570 1 . THR 111 111 5570 1 . LEU 112 112 5570 1 . SER 113 113 5570 1 . SER 114 114 5570 1 . PHE 115 115 5570 1 . MET 116 116 5570 1 . CYS 117 117 5570 1 . VAL 118 118 5570 1 . TYR 119 119 5570 1 . GLU 120 120 5570 1 . LEU 121 121 5570 1 . ARG 122 122 5570 1 . SER 123 123 5570 1 . ASP 124 124 5570 1 . ALA 125 125 5570 1 . THR 126 126 5570 1 . PRO 127 127 5570 1 . ILE 128 128 5570 1 . PHE 129 129 5570 1 . ASN 130 130 5570 1 . PRO 131 131 5570 1 . ASN 132 132 5570 1 . ASP 133 133 5570 1 . ILE 134 134 5570 1 . SER 135 135 5570 1 . GLY 136 136 5570 1 . GLY 137 137 5570 1 . GLU 138 138 5570 1 . TRP 139 139 5570 1 . LEU 140 140 5570 1 . THR 141 141 5570 1 . PRO 142 142 5570 1 . GLU 143 143 5570 1 . HIS 144 144 5570 1 . LEU 145 145 5570 1 . LEU 146 146 5570 1 . ALA 147 147 5570 1 . ARG 148 148 5570 1 . ILE 149 149 5570 1 . ALA 150 150 5570 1 . ALA 151 151 5570 1 . GLY 152 152 5570 1 . GLU 153 153 5570 1 . ALA 154 154 5570 1 . ALA 155 155 5570 1 . LYS 156 156 5570 1 . GLY 157 157 5570 1 . ASP 158 158 5570 1 . LEU 159 159 5570 1 . ALA 160 160 5570 1 . GLU 161 161 5570 1 . LEU 162 162 5570 1 . VAL 163 163 5570 1 . ARG 164 164 5570 1 . ARG 165 165 5570 1 . CYS 166 166 5570 1 . TYR 167 167 5570 1 . ARG 168 168 5570 1 . GLU 169 169 5570 1 . GLU 170 170 5570 1 . GLU 171 171 5570 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 5570 _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 $DR0079 . 1299 . . 'Deinococcus radiodurans' 'D. radiodurans' . . Eubacteria . Deinococcus radiodurans . . . . . . . . . . . . . . . . . . . . . 5570 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 5570 _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 $DR0079 . 'recombinant technology' 'Escherichia coli' 'E. coli' . . Escherichia coli BL21 . . . . . . . . . . . . . . . . . . . . . . 5570 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 5570 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 DR0079 '[U-15N; U-13C]' . . 1 $DR0079 . . . 0.1 4 mM . . . . 5570 1 stop_ save_ ####################### # Sample conditions # ####################### save_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_1 _Sample_condition_list.Entry_ID 5570 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.1 0.2 na 5570 1 temperature 298 1 K 5570 1 stop_ save_ ############################ # Computer software used # ############################ save_FELIX _Software.Sf_category software _Software.Sf_framecode FELIX _Software.Entry_ID 5570 _Software.ID 1 _Software.Name FELIX _Software.Version 97 _Software.Details . loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data processing' 5570 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 5570 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Inova _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 5570 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Inova _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_NMR_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_3 _NMR_spectrometer.Entry_ID 5570 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Inova _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 5570 _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 NMR_spectrometer_1 Varian Inova . 600 . . . 5570 1 2 NMR_spectrometer_2 Varian Inova . 750 . . . 5570 1 3 NMR_spectrometer_3 Varian Inova . 800 . . . 5570 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 5570 _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 HSQC-NOESY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5570 1 2 HNCA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5570 1 3 HNCOCA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5570 1 4 CBCA(CO)NH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5570 1 5 HNCACB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5570 1 6 HNCO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5570 1 7 HNCACO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5570 1 8 HCCH-TOCSY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5570 1 9 CCC-TOCSY-NNH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5570 1 10 CBCACOCAHA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5570 1 stop_ save_ save_NMR_spec_expt__0_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_1 _NMR_spec_expt.Entry_ID 5570 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name HSQC-NOESY _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 . _NMR_spec_expt.NMR_spectrometer_label . _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_ save_NMR_spec_expt__0_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_2 _NMR_spec_expt.Entry_ID 5570 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name HNCA _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 . _NMR_spec_expt.NMR_spectrometer_label . _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_ save_NMR_spec_expt__0_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_3 _NMR_spec_expt.Entry_ID 5570 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name HNCOCA _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 . _NMR_spec_expt.NMR_spectrometer_label . _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_ save_NMR_spec_expt__0_4 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_4 _NMR_spec_expt.Entry_ID 5570 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name CBCA(CO)NH _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 . _NMR_spec_expt.NMR_spectrometer_label . _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_ save_NMR_spec_expt__0_5 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_5 _NMR_spec_expt.Entry_ID 5570 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name HNCACB _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 . _NMR_spec_expt.NMR_spectrometer_label . _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_ save_NMR_spec_expt__0_6 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_6 _NMR_spec_expt.Entry_ID 5570 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name HNCO _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 . _NMR_spec_expt.NMR_spectrometer_label . _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_ save_NMR_spec_expt__0_7 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_7 _NMR_spec_expt.Entry_ID 5570 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name HNCACO _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 . _NMR_spec_expt.NMR_spectrometer_label . _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_ save_NMR_spec_expt__0_8 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_8 _NMR_spec_expt.Entry_ID 5570 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name HCCH-TOCSY _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 . _NMR_spec_expt.NMR_spectrometer_label . _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_ save_NMR_spec_expt__0_9 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_9 _NMR_spec_expt.Entry_ID 5570 _NMR_spec_expt.ID 9 _NMR_spec_expt.Name CCC-TOCSY-NNH _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 . _NMR_spec_expt.NMR_spectrometer_label . _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_ save_NMR_spec_expt__0_10 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_10 _NMR_spec_expt.Entry_ID 5570 _NMR_spec_expt.ID 10 _NMR_spec_expt.Name CBCACOCAHA _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 . _NMR_spec_expt.NMR_spectrometer_label . _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 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 5570 _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 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.000000000 . . . . . . . . . 5570 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 5570 1 C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 5570 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_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 5570 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _Assigned_chem_shift_list.Chem_shift_1H_err . _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 HSQC-NOESY 1 $sample_1 . 5570 1 2 HNCA 1 $sample_1 . 5570 1 3 HNCOCA 1 $sample_1 . 5570 1 4 CBCA(CO)NH 1 $sample_1 . 5570 1 5 HNCACB 1 $sample_1 . 5570 1 6 HNCO 1 $sample_1 . 5570 1 7 HNCACO 1 $sample_1 . 5570 1 8 HCCH-TOCSY 1 $sample_1 . 5570 1 9 CCC-TOCSY-NNH 1 $sample_1 . 5570 1 10 CBCACOCAHA 1 $sample_1 . 5570 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 MET HE1 H 1 2.13 0.02 . 1 . . . . . . . . 5570 1 2 . 1 1 1 1 MET HE2 H 1 2.13 0.02 . 1 . . . . . . . . 5570 1 3 . 1 1 1 1 MET HE3 H 1 2.13 0.02 . 1 . . . . . . . . 5570 1 4 . 1 1 1 1 MET CE C 13 16.9 0.2 . 1 . . . . . . . . 5570 1 5 . 1 1 2 2 GLY H H 1 8.47 0.02 . 1 . . . . . . . . 5570 1 6 . 1 1 3 3 GLY CA C 13 45.2 0.2 . 1 . . . . . . . . 5570 1 7 . 1 1 3 3 GLY N N 15 108.6 0.2 . 1 . . . . . . . . 5570 1 8 . 1 1 4 4 VAL H H 1 8.06 0.02 . 1 . . . . . . . . 5570 1 9 . 1 1 4 4 VAL HA H 1 4.21 0.02 . 1 . . . . . . . . 5570 1 10 . 1 1 4 4 VAL HB H 1 2.13 0.02 . 1 . . . . . . . . 5570 1 11 . 1 1 4 4 VAL HG11 H 1 0.98 0.02 . 1 . . . . . . . . 5570 1 12 . 1 1 4 4 VAL HG12 H 1 0.98 0.02 . 1 . . . . . . . . 5570 1 13 . 1 1 4 4 VAL HG13 H 1 0.98 0.02 . 1 . . . . . . . . 5570 1 14 . 1 1 4 4 VAL HG21 H 1 0.92 0.02 . 1 . . . . . . . . 5570 1 15 . 1 1 4 4 VAL HG22 H 1 0.92 0.02 . 1 . . . . . . . . 5570 1 16 . 1 1 4 4 VAL HG23 H 1 0.92 0.02 . 1 . . . . . . . . 5570 1 17 . 1 1 4 4 VAL C C 13 176.4 0.2 . 1 . . . . . . . . 5570 1 18 . 1 1 4 4 VAL CA C 13 62.2 0.2 . 1 . . . . . . . . 5570 1 19 . 1 1 4 4 VAL CB C 13 32.7 0.2 . 1 . . . . . . . . 5570 1 20 . 1 1 4 4 VAL CG1 C 13 21.2 0.2 . 1 . . . . . . . . 5570 1 21 . 1 1 4 4 VAL CG2 C 13 20.2 0.2 . 1 . . . . . . . . 5570 1 22 . 1 1 4 4 VAL N N 15 118.2 0.2 . 1 . . . . . . . . 5570 1 23 . 1 1 5 5 SER H H 1 8.41 0.02 . 1 . . . . . . . . 5570 1 24 . 1 1 5 5 SER HA H 1 4.48 0.02 . 1 . . . . . . . . 5570 1 25 . 1 1 5 5 SER HB2 H 1 3.91 0.02 . 2 . . . . . . . . 5570 1 26 . 1 1 5 5 SER HB3 H 1 3.85 0.02 . 2 . . . . . . . . 5570 1 27 . 1 1 5 5 SER C C 13 174.1 0.2 . 1 . . . . . . . . 5570 1 28 . 1 1 5 5 SER CA C 13 63.8 0.2 . 1 . . . . . . . . 5570 1 29 . 1 1 5 5 SER CB C 13 58.5 0.2 . 1 . . . . . . . . 5570 1 30 . 1 1 5 5 SER N N 15 118.0 0.2 . 1 . . . . . . . . 5570 1 31 . 1 1 6 6 ASP H H 1 8.25 0.02 . 1 . . . . . . . . 5570 1 32 . 1 1 6 6 ASP CA C 13 54.1 0.2 . 1 . . . . . . . . 5570 1 33 . 1 1 6 6 ASP CB C 13 41.5 0.2 . 1 . . . . . . . . 5570 1 34 . 1 1 6 6 ASP N N 15 121.9 0.2 . 1 . . . . . . . . 5570 1 35 . 1 1 7 7 GLU HA H 1 4.25 0.02 . 1 . . . . . . . . 5570 1 36 . 1 1 7 7 GLU HG2 H 1 2.34 0.02 . 2 . . . . . . . . 5570 1 37 . 1 1 7 7 GLU HG3 H 1 2.21 0.02 . 2 . . . . . . . . 5570 1 38 . 1 1 7 7 GLU CA C 13 57.1 0.2 . 1 . . . . . . . . 5570 1 39 . 1 1 7 7 GLU CB C 13 30.9 0.2 . 1 . . . . . . . . 5570 1 40 . 1 1 7 7 GLU CG C 13 36.7 0.2 . 1 . . . . . . . . 5570 1 41 . 1 1 8 8 ARG H H 1 8.47 0.02 . 1 . . . . . . . . 5570 1 42 . 1 1 8 8 ARG HA H 1 4.88 0.02 . 1 . . . . . . . . 5570 1 43 . 1 1 8 8 ARG HB2 H 1 1.74 0.02 . 2 . . . . . . . . 5570 1 44 . 1 1 8 8 ARG HB3 H 1 1.61 0.02 . 2 . . . . . . . . 5570 1 45 . 1 1 8 8 ARG HG2 H 1 1.48 0.02 . 1 . . . . . . . . 5570 1 46 . 1 1 8 8 ARG HG3 H 1 1.48 0.02 . 1 . . . . . . . . 5570 1 47 . 1 1 8 8 ARG HD2 H 1 3.09 0.02 . 1 . . . . . . . . 5570 1 48 . 1 1 8 8 ARG HD3 H 1 3.09 0.02 . 1 . . . . . . . . 5570 1 49 . 1 1 8 8 ARG CA C 13 55.6 0.2 . 1 . . . . . . . . 5570 1 50 . 1 1 8 8 ARG CB C 13 33.3 0.2 . 1 . . . . . . . . 5570 1 51 . 1 1 8 8 ARG CG C 13 28.0 0.2 . 1 . . . . . . . . 5570 1 52 . 1 1 8 8 ARG N N 15 121.6 0.2 . 1 . . . . . . . . 5570 1 53 . 1 1 9 9 LEU H H 1 9.38 0.02 . 1 . . . . . . . . 5570 1 54 . 1 1 9 9 LEU HA H 1 4.64 0.02 . 1 . . . . . . . . 5570 1 55 . 1 1 9 9 LEU HB2 H 1 1.87 0.02 . 4 . . . . . . . . 5570 1 56 . 1 1 9 9 LEU HB3 H 1 1.56 0.02 . 4 . . . . . . . . 5570 1 57 . 1 1 9 9 LEU HG H 1 1.56 0.02 . 4 . . . . . . . . 5570 1 58 . 1 1 9 9 LEU CA C 13 53.7 0.2 . 1 . . . . . . . . 5570 1 59 . 1 1 9 9 LEU CB C 13 43.0 0.2 . 1 . . . . . . . . 5570 1 60 . 1 1 9 9 LEU CG C 13 25.5 0.2 . 1 . . . . . . . . 5570 1 61 . 1 1 9 9 LEU N N 15 122.3 0.2 . 1 . . . . . . . . 5570 1 62 . 1 1 10 10 ASP H H 1 8.40 0.02 . 1 . . . . . . . . 5570 1 63 . 1 1 10 10 ASP HA H 1 5.22 0.02 . 1 . . . . . . . . 5570 1 64 . 1 1 10 10 ASP HB2 H 1 2.56 0.02 . 2 . . . . . . . . 5570 1 65 . 1 1 10 10 ASP HB3 H 1 2.45 0.02 . 2 . . . . . . . . 5570 1 66 . 1 1 10 10 ASP CA C 13 55.5 0.2 . 1 . . . . . . . . 5570 1 67 . 1 1 10 10 ASP CB C 13 41.4 0.2 . 1 . . . . . . . . 5570 1 68 . 1 1 10 10 ASP N N 15 119.4 0.2 . 1 . . . . . . . . 5570 1 69 . 1 1 11 11 LEU H H 1 8.21 0.02 . 1 . . . . . . . . 5570 1 70 . 1 1 11 11 LEU HA H 1 5.09 0.02 . 1 . . . . . . . . 5570 1 71 . 1 1 11 11 LEU HB2 H 1 1.14 0.02 . 2 . . . . . . . . 5570 1 72 . 1 1 11 11 LEU HB3 H 1 1.08 0.02 . 2 . . . . . . . . 5570 1 73 . 1 1 11 11 LEU HG H 1 1.22 0.02 . 1 . . . . . . . . 5570 1 74 . 1 1 11 11 LEU HD11 H 1 0.76 0.02 . 1 . . . . . . . . 5570 1 75 . 1 1 11 11 LEU HD12 H 1 0.76 0.02 . 1 . . . . . . . . 5570 1 76 . 1 1 11 11 LEU HD13 H 1 0.76 0.02 . 1 . . . . . . . . 5570 1 77 . 1 1 11 11 LEU HD21 H 1 0.76 0.02 . 1 . . . . . . . . 5570 1 78 . 1 1 11 11 LEU HD22 H 1 0.76 0.02 . 1 . . . . . . . . 5570 1 79 . 1 1 11 11 LEU HD23 H 1 0.76 0.02 . 1 . . . . . . . . 5570 1 80 . 1 1 11 11 LEU CA C 13 52.9 0.2 . 1 . . . . . . . . 5570 1 81 . 1 1 11 11 LEU CB C 13 45.3 0.2 . 1 . . . . . . . . 5570 1 82 . 1 1 11 11 LEU CG C 13 24.9 0.2 . 1 . . . . . . . . 5570 1 83 . 1 1 11 11 LEU N N 15 121.3 0.2 . 1 . . . . . . . . 5570 1 84 . 1 1 12 12 VAL H H 1 8.21 0.02 . 1 . . . . . . . . 5570 1 85 . 1 1 12 12 VAL HA H 1 5.53 0.02 . 1 . . . . . . . . 5570 1 86 . 1 1 12 12 VAL HB H 1 1.77 0.02 . 1 . . . . . . . . 5570 1 87 . 1 1 12 12 VAL HG11 H 1 0.60 0.02 . 1 . . . . . . . . 5570 1 88 . 1 1 12 12 VAL HG12 H 1 0.60 0.02 . 1 . . . . . . . . 5570 1 89 . 1 1 12 12 VAL HG13 H 1 0.60 0.02 . 1 . . . . . . . . 5570 1 90 . 1 1 12 12 VAL HG21 H 1 0.65 0.02 . 1 . . . . . . . . 5570 1 91 . 1 1 12 12 VAL HG22 H 1 0.65 0.02 . 1 . . . . . . . . 5570 1 92 . 1 1 12 12 VAL HG23 H 1 0.65 0.02 . 1 . . . . . . . . 5570 1 93 . 1 1 12 12 VAL CA C 13 58.0 0.2 . 1 . . . . . . . . 5570 1 94 . 1 1 12 12 VAL CB C 13 36.2 0.2 . 1 . . . . . . . . 5570 1 95 . 1 1 12 12 VAL CG1 C 13 18.1 0.2 . 1 . . . . . . . . 5570 1 96 . 1 1 12 12 VAL CG2 C 13 20.1 0.2 . 1 . . . . . . . . 5570 1 97 . 1 1 12 12 VAL N N 15 119.6 0.2 . 1 . . . . . . . . 5570 1 98 . 1 1 13 13 ASN H H 1 9.12 0.02 . 1 . . . . . . . . 5570 1 99 . 1 1 13 13 ASN HA H 1 4.83 0.02 . 1 . . . . . . . . 5570 1 100 . 1 1 13 13 ASN HB2 H 1 3.51 0.02 . 2 . . . . . . . . 5570 1 101 . 1 1 13 13 ASN HB3 H 1 2.86 0.02 . 2 . . . . . . . . 5570 1 102 . 1 1 13 13 ASN HD21 H 1 7.75 0.02 . 2 . . . . . . . . 5570 1 103 . 1 1 13 13 ASN HD22 H 1 7.66 0.02 . 2 . . . . . . . . 5570 1 104 . 1 1 13 13 ASN C C 13 175.8 0.2 . 1 . . . . . . . . 5570 1 105 . 1 1 13 13 ASN CA C 13 50.3 0.2 . 1 . . . . . . . . 5570 1 106 . 1 1 13 13 ASN CB C 13 39.1 0.2 . 1 . . . . . . . . 5570 1 107 . 1 1 13 13 ASN N N 15 115.2 0.2 . 1 . . . . . . . . 5570 1 108 . 1 1 13 13 ASN ND2 N 15 112.0 0.2 . 1 . . . . . . . . 5570 1 109 . 1 1 14 14 GLU H H 1 9.12 0.02 . 1 . . . . . . . . 5570 1 110 . 1 1 14 14 GLU HA H 1 4.41 0.02 . 1 . . . . . . . . 5570 1 111 . 1 1 14 14 GLU HB2 H 1 1.69 0.02 . 1 . . . . . . . . 5570 1 112 . 1 1 14 14 GLU HB3 H 1 1.69 0.02 . 1 . . . . . . . . 5570 1 113 . 1 1 14 14 GLU HG2 H 1 2.00 0.02 . 2 . . . . . . . . 5570 1 114 . 1 1 14 14 GLU HG3 H 1 1.93 0.02 . 2 . . . . . . . . 5570 1 115 . 1 1 14 14 GLU C C 13 176.3 0.2 . 1 . . . . . . . . 5570 1 116 . 1 1 14 14 GLU CA C 13 59.0 0.2 . 1 . . . . . . . . 5570 1 117 . 1 1 14 14 GLU CB C 13 28.5 0.2 . 1 . . . . . . . . 5570 1 118 . 1 1 14 14 GLU CG C 13 35.7 0.2 . 1 . . . . . . . . 5570 1 119 . 1 1 14 14 GLU N N 15 113.0 0.2 . 1 . . . . . . . . 5570 1 120 . 1 1 15 15 ARG H H 1 7.62 0.02 . 1 . . . . . . . . 5570 1 121 . 1 1 15 15 ARG HA H 1 4.54 0.02 . 1 . . . . . . . . 5570 1 122 . 1 1 15 15 ARG HG2 H 1 1.52 0.02 . 1 . . . . . . . . 5570 1 123 . 1 1 15 15 ARG HG3 H 1 1.52 0.02 . 1 . . . . . . . . 5570 1 124 . 1 1 15 15 ARG HD2 H 1 3.22 0.02 . 1 . . . . . . . . 5570 1 125 . 1 1 15 15 ARG HD3 H 1 3.22 0.02 . 1 . . . . . . . . 5570 1 126 . 1 1 15 15 ARG CA C 13 55.1 0.2 . 1 . . . . . . . . 5570 1 127 . 1 1 15 15 ARG CB C 13 30.4 0.2 . 1 . . . . . . . . 5570 1 128 . 1 1 15 15 ARG CG C 13 28.0 0.2 . 1 . . . . . . . . 5570 1 129 . 1 1 15 15 ARG CD C 13 43.5 0.2 . 1 . . . . . . . . 5570 1 130 . 1 1 15 15 ARG N N 15 118.4 0.2 . 1 . . . . . . . . 5570 1 131 . 1 1 16 16 ASP H H 1 8.28 0.02 . 1 . . . . . . . . 5570 1 132 . 1 1 16 16 ASP HA H 1 3.65 0.02 . 1 . . . . . . . . 5570 1 133 . 1 1 16 16 ASP HB2 H 1 3.05 0.02 . 2 . . . . . . . . 5570 1 134 . 1 1 16 16 ASP HB3 H 1 1.77 0.02 . 2 . . . . . . . . 5570 1 135 . 1 1 16 16 ASP C C 13 175.3 0.2 . 1 . . . . . . . . 5570 1 136 . 1 1 16 16 ASP CA C 13 54.7 0.2 . 1 . . . . . . . . 5570 1 137 . 1 1 16 16 ASP CB C 13 39.7 0.2 . 1 . . . . . . . . 5570 1 138 . 1 1 16 16 ASP N N 15 118.9 0.2 . 1 . . . . . . . . 5570 1 139 . 1 1 17 17 GLU H H 1 7.33 0.02 . 1 . . . . . . . . 5570 1 140 . 1 1 17 17 GLU HA H 1 4.42 0.02 . 1 . . . . . . . . 5570 1 141 . 1 1 17 17 GLU HB2 H 1 2.10 0.02 . 4 . . . . . . . . 5570 1 142 . 1 1 17 17 GLU HB3 H 1 1.91 0.02 . 4 . . . . . . . . 5570 1 143 . 1 1 17 17 GLU HG2 H 1 1.74 0.02 . 4 . . . . . . . . 5570 1 144 . 1 1 17 17 GLU HG3 H 1 1.50 0.02 . 4 . . . . . . . . 5570 1 145 . 1 1 17 17 GLU CA C 13 53.7 0.2 . 1 . . . . . . . . 5570 1 146 . 1 1 17 17 GLU N N 15 115.1 0.2 . 1 . . . . . . . . 5570 1 147 . 1 1 18 18 VAL HA H 1 4.21 0.2 . 1 . . . . . . . . 5570 1 148 . 1 1 18 18 VAL HB H 1 1.92 0.02 . 1 . . . . . . . . 5570 1 149 . 1 1 18 18 VAL HG11 H 1 1.09 0.02 . 1 . . . . . . . . 5570 1 150 . 1 1 18 18 VAL HG12 H 1 1.09 0.02 . 1 . . . . . . . . 5570 1 151 . 1 1 18 18 VAL HG13 H 1 1.09 0.02 . 1 . . . . . . . . 5570 1 152 . 1 1 18 18 VAL HG21 H 1 0.96 0.02 . 1 . . . . . . . . 5570 1 153 . 1 1 18 18 VAL HG22 H 1 0.96 0.02 . 1 . . . . . . . . 5570 1 154 . 1 1 18 18 VAL HG23 H 1 0.96 0.02 . 1 . . . . . . . . 5570 1 155 . 1 1 18 18 VAL C C 13 178.3 0.2 . 1 . . . . . . . . 5570 1 156 . 1 1 18 18 VAL CA C 13 64.3 0.2 . 1 . . . . . . . . 5570 1 157 . 1 1 18 18 VAL CB C 13 31.7 0.2 . 1 . . . . . . . . 5570 1 158 . 1 1 18 18 VAL CG1 C 13 21.7 0.3 . 1 . . . . . . . . 5570 1 159 . 1 1 18 18 VAL CG2 C 13 22.0 0.3 . 1 . . . . . . . . 5570 1 160 . 1 1 19 19 VAL H H 1 9.29 0.02 . 1 . . . . . . . . 5570 1 161 . 1 1 19 19 VAL HA H 1 4.64 0.02 . 1 . . . . . . . . 5570 1 162 . 1 1 19 19 VAL HB H 1 2.47 0.02 . 1 . . . . . . . . 5570 1 163 . 1 1 19 19 VAL HG11 H 1 0.94 0.02 . 1 . . . . . . . . 5570 1 164 . 1 1 19 19 VAL HG12 H 1 0.94 0.02 . 1 . . . . . . . . 5570 1 165 . 1 1 19 19 VAL HG13 H 1 0.94 0.02 . 1 . . . . . . . . 5570 1 166 . 1 1 19 19 VAL HG21 H 1 0.60 0.02 . 1 . . . . . . . . 5570 1 167 . 1 1 19 19 VAL HG22 H 1 0.60 0.02 . 1 . . . . . . . . 5570 1 168 . 1 1 19 19 VAL HG23 H 1 0.60 0.02 . 1 . . . . . . . . 5570 1 169 . 1 1 19 19 VAL C C 13 175.7 0.2 . 1 . . . . . . . . 5570 1 170 . 1 1 19 19 VAL CA C 13 60.5 0.2 . 1 . . . . . . . . 5570 1 171 . 1 1 19 19 VAL CB C 13 33.3 0.2 . 1 . . . . . . . . 5570 1 172 . 1 1 19 19 VAL CG1 C 13 21.7 0.2 . 1 . . . . . . . . 5570 1 173 . 1 1 19 19 VAL CG2 C 13 17.3 0.2 . 1 . . . . . . . . 5570 1 174 . 1 1 19 19 VAL N N 15 119.3 0.2 . 1 . . . . . . . . 5570 1 175 . 1 1 20 20 GLY H H 1 7.70 0.02 . 1 . . . . . . . . 5570 1 176 . 1 1 20 20 GLY HA2 H 1 4.18 0.02 . 2 . . . . . . . . 5570 1 177 . 1 1 20 20 GLY HA3 H 1 4.04 0.02 . 2 . . . . . . . . 5570 1 178 . 1 1 20 20 GLY C C 13 171.3 0.2 . 1 . . . . . . . . 5570 1 179 . 1 1 20 20 GLY CA C 13 45.9 0.2 . 1 . . . . . . . . 5570 1 180 . 1 1 20 20 GLY N N 15 109.2 0.2 . 1 . . . . . . . . 5570 1 181 . 1 1 21 21 GLN H H 1 8.53 0.02 . 1 . . . . . . . . 5570 1 182 . 1 1 21 21 GLN HA H 1 5.47 0.02 . 1 . . . . . . . . 5570 1 183 . 1 1 21 21 GLN HB2 H 1 2.03 0.02 . 2 . . . . . . . . 5570 1 184 . 1 1 21 21 GLN HB3 H 1 1.90 0.02 . 2 . . . . . . . . 5570 1 185 . 1 1 21 21 GLN HG2 H 1 2.45 0.02 . 2 . . . . . . . . 5570 1 186 . 1 1 21 21 GLN HG3 H 1 2.34 0.02 . 2 . . . . . . . . 5570 1 187 . 1 1 21 21 GLN HE21 H 1 7.51 0.02 . 2 . . . . . . . . 5570 1 188 . 1 1 21 21 GLN HE22 H 1 6.83 0.02 . 2 . . . . . . . . 5570 1 189 . 1 1 21 21 GLN C C 13 172.7 0.2 . 1 . . . . . . . . 5570 1 190 . 1 1 21 21 GLN CA C 13 55.6 0.2 . 1 . . . . . . . . 5570 1 191 . 1 1 21 21 GLN CB C 13 34.3 0.2 . 1 . . . . . . . . 5570 1 192 . 1 1 21 21 GLN CG C 13 34.8 0.2 . 1 . . . . . . . . 5570 1 193 . 1 1 21 21 GLN N N 15 118.9 0.2 . 1 . . . . . . . . 5570 1 194 . 1 1 21 21 GLN NE2 N 15 112.0 0.2 . 1 . . . . . . . . 5570 1 195 . 1 1 22 22 ILE H H 1 9.32 0.02 . 1 . . . . . . . . 5570 1 196 . 1 1 22 22 ILE HA H 1 4.61 0.02 . 1 . . . . . . . . 5570 1 197 . 1 1 22 22 ILE HB H 1 1.52 0.03 . 1 . . . . . . . . 5570 1 198 . 1 1 22 22 ILE HG12 H 1 1.68 0.02 . 2 . . . . . . . . 5570 1 199 . 1 1 22 22 ILE HG13 H 1 1.52 0.02 . 2 . . . . . . . . 5570 1 200 . 1 1 22 22 ILE HG21 H 1 0.62 0.02 . 1 . . . . . . . . 5570 1 201 . 1 1 22 22 ILE HG22 H 1 0.62 0.02 . 1 . . . . . . . . 5570 1 202 . 1 1 22 22 ILE HG23 H 1 0.62 0.02 . 1 . . . . . . . . 5570 1 203 . 1 1 22 22 ILE HD11 H 1 0.75 0.02 . 1 . . . . . . . . 5570 1 204 . 1 1 22 22 ILE HD12 H 1 0.75 0.02 . 1 . . . . . . . . 5570 1 205 . 1 1 22 22 ILE HD13 H 1 0.75 0.02 . 1 . . . . . . . . 5570 1 206 . 1 1 22 22 ILE C C 13 172.6 0.2 . 1 . . . . . . . . 5570 1 207 . 1 1 22 22 ILE CA C 13 59.9 0.2 . 1 . . . . . . . . 5570 1 208 . 1 1 22 22 ILE CB C 13 43.6 0.2 . 1 . . . . . . . . 5570 1 209 . 1 1 22 22 ILE CG1 C 13 28.8 0.2 . 1 . . . . . . . . 5570 1 210 . 1 1 22 22 ILE CG2 C 13 15.6 0.2 . 1 . . . . . . . . 5570 1 211 . 1 1 22 22 ILE CD1 C 13 14.7 0.2 . 1 . . . . . . . . 5570 1 212 . 1 1 22 22 ILE N N 15 120.8 0.2 . 1 . . . . . . . . 5570 1 213 . 1 1 23 23 LEU H H 1 8.68 0.02 . 1 . . . . . . . . 5570 1 214 . 1 1 23 23 LEU HA H 1 4.72 0.02 . 1 . . . . . . . . 5570 1 215 . 1 1 23 23 LEU HB2 H 1 1.72 0.02 . 4 . . . . . . . . 5570 1 216 . 1 1 23 23 LEU HB3 H 1 1.52 0.02 . 4 . . . . . . . . 5570 1 217 . 1 1 23 23 LEU C C 13 178.7 0.2 . 1 . . . . . . . . 5570 1 218 . 1 1 23 23 LEU CA C 13 55.7 0.2 . 1 . . . . . . . . 5570 1 219 . 1 1 23 23 LEU CB C 13 42.5 0.2 . 1 . . . . . . . . 5570 1 220 . 1 1 23 23 LEU N N 15 125.3 0.2 . 1 . . . . . . . . 5570 1 221 . 1 1 24 24 ARG H H 1 8.63 0.02 . 1 . . . . . . . . 5570 1 222 . 1 1 24 24 ARG HA H 1 3.83 0.02 . 1 . . . . . . . . 5570 1 223 . 1 1 24 24 ARG HD2 H 1 3.22 0.02 . 1 . . . . . . . . 5570 1 224 . 1 1 24 24 ARG HD3 H 1 3.22 0.02 . 1 . . . . . . . . 5570 1 225 . 1 1 24 24 ARG C C 13 176.2 0.2 . 1 . . . . . . . . 5570 1 226 . 1 1 24 24 ARG CA C 13 58.5 0.2 . 1 . . . . . . . . 5570 1 227 . 1 1 24 24 ARG CB C 13 30.3 0.2 . 1 . . . . . . . . 5570 1 228 . 1 1 24 24 ARG CG C 13 27.5 0.2 . 1 . . . . . . . . 5570 1 229 . 1 1 24 24 ARG N N 15 120.1 0.2 . 1 . . . . . . . . 5570 1 230 . 1 1 25 25 THR H H 1 7.28 0.02 . 1 . . . . . . . . 5570 1 231 . 1 1 25 25 THR HA H 1 4.19 0.02 . 1 . . . . . . . . 5570 1 232 . 1 1 25 25 THR HB H 1 4.58 0.02 . 1 . . . . . . . . 5570 1 233 . 1 1 25 25 THR HG21 H 1 1.25 0.02 . 1 . . . . . . . . 5570 1 234 . 1 1 25 25 THR HG22 H 1 1.25 0.02 . 1 . . . . . . . . 5570 1 235 . 1 1 25 25 THR HG23 H 1 1.25 0.02 . 1 . . . . . . . . 5570 1 236 . 1 1 25 25 THR C C 13 174.6 0.2 . 1 . . . . . . . . 5570 1 237 . 1 1 25 25 THR CA C 13 60.5 0.2 . 1 . . . . . . . . 5570 1 238 . 1 1 25 25 THR CB C 13 69.2 0.2 . 1 . . . . . . . . 5570 1 239 . 1 1 25 25 THR CG2 C 13 21.9 0.2 . 1 . . . . . . . . 5570 1 240 . 1 1 25 25 THR N N 15 102.5 0.2 . 1 . . . . . . . . 5570 1 241 . 1 1 26 26 ASP H H 1 7.56 0.02 . 1 . . . . . . . . 5570 1 242 . 1 1 26 26 ASP HB2 H 1 2.83 0.02 . 1 . . . . . . . . 5570 1 243 . 1 1 26 26 ASP HB3 H 1 2.70 0.02 . 1 . . . . . . . . 5570 1 244 . 1 1 26 26 ASP N N 15 124.5 0.2 . 1 . . . . . . . . 5570 1 245 . 1 1 27 27 PRO HA H 1 4.42 0.02 . 1 . . . . . . . . 5570 1 246 . 1 1 27 27 PRO HB2 H 1 2.40 0.02 . 2 . . . . . . . . 5570 1 247 . 1 1 27 27 PRO HB3 H 1 2.04 0.02 . 2 . . . . . . . . 5570 1 248 . 1 1 27 27 PRO HG2 H 1 2.07 0.02 . 1 . . . . . . . . 5570 1 249 . 1 1 27 27 PRO HG3 H 1 2.07 0.02 . 1 . . . . . . . . 5570 1 250 . 1 1 27 27 PRO HD2 H 1 4.04 0.02 . 2 . . . . . . . . 5570 1 251 . 1 1 27 27 PRO HD3 H 1 3.88 0.02 . 2 . . . . . . . . 5570 1 252 . 1 1 27 27 PRO C C 13 177.1 0.2 . 1 . . . . . . . . 5570 1 253 . 1 1 27 27 PRO CA C 13 64.3 0.2 . 1 . . . . . . . . 5570 1 254 . 1 1 27 27 PRO CB C 13 32.3 0.2 . 1 . . . . . . . . 5570 1 255 . 1 1 27 27 PRO CG C 13 27.5 0.2 . 1 . . . . . . . . 5570 1 256 . 1 1 27 27 PRO CD C 13 51.7 0.2 . 1 . . . . . . . . 5570 1 257 . 1 1 28 28 ALA H H 1 9.22 0.02 . 1 . . . . . . . . 5570 1 258 . 1 1 28 28 ALA HA H 1 4.31 0.02 . 1 . . . . . . . . 5570 1 259 . 1 1 28 28 ALA HB1 H 1 1.38 0.02 . 1 . . . . . . . . 5570 1 260 . 1 1 28 28 ALA HB2 H 1 1.38 0.02 . 1 . . . . . . . . 5570 1 261 . 1 1 28 28 ALA HB3 H 1 1.38 0.02 . 1 . . . . . . . . 5570 1 262 . 1 1 28 28 ALA C C 13 177.4 0.2 . 1 . . . . . . . . 5570 1 263 . 1 1 28 28 ALA CA C 13 51.9 0.2 . 1 . . . . . . . . 5570 1 264 . 1 1 28 28 ALA CB C 13 18.6 0.2 . 1 . . . . . . . . 5570 1 265 . 1 1 28 28 ALA N N 15 120.4 0.2 . 1 . . . . . . . . 5570 1 266 . 1 1 29 29 LEU H H 1 7.46 0.02 . 1 . . . . . . . . 5570 1 267 . 1 1 29 29 LEU HA H 1 3.61 0.02 . 1 . . . . . . . . 5570 1 268 . 1 1 29 29 LEU HB2 H 1 1.54 0.02 . 2 . . . . . . . . 5570 1 269 . 1 1 29 29 LEU HB3 H 1 1.43 0.02 . 2 . . . . . . . . 5570 1 270 . 1 1 29 29 LEU HG H 1 0.70 0.02 . 1 . . . . . . . . 5570 1 271 . 1 1 29 29 LEU HD11 H 1 0.43 0.02 . 1 . . . . . . . . 5570 1 272 . 1 1 29 29 LEU HD12 H 1 0.43 0.02 . 1 . . . . . . . . 5570 1 273 . 1 1 29 29 LEU HD13 H 1 0.43 0.02 . 1 . . . . . . . . 5570 1 274 . 1 1 29 29 LEU HD21 H 1 -0.23 0.02 . 1 . . . . . . . . 5570 1 275 . 1 1 29 29 LEU HD22 H 1 -0.23 0.02 . 1 . . . . . . . . 5570 1 276 . 1 1 29 29 LEU HD23 H 1 -0.23 0.02 . 1 . . . . . . . . 5570 1 277 . 1 1 29 29 LEU C C 13 175.8 0.2 . 1 . . . . . . . . 5570 1 278 . 1 1 29 29 LEU CA C 13 58.0 0.2 . 1 . . . . . . . . 5570 1 279 . 1 1 29 29 LEU CB C 13 42.0 0.2 . 1 . . . . . . . . 5570 1 280 . 1 1 29 29 LEU CG C 13 27.4 0.2 . 1 . . . . . . . . 5570 1 281 . 1 1 29 29 LEU CD1 C 13 26.0 0.2 . 1 . . . . . . . . 5570 1 282 . 1 1 29 29 LEU CD2 C 13 24.1 0.2 . 1 . . . . . . . . 5570 1 283 . 1 1 29 29 LEU N N 15 121.4 0.2 . 1 . . . . . . . . 5570 1 284 . 1 1 30 30 ARG H H 1 7.86 0.02 . 1 . . . . . . . . 5570 1 285 . 1 1 30 30 ARG HA H 1 4.61 0.02 . 1 . . . . . . . . 5570 1 286 . 1 1 30 30 ARG C C 13 176.5 0.2 . 1 . . . . . . . . 5570 1 287 . 1 1 30 30 ARG CA C 13 53.8 0.2 . 1 . . . . . . . . 5570 1 288 . 1 1 30 30 ARG CB C 13 31.7 0.2 . 1 . . . . . . . . 5570 1 289 . 1 1 30 30 ARG CG C 13 26.5 0.2 . 1 . . . . . . . . 5570 1 290 . 1 1 30 30 ARG N N 15 126.8 0.2 . 1 . . . . . . . . 5570 1 291 . 1 1 31 31 TRP H H 1 8.65 0.02 . 1 . . . . . . . . 5570 1 292 . 1 1 31 31 TRP HA H 1 4.13 0.02 . 1 . . . . . . . . 5570 1 293 . 1 1 31 31 TRP HB2 H 1 3.33 0.02 . 2 . . . . . . . . 5570 1 294 . 1 1 31 31 TRP HB3 H 1 2.99 0.02 . 2 . . . . . . . . 5570 1 295 . 1 1 31 31 TRP HD1 H 1 7.45 0.02 . 1 . . . . . . . . 5570 1 296 . 1 1 31 31 TRP HE1 H 1 10.08 0.02 . 1 . . . . . . . . 5570 1 297 . 1 1 31 31 TRP C C 13 177.4 0.2 . 1 . . . . . . . . 5570 1 298 . 1 1 31 31 TRP CA C 13 60.9 0.2 . 1 . . . . . . . . 5570 1 299 . 1 1 31 31 TRP CB C 13 28.0 0.2 . 1 . . . . . . . . 5570 1 300 . 1 1 31 31 TRP N N 15 124.3 0.2 . 1 . . . . . . . . 5570 1 301 . 1 1 31 31 TRP NE1 N 15 127.4 0.2 . 1 . . . . . . . . 5570 1 302 . 1 1 32 32 GLU H H 1 9.72 0.02 . 1 . . . . . . . . 5570 1 303 . 1 1 32 32 GLU HA H 1 4.60 0.02 . 1 . . . . . . . . 5570 1 304 . 1 1 32 32 GLU HB2 H 1 2.19 0.02 . 2 . . . . . . . . 5570 1 305 . 1 1 32 32 GLU HB3 H 1 1.98 0.02 . 2 . . . . . . . . 5570 1 306 . 1 1 32 32 GLU HG2 H 1 2.47 0.02 . 1 . . . . . . . . 5570 1 307 . 1 1 32 32 GLU HG3 H 1 2.47 0.02 . 1 . . . . . . . . 5570 1 308 . 1 1 32 32 GLU C C 13 174.9 0.2 . 1 . . . . . . . . 5570 1 309 . 1 1 32 32 GLU CA C 13 58.0 0.2 . 1 . . . . . . . . 5570 1 310 . 1 1 32 32 GLU CB C 13 27.0 0.2 . 1 . . . . . . . . 5570 1 311 . 1 1 32 32 GLU N N 15 117.7 0.2 . 1 . . . . . . . . 5570 1 312 . 1 1 33 33 ARG H H 1 7.84 0.02 . 1 . . . . . . . . 5570 1 313 . 1 1 33 33 ARG HA H 1 4.61 0.02 . 1 . . . . . . . . 5570 1 314 . 1 1 33 33 ARG CA C 13 55.1 0.2 . 1 . . . . . . . . 5570 1 315 . 1 1 33 33 ARG CB C 13 31.4 0.2 . 1 . . . . . . . . 5570 1 316 . 1 1 33 33 ARG N N 15 116.2 0.2 . 1 . . . . . . . . 5570 1 317 . 1 1 34 34 VAL H H 1 7.70 0.02 . 1 . . . . . . . . 5570 1 318 . 1 1 34 34 VAL HA H 1 5.18 0.02 . 1 . . . . . . . . 5570 1 319 . 1 1 34 34 VAL HB H 1 2.65 0.02 . 1 . . . . . . . . 5570 1 320 . 1 1 34 34 VAL HG11 H 1 0.79 0.02 . 1 . . . . . . . . 5570 1 321 . 1 1 34 34 VAL HG12 H 1 0.79 0.02 . 1 . . . . . . . . 5570 1 322 . 1 1 34 34 VAL HG13 H 1 0.79 0.02 . 1 . . . . . . . . 5570 1 323 . 1 1 34 34 VAL HG21 H 1 0.87 0.02 . 1 . . . . . . . . 5570 1 324 . 1 1 34 34 VAL HG22 H 1 0.87 0.02 . 1 . . . . . . . . 5570 1 325 . 1 1 34 34 VAL HG23 H 1 0.87 0.02 . 1 . . . . . . . . 5570 1 326 . 1 1 34 34 VAL C C 13 173.4 0.2 . 1 . . . . . . . . 5570 1 327 . 1 1 34 34 VAL CA C 13 59.4 0.2 . 1 . . . . . . . . 5570 1 328 . 1 1 34 34 VAL CB C 13 36.0 0.2 . 1 . . . . . . . . 5570 1 329 . 1 1 34 34 VAL CG1 C 13 21.7 0.2 . 1 . . . . . . . . 5570 1 330 . 1 1 34 34 VAL CG2 C 13 20.7 0.2 . 1 . . . . . . . . 5570 1 331 . 1 1 34 34 VAL N N 15 110.4 0.2 . 1 . . . . . . . . 5570 1 332 . 1 1 35 35 ARG H H 1 9.57 0.02 . 1 . . . . . . . . 5570 1 333 . 1 1 35 35 ARG HA H 1 5.45 0.02 . 1 . . . . . . . . 5570 1 334 . 1 1 35 35 ARG HB2 H 1 1.72 0.02 . 2 . . . . . . . . 5570 1 335 . 1 1 35 35 ARG HB3 H 1 1.67 0.02 . 2 . . . . . . . . 5570 1 336 . 1 1 35 35 ARG C C 13 177.2 0.2 . 1 . . . . . . . . 5570 1 337 . 1 1 35 35 ARG CA C 13 54.8 0.2 . 1 . . . . . . . . 5570 1 338 . 1 1 35 35 ARG CB C 13 34.1 0.2 . 1 . . . . . . . . 5570 1 339 . 1 1 35 35 ARG N N 15 117.6 0.2 . 1 . . . . . . . . 5570 1 340 . 1 1 36 36 VAL H H 1 9.33 0.02 . 1 . . . . . . . . 5570 1 341 . 1 1 36 36 VAL HA H 1 5.14 0.02 . 1 . . . . . . . . 5570 1 342 . 1 1 36 36 VAL HB H 1 2.23 0.02 . 1 . . . . . . . . 5570 1 343 . 1 1 36 36 VAL HG11 H 1 1.03 0.02 . 1 . . . . . . . . 5570 1 344 . 1 1 36 36 VAL HG12 H 1 1.03 0.02 . 1 . . . . . . . . 5570 1 345 . 1 1 36 36 VAL HG13 H 1 1.03 0.02 . 1 . . . . . . . . 5570 1 346 . 1 1 36 36 VAL HG21 H 1 0.90 0.02 . 1 . . . . . . . . 5570 1 347 . 1 1 36 36 VAL HG22 H 1 0.90 0.02 . 1 . . . . . . . . 5570 1 348 . 1 1 36 36 VAL HG23 H 1 0.90 0.02 . 1 . . . . . . . . 5570 1 349 . 1 1 36 36 VAL CA C 13 59.5 0.2 . 1 . . . . . . . . 5570 1 350 . 1 1 36 36 VAL CB C 13 35.6 0.2 . 1 . . . . . . . . 5570 1 351 . 1 1 36 36 VAL CG1 C 13 20.9 0.2 . 1 . . . . . . . . 5570 1 352 . 1 1 36 36 VAL CG2 C 13 20.7 0.2 . 1 . . . . . . . . 5570 1 353 . 1 1 36 36 VAL N N 15 112.7 0.2 . 1 . . . . . . . . 5570 1 354 . 1 1 37 37 VAL H H 1 8.71 0.02 . 1 . . . . . . . . 5570 1 355 . 1 1 37 37 VAL HA H 1 5.35 0.02 . 1 . . . . . . . . 5570 1 356 . 1 1 37 37 VAL HB H 1 2.21 0.02 . 1 . . . . . . . . 5570 1 357 . 1 1 37 37 VAL HG11 H 1 1.30 0.02 . 1 . . . . . . . . 5570 1 358 . 1 1 37 37 VAL HG12 H 1 1.30 0.02 . 1 . . . . . . . . 5570 1 359 . 1 1 37 37 VAL HG13 H 1 1.30 0.02 . 1 . . . . . . . . 5570 1 360 . 1 1 37 37 VAL HG21 H 1 1.04 0.02 . 1 . . . . . . . . 5570 1 361 . 1 1 37 37 VAL HG22 H 1 1.04 0.02 . 1 . . . . . . . . 5570 1 362 . 1 1 37 37 VAL HG23 H 1 1.04 0.02 . 1 . . . . . . . . 5570 1 363 . 1 1 37 37 VAL C C 13 174.2 0.2 . 1 . . . . . . . . 5570 1 364 . 1 1 37 37 VAL CA C 13 59.4 0.2 . 1 . . . . . . . . 5570 1 365 . 1 1 37 37 VAL CB C 13 35.9 0.2 . 1 . . . . . . . . 5570 1 366 . 1 1 37 37 VAL CG1 C 13 23.6 0.2 . 1 . . . . . . . . 5570 1 367 . 1 1 37 37 VAL CG2 C 13 20.0 0.2 . 1 . . . . . . . . 5570 1 368 . 1 1 37 37 VAL N N 15 110.5 0.2 . 1 . . . . . . . . 5570 1 369 . 1 1 38 38 ASN H H 1 8.06 0.02 . 1 . . . . . . . . 5570 1 370 . 1 1 38 38 ASN HA H 1 5.66 0.02 . 1 . . . . . . . . 5570 1 371 . 1 1 38 38 ASN HB2 H 1 2.18 0.02 . 1 . . . . . . . . 5570 1 372 . 1 1 38 38 ASN HB3 H 1 2.18 0.02 . 1 . . . . . . . . 5570 1 373 . 1 1 38 38 ASN HD21 H 1 7.35 0.02 . 2 . . . . . . . . 5570 1 374 . 1 1 38 38 ASN HD22 H 1 6.67 0.02 . 2 . . . . . . . . 5570 1 375 . 1 1 38 38 ASN C C 13 173.7 0.2 . 1 . . . . . . . . 5570 1 376 . 1 1 38 38 ASN CA C 13 52.4 0.2 . 1 . . . . . . . . 5570 1 377 . 1 1 38 38 ASN CB C 13 46.3 0.2 . 1 . . . . . . . . 5570 1 378 . 1 1 38 38 ASN N N 15 117.6 0.2 . 1 . . . . . . . . 5570 1 379 . 1 1 38 38 ASN ND2 N 15 110.0 0.2 . 1 . . . . . . . . 5570 1 380 . 1 1 39 39 ALA H H 1 9.16 0.02 . 1 . . . . . . . . 5570 1 381 . 1 1 39 39 ALA HA H 1 5.50 0.02 . 1 . . . . . . . . 5570 1 382 . 1 1 39 39 ALA HB1 H 1 1.20 0.02 . 1 . . . . . . . . 5570 1 383 . 1 1 39 39 ALA HB2 H 1 1.20 0.02 . 1 . . . . . . . . 5570 1 384 . 1 1 39 39 ALA HB3 H 1 1.20 0.02 . 1 . . . . . . . . 5570 1 385 . 1 1 39 39 ALA C C 13 174.4 0.2 . 1 . . . . . . . . 5570 1 386 . 1 1 39 39 ALA CA C 13 50.5 0.2 . 1 . . . . . . . . 5570 1 387 . 1 1 39 39 ALA CB C 13 24.7 0.2 . 1 . . . . . . . . 5570 1 388 . 1 1 39 39 ALA N N 15 120.0 0.2 . 1 . . . . . . . . 5570 1 389 . 1 1 40 40 PHE H H 1 8.49 0.02 . 1 . . . . . . . . 5570 1 390 . 1 1 40 40 PHE HA H 1 5.12 0.02 . 1 . . . . . . . . 5570 1 391 . 1 1 40 40 PHE HB2 H 1 3.16 0.02 . 1 . . . . . . . . 5570 1 392 . 1 1 40 40 PHE HB3 H 1 3.16 0.02 . 1 . . . . . . . . 5570 1 393 . 1 1 40 40 PHE HD1 H 1 7.24 0.02 . 1 . . . . . . . . 5570 1 394 . 1 1 40 40 PHE HD2 H 1 7.24 0.02 . 1 . . . . . . . . 5570 1 395 . 1 1 40 40 PHE HE1 H 1 7.05 0.02 . 1 . . . . . . . . 5570 1 396 . 1 1 40 40 PHE HE2 H 1 7.05 0.02 . 1 . . . . . . . . 5570 1 397 . 1 1 40 40 PHE C C 13 174.3 0.2 . 1 . . . . . . . . 5570 1 398 . 1 1 40 40 PHE CA C 13 56.6 0.2 . 1 . . . . . . . . 5570 1 399 . 1 1 40 40 PHE CB C 13 43.5 0.2 . 1 . . . . . . . . 5570 1 400 . 1 1 40 40 PHE N N 15 114.9 0.2 . 1 . . . . . . . . 5570 1 401 . 1 1 41 41 LEU H H 1 9.14 0.02 . 1 . . . . . . . . 5570 1 402 . 1 1 41 41 LEU HA H 1 5.40 0.02 . 1 . . . . . . . . 5570 1 403 . 1 1 41 41 LEU HB2 H 1 2.24 0.02 . 2 . . . . . . . . 5570 1 404 . 1 1 41 41 LEU HB3 H 1 1.41 0.02 . 2 . . . . . . . . 5570 1 405 . 1 1 41 41 LEU HD11 H 1 0.99 0.02 . 1 . . . . . . . . 5570 1 406 . 1 1 41 41 LEU HD12 H 1 0.99 0.02 . 1 . . . . . . . . 5570 1 407 . 1 1 41 41 LEU HD13 H 1 0.99 0.02 . 1 . . . . . . . . 5570 1 408 . 1 1 41 41 LEU HD21 H 1 0.81 0.02 . 1 . . . . . . . . 5570 1 409 . 1 1 41 41 LEU HD22 H 1 0.81 0.02 . 1 . . . . . . . . 5570 1 410 . 1 1 41 41 LEU HD23 H 1 0.81 0.02 . 1 . . . . . . . . 5570 1 411 . 1 1 41 41 LEU C C 13 173.9 0.2 . 1 . . . . . . . . 5570 1 412 . 1 1 41 41 LEU CA C 13 54.3 0.2 . 1 . . . . . . . . 5570 1 413 . 1 1 41 41 LEU CB C 13 44.4 0.2 . 1 . . . . . . . . 5570 1 414 . 1 1 41 41 LEU N N 15 123.9 0.2 . 1 . . . . . . . . 5570 1 415 . 1 1 42 42 ARG H H 1 9.39 0.02 . 1 . . . . . . . . 5570 1 416 . 1 1 42 42 ARG HA H 1 6.04 0.02 . 1 . . . . . . . . 5570 1 417 . 1 1 42 42 ARG HB2 H 1 1.74 0.02 . 2 . . . . . . . . 5570 1 418 . 1 1 42 42 ARG HB3 H 1 1.56 0.02 . 2 . . . . . . . . 5570 1 419 . 1 1 42 42 ARG C C 13 175.8 0.2 . 1 . . . . . . . . 5570 1 420 . 1 1 42 42 ARG CA C 13 54.6 0.2 . 1 . . . . . . . . 5570 1 421 . 1 1 42 42 ARG CB C 13 35.2 0.2 . 1 . . . . . . . . 5570 1 422 . 1 1 42 42 ARG CG C 13 27.0 0.2 . 1 . . . . . . . . 5570 1 423 . 1 1 42 42 ARG CD C 13 44.5 0.2 . 1 . . . . . . . . 5570 1 424 . 1 1 42 42 ARG N N 15 127.4 0.2 . 1 . . . . . . . . 5570 1 425 . 1 1 43 43 ASN H H 1 9.01 0.02 . 1 . . . . . . . . 5570 1 426 . 1 1 43 43 ASN HA H 1 5.05 0.02 . 1 . . . . . . . . 5570 1 427 . 1 1 43 43 ASN HB2 H 1 3.43 0.02 . 2 . . . . . . . . 5570 1 428 . 1 1 43 43 ASN HB3 H 1 2.68 0.02 . 2 . . . . . . . . 5570 1 429 . 1 1 43 43 ASN HD21 H 1 7.15 0.02 . 2 . . . . . . . . 5570 1 430 . 1 1 43 43 ASN HD22 H 1 5.96 0.02 . 2 . . . . . . . . 5570 1 431 . 1 1 43 43 ASN C C 13 178.9 0.2 . 1 . . . . . . . . 5570 1 432 . 1 1 43 43 ASN CA C 13 51.3 0.2 . 1 . . . . . . . . 5570 1 433 . 1 1 43 43 ASN CB C 13 39.6 0.2 . 1 . . . . . . . . 5570 1 434 . 1 1 43 43 ASN N N 15 125.0 0.2 . 1 . . . . . . . . 5570 1 435 . 1 1 43 43 ASN ND2 N 15 110.6 0.2 . 1 . . . . . . . . 5570 1 436 . 1 1 44 44 SER H H 1 9.47 0.02 . 1 . . . . . . . . 5570 1 437 . 1 1 44 44 SER CA C 13 61.1 0.2 . 1 . . . . . . . . 5570 1 438 . 1 1 44 44 SER CB C 13 62.9 0.2 . 1 . . . . . . . . 5570 1 439 . 1 1 44 44 SER N N 15 113.9 0.2 . 1 . . . . . . . . 5570 1 440 . 1 1 45 45 GLN H H 1 7.46 0.02 . 1 . . . . . . . . 5570 1 441 . 1 1 45 45 GLN HA H 1 4.42 0.02 . 1 . . . . . . . . 5570 1 442 . 1 1 45 45 GLN HB2 H 1 2.18 0.02 . 2 . . . . . . . . 5570 1 443 . 1 1 45 45 GLN HB3 H 1 1.80 0.02 . 2 . . . . . . . . 5570 1 444 . 1 1 45 45 GLN HE21 H 1 7.51 0.2 . 1 . . . . . . . . 5570 1 445 . 1 1 45 45 GLN HE22 H 1 6.60 0.2 . 1 . . . . . . . . 5570 1 446 . 1 1 45 45 GLN C C 13 175.9 0.2 . 1 . . . . . . . . 5570 1 447 . 1 1 45 45 GLN CA C 13 55.6 0.2 . 1 . . . . . . . . 5570 1 448 . 1 1 45 45 GLN CB C 13 29.4 0.2 . 1 . . . . . . . . 5570 1 449 . 1 1 45 45 GLN CG C 13 34.3 0.2 . 1 . . . . . . . . 5570 1 450 . 1 1 45 45 GLN N N 15 118.0 0.2 . 1 . . . . . . . . 5570 1 451 . 1 1 45 45 GLN NE2 N 15 110.4 0.2 . 1 . . . . . . . . 5570 1 452 . 1 1 46 46 GLY H H 1 8.06 0.02 . 1 . . . . . . . . 5570 1 453 . 1 1 46 46 GLY HA2 H 1 4.22 0.02 . 2 . . . . . . . . 5570 1 454 . 1 1 46 46 GLY HA3 H 1 3.54 0.02 . 2 . . . . . . . . 5570 1 455 . 1 1 46 46 GLY C C 13 174.6 0.2 . 1 . . . . . . . . 5570 1 456 . 1 1 46 46 GLY CA C 13 45.2 0.2 . 1 . . . . . . . . 5570 1 457 . 1 1 46 46 GLY N N 15 106.6 0.2 . 1 . . . . . . . . 5570 1 458 . 1 1 47 47 GLN H H 1 8.11 0.02 . 1 . . . . . . . . 5570 1 459 . 1 1 47 47 GLN HA H 1 4.61 0.02 . 1 . . . . . . . . 5570 1 460 . 1 1 47 47 GLN HE21 H 1 7.18 0.02 . 2 . . . . . . . . 5570 1 461 . 1 1 47 47 GLN HE22 H 1 6.73 0.02 . 2 . . . . . . . . 5570 1 462 . 1 1 47 47 GLN C C 13 174.1 0.2 . 1 . . . . . . . . 5570 1 463 . 1 1 47 47 GLN CA C 13 55.2 0.2 . 1 . . . . . . . . 5570 1 464 . 1 1 47 47 GLN CB C 13 30.8 0.2 . 1 . . . . . . . . 5570 1 465 . 1 1 47 47 GLN CG C 13 34.3 0.2 . 1 . . . . . . . . 5570 1 466 . 1 1 47 47 GLN N N 15 117.1 0.2 . 1 . . . . . . . . 5570 1 467 . 1 1 48 48 LEU H H 1 9.22 0.02 . 1 . . . . . . . . 5570 1 468 . 1 1 48 48 LEU HA H 1 5.76 0.02 . 1 . . . . . . . . 5570 1 469 . 1 1 48 48 LEU HG H 1 1.46 0.02 . 1 . . . . . . . . 5570 1 470 . 1 1 48 48 LEU HD11 H 1 0.38 0.02 . 1 . . . . . . . . 5570 1 471 . 1 1 48 48 LEU HD12 H 1 0.38 0.02 . 1 . . . . . . . . 5570 1 472 . 1 1 48 48 LEU HD13 H 1 0.38 0.02 . 1 . . . . . . . . 5570 1 473 . 1 1 48 48 LEU HD21 H 1 0.26 0.02 . 1 . . . . . . . . 5570 1 474 . 1 1 48 48 LEU HD22 H 1 0.26 0.02 . 1 . . . . . . . . 5570 1 475 . 1 1 48 48 LEU HD23 H 1 0.26 0.02 . 1 . . . . . . . . 5570 1 476 . 1 1 48 48 LEU C C 13 176.6 0.2 . 1 . . . . . . . . 5570 1 477 . 1 1 48 48 LEU CA C 13 51.9 0.2 . 1 . . . . . . . . 5570 1 478 . 1 1 48 48 LEU CB C 13 44.4 0.2 . 1 . . . . . . . . 5570 1 479 . 1 1 48 48 LEU CG C 13 27.5 0.2 . 1 . . . . . . . . 5570 1 480 . 1 1 48 48 LEU CD1 C 13 21.7 0.2 . 1 . . . . . . . . 5570 1 481 . 1 1 48 48 LEU CD2 C 13 25.2 0.2 . 1 . . . . . . . . 5570 1 482 . 1 1 48 48 LEU N N 15 119.3 0.2 . 1 . . . . . . . . 5570 1 483 . 1 1 49 49 TRP H H 1 8.68 0.02 . 1 . . . . . . . . 5570 1 484 . 1 1 49 49 TRP HA H 1 3.99 0.02 . 1 . . . . . . . . 5570 1 485 . 1 1 49 49 TRP HB2 H 1 2.34 0.02 . 1 . . . . . . . . 5570 1 486 . 1 1 49 49 TRP HB3 H 1 2.34 0.02 . 1 . . . . . . . . 5570 1 487 . 1 1 49 49 TRP HE1 H 1 9.98 0.02 . 1 . . . . . . . . 5570 1 488 . 1 1 49 49 TRP HZ2 H 1 6.97 0.02 . 1 . . . . . . . . 5570 1 489 . 1 1 49 49 TRP C C 13 174.3 0.2 . 1 . . . . . . . . 5570 1 490 . 1 1 49 49 TRP CA C 13 59.4 0.2 . 1 . . . . . . . . 5570 1 491 . 1 1 49 49 TRP CB C 13 26.6 0.2 . 1 . . . . . . . . 5570 1 492 . 1 1 49 49 TRP CZ2 C 13 112.8 0.2 . 1 . . . . . . . . 5570 1 493 . 1 1 49 49 TRP N N 15 123.6 0.2 . 1 . . . . . . . . 5570 1 494 . 1 1 49 49 TRP NE1 N 15 128.4 0.2 . 1 . . . . . . . . 5570 1 495 . 1 1 50 50 ILE H H 1 8.44 0.02 . 1 . . . . . . . . 5570 1 496 . 1 1 50 50 ILE HA H 1 4.69 0.02 . 1 . . . . . . . . 5570 1 497 . 1 1 50 50 ILE HB H 1 1.96 0.02 . 1 . . . . . . . . 5570 1 498 . 1 1 50 50 ILE HG12 H 1 1.74 0.02 . 1 . . . . . . . . 5570 1 499 . 1 1 50 50 ILE HG13 H 1 1.20 0.02 . 1 . . . . . . . . 5570 1 500 . 1 1 50 50 ILE HG21 H 1 1.03 0.02 . 1 . . . . . . . . 5570 1 501 . 1 1 50 50 ILE HG22 H 1 1.03 0.02 . 1 . . . . . . . . 5570 1 502 . 1 1 50 50 ILE HG23 H 1 1.03 0.02 . 1 . . . . . . . . 5570 1 503 . 1 1 50 50 ILE HD11 H 1 0.88 0.02 . 1 . . . . . . . . 5570 1 504 . 1 1 50 50 ILE HD12 H 1 0.88 0.02 . 1 . . . . . . . . 5570 1 505 . 1 1 50 50 ILE HD13 H 1 0.88 0.02 . 1 . . . . . . . . 5570 1 506 . 1 1 50 50 ILE CA C 13 53.9 0.2 . 1 . . . . . . . . 5570 1 507 . 1 1 50 50 ILE CB C 13 36.9 0.2 . 1 . . . . . . . . 5570 1 508 . 1 1 50 50 ILE CG1 C 13 25.9 0.2 . 1 . . . . . . . . 5570 1 509 . 1 1 50 50 ILE CG2 C 13 17.5 0.2 . 1 . . . . . . . . 5570 1 510 . 1 1 50 50 ILE CD1 C 13 8.9 0.2 . 1 . . . . . . . . 5570 1 511 . 1 1 50 50 ILE N N 15 131.4 0.2 . 1 . . . . . . . . 5570 1 512 . 1 1 53 53 ARG HA H 1 4.35 0.02 . 1 . . . . . . . . 5570 1 513 . 1 1 53 53 ARG C C 13 175.9 0.2 . 1 . . . . . . . . 5570 1 514 . 1 1 53 53 ARG CA C 13 56.6 0.2 . 1 . . . . . . . . 5570 1 515 . 1 1 53 53 ARG CB C 13 30.9 0.2 . 1 . . . . . . . . 5570 1 516 . 1 1 53 53 ARG CG C 13 27.0 0.2 . 1 . . . . . . . . 5570 1 517 . 1 1 53 53 ARG CD C 13 43.5 0.2 . 1 . . . . . . . . 5570 1 518 . 1 1 54 54 SER H H 1 8.02 0.02 . 1 . . . . . . . . 5570 1 519 . 1 1 54 54 SER HA H 1 4.53 0.02 . 1 . . . . . . . . 5570 1 520 . 1 1 54 54 SER HB2 H 1 3.90 0.02 . 2 . . . . . . . . 5570 1 521 . 1 1 54 54 SER HB3 H 1 3.55 0.02 . 2 . . . . . . . . 5570 1 522 . 1 1 54 54 SER CA C 13 56.7 0.2 . 1 . . . . . . . . 5570 1 523 . 1 1 54 54 SER CB C 13 63.2 0.2 . 1 . . . . . . . . 5570 1 524 . 1 1 54 54 SER N N 15 115.6 0.2 . 1 . . . . . . . . 5570 1 525 . 1 1 55 55 PRO HA H 1 4.40 0.02 . 1 . . . . . . . . 5570 1 526 . 1 1 55 55 PRO HB2 H 1 2.42 0.02 . 2 . . . . . . . . 5570 1 527 . 1 1 55 55 PRO HB3 H 1 2.06 0.02 . 2 . . . . . . . . 5570 1 528 . 1 1 55 55 PRO C C 13 176.7 0.2 . 1 . . . . . . . . 5570 1 529 . 1 1 55 55 PRO CA C 13 64.3 0.2 . 1 . . . . . . . . 5570 1 530 . 1 1 55 55 PRO CB C 13 31.8 0.2 . 1 . . . . . . . . 5570 1 531 . 1 1 55 55 PRO CG C 13 27.5 0.2 . 1 . . . . . . . . 5570 1 532 . 1 1 55 55 PRO CD C 13 51.7 0.2 . 1 . . . . . . . . 5570 1 533 . 1 1 56 56 SER H H 1 7.90 0.02 . 1 . . . . . . . . 5570 1 534 . 1 1 56 56 SER HA H 1 4.36 0.02 . 1 . . . . . . . . 5570 1 535 . 1 1 56 56 SER HB2 H 1 4.04 0.02 . 2 . . . . . . . . 5570 1 536 . 1 1 56 56 SER HB3 H 1 3.88 0.02 . 2 . . . . . . . . 5570 1 537 . 1 1 56 56 SER C C 13 175.1 0.2 . 1 . . . . . . . . 5570 1 538 . 1 1 56 56 SER CA C 13 58.5 0.2 . 1 . . . . . . . . 5570 1 539 . 1 1 56 56 SER CB C 13 63.8 0.2 . 1 . . . . . . . . 5570 1 540 . 1 1 56 56 SER N N 15 109.9 0.2 . 1 . . . . . . . . 5570 1 541 . 1 1 57 57 LYS H H 1 7.34 0.02 . 1 . . . . . . . . 5570 1 542 . 1 1 57 57 LYS N N 15 120.8 0.2 . 1 . . . . . . . . 5570 1 543 . 1 1 62 62 ASN HA H 1 4.48 0.02 . 1 . . . . . . . . 5570 1 544 . 1 1 62 62 ASN HB2 H 1 3.01 0.02 . 2 . . . . . . . . 5570 1 545 . 1 1 62 62 ASN HB3 H 1 2.86 0.02 . 2 . . . . . . . . 5570 1 546 . 1 1 62 62 ASN HD21 H 1 7.51 0.02 . 2 . . . . . . . . 5570 1 547 . 1 1 62 62 ASN HD22 H 1 6.90 0.02 . 2 . . . . . . . . 5570 1 548 . 1 1 62 62 ASN C C 13 173.3 0.2 . 1 . . . . . . . . 5570 1 549 . 1 1 62 62 ASN CA C 13 54.7 0.2 . 1 . . . . . . . . 5570 1 550 . 1 1 62 62 ASN CB C 13 38.8 0.2 . 1 . . . . . . . . 5570 1 551 . 1 1 62 62 ASN ND2 N 15 112.3 0.2 . 1 . . . . . . . . 5570 1 552 . 1 1 63 63 ALA H H 1 7.04 0.02 . 1 . . . . . . . . 5570 1 553 . 1 1 63 63 ALA HA H 1 4.36 0.02 . 1 . . . . . . . . 5570 1 554 . 1 1 63 63 ALA HB1 H 1 1.20 0.02 . 1 . . . . . . . . 5570 1 555 . 1 1 63 63 ALA HB2 H 1 1.20 0.02 . 1 . . . . . . . . 5570 1 556 . 1 1 63 63 ALA HB3 H 1 1.20 0.02 . 1 . . . . . . . . 5570 1 557 . 1 1 63 63 ALA C C 13 176.7 0.2 . 1 . . . . . . . . 5570 1 558 . 1 1 63 63 ALA CA C 13 51.2 0.2 . 1 . . . . . . . . 5570 1 559 . 1 1 63 63 ALA CB C 13 21.7 0.2 . 1 . . . . . . . . 5570 1 560 . 1 1 63 63 ALA N N 15 120.0 0.2 . 1 . . . . . . . . 5570 1 561 . 1 1 64 64 LEU H H 1 8.44 0.02 . 1 . . . . . . . . 5570 1 562 . 1 1 64 64 LEU HA H 1 4.62 0.02 . 1 . . . . . . . . 5570 1 563 . 1 1 64 64 LEU HB2 H 1 1.14 0.02 . 2 . . . . . . . . 5570 1 564 . 1 1 64 64 LEU HB3 H 1 1.03 0.02 . 2 . . . . . . . . 5570 1 565 . 1 1 64 64 LEU HG H 1 1.80 0.02 . 1 . . . . . . . . 5570 1 566 . 1 1 64 64 LEU HD11 H 1 0.56 0.02 . 1 . . . . . . . . 5570 1 567 . 1 1 64 64 LEU HD12 H 1 0.56 0.02 . 1 . . . . . . . . 5570 1 568 . 1 1 64 64 LEU HD13 H 1 0.56 0.02 . 1 . . . . . . . . 5570 1 569 . 1 1 64 64 LEU HD21 H 1 0.58 0.02 . 1 . . . . . . . . 5570 1 570 . 1 1 64 64 LEU HD22 H 1 0.58 0.02 . 1 . . . . . . . . 5570 1 571 . 1 1 64 64 LEU HD23 H 1 0.58 0.02 . 1 . . . . . . . . 5570 1 572 . 1 1 64 64 LEU C C 13 175.2 0.2 . 1 . . . . . . . . 5570 1 573 . 1 1 64 64 LEU CA C 13 55.6 0.2 . 1 . . . . . . . . 5570 1 574 . 1 1 64 64 LEU CB C 13 42.5 0.2 . 1 . . . . . . . . 5570 1 575 . 1 1 64 64 LEU CG C 13 26.8 0.2 . 1 . . . . . . . . 5570 1 576 . 1 1 64 64 LEU CD1 C 13 25.1 0.2 . 1 . . . . . . . . 5570 1 577 . 1 1 64 64 LEU CD2 C 13 21.7 0.2 . 1 . . . . . . . . 5570 1 578 . 1 1 64 64 LEU N N 15 120.5 0.2 . 1 . . . . . . . . 5570 1 579 . 1 1 65 65 ASP H H 1 7.97 0.02 . 1 . . . . . . . . 5570 1 580 . 1 1 65 65 ASP HA H 1 4.96 0.02 . 1 . . . . . . . . 5570 1 581 . 1 1 65 65 ASP HB2 H 1 2.79 0.02 . 2 . . . . . . . . 5570 1 582 . 1 1 65 65 ASP HB3 H 1 2.21 0.02 . 2 . . . . . . . . 5570 1 583 . 1 1 65 65 ASP C C 13 174.4 0.2 . 1 . . . . . . . . 5570 1 584 . 1 1 65 65 ASP CA C 13 51.9 0.2 . 1 . . . . . . . . 5570 1 585 . 1 1 65 65 ASP CB C 13 46.3 0.2 . 1 . . . . . . . . 5570 1 586 . 1 1 65 65 ASP N N 15 120.4 0.2 . 1 . . . . . . . . 5570 1 587 . 1 1 66 66 VAL H H 1 8.18 0.02 . 1 . . . . . . . . 5570 1 588 . 1 1 66 66 VAL HA H 1 3.78 0.02 . 1 . . . . . . . . 5570 1 589 . 1 1 66 66 VAL HB H 1 1.77 0.02 . 1 . . . . . . . . 5570 1 590 . 1 1 66 66 VAL HG11 H 1 0.62 0.02 . 1 . . . . . . . . 5570 1 591 . 1 1 66 66 VAL HG12 H 1 0.62 0.02 . 1 . . . . . . . . 5570 1 592 . 1 1 66 66 VAL HG13 H 1 0.62 0.02 . 1 . . . . . . . . 5570 1 593 . 1 1 66 66 VAL HG21 H 1 0.70 0.02 . 1 . . . . . . . . 5570 1 594 . 1 1 66 66 VAL HG22 H 1 0.70 0.02 . 1 . . . . . . . . 5570 1 595 . 1 1 66 66 VAL HG23 H 1 0.70 0.02 . 1 . . . . . . . . 5570 1 596 . 1 1 66 66 VAL C C 13 175.0 0.2 . 1 . . . . . . . . 5570 1 597 . 1 1 66 66 VAL CA C 13 60.9 0.2 . 1 . . . . . . . . 5570 1 598 . 1 1 66 66 VAL CB C 13 31.4 0.2 . 1 . . . . . . . . 5570 1 599 . 1 1 66 66 VAL CG1 C 13 22.2 0.2 . 1 . . . . . . . . 5570 1 600 . 1 1 66 66 VAL CG2 C 13 18.2 0.2 . 1 . . . . . . . . 5570 1 601 . 1 1 66 66 VAL N N 15 106.9 0.2 . 1 . . . . . . . . 5570 1 602 . 1 1 67 67 SER H H 1 6.79 0.02 . 1 . . . . . . . . 5570 1 603 . 1 1 67 67 SER CA C 13 62.9 0.2 . 1 . . . . . . . . 5570 1 604 . 1 1 67 67 SER N N 15 111.5 0.2 . 1 . . . . . . . . 5570 1 605 . 1 1 68 68 VAL H H 1 7.52 0.02 . 1 . . . . . . . . 5570 1 606 . 1 1 68 68 VAL HA H 1 4.36 0.02 . 1 . . . . . . . . 5570 1 607 . 1 1 68 68 VAL HB H 1 2.06 0.02 . 1 . . . . . . . . 5570 1 608 . 1 1 68 68 VAL HG11 H 1 0.75 0.02 . 1 . . . . . . . . 5570 1 609 . 1 1 68 68 VAL HG12 H 1 0.75 0.02 . 1 . . . . . . . . 5570 1 610 . 1 1 68 68 VAL HG13 H 1 0.75 0.02 . 1 . . . . . . . . 5570 1 611 . 1 1 68 68 VAL HG21 H 1 0.86 0.02 . 1 . . . . . . . . 5570 1 612 . 1 1 68 68 VAL HG22 H 1 0.86 0.02 . 1 . . . . . . . . 5570 1 613 . 1 1 68 68 VAL HG23 H 1 0.86 0.02 . 1 . . . . . . . . 5570 1 614 . 1 1 68 68 VAL C C 13 172.7 0.2 . 1 . . . . . . . . 5570 1 615 . 1 1 68 68 VAL CA C 13 60.5 0.2 . 1 . . . . . . . . 5570 1 616 . 1 1 68 68 VAL CB C 13 34.2 0.2 . 1 . . . . . . . . 5570 1 617 . 1 1 68 68 VAL CG1 C 13 20.2 0.2 . 1 . . . . . . . . 5570 1 618 . 1 1 68 68 VAL CG2 C 13 22.8 0.2 . 1 . . . . . . . . 5570 1 619 . 1 1 68 68 VAL N N 15 110.1 0.2 . 1 . . . . . . . . 5570 1 620 . 1 1 69 69 GLY H H 1 8.38 0.02 . 1 . . . . . . . . 5570 1 621 . 1 1 69 69 GLY HA2 H 1 4.46 0.02 . 2 . . . . . . . . 5570 1 622 . 1 1 69 69 GLY HA3 H 1 4.07 0.02 . 2 . . . . . . . . 5570 1 623 . 1 1 69 69 GLY C C 13 172.0 0.2 . 1 . . . . . . . . 5570 1 624 . 1 1 69 69 GLY CA C 13 46.4 0.2 . 1 . . . . . . . . 5570 1 625 . 1 1 69 69 GLY N N 15 113.0 0.2 . 1 . . . . . . . . 5570 1 626 . 1 1 70 70 GLY H H 1 8.25 0.02 . 1 . . . . . . . . 5570 1 627 . 1 1 70 70 GLY C C 13 171.9 0.2 . 1 . . . . . . . . 5570 1 628 . 1 1 70 70 GLY CA C 13 45.5 0.2 . 1 . . . . . . . . 5570 1 629 . 1 1 70 70 GLY N N 15 108.8 0.2 . 1 . . . . . . . . 5570 1 630 . 1 1 71 71 ALA H H 1 8.57 0.02 . 1 . . . . . . . . 5570 1 631 . 1 1 71 71 ALA HA H 1 4.83 0.02 . 1 . . . . . . . . 5570 1 632 . 1 1 71 71 ALA HB1 H 1 1.61 0.02 . 1 . . . . . . . . 5570 1 633 . 1 1 71 71 ALA HB2 H 1 1.61 0.02 . 1 . . . . . . . . 5570 1 634 . 1 1 71 71 ALA HB3 H 1 1.61 0.02 . 1 . . . . . . . . 5570 1 635 . 1 1 71 71 ALA C C 13 177.1 0.2 . 1 . . . . . . . . 5570 1 636 . 1 1 71 71 ALA CA C 13 52.7 0.2 . 1 . . . . . . . . 5570 1 637 . 1 1 71 71 ALA CB C 13 19.2 0.2 . 1 . . . . . . . . 5570 1 638 . 1 1 71 71 ALA N N 15 120.5 0.2 . 1 . . . . . . . . 5570 1 639 . 1 1 72 72 VAL H H 1 8.41 0.02 . 1 . . . . . . . . 5570 1 640 . 1 1 72 72 VAL HA H 1 3.73 0.02 . 1 . . . . . . . . 5570 1 641 . 1 1 72 72 VAL HB H 1 1.87 0.02 . 1 . . . . . . . . 5570 1 642 . 1 1 72 72 VAL HG11 H 1 0.81 0.02 . 1 . . . . . . . . 5570 1 643 . 1 1 72 72 VAL HG12 H 1 0.81 0.02 . 1 . . . . . . . . 5570 1 644 . 1 1 72 72 VAL HG13 H 1 0.81 0.02 . 1 . . . . . . . . 5570 1 645 . 1 1 72 72 VAL HG21 H 1 0.81 0.02 . 1 . . . . . . . . 5570 1 646 . 1 1 72 72 VAL HG22 H 1 0.81 0.02 . 1 . . . . . . . . 5570 1 647 . 1 1 72 72 VAL HG23 H 1 0.81 0.02 . 1 . . . . . . . . 5570 1 648 . 1 1 72 72 VAL C C 13 177.4 0.2 . 1 . . . . . . . . 5570 1 649 . 1 1 72 72 VAL CA C 13 62.4 0.2 . 1 . . . . . . . . 5570 1 650 . 1 1 72 72 VAL CB C 13 32.3 0.2 . 1 . . . . . . . . 5570 1 651 . 1 1 72 72 VAL CG1 C 13 22.6 0.2 . 1 . . . . . . . . 5570 1 652 . 1 1 72 72 VAL CG2 C 13 22.6 0.2 . 1 . . . . . . . . 5570 1 653 . 1 1 72 72 VAL N N 15 123.4 0.2 . 1 . . . . . . . . 5570 1 654 . 1 1 73 73 GLN H H 1 9.25 0.02 . 1 . . . . . . . . 5570 1 655 . 1 1 73 73 GLN HA H 1 4.39 0.02 . 1 . . . . . . . . 5570 1 656 . 1 1 73 73 GLN HB2 H 1 2.21 0.02 . 2 . . . . . . . . 5570 1 657 . 1 1 73 73 GLN HB3 H 1 1.73 0.02 . 2 . . . . . . . . 5570 1 658 . 1 1 73 73 GLN HG2 H 1 2.53 0.02 . 2 . . . . . . . . 5570 1 659 . 1 1 73 73 GLN HG3 H 1 2.34 0.02 . 2 . . . . . . . . 5570 1 660 . 1 1 73 73 GLN HE21 H 1 7.32 0.02 . 2 . . . . . . . . 5570 1 661 . 1 1 73 73 GLN HE22 H 1 6.91 0.02 . 2 . . . . . . . . 5570 1 662 . 1 1 73 73 GLN C C 13 176.2 0.2 . 1 . . . . . . . . 5570 1 663 . 1 1 73 73 GLN CA C 13 56.1 0.2 . 1 . . . . . . . . 5570 1 664 . 1 1 73 73 GLN CB C 13 28.9 0.2 . 1 . . . . . . . . 5570 1 665 . 1 1 73 73 GLN CG C 13 34.3 0.2 . 1 . . . . . . . . 5570 1 666 . 1 1 73 73 GLN N N 15 128.0 0.2 . 1 . . . . . . . . 5570 1 667 . 1 1 73 73 GLN NE2 N 15 109.0 0.2 . 1 . . . . . . . . 5570 1 668 . 1 1 74 74 SER H H 1 8.56 0.02 . 1 . . . . . . . . 5570 1 669 . 1 1 74 74 SER HA H 1 4.18 0.02 . 1 . . . . . . . . 5570 1 670 . 1 1 74 74 SER HB2 H 1 3.49 0.02 . 2 . . . . . . . . 5570 1 671 . 1 1 74 74 SER HB3 H 1 3.33 0.02 . 2 . . . . . . . . 5570 1 672 . 1 1 74 74 SER C C 13 177.1 0.2 . 1 . . . . . . . . 5570 1 673 . 1 1 74 74 SER CA C 13 59.5 0.2 . 1 . . . . . . . . 5570 1 674 . 1 1 74 74 SER CB C 13 62.9 0.2 . 1 . . . . . . . . 5570 1 675 . 1 1 74 74 SER N N 15 112.0 0.2 . 1 . . . . . . . . 5570 1 676 . 1 1 75 75 GLY H H 1 9.19 0.02 . 1 . . . . . . . . 5570 1 677 . 1 1 75 75 GLY HA2 H 1 4.29 0.02 . 2 . . . . . . . . 5570 1 678 . 1 1 75 75 GLY HA3 H 1 3.76 0.02 . 2 . . . . . . . . 5570 1 679 . 1 1 75 75 GLY C C 13 174.1 0.02 . 1 . . . . . . . . 5570 1 680 . 1 1 75 75 GLY CA C 13 45.4 0.2 . 1 . . . . . . . . 5570 1 681 . 1 1 75 75 GLY N N 15 115.9 0.2 . 1 . . . . . . . . 5570 1 682 . 1 1 76 76 GLU H H 1 8.31 0.02 . 1 . . . . . . . . 5570 1 683 . 1 1 76 76 GLU HA H 1 4.58 0.02 . 1 . . . . . . . . 5570 1 684 . 1 1 76 76 GLU C C 13 177.8 0.2 . 1 . . . . . . . . 5570 1 685 . 1 1 76 76 GLU CA C 13 56.1 0.2 . 1 . . . . . . . . 5570 1 686 . 1 1 76 76 GLU CB C 13 32.3 0.2 . 1 . . . . . . . . 5570 1 687 . 1 1 76 76 GLU CG C 13 37.7 0.2 . 1 . . . . . . . . 5570 1 688 . 1 1 76 76 GLU N N 15 120.6 0.2 . 1 . . . . . . . . 5570 1 689 . 1 1 77 77 THR H H 1 8.19 0.02 . 1 . . . . . . . . 5570 1 690 . 1 1 77 77 THR HA H 1 4.61 0.02 . 1 . . . . . . . . 5570 1 691 . 1 1 77 77 THR HB H 1 4.84 0.02 . 1 . . . . . . . . 5570 1 692 . 1 1 77 77 THR HG21 H 1 1.38 0.02 . 1 . . . . . . . . 5570 1 693 . 1 1 77 77 THR HG22 H 1 1.38 0.02 . 1 . . . . . . . . 5570 1 694 . 1 1 77 77 THR HG23 H 1 1.38 0.02 . 1 . . . . . . . . 5570 1 695 . 1 1 77 77 THR C C 13 176.1 0.2 . 1 . . . . . . . . 5570 1 696 . 1 1 77 77 THR CA C 13 60.0 0.2 . 1 . . . . . . . . 5570 1 697 . 1 1 77 77 THR CB C 13 71.6 0.2 . 1 . . . . . . . . 5570 1 698 . 1 1 77 77 THR CG2 C 13 22.0 0.2 . 1 . . . . . . . . 5570 1 699 . 1 1 77 77 THR N N 15 111.0 0.2 . 1 . . . . . . . . 5570 1 700 . 1 1 78 78 TYR H H 1 7.78 0.02 . 1 . . . . . . . . 5570 1 701 . 1 1 78 78 TYR HA H 1 4.11 0.02 . 1 . . . . . . . . 5570 1 702 . 1 1 78 78 TYR HB2 H 1 3.36 0.02 . 2 . . . . . . . . 5570 1 703 . 1 1 78 78 TYR HB3 H 1 2.99 0.02 . 2 . . . . . . . . 5570 1 704 . 1 1 78 78 TYR HD1 H 1 7.27 0.02 . 1 . . . . . . . . 5570 1 705 . 1 1 78 78 TYR HD2 H 1 7.27 0.02 . 1 . . . . . . . . 5570 1 706 . 1 1 78 78 TYR HE1 H 1 7.00 0.02 . 1 . . . . . . . . 5570 1 707 . 1 1 78 78 TYR HE2 H 1 7.00 0.02 . 1 . . . . . . . . 5570 1 708 . 1 1 78 78 TYR C C 13 177.5 0.2 . 1 . . . . . . . . 5570 1 709 . 1 1 78 78 TYR CA C 13 63.4 0.2 . 1 . . . . . . . . 5570 1 710 . 1 1 78 78 TYR CB C 13 38.6 0.2 . 1 . . . . . . . . 5570 1 711 . 1 1 78 78 TYR CD1 C 13 134.1 0.2 . 1 . . . . . . . . 5570 1 712 . 1 1 78 78 TYR CD2 C 13 134.1 0.2 . 1 . . . . . . . . 5570 1 713 . 1 1 78 78 TYR CE1 C 13 118.4 0.2 . 1 . . . . . . . . 5570 1 714 . 1 1 78 78 TYR CE2 C 13 118.4 0.2 . 1 . . . . . . . . 5570 1 715 . 1 1 78 78 TYR N N 15 116.6 0.2 . 1 . . . . . . . . 5570 1 716 . 1 1 79 79 GLU H H 1 8.41 0.02 . 1 . . . . . . . . 5570 1 717 . 1 1 79 79 GLU HA H 1 3.77 0.02 . 1 . . . . . . . . 5570 1 718 . 1 1 79 79 GLU C C 13 178.7 0.2 . 1 . . . . . . . . 5570 1 719 . 1 1 79 79 GLU CA C 13 60.5 0.2 . 1 . . . . . . . . 5570 1 720 . 1 1 79 79 GLU CB C 13 30.4 0.2 . 1 . . . . . . . . 5570 1 721 . 1 1 79 79 GLU CG C 13 37.7 0.2 . 1 . . . . . . . . 5570 1 722 . 1 1 79 79 GLU N N 15 116.7 0.2 . 1 . . . . . . . . 5570 1 723 . 1 1 80 80 GLU H H 1 7.83 0.02 . 1 . . . . . . . . 5570 1 724 . 1 1 80 80 GLU HA H 1 3.86 0.02 . 1 . . . . . . . . 5570 1 725 . 1 1 80 80 GLU HB2 H 1 2.00 0.02 . 2 . . . . . . . . 5570 1 726 . 1 1 80 80 GLU HB3 H 1 1.90 0.02 . 2 . . . . . . . . 5570 1 727 . 1 1 80 80 GLU HG2 H 1 2.34 0.02 . 2 . . . . . . . . 5570 1 728 . 1 1 80 80 GLU HG3 H 1 2.26 0.02 . 2 . . . . . . . . 5570 1 729 . 1 1 80 80 GLU C C 13 179.8 0.2 . 1 . . . . . . . . 5570 1 730 . 1 1 80 80 GLU CA C 13 59.4 0.2 . 1 . . . . . . . . 5570 1 731 . 1 1 80 80 GLU CB C 13 30.3 0.2 . 1 . . . . . . . . 5570 1 732 . 1 1 80 80 GLU CG C 13 37.2 0.2 . 1 . . . . . . . . 5570 1 733 . 1 1 80 80 GLU N N 15 117.2 0.2 . 1 . . . . . . . . 5570 1 734 . 1 1 81 81 ALA H H 1 8.24 0.02 . 1 . . . . . . . . 5570 1 735 . 1 1 81 81 ALA HA H 1 4.17 0.02 . 1 . . . . . . . . 5570 1 736 . 1 1 81 81 ALA HB1 H 1 1.71 0.02 . 1 . . . . . . . . 5570 1 737 . 1 1 81 81 ALA HB2 H 1 1.71 0.02 . 1 . . . . . . . . 5570 1 738 . 1 1 81 81 ALA HB3 H 1 1.71 0.02 . 1 . . . . . . . . 5570 1 739 . 1 1 81 81 ALA C C 13 178.5 0.2 . 1 . . . . . . . . 5570 1 740 . 1 1 81 81 ALA CA C 13 55.6 0.2 . 1 . . . . . . . . 5570 1 741 . 1 1 81 81 ALA CB C 13 20.8 0.2 . 1 . . . . . . . . 5570 1 742 . 1 1 81 81 ALA N N 15 122.8 0.2 . 1 . . . . . . . . 5570 1 743 . 1 1 82 82 PHE H H 1 8.34 0.02 . 1 . . . . . . . . 5570 1 744 . 1 1 82 82 PHE HA H 1 3.77 0.02 . 1 . . . . . . . . 5570 1 745 . 1 1 82 82 PHE HB2 H 1 2.87 0.02 . 2 . . . . . . . . 5570 1 746 . 1 1 82 82 PHE HB3 H 1 2.76 0.02 . 2 . . . . . . . . 5570 1 747 . 1 1 82 82 PHE CA C 13 58.5 0.2 . 1 . . . . . . . . 5570 1 748 . 1 1 82 82 PHE CB C 13 38.6 0.2 . 1 . . . . . . . . 5570 1 749 . 1 1 82 82 PHE N N 15 118.2 0.2 . 1 . . . . . . . . 5570 1 750 . 1 1 83 83 ARG H H 1 8.06 0.02 . 1 . . . . . . . . 5570 1 751 . 1 1 83 83 ARG HA H 1 3.76 0.02 . 1 . . . . . . . . 5570 1 752 . 1 1 83 83 ARG HD2 H 1 3.04 0.02 . 1 . . . . . . . . 5570 1 753 . 1 1 83 83 ARG HD3 H 1 3.04 0.02 . 1 . . . . . . . . 5570 1 754 . 1 1 83 83 ARG C C 13 178.7 0.2 . 1 . . . . . . . . 5570 1 755 . 1 1 83 83 ARG CA C 13 60.0 0.2 . 1 . . . . . . . . 5570 1 756 . 1 1 83 83 ARG CB C 13 30.4 0.2 . 1 . . . . . . . . 5570 1 757 . 1 1 83 83 ARG CG C 13 27.5 0.2 . 1 . . . . . . . . 5570 1 758 . 1 1 83 83 ARG CD C 13 39.1 0.2 . 1 . . . . . . . . 5570 1 759 . 1 1 83 83 ARG N N 15 117.6 0.2 . 1 . . . . . . . . 5570 1 760 . 1 1 84 84 ARG H H 1 8.02 0.02 . 1 . . . . . . . . 5570 1 761 . 1 1 84 84 ARG HA H 1 3.95 0.02 . 1 . . . . . . . . 5570 1 762 . 1 1 84 84 ARG HD2 H 1 3.00 0.02 . 1 . . . . . . . . 5570 1 763 . 1 1 84 84 ARG HD3 H 1 3.00 0.02 . 1 . . . . . . . . 5570 1 764 . 1 1 84 84 ARG C C 13 178.2 0.2 . 1 . . . . . . . . 5570 1 765 . 1 1 84 84 ARG CA C 13 60.0 0.2 . 1 . . . . . . . . 5570 1 766 . 1 1 84 84 ARG CB C 13 29.4 0.2 . 1 . . . . . . . . 5570 1 767 . 1 1 84 84 ARG N N 15 118.7 0.2 . 1 . . . . . . . . 5570 1 768 . 1 1 85 85 GLU H H 1 8.93 0.02 . 1 . . . . . . . . 5570 1 769 . 1 1 85 85 GLU HA H 1 4.19 0.02 . 1 . . . . . . . . 5570 1 770 . 1 1 85 85 GLU HB2 H 1 1.92 0.02 . 2 . . . . . . . . 5570 1 771 . 1 1 85 85 GLU HB3 H 1 1.78 0.02 . 2 . . . . . . . . 5570 1 772 . 1 1 85 85 GLU C C 13 178.9 0.2 . 1 . . . . . . . . 5570 1 773 . 1 1 85 85 GLU CA C 13 59.0 0.2 . 1 . . . . . . . . 5570 1 774 . 1 1 85 85 GLU CB C 13 28.9 0.2 . 1 . . . . . . . . 5570 1 775 . 1 1 85 85 GLU CG C 13 34.3 0.2 . 1 . . . . . . . . 5570 1 776 . 1 1 85 85 GLU N N 15 118.0 0.2 . 1 . . . . . . . . 5570 1 777 . 1 1 86 86 ALA H H 1 8.63 0.02 . 1 . . . . . . . . 5570 1 778 . 1 1 86 86 ALA HA H 1 3.71 0.02 . 1 . . . . . . . . 5570 1 779 . 1 1 86 86 ALA HB1 H 1 0.91 0.02 . 1 . . . . . . . . 5570 1 780 . 1 1 86 86 ALA HB2 H 1 0.91 0.02 . 1 . . . . . . . . 5570 1 781 . 1 1 86 86 ALA HB3 H 1 0.91 0.02 . 1 . . . . . . . . 5570 1 782 . 1 1 86 86 ALA C C 13 179.9 0.2 . 1 . . . . . . . . 5570 1 783 . 1 1 86 86 ALA CA C 13 56.1 0.2 . 1 . . . . . . . . 5570 1 784 . 1 1 86 86 ALA CB C 13 17.3 0.2 . 1 . . . . . . . . 5570 1 785 . 1 1 86 86 ALA N N 15 116.1 0.2 . 1 . . . . . . . . 5570 1 786 . 1 1 87 87 ARG H H 1 7.24 0.02 . 1 . . . . . . . . 5570 1 787 . 1 1 87 87 ARG HA H 1 4.07 0.02 . 1 . . . . . . . . 5570 1 788 . 1 1 87 87 ARG C C 13 178.9 0.2 . 1 . . . . . . . . 5570 1 789 . 1 1 87 87 ARG CA C 13 59.9 0.2 . 1 . . . . . . . . 5570 1 790 . 1 1 87 87 ARG CB C 13 30.3 0.2 . 1 . . . . . . . . 5570 1 791 . 1 1 87 87 ARG CG C 13 27.5 0.2 . 1 . . . . . . . . 5570 1 792 . 1 1 87 87 ARG CD C 13 43.5 0.2 . 1 . . . . . . . . 5570 1 793 . 1 1 87 87 ARG N N 15 117.7 0.2 . 1 . . . . . . . . 5570 1 794 . 1 1 88 88 GLU H H 1 8.56 0.02 . 1 . . . . . . . . 5570 1 795 . 1 1 88 88 GLU HA H 1 4.02 0.02 . 1 . . . . . . . . 5570 1 796 . 1 1 88 88 GLU HB2 H 1 2.13 0.02 . 1 . . . . . . . . 5570 1 797 . 1 1 88 88 GLU HB3 H 1 2.13 0.02 . 1 . . . . . . . . 5570 1 798 . 1 1 88 88 GLU HG2 H 1 2.47 0.02 . 2 . . . . . . . . 5570 1 799 . 1 1 88 88 GLU HG3 H 1 2.35 0.02 . 2 . . . . . . . . 5570 1 800 . 1 1 88 88 GLU C C 13 178.9 0.2 . 1 . . . . . . . . 5570 1 801 . 1 1 88 88 GLU CA C 13 59.5 0.2 . 1 . . . . . . . . 5570 1 802 . 1 1 88 88 GLU CB C 13 30.4 0.2 . 1 . . . . . . . . 5570 1 803 . 1 1 88 88 GLU CG C 13 36.7 0.2 . 1 . . . . . . . . 5570 1 804 . 1 1 88 88 GLU N N 15 117.5 0.2 . 1 . . . . . . . . 5570 1 805 . 1 1 89 89 GLU H H 1 8.91 0.02 . 1 . . . . . . . . 5570 1 806 . 1 1 89 89 GLU HA H 1 4.72 0.02 . 1 . . . . . . . . 5570 1 807 . 1 1 89 89 GLU HB2 H 1 2.21 0.02 . 1 . . . . . . . . 5570 1 808 . 1 1 89 89 GLU HB3 H 1 2.21 0.02 . 1 . . . . . . . . 5570 1 809 . 1 1 89 89 GLU HG2 H 1 2.79 0.02 . 2 . . . . . . . . 5570 1 810 . 1 1 89 89 GLU HG3 H 1 2.63 0.02 . 2 . . . . . . . . 5570 1 811 . 1 1 89 89 GLU C C 13 177.4 0.2 . 1 . . . . . . . . 5570 1 812 . 1 1 89 89 GLU CA C 13 58.0 0.2 . 1 . . . . . . . . 5570 1 813 . 1 1 89 89 GLU CB C 13 30.4 0.2 . 1 . . . . . . . . 5570 1 814 . 1 1 89 89 GLU CG C 13 34.8 0.2 . 1 . . . . . . . . 5570 1 815 . 1 1 89 89 GLU N N 15 112.7 0.2 . 1 . . . . . . . . 5570 1 816 . 1 1 90 90 LEU H H 1 7.02 0.02 . 1 . . . . . . . . 5570 1 817 . 1 1 90 90 LEU HA H 1 4.70 0.02 . 1 . . . . . . . . 5570 1 818 . 1 1 90 90 LEU HB2 H 1 1.94 0.02 . 2 . . . . . . . . 5570 1 819 . 1 1 90 90 LEU HB3 H 1 1.56 0.02 . 2 . . . . . . . . 5570 1 820 . 1 1 90 90 LEU C C 13 174.6 0.2 . 1 . . . . . . . . 5570 1 821 . 1 1 90 90 LEU CA C 13 53.3 0.2 . 1 . . . . . . . . 5570 1 822 . 1 1 90 90 LEU CB C 13 43.9 0.2 . 1 . . . . . . . . 5570 1 823 . 1 1 90 90 LEU CG C 13 26.0 0.2 . 1 . . . . . . . . 5570 1 824 . 1 1 90 90 LEU N N 15 111.6 0.2 . 1 . . . . . . . . 5570 1 825 . 1 1 91 91 ASN H H 1 7.58 0.02 . 1 . . . . . . . . 5570 1 826 . 1 1 91 91 ASN HA H 1 4.66 0.02 . 1 . . . . . . . . 5570 1 827 . 1 1 91 91 ASN HB2 H 1 2.92 0.02 . 1 . . . . . . . . 5570 1 828 . 1 1 91 91 ASN HB3 H 1 2.92 0.02 . 1 . . . . . . . . 5570 1 829 . 1 1 91 91 ASN HD21 H 1 7.70 0.02 . 2 . . . . . . . . 5570 1 830 . 1 1 91 91 ASN HD22 H 1 6.82 0.02 . 2 . . . . . . . . 5570 1 831 . 1 1 91 91 ASN C C 13 174.1 0.2 . 1 . . . . . . . . 5570 1 832 . 1 1 91 91 ASN CA C 13 55.1 0.2 . 1 . . . . . . . . 5570 1 833 . 1 1 91 91 ASN CB C 13 38.1 0.2 . 1 . . . . . . . . 5570 1 834 . 1 1 91 91 ASN N N 15 112.7 0.2 . 1 . . . . . . . . 5570 1 835 . 1 1 91 91 ASN ND2 N 15 113.6 0.2 . 1 . . . . . . . . 5570 1 836 . 1 1 92 92 VAL H H 1 7.28 0.02 . 1 . . . . . . . . 5570 1 837 . 1 1 92 92 VAL HA H 1 4.31 0.02 . 1 . . . . . . . . 5570 1 838 . 1 1 92 92 VAL HB H 1 1.63 0.02 . 1 . . . . . . . . 5570 1 839 . 1 1 92 92 VAL HG11 H 1 0.65 0.02 . 1 . . . . . . . . 5570 1 840 . 1 1 92 92 VAL HG12 H 1 0.65 0.02 . 1 . . . . . . . . 5570 1 841 . 1 1 92 92 VAL HG13 H 1 0.65 0.02 . 1 . . . . . . . . 5570 1 842 . 1 1 92 92 VAL HG21 H 1 0.62 0.02 . 1 . . . . . . . . 5570 1 843 . 1 1 92 92 VAL HG22 H 1 0.62 0.02 . 1 . . . . . . . . 5570 1 844 . 1 1 92 92 VAL HG23 H 1 0.62 0.02 . 1 . . . . . . . . 5570 1 845 . 1 1 92 92 VAL C C 13 174.5 0.2 . 1 . . . . . . . . 5570 1 846 . 1 1 92 92 VAL CA C 13 60.5 0.2 . 1 . . . . . . . . 5570 1 847 . 1 1 92 92 VAL CB C 13 35.2 0.2 . 1 . . . . . . . . 5570 1 848 . 1 1 92 92 VAL CG1 C 13 21.3 0.2 . 1 . . . . . . . . 5570 1 849 . 1 1 92 92 VAL CG2 C 13 20.5 0.2 . 1 . . . . . . . . 5570 1 850 . 1 1 92 92 VAL N N 15 111.5 0.2 . 1 . . . . . . . . 5570 1 851 . 1 1 93 93 GLU H H 1 8.18 0.02 . 1 . . . . . . . . 5570 1 852 . 1 1 93 93 GLU HA H 1 4.30 0.02 . 1 . . . . . . . . 5570 1 853 . 1 1 93 93 GLU HB2 H 1 2.06 0.02 . 2 . . . . . . . . 5570 1 854 . 1 1 93 93 GLU HB3 H 1 1.87 0.02 . 2 . . . . . . . . 5570 1 855 . 1 1 93 93 GLU HG2 H 1 2.20 0.02 . 2 . . . . . . . . 5570 1 856 . 1 1 93 93 GLU HG3 H 1 2.16 0.02 . 2 . . . . . . . . 5570 1 857 . 1 1 93 93 GLU C C 13 177.4 0.2 . 1 . . . . . . . . 5570 1 858 . 1 1 93 93 GLU CA C 13 53.7 0.2 . 1 . . . . . . . . 5570 1 859 . 1 1 93 93 GLU CB C 13 29.4 0.2 . 1 . . . . . . . . 5570 1 860 . 1 1 93 93 GLU CG C 13 35.2 0.2 . 1 . . . . . . . . 5570 1 861 . 1 1 93 93 GLU N N 15 123.8 0.2 . 1 . . . . . . . . 5570 1 862 . 1 1 94 94 ILE H H 1 7.86 0.02 . 1 . . . . . . . . 5570 1 863 . 1 1 94 94 ILE HA H 1 3.58 0.02 . 1 . . . . . . . . 5570 1 864 . 1 1 94 94 ILE HB H 1 1.22 0.02 . 1 . . . . . . . . 5570 1 865 . 1 1 94 94 ILE HG12 H 1 1.03 0.02 . 2 . . . . . . . . 5570 1 866 . 1 1 94 94 ILE HG13 H 1 0.54 0.02 . 2 . . . . . . . . 5570 1 867 . 1 1 94 94 ILE HG21 H 1 -0.05 0.02 . 1 . . . . . . . . 5570 1 868 . 1 1 94 94 ILE HG22 H 1 -0.05 0.02 . 1 . . . . . . . . 5570 1 869 . 1 1 94 94 ILE HG23 H 1 -0.05 0.02 . 1 . . . . . . . . 5570 1 870 . 1 1 94 94 ILE HD11 H 1 -0.62 0.02 . 1 . . . . . . . . 5570 1 871 . 1 1 94 94 ILE HD12 H 1 -0.62 0.02 . 1 . . . . . . . . 5570 1 872 . 1 1 94 94 ILE HD13 H 1 -0.62 0.02 . 1 . . . . . . . . 5570 1 873 . 1 1 94 94 ILE C C 13 176.6 0.2 . 1 . . . . . . . . 5570 1 874 . 1 1 94 94 ILE CA C 13 65.8 0.2 . 1 . . . . . . . . 5570 1 875 . 1 1 94 94 ILE CB C 13 36.7 0.2 . 1 . . . . . . . . 5570 1 876 . 1 1 94 94 ILE CG1 C 13 25.5 0.2 . 1 . . . . . . . . 5570 1 877 . 1 1 94 94 ILE CG2 C 13 18.0 0.2 . 1 . . . . . . . . 5570 1 878 . 1 1 94 94 ILE CD1 C 13 14.1 0.2 . 1 . . . . . . . . 5570 1 879 . 1 1 94 94 ILE N N 15 118.7 0.2 . 1 . . . . . . . . 5570 1 880 . 1 1 95 95 ASP H H 1 8.35 0.02 . 1 . . . . . . . . 5570 1 881 . 1 1 95 95 ASP HA H 1 4.78 0.02 . 1 . . . . . . . . 5570 1 882 . 1 1 95 95 ASP HB2 H 1 2.92 0.02 . 2 . . . . . . . . 5570 1 883 . 1 1 95 95 ASP HB3 H 1 2.55 0.02 . 2 . . . . . . . . 5570 1 884 . 1 1 95 95 ASP C C 13 176.6 0.2 . 1 . . . . . . . . 5570 1 885 . 1 1 95 95 ASP CA C 13 56.1 0.2 . 1 . . . . . . . . 5570 1 886 . 1 1 95 95 ASP CB C 13 40.6 0.2 . 1 . . . . . . . . 5570 1 887 . 1 1 95 95 ASP N N 15 116.1 0.2 . 1 . . . . . . . . 5570 1 888 . 1 1 96 96 ALA H H 1 7.80 0.02 . 1 . . . . . . . . 5570 1 889 . 1 1 96 96 ALA HA H 1 4.55 0.02 . 1 . . . . . . . . 5570 1 890 . 1 1 96 96 ALA HB1 H 1 1.56 0.02 . 1 . . . . . . . . 5570 1 891 . 1 1 96 96 ALA HB2 H 1 1.56 0.02 . 1 . . . . . . . . 5570 1 892 . 1 1 96 96 ALA HB3 H 1 1.56 0.02 . 1 . . . . . . . . 5570 1 893 . 1 1 96 96 ALA C C 13 176.9 0.2 . 1 . . . . . . . . 5570 1 894 . 1 1 96 96 ALA CA C 13 51.9 0.2 . 1 . . . . . . . . 5570 1 895 . 1 1 96 96 ALA CB C 13 19.6 0.2 . 1 . . . . . . . . 5570 1 896 . 1 1 96 96 ALA N N 15 119.9 0.2 . 1 . . . . . . . . 5570 1 897 . 1 1 97 97 LEU H H 1 7.72 0.02 . 1 . . . . . . . . 5570 1 898 . 1 1 97 97 LEU HA H 1 4.87 0.02 . 1 . . . . . . . . 5570 1 899 . 1 1 97 97 LEU HB2 H 1 1.90 0.02 . 2 . . . . . . . . 5570 1 900 . 1 1 97 97 LEU HB3 H 1 1.76 0.02 . 2 . . . . . . . . 5570 1 901 . 1 1 97 97 LEU HG H 1 1.78 0.02 . 1 . . . . . . . . 5570 1 902 . 1 1 97 97 LEU HD11 H 1 0.89 0.02 . 1 . . . . . . . . 5570 1 903 . 1 1 97 97 LEU HD12 H 1 0.89 0.02 . 1 . . . . . . . . 5570 1 904 . 1 1 97 97 LEU HD13 H 1 0.89 0.02 . 1 . . . . . . . . 5570 1 905 . 1 1 97 97 LEU HD21 H 1 1.04 0.02 . 1 . . . . . . . . 5570 1 906 . 1 1 97 97 LEU HD22 H 1 1.04 0.02 . 1 . . . . . . . . 5570 1 907 . 1 1 97 97 LEU HD23 H 1 1.04 0.02 . 1 . . . . . . . . 5570 1 908 . 1 1 97 97 LEU C C 13 175.3 0.2 . 1 . . . . . . . . 5570 1 909 . 1 1 97 97 LEU CA C 13 51.0 0.2 . 1 . . . . . . . . 5570 1 910 . 1 1 97 97 LEU CB C 13 44.3 0.2 . 1 . . . . . . . . 5570 1 911 . 1 1 97 97 LEU CG C 13 27.5 0.2 . 1 . . . . . . . . 5570 1 912 . 1 1 97 97 LEU CD1 C 13 26.1 0.2 . 1 . . . . . . . . 5570 1 913 . 1 1 97 97 LEU CD2 C 13 23.6 0.2 . 1 . . . . . . . . 5570 1 914 . 1 1 97 97 LEU N N 15 119.6 0.2 . 1 . . . . . . . . 5570 1 915 . 1 1 98 98 SER H H 1 8.38 0.02 . 1 . . . . . . . . 5570 1 916 . 1 1 98 98 SER HA H 1 4.47 0.02 . 1 . . . . . . . . 5570 1 917 . 1 1 98 98 SER HB2 H 1 3.96 0.02 . 2 . . . . . . . . 5570 1 918 . 1 1 98 98 SER HB3 H 1 3.90 0.02 . 2 . . . . . . . . 5570 1 919 . 1 1 98 98 SER C C 13 173.3 0.2 . 1 . . . . . . . . 5570 1 920 . 1 1 98 98 SER CA C 13 58.2 0.2 . 1 . . . . . . . . 5570 1 921 . 1 1 98 98 SER CB C 13 63.8 0.2 . 1 . . . . . . . . 5570 1 922 . 1 1 98 98 SER N N 15 113.0 0.2 . 1 . . . . . . . . 5570 1 923 . 1 1 99 99 TRP H H 1 8.15 0.02 . 1 . . . . . . . . 5570 1 924 . 1 1 99 99 TRP HA H 1 5.89 0.02 . 1 . . . . . . . . 5570 1 925 . 1 1 99 99 TRP HB2 H 1 3.62 0.02 . 2 . . . . . . . . 5570 1 926 . 1 1 99 99 TRP HB3 H 1 3.38 0.02 . 2 . . . . . . . . 5570 1 927 . 1 1 99 99 TRP HD1 H 1 6.97 0.02 . 1 . . . . . . . . 5570 1 928 . 1 1 99 99 TRP HE1 H 1 9.99 0.02 . 1 . . . . . . . . 5570 1 929 . 1 1 99 99 TRP C C 13 174.6 0.2 . 1 . . . . . . . . 5570 1 930 . 1 1 99 99 TRP CA C 13 55.2 0.2 . 1 . . . . . . . . 5570 1 931 . 1 1 99 99 TRP CB C 13 33.2 0.2 . 1 . . . . . . . . 5570 1 932 . 1 1 99 99 TRP N N 15 121.8 0.2 . 1 . . . . . . . . 5570 1 933 . 1 1 99 99 TRP NE1 N 15 129.4 0.2 . 1 . . . . . . . . 5570 1 934 . 1 1 100 100 ARG H H 1 9.25 0.02 . 1 . . . . . . . . 5570 1 935 . 1 1 100 100 ARG HA H 1 4.97 0.02 . 1 . . . . . . . . 5570 1 936 . 1 1 100 100 ARG HB2 H 1 1.87 0.02 . 1 . . . . . . . . 5570 1 937 . 1 1 100 100 ARG HB3 H 1 1.87 0.02 . 1 . . . . . . . . 5570 1 938 . 1 1 100 100 ARG HG2 H 1 1.46 0.02 . 1 . . . . . . . . 5570 1 939 . 1 1 100 100 ARG HG3 H 1 1.46 0.02 . 1 . . . . . . . . 5570 1 940 . 1 1 100 100 ARG HD2 H 1 3.20 0.02 . 2 . . . . . . . . 5570 1 941 . 1 1 100 100 ARG HD3 H 1 3.10 0.02 . 2 . . . . . . . . 5570 1 942 . 1 1 100 100 ARG CA C 13 53.7 0.2 . 1 . . . . . . . . 5570 1 943 . 1 1 100 100 ARG CB C 13 30.9 0.2 . 1 . . . . . . . . 5570 1 944 . 1 1 100 100 ARG N N 15 114.5 0.2 . 1 . . . . . . . . 5570 1 945 . 1 1 101 101 PRO HA H 1 4.63 0.02 . 1 . . . . . . . . 5570 1 946 . 1 1 101 101 PRO HB2 H 1 2.13 0.02 . 1 . . . . . . . . 5570 1 947 . 1 1 101 101 PRO HB3 H 1 1.84 0.02 . 1 . . . . . . . . 5570 1 948 . 1 1 101 101 PRO C C 13 176.2 0.2 . 1 . . . . . . . . 5570 1 949 . 1 1 101 101 PRO CA C 13 62.9 0.2 . 1 . . . . . . . . 5570 1 950 . 1 1 101 101 PRO CB C 13 31.4 0.2 . 1 . . . . . . . . 5570 1 951 . 1 1 102 102 LEU H H 1 9.51 0.02 . 1 . . . . . . . . 5570 1 952 . 1 1 102 102 LEU HA H 1 4.35 0.02 . 1 . . . . . . . . 5570 1 953 . 1 1 102 102 LEU HB2 H 1 1.41 0.02 . 2 . . . . . . . . 5570 1 954 . 1 1 102 102 LEU HB3 H 1 1.33 0.02 . 2 . . . . . . . . 5570 1 955 . 1 1 102 102 LEU HG H 1 1.34 0.02 . 1 . . . . . . . . 5570 1 956 . 1 1 102 102 LEU HD11 H 1 0.91 0.02 . 2 . . . . . . . . 5570 1 957 . 1 1 102 102 LEU HD12 H 1 0.91 0.02 . 2 . . . . . . . . 5570 1 958 . 1 1 102 102 LEU HD13 H 1 0.91 0.02 . 2 . . . . . . . . 5570 1 959 . 1 1 102 102 LEU HD21 H 1 0.78 0.02 . 2 . . . . . . . . 5570 1 960 . 1 1 102 102 LEU HD22 H 1 0.78 0.02 . 2 . . . . . . . . 5570 1 961 . 1 1 102 102 LEU HD23 H 1 0.78 0.02 . 2 . . . . . . . . 5570 1 962 . 1 1 102 102 LEU C C 13 177.0 0.2 . 1 . . . . . . . . 5570 1 963 . 1 1 102 102 LEU CA C 13 56.1 0.2 . 1 . . . . . . . . 5570 1 964 . 1 1 102 102 LEU CB C 13 44.5 0.2 . 1 . . . . . . . . 5570 1 965 . 1 1 102 102 LEU CG C 13 25.0 0.2 . 1 . . . . . . . . 5570 1 966 . 1 1 102 102 LEU CD1 C 13 22.6 0.2 . 1 . . . . . . . . 5570 1 967 . 1 1 102 102 LEU CD2 C 13 22.6 0.2 . 1 . . . . . . . . 5570 1 968 . 1 1 102 102 LEU N N 15 123.5 0.2 . 1 . . . . . . . . 5570 1 969 . 1 1 103 103 ALA H H 1 7.26 0.02 . 1 . . . . . . . . 5570 1 970 . 1 1 103 103 ALA HA H 1 4.11 0.02 . 1 . . . . . . . . 5570 1 971 . 1 1 103 103 ALA HB1 H 1 0.62 0.02 . 1 . . . . . . . . 5570 1 972 . 1 1 103 103 ALA HB2 H 1 0.62 0.02 . 1 . . . . . . . . 5570 1 973 . 1 1 103 103 ALA HB3 H 1 0.62 0.02 . 1 . . . . . . . . 5570 1 974 . 1 1 103 103 ALA C C 13 174.7 0.2 . 1 . . . . . . . . 5570 1 975 . 1 1 103 103 ALA CA C 13 51.9 0.2 . 1 . . . . . . . . 5570 1 976 . 1 1 103 103 ALA CB C 13 23.3 0.2 . 1 . . . . . . . . 5570 1 977 . 1 1 103 103 ALA N N 15 115.7 0.2 . 1 . . . . . . . . 5570 1 978 . 1 1 104 104 SER H H 1 7.67 0.02 . 1 . . . . . . . . 5570 1 979 . 1 1 104 104 SER HA H 1 4.88 0.02 . 1 . . . . . . . . 5570 1 980 . 1 1 104 104 SER HB2 H 1 3.71 0.02 . 2 . . . . . . . . 5570 1 981 . 1 1 104 104 SER HB3 H 1 3.60 0.02 . 2 . . . . . . . . 5570 1 982 . 1 1 104 104 SER C C 13 172.6 0.2 . 1 . . . . . . . . 5570 1 983 . 1 1 104 104 SER CA C 13 57.1 0.2 . 1 . . . . . . . . 5570 1 984 . 1 1 104 104 SER CB C 13 64.8 0.2 . 1 . . . . . . . . 5570 1 985 . 1 1 104 104 SER N N 15 113.2 0.2 . 1 . . . . . . . . 5570 1 986 . 1 1 105 105 PHE H H 1 8.56 0.02 . 1 . . . . . . . . 5570 1 987 . 1 1 105 105 PHE HA H 1 5.45 0.02 . 1 . . . . . . . . 5570 1 988 . 1 1 105 105 PHE HB2 H 1 3.01 0.02 . 2 . . . . . . . . 5570 1 989 . 1 1 105 105 PHE HB3 H 1 2.37 0.02 . 2 . . . . . . . . 5570 1 990 . 1 1 105 105 PHE C C 13 174.1 0.2 . 1 . . . . . . . . 5570 1 991 . 1 1 105 105 PHE CA C 13 56.1 0.2 . 1 . . . . . . . . 5570 1 992 . 1 1 105 105 PHE CB C 13 45.3 0.2 . 1 . . . . . . . . 5570 1 993 . 1 1 105 105 PHE N N 15 118.0 0.2 . 1 . . . . . . . . 5570 1 994 . 1 1 106 106 SER H H 1 8.38 0.02 . 1 . . . . . . . . 5570 1 995 . 1 1 106 106 SER HA H 1 4.73 0.02 . 1 . . . . . . . . 5570 1 996 . 1 1 106 106 SER HB2 H 1 3.70 0.02 . 1 . . . . . . . . 5570 1 997 . 1 1 106 106 SER HB3 H 1 3.70 0.02 . 1 . . . . . . . . 5570 1 998 . 1 1 106 106 SER CA C 13 58.0 0.2 . 1 . . . . . . . . 5570 1 999 . 1 1 106 106 SER CB C 13 63.8 0.2 . 1 . . . . . . . . 5570 1 1000 . 1 1 106 106 SER N N 15 113.0 0.2 . 1 . . . . . . . . 5570 1 1001 . 1 1 107 107 PRO HA H 1 4.01 0.02 . 1 . . . . . . . . 5570 1 1002 . 1 1 107 107 PRO HB2 H 1 1.41 0.02 . 1 . . . . . . . . 5570 1 1003 . 1 1 107 107 PRO HB3 H 1 1.41 0.02 . 1 . . . . . . . . 5570 1 1004 . 1 1 107 107 PRO CA C 13 63.8 0.2 . 1 . . . . . . . . 5570 1 1005 . 1 1 107 107 PRO CB C 13 31.4 0.2 . 1 . . . . . . . . 5570 1 1006 . 1 1 108 108 PHE H H 1 7.83 0.02 . 1 . . . . . . . . 5570 1 1007 . 1 1 108 108 PHE HA H 1 3.49 0.02 . 1 . . . . . . . . 5570 1 1008 . 1 1 108 108 PHE C C 13 175.9 0.2 . 1 . . . . . . . . 5570 1 1009 . 1 1 108 108 PHE CA C 13 58.5 0.2 . 1 . . . . . . . . 5570 1 1010 . 1 1 108 108 PHE CB C 13 37.7 0.2 . 1 . . . . . . . . 5570 1 1011 . 1 1 108 108 PHE N N 15 115.1 0.2 . 1 . . . . . . . . 5570 1 1012 . 1 1 109 109 GLN H H 1 7.05 0.02 . 1 . . . . . . . . 5570 1 1013 . 1 1 109 109 GLN HA H 1 4.70 0.02 . 1 . . . . . . . . 5570 1 1014 . 1 1 109 109 GLN HB2 H 1 2.13 0.02 . 1 . . . . . . . . 5570 1 1015 . 1 1 109 109 GLN HB3 H 1 2.13 0.02 . 1 . . . . . . . . 5570 1 1016 . 1 1 109 109 GLN HG2 H 1 2.43 0.02 . 1 . . . . . . . . 5570 1 1017 . 1 1 109 109 GLN HG3 H 1 2.43 0.02 . 1 . . . . . . . . 5570 1 1018 . 1 1 109 109 GLN HE21 H 1 7.59 0.02 . 2 . . . . . . . . 5570 1 1019 . 1 1 109 109 GLN HE22 H 1 7.00 0.02 . 2 . . . . . . . . 5570 1 1020 . 1 1 109 109 GLN C C 13 174.5 0.2 . 1 . . . . . . . . 5570 1 1021 . 1 1 109 109 GLN CA C 13 55.6 0.2 . 1 . . . . . . . . 5570 1 1022 . 1 1 109 109 GLN CB C 13 31.8 0.2 . 1 . . . . . . . . 5570 1 1023 . 1 1 109 109 GLN CG C 13 33.8 0.2 . 1 . . . . . . . . 5570 1 1024 . 1 1 109 109 GLN N N 15 115.7 0.2 . 1 . . . . . . . . 5570 1 1025 . 1 1 109 109 GLN NE2 N 15 111.2 0.2 . 1 . . . . . . . . 5570 1 1026 . 1 1 110 110 THR H H 1 7.30 0.02 . 1 . . . . . . . . 5570 1 1027 . 1 1 110 110 THR HA H 1 4.70 0.02 . 1 . . . . . . . . 5570 1 1028 . 1 1 110 110 THR HB H 1 4.19 0.02 . 1 . . . . . . . . 5570 1 1029 . 1 1 110 110 THR HG21 H 1 1.15 0.02 . 1 . . . . . . . . 5570 1 1030 . 1 1 110 110 THR HG22 H 1 1.15 0.02 . 1 . . . . . . . . 5570 1 1031 . 1 1 110 110 THR HG23 H 1 1.15 0.02 . 1 . . . . . . . . 5570 1 1032 . 1 1 110 110 THR C C 13 173.3 0.2 . 1 . . . . . . . . 5570 1 1033 . 1 1 110 110 THR CA C 13 60.5 0.2 . 1 . . . . . . . . 5570 1 1034 . 1 1 110 110 THR CB C 13 72.6 0.2 . 1 . . . . . . . . 5570 1 1035 . 1 1 110 110 THR CG2 C 13 21.6 0.2 . 1 . . . . . . . . 5570 1 1036 . 1 1 110 110 THR N N 15 109.9 0.2 . 1 . . . . . . . . 5570 1 1037 . 1 1 111 111 THR H H 1 8.57 0.02 . 1 . . . . . . . . 5570 1 1038 . 1 1 111 111 THR HA H 1 4.81 0.02 . 1 . . . . . . . . 5570 1 1039 . 1 1 111 111 THR HB H 1 4.71 0.02 . 1 . . . . . . . . 5570 1 1040 . 1 1 111 111 THR HG21 H 1 1.06 0.02 . 1 . . . . . . . . 5570 1 1041 . 1 1 111 111 THR HG22 H 1 1.06 0.02 . 1 . . . . . . . . 5570 1 1042 . 1 1 111 111 THR HG23 H 1 1.06 0.02 . 1 . . . . . . . . 5570 1 1043 . 1 1 111 111 THR C C 13 174.8 0.2 . 1 . . . . . . . . 5570 1 1044 . 1 1 111 111 THR CA C 13 60.5 0.2 . 1 . . . . . . . . 5570 1 1045 . 1 1 111 111 THR CB C 13 66.8 0.2 . 1 . . . . . . . . 5570 1 1046 . 1 1 111 111 THR CG2 C 13 21.7 0.2 . 1 . . . . . . . . 5570 1 1047 . 1 1 111 111 THR N N 15 106.7 0.2 . 1 . . . . . . . . 5570 1 1048 . 1 1 112 112 LEU H H 1 7.50 0.02 . 1 . . . . . . . . 5570 1 1049 . 1 1 112 112 LEU HA H 1 4.13 0.02 . 1 . . . . . . . . 5570 1 1050 . 1 1 112 112 LEU HB2 H 1 1.32 0.02 . 4 . . . . . . . . 5570 1 1051 . 1 1 112 112 LEU HB3 H 1 1.32 0.02 . 4 . . . . . . . . 5570 1 1052 . 1 1 112 112 LEU HG H 1 1.31 0.02 . 4 . . . . . . . . 5570 1 1053 . 1 1 112 112 LEU HD11 H 1 0.36 0.02 . 1 . . . . . . . . 5570 1 1054 . 1 1 112 112 LEU HD12 H 1 0.36 0.02 . 1 . . . . . . . . 5570 1 1055 . 1 1 112 112 LEU HD13 H 1 0.36 0.02 . 1 . . . . . . . . 5570 1 1056 . 1 1 112 112 LEU HD21 H 1 0.65 0.02 . 1 . . . . . . . . 5570 1 1057 . 1 1 112 112 LEU HD22 H 1 0.65 0.02 . 1 . . . . . . . . 5570 1 1058 . 1 1 112 112 LEU HD23 H 1 0.65 0.02 . 1 . . . . . . . . 5570 1 1059 . 1 1 112 112 LEU C C 13 179.2 0.2 . 1 . . . . . . . . 5570 1 1060 . 1 1 112 112 LEU CA C 13 54.7 0.2 . 1 . . . . . . . . 5570 1 1061 . 1 1 112 112 LEU CB C 13 43.0 0.2 . 1 . . . . . . . . 5570 1 1062 . 1 1 112 112 LEU CG C 13 27.2 0.2 . 1 . . . . . . . . 5570 1 1063 . 1 1 112 112 LEU CD1 C 13 26.7 0.2 . 1 . . . . . . . . 5570 1 1064 . 1 1 112 112 LEU CD2 C 13 25.1 0.2 . 1 . . . . . . . . 5570 1 1065 . 1 1 112 112 LEU N N 15 120.3 0.2 . 1 . . . . . . . . 5570 1 1066 . 1 1 113 113 SER H H 1 8.72 0.02 . 1 . . . . . . . . 5570 1 1067 . 1 1 113 113 SER HA H 1 3.88 0.02 . 1 . . . . . . . . 5570 1 1068 . 1 1 113 113 SER HB2 H 1 3.72 0.02 . 1 . . . . . . . . 5570 1 1069 . 1 1 113 113 SER HB3 H 1 3.72 0.02 . 1 . . . . . . . . 5570 1 1070 . 1 1 113 113 SER C C 13 174.5 0.2 . 1 . . . . . . . . 5570 1 1071 . 1 1 113 113 SER CA C 13 61.9 0.2 . 1 . . . . . . . . 5570 1 1072 . 1 1 113 113 SER CB C 13 63.8 0.2 . 1 . . . . . . . . 5570 1 1073 . 1 1 113 113 SER N N 15 112.5 0.2 . 1 . . . . . . . . 5570 1 1074 . 1 1 114 114 SER H H 1 6.42 0.02 . 1 . . . . . . . . 5570 1 1075 . 1 1 114 114 SER HA H 1 5.21 0.02 . 1 . . . . . . . . 5570 1 1076 . 1 1 114 114 SER HB2 H 1 4.79 0.02 . 2 . . . . . . . . 5570 1 1077 . 1 1 114 114 SER HB3 H 1 3.30 0.02 . 2 . . . . . . . . 5570 1 1078 . 1 1 114 114 SER C C 13 173.8 0.2 . 1 . . . . . . . . 5570 1 1079 . 1 1 114 114 SER CA C 13 57.6 0.2 . 1 . . . . . . . . 5570 1 1080 . 1 1 114 114 SER CB C 13 70.7 0.2 . 1 . . . . . . . . 5570 1 1081 . 1 1 114 114 SER N N 15 111.9 0.2 . 1 . . . . . . . . 5570 1 1082 . 1 1 115 115 PHE H H 1 7.97 0.02 . 1 . . . . . . . . 5570 1 1083 . 1 1 115 115 PHE HA H 1 4.67 0.02 . 1 . . . . . . . . 5570 1 1084 . 1 1 115 115 PHE HB2 H 1 3.50 0.02 . 2 . . . . . . . . 5570 1 1085 . 1 1 115 115 PHE HB3 H 1 3.07 0.02 . 2 . . . . . . . . 5570 1 1086 . 1 1 115 115 PHE C C 13 177.2 0.2 . 1 . . . . . . . . 5570 1 1087 . 1 1 115 115 PHE CA C 13 61.5 0.2 . 1 . . . . . . . . 5570 1 1088 . 1 1 115 115 PHE CB C 13 40.2 0.2 . 1 . . . . . . . . 5570 1 1089 . 1 1 115 115 PHE N N 15 118.6 0.2 . 1 . . . . . . . . 5570 1 1090 . 1 1 116 116 MET H H 1 8.49 0.02 . 1 . . . . . . . . 5570 1 1091 . 1 1 116 116 MET HA H 1 6.35 0.02 . 1 . . . . . . . . 5570 1 1092 . 1 1 116 116 MET HB2 H 1 2.31 0.02 . 2 . . . . . . . . 5570 1 1093 . 1 1 116 116 MET HB3 H 1 1.56 0.02 . 2 . . . . . . . . 5570 1 1094 . 1 1 116 116 MET HG2 H 1 2.62 0.02 . 2 . . . . . . . . 5570 1 1095 . 1 1 116 116 MET HG3 H 1 2.18 0.02 . 2 . . . . . . . . 5570 1 1096 . 1 1 116 116 MET HE1 H 1 1.93 0.02 . 1 . . . . . . . . 5570 1 1097 . 1 1 116 116 MET HE2 H 1 1.93 0.02 . 1 . . . . . . . . 5570 1 1098 . 1 1 116 116 MET HE3 H 1 1.93 0.02 . 1 . . . . . . . . 5570 1 1099 . 1 1 116 116 MET C C 13 175.3 0.2 . 1 . . . . . . . . 5570 1 1100 . 1 1 116 116 MET CA C 13 55.1 0.2 . 1 . . . . . . . . 5570 1 1101 . 1 1 116 116 MET CB C 13 37.7 0.2 . 1 . . . . . . . . 5570 1 1102 . 1 1 116 116 MET CG C 13 30.7 0.2 . 1 . . . . . . . . 5570 1 1103 . 1 1 116 116 MET CE C 13 16.7 0.2 . 1 . . . . . . . . 5570 1 1104 . 1 1 116 116 MET N N 15 113.2 0.2 . 1 . . . . . . . . 5570 1 1105 . 1 1 117 117 CYS H H 1 7.04 0.02 . 1 . . . . . . . . 5570 1 1106 . 1 1 117 117 CYS HA H 1 4.62 0.02 . 1 . . . . . . . . 5570 1 1107 . 1 1 117 117 CYS HB2 H 1 2.23 0.02 . 2 . . . . . . . . 5570 1 1108 . 1 1 117 117 CYS HB3 H 1 2.07 0.02 . 2 . . . . . . . . 5570 1 1109 . 1 1 117 117 CYS C C 13 171.9 0.2 . 1 . . . . . . . . 5570 1 1110 . 1 1 117 117 CYS CA C 13 59.5 0.2 . 1 . . . . . . . . 5570 1 1111 . 1 1 117 117 CYS CB C 13 30.4 0.2 . 1 . . . . . . . . 5570 1 1112 . 1 1 117 117 CYS N N 15 119.5 0.2 . 1 . . . . . . . . 5570 1 1113 . 1 1 118 118 VAL H H 1 8.31 0.02 . 1 . . . . . . . . 5570 1 1114 . 1 1 118 118 VAL HA H 1 5.42 0.02 . 1 . . . . . . . . 5570 1 1115 . 1 1 118 118 VAL HB H 1 1.85 0.02 . 1 . . . . . . . . 5570 1 1116 . 1 1 118 118 VAL HG11 H 1 1.20 0.02 . 1 . . . . . . . . 5570 1 1117 . 1 1 118 118 VAL HG12 H 1 1.20 0.02 . 1 . . . . . . . . 5570 1 1118 . 1 1 118 118 VAL HG13 H 1 1.20 0.02 . 1 . . . . . . . . 5570 1 1119 . 1 1 118 118 VAL HG21 H 1 0.94 0.02 . 1 . . . . . . . . 5570 1 1120 . 1 1 118 118 VAL HG22 H 1 0.94 0.02 . 1 . . . . . . . . 5570 1 1121 . 1 1 118 118 VAL HG23 H 1 0.94 0.02 . 1 . . . . . . . . 5570 1 1122 . 1 1 118 118 VAL C C 13 175.2 0.2 . 1 . . . . . . . . 5570 1 1123 . 1 1 118 118 VAL CA C 13 59.5 0.2 . 1 . . . . . . . . 5570 1 1124 . 1 1 118 118 VAL CB C 13 33.8 0.2 . 1 . . . . . . . . 5570 1 1125 . 1 1 118 118 VAL CG1 C 13 21.7 0.2 . 1 . . . . . . . . 5570 1 1126 . 1 1 118 118 VAL CG2 C 13 23.1 0.2 . 1 . . . . . . . . 5570 1 1127 . 1 1 118 118 VAL N N 15 123.4 0.2 . 1 . . . . . . . . 5570 1 1128 . 1 1 119 119 TYR H H 1 8.50 0.02 . 1 . . . . . . . . 5570 1 1129 . 1 1 119 119 TYR HA H 1 5.10 0.02 . 1 . . . . . . . . 5570 1 1130 . 1 1 119 119 TYR HB2 H 1 2.55 0.02 . 2 . . . . . . . . 5570 1 1131 . 1 1 119 119 TYR HB3 H 1 1.72 0.02 . 2 . . . . . . . . 5570 1 1132 . 1 1 119 119 TYR HD1 H 1 6.48 0.02 . 1 . . . . . . . . 5570 1 1133 . 1 1 119 119 TYR HD2 H 1 6.48 0.02 . 1 . . . . . . . . 5570 1 1134 . 1 1 119 119 TYR HE1 H 1 6.61 0.02 . 1 . . . . . . . . 5570 1 1135 . 1 1 119 119 TYR HE2 H 1 6.61 0.02 . 1 . . . . . . . . 5570 1 1136 . 1 1 119 119 TYR C C 13 173.4 0.2 . 1 . . . . . . . . 5570 1 1137 . 1 1 119 119 TYR CA C 13 57.0 0.2 . 1 . . . . . . . . 5570 1 1138 . 1 1 119 119 TYR CB C 13 43.5 0.2 . 1 . . . . . . . . 5570 1 1139 . 1 1 119 119 TYR CD1 C 13 132.8 0.2 . 1 . . . . . . . . 5570 1 1140 . 1 1 119 119 TYR CD2 C 13 132.8 0.2 . 1 . . . . . . . . 5570 1 1141 . 1 1 119 119 TYR CE1 C 13 117.2 0.2 . 1 . . . . . . . . 5570 1 1142 . 1 1 119 119 TYR CE2 C 13 117.2 0.2 . 1 . . . . . . . . 5570 1 1143 . 1 1 119 119 TYR N N 15 124.8 0.2 . 1 . . . . . . . . 5570 1 1144 . 1 1 120 120 GLU H H 1 9.29 0.02 . 1 . . . . . . . . 5570 1 1145 . 1 1 120 120 GLU HA H 1 5.77 0.02 . 1 . . . . . . . . 5570 1 1146 . 1 1 120 120 GLU HB2 H 1 2.29 0.02 . 2 . . . . . . . . 5570 1 1147 . 1 1 120 120 GLU HB3 H 1 2.18 0.02 . 2 . . . . . . . . 5570 1 1148 . 1 1 120 120 GLU HG2 H 1 2.45 0.02 . 2 . . . . . . . . 5570 1 1149 . 1 1 120 120 GLU HG3 H 1 2.12 0.02 . 2 . . . . . . . . 5570 1 1150 . 1 1 120 120 GLU C C 13 175.1 0.2 . 1 . . . . . . . . 5570 1 1151 . 1 1 120 120 GLU CA C 13 55.1 0.2 . 1 . . . . . . . . 5570 1 1152 . 1 1 120 120 GLU CB C 13 35.2 0.2 . 1 . . . . . . . . 5570 1 1153 . 1 1 120 120 GLU CG C 13 39.4 0.2 . 1 . . . . . . . . 5570 1 1154 . 1 1 120 120 GLU N N 15 119.3 0.2 . 1 . . . . . . . . 5570 1 1155 . 1 1 121 121 LEU H H 1 9.60 0.02 . 1 . . . . . . . . 5570 1 1156 . 1 1 121 121 LEU HA H 1 5.28 0.02 . 1 . . . . . . . . 5570 1 1157 . 1 1 121 121 LEU HB2 H 1 1.80 0.02 . 4 . . . . . . . . 5570 1 1158 . 1 1 121 121 LEU HB3 H 1 1.80 0.02 . 4 . . . . . . . . 5570 1 1159 . 1 1 121 121 LEU HG H 1 1.80 0.02 . 4 . . . . . . . . 5570 1 1160 . 1 1 121 121 LEU HD11 H 1 0.94 0.02 . 1 . . . . . . . . 5570 1 1161 . 1 1 121 121 LEU HD12 H 1 0.94 0.02 . 1 . . . . . . . . 5570 1 1162 . 1 1 121 121 LEU HD13 H 1 0.94 0.02 . 1 . . . . . . . . 5570 1 1163 . 1 1 121 121 LEU HD21 H 1 0.94 0.02 . 1 . . . . . . . . 5570 1 1164 . 1 1 121 121 LEU HD22 H 1 0.94 0.02 . 1 . . . . . . . . 5570 1 1165 . 1 1 121 121 LEU HD23 H 1 0.94 0.02 . 1 . . . . . . . . 5570 1 1166 . 1 1 121 121 LEU C C 13 174.7 0.2 . 1 . . . . . . . . 5570 1 1167 . 1 1 121 121 LEU CA C 13 53.8 0.2 . 1 . . . . . . . . 5570 1 1168 . 1 1 121 121 LEU CB C 13 46.3 0.2 . 1 . . . . . . . . 5570 1 1169 . 1 1 121 121 LEU CD1 C 13 26.2 0.2 . 1 . . . . . . . . 5570 1 1170 . 1 1 121 121 LEU CD2 C 13 26.2 0.2 . 1 . . . . . . . . 5570 1 1171 . 1 1 121 121 LEU N N 15 127.5 0.2 . 1 . . . . . . . . 5570 1 1172 . 1 1 122 122 ARG H H 1 8.90 0.02 . 1 . . . . . . . . 5570 1 1173 . 1 1 122 122 ARG HA H 1 5.54 0.02 . 1 . . . . . . . . 5570 1 1174 . 1 1 122 122 ARG HB2 H 1 1.88 0.02 . 1 . . . . . . . . 5570 1 1175 . 1 1 122 122 ARG HB3 H 1 1.88 0.02 . 1 . . . . . . . . 5570 1 1176 . 1 1 122 122 ARG HG2 H 1 1.80 0.02 . 2 . . . . . . . . 5570 1 1177 . 1 1 122 122 ARG HG3 H 1 1.67 0.02 . 2 . . . . . . . . 5570 1 1178 . 1 1 122 122 ARG HD2 H 1 3.28 0.02 . 1 . . . . . . . . 5570 1 1179 . 1 1 122 122 ARG HD3 H 1 3.28 0.02 . 1 . . . . . . . . 5570 1 1180 . 1 1 122 122 ARG C C 13 175.4 0.2 . 1 . . . . . . . . 5570 1 1181 . 1 1 122 122 ARG CA C 13 54.3 0.2 . 1 . . . . . . . . 5570 1 1182 . 1 1 122 122 ARG CB C 13 29.9 0.2 . 1 . . . . . . . . 5570 1 1183 . 1 1 122 122 ARG CG C 13 27.5 0.2 . 1 . . . . . . . . 5570 1 1184 . 1 1 122 122 ARG CD C 13 43.0 0.2 . 1 . . . . . . . . 5570 1 1185 . 1 1 122 122 ARG N N 15 123.3 0.2 . 1 . . . . . . . . 5570 1 1186 . 1 1 123 123 SER H H 1 7.91 0.02 . 1 . . . . . . . . 5570 1 1187 . 1 1 123 123 SER HA H 1 4.47 0.02 . 1 . . . . . . . . 5570 1 1188 . 1 1 123 123 SER HB2 H 1 4.17 0.02 . 2 . . . . . . . . 5570 1 1189 . 1 1 123 123 SER HB3 H 1 3.58 0.02 . 2 . . . . . . . . 5570 1 1190 . 1 1 123 123 SER C C 13 172.3 0.2 . 1 . . . . . . . . 5570 1 1191 . 1 1 123 123 SER CA C 13 57.5 0.2 . 1 . . . . . . . . 5570 1 1192 . 1 1 123 123 SER CB C 13 65.3 0.2 . 1 . . . . . . . . 5570 1 1193 . 1 1 123 123 SER N N 15 116.9 0.2 . 1 . . . . . . . . 5570 1 1194 . 1 1 124 124 ASP H H 1 8.22 0.02 . 1 . . . . . . . . 5570 1 1195 . 1 1 124 124 ASP HA H 1 4.80 0.02 . 1 . . . . . . . . 5570 1 1196 . 1 1 124 124 ASP HB2 H 1 2.84 0.02 . 2 . . . . . . . . 5570 1 1197 . 1 1 124 124 ASP HB3 H 1 2.47 0.02 . 2 . . . . . . . . 5570 1 1198 . 1 1 124 124 ASP C C 13 176.2 0.2 . 1 . . . . . . . . 5570 1 1199 . 1 1 124 124 ASP CA C 13 53.8 0.2 . 1 . . . . . . . . 5570 1 1200 . 1 1 124 124 ASP CB C 13 41.6 0.2 . 1 . . . . . . . . 5570 1 1201 . 1 1 124 124 ASP N N 15 120.3 0.2 . 1 . . . . . . . . 5570 1 1202 . 1 1 125 125 ALA H H 1 8.09 0.02 . 1 . . . . . . . . 5570 1 1203 . 1 1 125 125 ALA HA H 1 4.47 0.02 . 1 . . . . . . . . 5570 1 1204 . 1 1 125 125 ALA HB1 H 1 1.31 0.02 . 1 . . . . . . . . 5570 1 1205 . 1 1 125 125 ALA HB2 H 1 1.31 0.02 . 1 . . . . . . . . 5570 1 1206 . 1 1 125 125 ALA HB3 H 1 1.31 0.02 . 1 . . . . . . . . 5570 1 1207 . 1 1 125 125 ALA C C 13 177.1 0.2 . 1 . . . . . . . . 5570 1 1208 . 1 1 125 125 ALA CA C 13 53.5 0.2 . 1 . . . . . . . . 5570 1 1209 . 1 1 125 125 ALA CB C 13 19.8 0.2 . 1 . . . . . . . . 5570 1 1210 . 1 1 125 125 ALA N N 15 123.8 0.2 . 1 . . . . . . . . 5570 1 1211 . 1 1 126 126 THR H H 1 8.74 0.02 . 1 . . . . . . . . 5570 1 1212 . 1 1 126 126 THR HA H 1 4.13 0.02 . 1 . . . . . . . . 5570 1 1213 . 1 1 126 126 THR HB H 1 4.10 0.02 . 1 . . . . . . . . 5570 1 1214 . 1 1 126 126 THR HG21 H 1 1.40 0.02 . 1 . . . . . . . . 5570 1 1215 . 1 1 126 126 THR HG22 H 1 1.40 0.02 . 1 . . . . . . . . 5570 1 1216 . 1 1 126 126 THR HG23 H 1 1.40 0.02 . 1 . . . . . . . . 5570 1 1217 . 1 1 126 126 THR CA C 13 61.5 0.2 . 1 . . . . . . . . 5570 1 1218 . 1 1 126 126 THR CB C 13 70.0 0.2 . 1 . . . . . . . . 5570 1 1219 . 1 1 126 126 THR CG2 C 13 21.6 0.2 . 1 . . . . . . . . 5570 1 1220 . 1 1 126 126 THR N N 15 121.3 0.2 . 1 . . . . . . . . 5570 1 1221 . 1 1 127 127 PRO HA H 1 4.92 0.02 . 1 . . . . . . . . 5570 1 1222 . 1 1 127 127 PRO C C 13 175.2 0.2 . 1 . . . . . . . . 5570 1 1223 . 1 1 127 127 PRO CA C 13 62.9 0.2 . 1 . . . . . . . . 5570 1 1224 . 1 1 127 127 PRO CB C 13 32.8 0.2 . 1 . . . . . . . . 5570 1 1225 . 1 1 127 127 PRO CG C 13 27.0 0.2 . 1 . . . . . . . . 5570 1 1226 . 1 1 128 128 ILE H H 1 8.65 0.02 . 1 . . . . . . . . 5570 1 1227 . 1 1 128 128 ILE HA H 1 3.77 0.02 . 1 . . . . . . . . 5570 1 1228 . 1 1 128 128 ILE HB H 1 1.91 0.02 . 1 . . . . . . . . 5570 1 1229 . 1 1 128 128 ILE HG12 H 1 1.41 0.02 . 2 . . . . . . . . 5570 1 1230 . 1 1 128 128 ILE HG13 H 1 1.20 0.02 . 2 . . . . . . . . 5570 1 1231 . 1 1 128 128 ILE HG21 H 1 0.74 0.02 . 1 . . . . . . . . 5570 1 1232 . 1 1 128 128 ILE HG22 H 1 0.74 0.02 . 1 . . . . . . . . 5570 1 1233 . 1 1 128 128 ILE HG23 H 1 0.74 0.02 . 1 . . . . . . . . 5570 1 1234 . 1 1 128 128 ILE HD11 H 1 0.72 0.02 . 1 . . . . . . . . 5570 1 1235 . 1 1 128 128 ILE HD12 H 1 0.72 0.02 . 1 . . . . . . . . 5570 1 1236 . 1 1 128 128 ILE HD13 H 1 0.72 0.02 . 1 . . . . . . . . 5570 1 1237 . 1 1 128 128 ILE C C 13 173.8 0.2 . 1 . . . . . . . . 5570 1 1238 . 1 1 128 128 ILE CA C 13 59.9 0.2 . 1 . . . . . . . . 5570 1 1239 . 1 1 128 128 ILE CB C 13 35.0 0.2 . 1 . . . . . . . . 5570 1 1240 . 1 1 128 128 ILE CG1 C 13 26.8 0.2 . 1 . . . . . . . . 5570 1 1241 . 1 1 128 128 ILE CG2 C 13 17.7 0.2 . 1 . . . . . . . . 5570 1 1242 . 1 1 128 128 ILE CD1 C 13 11.4 0.2 . 1 . . . . . . . . 5570 1 1243 . 1 1 128 128 ILE N N 15 122.1 0.2 . 1 . . . . . . . . 5570 1 1244 . 1 1 129 129 PHE H H 1 6.30 0.02 . 1 . . . . . . . . 5570 1 1245 . 1 1 129 129 PHE HA H 1 4.78 0.02 . 1 . . . . . . . . 5570 1 1246 . 1 1 129 129 PHE HB2 H 1 3.38 0.02 . 2 . . . . . . . . 5570 1 1247 . 1 1 129 129 PHE HB3 H 1 2.78 0.02 . 2 . . . . . . . . 5570 1 1248 . 1 1 129 129 PHE CA C 13 55.0 0.2 . 1 . . . . . . . . 5570 1 1249 . 1 1 129 129 PHE CB C 13 41.0 0.2 . 1 . . . . . . . . 5570 1 1250 . 1 1 129 129 PHE N N 15 117.6 0.2 . 1 . . . . . . . . 5570 1 1251 . 1 1 130 130 ASN H H 1 8.94 0.02 . 1 . . . . . . . . 5570 1 1252 . 1 1 130 130 ASN HA H 1 5.03 0.02 . 1 . . . . . . . . 5570 1 1253 . 1 1 130 130 ASN HB2 H 1 3.52 0.02 . 2 . . . . . . . . 5570 1 1254 . 1 1 130 130 ASN HB3 H 1 3.14 0.02 . 2 . . . . . . . . 5570 1 1255 . 1 1 130 130 ASN HD21 H 1 7.55 0.02 . 2 . . . . . . . . 5570 1 1256 . 1 1 130 130 ASN HD22 H 1 7.13 0.02 . 2 . . . . . . . . 5570 1 1257 . 1 1 130 130 ASN CA C 13 50.9 0.2 . 1 . . . . . . . . 5570 1 1258 . 1 1 130 130 ASN CB C 13 39.1 0.2 . 1 . . . . . . . . 5570 1 1259 . 1 1 130 130 ASN N N 15 119.4 0.2 . 1 . . . . . . . . 5570 1 1260 . 1 1 130 130 ASN ND2 N 15 112.0 0.2 . 1 . . . . . . . . 5570 1 1261 . 1 1 131 131 PRO HA H 1 5.52 0.02 . 1 . . . . . . . . 5570 1 1262 . 1 1 131 131 PRO HB2 H 1 2.44 0.02 . 2 . . . . . . . . 5570 1 1263 . 1 1 131 131 PRO HB3 H 1 2.22 0.02 . 2 . . . . . . . . 5570 1 1264 . 1 1 131 131 PRO HG2 H 1 1.87 0.02 . 2 . . . . . . . . 5570 1 1265 . 1 1 131 131 PRO HG3 H 1 1.64 0.02 . 2 . . . . . . . . 5570 1 1266 . 1 1 131 131 PRO HD2 H 1 4.31 0.02 . 2 . . . . . . . . 5570 1 1267 . 1 1 131 131 PRO HD3 H 1 3.98 0.02 . 2 . . . . . . . . 5570 1 1268 . 1 1 131 131 PRO C C 13 177.5 0.2 . 1 . . . . . . . . 5570 1 1269 . 1 1 131 131 PRO CA C 13 63.8 0.2 . 1 . . . . . . . . 5570 1 1270 . 1 1 131 131 PRO CB C 13 32.3 0.2 . 1 . . . . . . . . 5570 1 1271 . 1 1 131 131 PRO CG C 13 27.5 0.2 . 1 . . . . . . . . 5570 1 1272 . 1 1 131 131 PRO CD C 13 51.4 0.2 . 1 . . . . . . . . 5570 1 1273 . 1 1 132 132 ASN H H 1 8.43 0.02 . 1 . . . . . . . . 5570 1 1274 . 1 1 132 132 ASN HA H 1 4.56 0.02 . 1 . . . . . . . . 5570 1 1275 . 1 1 132 132 ASN HB2 H 1 2.74 0.02 . 1 . . . . . . . . 5570 1 1276 . 1 1 132 132 ASN HB3 H 1 2.74 0.02 . 1 . . . . . . . . 5570 1 1277 . 1 1 132 132 ASN HD21 H 1 7.81 0.02 . 2 . . . . . . . . 5570 1 1278 . 1 1 132 132 ASN HD22 H 1 7.05 0.02 . 2 . . . . . . . . 5570 1 1279 . 1 1 132 132 ASN C C 13 175.6 0.2 . 1 . . . . . . . . 5570 1 1280 . 1 1 132 132 ASN CA C 13 55.1 0.2 . 1 . . . . . . . . 5570 1 1281 . 1 1 132 132 ASN CB C 13 38.6 0.2 . 1 . . . . . . . . 5570 1 1282 . 1 1 132 132 ASN N N 15 115.4 0.2 . 1 . . . . . . . . 5570 1 1283 . 1 1 132 132 ASN ND2 N 15 113.6 0.2 . 1 . . . . . . . . 5570 1 1284 . 1 1 133 133 ASP H H 1 7.70 0.02 . 1 . . . . . . . . 5570 1 1285 . 1 1 133 133 ASP HA H 1 4.88 0.02 . 1 . . . . . . . . 5570 1 1286 . 1 1 133 133 ASP HB2 H 1 3.03 0.02 . 2 . . . . . . . . 5570 1 1287 . 1 1 133 133 ASP HB3 H 1 2.71 0.02 . 2 . . . . . . . . 5570 1 1288 . 1 1 133 133 ASP C C 13 175.6 0.2 . 1 . . . . . . . . 5570 1 1289 . 1 1 133 133 ASP CA C 13 55.6 0.2 . 1 . . . . . . . . 5570 1 1290 . 1 1 133 133 ASP CB C 13 44.0 0.2 . 1 . . . . . . . . 5570 1 1291 . 1 1 133 133 ASP N N 15 115.2 0.2 . 1 . . . . . . . . 5570 1 1292 . 1 1 134 134 ILE H H 1 8.19 0.02 . 1 . . . . . . . . 5570 1 1293 . 1 1 134 134 ILE HA H 1 4.52 0.02 . 1 . . . . . . . . 5570 1 1294 . 1 1 134 134 ILE HB H 1 1.63 0.02 . 1 . . . . . . . . 5570 1 1295 . 1 1 134 134 ILE HG12 H 1 1.52 0.02 . 2 . . . . . . . . 5570 1 1296 . 1 1 134 134 ILE HG13 H 1 0.97 0.02 . 2 . . . . . . . . 5570 1 1297 . 1 1 134 134 ILE HG21 H 1 0.31 0.02 . 1 . . . . . . . . 5570 1 1298 . 1 1 134 134 ILE HG22 H 1 0.31 0.02 . 1 . . . . . . . . 5570 1 1299 . 1 1 134 134 ILE HG23 H 1 0.31 0.02 . 1 . . . . . . . . 5570 1 1300 . 1 1 134 134 ILE HD11 H 1 1.09 0.02 . 1 . . . . . . . . 5570 1 1301 . 1 1 134 134 ILE HD12 H 1 1.09 0.02 . 1 . . . . . . . . 5570 1 1302 . 1 1 134 134 ILE HD13 H 1 1.09 0.02 . 1 . . . . . . . . 5570 1 1303 . 1 1 134 134 ILE C C 13 173.5 0.2 . 1 . . . . . . . . 5570 1 1304 . 1 1 134 134 ILE CA C 13 60.5 0.2 . 1 . . . . . . . . 5570 1 1305 . 1 1 134 134 ILE CB C 13 43.5 0.2 . 1 . . . . . . . . 5570 1 1306 . 1 1 134 134 ILE CG1 C 13 28.1 0.2 . 1 . . . . . . . . 5570 1 1307 . 1 1 134 134 ILE CG2 C 13 17.8 0.2 . 1 . . . . . . . . 5570 1 1308 . 1 1 134 134 ILE CD1 C 13 13.9 0.2 . 1 . . . . . . . . 5570 1 1309 . 1 1 134 134 ILE N N 15 124.5 0.2 . 1 . . . . . . . . 5570 1 1310 . 1 1 135 135 SER H H 1 8.56 0.02 . 1 . . . . . . . . 5570 1 1311 . 1 1 135 135 SER HA H 1 4.74 0.02 . 1 . . . . . . . . 5570 1 1312 . 1 1 135 135 SER HB2 H 1 3.86 0.02 . 2 . . . . . . . . 5570 1 1313 . 1 1 135 135 SER HB3 H 1 3.75 0.02 . 2 . . . . . . . . 5570 1 1314 . 1 1 135 135 SER C C 13 174.9 0.2 . 1 . . . . . . . . 5570 1 1315 . 1 1 135 135 SER CA C 13 58.5 0.2 . 1 . . . . . . . . 5570 1 1316 . 1 1 135 135 SER CB C 13 64.8 0.2 . 1 . . . . . . . . 5570 1 1317 . 1 1 135 135 SER N N 15 116.6 0.2 . 1 . . . . . . . . 5570 1 1318 . 1 1 136 136 GLY H H 1 7.14 0.02 . 1 . . . . . . . . 5570 1 1319 . 1 1 136 136 GLY HA2 H 1 4.10 0.02 . 2 . . . . . . . . 5570 1 1320 . 1 1 136 136 GLY HA3 H 1 3.67 0.02 . 2 . . . . . . . . 5570 1 1321 . 1 1 136 136 GLY C C 13 168.7 0.2 . 1 . . . . . . . . 5570 1 1322 . 1 1 136 136 GLY CA C 13 44.5 0.2 . 1 . . . . . . . . 5570 1 1323 . 1 1 136 136 GLY N N 15 109.6 0.2 . 1 . . . . . . . . 5570 1 1324 . 1 1 137 137 GLY H H 1 8.15 0.02 . 1 . . . . . . . . 5570 1 1325 . 1 1 137 137 GLY C C 13 171.9 0.2 . 1 . . . . . . . . 5570 1 1326 . 1 1 137 137 GLY CA C 13 45.4 0.2 . 1 . . . . . . . . 5570 1 1327 . 1 1 137 137 GLY N N 15 103.0 0.2 . 1 . . . . . . . . 5570 1 1328 . 1 1 138 138 GLU H H 1 7.24 0.02 . 1 . . . . . . . . 5570 1 1329 . 1 1 138 138 GLU HA H 1 4.56 0.02 . 2 . . . . . . . . 5570 1 1330 . 1 1 138 138 GLU HB2 H 1 1.87 0.02 . 2 . . . . . . . . 5570 1 1331 . 1 1 138 138 GLU HB3 H 1 1.66 0.02 . 2 . . . . . . . . 5570 1 1332 . 1 1 138 138 GLU HG2 H 1 2.08 0.02 . 2 . . . . . . . . 5570 1 1333 . 1 1 138 138 GLU HG3 H 1 2.03 0.02 . 2 . . . . . . . . 5570 1 1334 . 1 1 138 138 GLU C C 13 173.4 0.2 . 1 . . . . . . . . 5570 1 1335 . 1 1 138 138 GLU CA C 13 54.3 0.2 . 1 . . . . . . . . 5570 1 1336 . 1 1 138 138 GLU CB C 13 35.5 0.2 . 1 . . . . . . . . 5570 1 1337 . 1 1 138 138 GLU CG C 13 37.0 0.2 . 1 . . . . . . . . 5570 1 1338 . 1 1 138 138 GLU N N 15 117.7 0.2 . 1 . . . . . . . . 5570 1 1339 . 1 1 139 139 TRP H H 1 8.62 0.02 . 1 . . . . . . . . 5570 1 1340 . 1 1 139 139 TRP HA H 1 5.34 0.02 . 1 . . . . . . . . 5570 1 1341 . 1 1 139 139 TRP HB2 H 1 3.01 0.02 . 1 . . . . . . . . 5570 1 1342 . 1 1 139 139 TRP HB3 H 1 3.01 0.02 . 1 . . . . . . . . 5570 1 1343 . 1 1 139 139 TRP HE1 H 1 9.97 0.02 . 1 . . . . . . . . 5570 1 1344 . 1 1 139 139 TRP C C 13 176.3 0.2 . 1 . . . . . . . . 5570 1 1345 . 1 1 139 139 TRP CA C 13 56.1 0.2 . 1 . . . . . . . . 5570 1 1346 . 1 1 139 139 TRP CB C 13 28.9 0.2 . 1 . . . . . . . . 5570 1 1347 . 1 1 139 139 TRP N N 15 122.5 0.2 . 1 . . . . . . . . 5570 1 1348 . 1 1 139 139 TRP NE1 N 15 127.0 0.2 . 1 . . . . . . . . 5570 1 1349 . 1 1 140 140 LEU H H 1 9.67 0.02 . 1 . . . . . . . . 5570 1 1350 . 1 1 140 140 LEU HA H 1 5.19 0.02 . 1 . . . . . . . . 5570 1 1351 . 1 1 140 140 LEU HB2 H 1 1.67 0.02 . 2 . . . . . . . . 5570 1 1352 . 1 1 140 140 LEU HB3 H 1 1.49 0.02 . 2 . . . . . . . . 5570 1 1353 . 1 1 140 140 LEU HD11 H 1 0.68 0.02 . 1 . . . . . . . . 5570 1 1354 . 1 1 140 140 LEU HD12 H 1 0.68 0.02 . 1 . . . . . . . . 5570 1 1355 . 1 1 140 140 LEU HD13 H 1 0.68 0.02 . 1 . . . . . . . . 5570 1 1356 . 1 1 140 140 LEU HD21 H 1 0.83 0.02 . 1 . . . . . . . . 5570 1 1357 . 1 1 140 140 LEU HD22 H 1 0.83 0.02 . 1 . . . . . . . . 5570 1 1358 . 1 1 140 140 LEU HD23 H 1 0.83 0.02 . 1 . . . . . . . . 5570 1 1359 . 1 1 140 140 LEU CA C 13 53.7 0.2 . 1 . . . . . . . . 5570 1 1360 . 1 1 140 140 LEU CB C 13 47.8 0.2 . 1 . . . . . . . . 5570 1 1361 . 1 1 140 140 LEU CD1 C 13 26.5 0.2 . 1 . . . . . . . . 5570 1 1362 . 1 1 140 140 LEU CD2 C 13 23.9 0.2 . 1 . . . . . . . . 5570 1 1363 . 1 1 140 140 LEU N N 15 124.4 0.2 . 1 . . . . . . . . 5570 1 1364 . 1 1 141 141 THR H H 1 8.93 0.02 . 1 . . . . . . . . 5570 1 1365 . 1 1 141 141 THR HA H 1 4.64 0.02 . 1 . . . . . . . . 5570 1 1366 . 1 1 141 141 THR HB H 1 4.64 0.02 . 1 . . . . . . . . 5570 1 1367 . 1 1 141 141 THR HG21 H 1 1.41 0.02 . 1 . . . . . . . . 5570 1 1368 . 1 1 141 141 THR HG22 H 1 1.41 0.02 . 1 . . . . . . . . 5570 1 1369 . 1 1 141 141 THR HG23 H 1 1.41 0.02 . 1 . . . . . . . . 5570 1 1370 . 1 1 141 141 THR CA C 13 60.9 0.2 . 1 . . . . . . . . 5570 1 1371 . 1 1 141 141 THR CB C 13 68.2 0.2 . 1 . . . . . . . . 5570 1 1372 . 1 1 141 141 THR CG2 C 13 23.1 0.2 . 1 . . . . . . . . 5570 1 1373 . 1 1 141 141 THR N N 15 113.7 0.2 . 1 . . . . . . . . 5570 1 1374 . 1 1 142 142 PRO HA H 1 3.80 0.02 . 1 . . . . . . . . 5570 1 1375 . 1 1 142 142 PRO HB2 H 1 1.92 0.02 . 1 . . . . . . . . 5570 1 1376 . 1 1 142 142 PRO HB3 H 1 1.92 0.02 . 1 . . . . . . . . 5570 1 1377 . 1 1 142 142 PRO HG2 H 1 2.12 0.02 . 2 . . . . . . . . 5570 1 1378 . 1 1 142 142 PRO HG3 H 1 1.41 0.02 . 2 . . . . . . . . 5570 1 1379 . 1 1 142 142 PRO C C 13 177.3 0.2 . 1 . . . . . . . . 5570 1 1380 . 1 1 142 142 PRO CA C 13 66.3 0.2 . 1 . . . . . . . . 5570 1 1381 . 1 1 142 142 PRO CB C 13 31.8 0.2 . 1 . . . . . . . . 5570 1 1382 . 1 1 142 142 PRO CG C 13 27.5 0.2 . 1 . . . . . . . . 5570 1 1383 . 1 1 143 143 GLU H H 1 8.81 0.02 . 1 . . . . . . . . 5570 1 1384 . 1 1 143 143 GLU HA H 1 3.87 0.02 . 1 . . . . . . . . 5570 1 1385 . 1 1 143 143 GLU HB2 H 1 2.00 0.02 . 2 . . . . . . . . 5570 1 1386 . 1 1 143 143 GLU HB3 H 1 1.92 0.02 . 2 . . . . . . . . 5570 1 1387 . 1 1 143 143 GLU HG2 H 1 2.34 0.02 . 1 . . . . . . . . 5570 1 1388 . 1 1 143 143 GLU HG3 H 1 2.26 0.02 . 1 . . . . . . . . 5570 1 1389 . 1 1 143 143 GLU C C 13 179.2 0.2 . 1 . . . . . . . . 5570 1 1390 . 1 1 143 143 GLU CA C 13 60.0 0.2 . 1 . . . . . . . . 5570 1 1391 . 1 1 143 143 GLU CB C 13 29.4 0.2 . 1 . . . . . . . . 5570 1 1392 . 1 1 143 143 GLU CG C 13 36.7 0.2 . 1 . . . . . . . . 5570 1 1393 . 1 1 143 143 GLU N N 15 113.0 0.2 . 1 . . . . . . . . 5570 1 1394 . 1 1 144 144 HIS H H 1 7.93 0.02 . 1 . . . . . . . . 5570 1 1395 . 1 1 144 144 HIS HA H 1 4.52 0.02 . 1 . . . . . . . . 5570 1 1396 . 1 1 144 144 HIS HB2 H 1 3.25 0.02 . 2 . . . . . . . . 5570 1 1397 . 1 1 144 144 HIS HB3 H 1 3.18 0.02 . 2 . . . . . . . . 5570 1 1398 . 1 1 144 144 HIS HD2 H 1 6.96 0.02 . 1 . . . . . . . . 5570 1 1399 . 1 1 144 144 HIS C C 13 178.2 0.2 . 1 . . . . . . . . 5570 1 1400 . 1 1 144 144 HIS CA C 13 58.0 0.2 . 1 . . . . . . . . 5570 1 1401 . 1 1 144 144 HIS CB C 13 31.4 0.2 . 1 . . . . . . . . 5570 1 1402 . 1 1 144 144 HIS N N 15 120.9 0.2 . 1 . . . . . . . . 5570 1 1403 . 1 1 145 145 LEU H H 1 8.46 0.02 . 1 . . . . . . . . 5570 1 1404 . 1 1 145 145 LEU HA H 1 3.88 0.02 . 1 . . . . . . . . 5570 1 1405 . 1 1 145 145 LEU C C 13 178.2 0.2 . 1 . . . . . . . . 5570 1 1406 . 1 1 145 145 LEU CA C 13 58.5 0.2 . 1 . . . . . . . . 5570 1 1407 . 1 1 145 145 LEU CB C 13 41.5 0.2 . 1 . . . . . . . . 5570 1 1408 . 1 1 145 145 LEU N N 15 119.4 0.2 . 1 . . . . . . . . 5570 1 1409 . 1 1 146 146 LEU H H 1 8.35 0.02 . 1 . . . . . . . . 5570 1 1410 . 1 1 146 146 LEU HA H 1 3.90 0.02 . 1 . . . . . . . . 5570 1 1411 . 1 1 146 146 LEU HB2 H 1 1.87 0.02 . 2 . . . . . . . . 5570 1 1412 . 1 1 146 146 LEU HB3 H 1 1.41 0.02 . 2 . . . . . . . . 5570 1 1413 . 1 1 146 146 LEU HD11 H 1 0.93 0.02 . 2 . . . . . . . . 5570 1 1414 . 1 1 146 146 LEU HD12 H 1 0.93 0.02 . 2 . . . . . . . . 5570 1 1415 . 1 1 146 146 LEU HD13 H 1 0.93 0.02 . 2 . . . . . . . . 5570 1 1416 . 1 1 146 146 LEU HD21 H 1 0.80 0.02 . 2 . . . . . . . . 5570 1 1417 . 1 1 146 146 LEU HD22 H 1 0.80 0.02 . 2 . . . . . . . . 5570 1 1418 . 1 1 146 146 LEU HD23 H 1 0.80 0.02 . 2 . . . . . . . . 5570 1 1419 . 1 1 146 146 LEU C C 13 179.8 0.2 . 1 . . . . . . . . 5570 1 1420 . 1 1 146 146 LEU CA C 13 58.5 0.2 . 1 . . . . . . . . 5570 1 1421 . 1 1 146 146 LEU CB C 13 41.1 0.2 . 1 . . . . . . . . 5570 1 1422 . 1 1 146 146 LEU CG C 13 26.0 0.2 . 1 . . . . . . . . 5570 1 1423 . 1 1 146 146 LEU N N 15 116.1 0.2 . 1 . . . . . . . . 5570 1 1424 . 1 1 147 147 ALA H H 1 7.91 0.02 . 1 . . . . . . . . 5570 1 1425 . 1 1 147 147 ALA HA H 1 4.18 0.02 . 1 . . . . . . . . 5570 1 1426 . 1 1 147 147 ALA HB1 H 1 1.54 0.02 . 1 . . . . . . . . 5570 1 1427 . 1 1 147 147 ALA HB2 H 1 1.54 0.02 . 1 . . . . . . . . 5570 1 1428 . 1 1 147 147 ALA HB3 H 1 1.54 0.02 . 1 . . . . . . . . 5570 1 1429 . 1 1 147 147 ALA CA C 13 55.1 0.2 . 1 . . . . . . . . 5570 1 1430 . 1 1 147 147 ALA CB C 13 17.8 0.2 . 1 . . . . . . . . 5570 1 1431 . 1 1 147 147 ALA N N 15 121.9 0.2 . 1 . . . . . . . . 5570 1 1432 . 1 1 148 148 ARG H H 1 8.00 0.02 . 1 . . . . . . . . 5570 1 1433 . 1 1 148 148 ARG HA H 1 3.99 0.02 . 1 . . . . . . . . 5570 1 1434 . 1 1 148 148 ARG C C 13 179.2 0.2 . 1 . . . . . . . . 5570 1 1435 . 1 1 148 148 ARG CA C 13 59.4 0.2 . 1 . . . . . . . . 5570 1 1436 . 1 1 148 148 ARG CB C 13 30.3 0.2 . 1 . . . . . . . . 5570 1 1437 . 1 1 148 148 ARG CG C 13 27.0 0.2 . 1 . . . . . . . . 5570 1 1438 . 1 1 148 148 ARG CD C 13 39.1 0.2 . 1 . . . . . . . . 5570 1 1439 . 1 1 148 148 ARG N N 15 119.6 0.2 . 1 . . . . . . . . 5570 1 1440 . 1 1 149 149 ILE H H 1 8.02 0.02 . 1 . . . . . . . . 5570 1 1441 . 1 1 149 149 ILE HA H 1 3.83 0.02 . 1 . . . . . . . . 5570 1 1442 . 1 1 149 149 ILE HB H 1 1.76 0.02 . 1 . . . . . . . . 5570 1 1443 . 1 1 149 149 ILE HG12 H 1 1.80 0.02 . 1 . . . . . . . . 5570 1 1444 . 1 1 149 149 ILE HG13 H 1 1.80 0.02 . 1 . . . . . . . . 5570 1 1445 . 1 1 149 149 ILE HG21 H 1 0.94 0.02 . 1 . . . . . . . . 5570 1 1446 . 1 1 149 149 ILE HG22 H 1 0.94 0.02 . 1 . . . . . . . . 5570 1 1447 . 1 1 149 149 ILE HG23 H 1 0.94 0.02 . 1 . . . . . . . . 5570 1 1448 . 1 1 149 149 ILE HD11 H 1 0.68 0.02 . 1 . . . . . . . . 5570 1 1449 . 1 1 149 149 ILE HD12 H 1 0.68 0.02 . 1 . . . . . . . . 5570 1 1450 . 1 1 149 149 ILE HD13 H 1 0.68 0.02 . 1 . . . . . . . . 5570 1 1451 . 1 1 149 149 ILE CA C 13 65.8 0.2 . 1 . . . . . . . . 5570 1 1452 . 1 1 149 149 ILE CB C 13 38.6 0.2 . 1 . . . . . . . . 5570 1 1453 . 1 1 149 149 ILE CG1 C 13 28.9 0.2 . 1 . . . . . . . . 5570 1 1454 . 1 1 149 149 ILE CG2 C 13 16.8 0.2 . 1 . . . . . . . . 5570 1 1455 . 1 1 149 149 ILE CD1 C 13 13.7 0.2 . 1 . . . . . . . . 5570 1 1456 . 1 1 149 149 ILE N N 15 119.0 0.2 . 1 . . . . . . . . 5570 1 1457 . 1 1 150 150 ALA H H 1 8.41 0.02 . 1 . . . . . . . . 5570 1 1458 . 1 1 150 150 ALA HA H 1 4.14 0.02 . 1 . . . . . . . . 5570 1 1459 . 1 1 150 150 ALA HB1 H 1 1.53 0.02 . 1 . . . . . . . . 5570 1 1460 . 1 1 150 150 ALA HB2 H 1 1.53 0.02 . 1 . . . . . . . . 5570 1 1461 . 1 1 150 150 ALA HB3 H 1 1.53 0.02 . 1 . . . . . . . . 5570 1 1462 . 1 1 150 150 ALA C C 13 178.6 0.2 . 1 . . . . . . . . 5570 1 1463 . 1 1 150 150 ALA CA C 13 54.8 0.2 . 1 . . . . . . . . 5570 1 1464 . 1 1 150 150 ALA CB C 13 17.7 0.2 . 1 . . . . . . . . 5570 1 1465 . 1 1 150 150 ALA N N 15 123.4 0.2 . 1 . . . . . . . . 5570 1 1466 . 1 1 151 151 ALA H H 1 7.46 0.02 . 1 . . . . . . . . 5570 1 1467 . 1 1 151 151 ALA HA H 1 4.38 0.02 . 1 . . . . . . . . 5570 1 1468 . 1 1 151 151 ALA HB1 H 1 1.56 0.02 . 1 . . . . . . . . 5570 1 1469 . 1 1 151 151 ALA HB2 H 1 1.56 0.02 . 1 . . . . . . . . 5570 1 1470 . 1 1 151 151 ALA HB3 H 1 1.56 0.02 . 1 . . . . . . . . 5570 1 1471 . 1 1 151 151 ALA C C 13 177.9 0.2 . 1 . . . . . . . . 5570 1 1472 . 1 1 151 151 ALA CA C 13 52.4 0.2 . 1 . . . . . . . . 5570 1 1473 . 1 1 151 151 ALA CB C 13 18.6 0.2 . 1 . . . . . . . . 5570 1 1474 . 1 1 151 151 ALA N N 15 117.2 0.2 . 1 . . . . . . . . 5570 1 1475 . 1 1 152 152 GLY H H 1 7.78 0.02 . 1 . . . . . . . . 5570 1 1476 . 1 1 152 152 GLY HA2 H 1 4.46 0.02 . 2 . . . . . . . . 5570 1 1477 . 1 1 152 152 GLY HA3 H 1 3.68 0.02 . 2 . . . . . . . . 5570 1 1478 . 1 1 152 152 GLY C C 13 174.6 0.2 . 1 . . . . . . . . 5570 1 1479 . 1 1 152 152 GLY CA C 13 44.9 0.2 . 1 . . . . . . . . 5570 1 1480 . 1 1 152 152 GLY N N 15 104.5 0.2 . 1 . . . . . . . . 5570 1 1481 . 1 1 153 153 GLU H H 1 7.67 0.02 . 1 . . . . . . . . 5570 1 1482 . 1 1 153 153 GLU HA H 1 4.07 0.02 . 1 . . . . . . . . 5570 1 1483 . 1 1 153 153 GLU HB2 H 1 1.77 0.02 . 2 . . . . . . . . 5570 1 1484 . 1 1 153 153 GLU HB3 H 1 1.61 0.02 . 2 . . . . . . . . 5570 1 1485 . 1 1 153 153 GLU HG2 H 1 2.31 0.02 . 2 . . . . . . . . 5570 1 1486 . 1 1 153 153 GLU HG3 H 1 2.24 0.02 . 2 . . . . . . . . 5570 1 1487 . 1 1 153 153 GLU C C 13 175.7 0.2 . 1 . . . . . . . . 5570 1 1488 . 1 1 153 153 GLU CA C 13 57.5 0.2 . 1 . . . . . . . . 5570 1 1489 . 1 1 153 153 GLU CB C 13 30.3 0.2 . 1 . . . . . . . . 5570 1 1490 . 1 1 153 153 GLU CG C 13 36.7 0.2 . 1 . . . . . . . . 5570 1 1491 . 1 1 153 153 GLU N N 15 121.9 0.2 . 1 . . . . . . . . 5570 1 1492 . 1 1 154 154 ALA H H 1 8.43 0.02 . 1 . . . . . . . . 5570 1 1493 . 1 1 154 154 ALA HA H 1 4.20 0.02 . 1 . . . . . . . . 5570 1 1494 . 1 1 154 154 ALA HB1 H 1 1.42 0.02 . 1 . . . . . . . . 5570 1 1495 . 1 1 154 154 ALA HB2 H 1 1.42 0.02 . 1 . . . . . . . . 5570 1 1496 . 1 1 154 154 ALA HB3 H 1 1.42 0.02 . 1 . . . . . . . . 5570 1 1497 . 1 1 154 154 ALA C C 13 177.2 0.2 . 1 . . . . . . . . 5570 1 1498 . 1 1 154 154 ALA CA C 13 52.8 0.2 . 1 . . . . . . . . 5570 1 1499 . 1 1 154 154 ALA CB C 13 19.1 0.2 . 1 . . . . . . . . 5570 1 1500 . 1 1 154 154 ALA N N 15 127.0 0.2 . 1 . . . . . . . . 5570 1 1501 . 1 1 155 155 ALA H H 1 8.09 0.02 . 1 . . . . . . . . 5570 1 1502 . 1 1 155 155 ALA HA H 1 4.91 0.02 . 1 . . . . . . . . 5570 1 1503 . 1 1 155 155 ALA HB1 H 1 1.27 0.02 . 1 . . . . . . . . 5570 1 1504 . 1 1 155 155 ALA HB2 H 1 1.27 0.02 . 1 . . . . . . . . 5570 1 1505 . 1 1 155 155 ALA HB3 H 1 1.27 0.02 . 1 . . . . . . . . 5570 1 1506 . 1 1 155 155 ALA C C 13 175.5 0.2 . 1 . . . . . . . . 5570 1 1507 . 1 1 155 155 ALA CA C 13 50.8 0.2 . 1 . . . . . . . . 5570 1 1508 . 1 1 155 155 ALA CB C 13 23.1 0.2 . 1 . . . . . . . . 5570 1 1509 . 1 1 155 155 ALA N N 15 122.0 0.2 . 1 . . . . . . . . 5570 1 1510 . 1 1 156 156 LYS H H 1 8.68 0.02 . 1 . . . . . . . . 5570 1 1511 . 1 1 156 156 LYS HB2 H 1 1.62 0.02 . 2 . . . . . . . . 5570 1 1512 . 1 1 156 156 LYS HB3 H 1 1.36 0.02 . 2 . . . . . . . . 5570 1 1513 . 1 1 156 156 LYS HE2 H 1 2.92 0.02 . 1 . . . . . . . . 5570 1 1514 . 1 1 156 156 LYS HE3 H 1 2.92 0.02 . 1 . . . . . . . . 5570 1 1515 . 1 1 156 156 LYS CA C 13 56.6 0.2 . 1 . . . . . . . . 5570 1 1516 . 1 1 156 156 LYS CB C 13 32.8 0.2 . 1 . . . . . . . . 5570 1 1517 . 1 1 156 156 LYS N N 15 122.1 0.2 . 1 . . . . . . . . 5570 1 1518 . 1 1 157 157 GLY HA2 H 1 3.83 0.02 . 2 . . . . . . . . 5570 1 1519 . 1 1 157 157 GLY HA3 H 1 3.69 0.02 . 2 . . . . . . . . 5570 1 1520 . 1 1 157 157 GLY CA C 13 48.3 0.2 . 1 . . . . . . . . 5570 1 1521 . 1 1 158 158 ASP H H 1 7.71 0.02 . 1 . . . . . . . . 5570 1 1522 . 1 1 158 158 ASP HA H 1 4.66 0.02 . 1 . . . . . . . . 5570 1 1523 . 1 1 158 158 ASP HB2 H 1 2.62 0.02 . 2 . . . . . . . . 5570 1 1524 . 1 1 158 158 ASP HB3 H 1 2.26 0.02 . 2 . . . . . . . . 5570 1 1525 . 1 1 158 158 ASP C C 13 175.8 0.2 . 1 . . . . . . . . 5570 1 1526 . 1 1 158 158 ASP CA C 13 55.6 0.2 . 1 . . . . . . . . 5570 1 1527 . 1 1 158 158 ASP CB C 13 42.0 0.2 . 1 . . . . . . . . 5570 1 1528 . 1 1 158 158 ASP N N 15 116.9 0.2 . 1 . . . . . . . . 5570 1 1529 . 1 1 159 159 LEU H H 1 7.30 0.02 . 1 . . . . . . . . 5570 1 1530 . 1 1 159 159 LEU HA H 1 3.79 0.02 . 1 . . . . . . . . 5570 1 1531 . 1 1 159 159 LEU HD11 H 1 0.92 0.2 . 2 . . . . . . . . 5570 1 1532 . 1 1 159 159 LEU HD12 H 1 0.92 0.2 . 2 . . . . . . . . 5570 1 1533 . 1 1 159 159 LEU HD13 H 1 0.92 0.2 . 2 . . . . . . . . 5570 1 1534 . 1 1 159 159 LEU HD21 H 1 0.68 0.2 . 2 . . . . . . . . 5570 1 1535 . 1 1 159 159 LEU HD22 H 1 0.68 0.2 . 2 . . . . . . . . 5570 1 1536 . 1 1 159 159 LEU HD23 H 1 0.68 0.2 . 2 . . . . . . . . 5570 1 1537 . 1 1 159 159 LEU C C 13 176.6 0.2 . 1 . . . . . . . . 5570 1 1538 . 1 1 159 159 LEU CA C 13 60.0 0.2 . 1 . . . . . . . . 5570 1 1539 . 1 1 159 159 LEU CB C 13 42.5 0.2 . 1 . . . . . . . . 5570 1 1540 . 1 1 159 159 LEU N N 15 118.1 0.2 . 1 . . . . . . . . 5570 1 1541 . 1 1 160 160 ALA H H 1 8.93 0.02 . 1 . . . . . . . . 5570 1 1542 . 1 1 160 160 ALA HA H 1 3.66 0.02 . 1 . . . . . . . . 5570 1 1543 . 1 1 160 160 ALA HB1 H 1 1.35 0.02 . 1 . . . . . . . . 5570 1 1544 . 1 1 160 160 ALA HB2 H 1 1.35 0.02 . 1 . . . . . . . . 5570 1 1545 . 1 1 160 160 ALA HB3 H 1 1.35 0.02 . 1 . . . . . . . . 5570 1 1546 . 1 1 160 160 ALA C C 13 179.1 0.2 . 1 . . . . . . . . 5570 1 1547 . 1 1 160 160 ALA CA C 13 56.1 0.2 . 1 . . . . . . . . 5570 1 1548 . 1 1 160 160 ALA CB C 13 17.8 0.2 . 1 . . . . . . . . 5570 1 1549 . 1 1 160 160 ALA N N 15 118.0 0.2 . 1 . . . . . . . . 5570 1 1550 . 1 1 161 161 GLU H H 1 8.47 0.02 . 1 . . . . . . . . 5570 1 1551 . 1 1 161 161 GLU HA H 1 3.77 0.02 . 1 . . . . . . . . 5570 1 1552 . 1 1 161 161 GLU HB2 H 1 1.93 0.02 . 2 . . . . . . . . 5570 1 1553 . 1 1 161 161 GLU HB3 H 1 1.70 0.02 . 2 . . . . . . . . 5570 1 1554 . 1 1 161 161 GLU C C 13 178.3 0.2 . 1 . . . . . . . . 5570 1 1555 . 1 1 161 161 GLU CA C 13 59.5 0.2 . 1 . . . . . . . . 5570 1 1556 . 1 1 161 161 GLU CB C 13 28.9 0.2 . 1 . . . . . . . . 5570 1 1557 . 1 1 161 161 GLU CG C 13 35.7 0.2 . 1 . . . . . . . . 5570 1 1558 . 1 1 161 161 GLU N N 15 117.5 0.2 . 1 . . . . . . . . 5570 1 1559 . 1 1 162 162 LEU H H 1 8.32 0.02 . 1 . . . . . . . . 5570 1 1560 . 1 1 162 162 LEU HA H 1 3.90 0.02 . 1 . . . . . . . . 5570 1 1561 . 1 1 162 162 LEU HB2 H 1 1.41 0.02 . 4 . . . . . . . . 5570 1 1562 . 1 1 162 162 LEU HB3 H 1 1.41 0.02 . 4 . . . . . . . . 5570 1 1563 . 1 1 162 162 LEU HG H 1 1.61 0.02 . 4 . . . . . . . . 5570 1 1564 . 1 1 162 162 LEU HD11 H 1 0.95 0.02 . 2 . . . . . . . . 5570 1 1565 . 1 1 162 162 LEU HD12 H 1 0.95 0.02 . 2 . . . . . . . . 5570 1 1566 . 1 1 162 162 LEU HD13 H 1 0.95 0.02 . 2 . . . . . . . . 5570 1 1567 . 1 1 162 162 LEU HD21 H 1 0.65 0.02 . 2 . . . . . . . . 5570 1 1568 . 1 1 162 162 LEU HD22 H 1 0.65 0.02 . 2 . . . . . . . . 5570 1 1569 . 1 1 162 162 LEU HD23 H 1 0.65 0.02 . 2 . . . . . . . . 5570 1 1570 . 1 1 162 162 LEU C C 13 179.2 0.2 . 1 . . . . . . . . 5570 1 1571 . 1 1 162 162 LEU CA C 13 58.0 0.2 . 1 . . . . . . . . 5570 1 1572 . 1 1 162 162 LEU CB C 13 43.4 0.2 . 1 . . . . . . . . 5570 1 1573 . 1 1 162 162 LEU CG C 13 26.0 0.2 . 1 . . . . . . . . 5570 1 1574 . 1 1 162 162 LEU N N 15 117.0 0.2 . 1 . . . . . . . . 5570 1 1575 . 1 1 163 163 VAL H H 1 8.34 0.02 . 1 . . . . . . . . 5570 1 1576 . 1 1 163 163 VAL HA H 1 3.43 0.02 . 1 . . . . . . . . 5570 1 1577 . 1 1 163 163 VAL HB H 1 2.12 0.02 . 1 . . . . . . . . 5570 1 1578 . 1 1 163 163 VAL HG11 H 1 0.88 0.02 . 1 . . . . . . . . 5570 1 1579 . 1 1 163 163 VAL HG12 H 1 0.88 0.02 . 1 . . . . . . . . 5570 1 1580 . 1 1 163 163 VAL HG13 H 1 0.88 0.02 . 1 . . . . . . . . 5570 1 1581 . 1 1 163 163 VAL HG21 H 1 0.94 0.02 . 1 . . . . . . . . 5570 1 1582 . 1 1 163 163 VAL HG22 H 1 0.94 0.02 . 1 . . . . . . . . 5570 1 1583 . 1 1 163 163 VAL HG23 H 1 0.94 0.02 . 1 . . . . . . . . 5570 1 1584 . 1 1 163 163 VAL C C 13 178.3 0.2 . 1 . . . . . . . . 5570 1 1585 . 1 1 163 163 VAL CA C 13 67.7 0.2 . 1 . . . . . . . . 5570 1 1586 . 1 1 163 163 VAL CB C 13 31.4 0.2 . 1 . . . . . . . . 5570 1 1587 . 1 1 163 163 VAL CG1 C 13 22.3 0.2 . 1 . . . . . . . . 5570 1 1588 . 1 1 163 163 VAL CG2 C 13 23.9 0.2 . 1 . . . . . . . . 5570 1 1589 . 1 1 163 163 VAL N N 15 118.1 0.2 . 1 . . . . . . . . 5570 1 1590 . 1 1 164 164 ARG H H 1 8.53 0.02 . 1 . . . . . . . . 5570 1 1591 . 1 1 164 164 ARG HA H 1 3.83 0.02 . 1 . . . . . . . . 5570 1 1592 . 1 1 164 164 ARG C C 13 178.7 0.2 . 1 . . . . . . . . 5570 1 1593 . 1 1 164 164 ARG CA C 13 60.5 0.2 . 1 . . . . . . . . 5570 1 1594 . 1 1 164 164 ARG CB C 13 30.4 0.2 . 1 . . . . . . . . 5570 1 1595 . 1 1 164 164 ARG N N 15 118.9 0.2 . 1 . . . . . . . . 5570 1 1596 . 1 1 165 165 ARG H H 1 8.49 0.02 . 1 . . . . . . . . 5570 1 1597 . 1 1 165 165 ARG HA H 1 4.10 0.02 . 1 . . . . . . . . 5570 1 1598 . 1 1 165 165 ARG HB2 H 1 2.06 0.02 . 2 . . . . . . . . 5570 1 1599 . 1 1 165 165 ARG HB3 H 1 1.92 0.02 . 2 . . . . . . . . 5570 1 1600 . 1 1 165 165 ARG C C 13 179.3 0.2 . 1 . . . . . . . . 5570 1 1601 . 1 1 165 165 ARG CA C 13 59.9 0.2 . 1 . . . . . . . . 5570 1 1602 . 1 1 165 165 ARG CB C 13 31.8 0.2 . 1 . . . . . . . . 5570 1 1603 . 1 1 165 165 ARG CG C 13 29.9 0.2 . 1 . . . . . . . . 5570 1 1604 . 1 1 165 165 ARG CD C 13 43.0 0.2 . 1 . . . . . . . . 5570 1 1605 . 1 1 165 165 ARG N N 15 113.7 0.2 . 1 . . . . . . . . 5570 1 1606 . 1 1 166 166 CYS H H 1 8.27 0.02 . 1 . . . . . . . . 5570 1 1607 . 1 1 166 166 CYS HA H 1 4.22 0.02 . 1 . . . . . . . . 5570 1 1608 . 1 1 166 166 CYS HB2 H 1 2.59 0.02 . 2 . . . . . . . . 5570 1 1609 . 1 1 166 166 CYS HB3 H 1 2.13 0.02 . 2 . . . . . . . . 5570 1 1610 . 1 1 166 166 CYS CA C 13 62.4 0.2 . 1 . . . . . . . . 5570 1 1611 . 1 1 166 166 CYS CB C 13 29.4 0.2 . 1 . . . . . . . . 5570 1 1612 . 1 1 166 166 CYS N N 15 112.4 0.2 . 1 . . . . . . . . 5570 1 1613 . 1 1 167 167 TYR H H 1 8.06 0.02 . 1 . . . . . . . . 5570 1 1614 . 1 1 167 167 TYR HA H 1 4.74 0.02 . 1 . . . . . . . . 5570 1 1615 . 1 1 167 167 TYR HB2 H 1 3.17 0.02 . 2 . . . . . . . . 5570 1 1616 . 1 1 167 167 TYR HB3 H 1 2.68 0.02 . 2 . . . . . . . . 5570 1 1617 . 1 1 167 167 TYR HD1 H 1 6.83 0.02 . 1 . . . . . . . . 5570 1 1618 . 1 1 167 167 TYR HD2 H 1 6.83 0.02 . 1 . . . . . . . . 5570 1 1619 . 1 1 167 167 TYR HE1 H 1 6.24 0.02 . 1 . . . . . . . . 5570 1 1620 . 1 1 167 167 TYR HE2 H 1 6.24 0.02 . 1 . . . . . . . . 5570 1 1621 . 1 1 167 167 TYR C C 13 175.6 0.2 . 1 . . . . . . . . 5570 1 1622 . 1 1 167 167 TYR CA C 13 59.5 0.2 . 1 . . . . . . . . 5570 1 1623 . 1 1 167 167 TYR CB C 13 39.6 0.2 . 1 . . . . . . . . 5570 1 1624 . 1 1 167 167 TYR CD1 C 13 132.2 0.2 . 1 . . . . . . . . 5570 1 1625 . 1 1 167 167 TYR CD2 C 13 132.2 0.2 . 1 . . . . . . . . 5570 1 1626 . 1 1 167 167 TYR CE1 C 13 117.8 0.2 . 1 . . . . . . . . 5570 1 1627 . 1 1 167 167 TYR CE2 C 13 117.8 0.2 . 1 . . . . . . . . 5570 1 1628 . 1 1 167 167 TYR N N 15 114.0 0.2 . 1 . . . . . . . . 5570 1 1629 . 1 1 168 168 ARG H H 1 7.62 0.02 . 1 . . . . . . . . 5570 1 1630 . 1 1 168 168 ARG HA H 1 4.60 0.02 . 1 . . . . . . . . 5570 1 1631 . 1 1 168 168 ARG HB2 H 1 2.04 0.02 . 2 . . . . . . . . 5570 1 1632 . 1 1 168 168 ARG HB3 H 1 1.91 0.02 . 2 . . . . . . . . 5570 1 1633 . 1 1 168 168 ARG HG2 H 1 1.61 0.02 . 1 . . . . . . . . 5570 1 1634 . 1 1 168 168 ARG HG3 H 1 1.61 0.02 . 1 . . . . . . . . 5570 1 1635 . 1 1 168 168 ARG C C 13 175.5 0.2 . 1 . . . . . . . . 5570 1 1636 . 1 1 168 168 ARG CA C 13 55.6 0.2 . 1 . . . . . . . . 5570 1 1637 . 1 1 168 168 ARG CB C 13 30.9 0.2 . 1 . . . . . . . . 5570 1 1638 . 1 1 168 168 ARG CG C 13 27.0 0.2 . 1 . . . . . . . . 5570 1 1639 . 1 1 168 168 ARG CD C 13 43.5 0.2 . 1 . . . . . . . . 5570 1 1640 . 1 1 168 168 ARG N N 15 120.5 0.2 . 1 . . . . . . . . 5570 1 1641 . 1 1 169 169 GLU H H 1 8.40 0.02 . 1 . . . . . . . . 5570 1 1642 . 1 1 169 169 GLU HA H 1 4.27 0.02 . 1 . . . . . . . . 5570 1 1643 . 1 1 169 169 GLU HB2 H 1 2.10 0.02 . 2 . . . . . . . . 5570 1 1644 . 1 1 169 169 GLU HB3 H 1 1.99 0.02 . 2 . . . . . . . . 5570 1 1645 . 1 1 169 169 GLU HG2 H 1 2.26 0.02 . 1 . . . . . . . . 5570 1 1646 . 1 1 169 169 GLU HG3 H 1 2.26 0.02 . 1 . . . . . . . . 5570 1 1647 . 1 1 169 169 GLU C C 13 176.3 0.2 . 1 . . . . . . . . 5570 1 1648 . 1 1 169 169 GLU CA C 13 57.1 0.2 . 1 . . . . . . . . 5570 1 1649 . 1 1 169 169 GLU CB C 13 30.4 0.2 . 1 . . . . . . . . 5570 1 1650 . 1 1 169 169 GLU CG C 13 36.2 0.2 . 1 . . . . . . . . 5570 1 1651 . 1 1 169 169 GLU N N 15 120.5 0.2 . 1 . . . . . . . . 5570 1 1652 . 1 1 170 170 GLU H H 1 8.31 0.02 . 1 . . . . . . . . 5570 1 1653 . 1 1 170 170 GLU HA H 1 4.32 0.02 . 1 . . . . . . . . 5570 1 1654 . 1 1 170 170 GLU HB2 H 1 2.01 0.02 . 2 . . . . . . . . 5570 1 1655 . 1 1 170 170 GLU HB3 H 1 1.91 0.02 . 2 . . . . . . . . 5570 1 1656 . 1 1 170 170 GLU HG2 H 1 2.29 0.02 . 1 . . . . . . . . 5570 1 1657 . 1 1 170 170 GLU HG3 H 1 2.29 0.02 . 1 . . . . . . . . 5570 1 1658 . 1 1 170 170 GLU CA C 13 56.6 0.2 . 1 . . . . . . . . 5570 1 1659 . 1 1 170 170 GLU CB C 13 30.9 0.2 . 1 . . . . . . . . 5570 1 1660 . 1 1 170 170 GLU CG C 13 36.2 0.2 . 1 . . . . . . . . 5570 1 1661 . 1 1 170 170 GLU N N 15 120.6 0.2 . 1 . . . . . . . . 5570 1 1662 . 1 1 171 171 GLU H H 1 8.02 0.02 . 1 . . . . . . . . 5570 1 1663 . 1 1 171 171 GLU N N 15 126.3 0.2 . 1 . . . . . . . . 5570 1 stop_ loop_ _Ambiguous_atom_chem_shift.Ambiguous_shift_set_ID _Ambiguous_atom_chem_shift.Atom_chem_shift_ID _Ambiguous_atom_chem_shift.Entry_ID _Ambiguous_atom_chem_shift.Assigned_chem_shift_list_ID 1 57 5570 1 1 56 5570 1 1 55 5570 1 2 144 5570 1 2 143 5570 1 2 142 5570 1 2 141 5570 1 3 216 5570 1 3 215 5570 1 4 1055 5570 1 4 1054 5570 1 4 1053 5570 1 4 1052 5570 1 4 1051 5570 1 5 1162 5570 1 5 1161 5570 1 5 1160 5570 1 5 1159 5570 1 5 1158 5570 1 6 1566 5570 1 6 1565 5570 1 6 1564 5570 1 6 1563 5570 1 6 1562 5570 1 stop_ save_