data_6626 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6626 _Entry.Title ; 'Complete 1H, 13C, and 15N Chemical Shift Assignments for plant Tom20 mitochondrial import receptor cytosolic domain (isoform 3) from Arabidopsis thaliana' ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2005-05-12 _Entry.Accession_date 2005-05-12 _Entry.Last_release_date 2005-12-14 _Entry.Original_release_date 2005-12-14 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _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 Andrew Perry . J. . 6626 2 Joanne Hulett . M. . 6626 3 Trevor Lithgow . . . 6626 4 Paul Gooley . R. . 6626 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6626 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 620 6626 '15N chemical shifts' 159 6626 '1H chemical shifts' 1039 6626 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 . . 2005-12-14 2005-05-12 original author . 6626 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6626 _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 ; 1H, 13C and 15N Resonance Assignments of the Cytosolic Domain of Tom20 from Arabidopsis thaliana ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 33 _Citation.Journal_issue 3 _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 198 _Citation.Page_last 198 _Citation.Year 2005 _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 Andrew Perry . J. . 6626 1 2 Joanne Hulett . M. . 6626 1 3 Trevor Lithgow . . . 6626 1 4 Paul Gooley . R. . 6626 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID assignment 6626 1 NMR 6626 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 6626 _Assembly.ID 1 _Assembly.Name 'Plant Tom20' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass 17954.8 _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'Plant Tom20' 1 $Plant_Tom20_receptor . . yes native no no . . . 6626 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Plant_Tom20_receptor _Entity.Sf_category entity _Entity.Sf_framecode Plant_Tom20_receptor _Entity.Entry_ID 6626 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Plant Tom20 receptor' _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 ; GPLGSMDTETEFDRILLFEQ IRQDAENTYKSNPLDADNLT RWGGVLLELSQFHSISDAKQ MIQEAITKFEEALLIDPKKD EAVWCIGNAYTSFAFLTPDE TEAKHNFDLATQFFQQAVDE QPDNTHYLKSLEMTAKAPQL HAEAYKQGLGGSHHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 158 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 17954.8 _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 1ZU2 . "Solution Nmr Structure Of The Plant Tom20 Mitochondrial Import Receptor From Arabidopsis Thaliana" . . . . . 100.00 158 100.00 100.00 5.65e-113 . . . . 6626 1 2 no DBJ BAB01089 . "TOM20-like protein [Arabidopsis thaliana]" . . . . . 92.41 202 99.32 99.32 1.15e-101 . . . . 6626 1 3 no EMBL CAC14430 . "TOM20-3 protein [Arabidopsis thaliana]" . . . . . 92.41 202 99.32 99.32 1.15e-101 . . . . 6626 1 4 no GB AAK64184 . "putative TOM20 protein [Arabidopsis thaliana]" . . . . . 92.41 202 99.32 99.32 1.15e-101 . . . . 6626 1 5 no GB AAL85142 . "putative TOM20 protein [Arabidopsis thaliana]" . . . . . 92.41 202 99.32 99.32 1.15e-101 . . . . 6626 1 6 no GB AAM64598 . "putative TOM20 [Arabidopsis thaliana]" . . . . . 92.41 202 98.63 98.63 5.44e-101 . . . . 6626 1 7 no GB AEE77264 . "mitochondrial import receptor subunit TOM20-3 [Arabidopsis thaliana]" . . . . . 92.41 202 99.32 99.32 1.15e-101 . . . . 6626 1 8 no REF NP_189344 . "mitochondrial import receptor subunit TOM20-3 [Arabidopsis thaliana]" . . . . . 92.41 202 99.32 99.32 1.15e-101 . . . . 6626 1 9 no SP P82874 . "RecName: Full=Mitochondrial import receptor subunit TOM20-3; AltName: Full=Translocase of outer membrane 20 kDa subunit 3 [Arab" . . . . . 92.41 202 99.32 99.32 1.15e-101 . . . . 6626 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'protein import; polypeptide receptor' 6626 1 stop_ loop_ _Entity_keyword.Keyword _Entity_keyword.Entry_ID _Entity_keyword.Entity_ID mitochondrial 6626 1 'protein import' 6626 1 receptor 6626 1 'tetratricopeptide repeat' 6626 1 TPR-like 6626 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 6626 1 2 . PRO . 6626 1 3 . LEU . 6626 1 4 . GLY . 6626 1 5 . SER . 6626 1 6 . MET . 6626 1 7 . ASP . 6626 1 8 . THR . 6626 1 9 . GLU . 6626 1 10 . THR . 6626 1 11 . GLU . 6626 1 12 . PHE . 6626 1 13 . ASP . 6626 1 14 . ARG . 6626 1 15 . ILE . 6626 1 16 . LEU . 6626 1 17 . LEU . 6626 1 18 . PHE . 6626 1 19 . GLU . 6626 1 20 . GLN . 6626 1 21 . ILE . 6626 1 22 . ARG . 6626 1 23 . GLN . 6626 1 24 . ASP . 6626 1 25 . ALA . 6626 1 26 . GLU . 6626 1 27 . ASN . 6626 1 28 . THR . 6626 1 29 . TYR . 6626 1 30 . LYS . 6626 1 31 . SER . 6626 1 32 . ASN . 6626 1 33 . PRO . 6626 1 34 . LEU . 6626 1 35 . ASP . 6626 1 36 . ALA . 6626 1 37 . ASP . 6626 1 38 . ASN . 6626 1 39 . LEU . 6626 1 40 . THR . 6626 1 41 . ARG . 6626 1 42 . TRP . 6626 1 43 . GLY . 6626 1 44 . GLY . 6626 1 45 . VAL . 6626 1 46 . LEU . 6626 1 47 . LEU . 6626 1 48 . GLU . 6626 1 49 . LEU . 6626 1 50 . SER . 6626 1 51 . GLN . 6626 1 52 . PHE . 6626 1 53 . HIS . 6626 1 54 . SER . 6626 1 55 . ILE . 6626 1 56 . SER . 6626 1 57 . ASP . 6626 1 58 . ALA . 6626 1 59 . LYS . 6626 1 60 . GLN . 6626 1 61 . MET . 6626 1 62 . ILE . 6626 1 63 . GLN . 6626 1 64 . GLU . 6626 1 65 . ALA . 6626 1 66 . ILE . 6626 1 67 . THR . 6626 1 68 . LYS . 6626 1 69 . PHE . 6626 1 70 . GLU . 6626 1 71 . GLU . 6626 1 72 . ALA . 6626 1 73 . LEU . 6626 1 74 . LEU . 6626 1 75 . ILE . 6626 1 76 . ASP . 6626 1 77 . PRO . 6626 1 78 . LYS . 6626 1 79 . LYS . 6626 1 80 . ASP . 6626 1 81 . GLU . 6626 1 82 . ALA . 6626 1 83 . VAL . 6626 1 84 . TRP . 6626 1 85 . CYS . 6626 1 86 . ILE . 6626 1 87 . GLY . 6626 1 88 . ASN . 6626 1 89 . ALA . 6626 1 90 . TYR . 6626 1 91 . THR . 6626 1 92 . SER . 6626 1 93 . PHE . 6626 1 94 . ALA . 6626 1 95 . PHE . 6626 1 96 . LEU . 6626 1 97 . THR . 6626 1 98 . PRO . 6626 1 99 . ASP . 6626 1 100 . GLU . 6626 1 101 . THR . 6626 1 102 . GLU . 6626 1 103 . ALA . 6626 1 104 . LYS . 6626 1 105 . HIS . 6626 1 106 . ASN . 6626 1 107 . PHE . 6626 1 108 . ASP . 6626 1 109 . LEU . 6626 1 110 . ALA . 6626 1 111 . THR . 6626 1 112 . GLN . 6626 1 113 . PHE . 6626 1 114 . PHE . 6626 1 115 . GLN . 6626 1 116 . GLN . 6626 1 117 . ALA . 6626 1 118 . VAL . 6626 1 119 . ASP . 6626 1 120 . GLU . 6626 1 121 . GLN . 6626 1 122 . PRO . 6626 1 123 . ASP . 6626 1 124 . ASN . 6626 1 125 . THR . 6626 1 126 . HIS . 6626 1 127 . TYR . 6626 1 128 . LEU . 6626 1 129 . LYS . 6626 1 130 . SER . 6626 1 131 . LEU . 6626 1 132 . GLU . 6626 1 133 . MET . 6626 1 134 . THR . 6626 1 135 . ALA . 6626 1 136 . LYS . 6626 1 137 . ALA . 6626 1 138 . PRO . 6626 1 139 . GLN . 6626 1 140 . LEU . 6626 1 141 . HIS . 6626 1 142 . ALA . 6626 1 143 . GLU . 6626 1 144 . ALA . 6626 1 145 . TYR . 6626 1 146 . LYS . 6626 1 147 . GLN . 6626 1 148 . GLY . 6626 1 149 . LEU . 6626 1 150 . GLY . 6626 1 151 . GLY . 6626 1 152 . SER . 6626 1 153 . HIS . 6626 1 154 . HIS . 6626 1 155 . HIS . 6626 1 156 . HIS . 6626 1 157 . HIS . 6626 1 158 . HIS . 6626 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 6626 1 . PRO 2 2 6626 1 . LEU 3 3 6626 1 . GLY 4 4 6626 1 . SER 5 5 6626 1 . MET 6 6 6626 1 . ASP 7 7 6626 1 . THR 8 8 6626 1 . GLU 9 9 6626 1 . THR 10 10 6626 1 . GLU 11 11 6626 1 . PHE 12 12 6626 1 . ASP 13 13 6626 1 . ARG 14 14 6626 1 . ILE 15 15 6626 1 . LEU 16 16 6626 1 . LEU 17 17 6626 1 . PHE 18 18 6626 1 . GLU 19 19 6626 1 . GLN 20 20 6626 1 . ILE 21 21 6626 1 . ARG 22 22 6626 1 . GLN 23 23 6626 1 . ASP 24 24 6626 1 . ALA 25 25 6626 1 . GLU 26 26 6626 1 . ASN 27 27 6626 1 . THR 28 28 6626 1 . TYR 29 29 6626 1 . LYS 30 30 6626 1 . SER 31 31 6626 1 . ASN 32 32 6626 1 . PRO 33 33 6626 1 . LEU 34 34 6626 1 . ASP 35 35 6626 1 . ALA 36 36 6626 1 . ASP 37 37 6626 1 . ASN 38 38 6626 1 . LEU 39 39 6626 1 . THR 40 40 6626 1 . ARG 41 41 6626 1 . TRP 42 42 6626 1 . GLY 43 43 6626 1 . GLY 44 44 6626 1 . VAL 45 45 6626 1 . LEU 46 46 6626 1 . LEU 47 47 6626 1 . GLU 48 48 6626 1 . LEU 49 49 6626 1 . SER 50 50 6626 1 . GLN 51 51 6626 1 . PHE 52 52 6626 1 . HIS 53 53 6626 1 . SER 54 54 6626 1 . ILE 55 55 6626 1 . SER 56 56 6626 1 . ASP 57 57 6626 1 . ALA 58 58 6626 1 . LYS 59 59 6626 1 . GLN 60 60 6626 1 . MET 61 61 6626 1 . ILE 62 62 6626 1 . GLN 63 63 6626 1 . GLU 64 64 6626 1 . ALA 65 65 6626 1 . ILE 66 66 6626 1 . THR 67 67 6626 1 . LYS 68 68 6626 1 . PHE 69 69 6626 1 . GLU 70 70 6626 1 . GLU 71 71 6626 1 . ALA 72 72 6626 1 . LEU 73 73 6626 1 . LEU 74 74 6626 1 . ILE 75 75 6626 1 . ASP 76 76 6626 1 . PRO 77 77 6626 1 . LYS 78 78 6626 1 . LYS 79 79 6626 1 . ASP 80 80 6626 1 . GLU 81 81 6626 1 . ALA 82 82 6626 1 . VAL 83 83 6626 1 . TRP 84 84 6626 1 . CYS 85 85 6626 1 . ILE 86 86 6626 1 . GLY 87 87 6626 1 . ASN 88 88 6626 1 . ALA 89 89 6626 1 . TYR 90 90 6626 1 . THR 91 91 6626 1 . SER 92 92 6626 1 . PHE 93 93 6626 1 . ALA 94 94 6626 1 . PHE 95 95 6626 1 . LEU 96 96 6626 1 . THR 97 97 6626 1 . PRO 98 98 6626 1 . ASP 99 99 6626 1 . GLU 100 100 6626 1 . THR 101 101 6626 1 . GLU 102 102 6626 1 . ALA 103 103 6626 1 . LYS 104 104 6626 1 . HIS 105 105 6626 1 . ASN 106 106 6626 1 . PHE 107 107 6626 1 . ASP 108 108 6626 1 . LEU 109 109 6626 1 . ALA 110 110 6626 1 . THR 111 111 6626 1 . GLN 112 112 6626 1 . PHE 113 113 6626 1 . PHE 114 114 6626 1 . GLN 115 115 6626 1 . GLN 116 116 6626 1 . ALA 117 117 6626 1 . VAL 118 118 6626 1 . ASP 119 119 6626 1 . GLU 120 120 6626 1 . GLN 121 121 6626 1 . PRO 122 122 6626 1 . ASP 123 123 6626 1 . ASN 124 124 6626 1 . THR 125 125 6626 1 . HIS 126 126 6626 1 . TYR 127 127 6626 1 . LEU 128 128 6626 1 . LYS 129 129 6626 1 . SER 130 130 6626 1 . LEU 131 131 6626 1 . GLU 132 132 6626 1 . MET 133 133 6626 1 . THR 134 134 6626 1 . ALA 135 135 6626 1 . LYS 136 136 6626 1 . ALA 137 137 6626 1 . PRO 138 138 6626 1 . GLN 139 139 6626 1 . LEU 140 140 6626 1 . HIS 141 141 6626 1 . ALA 142 142 6626 1 . GLU 143 143 6626 1 . ALA 144 144 6626 1 . TYR 145 145 6626 1 . LYS 146 146 6626 1 . GLN 147 147 6626 1 . GLY 148 148 6626 1 . LEU 149 149 6626 1 . GLY 150 150 6626 1 . GLY 151 151 6626 1 . SER 152 152 6626 1 . HIS 153 153 6626 1 . HIS 154 154 6626 1 . HIS 155 155 6626 1 . HIS 156 156 6626 1 . HIS 157 157 6626 1 . HIS 158 158 6626 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 6626 _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 $Plant_Tom20_receptor . 3702 . no . 'Mouse-ear cress' . . Eukaryota Viridiplantae Arabidopsis thaliana . . . . . . . . . mitochondria . . . . . . . . . . . 6626 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 6626 _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 $Plant_Tom20_receptor . 'recombinant technology' . 'E. coli' . 562 Escherichia coli 'BL21(DE3) Rosetta' . . . . . . . . . . . . plasmid . . pGEX-6-3P-AtTom20-3 'Prescission protease cleavable glutathione S-transferase fusion tag. Coding sequence inserted using BamHI/XhoI restriction sites.' Pharmacia . . . . 6626 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6626 _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 'Plant Tom20 receptor' '[U-95% 13C; U-95% 15N]' . . 1 $Plant_Tom20_receptor . protein 0.8 0.7 1.0 mM 0.08 . . . 6626 1 2 'sodium phosphate' . . . . . . buffer 20 . . mM . . . . 6626 1 3 'sodium chloride' . . . . . . salt 150 . . mM . . . . 6626 1 4 'sodium azide' . . . . . . . 0.02 . . % . . . . 6626 1 5 dithiothreitol . . . . . . . 1 . . mM . . . . 6626 1 6 'ethylenediaminetetraacetic acid' . . . . . . 'chelating agent' 1 . . mM . . . . 6626 1 7 phenylmethylsulphonylfluoride . . . . . . . 1 . . mM . . . . 6626 1 8 'deuterium dioxide' . . . . . . . . . . % 10 . . . 6626 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 6626 _Sample.ID 2 _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 'Plant Tom20 receptor' '[U-95% 13C; U-95% 15N]' . . 1 $Plant_Tom20_receptor . protein 0.8 0.7 1.0 mM 0.08 . . . 6626 2 2 'sodium phosphate' . . . . . . buffer 20 . . mM . . . . 6626 2 3 'sodium chloride' . . . . . . salt 150 . . mM . . . . 6626 2 4 'sodium azide' . . . . . . . 0.02 . . % . . . . 6626 2 5 dithiothreitol . . . . . . . 1 . . mM . . . . 6626 2 6 'ethylenediaminetetraacetic acid' . . . . . . 'chelating agent' 1 . . mM . . . . 6626 2 7 phenylmethylsulphonylfluoride . . . . . . . 1 . . mM . . . . 6626 2 8 'deuterium dioxide' . . . . . . . . . . % 98 . . . 6626 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 6626 _Sample.ID 3 _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 'Plant Tom20 receptor' '[U-95% 15N]' . . 1 $Plant_Tom20_receptor . protein 0.8 0.7 1.0 mM 0.08 . . . 6626 3 2 'sodium phosphate' . . . . . . buffer 20 . . mM . . . . 6626 3 3 'sodium chloride' . . . . . . salt 150 . . mM . . . . 6626 3 4 'sodium azide' . . . . . . . 0.02 . . % . . . . 6626 3 5 dithiothreitol . . . . . . . 1 . . mM . . . . 6626 3 6 'ethylenediaminetetraacetic acid' . . . . . . 'chelating agent' 1 . . mM . . . . 6626 3 7 phenylmethylsulphonylfluoride . . . . . . . 1 . . mM . . . . 6626 3 8 'deuterium dioxide' . . . . . . . . . . % 10 . . . 6626 3 stop_ save_ ####################### # Sample conditions # ####################### save_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode conditions_1 _Sample_condition_list.Entry_ID 6626 _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 7.4 0.05 pH 6626 1 pressure 1 0 atm 6626 1 temperature 298 0.05 K 6626 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 6626 _Software.ID 1 _Software.Name NMRPipe _Software.Version 1.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Frank Delaglio' . http://spin.niddk.nih.gov/bax/software/NMRPipe/ 6626 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'spectra processing' 6626 1 stop_ save_ save_Sparky _Software.Sf_category software _Software.Sf_framecode Sparky _Software.Entry_ID 6626 _Software.ID 2 _Software.Name SPARKY _Software.Version 3.110 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'T. D. Goddard and D. G. Kneller' 'University of California, San Francisco' http://www.cgl.ucsf.edu/home/sparky/ 6626 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'spectral assignment' 6626 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_600MHz _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 600MHz _NMR_spectrometer.Entry_ID 6626 _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_500MHz _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 500MHz _NMR_spectrometer.Entry_ID 6626 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 6626 _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 15N-HSQC no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $600MHz . . . . . . . . . . . . . . . . 6626 1 2 13C_1H-HSQC no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 . . . . . . . . . . . . . . . . . 6626 1 3 HNCACB no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 . . . . . . . . . . . . . . . . . 6626 1 4 CBCA(CO)NH no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 . . . . . . . . . . . . . . . . . 6626 1 5 C(CO)NH-TOCSY no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 . . . . . . . . . . . . . . . . . 6626 1 6 H(CCO)NH-TOCSY no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 . . . . . . . . . . . . . . . . . 6626 1 7 HNCO no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 . . . . . . . . . . . . . . . . . 6626 1 8 HCCH-TOCSY no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 . . . . . . . . . . . . . . . . . 6626 1 9 HCCH-COSY no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 . . . . . . . . . . . . . . . . . 6626 1 10 HN(CA)CO no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 . . . . . . . . . . . . . . . . . 6626 1 11 '13C HSQC-NOESY' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 . . . . . . . . . . . . . . . . . 6626 1 12 '13C NOESY-HSQC (aromatic region)' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 . . . . . . . . . . . . . . . . . 6626 1 13 '[13C,1H]-HSQC (aromatic region)' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 . . . . . . . . . . . . . . . . . 6626 1 14 '15N NOESY-HSQC' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 . . . . . . . . . . . . . . . . . 6626 1 stop_ save_ save_15N-HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 15N-HSQC _NMR_spec_expt.Entry_ID 6626 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name 15N-HSQC _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $600MHz _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_13C_1H-HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 13C_1H-HSQC _NMR_spec_expt.Entry_ID 6626 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name [13C,1H]-HSQC _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label . _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_HNCACB _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HNCACB _NMR_spec_expt.Entry_ID 6626 _NMR_spec_expt.ID 3 _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 1 _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_CBCA(CO)NH _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode CBCA(CO)NH _NMR_spec_expt.Entry_ID 6626 _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 1 _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_C(CO)NH-TOCSY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode C(CO)NH-TOCSY _NMR_spec_expt.Entry_ID 6626 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name C(CO)NH-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 1 _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_H(CCO)NH-TOCSY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode H(CCO)NH-TOCSY _NMR_spec_expt.Entry_ID 6626 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name H(CCO)NH-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 1 _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_HNCO _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HNCO _NMR_spec_expt.Entry_ID 6626 _NMR_spec_expt.ID 7 _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 1 _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_HCCH-TOCSY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HCCH-TOCSY _NMR_spec_expt.Entry_ID 6626 _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 1 _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_HCCH-COSY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HCCH-COSY _NMR_spec_expt.Entry_ID 6626 _NMR_spec_expt.ID 9 _NMR_spec_expt.Name HCCH-COSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label . _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_HN(CA)CO _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode HN(CA)CO _NMR_spec_expt.Entry_ID 6626 _NMR_spec_expt.ID 10 _NMR_spec_expt.Name HN(CA)CO _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label . _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_13C_HSQC-NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 13C_HSQC-NOESY _NMR_spec_expt.Entry_ID 6626 _NMR_spec_expt.ID 11 _NMR_spec_expt.Name '13C 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 1 _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_13C_NOESY-HSQC_(aromatic_region) _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 13C_NOESY-HSQC_(aromatic_region) _NMR_spec_expt.Entry_ID 6626 _NMR_spec_expt.ID 12 _NMR_spec_expt.Name '13C NOESY-HSQC (aromatic region)' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label . _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 'aromatic region' save_ save_13C-1H-HSQC_(aromatic_region) _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 13C-1H-HSQC_(aromatic_region) _NMR_spec_expt.Entry_ID 6626 _NMR_spec_expt.ID 13 _NMR_spec_expt.Name '[13C,1H]-HSQC (aromatic region)' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label . _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 'aromatic region' save_ save_15N_NOESY-HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 15N_NOESY-HSQC _NMR_spec_expt.Entry_ID 6626 _NMR_spec_expt.ID 14 _NMR_spec_expt.Name '15N NOESY-HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label . _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_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 6626 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 6626 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . . . . . 6626 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 6626 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 6626 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err 0.01 _Assigned_chem_shift_list.Chem_shift_13C_err 0.1 _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _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 $sample_1 isotropic 6626 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 2 $Sparky . . 6626 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 2 2 PRO HA H 1 4.40 0.01 . 1 . . . . 2 PRO HA . 6626 1 2 . 1 1 2 2 PRO HB2 H 1 2.24 0.01 . 2 . . . . 2 PRO HB2 . 6626 1 3 . 1 1 2 2 PRO HB3 H 1 1.88 0.01 . 2 . . . . 2 PRO HB3 . 6626 1 4 . 1 1 2 2 PRO HG2 H 1 1.93 0.01 . 1 . . . . 2 PRO HG2 . 6626 1 5 . 1 1 2 2 PRO HG3 H 1 1.93 0.01 . 1 . . . . 2 PRO HG3 . 6626 1 6 . 1 1 2 2 PRO HD2 H 1 3.54 0.01 . 2 . . . . 2 PRO HD2 . 6626 1 7 . 1 1 2 2 PRO HD3 H 1 3.48 0.01 . 2 . . . . 2 PRO HD3 . 6626 1 8 . 1 1 2 2 PRO C C 13 177.0 0.1 . 1 . . . . 2 PRO C . 6626 1 9 . 1 1 2 2 PRO CA C 13 63.3 0.1 . 1 . . . . 2 PRO CA . 6626 1 10 . 1 1 2 2 PRO CB C 13 32.4 0.1 . 1 . . . . 2 PRO CB . 6626 1 11 . 1 1 2 2 PRO CG C 13 27.2 0.1 . 1 . . . . 2 PRO CG . 6626 1 12 . 1 1 3 3 LEU H H 1 8.54 0.01 . 1 . . . . 3 LEU HN . 6626 1 13 . 1 1 3 3 LEU HA H 1 4.28 0.01 . 1 . . . . 3 LEU HA . 6626 1 14 . 1 1 3 3 LEU HB2 H 1 1.54 0.01 . 1 . . . . 3 LEU HB2 . 6626 1 15 . 1 1 3 3 LEU HB3 H 1 1.54 0.01 . 1 . . . . 3 LEU HB3 . 6626 1 16 . 1 1 3 3 LEU HG H 1 1.58 0.01 . 1 . . . . 3 LEU HG . 6626 1 17 . 1 1 3 3 LEU HD11 H 1 0.82 0.01 . 2 . . . . 3 LEU HD1 . 6626 1 18 . 1 1 3 3 LEU HD12 H 1 0.82 0.01 . 2 . . . . 3 LEU HD1 . 6626 1 19 . 1 1 3 3 LEU HD13 H 1 0.82 0.01 . 2 . . . . 3 LEU HD1 . 6626 1 20 . 1 1 3 3 LEU HD21 H 1 0.81 0.01 . 2 . . . . 3 LEU HD2 . 6626 1 21 . 1 1 3 3 LEU HD22 H 1 0.81 0.01 . 2 . . . . 3 LEU HD2 . 6626 1 22 . 1 1 3 3 LEU HD23 H 1 0.81 0.01 . 2 . . . . 3 LEU HD2 . 6626 1 23 . 1 1 3 3 LEU C C 13 177.8 0.1 . 1 . . . . 3 LEU C . 6626 1 24 . 1 1 3 3 LEU CA C 13 55.4 0.1 . 1 . . . . 3 LEU CA . 6626 1 25 . 1 1 3 3 LEU CB C 13 42.1 0.1 . 1 . . . . 3 LEU CB . 6626 1 26 . 1 1 3 3 LEU CG C 13 27.2 0.1 . 1 . . . . 3 LEU CG . 6626 1 27 . 1 1 3 3 LEU CD1 C 13 25.0 0.1 . 1 . . . . 3 LEU CD1 . 6626 1 28 . 1 1 3 3 LEU CD2 C 13 23.6 0.1 . 1 . . . . 3 LEU CD2 . 6626 1 29 . 1 1 3 3 LEU N N 15 119.4 0.1 . 1 . . . . 3 LEU N . 6626 1 30 . 1 1 4 4 GLY H H 1 8.37 0.01 . 1 . . . . 4 GLY HN . 6626 1 31 . 1 1 4 4 GLY HA2 H 1 3.78 0.01 . 1 . . . . 4 GLY HA1 . 6626 1 32 . 1 1 4 4 GLY HA3 H 1 3.78 0.01 . 1 . . . . 4 GLY HA2 . 6626 1 33 . 1 1 4 4 GLY C C 13 181.6 0.1 . 1 . . . . 4 GLY C . 6626 1 34 . 1 1 4 4 GLY CA C 13 45.4 0.1 . 1 . . . . 4 GLY CA . 6626 1 35 . 1 1 4 4 GLY N N 15 107.4 0.1 . 1 . . . . 4 GLY N . 6626 1 36 . 1 1 5 5 SER H H 1 8.16 0.01 . 1 . . . . 5 SER HN . 6626 1 37 . 1 1 5 5 SER C C 13 174.7 0.1 . 1 . . . . 5 SER C . 6626 1 38 . 1 1 5 5 SER CA C 13 58.4 0.1 . 1 . . . . 5 SER CA . 6626 1 39 . 1 1 5 5 SER CB C 13 64.0 0.1 . 1 . . . . 5 SER CB . 6626 1 40 . 1 1 5 5 SER N N 15 113.2 0.1 . 1 . . . . 5 SER N . 6626 1 41 . 1 1 6 6 MET H H 1 8.46 0.01 . 1 . . . . 6 MET HN . 6626 1 42 . 1 1 6 6 MET HA H 1 4.46 0.01 . 1 . . . . 6 MET HA . 6626 1 43 . 1 1 6 6 MET HE1 H 1 2.00 0.01 . 1 . . . . 6 MET HE . 6626 1 44 . 1 1 6 6 MET HE2 H 1 2.00 0.01 . 1 . . . . 6 MET HE . 6626 1 45 . 1 1 6 6 MET HE3 H 1 2.00 0.01 . 1 . . . . 6 MET HE . 6626 1 46 . 1 1 6 6 MET C C 13 175.9 0.1 . 1 . . . . 6 MET C . 6626 1 47 . 1 1 6 6 MET CA C 13 55.6 0.1 . 1 . . . . 6 MET CA . 6626 1 48 . 1 1 6 6 MET CB C 13 32.7 0.1 . 1 . . . . 6 MET CB . 6626 1 49 . 1 1 6 6 MET CG C 13 32.1 0.1 . 1 . . . . 6 MET CG . 6626 1 50 . 1 1 6 6 MET CE C 13 17.1 0.1 . 1 . . . . 6 MET CE . 6626 1 51 . 1 1 6 6 MET N N 15 119.4 0.1 . 1 . . . . 6 MET N . 6626 1 52 . 1 1 7 7 ASP H H 1 8.32 0.01 . 1 . . . . 7 ASP HN . 6626 1 53 . 1 1 7 7 ASP HA H 1 4.59 0.01 . 1 . . . . 7 ASP HA . 6626 1 54 . 1 1 7 7 ASP HB2 H 1 2.69 0.01 . 2 . . . . 7 ASP HB2 . 6626 1 55 . 1 1 7 7 ASP HB3 H 1 2.59 0.01 . 2 . . . . 7 ASP HB3 . 6626 1 56 . 1 1 7 7 ASP C C 13 176.4 0.1 . 1 . . . . 7 ASP C . 6626 1 57 . 1 1 7 7 ASP CA C 13 54.7 0.1 . 1 . . . . 7 ASP CA . 6626 1 58 . 1 1 7 7 ASP CB C 13 41.1 0.1 . 1 . . . . 7 ASP CB . 6626 1 59 . 1 1 7 7 ASP N N 15 118.9 0.1 . 1 . . . . 7 ASP N . 6626 1 60 . 1 1 8 8 THR H H 1 7.99 0.01 . 1 . . . . 8 THR HN . 6626 1 61 . 1 1 8 8 THR HA H 1 4.26 0.01 . 1 . . . . 8 THR HA . 6626 1 62 . 1 1 8 8 THR HB H 1 4.21 0.01 . 1 . . . . 8 THR HB . 6626 1 63 . 1 1 8 8 THR HG21 H 1 1.13 0.01 . 1 . . . . 8 THR HG2 . 6626 1 64 . 1 1 8 8 THR HG22 H 1 1.13 0.01 . 1 . . . . 8 THR HG2 . 6626 1 65 . 1 1 8 8 THR HG23 H 1 1.13 0.01 . 1 . . . . 8 THR HG2 . 6626 1 66 . 1 1 8 8 THR C C 13 174.8 0.1 . 1 . . . . 8 THR C . 6626 1 67 . 1 1 8 8 THR CA C 13 62.0 0.1 . 1 . . . . 8 THR CA . 6626 1 68 . 1 1 8 8 THR CB C 13 69.7 0.1 . 1 . . . . 8 THR CB . 6626 1 69 . 1 1 8 8 THR CG2 C 13 21.7 0.1 . 1 . . . . 8 THR CG2 . 6626 1 70 . 1 1 8 8 THR N N 15 110.9 0.1 . 1 . . . . 8 THR N . 6626 1 71 . 1 1 9 9 GLU H H 1 8.42 0.01 . 1 . . . . 9 GLU HN . 6626 1 72 . 1 1 9 9 GLU HA H 1 4.31 0.01 . 1 . . . . 9 GLU HA . 6626 1 73 . 1 1 9 9 GLU HB2 H 1 2.06 0.01 . 2 . . . . 9 GLU HB2 . 6626 1 74 . 1 1 9 9 GLU HB3 H 1 1.97 0.01 . 2 . . . . 9 GLU HB3 . 6626 1 75 . 1 1 9 9 GLU HG2 H 1 2.21 0.01 . 1 . . . . 9 GLU HG2 . 6626 1 76 . 1 1 9 9 GLU HG3 H 1 2.21 0.01 . 1 . . . . 9 GLU HG3 . 6626 1 77 . 1 1 9 9 GLU C C 13 177.0 0.1 . 1 . . . . 9 GLU C . 6626 1 78 . 1 1 9 9 GLU CA C 13 57.2 0.1 . 1 . . . . 9 GLU CA . 6626 1 79 . 1 1 9 9 GLU CB C 13 30.4 0.1 . 1 . . . . 9 GLU CB . 6626 1 80 . 1 1 9 9 GLU CG C 13 36.5 0.1 . 1 . . . . 9 GLU CG . 6626 1 81 . 1 1 9 9 GLU N N 15 120.5 0.1 . 1 . . . . 9 GLU N . 6626 1 82 . 1 1 10 10 THR H H 1 8.28 0.01 . 1 . . . . 10 THR HN . 6626 1 83 . 1 1 10 10 THR HA H 1 4.35 0.01 . 1 . . . . 10 THR HA . 6626 1 84 . 1 1 10 10 THR HB H 1 4.27 0.01 . 1 . . . . 10 THR HB . 6626 1 85 . 1 1 10 10 THR HG21 H 1 1.19 0.01 . 1 . . . . 10 THR HG2 . 6626 1 86 . 1 1 10 10 THR HG22 H 1 1.19 0.01 . 1 . . . . 10 THR HG2 . 6626 1 87 . 1 1 10 10 THR HG23 H 1 1.19 0.01 . 1 . . . . 10 THR HG2 . 6626 1 88 . 1 1 10 10 THR C C 13 175.2 0.1 . 1 . . . . 10 THR C . 6626 1 89 . 1 1 10 10 THR CA C 13 61.9 0.1 . 1 . . . . 10 THR CA . 6626 1 90 . 1 1 10 10 THR CB C 13 70.4 0.1 . 1 . . . . 10 THR CB . 6626 1 91 . 1 1 10 10 THR CG2 C 13 21.8 0.1 . 1 . . . . 10 THR CG2 . 6626 1 92 . 1 1 10 10 THR N N 15 111.7 0.1 . 1 . . . . 10 THR N . 6626 1 93 . 1 1 11 11 GLU H H 1 8.53 0.01 . 1 . . . . 11 GLU HN . 6626 1 94 . 1 1 11 11 GLU HA H 1 4.08 0.01 . 1 . . . . 11 GLU HA . 6626 1 95 . 1 1 11 11 GLU HB2 H 1 1.94 0.01 . 1 . . . . 11 GLU HB2 . 6626 1 96 . 1 1 11 11 GLU HB3 H 1 1.94 0.01 . 1 . . . . 11 GLU HB3 . 6626 1 97 . 1 1 11 11 GLU HG2 H 1 2.17 0.01 . 2 . . . . 11 GLU HG2 . 6626 1 98 . 1 1 11 11 GLU HG3 H 1 2.09 0.01 . 2 . . . . 11 GLU HG3 . 6626 1 99 . 1 1 11 11 GLU CA C 13 58.3 0.1 . 1 . . . . 11 GLU CA . 6626 1 100 . 1 1 11 11 GLU CB C 13 29.8 0.1 . 1 . . . . 11 GLU CB . 6626 1 101 . 1 1 11 11 GLU CG C 13 36.6 0.1 . 1 . . . . 11 GLU CG . 6626 1 102 . 1 1 11 11 GLU N N 15 120.2 0.1 . 1 . . . . 11 GLU N . 6626 1 103 . 1 1 12 12 PHE H H 1 7.96 0.01 . 1 . . . . 12 PHE HN . 6626 1 104 . 1 1 12 12 PHE HA H 1 4.16 0.01 . 1 . . . . 12 PHE HA . 6626 1 105 . 1 1 12 12 PHE HB2 H 1 3.01 0.01 . 1 . . . . 12 PHE HB2 . 6626 1 106 . 1 1 12 12 PHE HB3 H 1 3.01 0.01 . 1 . . . . 12 PHE HB3 . 6626 1 107 . 1 1 12 12 PHE HD1 H 1 7.17 0.01 . 1 . . . . 12 PHE HD1 . 6626 1 108 . 1 1 12 12 PHE HD2 H 1 7.17 0.01 . 1 . . . . 12 PHE HD2 . 6626 1 109 . 1 1 12 12 PHE HE1 H 1 7.28 0.01 . 1 . . . . 12 PHE HE1 . 6626 1 110 . 1 1 12 12 PHE HE2 H 1 7.28 0.01 . 1 . . . . 12 PHE HE2 . 6626 1 111 . 1 1 12 12 PHE C C 13 176.8 0.1 . 1 . . . . 12 PHE C . 6626 1 112 . 1 1 12 12 PHE CA C 13 59.9 0.1 . 1 . . . . 12 PHE CA . 6626 1 113 . 1 1 12 12 PHE CB C 13 39.2 0.1 . 1 . . . . 12 PHE CB . 6626 1 114 . 1 1 12 12 PHE CD1 C 13 131.8 0.1 . 1 . . . . 12 PHE CD1 . 6626 1 115 . 1 1 12 12 PHE CE1 C 13 131.6 0.1 . 1 . . . . 12 PHE CE1 . 6626 1 116 . 1 1 12 12 PHE N N 15 116.9 0.1 . 1 . . . . 12 PHE N . 6626 1 117 . 1 1 13 13 ASP H H 1 7.96 0.01 . 1 . . . . 13 ASP HN . 6626 1 118 . 1 1 13 13 ASP HA H 1 4.27 0.01 . 1 . . . . 13 ASP HA . 6626 1 119 . 1 1 13 13 ASP HB2 H 1 2.60 0.01 . 1 . . . . 13 ASP HB2 . 6626 1 120 . 1 1 13 13 ASP HB3 H 1 2.60 0.01 . 1 . . . . 13 ASP HB3 . 6626 1 121 . 1 1 13 13 ASP C C 13 178.1 0.1 . 1 . . . . 13 ASP C . 6626 1 122 . 1 1 13 13 ASP CA C 13 56.3 0.1 . 1 . . . . 13 ASP CA . 6626 1 123 . 1 1 13 13 ASP CB C 13 40.7 0.1 . 1 . . . . 13 ASP CB . 6626 1 124 . 1 1 13 13 ASP N N 15 116.9 0.1 . 1 . . . . 13 ASP N . 6626 1 125 . 1 1 14 14 ARG H H 1 7.81 0.01 . 1 . . . . 14 ARG HN . 6626 1 126 . 1 1 14 14 ARG HA H 1 3.66 0.01 . 1 . . . . 14 ARG HA . 6626 1 127 . 1 1 14 14 ARG HB2 H 1 1.70 0.01 . 2 . . . . 14 ARG HB2 . 6626 1 128 . 1 1 14 14 ARG HB3 H 1 1.59 0.01 . 2 . . . . 14 ARG HB3 . 6626 1 129 . 1 1 14 14 ARG HG2 H 1 1.52 0.01 . 2 . . . . 14 ARG HG2 . 6626 1 130 . 1 1 14 14 ARG HG3 H 1 1.36 0.01 . 2 . . . . 14 ARG HG3 . 6626 1 131 . 1 1 14 14 ARG HD2 H 1 3.17 0.01 . 1 . . . . 14 ARG HD2 . 6626 1 132 . 1 1 14 14 ARG HD3 H 1 3.17 0.01 . 1 . . . . 14 ARG HD3 . 6626 1 133 . 1 1 14 14 ARG C C 13 177.1 0.1 . 1 . . . . 14 ARG C . 6626 1 134 . 1 1 14 14 ARG CA C 13 59.1 0.1 . 1 . . . . 14 ARG CA . 6626 1 135 . 1 1 14 14 ARG CB C 13 30.2 0.1 . 1 . . . . 14 ARG CB . 6626 1 136 . 1 1 14 14 ARG CG C 13 27.7 0.1 . 1 . . . . 14 ARG CG . 6626 1 137 . 1 1 14 14 ARG CD C 13 43.6 0.1 . 1 . . . . 14 ARG CD . 6626 1 138 . 1 1 14 14 ARG N N 15 119.2 0.1 . 1 . . . . 14 ARG N . 6626 1 139 . 1 1 15 15 ILE H H 1 7.69 0.01 . 1 . . . . 15 ILE HN . 6626 1 140 . 1 1 15 15 ILE HA H 1 3.31 0.01 . 1 . . . . 15 ILE HA . 6626 1 141 . 1 1 15 15 ILE HB H 1 1.46 0.01 . 1 . . . . 15 ILE HB . 6626 1 142 . 1 1 15 15 ILE HG12 H 1 0.97 0.01 . 2 . . . . 15 ILE HG12 . 6626 1 143 . 1 1 15 15 ILE HG13 H 1 0.18 0.01 . 2 . . . . 15 ILE HG13 . 6626 1 144 . 1 1 15 15 ILE HG21 H 1 0.67 0.01 . 1 . . . . 15 ILE HG2 . 6626 1 145 . 1 1 15 15 ILE HG22 H 1 0.67 0.01 . 1 . . . . 15 ILE HG2 . 6626 1 146 . 1 1 15 15 ILE HG23 H 1 0.67 0.01 . 1 . . . . 15 ILE HG2 . 6626 1 147 . 1 1 15 15 ILE HD11 H 1 0.40 0.01 . 1 . . . . 15 ILE HD1 . 6626 1 148 . 1 1 15 15 ILE HD12 H 1 0.40 0.01 . 1 . . . . 15 ILE HD1 . 6626 1 149 . 1 1 15 15 ILE HD13 H 1 0.40 0.01 . 1 . . . . 15 ILE HD1 . 6626 1 150 . 1 1 15 15 ILE C C 13 177.4 0.1 . 1 . . . . 15 ILE C . 6626 1 151 . 1 1 15 15 ILE CA C 13 65.8 0.1 . 1 . . . . 15 ILE CA . 6626 1 152 . 1 1 15 15 ILE CB C 13 37.7 0.1 . 1 . . . . 15 ILE CB . 6626 1 153 . 1 1 15 15 ILE CG1 C 13 29.1 0.1 . 1 . . . . 15 ILE CG1 . 6626 1 154 . 1 1 15 15 ILE CG2 C 13 17.1 0.1 . 1 . . . . 15 ILE CG2 . 6626 1 155 . 1 1 15 15 ILE CD1 C 13 13.7 0.1 . 1 . . . . 15 ILE CD1 . 6626 1 156 . 1 1 15 15 ILE N N 15 116.3 0.1 . 1 . . . . 15 ILE N . 6626 1 157 . 1 1 16 16 LEU H H 1 7.41 0.01 . 1 . . . . 16 LEU HN . 6626 1 158 . 1 1 16 16 LEU HA H 1 3.87 0.01 . 1 . . . . 16 LEU HA . 6626 1 159 . 1 1 16 16 LEU HB2 H 1 1.57 0.01 . 2 . . . . 16 LEU HB2 . 6626 1 160 . 1 1 16 16 LEU HB3 H 1 1.44 0.01 . 2 . . . . 16 LEU HB3 . 6626 1 161 . 1 1 16 16 LEU HD11 H 1 0.79 0.01 . 2 . . . . 16 LEU HD1 . 6626 1 162 . 1 1 16 16 LEU HD12 H 1 0.79 0.01 . 2 . . . . 16 LEU HD1 . 6626 1 163 . 1 1 16 16 LEU HD13 H 1 0.79 0.01 . 2 . . . . 16 LEU HD1 . 6626 1 164 . 1 1 16 16 LEU HD21 H 1 0.74 0.01 . 2 . . . . 16 LEU HD2 . 6626 1 165 . 1 1 16 16 LEU HD22 H 1 0.74 0.01 . 2 . . . . 16 LEU HD2 . 6626 1 166 . 1 1 16 16 LEU HD23 H 1 0.74 0.01 . 2 . . . . 16 LEU HD2 . 6626 1 167 . 1 1 16 16 LEU C C 13 180.0 0.1 . 1 . . . . 16 LEU C . 6626 1 168 . 1 1 16 16 LEU CA C 13 57.9 0.1 . 1 . . . . 16 LEU CA . 6626 1 169 . 1 1 16 16 LEU CB C 13 41.6 0.1 . 1 . . . . 16 LEU CB . 6626 1 170 . 1 1 16 16 LEU CG C 13 26.9 0.1 . 1 . . . . 16 LEU CG . 6626 1 171 . 1 1 16 16 LEU CD1 C 13 25.0 0.1 . 1 . . . . 16 LEU CD1 . 6626 1 172 . 1 1 16 16 LEU CD2 C 13 23.6 0.1 . 1 . . . . 16 LEU CD2 . 6626 1 173 . 1 1 16 16 LEU N N 15 116.1 0.1 . 1 . . . . 16 LEU N . 6626 1 174 . 1 1 17 17 LEU H H 1 7.38 0.01 . 1 . . . . 17 LEU HN . 6626 1 175 . 1 1 17 17 LEU HA H 1 4.05 0.01 . 1 . . . . 17 LEU HA . 6626 1 176 . 1 1 17 17 LEU HB2 H 1 1.50 0.01 . 1 . . . . 17 LEU HB2 . 6626 1 177 . 1 1 17 17 LEU HB3 H 1 1.50 0.01 . 1 . . . . 17 LEU HB3 . 6626 1 178 . 1 1 17 17 LEU HG H 1 1.47 0.01 . 1 . . . . 17 LEU HG . 6626 1 179 . 1 1 17 17 LEU HD11 H 1 0.79 0.01 . 2 . . . . 17 LEU HD1 . 6626 1 180 . 1 1 17 17 LEU HD12 H 1 0.79 0.01 . 2 . . . . 17 LEU HD1 . 6626 1 181 . 1 1 17 17 LEU HD13 H 1 0.79 0.01 . 2 . . . . 17 LEU HD1 . 6626 1 182 . 1 1 17 17 LEU HD21 H 1 0.70 0.01 . 2 . . . . 17 LEU HD2 . 6626 1 183 . 1 1 17 17 LEU HD22 H 1 0.70 0.01 . 2 . . . . 17 LEU HD2 . 6626 1 184 . 1 1 17 17 LEU HD23 H 1 0.70 0.01 . 2 . . . . 17 LEU HD2 . 6626 1 185 . 1 1 17 17 LEU C C 13 179.6 0.1 . 1 . . . . 17 LEU C . 6626 1 186 . 1 1 17 17 LEU CA C 13 58.1 0.1 . 1 . . . . 17 LEU CA . 6626 1 187 . 1 1 17 17 LEU CB C 13 41.4 0.1 . 1 . . . . 17 LEU CB . 6626 1 188 . 1 1 17 17 LEU CG C 13 27.0 0.1 . 1 . . . . 17 LEU CG . 6626 1 189 . 1 1 17 17 LEU CD1 C 13 24.3 0.1 . 1 . . . . 17 LEU CD1 . 6626 1 190 . 1 1 17 17 LEU CD2 C 13 24.5 0.1 . 1 . . . . 17 LEU CD2 . 6626 1 191 . 1 1 17 17 LEU N N 15 117.8 0.1 . 1 . . . . 17 LEU N . 6626 1 192 . 1 1 18 18 PHE H H 1 8.08 0.01 . 1 . . . . 18 PHE HN . 6626 1 193 . 1 1 18 18 PHE HA H 1 4.50 0.01 . 1 . . . . 18 PHE HA . 6626 1 194 . 1 1 18 18 PHE HB2 H 1 3.27 0.01 . 2 . . . . 18 PHE HB2 . 6626 1 195 . 1 1 18 18 PHE HB3 H 1 3.10 0.01 . 2 . . . . 18 PHE HB3 . 6626 1 196 . 1 1 18 18 PHE HD1 H 1 7.11 0.01 . 1 . . . . 18 PHE HD1 . 6626 1 197 . 1 1 18 18 PHE HD2 H 1 7.11 0.01 . 1 . . . . 18 PHE HD2 . 6626 1 198 . 1 1 18 18 PHE HE1 H 1 7.36 0.01 . 1 . . . . 18 PHE HE1 . 6626 1 199 . 1 1 18 18 PHE HE2 H 1 7.36 0.01 . 1 . . . . 18 PHE HE2 . 6626 1 200 . 1 1 18 18 PHE C C 13 178.6 0.1 . 1 . . . . 18 PHE C . 6626 1 201 . 1 1 18 18 PHE CA C 13 59.2 0.1 . 1 . . . . 18 PHE CA . 6626 1 202 . 1 1 18 18 PHE CB C 13 38.0 0.1 . 1 . . . . 18 PHE CB . 6626 1 203 . 1 1 18 18 PHE N N 15 115.6 0.1 . 1 . . . . 18 PHE N . 6626 1 204 . 1 1 19 19 GLU H H 1 8.90 0.01 . 1 . . . . 19 GLU HN . 6626 1 205 . 1 1 19 19 GLU HA H 1 4.30 0.01 . 1 . . . . 19 GLU HA . 6626 1 206 . 1 1 19 19 GLU HB2 H 1 2.13 0.01 . 2 . . . . 19 GLU HB2 . 6626 1 207 . 1 1 19 19 GLU HB3 H 1 1.99 0.01 . 2 . . . . 19 GLU HB3 . 6626 1 208 . 1 1 19 19 GLU HG2 H 1 2.33 0.01 . 1 . . . . 19 GLU HG2 . 6626 1 209 . 1 1 19 19 GLU HG3 H 1 2.33 0.01 . 1 . . . . 19 GLU HG3 . 6626 1 210 . 1 1 19 19 GLU C C 13 179.4 0.1 . 1 . . . . 19 GLU C . 6626 1 211 . 1 1 19 19 GLU CA C 13 59.4 0.1 . 1 . . . . 19 GLU CA . 6626 1 212 . 1 1 19 19 GLU CB C 13 29.1 0.1 . 1 . . . . 19 GLU CB . 6626 1 213 . 1 1 19 19 GLU CG C 13 35.9 0.1 . 1 . . . . 19 GLU CG . 6626 1 214 . 1 1 19 19 GLU N N 15 117.6 0.1 . 1 . . . . 19 GLU N . 6626 1 215 . 1 1 20 20 GLN H H 1 7.93 0.01 . 1 . . . . 20 GLN HN . 6626 1 216 . 1 1 20 20 GLN HA H 1 4.00 0.01 . 1 . . . . 20 GLN HA . 6626 1 217 . 1 1 20 20 GLN HB2 H 1 2.24 0.01 . 1 . . . . 20 GLN HB2 . 6626 1 218 . 1 1 20 20 GLN HB3 H 1 2.24 0.01 . 1 . . . . 20 GLN HB3 . 6626 1 219 . 1 1 20 20 GLN HG2 H 1 2.45 0.01 . 2 . . . . 20 GLN HG2 . 6626 1 220 . 1 1 20 20 GLN HG3 H 1 2.33 0.01 . 2 . . . . 20 GLN HG3 . 6626 1 221 . 1 1 20 20 GLN C C 13 178.7 0.1 . 1 . . . . 20 GLN C . 6626 1 222 . 1 1 20 20 GLN CA C 13 59.1 0.1 . 1 . . . . 20 GLN CA . 6626 1 223 . 1 1 20 20 GLN CB C 13 28.3 0.1 . 1 . . . . 20 GLN CB . 6626 1 224 . 1 1 20 20 GLN CG C 13 34.0 0.1 . 1 . . . . 20 GLN CG . 6626 1 225 . 1 1 20 20 GLN N N 15 118.3 0.1 . 1 . . . . 20 GLN N . 6626 1 226 . 1 1 21 21 ILE H H 1 8.06 0.01 . 1 . . . . 21 ILE HN . 6626 1 227 . 1 1 21 21 ILE HA H 1 3.72 0.01 . 1 . . . . 21 ILE HA . 6626 1 228 . 1 1 21 21 ILE HB H 1 2.10 0.01 . 1 . . . . 21 ILE HB . 6626 1 229 . 1 1 21 21 ILE HG12 H 1 1.91 0.01 . 2 . . . . 21 ILE HG12 . 6626 1 230 . 1 1 21 21 ILE HG13 H 1 1.10 0.01 . 2 . . . . 21 ILE HG13 . 6626 1 231 . 1 1 21 21 ILE HG21 H 1 0.91 0.01 . 1 . . . . 21 ILE HG2 . 6626 1 232 . 1 1 21 21 ILE HG22 H 1 0.91 0.01 . 1 . . . . 21 ILE HG2 . 6626 1 233 . 1 1 21 21 ILE HG23 H 1 0.91 0.01 . 1 . . . . 21 ILE HG2 . 6626 1 234 . 1 1 21 21 ILE HD11 H 1 0.90 0.01 . 1 . . . . 21 ILE HD1 . 6626 1 235 . 1 1 21 21 ILE HD12 H 1 0.90 0.01 . 1 . . . . 21 ILE HD1 . 6626 1 236 . 1 1 21 21 ILE HD13 H 1 0.90 0.01 . 1 . . . . 21 ILE HD1 . 6626 1 237 . 1 1 21 21 ILE C C 13 178.3 0.1 . 1 . . . . 21 ILE C . 6626 1 238 . 1 1 21 21 ILE CA C 13 65.4 0.1 . 1 . . . . 21 ILE CA . 6626 1 239 . 1 1 21 21 ILE CB C 13 38.2 0.1 . 1 . . . . 21 ILE CB . 6626 1 240 . 1 1 21 21 ILE CG1 C 13 29.0 0.1 . 1 . . . . 21 ILE CG1 . 6626 1 241 . 1 1 21 21 ILE CG2 C 13 17.2 0.1 . 1 . . . . 21 ILE CG2 . 6626 1 242 . 1 1 21 21 ILE CD1 C 13 13.8 0.1 . 1 . . . . 21 ILE CD1 . 6626 1 243 . 1 1 21 21 ILE N N 15 119.0 0.1 . 1 . . . . 21 ILE N . 6626 1 244 . 1 1 22 22 ARG H H 1 8.62 0.01 . 1 . . . . 22 ARG HN . 6626 1 245 . 1 1 22 22 ARG HA H 1 3.55 0.01 . 1 . . . . 22 ARG HA . 6626 1 246 . 1 1 22 22 ARG HB2 H 1 1.82 0.01 . 1 . . . . 22 ARG HB2 . 6626 1 247 . 1 1 22 22 ARG HB3 H 1 1.82 0.01 . 1 . . . . 22 ARG HB3 . 6626 1 248 . 1 1 22 22 ARG HG2 H 1 1.69 0.01 . 2 . . . . 22 ARG HG2 . 6626 1 249 . 1 1 22 22 ARG HG3 H 1 1.48 0.01 . 2 . . . . 22 ARG HG3 . 6626 1 250 . 1 1 22 22 ARG C C 13 177.1 0.1 . 1 . . . . 22 ARG C . 6626 1 251 . 1 1 22 22 ARG CA C 13 60.2 0.1 . 1 . . . . 22 ARG CA . 6626 1 252 . 1 1 22 22 ARG CB C 13 30.2 0.1 . 1 . . . . 22 ARG CB . 6626 1 253 . 1 1 22 22 ARG CG C 13 25.9 0.1 . 1 . . . . 22 ARG CG . 6626 1 254 . 1 1 22 22 ARG CD C 13 45.3 0.1 . 1 . . . . 22 ARG CD . 6626 1 255 . 1 1 22 22 ARG N N 15 118.9 0.1 . 1 . . . . 22 ARG N . 6626 1 256 . 1 1 23 23 GLN H H 1 8.20 0.01 . 1 . . . . 23 GLN HN . 6626 1 257 . 1 1 23 23 GLN HA H 1 3.83 0.01 . 1 . . . . 23 GLN HA . 6626 1 258 . 1 1 23 23 GLN HB2 H 1 2.08 0.01 . 1 . . . . 23 GLN HB2 . 6626 1 259 . 1 1 23 23 GLN HB3 H 1 2.08 0.01 . 1 . . . . 23 GLN HB3 . 6626 1 260 . 1 1 23 23 GLN HG2 H 1 2.43 0.01 . 2 . . . . 23 GLN HG2 . 6626 1 261 . 1 1 23 23 GLN HG3 H 1 2.30 0.01 . 2 . . . . 23 GLN HG3 . 6626 1 262 . 1 1 23 23 GLN HE21 H 1 7.46 0.01 . 2 . . . . 23 GLN HE21 . 6626 1 263 . 1 1 23 23 GLN HE22 H 1 6.80 0.01 . 2 . . . . 23 GLN HE22 . 6626 1 264 . 1 1 23 23 GLN C C 13 178.6 0.1 . 1 . . . . 23 GLN C . 6626 1 265 . 1 1 23 23 GLN CA C 13 58.9 0.1 . 1 . . . . 23 GLN CA . 6626 1 266 . 1 1 23 23 GLN CB C 13 28.7 0.1 . 1 . . . . 23 GLN CB . 6626 1 267 . 1 1 23 23 GLN CG C 13 34.3 0.1 . 1 . . . . 23 GLN CG . 6626 1 268 . 1 1 23 23 GLN N N 15 115.8 0.1 . 1 . . . . 23 GLN N . 6626 1 269 . 1 1 23 23 GLN NE2 N 15 110.5 0.1 . 1 . . . . 23 GLN NE2 . 6626 1 270 . 1 1 24 24 ASP H H 1 8.27 0.01 . 1 . . . . 24 ASP HN . 6626 1 271 . 1 1 24 24 ASP HA H 1 4.34 0.01 . 1 . . . . 24 ASP HA . 6626 1 272 . 1 1 24 24 ASP HB2 H 1 2.75 0.01 . 2 . . . . 24 ASP HB2 . 6626 1 273 . 1 1 24 24 ASP HB3 H 1 2.65 0.01 . 2 . . . . 24 ASP HB3 . 6626 1 274 . 1 1 24 24 ASP C C 13 178.9 0.1 . 1 . . . . 24 ASP C . 6626 1 275 . 1 1 24 24 ASP CA C 13 57.4 0.1 . 1 . . . . 24 ASP CA . 6626 1 276 . 1 1 24 24 ASP CB C 13 41.0 0.1 . 1 . . . . 24 ASP CB . 6626 1 277 . 1 1 24 24 ASP N N 15 118.1 0.1 . 1 . . . . 24 ASP N . 6626 1 278 . 1 1 25 25 ALA H H 1 8.50 0.01 . 1 . . . . 25 ALA HN . 6626 1 279 . 1 1 25 25 ALA HA H 1 4.55 0.01 . 1 . . . . 25 ALA HA . 6626 1 280 . 1 1 25 25 ALA HB1 H 1 0.91 0.01 . 1 . . . . 25 ALA HB . 6626 1 281 . 1 1 25 25 ALA HB2 H 1 0.91 0.01 . 1 . . . . 25 ALA HB . 6626 1 282 . 1 1 25 25 ALA HB3 H 1 0.91 0.01 . 1 . . . . 25 ALA HB . 6626 1 283 . 1 1 25 25 ALA C C 13 180.5 0.1 . 1 . . . . 25 ALA C . 6626 1 284 . 1 1 25 25 ALA CA C 13 54.0 0.1 . 1 . . . . 25 ALA CA . 6626 1 285 . 1 1 25 25 ALA CB C 13 16.1 0.1 . 1 . . . . 25 ALA CB . 6626 1 286 . 1 1 25 25 ALA N N 15 123.0 0.1 . 1 . . . . 25 ALA N . 6626 1 287 . 1 1 26 26 GLU H H 1 7.69 0.01 . 1 . . . . 26 GLU HN . 6626 1 288 . 1 1 26 26 GLU HA H 1 2.58 0.01 . 1 . . . . 26 GLU HA . 6626 1 289 . 1 1 26 26 GLU HB2 H 1 1.75 0.01 . 2 . . . . 26 GLU HB2 . 6626 1 290 . 1 1 26 26 GLU HB3 H 1 1.65 0.01 . 2 . . . . 26 GLU HB3 . 6626 1 291 . 1 1 26 26 GLU HG2 H 1 2.16 0.01 . 2 . . . . 26 GLU HG2 . 6626 1 292 . 1 1 26 26 GLU HG3 H 1 1.96 0.01 . 2 . . . . 26 GLU HG3 . 6626 1 293 . 1 1 26 26 GLU C C 13 179.0 0.1 . 1 . . . . 26 GLU C . 6626 1 294 . 1 1 26 26 GLU CA C 13 58.9 0.1 . 1 . . . . 26 GLU CA . 6626 1 295 . 1 1 26 26 GLU CB C 13 29.2 0.1 . 1 . . . . 26 GLU CB . 6626 1 296 . 1 1 26 26 GLU CG C 13 36.4 0.1 . 1 . . . . 26 GLU CG . 6626 1 297 . 1 1 26 26 GLU N N 15 118.5 0.1 . 1 . . . . 26 GLU N . 6626 1 298 . 1 1 27 27 ASN H H 1 8.03 0.01 . 1 . . . . 27 ASN HN . 6626 1 299 . 1 1 27 27 ASN HA H 1 4.33 0.01 . 1 . . . . 27 ASN HA . 6626 1 300 . 1 1 27 27 ASN HB2 H 1 2.88 0.01 . 2 . . . . 27 ASN HB2 . 6626 1 301 . 1 1 27 27 ASN HB3 H 1 2.77 0.01 . 2 . . . . 27 ASN HB3 . 6626 1 302 . 1 1 27 27 ASN HD21 H 1 6.92 0.01 . 2 . . . . 27 ASN HD21 . 6626 1 303 . 1 1 27 27 ASN HD22 H 1 7.78 0.01 . 2 . . . . 27 ASN HD22 . 6626 1 304 . 1 1 27 27 ASN C C 13 178.9 0.1 . 1 . . . . 27 ASN C . 6626 1 305 . 1 1 27 27 ASN CA C 13 56.2 0.1 . 1 . . . . 27 ASN CA . 6626 1 306 . 1 1 27 27 ASN CB C 13 38.0 0.1 . 1 . . . . 27 ASN CB . 6626 1 307 . 1 1 27 27 ASN N N 15 115.8 0.1 . 1 . . . . 27 ASN N . 6626 1 308 . 1 1 27 27 ASN ND2 N 15 110.8 0.1 . 1 . . . . 27 ASN ND2 . 6626 1 309 . 1 1 28 28 THR H H 1 8.67 0.01 . 1 . . . . 28 THR HN . 6626 1 310 . 1 1 28 28 THR HA H 1 3.87 0.01 . 1 . . . . 28 THR HA . 6626 1 311 . 1 1 28 28 THR HB H 1 4.17 0.01 . 1 . . . . 28 THR HB . 6626 1 312 . 1 1 28 28 THR HG21 H 1 1.13 0.01 . 1 . . . . 28 THR HG2 . 6626 1 313 . 1 1 28 28 THR HG22 H 1 1.13 0.01 . 1 . . . . 28 THR HG2 . 6626 1 314 . 1 1 28 28 THR HG23 H 1 1.13 0.01 . 1 . . . . 28 THR HG2 . 6626 1 315 . 1 1 28 28 THR C C 13 175.4 0.1 . 1 . . . . 28 THR C . 6626 1 316 . 1 1 28 28 THR CA C 13 66.9 0.1 . 1 . . . . 28 THR CA . 6626 1 317 . 1 1 28 28 THR CB C 13 68.1 0.1 . 1 . . . . 28 THR CB . 6626 1 318 . 1 1 28 28 THR CG2 C 13 21.0 0.1 . 1 . . . . 28 THR CG2 . 6626 1 319 . 1 1 28 28 THR N N 15 117.9 0.1 . 1 . . . . 28 THR N . 6626 1 320 . 1 1 29 29 TYR H H 1 8.01 0.01 . 1 . . . . 29 TYR HN . 6626 1 321 . 1 1 29 29 TYR HA H 1 3.86 0.01 . 1 . . . . 29 TYR HA . 6626 1 322 . 1 1 29 29 TYR HB2 H 1 2.99 0.01 . 2 . . . . 29 TYR HB2 . 6626 1 323 . 1 1 29 29 TYR HB3 H 1 2.82 0.01 . 2 . . . . 29 TYR HB3 . 6626 1 324 . 1 1 29 29 TYR HD1 H 1 7.42 0.01 . 1 . . . . 29 TYR HD1 . 6626 1 325 . 1 1 29 29 TYR HD2 H 1 7.42 0.01 . 1 . . . . 29 TYR HD2 . 6626 1 326 . 1 1 29 29 TYR HE1 H 1 7.00 0.01 . 1 . . . . 29 TYR HE1 . 6626 1 327 . 1 1 29 29 TYR HE2 H 1 7.00 0.01 . 1 . . . . 29 TYR HE2 . 6626 1 328 . 1 1 29 29 TYR C C 13 175.9 0.1 . 1 . . . . 29 TYR C . 6626 1 329 . 1 1 29 29 TYR CA C 13 61.3 0.1 . 1 . . . . 29 TYR CA . 6626 1 330 . 1 1 29 29 TYR CB C 13 39.5 0.1 . 1 . . . . 29 TYR CB . 6626 1 331 . 1 1 29 29 TYR CD1 C 13 133.8 0.1 . 1 . . . . 29 TYR CD1 . 6626 1 332 . 1 1 29 29 TYR CE1 C 13 119.3 0.1 . 1 . . . . 29 TYR CE1 . 6626 1 333 . 1 1 29 29 TYR N N 15 120.9 0.1 . 1 . . . . 29 TYR N . 6626 1 334 . 1 1 30 30 LYS H H 1 7.33 0.01 . 1 . . . . 30 LYS HN . 6626 1 335 . 1 1 30 30 LYS HA H 1 3.85 0.01 . 1 . . . . 30 LYS HA . 6626 1 336 . 1 1 30 30 LYS HB2 H 1 1.90 0.01 . 1 . . . . 30 LYS HB2 . 6626 1 337 . 1 1 30 30 LYS HB3 H 1 1.90 0.01 . 1 . . . . 30 LYS HB3 . 6626 1 338 . 1 1 30 30 LYS HG2 H 1 1.72 0.01 . 2 . . . . 30 LYS HG2 . 6626 1 339 . 1 1 30 30 LYS HG3 H 1 1.50 0.01 . 2 . . . . 30 LYS HG3 . 6626 1 340 . 1 1 30 30 LYS HD2 H 1 1.70 0.01 . 1 . . . . 30 LYS HD2 . 6626 1 341 . 1 1 30 30 LYS HD3 H 1 1.70 0.01 . 1 . . . . 30 LYS HD3 . 6626 1 342 . 1 1 30 30 LYS HE2 H 1 2.97 0.01 . 1 . . . . 30 LYS HE2 . 6626 1 343 . 1 1 30 30 LYS HE3 H 1 2.97 0.01 . 1 . . . . 30 LYS HE3 . 6626 1 344 . 1 1 30 30 LYS C C 13 178.3 0.1 . 1 . . . . 30 LYS C . 6626 1 345 . 1 1 30 30 LYS CA C 13 59.0 0.1 . 1 . . . . 30 LYS CA . 6626 1 346 . 1 1 30 30 LYS CB C 13 32.4 0.1 . 1 . . . . 30 LYS CB . 6626 1 347 . 1 1 30 30 LYS CG C 13 25.6 0.1 . 1 . . . . 30 LYS CG . 6626 1 348 . 1 1 30 30 LYS CD C 13 29.4 0.1 . 1 . . . . 30 LYS CD . 6626 1 349 . 1 1 30 30 LYS CE C 13 42.3 0.1 . 1 . . . . 30 LYS CE . 6626 1 350 . 1 1 30 30 LYS N N 15 112.7 0.1 . 1 . . . . 30 LYS N . 6626 1 351 . 1 1 31 31 SER H H 1 7.14 0.01 . 1 . . . . 31 SER HN . 6626 1 352 . 1 1 31 31 SER HA H 1 4.38 0.01 . 1 . . . . 31 SER HA . 6626 1 353 . 1 1 31 31 SER HB2 H 1 3.85 0.01 . 1 . . . . 31 SER HB2 . 6626 1 354 . 1 1 31 31 SER HB3 H 1 3.85 0.01 . 1 . . . . 31 SER HB3 . 6626 1 355 . 1 1 31 31 SER C C 13 174.6 0.1 . 1 . . . . 31 SER C . 6626 1 356 . 1 1 31 31 SER CA C 13 59.7 0.1 . 1 . . . . 31 SER CA . 6626 1 357 . 1 1 31 31 SER CB C 13 64.0 0.1 . 1 . . . . 31 SER CB . 6626 1 358 . 1 1 31 31 SER N N 15 108.5 0.1 . 1 . . . . 31 SER N . 6626 1 359 . 1 1 32 32 ASN H H 1 8.47 0.01 . 1 . . . . 32 ASN HN . 6626 1 360 . 1 1 32 32 ASN HA H 1 5.03 0.01 . 1 . . . . 32 ASN HA . 6626 1 361 . 1 1 32 32 ASN HB2 H 1 2.95 0.01 . 2 . . . . 32 ASN HB2 . 6626 1 362 . 1 1 32 32 ASN HB3 H 1 2.68 0.01 . 2 . . . . 32 ASN HB3 . 6626 1 363 . 1 1 32 32 ASN C C 13 172.2 0.1 . 1 . . . . 32 ASN C . 6626 1 364 . 1 1 32 32 ASN CA C 13 51.0 0.1 . 1 . . . . 32 ASN CA . 6626 1 365 . 1 1 32 32 ASN CB C 13 38.4 0.1 . 1 . . . . 32 ASN CB . 6626 1 366 . 1 1 32 32 ASN N N 15 114.7 0.1 . 1 . . . . 32 ASN N . 6626 1 367 . 1 1 33 33 PRO HA H 1 4.23 0.01 . 1 . . . . 33 PRO HA . 6626 1 368 . 1 1 33 33 PRO HB2 H 1 1.76 0.01 . 2 . . . . 33 PRO HB2 . 6626 1 369 . 1 1 33 33 PRO HB3 H 1 1.48 0.01 . 2 . . . . 33 PRO HB3 . 6626 1 370 . 1 1 33 33 PRO HG2 H 1 1.80 0.01 . 2 . . . . 33 PRO HG2 . 6626 1 371 . 1 1 33 33 PRO HG3 H 1 1.70 0.01 . 2 . . . . 33 PRO HG3 . 6626 1 372 . 1 1 33 33 PRO HD2 H 1 3.69 0.01 . 2 . . . . 33 PRO HD2 . 6626 1 373 . 1 1 33 33 PRO HD3 H 1 3.23 0.01 . 2 . . . . 33 PRO HD3 . 6626 1 374 . 1 1 33 33 PRO C C 13 175.5 0.1 . 1 . . . . 33 PRO C . 6626 1 375 . 1 1 33 33 PRO CA C 13 64.3 0.1 . 1 . . . . 33 PRO CA . 6626 1 376 . 1 1 33 33 PRO CB C 13 31.7 0.1 . 1 . . . . 33 PRO CB . 6626 1 377 . 1 1 33 33 PRO CG C 13 26.6 0.1 . 1 . . . . 33 PRO CG . 6626 1 378 . 1 1 33 33 PRO CD C 13 50.3 0.1 . 1 . . . . 33 PRO CD . 6626 1 379 . 1 1 34 34 LEU H H 1 7.42 0.01 . 1 . . . . 34 LEU HN . 6626 1 380 . 1 1 34 34 LEU HA H 1 4.58 0.01 . 1 . . . . 34 LEU HA . 6626 1 381 . 1 1 34 34 LEU HB2 H 1 1.75 0.01 . 2 . . . . 34 LEU HB2 . 6626 1 382 . 1 1 34 34 LEU HB3 H 1 1.69 0.01 . 2 . . . . 34 LEU HB3 . 6626 1 383 . 1 1 34 34 LEU HG H 1 1.50 0.01 . 1 . . . . 34 LEU HG . 6626 1 384 . 1 1 34 34 LEU HD11 H 1 0.92 0.01 . 2 . . . . 34 LEU HD1 . 6626 1 385 . 1 1 34 34 LEU HD12 H 1 0.92 0.01 . 2 . . . . 34 LEU HD1 . 6626 1 386 . 1 1 34 34 LEU HD13 H 1 0.92 0.01 . 2 . . . . 34 LEU HD1 . 6626 1 387 . 1 1 34 34 LEU HD21 H 1 0.81 0.01 . 2 . . . . 34 LEU HD2 . 6626 1 388 . 1 1 34 34 LEU HD22 H 1 0.81 0.01 . 2 . . . . 34 LEU HD2 . 6626 1 389 . 1 1 34 34 LEU HD23 H 1 0.81 0.01 . 2 . . . . 34 LEU HD2 . 6626 1 390 . 1 1 34 34 LEU C C 13 176.0 0.1 . 1 . . . . 34 LEU C . 6626 1 391 . 1 1 34 34 LEU CA C 13 53.5 0.1 . 1 . . . . 34 LEU CA . 6626 1 392 . 1 1 34 34 LEU CB C 13 40.3 0.1 . 1 . . . . 34 LEU CB . 6626 1 393 . 1 1 34 34 LEU CG C 13 27.4 0.1 . 1 . . . . 34 LEU CG . 6626 1 394 . 1 1 34 34 LEU CD1 C 13 25.4 0.1 . 1 . . . . 34 LEU CD1 . 6626 1 395 . 1 1 34 34 LEU CD2 C 13 22.6 0.1 . 1 . . . . 34 LEU CD2 . 6626 1 396 . 1 1 34 34 LEU N N 15 113.3 0.1 . 1 . . . . 34 LEU N . 6626 1 397 . 1 1 35 35 ASP H H 1 6.81 0.01 . 1 . . . . 35 ASP HN . 6626 1 398 . 1 1 35 35 ASP HA H 1 4.73 0.01 . 1 . . . . 35 ASP HA . 6626 1 399 . 1 1 35 35 ASP HB2 H 1 3.09 0.01 . 2 . . . . 35 ASP HB2 . 6626 1 400 . 1 1 35 35 ASP HB3 H 1 2.59 0.01 . 2 . . . . 35 ASP HB3 . 6626 1 401 . 1 1 35 35 ASP C C 13 177.4 0.1 . 1 . . . . 35 ASP C . 6626 1 402 . 1 1 35 35 ASP CA C 13 53.2 0.1 . 1 . . . . 35 ASP CA . 6626 1 403 . 1 1 35 35 ASP CB C 13 40.5 0.1 . 1 . . . . 35 ASP CB . 6626 1 404 . 1 1 35 35 ASP N N 15 114.8 0.1 . 1 . . . . 35 ASP N . 6626 1 405 . 1 1 36 36 ALA H H 1 8.98 0.01 . 1 . . . . 36 ALA HN . 6626 1 406 . 1 1 36 36 ALA HA H 1 4.25 0.01 . 1 . . . . 36 ALA HA . 6626 1 407 . 1 1 36 36 ALA HB1 H 1 1.68 0.01 . 1 . . . . 36 ALA HB . 6626 1 408 . 1 1 36 36 ALA HB2 H 1 1.68 0.01 . 1 . . . . 36 ALA HB . 6626 1 409 . 1 1 36 36 ALA HB3 H 1 1.68 0.01 . 1 . . . . 36 ALA HB . 6626 1 410 . 1 1 36 36 ALA C C 13 180.1 0.1 . 1 . . . . 36 ALA C . 6626 1 411 . 1 1 36 36 ALA CA C 13 54.8 0.1 . 1 . . . . 36 ALA CA . 6626 1 412 . 1 1 36 36 ALA CB C 13 19.1 0.1 . 1 . . . . 36 ALA CB . 6626 1 413 . 1 1 36 36 ALA N N 15 128.5 0.1 . 1 . . . . 36 ALA N . 6626 1 414 . 1 1 37 37 ASP H H 1 8.43 0.01 . 1 . . . . 37 ASP HN . 6626 1 415 . 1 1 37 37 ASP HA H 1 4.50 0.01 . 1 . . . . 37 ASP HA . 6626 1 416 . 1 1 37 37 ASP HB2 H 1 3.00 0.01 . 2 . . . . 37 ASP HB2 . 6626 1 417 . 1 1 37 37 ASP HB3 H 1 2.73 0.01 . 2 . . . . 37 ASP HB3 . 6626 1 418 . 1 1 37 37 ASP C C 13 179.0 0.1 . 1 . . . . 37 ASP C . 6626 1 419 . 1 1 37 37 ASP CA C 13 58.0 0.1 . 1 . . . . 37 ASP CA . 6626 1 420 . 1 1 37 37 ASP CB C 13 40.0 0.1 . 1 . . . . 37 ASP CB . 6626 1 421 . 1 1 37 37 ASP N N 15 120.2 0.1 . 1 . . . . 37 ASP N . 6626 1 422 . 1 1 38 38 ASN H H 1 8.62 0.01 . 1 . . . . 38 ASN HN . 6626 1 423 . 1 1 38 38 ASN HA H 1 4.40 0.01 . 1 . . . . 38 ASN HA . 6626 1 424 . 1 1 38 38 ASN HB2 H 1 2.91 0.01 . 2 . . . . 38 ASN HB2 . 6626 1 425 . 1 1 38 38 ASN HB3 H 1 2.65 0.01 . 2 . . . . 38 ASN HB3 . 6626 1 426 . 1 1 38 38 ASN HD21 H 1 8.05 0.01 . 2 . . . . 38 ASN HD21 . 6626 1 427 . 1 1 38 38 ASN HD22 H 1 7.57 0.01 . 2 . . . . 38 ASN HD22 . 6626 1 428 . 1 1 38 38 ASN C C 13 177.4 0.1 . 1 . . . . 38 ASN C . 6626 1 429 . 1 1 38 38 ASN CA C 13 57.4 0.1 . 1 . . . . 38 ASN CA . 6626 1 430 . 1 1 38 38 ASN CB C 13 39.4 0.1 . 1 . . . . 38 ASN CB . 6626 1 431 . 1 1 38 38 ASN N N 15 118.9 0.1 . 1 . . . . 38 ASN N . 6626 1 432 . 1 1 38 38 ASN ND2 N 15 110.4 0.1 . 1 . . . . 38 ASN ND2 . 6626 1 433 . 1 1 39 39 LEU H H 1 7.52 0.01 . 1 . . . . 39 LEU HN . 6626 1 434 . 1 1 39 39 LEU HA H 1 4.13 0.01 . 1 . . . . 39 LEU HA . 6626 1 435 . 1 1 39 39 LEU HB2 H 1 1.90 0.01 . 2 . . . . 39 LEU HB2 . 6626 1 436 . 1 1 39 39 LEU HB3 H 1 1.74 0.01 . 2 . . . . 39 LEU HB3 . 6626 1 437 . 1 1 39 39 LEU HG H 1 1.92 0.01 . 1 . . . . 39 LEU HG . 6626 1 438 . 1 1 39 39 LEU HD11 H 1 1.01 0.01 . 2 . . . . 39 LEU HD1 . 6626 1 439 . 1 1 39 39 LEU HD12 H 1 1.01 0.01 . 2 . . . . 39 LEU HD1 . 6626 1 440 . 1 1 39 39 LEU HD13 H 1 1.01 0.01 . 2 . . . . 39 LEU HD1 . 6626 1 441 . 1 1 39 39 LEU HD21 H 1 1.01 0.01 . 2 . . . . 39 LEU HD2 . 6626 1 442 . 1 1 39 39 LEU HD22 H 1 1.01 0.01 . 2 . . . . 39 LEU HD2 . 6626 1 443 . 1 1 39 39 LEU HD23 H 1 1.01 0.01 . 2 . . . . 39 LEU HD2 . 6626 1 444 . 1 1 39 39 LEU C C 13 178.2 0.1 . 1 . . . . 39 LEU C . 6626 1 445 . 1 1 39 39 LEU CA C 13 59.6 0.1 . 1 . . . . 39 LEU CA . 6626 1 446 . 1 1 39 39 LEU CB C 13 43.5 0.1 . 1 . . . . 39 LEU CB . 6626 1 447 . 1 1 39 39 LEU CD1 C 13 26.3 0.1 . 1 . . . . 39 LEU CD1 . 6626 1 448 . 1 1 39 39 LEU CD2 C 13 24.7 0.1 . 1 . . . . 39 LEU CD2 . 6626 1 449 . 1 1 39 39 LEU N N 15 116.3 0.1 . 1 . . . . 39 LEU N . 6626 1 450 . 1 1 40 40 THR H H 1 7.83 0.01 . 1 . . . . 40 THR HN . 6626 1 451 . 1 1 40 40 THR HA H 1 4.04 0.01 . 1 . . . . 40 THR HA . 6626 1 452 . 1 1 40 40 THR HB H 1 4.43 0.01 . 1 . . . . 40 THR HB . 6626 1 453 . 1 1 40 40 THR HG21 H 1 1.28 0.01 . 1 . . . . 40 THR HG2 . 6626 1 454 . 1 1 40 40 THR HG22 H 1 1.28 0.01 . 1 . . . . 40 THR HG2 . 6626 1 455 . 1 1 40 40 THR HG23 H 1 1.28 0.01 . 1 . . . . 40 THR HG2 . 6626 1 456 . 1 1 40 40 THR C C 13 177.0 0.1 . 1 . . . . 40 THR C . 6626 1 457 . 1 1 40 40 THR CA C 13 67.9 0.1 . 1 . . . . 40 THR CA . 6626 1 458 . 1 1 40 40 THR CB C 13 68.0 0.1 . 1 . . . . 40 THR CB . 6626 1 459 . 1 1 40 40 THR CG2 C 13 21.5 0.1 . 1 . . . . 40 THR CG2 . 6626 1 460 . 1 1 40 40 THR N N 15 113.0 0.1 . 1 . . . . 40 THR N . 6626 1 461 . 1 1 41 41 ARG H H 1 8.37 0.01 . 1 . . . . 41 ARG HN . 6626 1 462 . 1 1 41 41 ARG HA H 1 4.19 0.01 . 1 . . . . 41 ARG HA . 6626 1 463 . 1 1 41 41 ARG HB2 H 1 2.01 0.01 . 1 . . . . 41 ARG HB2 . 6626 1 464 . 1 1 41 41 ARG HB3 H 1 2.01 0.01 . 1 . . . . 41 ARG HB3 . 6626 1 465 . 1 1 41 41 ARG HG2 H 1 1.76 0.01 . 2 . . . . 41 ARG HG2 . 6626 1 466 . 1 1 41 41 ARG HG3 H 1 1.49 0.01 . 2 . . . . 41 ARG HG3 . 6626 1 467 . 1 1 41 41 ARG HD2 H 1 3.24 0.01 . 1 . . . . 41 ARG HD2 . 6626 1 468 . 1 1 41 41 ARG HD3 H 1 3.24 0.01 . 1 . . . . 41 ARG HD3 . 6626 1 469 . 1 1 41 41 ARG C C 13 178.5 0.1 . 1 . . . . 41 ARG C . 6626 1 470 . 1 1 41 41 ARG CA C 13 59.6 0.1 . 1 . . . . 41 ARG CA . 6626 1 471 . 1 1 41 41 ARG CB C 13 30.2 0.1 . 1 . . . . 41 ARG CB . 6626 1 472 . 1 1 41 41 ARG CG C 13 27.8 0.1 . 1 . . . . 41 ARG CG . 6626 1 473 . 1 1 41 41 ARG CD C 13 43.8 0.1 . 1 . . . . 41 ARG CD . 6626 1 474 . 1 1 41 41 ARG N N 15 122.6 0.1 . 1 . . . . 41 ARG N . 6626 1 475 . 1 1 42 42 TRP H H 1 8.75 0.01 . 1 . . . . 42 TRP HN . 6626 1 476 . 1 1 42 42 TRP HA H 1 4.34 0.01 . 1 . . . . 42 TRP HA . 6626 1 477 . 1 1 42 42 TRP HB2 H 1 3.44 0.01 . 2 . . . . 42 TRP HB2 . 6626 1 478 . 1 1 42 42 TRP HB3 H 1 3.26 0.01 . 2 . . . . 42 TRP HB3 . 6626 1 479 . 1 1 42 42 TRP HD1 H 1 6.97 0.01 . 1 . . . . 42 TRP HD1 . 6626 1 480 . 1 1 42 42 TRP HE1 H 1 10.49 0.01 . 1 . . . . 42 TRP HE1 . 6626 1 481 . 1 1 42 42 TRP HZ2 H 1 7.39 0.01 . 1 . . . . 42 TRP HZ2 . 6626 1 482 . 1 1 42 42 TRP HZ3 H 1 6.16 0.01 . 1 . . . . 42 TRP HZ3 . 6626 1 483 . 1 1 42 42 TRP HH2 H 1 6.92 0.01 . 1 . . . . 42 TRP HH2 . 6626 1 484 . 1 1 42 42 TRP C C 13 178.7 0.1 . 1 . . . . 42 TRP C . 6626 1 485 . 1 1 42 42 TRP CA C 13 57.3 0.1 . 1 . . . . 42 TRP CA . 6626 1 486 . 1 1 42 42 TRP CB C 13 30.5 0.1 . 1 . . . . 42 TRP CB . 6626 1 487 . 1 1 42 42 TRP CD1 C 13 122.8 0.1 . 1 . . . . 42 TRP CD1 . 6626 1 488 . 1 1 42 42 TRP CZ2 C 13 114.9 0.1 . 1 . . . . 42 TRP CZ2 . 6626 1 489 . 1 1 42 42 TRP CZ3 C 13 121.4 0.1 . 1 . . . . 42 TRP CZ3 . 6626 1 490 . 1 1 42 42 TRP CH2 C 13 123.5 0.1 . 1 . . . . 42 TRP CH2 . 6626 1 491 . 1 1 42 42 TRP N N 15 119.7 0.1 . 1 . . . . 42 TRP N . 6626 1 492 . 1 1 42 42 TRP NE1 N 15 125.5 0.1 . 1 . . . . 42 TRP NE1 . 6626 1 493 . 1 1 43 43 GLY H H 1 8.41 0.01 . 1 . . . . 43 GLY HN . 6626 1 494 . 1 1 43 43 GLY HA2 H 1 3.04 0.01 . 2 . . . . 43 GLY HA1 . 6626 1 495 . 1 1 43 43 GLY HA3 H 1 2.66 0.01 . 2 . . . . 43 GLY HA2 . 6626 1 496 . 1 1 43 43 GLY C C 13 175.7 0.1 . 1 . . . . 43 GLY C . 6626 1 497 . 1 1 43 43 GLY CA C 13 48.2 0.1 . 1 . . . . 43 GLY CA . 6626 1 498 . 1 1 43 43 GLY N N 15 101.4 0.1 . 1 . . . . 43 GLY N . 6626 1 499 . 1 1 44 44 GLY H H 1 8.57 0.01 . 1 . . . . 44 GLY HN . 6626 1 500 . 1 1 44 44 GLY HA2 H 1 4.21 0.01 . 2 . . . . 44 GLY HA1 . 6626 1 501 . 1 1 44 44 GLY HA3 H 1 3.88 0.01 . 2 . . . . 44 GLY HA2 . 6626 1 502 . 1 1 44 44 GLY C C 13 175.6 0.1 . 1 . . . . 44 GLY C . 6626 1 503 . 1 1 44 44 GLY CA C 13 47.8 0.1 . 1 . . . . 44 GLY CA . 6626 1 504 . 1 1 44 44 GLY N N 15 105.8 0.1 . 1 . . . . 44 GLY N . 6626 1 505 . 1 1 45 45 VAL H H 1 8.41 0.01 . 1 . . . . 45 VAL HN . 6626 1 506 . 1 1 45 45 VAL HA H 1 4.05 0.01 . 1 . . . . 45 VAL HA . 6626 1 507 . 1 1 45 45 VAL HB H 1 2.23 0.01 . 1 . . . . 45 VAL HB . 6626 1 508 . 1 1 45 45 VAL HG11 H 1 1.23 0.01 . 2 . . . . 45 VAL HG1 . 6626 1 509 . 1 1 45 45 VAL HG12 H 1 1.23 0.01 . 2 . . . . 45 VAL HG1 . 6626 1 510 . 1 1 45 45 VAL HG13 H 1 1.23 0.01 . 2 . . . . 45 VAL HG1 . 6626 1 511 . 1 1 45 45 VAL HG21 H 1 1.25 0.01 . 2 . . . . 45 VAL HG2 . 6626 1 512 . 1 1 45 45 VAL HG22 H 1 1.25 0.01 . 2 . . . . 45 VAL HG2 . 6626 1 513 . 1 1 45 45 VAL HG23 H 1 1.25 0.01 . 2 . . . . 45 VAL HG2 . 6626 1 514 . 1 1 45 45 VAL C C 13 177.3 0.1 . 1 . . . . 45 VAL C . 6626 1 515 . 1 1 45 45 VAL CA C 13 64.8 0.1 . 1 . . . . 45 VAL CA . 6626 1 516 . 1 1 45 45 VAL CB C 13 31.4 0.1 . 1 . . . . 45 VAL CB . 6626 1 517 . 1 1 45 45 VAL CG1 C 13 21.2 0.1 . 1 . . . . 45 VAL CG1 . 6626 1 518 . 1 1 45 45 VAL CG2 C 13 23.5 0.1 . 1 . . . . 45 VAL CG2 . 6626 1 519 . 1 1 45 45 VAL N N 15 119.0 0.1 . 1 . . . . 45 VAL N . 6626 1 520 . 1 1 46 46 LEU H H 1 7.83 0.01 . 1 . . . . 46 LEU HN . 6626 1 521 . 1 1 46 46 LEU HA H 1 4.03 0.01 . 1 . . . . 46 LEU HA . 6626 1 522 . 1 1 46 46 LEU HB2 H 1 1.93 0.01 . 2 . . . . 46 LEU HB2 . 6626 1 523 . 1 1 46 46 LEU HB3 H 1 1.18 0.01 . 2 . . . . 46 LEU HB3 . 6626 1 524 . 1 1 46 46 LEU HG H 1 1.78 0.01 . 1 . . . . 46 LEU HG . 6626 1 525 . 1 1 46 46 LEU HD11 H 1 0.28 0.01 . 2 . . . . 46 LEU HD1 . 6626 1 526 . 1 1 46 46 LEU HD12 H 1 0.28 0.01 . 2 . . . . 46 LEU HD1 . 6626 1 527 . 1 1 46 46 LEU HD13 H 1 0.28 0.01 . 2 . . . . 46 LEU HD1 . 6626 1 528 . 1 1 46 46 LEU HD21 H 1 0.84 0.01 . 2 . . . . 46 LEU HD2 . 6626 1 529 . 1 1 46 46 LEU HD22 H 1 0.84 0.01 . 2 . . . . 46 LEU HD2 . 6626 1 530 . 1 1 46 46 LEU HD23 H 1 0.84 0.01 . 2 . . . . 46 LEU HD2 . 6626 1 531 . 1 1 46 46 LEU C C 13 179.2 0.1 . 1 . . . . 46 LEU C . 6626 1 532 . 1 1 46 46 LEU CA C 13 58.4 0.1 . 1 . . . . 46 LEU CA . 6626 1 533 . 1 1 46 46 LEU CB C 13 41.8 0.1 . 1 . . . . 46 LEU CB . 6626 1 534 . 1 1 46 46 LEU CG C 13 27.2 0.1 . 1 . . . . 46 LEU CG . 6626 1 535 . 1 1 46 46 LEU CD1 C 13 25.0 0.1 . 1 . . . . 46 LEU CD1 . 6626 1 536 . 1 1 46 46 LEU CD2 C 13 22.3 0.1 . 1 . . . . 46 LEU CD2 . 6626 1 537 . 1 1 46 46 LEU N N 15 121.8 0.1 . 1 . . . . 46 LEU N . 6626 1 538 . 1 1 47 47 LEU H H 1 7.79 0.01 . 1 . . . . 47 LEU HN . 6626 1 539 . 1 1 47 47 LEU HA H 1 3.84 0.01 . 1 . . . . 47 LEU HA . 6626 1 540 . 1 1 47 47 LEU HB2 H 1 1.93 0.01 . 2 . . . . 47 LEU HB2 . 6626 1 541 . 1 1 47 47 LEU HB3 H 1 1.57 0.01 . 2 . . . . 47 LEU HB3 . 6626 1 542 . 1 1 47 47 LEU HG H 1 1.86 0.01 . 1 . . . . 47 LEU HG . 6626 1 543 . 1 1 47 47 LEU HD11 H 1 0.90 0.01 . 2 . . . . 47 LEU HD1 . 6626 1 544 . 1 1 47 47 LEU HD12 H 1 0.90 0.01 . 2 . . . . 47 LEU HD1 . 6626 1 545 . 1 1 47 47 LEU HD13 H 1 0.90 0.01 . 2 . . . . 47 LEU HD1 . 6626 1 546 . 1 1 47 47 LEU HD21 H 1 0.75 0.01 . 2 . . . . 47 LEU HD2 . 6626 1 547 . 1 1 47 47 LEU HD22 H 1 0.75 0.01 . 2 . . . . 47 LEU HD2 . 6626 1 548 . 1 1 47 47 LEU HD23 H 1 0.75 0.01 . 2 . . . . 47 LEU HD2 . 6626 1 549 . 1 1 47 47 LEU C C 13 181.4 0.1 . 1 . . . . 47 LEU C . 6626 1 550 . 1 1 47 47 LEU CA C 13 58.0 0.1 . 1 . . . . 47 LEU CA . 6626 1 551 . 1 1 47 47 LEU CB C 13 40.9 0.1 . 1 . . . . 47 LEU CB . 6626 1 552 . 1 1 47 47 LEU CG C 13 26.3 0.1 . 1 . . . . 47 LEU CG . 6626 1 553 . 1 1 47 47 LEU CD1 C 13 25.0 0.1 . 1 . . . . 47 LEU CD1 . 6626 1 554 . 1 1 47 47 LEU CD2 C 13 24.3 0.1 . 1 . . . . 47 LEU CD2 . 6626 1 555 . 1 1 47 47 LEU N N 15 114.6 0.1 . 1 . . . . 47 LEU N . 6626 1 556 . 1 1 48 48 GLU H H 1 7.72 0.01 . 1 . . . . 48 GLU HN . 6626 1 557 . 1 1 48 48 GLU HA H 1 3.93 0.01 . 1 . . . . 48 GLU HA . 6626 1 558 . 1 1 48 48 GLU HB2 H 1 1.44 0.01 . 2 . . . . 48 GLU HB2 . 6626 1 559 . 1 1 48 48 GLU HB3 H 1 1.34 0.01 . 2 . . . . 48 GLU HB3 . 6626 1 560 . 1 1 48 48 GLU HG2 H 1 1.97 0.01 . 2 . . . . 48 GLU HG2 . 6626 1 561 . 1 1 48 48 GLU HG3 H 1 1.90 0.01 . 2 . . . . 48 GLU HG3 . 6626 1 562 . 1 1 48 48 GLU C C 13 179.6 0.1 . 1 . . . . 48 GLU C . 6626 1 563 . 1 1 48 48 GLU CA C 13 59.4 0.1 . 1 . . . . 48 GLU CA . 6626 1 564 . 1 1 48 48 GLU CB C 13 28.8 0.1 . 1 . . . . 48 GLU CB . 6626 1 565 . 1 1 48 48 GLU CG C 13 35.2 0.1 . 1 . . . . 48 GLU CG . 6626 1 566 . 1 1 48 48 GLU N N 15 118.6 0.1 . 1 . . . . 48 GLU N . 6626 1 567 . 1 1 49 49 LEU H H 1 8.72 0.01 . 1 . . . . 49 LEU HN . 6626 1 568 . 1 1 49 49 LEU HA H 1 4.26 0.01 . 1 . . . . 49 LEU HA . 6626 1 569 . 1 1 49 49 LEU HB2 H 1 2.00 0.01 . 2 . . . . 49 LEU HB2 . 6626 1 570 . 1 1 49 49 LEU HB3 H 1 1.60 0.01 . 2 . . . . 49 LEU HB3 . 6626 1 571 . 1 1 49 49 LEU HG H 1 1.68 0.01 . 1 . . . . 49 LEU HG . 6626 1 572 . 1 1 49 49 LEU HD11 H 1 0.94 0.01 . 2 . . . . 49 LEU HD1 . 6626 1 573 . 1 1 49 49 LEU HD12 H 1 0.94 0.01 . 2 . . . . 49 LEU HD1 . 6626 1 574 . 1 1 49 49 LEU HD13 H 1 0.94 0.01 . 2 . . . . 49 LEU HD1 . 6626 1 575 . 1 1 49 49 LEU HD21 H 1 1.20 0.01 . 2 . . . . 49 LEU HD2 . 6626 1 576 . 1 1 49 49 LEU HD22 H 1 1.20 0.01 . 2 . . . . 49 LEU HD2 . 6626 1 577 . 1 1 49 49 LEU HD23 H 1 1.20 0.01 . 2 . . . . 49 LEU HD2 . 6626 1 578 . 1 1 49 49 LEU C C 13 180.1 0.1 . 1 . . . . 49 LEU C . 6626 1 579 . 1 1 49 49 LEU CA C 13 57.4 0.1 . 1 . . . . 49 LEU CA . 6626 1 580 . 1 1 49 49 LEU CB C 13 43.5 0.1 . 1 . . . . 49 LEU CB . 6626 1 581 . 1 1 49 49 LEU CG C 13 17.2 0.1 . 1 . . . . 49 LEU CG . 6626 1 582 . 1 1 49 49 LEU CD2 C 13 24.7 0.1 . 1 . . . . 49 LEU CD2 . 6626 1 583 . 1 1 49 49 LEU N N 15 116.0 0.1 . 1 . . . . 49 LEU N . 6626 1 584 . 1 1 50 50 SER H H 1 8.03 0.01 . 1 . . . . 50 SER HN . 6626 1 585 . 1 1 50 50 SER HA H 1 3.87 0.01 . 1 . . . . 50 SER HA . 6626 1 586 . 1 1 50 50 SER HB2 H 1 4.12 0.01 . 1 . . . . 50 SER HB2 . 6626 1 587 . 1 1 50 50 SER HB3 H 1 4.12 0.01 . 1 . . . . 50 SER HB3 . 6626 1 588 . 1 1 50 50 SER C C 13 175.1 0.1 . 1 . . . . 50 SER C . 6626 1 589 . 1 1 50 50 SER CA C 13 62.8 0.1 . 1 . . . . 50 SER CA . 6626 1 590 . 1 1 50 50 SER CB C 13 62.7 0.1 . 1 . . . . 50 SER CB . 6626 1 591 . 1 1 50 50 SER N N 15 113.9 0.1 . 1 . . . . 50 SER N . 6626 1 592 . 1 1 51 51 GLN H H 1 6.77 0.01 . 1 . . . . 51 GLN HN . 6626 1 593 . 1 1 51 51 GLN HA H 1 4.02 0.01 . 1 . . . . 51 GLN HA . 6626 1 594 . 1 1 51 51 GLN HB2 H 1 1.59 0.01 . 1 . . . . 51 GLN HB2 . 6626 1 595 . 1 1 51 51 GLN HB3 H 1 1.59 0.01 . 1 . . . . 51 GLN HB3 . 6626 1 596 . 1 1 51 51 GLN HG2 H 1 1.95 0.01 . 2 . . . . 51 GLN HG2 . 6626 1 597 . 1 1 51 51 GLN HG3 H 1 1.46 0.01 . 2 . . . . 51 GLN HG3 . 6626 1 598 . 1 1 51 51 GLN HE21 H 1 7.60 0.01 . 2 . . . . 51 GLN HE21 . 6626 1 599 . 1 1 51 51 GLN HE22 H 1 6.69 0.01 . 2 . . . . 51 GLN HE22 . 6626 1 600 . 1 1 51 51 GLN C C 13 176.1 0.1 . 1 . . . . 51 GLN C . 6626 1 601 . 1 1 51 51 GLN CA C 13 57.2 0.1 . 1 . . . . 51 GLN CA . 6626 1 602 . 1 1 51 51 GLN CB C 13 29.0 0.1 . 1 . . . . 51 GLN CB . 6626 1 603 . 1 1 51 51 GLN CG C 13 33.2 0.1 . 1 . . . . 51 GLN CG . 6626 1 604 . 1 1 51 51 GLN N N 15 115.5 0.1 . 1 . . . . 51 GLN N . 6626 1 605 . 1 1 51 51 GLN NE2 N 15 110.0 0.1 . 1 . . . . 51 GLN NE2 . 6626 1 606 . 1 1 52 52 PHE H H 1 7.67 0.01 . 1 . . . . 52 PHE HN . 6626 1 607 . 1 1 52 52 PHE HA H 1 4.60 0.01 . 1 . . . . 52 PHE HA . 6626 1 608 . 1 1 52 52 PHE HB2 H 1 3.38 0.01 . 2 . . . . 52 PHE HB2 . 6626 1 609 . 1 1 52 52 PHE HB3 H 1 2.60 0.01 . 2 . . . . 52 PHE HB3 . 6626 1 610 . 1 1 52 52 PHE HD1 H 1 7.38 0.01 . 1 . . . . 52 PHE HD1 . 6626 1 611 . 1 1 52 52 PHE HD2 H 1 7.38 0.01 . 1 . . . . 52 PHE HD2 . 6626 1 612 . 1 1 52 52 PHE C C 13 174.9 0.1 . 1 . . . . 52 PHE C . 6626 1 613 . 1 1 52 52 PHE CA C 13 57.4 0.1 . 1 . . . . 52 PHE CA . 6626 1 614 . 1 1 52 52 PHE CB C 13 39.1 0.1 . 1 . . . . 52 PHE CB . 6626 1 615 . 1 1 52 52 PHE CD1 C 13 132.3 0.1 . 1 . . . . 52 PHE CD1 . 6626 1 616 . 1 1 52 52 PHE N N 15 114.5 0.1 . 1 . . . . 52 PHE N . 6626 1 617 . 1 1 53 53 HIS H H 1 7.29 0.01 . 1 . . . . 53 HIS HN . 6626 1 618 . 1 1 53 53 HIS HA H 1 4.71 0.01 . 1 . . . . 53 HIS HA . 6626 1 619 . 1 1 53 53 HIS HB2 H 1 3.44 0.01 . 2 . . . . 53 HIS HB2 . 6626 1 620 . 1 1 53 53 HIS HB3 H 1 2.74 0.01 . 2 . . . . 53 HIS HB3 . 6626 1 621 . 1 1 53 53 HIS HD2 H 1 7.24 0.01 . 1 . . . . 53 HIS HD2 . 6626 1 622 . 1 1 53 53 HIS HE1 H 1 7.37 0.01 . 1 . . . . 53 HIS HE1 . 6626 1 623 . 1 1 53 53 HIS C C 13 174.6 0.1 . 1 . . . . 53 HIS C . 6626 1 624 . 1 1 53 53 HIS CA C 13 56.4 0.1 . 1 . . . . 53 HIS CA . 6626 1 625 . 1 1 53 53 HIS CB C 13 34.4 0.1 . 1 . . . . 53 HIS CB . 6626 1 626 . 1 1 53 53 HIS CD2 C 13 121.3 0.1 . 1 . . . . 53 HIS CD2 . 6626 1 627 . 1 1 53 53 HIS N N 15 116.1 0.1 . 1 . . . . 53 HIS N . 6626 1 628 . 1 1 54 54 SER H H 1 9.19 0.01 . 1 . . . . 54 SER HN . 6626 1 629 . 1 1 54 54 SER HA H 1 4.43 0.01 . 1 . . . . 54 SER HA . 6626 1 630 . 1 1 54 54 SER HB2 H 1 4.24 0.01 . 2 . . . . 54 SER HB2 . 6626 1 631 . 1 1 54 54 SER HB3 H 1 4.10 0.01 . 2 . . . . 54 SER HB3 . 6626 1 632 . 1 1 54 54 SER C C 13 174.1 0.1 . 1 . . . . 54 SER C . 6626 1 633 . 1 1 54 54 SER CA C 13 58.1 0.1 . 1 . . . . 54 SER CA . 6626 1 634 . 1 1 54 54 SER CB C 13 64.2 0.1 . 1 . . . . 54 SER CB . 6626 1 635 . 1 1 54 54 SER N N 15 114.1 0.1 . 1 . . . . 54 SER N . 6626 1 636 . 1 1 55 55 ILE H H 1 8.45 0.01 . 1 . . . . 55 ILE HN . 6626 1 637 . 1 1 55 55 ILE HA H 1 3.78 0.01 . 1 . . . . 55 ILE HA . 6626 1 638 . 1 1 55 55 ILE HB H 1 1.86 0.01 . 1 . . . . 55 ILE HB . 6626 1 639 . 1 1 55 55 ILE HG12 H 1 1.66 0.01 . 2 . . . . 55 ILE HG12 . 6626 1 640 . 1 1 55 55 ILE HG13 H 1 1.21 0.01 . 2 . . . . 55 ILE HG13 . 6626 1 641 . 1 1 55 55 ILE HG21 H 1 0.97 0.01 . 1 . . . . 55 ILE HG2 . 6626 1 642 . 1 1 55 55 ILE HG22 H 1 0.97 0.01 . 1 . . . . 55 ILE HG2 . 6626 1 643 . 1 1 55 55 ILE HG23 H 1 0.97 0.01 . 1 . . . . 55 ILE HG2 . 6626 1 644 . 1 1 55 55 ILE HD11 H 1 0.93 0.01 . 1 . . . . 55 ILE HD1 . 6626 1 645 . 1 1 55 55 ILE HD12 H 1 0.93 0.01 . 1 . . . . 55 ILE HD1 . 6626 1 646 . 1 1 55 55 ILE HD13 H 1 0.93 0.01 . 1 . . . . 55 ILE HD1 . 6626 1 647 . 1 1 55 55 ILE C C 13 177.4 0.1 . 1 . . . . 55 ILE C . 6626 1 648 . 1 1 55 55 ILE CA C 13 65.9 0.1 . 1 . . . . 55 ILE CA . 6626 1 649 . 1 1 55 55 ILE CB C 13 38.0 0.1 . 1 . . . . 55 ILE CB . 6626 1 650 . 1 1 55 55 ILE CG1 C 13 29.1 0.1 . 1 . . . . 55 ILE CG1 . 6626 1 651 . 1 1 55 55 ILE CG2 C 13 17.5 0.1 . 1 . . . . 55 ILE CG2 . 6626 1 652 . 1 1 55 55 ILE CD1 C 13 13.3 0.1 . 1 . . . . 55 ILE CD1 . 6626 1 653 . 1 1 55 55 ILE N N 15 118.1 0.1 . 1 . . . . 55 ILE N . 6626 1 654 . 1 1 56 56 SER H H 1 8.36 0.01 . 1 . . . . 56 SER HN . 6626 1 655 . 1 1 56 56 SER HA H 1 4.08 0.01 . 1 . . . . 56 SER HA . 6626 1 656 . 1 1 56 56 SER HB2 H 1 3.84 0.01 . 1 . . . . 56 SER HB2 . 6626 1 657 . 1 1 56 56 SER HB3 H 1 3.84 0.01 . 1 . . . . 56 SER HB3 . 6626 1 658 . 1 1 56 56 SER C C 13 177.6 0.1 . 1 . . . . 56 SER C . 6626 1 659 . 1 1 56 56 SER CA C 13 62.0 0.1 . 1 . . . . 56 SER CA . 6626 1 660 . 1 1 56 56 SER CB C 13 62.4 0.1 . 1 . . . . 56 SER CB . 6626 1 661 . 1 1 56 56 SER N N 15 110.8 0.1 . 1 . . . . 56 SER N . 6626 1 662 . 1 1 57 57 ASP H H 1 7.51 0.01 . 1 . . . . 57 ASP HN . 6626 1 663 . 1 1 57 57 ASP HA H 1 4.41 0.01 . 1 . . . . 57 ASP HA . 6626 1 664 . 1 1 57 57 ASP HB2 H 1 2.85 0.01 . 2 . . . . 57 ASP HB2 . 6626 1 665 . 1 1 57 57 ASP HB3 H 1 2.46 0.01 . 2 . . . . 57 ASP HB3 . 6626 1 666 . 1 1 57 57 ASP C C 13 178.3 0.1 . 1 . . . . 57 ASP C . 6626 1 667 . 1 1 57 57 ASP CA C 13 57.0 0.1 . 1 . . . . 57 ASP CA . 6626 1 668 . 1 1 57 57 ASP CB C 13 40.6 0.1 . 1 . . . . 57 ASP CB . 6626 1 669 . 1 1 57 57 ASP N N 15 120.2 0.1 . 1 . . . . 57 ASP N . 6626 1 670 . 1 1 58 58 ALA H H 1 9.52 0.01 . 1 . . . . 58 ALA HN . 6626 1 671 . 1 1 58 58 ALA HA H 1 3.84 0.01 . 1 . . . . 58 ALA HA . 6626 1 672 . 1 1 58 58 ALA HB1 H 1 1.47 0.01 . 1 . . . . 58 ALA HB . 6626 1 673 . 1 1 58 58 ALA HB2 H 1 1.47 0.01 . 1 . . . . 58 ALA HB . 6626 1 674 . 1 1 58 58 ALA HB3 H 1 1.47 0.01 . 1 . . . . 58 ALA HB . 6626 1 675 . 1 1 58 58 ALA C C 13 179.7 0.1 . 1 . . . . 58 ALA C . 6626 1 676 . 1 1 58 58 ALA CA C 13 55.7 0.1 . 1 . . . . 58 ALA CA . 6626 1 677 . 1 1 58 58 ALA CB C 13 19.6 0.1 . 1 . . . . 58 ALA CB . 6626 1 678 . 1 1 58 58 ALA N N 15 122.2 0.1 . 1 . . . . 58 ALA N . 6626 1 679 . 1 1 59 59 LYS H H 1 8.23 0.01 . 1 . . . . 59 LYS HN . 6626 1 680 . 1 1 59 59 LYS HA H 1 3.69 0.01 . 1 . . . . 59 LYS HA . 6626 1 681 . 1 1 59 59 LYS HB2 H 1 1.84 0.01 . 1 . . . . 59 LYS HB2 . 6626 1 682 . 1 1 59 59 LYS HB3 H 1 1.84 0.01 . 1 . . . . 59 LYS HB3 . 6626 1 683 . 1 1 59 59 LYS HG2 H 1 1.73 0.01 . 2 . . . . 59 LYS HG2 . 6626 1 684 . 1 1 59 59 LYS HG3 H 1 0.68 0.01 . 2 . . . . 59 LYS HG3 . 6626 1 685 . 1 1 59 59 LYS HD2 H 1 1.45 0.01 . 2 . . . . 59 LYS HD2 . 6626 1 686 . 1 1 59 59 LYS HD3 H 1 1.35 0.01 . 2 . . . . 59 LYS HD3 . 6626 1 687 . 1 1 59 59 LYS HE2 H 1 2.38 0.01 . 1 . . . . 59 LYS HE2 . 6626 1 688 . 1 1 59 59 LYS HE3 H 1 2.38 0.01 . 1 . . . . 59 LYS HE3 . 6626 1 689 . 1 1 59 59 LYS C C 13 178.7 0.1 . 1 . . . . 59 LYS C . 6626 1 690 . 1 1 59 59 LYS CA C 13 61.3 0.1 . 1 . . . . 59 LYS CA . 6626 1 691 . 1 1 59 59 LYS CB C 13 32.5 0.1 . 1 . . . . 59 LYS CB . 6626 1 692 . 1 1 59 59 LYS CG C 13 27.4 0.1 . 1 . . . . 59 LYS CG . 6626 1 693 . 1 1 59 59 LYS CD C 13 29.3 0.1 . 1 . . . . 59 LYS CD . 6626 1 694 . 1 1 59 59 LYS CE C 13 41.7 0.1 . 1 . . . . 59 LYS CE . 6626 1 695 . 1 1 59 59 LYS N N 15 113.4 0.1 . 1 . . . . 59 LYS N . 6626 1 696 . 1 1 60 60 GLN H H 1 7.19 0.01 . 1 . . . . 60 GLN HN . 6626 1 697 . 1 1 60 60 GLN HA H 1 4.07 0.01 . 1 . . . . 60 GLN HA . 6626 1 698 . 1 1 60 60 GLN HB2 H 1 2.16 0.01 . 1 . . . . 60 GLN HB2 . 6626 1 699 . 1 1 60 60 GLN HB3 H 1 2.16 0.01 . 1 . . . . 60 GLN HB3 . 6626 1 700 . 1 1 60 60 GLN HG2 H 1 2.46 0.01 . 2 . . . . 60 GLN HG2 . 6626 1 701 . 1 1 60 60 GLN HG3 H 1 2.34 0.01 . 2 . . . . 60 GLN HG3 . 6626 1 702 . 1 1 60 60 GLN HE21 H 1 7.46 0.01 . 2 . . . . 60 GLN HE21 . 6626 1 703 . 1 1 60 60 GLN HE22 H 1 6.68 0.01 . 2 . . . . 60 GLN HE22 . 6626 1 704 . 1 1 60 60 GLN C C 13 178.6 0.1 . 1 . . . . 60 GLN C . 6626 1 705 . 1 1 60 60 GLN CA C 13 59.0 0.1 . 1 . . . . 60 GLN CA . 6626 1 706 . 1 1 60 60 GLN CB C 13 28.3 0.1 . 1 . . . . 60 GLN CB . 6626 1 707 . 1 1 60 60 GLN CG C 13 34.0 0.1 . 1 . . . . 60 GLN CG . 6626 1 708 . 1 1 60 60 GLN N N 15 114.9 0.1 . 1 . . . . 60 GLN N . 6626 1 709 . 1 1 60 60 GLN NE2 N 15 110.4 0.1 . 1 . . . . 60 GLN NE2 . 6626 1 710 . 1 1 61 61 MET H H 1 8.04 0.01 . 1 . . . . 61 MET HN . 6626 1 711 . 1 1 61 61 MET HA H 1 3.95 0.01 . 1 . . . . 61 MET HA . 6626 1 712 . 1 1 61 61 MET HB2 H 1 2.54 0.01 . 2 . . . . 61 MET HB2 . 6626 1 713 . 1 1 61 61 MET HB3 H 1 2.27 0.01 . 2 . . . . 61 MET HB3 . 6626 1 714 . 1 1 61 61 MET HG2 H 1 1.91 0.01 . 1 . . . . 61 MET HG2 . 6626 1 715 . 1 1 61 61 MET HG3 H 1 1.91 0.01 . 1 . . . . 61 MET HG3 . 6626 1 716 . 1 1 61 61 MET HE1 H 1 1.68 0.01 . 1 . . . . 61 MET HE . 6626 1 717 . 1 1 61 61 MET HE2 H 1 1.68 0.01 . 1 . . . . 61 MET HE . 6626 1 718 . 1 1 61 61 MET HE3 H 1 1.68 0.01 . 1 . . . . 61 MET HE . 6626 1 719 . 1 1 61 61 MET C C 13 178.0 0.1 . 1 . . . . 61 MET C . 6626 1 720 . 1 1 61 61 MET CA C 13 59.5 0.1 . 1 . . . . 61 MET CA . 6626 1 721 . 1 1 61 61 MET CB C 13 33.4 0.1 . 1 . . . . 61 MET CB . 6626 1 722 . 1 1 61 61 MET CE C 13 17.2 0.1 . 1 . . . . 61 MET CE . 6626 1 723 . 1 1 61 61 MET N N 15 118.7 0.1 . 1 . . . . 61 MET N . 6626 1 724 . 1 1 62 62 ILE H H 1 8.50 0.01 . 1 . . . . 62 ILE HN . 6626 1 725 . 1 1 62 62 ILE HA H 1 3.34 0.01 . 1 . . . . 62 ILE HA . 6626 1 726 . 1 1 62 62 ILE HB H 1 1.71 0.01 . 1 . . . . 62 ILE HB . 6626 1 727 . 1 1 62 62 ILE HG12 H 1 1.86 0.01 . 2 . . . . 62 ILE HG12 . 6626 1 728 . 1 1 62 62 ILE HG13 H 1 0.75 0.01 . 2 . . . . 62 ILE HG13 . 6626 1 729 . 1 1 62 62 ILE HG21 H 1 0.60 0.01 . 1 . . . . 62 ILE HG2 . 6626 1 730 . 1 1 62 62 ILE HG22 H 1 0.60 0.01 . 1 . . . . 62 ILE HG2 . 6626 1 731 . 1 1 62 62 ILE HG23 H 1 0.60 0.01 . 1 . . . . 62 ILE HG2 . 6626 1 732 . 1 1 62 62 ILE HD11 H 1 0.64 0.01 . 1 . . . . 62 ILE HD1 . 6626 1 733 . 1 1 62 62 ILE HD12 H 1 0.64 0.01 . 1 . . . . 62 ILE HD1 . 6626 1 734 . 1 1 62 62 ILE HD13 H 1 0.64 0.01 . 1 . . . . 62 ILE HD1 . 6626 1 735 . 1 1 62 62 ILE C C 13 177.6 0.1 . 1 . . . . 62 ILE C . 6626 1 736 . 1 1 62 62 ILE CA C 13 65.7 0.1 . 1 . . . . 62 ILE CA . 6626 1 737 . 1 1 62 62 ILE CB C 13 37.9 0.1 . 1 . . . . 62 ILE CB . 6626 1 738 . 1 1 62 62 ILE CG1 C 13 29.7 0.1 . 1 . . . . 62 ILE CG1 . 6626 1 739 . 1 1 62 62 ILE CG2 C 13 19.0 0.1 . 1 . . . . 62 ILE CG2 . 6626 1 740 . 1 1 62 62 ILE CD1 C 13 14.5 0.1 . 1 . . . . 62 ILE CD1 . 6626 1 741 . 1 1 62 62 ILE N N 15 118.1 0.1 . 1 . . . . 62 ILE N . 6626 1 742 . 1 1 63 63 GLN H H 1 7.82 0.01 . 1 . . . . 63 GLN HN . 6626 1 743 . 1 1 63 63 GLN HA H 1 3.69 0.01 . 1 . . . . 63 GLN HA . 6626 1 744 . 1 1 63 63 GLN HB2 H 1 2.16 0.01 . 2 . . . . 63 GLN HB2 . 6626 1 745 . 1 1 63 63 GLN HB3 H 1 1.98 0.01 . 2 . . . . 63 GLN HB3 . 6626 1 746 . 1 1 63 63 GLN HG2 H 1 2.44 0.01 . 2 . . . . 63 GLN HG2 . 6626 1 747 . 1 1 63 63 GLN HG3 H 1 2.15 0.01 . 2 . . . . 63 GLN HG3 . 6626 1 748 . 1 1 63 63 GLN HE21 H 1 6.67 0.01 . 2 . . . . 63 GLN HE21 . 6626 1 749 . 1 1 63 63 GLN HE22 H 1 6.62 0.01 . 2 . . . . 63 GLN HE22 . 6626 1 750 . 1 1 63 63 GLN CA C 13 59.3 0.1 . 1 . . . . 63 GLN CA . 6626 1 751 . 1 1 63 63 GLN CB C 13 28.0 0.1 . 1 . . . . 63 GLN CB . 6626 1 752 . 1 1 63 63 GLN CG C 13 34.4 0.1 . 1 . . . . 63 GLN CG . 6626 1 753 . 1 1 63 63 GLN N N 15 115.7 0.1 . 1 . . . . 63 GLN N . 6626 1 754 . 1 1 63 63 GLN NE2 N 15 108.7 0.1 . 1 . . . . 63 GLN NE2 . 6626 1 755 . 1 1 64 64 GLU H H 1 8.08 0.01 . 1 . . . . 64 GLU HN . 6626 1 756 . 1 1 64 64 GLU HA H 1 3.73 0.01 . 1 . . . . 64 GLU HA . 6626 1 757 . 1 1 64 64 GLU HB2 H 1 1.93 0.01 . 2 . . . . 64 GLU HB2 . 6626 1 758 . 1 1 64 64 GLU HB3 H 1 1.85 0.01 . 2 . . . . 64 GLU HB3 . 6626 1 759 . 1 1 64 64 GLU HG2 H 1 1.98 0.01 . 2 . . . . 64 GLU HG2 . 6626 1 760 . 1 1 64 64 GLU HG3 H 1 1.70 0.01 . 2 . . . . 64 GLU HG3 . 6626 1 761 . 1 1 64 64 GLU C C 13 179.5 0.1 . 1 . . . . 64 GLU C . 6626 1 762 . 1 1 64 64 GLU CA C 13 59.2 0.1 . 1 . . . . 64 GLU CA . 6626 1 763 . 1 1 64 64 GLU CB C 13 29.0 0.1 . 1 . . . . 64 GLU CB . 6626 1 764 . 1 1 64 64 GLU CG C 13 36.2 0.1 . 1 . . . . 64 GLU CG . 6626 1 765 . 1 1 64 64 GLU N N 15 118.6 0.1 . 1 . . . . 64 GLU N . 6626 1 766 . 1 1 65 65 ALA H H 1 8.44 0.01 . 1 . . . . 65 ALA HN . 6626 1 767 . 1 1 65 65 ALA HA H 1 3.22 0.01 . 1 . . . . 65 ALA HA . 6626 1 768 . 1 1 65 65 ALA HB1 H 1 1.37 0.01 . 1 . . . . 65 ALA HB . 6626 1 769 . 1 1 65 65 ALA HB2 H 1 1.37 0.01 . 1 . . . . 65 ALA HB . 6626 1 770 . 1 1 65 65 ALA HB3 H 1 1.37 0.01 . 1 . . . . 65 ALA HB . 6626 1 771 . 1 1 65 65 ALA C C 13 178.2 0.1 . 1 . . . . 65 ALA C . 6626 1 772 . 1 1 65 65 ALA CA C 13 55.8 0.1 . 1 . . . . 65 ALA CA . 6626 1 773 . 1 1 65 65 ALA CB C 13 18.0 0.1 . 1 . . . . 65 ALA CB . 6626 1 774 . 1 1 65 65 ALA N N 15 122.2 0.1 . 1 . . . . 65 ALA N . 6626 1 775 . 1 1 66 66 ILE H H 1 7.86 0.01 . 1 . . . . 66 ILE HN . 6626 1 776 . 1 1 66 66 ILE HA H 1 3.36 0.01 . 1 . . . . 66 ILE HA . 6626 1 777 . 1 1 66 66 ILE HB H 1 1.70 0.01 . 1 . . . . 66 ILE HB . 6626 1 778 . 1 1 66 66 ILE HG12 H 1 1.53 0.01 . 2 . . . . 66 ILE HG12 . 6626 1 779 . 1 1 66 66 ILE HG13 H 1 0.22 0.01 . 2 . . . . 66 ILE HG13 . 6626 1 780 . 1 1 66 66 ILE HG21 H 1 0.60 0.01 . 1 . . . . 66 ILE HG2 . 6626 1 781 . 1 1 66 66 ILE HG22 H 1 0.60 0.01 . 1 . . . . 66 ILE HG2 . 6626 1 782 . 1 1 66 66 ILE HG23 H 1 0.60 0.01 . 1 . . . . 66 ILE HG2 . 6626 1 783 . 1 1 66 66 ILE HD11 H 1 -0.11 0.01 . 1 . . . . 66 ILE HD1 . 6626 1 784 . 1 1 66 66 ILE HD12 H 1 -0.11 0.01 . 1 . . . . 66 ILE HD1 . 6626 1 785 . 1 1 66 66 ILE HD13 H 1 -0.11 0.01 . 1 . . . . 66 ILE HD1 . 6626 1 786 . 1 1 66 66 ILE C C 13 177.4 0.1 . 1 . . . . 66 ILE C . 6626 1 787 . 1 1 66 66 ILE CA C 13 67.2 0.1 . 1 . . . . 66 ILE CA . 6626 1 788 . 1 1 66 66 ILE CB C 13 37.9 0.1 . 1 . . . . 66 ILE CB . 6626 1 789 . 1 1 66 66 ILE CG1 C 13 31.6 0.1 . 1 . . . . 66 ILE CG1 . 6626 1 790 . 1 1 66 66 ILE CG2 C 13 16.8 0.1 . 1 . . . . 66 ILE CG2 . 6626 1 791 . 1 1 66 66 ILE CD1 C 13 12.3 0.1 . 1 . . . . 66 ILE CD1 . 6626 1 792 . 1 1 66 66 ILE N N 15 114.0 0.1 . 1 . . . . 66 ILE N . 6626 1 793 . 1 1 67 67 THR H H 1 7.36 0.01 . 1 . . . . 67 THR HN . 6626 1 794 . 1 1 67 67 THR HA H 1 4.14 0.01 . 1 . . . . 67 THR HA . 6626 1 795 . 1 1 67 67 THR HB H 1 4.08 0.01 . 1 . . . . 67 THR HB . 6626 1 796 . 1 1 67 67 THR HG21 H 1 1.21 0.01 . 1 . . . . 67 THR HG2 . 6626 1 797 . 1 1 67 67 THR HG22 H 1 1.21 0.01 . 1 . . . . 67 THR HG2 . 6626 1 798 . 1 1 67 67 THR HG23 H 1 1.21 0.01 . 1 . . . . 67 THR HG2 . 6626 1 799 . 1 1 67 67 THR C C 13 177.4 0.1 . 1 . . . . 67 THR C . 6626 1 800 . 1 1 67 67 THR CA C 13 65.6 0.1 . 1 . . . . 67 THR CA . 6626 1 801 . 1 1 67 67 THR CB C 13 68.6 0.1 . 1 . . . . 67 THR CB . 6626 1 802 . 1 1 67 67 THR CG2 C 13 22.2 0.1 . 1 . . . . 67 THR CG2 . 6626 1 803 . 1 1 67 67 THR N N 15 107.7 0.1 . 1 . . . . 67 THR N . 6626 1 804 . 1 1 68 68 LYS H H 1 7.25 0.01 . 1 . . . . 68 LYS HN . 6626 1 805 . 1 1 68 68 LYS HA H 1 3.80 0.01 . 1 . . . . 68 LYS HA . 6626 1 806 . 1 1 68 68 LYS HB2 H 1 1.64 0.01 . 1 . . . . 68 LYS HB2 . 6626 1 807 . 1 1 68 68 LYS HB3 H 1 1.64 0.01 . 1 . . . . 68 LYS HB3 . 6626 1 808 . 1 1 68 68 LYS HG2 H 1 0.86 0.01 . 2 . . . . 68 LYS HG2 . 6626 1 809 . 1 1 68 68 LYS HG3 H 1 0.00 0.01 . 2 . . . . 68 LYS HG3 . 6626 1 810 . 1 1 68 68 LYS HD2 H 1 0.10 0.01 . 2 . . . . 68 LYS HD2 . 6626 1 811 . 1 1 68 68 LYS HD3 H 1 0.62 0.01 . 2 . . . . 68 LYS HD3 . 6626 1 812 . 1 1 68 68 LYS HE2 H 1 0.11 0.01 . 2 . . . . 68 LYS HE2 . 6626 1 813 . 1 1 68 68 LYS HE3 H 1 1.30 0.01 . 2 . . . . 68 LYS HE3 . 6626 1 814 . 1 1 68 68 LYS C C 13 178.7 0.1 . 1 . . . . 68 LYS C . 6626 1 815 . 1 1 68 68 LYS CA C 13 57.4 0.1 . 1 . . . . 68 LYS CA . 6626 1 816 . 1 1 68 68 LYS CB C 13 29.1 0.1 . 1 . . . . 68 LYS CB . 6626 1 817 . 1 1 68 68 LYS CG C 13 23.4 0.1 . 1 . . . . 68 LYS CG . 6626 1 818 . 1 1 68 68 LYS CD C 13 26.1 0.1 . 1 . . . . 68 LYS CD . 6626 1 819 . 1 1 68 68 LYS CE C 13 41.0 0.1 . 1 . . . . 68 LYS CE . 6626 1 820 . 1 1 68 68 LYS N N 15 119.1 0.1 . 1 . . . . 68 LYS N . 6626 1 821 . 1 1 69 69 PHE H H 1 7.53 0.01 . 1 . . . . 69 PHE HN . 6626 1 822 . 1 1 69 69 PHE HA H 1 4.34 0.01 . 1 . . . . 69 PHE HA . 6626 1 823 . 1 1 69 69 PHE HB2 H 1 3.19 0.01 . 2 . . . . 69 PHE HB2 . 6626 1 824 . 1 1 69 69 PHE HB3 H 1 2.85 0.01 . 2 . . . . 69 PHE HB3 . 6626 1 825 . 1 1 69 69 PHE HD1 H 1 6.93 0.01 . 1 . . . . 69 PHE HD1 . 6626 1 826 . 1 1 69 69 PHE HD2 H 1 6.93 0.01 . 1 . . . . 69 PHE HD2 . 6626 1 827 . 1 1 69 69 PHE HE1 H 1 6.74 0.01 . 1 . . . . 69 PHE HE1 . 6626 1 828 . 1 1 69 69 PHE HE2 H 1 6.74 0.01 . 1 . . . . 69 PHE HE2 . 6626 1 829 . 1 1 69 69 PHE HZ H 1 7.34 0.01 . 1 . . . . 69 PHE HZ . 6626 1 830 . 1 1 69 69 PHE C C 13 178.3 0.1 . 1 . . . . 69 PHE C . 6626 1 831 . 1 1 69 69 PHE CA C 13 59.5 0.1 . 1 . . . . 69 PHE CA . 6626 1 832 . 1 1 69 69 PHE CB C 13 39.2 0.1 . 1 . . . . 69 PHE CB . 6626 1 833 . 1 1 69 69 PHE CD1 C 13 129.6 0.1 . 1 . . . . 69 PHE CD1 . 6626 1 834 . 1 1 69 69 PHE CE1 C 13 128.9 0.1 . 1 . . . . 69 PHE CE1 . 6626 1 835 . 1 1 69 69 PHE N N 15 115.9 0.1 . 1 . . . . 69 PHE N . 6626 1 836 . 1 1 70 70 GLU H H 1 8.81 0.01 . 1 . . . . 70 GLU HN . 6626 1 837 . 1 1 70 70 GLU HA H 1 3.86 0.01 . 1 . . . . 70 GLU HA . 6626 1 838 . 1 1 70 70 GLU HB2 H 1 2.12 0.01 . 2 . . . . 70 GLU HB2 . 6626 1 839 . 1 1 70 70 GLU HB3 H 1 1.82 0.01 . 2 . . . . 70 GLU HB3 . 6626 1 840 . 1 1 70 70 GLU HG2 H 1 2.49 0.01 . 2 . . . . 70 GLU HG2 . 6626 1 841 . 1 1 70 70 GLU HG3 H 1 2.02 0.01 . 2 . . . . 70 GLU HG3 . 6626 1 842 . 1 1 70 70 GLU C C 13 179.7 0.1 . 1 . . . . 70 GLU C . 6626 1 843 . 1 1 70 70 GLU CA C 13 59.8 0.1 . 1 . . . . 70 GLU CA . 6626 1 844 . 1 1 70 70 GLU CB C 13 29.9 0.1 . 1 . . . . 70 GLU CB . 6626 1 845 . 1 1 70 70 GLU CG C 13 37.6 0.1 . 1 . . . . 70 GLU CG . 6626 1 846 . 1 1 70 70 GLU N N 15 114.6 0.1 . 1 . . . . 70 GLU N . 6626 1 847 . 1 1 71 71 GLU H H 1 7.91 0.01 . 1 . . . . 71 GLU HN . 6626 1 848 . 1 1 71 71 GLU HA H 1 3.97 0.01 . 1 . . . . 71 GLU HA . 6626 1 849 . 1 1 71 71 GLU HB2 H 1 2.14 0.01 . 1 . . . . 71 GLU HB2 . 6626 1 850 . 1 1 71 71 GLU HB3 H 1 2.14 0.01 . 1 . . . . 71 GLU HB3 . 6626 1 851 . 1 1 71 71 GLU HG2 H 1 2.43 0.01 . 2 . . . . 71 GLU HG2 . 6626 1 852 . 1 1 71 71 GLU HG3 H 1 2.35 0.01 . 2 . . . . 71 GLU HG3 . 6626 1 853 . 1 1 71 71 GLU C C 13 179.1 0.1 . 1 . . . . 71 GLU C . 6626 1 854 . 1 1 71 71 GLU CA C 13 59.9 0.1 . 1 . . . . 71 GLU CA . 6626 1 855 . 1 1 71 71 GLU CB C 13 29.5 0.1 . 1 . . . . 71 GLU CB . 6626 1 856 . 1 1 71 71 GLU CG C 13 36.3 0.1 . 1 . . . . 71 GLU CG . 6626 1 857 . 1 1 71 71 GLU N N 15 119.4 0.1 . 1 . . . . 71 GLU N . 6626 1 858 . 1 1 72 72 ALA H H 1 8.21 0.01 . 1 . . . . 72 ALA HN . 6626 1 859 . 1 1 72 72 ALA HA H 1 4.00 0.01 . 1 . . . . 72 ALA HA . 6626 1 860 . 1 1 72 72 ALA HB1 H 1 1.66 0.01 . 1 . . . . 72 ALA HB . 6626 1 861 . 1 1 72 72 ALA HB2 H 1 1.66 0.01 . 1 . . . . 72 ALA HB . 6626 1 862 . 1 1 72 72 ALA HB3 H 1 1.66 0.01 . 1 . . . . 72 ALA HB . 6626 1 863 . 1 1 72 72 ALA C C 13 179.1 0.1 . 1 . . . . 72 ALA C . 6626 1 864 . 1 1 72 72 ALA CA C 13 55.8 0.1 . 1 . . . . 72 ALA CA . 6626 1 865 . 1 1 72 72 ALA CB C 13 18.4 0.1 . 1 . . . . 72 ALA CB . 6626 1 866 . 1 1 72 72 ALA N N 15 119.4 0.1 . 1 . . . . 72 ALA N . 6626 1 867 . 1 1 73 73 LEU H H 1 7.75 0.01 . 1 . . . . 73 LEU HN . 6626 1 868 . 1 1 73 73 LEU HA H 1 4.29 0.01 . 1 . . . . 73 LEU HA . 6626 1 869 . 1 1 73 73 LEU HB2 H 1 1.80 0.01 . 2 . . . . 73 LEU HB2 . 6626 1 870 . 1 1 73 73 LEU HB3 H 1 1.41 0.01 . 2 . . . . 73 LEU HB3 . 6626 1 871 . 1 1 73 73 LEU HG H 1 1.72 0.01 . 1 . . . . 73 LEU HG . 6626 1 872 . 1 1 73 73 LEU HD11 H 1 0.78 0.01 . 2 . . . . 73 LEU HD1 . 6626 1 873 . 1 1 73 73 LEU HD12 H 1 0.78 0.01 . 2 . . . . 73 LEU HD1 . 6626 1 874 . 1 1 73 73 LEU HD13 H 1 0.78 0.01 . 2 . . . . 73 LEU HD1 . 6626 1 875 . 1 1 73 73 LEU HD21 H 1 1.00 0.01 . 2 . . . . 73 LEU HD2 . 6626 1 876 . 1 1 73 73 LEU HD22 H 1 1.00 0.01 . 2 . . . . 73 LEU HD2 . 6626 1 877 . 1 1 73 73 LEU HD23 H 1 1.00 0.01 . 2 . . . . 73 LEU HD2 . 6626 1 878 . 1 1 73 73 LEU C C 13 179.2 0.1 . 1 . . . . 73 LEU C . 6626 1 879 . 1 1 73 73 LEU CA C 13 56.2 0.1 . 1 . . . . 73 LEU CA . 6626 1 880 . 1 1 73 73 LEU CB C 13 42.7 0.1 . 1 . . . . 73 LEU CB . 6626 1 881 . 1 1 73 73 LEU CG C 13 27.9 0.1 . 1 . . . . 73 LEU CG . 6626 1 882 . 1 1 73 73 LEU CD1 C 13 26.0 0.1 . 1 . . . . 73 LEU CD1 . 6626 1 883 . 1 1 73 73 LEU CD2 C 13 23.7 0.1 . 1 . . . . 73 LEU CD2 . 6626 1 884 . 1 1 73 73 LEU N N 15 114.6 0.1 . 1 . . . . 73 LEU N . 6626 1 885 . 1 1 74 74 LEU H H 1 7.50 0.01 . 1 . . . . 74 LEU HN . 6626 1 886 . 1 1 74 74 LEU HA H 1 4.14 0.01 . 1 . . . . 74 LEU HA . 6626 1 887 . 1 1 74 74 LEU HB2 H 1 1.90 0.01 . 2 . . . . 74 LEU HB2 . 6626 1 888 . 1 1 74 74 LEU HB3 H 1 1.63 0.01 . 2 . . . . 74 LEU HB3 . 6626 1 889 . 1 1 74 74 LEU HG H 1 1.76 0.01 . 1 . . . . 74 LEU HG . 6626 1 890 . 1 1 74 74 LEU HD11 H 1 0.90 0.01 . 2 . . . . 74 LEU HD1 . 6626 1 891 . 1 1 74 74 LEU HD12 H 1 0.90 0.01 . 2 . . . . 74 LEU HD1 . 6626 1 892 . 1 1 74 74 LEU HD13 H 1 0.90 0.01 . 2 . . . . 74 LEU HD1 . 6626 1 893 . 1 1 74 74 LEU HD21 H 1 0.86 0.01 . 2 . . . . 74 LEU HD2 . 6626 1 894 . 1 1 74 74 LEU HD22 H 1 0.86 0.01 . 2 . . . . 74 LEU HD2 . 6626 1 895 . 1 1 74 74 LEU HD23 H 1 0.86 0.01 . 2 . . . . 74 LEU HD2 . 6626 1 896 . 1 1 74 74 LEU C C 13 179.5 0.1 . 1 . . . . 74 LEU C . 6626 1 897 . 1 1 74 74 LEU CA C 13 57.0 0.1 . 1 . . . . 74 LEU CA . 6626 1 898 . 1 1 74 74 LEU CB C 13 41.9 0.1 . 1 . . . . 74 LEU CB . 6626 1 899 . 1 1 74 74 LEU CG C 13 26.9 0.1 . 1 . . . . 74 LEU CG . 6626 1 900 . 1 1 74 74 LEU CD1 C 13 25.1 0.1 . 1 . . . . 74 LEU CD1 . 6626 1 901 . 1 1 74 74 LEU CD2 C 13 23.5 0.1 . 1 . . . . 74 LEU CD2 . 6626 1 902 . 1 1 74 74 LEU N N 15 117.4 0.1 . 1 . . . . 74 LEU N . 6626 1 903 . 1 1 75 75 ILE H H 1 7.26 0.01 . 1 . . . . 75 ILE HN . 6626 1 904 . 1 1 75 75 ILE HA H 1 3.79 0.01 . 1 . . . . 75 ILE HA . 6626 1 905 . 1 1 75 75 ILE HB H 1 1.96 0.01 . 1 . . . . 75 ILE HB . 6626 1 906 . 1 1 75 75 ILE HG12 H 1 1.82 0.01 . 2 . . . . 75 ILE HG12 . 6626 1 907 . 1 1 75 75 ILE HG13 H 1 1.06 0.01 . 2 . . . . 75 ILE HG13 . 6626 1 908 . 1 1 75 75 ILE HG21 H 1 1.07 0.01 . 1 . . . . 75 ILE HG2 . 6626 1 909 . 1 1 75 75 ILE HG22 H 1 1.07 0.01 . 1 . . . . 75 ILE HG2 . 6626 1 910 . 1 1 75 75 ILE HG23 H 1 1.07 0.01 . 1 . . . . 75 ILE HG2 . 6626 1 911 . 1 1 75 75 ILE HD11 H 1 0.98 0.01 . 1 . . . . 75 ILE HD1 . 6626 1 912 . 1 1 75 75 ILE HD12 H 1 0.98 0.01 . 1 . . . . 75 ILE HD1 . 6626 1 913 . 1 1 75 75 ILE HD13 H 1 0.98 0.01 . 1 . . . . 75 ILE HD1 . 6626 1 914 . 1 1 75 75 ILE C C 13 176.8 0.1 . 1 . . . . 75 ILE C . 6626 1 915 . 1 1 75 75 ILE CA C 13 63.8 0.1 . 1 . . . . 75 ILE CA . 6626 1 916 . 1 1 75 75 ILE CB C 13 39.3 0.1 . 1 . . . . 75 ILE CB . 6626 1 917 . 1 1 75 75 ILE CG1 C 13 28.7 0.1 . 1 . . . . 75 ILE CG1 . 6626 1 918 . 1 1 75 75 ILE CG2 C 13 18.0 0.1 . 1 . . . . 75 ILE CG2 . 6626 1 919 . 1 1 75 75 ILE CD1 C 13 15.5 0.1 . 1 . . . . 75 ILE CD1 . 6626 1 920 . 1 1 75 75 ILE N N 15 117.6 0.1 . 1 . . . . 75 ILE N . 6626 1 921 . 1 1 76 76 ASP H H 1 8.48 0.01 . 1 . . . . 76 ASP HN . 6626 1 922 . 1 1 76 76 ASP HA H 1 5.03 0.01 . 1 . . . . 76 ASP HA . 6626 1 923 . 1 1 76 76 ASP HB2 H 1 2.82 0.01 . 2 . . . . 76 ASP HB2 . 6626 1 924 . 1 1 76 76 ASP HB3 H 1 2.37 0.01 . 2 . . . . 76 ASP HB3 . 6626 1 925 . 1 1 76 76 ASP C C 13 174.6 0.1 . 1 . . . . 76 ASP C . 6626 1 926 . 1 1 76 76 ASP CA C 13 50.4 0.1 . 1 . . . . 76 ASP CA . 6626 1 927 . 1 1 76 76 ASP CB C 13 42.0 0.1 . 1 . . . . 76 ASP CB . 6626 1 928 . 1 1 76 76 ASP N N 15 114.6 0.1 . 1 . . . . 76 ASP N . 6626 1 929 . 1 1 77 77 PRO HA H 1 4.67 0.01 . 1 . . . . 77 PRO HA . 6626 1 930 . 1 1 77 77 PRO HB2 H 1 2.46 0.01 . 2 . . . . 77 PRO HB2 . 6626 1 931 . 1 1 77 77 PRO HB3 H 1 1.92 0.01 . 2 . . . . 77 PRO HB3 . 6626 1 932 . 1 1 77 77 PRO HG2 H 1 2.09 0.01 . 2 . . . . 77 PRO HG2 . 6626 1 933 . 1 1 77 77 PRO HG3 H 1 1.96 0.01 . 2 . . . . 77 PRO HG3 . 6626 1 934 . 1 1 77 77 PRO HD2 H 1 3.85 0.01 . 2 . . . . 77 PRO HD2 . 6626 1 935 . 1 1 77 77 PRO HD3 H 1 3.49 0.01 . 2 . . . . 77 PRO HD3 . 6626 1 936 . 1 1 77 77 PRO C C 13 177.5 0.1 . 1 . . . . 77 PRO C . 6626 1 937 . 1 1 77 77 PRO CA C 13 63.9 0.1 . 1 . . . . 77 PRO CA . 6626 1 938 . 1 1 77 77 PRO CB C 13 32.6 0.1 . 1 . . . . 77 PRO CB . 6626 1 939 . 1 1 77 77 PRO CG C 13 27.0 0.1 . 1 . . . . 77 PRO CG . 6626 1 940 . 1 1 77 77 PRO CD C 13 50.4 0.1 . 1 . . . . 77 PRO CD . 6626 1 941 . 1 1 78 78 LYS H H 1 7.75 0.01 . 1 . . . . 78 LYS HN . 6626 1 942 . 1 1 78 78 LYS HA H 1 4.42 0.01 . 1 . . . . 78 LYS HA . 6626 1 943 . 1 1 78 78 LYS HB2 H 1 2.22 0.01 . 2 . . . . 78 LYS HB2 . 6626 1 944 . 1 1 78 78 LYS HB3 H 1 1.84 0.01 . 2 . . . . 78 LYS HB3 . 6626 1 945 . 1 1 78 78 LYS HG2 H 1 1.50 0.01 . 2 . . . . 78 LYS HG2 . 6626 1 946 . 1 1 78 78 LYS HG3 H 1 1.39 0.01 . 2 . . . . 78 LYS HG3 . 6626 1 947 . 1 1 78 78 LYS HD2 H 1 1.71 0.01 . 1 . . . . 78 LYS HD2 . 6626 1 948 . 1 1 78 78 LYS HD3 H 1 1.71 0.01 . 1 . . . . 78 LYS HD3 . 6626 1 949 . 1 1 78 78 LYS HE2 H 1 3.08 0.01 . 2 . . . . 78 LYS HE2 . 6626 1 950 . 1 1 78 78 LYS HE3 H 1 3.00 0.01 . 2 . . . . 78 LYS HE3 . 6626 1 951 . 1 1 78 78 LYS C C 13 176.3 0.1 . 1 . . . . 78 LYS C . 6626 1 952 . 1 1 78 78 LYS CA C 13 54.5 0.1 . 1 . . . . 78 LYS CA . 6626 1 953 . 1 1 78 78 LYS CB C 13 30.7 0.1 . 1 . . . . 78 LYS CB . 6626 1 954 . 1 1 78 78 LYS CG C 13 24.6 0.1 . 1 . . . . 78 LYS CG . 6626 1 955 . 1 1 78 78 LYS CD C 13 28.3 0.1 . 1 . . . . 78 LYS CD . 6626 1 956 . 1 1 78 78 LYS CE C 13 41.8 0.1 . 1 . . . . 78 LYS CE . 6626 1 957 . 1 1 78 78 LYS N N 15 113.0 0.1 . 1 . . . . 78 LYS N . 6626 1 958 . 1 1 79 79 LYS H H 1 7.40 0.01 . 1 . . . . 79 LYS HN . 6626 1 959 . 1 1 79 79 LYS HA H 1 4.54 0.01 . 1 . . . . 79 LYS HA . 6626 1 960 . 1 1 79 79 LYS HB2 H 1 2.26 0.01 . 1 . . . . 79 LYS HB2 . 6626 1 961 . 1 1 79 79 LYS HB3 H 1 2.26 0.01 . 1 . . . . 79 LYS HB3 . 6626 1 962 . 1 1 79 79 LYS HG2 H 1 1.49 0.01 . 1 . . . . 79 LYS HG2 . 6626 1 963 . 1 1 79 79 LYS HG3 H 1 1.49 0.01 . 1 . . . . 79 LYS HG3 . 6626 1 964 . 1 1 79 79 LYS HD2 H 1 1.75 0.01 . 1 . . . . 79 LYS HD2 . 6626 1 965 . 1 1 79 79 LYS HD3 H 1 1.75 0.01 . 1 . . . . 79 LYS HD3 . 6626 1 966 . 1 1 79 79 LYS C C 13 175.5 0.1 . 1 . . . . 79 LYS C . 6626 1 967 . 1 1 79 79 LYS CA C 13 54.9 0.1 . 1 . . . . 79 LYS CA . 6626 1 968 . 1 1 79 79 LYS CB C 13 30.2 0.1 . 1 . . . . 79 LYS CB . 6626 1 969 . 1 1 79 79 LYS CG C 13 25.8 0.1 . 1 . . . . 79 LYS CG . 6626 1 970 . 1 1 79 79 LYS CD C 13 29.7 0.1 . 1 . . . . 79 LYS CD . 6626 1 971 . 1 1 79 79 LYS CE C 13 38.2 0.1 . 1 . . . . 79 LYS CE . 6626 1 972 . 1 1 79 79 LYS N N 15 120.1 0.1 . 1 . . . . 79 LYS N . 6626 1 973 . 1 1 80 80 ASP H H 1 8.67 0.01 . 1 . . . . 80 ASP HN . 6626 1 974 . 1 1 80 80 ASP HA H 1 4.21 0.01 . 1 . . . . 80 ASP HA . 6626 1 975 . 1 1 80 80 ASP HB2 H 1 2.80 0.01 . 2 . . . . 80 ASP HB2 . 6626 1 976 . 1 1 80 80 ASP HB3 H 1 2.67 0.01 . 2 . . . . 80 ASP HB3 . 6626 1 977 . 1 1 80 80 ASP C C 13 176.7 0.1 . 1 . . . . 80 ASP C . 6626 1 978 . 1 1 80 80 ASP CA C 13 57.3 0.1 . 1 . . . . 80 ASP CA . 6626 1 979 . 1 1 80 80 ASP CB C 13 41.3 0.1 . 1 . . . . 80 ASP CB . 6626 1 980 . 1 1 80 80 ASP N N 15 124.4 0.1 . 1 . . . . 80 ASP N . 6626 1 981 . 1 1 81 81 GLU H H 1 9.23 0.01 . 1 . . . . 81 GLU HN . 6626 1 982 . 1 1 81 81 GLU HA H 1 4.41 0.01 . 1 . . . . 81 GLU HA . 6626 1 983 . 1 1 81 81 GLU HB2 H 1 2.16 0.01 . 2 . . . . 81 GLU HB2 . 6626 1 984 . 1 1 81 81 GLU HB3 H 1 1.89 0.01 . 2 . . . . 81 GLU HB3 . 6626 1 985 . 1 1 81 81 GLU HG2 H 1 2.46 0.01 . 2 . . . . 81 GLU HG2 . 6626 1 986 . 1 1 81 81 GLU HG3 H 1 2.30 0.01 . 2 . . . . 81 GLU HG3 . 6626 1 987 . 1 1 81 81 GLU C C 13 179.1 0.1 . 1 . . . . 81 GLU C . 6626 1 988 . 1 1 81 81 GLU CA C 13 59.9 0.1 . 1 . . . . 81 GLU CA . 6626 1 989 . 1 1 81 81 GLU CB C 13 30.5 0.1 . 1 . . . . 81 GLU CB . 6626 1 990 . 1 1 81 81 GLU CG C 13 36.5 0.1 . 1 . . . . 81 GLU CG . 6626 1 991 . 1 1 81 81 GLU N N 15 118.4 0.1 . 1 . . . . 81 GLU N . 6626 1 992 . 1 1 82 82 ALA H H 1 7.65 0.01 . 1 . . . . 82 ALA HN . 6626 1 993 . 1 1 82 82 ALA HA H 1 3.76 0.01 . 1 . . . . 82 ALA HA . 6626 1 994 . 1 1 82 82 ALA HB1 H 1 1.65 0.01 . 1 . . . . 82 ALA HB . 6626 1 995 . 1 1 82 82 ALA HB2 H 1 1.65 0.01 . 1 . . . . 82 ALA HB . 6626 1 996 . 1 1 82 82 ALA HB3 H 1 1.65 0.01 . 1 . . . . 82 ALA HB . 6626 1 997 . 1 1 82 82 ALA C C 13 178.1 0.1 . 1 . . . . 82 ALA C . 6626 1 998 . 1 1 82 82 ALA CA C 13 55.2 0.1 . 1 . . . . 82 ALA CA . 6626 1 999 . 1 1 82 82 ALA CB C 13 17.4 0.1 . 1 . . . . 82 ALA CB . 6626 1 1000 . 1 1 82 82 ALA N N 15 117.4 0.1 . 1 . . . . 82 ALA N . 6626 1 1001 . 1 1 83 83 VAL H H 1 7.06 0.01 . 1 . . . . 83 VAL HN . 6626 1 1002 . 1 1 83 83 VAL HA H 1 3.44 0.01 . 1 . . . . 83 VAL HA . 6626 1 1003 . 1 1 83 83 VAL HB H 1 2.35 0.01 . 1 . . . . 83 VAL HB . 6626 1 1004 . 1 1 83 83 VAL HG11 H 1 1.11 0.01 . 2 . . . . 83 VAL HG1 . 6626 1 1005 . 1 1 83 83 VAL HG12 H 1 1.11 0.01 . 2 . . . . 83 VAL HG1 . 6626 1 1006 . 1 1 83 83 VAL HG13 H 1 1.11 0.01 . 2 . . . . 83 VAL HG1 . 6626 1 1007 . 1 1 83 83 VAL HG21 H 1 1.11 0.01 . 2 . . . . 83 VAL HG2 . 6626 1 1008 . 1 1 83 83 VAL HG22 H 1 1.11 0.01 . 2 . . . . 83 VAL HG2 . 6626 1 1009 . 1 1 83 83 VAL HG23 H 1 1.11 0.01 . 2 . . . . 83 VAL HG2 . 6626 1 1010 . 1 1 83 83 VAL C C 13 177.5 0.1 . 1 . . . . 83 VAL C . 6626 1 1011 . 1 1 83 83 VAL CA C 13 66.6 0.1 . 1 . . . . 83 VAL CA . 6626 1 1012 . 1 1 83 83 VAL CB C 13 32.2 0.1 . 1 . . . . 83 VAL CB . 6626 1 1013 . 1 1 83 83 VAL CG1 C 13 23.8 0.1 . 1 . . . . 83 VAL CG1 . 6626 1 1014 . 1 1 83 83 VAL N N 15 115.4 0.1 . 1 . . . . 83 VAL N . 6626 1 1015 . 1 1 84 84 TRP H H 1 7.96 0.01 . 1 . . . . 84 TRP HN . 6626 1 1016 . 1 1 84 84 TRP HA H 1 3.84 0.01 . 1 . . . . 84 TRP HA . 6626 1 1017 . 1 1 84 84 TRP HB2 H 1 3.32 0.01 . 2 . . . . 84 TRP HB2 . 6626 1 1018 . 1 1 84 84 TRP HB3 H 1 2.38 0.01 . 2 . . . . 84 TRP HB3 . 6626 1 1019 . 1 1 84 84 TRP HD1 H 1 7.39 0.01 . 1 . . . . 84 TRP HD1 . 6626 1 1020 . 1 1 84 84 TRP HE1 H 1 10.46 0.01 . 1 . . . . 84 TRP HE1 . 6626 1 1021 . 1 1 84 84 TRP HE3 H 1 7.12 0.01 . 1 . . . . 84 TRP HE3 . 6626 1 1022 . 1 1 84 84 TRP HZ2 H 1 7.45 0.01 . 1 . . . . 84 TRP HZ2 . 6626 1 1023 . 1 1 84 84 TRP HZ3 H 1 7.12 0.01 . 1 . . . . 84 TRP HZ3 . 6626 1 1024 . 1 1 84 84 TRP HH2 H 1 7.84 0.01 . 1 . . . . 84 TRP HH2 . 6626 1 1025 . 1 1 84 84 TRP C C 13 178.0 0.1 . 1 . . . . 84 TRP C . 6626 1 1026 . 1 1 84 84 TRP CA C 13 62.0 0.1 . 1 . . . . 84 TRP CA . 6626 1 1027 . 1 1 84 84 TRP CB C 13 28.5 0.1 . 1 . . . . 84 TRP CB . 6626 1 1028 . 1 1 84 84 TRP CD1 C 13 127.9 0.1 . 1 . . . . 84 TRP CD1 . 6626 1 1029 . 1 1 84 84 TRP CE3 C 13 124.1 0.1 . 1 . . . . 84 TRP CE3 . 6626 1 1030 . 1 1 84 84 TRP CZ2 C 13 113.8 0.1 . 1 . . . . 84 TRP CZ2 . 6626 1 1031 . 1 1 84 84 TRP CZ3 C 13 122.0 0.1 . 1 . . . . 84 TRP CZ3 . 6626 1 1032 . 1 1 84 84 TRP CH2 C 13 121.9 0.1 . 1 . . . . 84 TRP CH2 . 6626 1 1033 . 1 1 84 84 TRP N N 15 117.2 0.1 . 1 . . . . 84 TRP N . 6626 1 1034 . 1 1 84 84 TRP NE1 N 15 127.9 0.1 . 1 . . . . 84 TRP NE1 . 6626 1 1035 . 1 1 85 85 CYS H H 1 8.26 0.01 . 1 . . . . 85 CYS HN . 6626 1 1036 . 1 1 85 85 CYS HA H 1 3.34 0.01 . 1 . . . . 85 CYS HA . 6626 1 1037 . 1 1 85 85 CYS HB2 H 1 1.72 0.01 . 2 . . . . 85 CYS HB2 . 6626 1 1038 . 1 1 85 85 CYS HB3 H 1 1.26 0.01 . 2 . . . . 85 CYS HB3 . 6626 1 1039 . 1 1 85 85 CYS C C 13 176.7 0.1 . 1 . . . . 85 CYS C . 6626 1 1040 . 1 1 85 85 CYS CA C 13 64.3 0.1 . 1 . . . . 85 CYS CA . 6626 1 1041 . 1 1 85 85 CYS CB C 13 25.4 0.1 . 1 . . . . 85 CYS CB . 6626 1 1042 . 1 1 85 85 CYS N N 15 113.0 0.1 . 1 . . . . 85 CYS N . 6626 1 1043 . 1 1 86 86 ILE H H 1 7.38 0.01 . 1 . . . . 86 ILE HN . 6626 1 1044 . 1 1 86 86 ILE HA H 1 3.06 0.01 . 1 . . . . 86 ILE HA . 6626 1 1045 . 1 1 86 86 ILE HB H 1 1.37 0.01 . 1 . . . . 86 ILE HB . 6626 1 1046 . 1 1 86 86 ILE HG12 H 1 1.80 0.01 . 2 . . . . 86 ILE HG12 . 6626 1 1047 . 1 1 86 86 ILE HG13 H 1 0.48 0.01 . 2 . . . . 86 ILE HG13 . 6626 1 1048 . 1 1 86 86 ILE HG21 H 1 -0.21 0.01 . 1 . . . . 86 ILE HG2 . 6626 1 1049 . 1 1 86 86 ILE HG22 H 1 -0.21 0.01 . 1 . . . . 86 ILE HG2 . 6626 1 1050 . 1 1 86 86 ILE HG23 H 1 -0.21 0.01 . 1 . . . . 86 ILE HG2 . 6626 1 1051 . 1 1 86 86 ILE HD11 H 1 0.59 0.01 . 1 . . . . 86 ILE HD1 . 6626 1 1052 . 1 1 86 86 ILE HD12 H 1 0.59 0.01 . 1 . . . . 86 ILE HD1 . 6626 1 1053 . 1 1 86 86 ILE HD13 H 1 0.59 0.01 . 1 . . . . 86 ILE HD1 . 6626 1 1054 . 1 1 86 86 ILE C C 13 177.9 0.1 . 1 . . . . 86 ILE C . 6626 1 1055 . 1 1 86 86 ILE CA C 13 66.6 0.1 . 1 . . . . 86 ILE CA . 6626 1 1056 . 1 1 86 86 ILE CB C 13 37.4 0.1 . 1 . . . . 86 ILE CB . 6626 1 1057 . 1 1 86 86 ILE CG1 C 13 32.5 0.1 . 1 . . . . 86 ILE CG1 . 6626 1 1058 . 1 1 86 86 ILE CG2 C 13 17.9 0.1 . 1 . . . . 86 ILE CG2 . 6626 1 1059 . 1 1 86 86 ILE CD1 C 13 14.3 0.1 . 1 . . . . 86 ILE CD1 . 6626 1 1060 . 1 1 86 86 ILE N N 15 118.3 0.1 . 1 . . . . 86 ILE N . 6626 1 1061 . 1 1 87 87 GLY H H 1 7.22 0.01 . 1 . . . . 87 GLY HN . 6626 1 1062 . 1 1 87 87 GLY HA2 H 1 3.21 0.01 . 2 . . . . 87 GLY HA1 . 6626 1 1063 . 1 1 87 87 GLY HA3 H 1 2.38 0.01 . 2 . . . . 87 GLY HA2 . 6626 1 1064 . 1 1 87 87 GLY C C 13 176.9 0.1 . 1 . . . . 87 GLY C . 6626 1 1065 . 1 1 87 87 GLY CA C 13 48.1 0.1 . 1 . . . . 87 GLY CA . 6626 1 1066 . 1 1 87 87 GLY N N 15 104.6 0.1 . 1 . . . . 87 GLY N . 6626 1 1067 . 1 1 88 88 ASN H H 1 7.75 0.01 . 1 . . . . 88 ASN HN . 6626 1 1068 . 1 1 88 88 ASN HA H 1 4.33 0.01 . 1 . . . . 88 ASN HA . 6626 1 1069 . 1 1 88 88 ASN HB2 H 1 2.40 0.01 . 2 . . . . 88 ASN HB2 . 6626 1 1070 . 1 1 88 88 ASN HB3 H 1 2.32 0.01 . 2 . . . . 88 ASN HB3 . 6626 1 1071 . 1 1 88 88 ASN C C 13 177.6 0.1 . 1 . . . . 88 ASN C . 6626 1 1072 . 1 1 88 88 ASN CA C 13 56.1 0.1 . 1 . . . . 88 ASN CA . 6626 1 1073 . 1 1 88 88 ASN CB C 13 37.3 0.1 . 1 . . . . 88 ASN CB . 6626 1 1074 . 1 1 88 88 ASN N N 15 121.2 0.1 . 1 . . . . 88 ASN N . 6626 1 1075 . 1 1 89 89 ALA H H 1 8.45 0.01 . 1 . . . . 89 ALA HN . 6626 1 1076 . 1 1 89 89 ALA HA H 1 3.82 0.01 . 1 . . . . 89 ALA HA . 6626 1 1077 . 1 1 89 89 ALA HB1 H 1 1.25 0.01 . 1 . . . . 89 ALA HB . 6626 1 1078 . 1 1 89 89 ALA HB2 H 1 1.25 0.01 . 1 . . . . 89 ALA HB . 6626 1 1079 . 1 1 89 89 ALA HB3 H 1 1.25 0.01 . 1 . . . . 89 ALA HB . 6626 1 1080 . 1 1 89 89 ALA C C 13 178.8 0.1 . 1 . . . . 89 ALA C . 6626 1 1081 . 1 1 89 89 ALA CA C 13 55.4 0.1 . 1 . . . . 89 ALA CA . 6626 1 1082 . 1 1 89 89 ALA CB C 13 19.3 0.1 . 1 . . . . 89 ALA CB . 6626 1 1083 . 1 1 89 89 ALA N N 15 123.7 0.1 . 1 . . . . 89 ALA N . 6626 1 1084 . 1 1 90 90 TYR H H 1 8.32 0.01 . 1 . . . . 90 TYR HN . 6626 1 1085 . 1 1 90 90 TYR HA H 1 4.11 0.01 . 1 . . . . 90 TYR HA . 6626 1 1086 . 1 1 90 90 TYR HB2 H 1 3.42 0.01 . 2 . . . . 90 TYR HB2 . 6626 1 1087 . 1 1 90 90 TYR HB3 H 1 2.36 0.01 . 2 . . . . 90 TYR HB3 . 6626 1 1088 . 1 1 90 90 TYR HD1 H 1 6.96 0.01 . 1 . . . . 90 TYR HD1 . 6626 1 1089 . 1 1 90 90 TYR HD2 H 1 6.96 0.01 . 1 . . . . 90 TYR HD2 . 6626 1 1090 . 1 1 90 90 TYR HE1 H 1 6.36 0.01 . 1 . . . . 90 TYR HE1 . 6626 1 1091 . 1 1 90 90 TYR HE2 H 1 6.36 0.01 . 1 . . . . 90 TYR HE2 . 6626 1 1092 . 1 1 90 90 TYR C C 13 178.7 0.1 . 1 . . . . 90 TYR C . 6626 1 1093 . 1 1 90 90 TYR CA C 13 64.0 0.1 . 1 . . . . 90 TYR CA . 6626 1 1094 . 1 1 90 90 TYR CB C 13 38.2 0.1 . 1 . . . . 90 TYR CB . 6626 1 1095 . 1 1 90 90 TYR CD1 C 13 132.7 0.1 . 1 . . . . 90 TYR CD1 . 6626 1 1096 . 1 1 90 90 TYR CE1 C 13 118.3 0.1 . 1 . . . . 90 TYR CE1 . 6626 1 1097 . 1 1 90 90 TYR N N 15 114.5 0.1 . 1 . . . . 90 TYR N . 6626 1 1098 . 1 1 91 91 THR H H 1 7.91 0.01 . 1 . . . . 91 THR HN . 6626 1 1099 . 1 1 91 91 THR HA H 1 3.76 0.01 . 1 . . . . 91 THR HA . 6626 1 1100 . 1 1 91 91 THR HB H 1 4.61 0.01 . 1 . . . . 91 THR HB . 6626 1 1101 . 1 1 91 91 THR HG21 H 1 1.53 0.01 . 1 . . . . 91 THR HG2 . 6626 1 1102 . 1 1 91 91 THR HG22 H 1 1.53 0.01 . 1 . . . . 91 THR HG2 . 6626 1 1103 . 1 1 91 91 THR HG23 H 1 1.53 0.01 . 1 . . . . 91 THR HG2 . 6626 1 1104 . 1 1 91 91 THR C C 13 175.5 0.1 . 1 . . . . 91 THR C . 6626 1 1105 . 1 1 91 91 THR CA C 13 68.4 0.1 . 1 . . . . 91 THR CA . 6626 1 1106 . 1 1 91 91 THR CB C 13 68.5 0.1 . 1 . . . . 91 THR CB . 6626 1 1107 . 1 1 91 91 THR CG2 C 13 21.7 0.1 . 1 . . . . 91 THR CG2 . 6626 1 1108 . 1 1 91 91 THR N N 15 114.4 0.1 . 1 . . . . 91 THR N . 6626 1 1109 . 1 1 92 92 SER H H 1 8.20 0.01 . 1 . . . . 92 SER HN . 6626 1 1110 . 1 1 92 92 SER HA H 1 4.30 0.01 . 1 . . . . 92 SER HA . 6626 1 1111 . 1 1 92 92 SER HB2 H 1 4.02 0.01 . 2 . . . . 92 SER HB2 . 6626 1 1112 . 1 1 92 92 SER HB3 H 1 3.82 0.01 . 2 . . . . 92 SER HB3 . 6626 1 1113 . 1 1 92 92 SER CA C 13 63.0 0.1 . 1 . . . . 92 SER CA . 6626 1 1114 . 1 1 92 92 SER CB C 13 62.8 0.1 . 1 . . . . 92 SER CB . 6626 1 1115 . 1 1 92 92 SER N N 15 115.2 0.1 . 1 . . . . 92 SER N . 6626 1 1116 . 1 1 93 93 PHE H H 1 8.55 0.01 . 1 . . . . 93 PHE HN . 6626 1 1117 . 1 1 93 93 PHE HA H 1 3.80 0.01 . 1 . . . . 93 PHE HA . 6626 1 1118 . 1 1 93 93 PHE HB2 H 1 3.15 0.01 . 2 . . . . 93 PHE HB2 . 6626 1 1119 . 1 1 93 93 PHE HB3 H 1 3.05 0.01 . 2 . . . . 93 PHE HB3 . 6626 1 1120 . 1 1 93 93 PHE HD1 H 1 6.88 0.01 . 1 . . . . 93 PHE HD1 . 6626 1 1121 . 1 1 93 93 PHE HD2 H 1 6.88 0.01 . 1 . . . . 93 PHE HD2 . 6626 1 1122 . 1 1 93 93 PHE HE1 H 1 7.27 0.01 . 1 . . . . 93 PHE HE1 . 6626 1 1123 . 1 1 93 93 PHE HE2 H 1 7.27 0.01 . 1 . . . . 93 PHE HE2 . 6626 1 1124 . 1 1 93 93 PHE HZ H 1 7.20 0.01 . 1 . . . . 93 PHE HZ . 6626 1 1125 . 1 1 93 93 PHE C C 13 179.0 0.1 . 1 . . . . 93 PHE C . 6626 1 1126 . 1 1 93 93 PHE CA C 13 61.3 0.1 . 1 . . . . 93 PHE CA . 6626 1 1127 . 1 1 93 93 PHE CB C 13 39.6 0.1 . 1 . . . . 93 PHE CB . 6626 1 1128 . 1 1 93 93 PHE CD1 C 13 131.1 0.1 . 1 . . . . 93 PHE CD1 . 6626 1 1129 . 1 1 93 93 PHE CE1 C 13 131.4 0.1 . 1 . . . . 93 PHE CE1 . 6626 1 1130 . 1 1 93 93 PHE N N 15 119.3 0.1 . 1 . . . . 93 PHE N . 6626 1 1131 . 1 1 94 94 ALA H H 1 8.21 0.01 . 1 . . . . 94 ALA HN . 6626 1 1132 . 1 1 94 94 ALA HA H 1 3.51 0.01 . 1 . . . . 94 ALA HA . 6626 1 1133 . 1 1 94 94 ALA HB1 H 1 0.44 0.01 . 1 . . . . 94 ALA HB . 6626 1 1134 . 1 1 94 94 ALA HB2 H 1 0.44 0.01 . 1 . . . . 94 ALA HB . 6626 1 1135 . 1 1 94 94 ALA HB3 H 1 0.44 0.01 . 1 . . . . 94 ALA HB . 6626 1 1136 . 1 1 94 94 ALA C C 13 179.4 0.1 . 1 . . . . 94 ALA C . 6626 1 1137 . 1 1 94 94 ALA CA C 13 55.8 0.1 . 1 . . . . 94 ALA CA . 6626 1 1138 . 1 1 94 94 ALA CB C 13 18.0 0.1 . 1 . . . . 94 ALA CB . 6626 1 1139 . 1 1 94 94 ALA N N 15 120.1 0.1 . 1 . . . . 94 ALA N . 6626 1 1140 . 1 1 95 95 PHE H H 1 7.72 0.01 . 1 . . . . 95 PHE HN . 6626 1 1141 . 1 1 95 95 PHE HA H 1 4.50 0.01 . 1 . . . . 95 PHE HA . 6626 1 1142 . 1 1 95 95 PHE HB2 H 1 3.35 0.01 . 2 . . . . 95 PHE HB2 . 6626 1 1143 . 1 1 95 95 PHE HB3 H 1 2.98 0.01 . 2 . . . . 95 PHE HB3 . 6626 1 1144 . 1 1 95 95 PHE HD1 H 1 7.52 0.01 . 1 . . . . 95 PHE HD1 . 6626 1 1145 . 1 1 95 95 PHE HD2 H 1 7.52 0.01 . 1 . . . . 95 PHE HD2 . 6626 1 1146 . 1 1 95 95 PHE HE1 H 1 7.30 0.01 . 1 . . . . 95 PHE HE1 . 6626 1 1147 . 1 1 95 95 PHE HE2 H 1 7.30 0.01 . 1 . . . . 95 PHE HE2 . 6626 1 1148 . 1 1 95 95 PHE HZ H 1 7.65 0.01 . 1 . . . . 95 PHE HZ . 6626 1 1149 . 1 1 95 95 PHE C C 13 177.2 0.1 . 1 . . . . 95 PHE C . 6626 1 1150 . 1 1 95 95 PHE CA C 13 62.4 0.1 . 1 . . . . 95 PHE CA . 6626 1 1151 . 1 1 95 95 PHE CB C 13 39.0 0.1 . 1 . . . . 95 PHE CB . 6626 1 1152 . 1 1 95 95 PHE CD1 C 13 132.0 0.1 . 1 . . . . 95 PHE CD1 . 6626 1 1153 . 1 1 95 95 PHE CE1 C 13 130.4 0.1 . 1 . . . . 95 PHE CE1 . 6626 1 1154 . 1 1 95 95 PHE N N 15 109.4 0.1 . 1 . . . . 95 PHE N . 6626 1 1155 . 1 1 96 96 LEU H H 1 7.57 0.01 . 1 . . . . 96 LEU HN . 6626 1 1156 . 1 1 96 96 LEU HA H 1 4.35 0.01 . 1 . . . . 96 LEU HA . 6626 1 1157 . 1 1 96 96 LEU HB2 H 1 1.58 0.01 . 1 . . . . 96 LEU HB2 . 6626 1 1158 . 1 1 96 96 LEU HB3 H 1 1.58 0.01 . 1 . . . . 96 LEU HB3 . 6626 1 1159 . 1 1 96 96 LEU HG H 1 1.77 0.01 . 1 . . . . 96 LEU HG . 6626 1 1160 . 1 1 96 96 LEU HD11 H 1 0.67 0.01 . 2 . . . . 96 LEU HD1 . 6626 1 1161 . 1 1 96 96 LEU HD12 H 1 0.67 0.01 . 2 . . . . 96 LEU HD1 . 6626 1 1162 . 1 1 96 96 LEU HD13 H 1 0.67 0.01 . 2 . . . . 96 LEU HD1 . 6626 1 1163 . 1 1 96 96 LEU HD21 H 1 0.75 0.01 . 2 . . . . 96 LEU HD2 . 6626 1 1164 . 1 1 96 96 LEU HD22 H 1 0.75 0.01 . 2 . . . . 96 LEU HD2 . 6626 1 1165 . 1 1 96 96 LEU HD23 H 1 0.75 0.01 . 2 . . . . 96 LEU HD2 . 6626 1 1166 . 1 1 96 96 LEU C C 13 175.3 0.1 . 1 . . . . 96 LEU C . 6626 1 1167 . 1 1 96 96 LEU CA C 13 55.0 0.1 . 1 . . . . 96 LEU CA . 6626 1 1168 . 1 1 96 96 LEU CB C 13 42.3 0.1 . 1 . . . . 96 LEU CB . 6626 1 1169 . 1 1 96 96 LEU CD1 C 13 26.5 0.1 . 1 . . . . 96 LEU CD1 . 6626 1 1170 . 1 1 96 96 LEU CD2 C 13 22.7 0.1 . 1 . . . . 96 LEU CD2 . 6626 1 1171 . 1 1 96 96 LEU N N 15 118.2 0.1 . 1 . . . . 96 LEU N . 6626 1 1172 . 1 1 97 97 THR H H 1 7.41 0.01 . 1 . . . . 97 THR HN . 6626 1 1173 . 1 1 97 97 THR HA H 1 4.64 0.01 . 1 . . . . 97 THR HA . 6626 1 1174 . 1 1 97 97 THR HB H 1 4.13 0.01 . 1 . . . . 97 THR HB . 6626 1 1175 . 1 1 97 97 THR HG21 H 1 1.14 0.01 . 1 . . . . 97 THR HG2 . 6626 1 1176 . 1 1 97 97 THR HG22 H 1 1.14 0.01 . 1 . . . . 97 THR HG2 . 6626 1 1177 . 1 1 97 97 THR HG23 H 1 1.14 0.01 . 1 . . . . 97 THR HG2 . 6626 1 1178 . 1 1 97 97 THR CA C 13 58.0 0.1 . 1 . . . . 97 THR CA . 6626 1 1179 . 1 1 97 97 THR CB C 13 70.5 0.1 . 1 . . . . 97 THR CB . 6626 1 1180 . 1 1 97 97 THR CG2 C 13 20.7 0.1 . 1 . . . . 97 THR CG2 . 6626 1 1181 . 1 1 97 97 THR N N 15 114.4 0.1 . 1 . . . . 97 THR N . 6626 1 1182 . 1 1 98 98 PRO HA H 1 3.08 0.01 . 1 . . . . 98 PRO HA . 6626 1 1183 . 1 1 98 98 PRO HB2 H 1 1.73 0.01 . 2 . . . . 98 PRO HB2 . 6626 1 1184 . 1 1 98 98 PRO HB3 H 1 1.88 0.01 . 2 . . . . 98 PRO HB3 . 6626 1 1185 . 1 1 98 98 PRO HG2 H 1 1.86 0.01 . 1 . . . . 98 PRO HG2 . 6626 1 1186 . 1 1 98 98 PRO HG3 H 1 1.86 0.01 . 1 . . . . 98 PRO HG3 . 6626 1 1187 . 1 1 98 98 PRO HD2 H 1 3.84 0.01 . 2 . . . . 98 PRO HD2 . 6626 1 1188 . 1 1 98 98 PRO HD3 H 1 3.67 0.01 . 2 . . . . 98 PRO HD3 . 6626 1 1189 . 1 1 98 98 PRO C C 13 176.7 0.1 . 1 . . . . 98 PRO C . 6626 1 1190 . 1 1 98 98 PRO CA C 13 63.3 0.1 . 1 . . . . 98 PRO CA . 6626 1 1191 . 1 1 98 98 PRO CB C 13 32.3 0.1 . 1 . . . . 98 PRO CB . 6626 1 1192 . 1 1 98 98 PRO CG C 13 26.7 0.1 . 1 . . . . 98 PRO CG . 6626 1 1193 . 1 1 98 98 PRO CD C 13 50.9 0.1 . 1 . . . . 98 PRO CD . 6626 1 1194 . 1 1 99 99 ASP H H 1 7.39 0.01 . 1 . . . . 99 ASP HN . 6626 1 1195 . 1 1 99 99 ASP HA H 1 4.36 0.01 . 1 . . . . 99 ASP HA . 6626 1 1196 . 1 1 99 99 ASP HB2 H 1 2.59 0.01 . 2 . . . . 99 ASP HB2 . 6626 1 1197 . 1 1 99 99 ASP HB3 H 1 2.52 0.01 . 2 . . . . 99 ASP HB3 . 6626 1 1198 . 1 1 99 99 ASP C C 13 176.2 0.1 . 1 . . . . 99 ASP C . 6626 1 1199 . 1 1 99 99 ASP CA C 13 54.7 0.1 . 1 . . . . 99 ASP CA . 6626 1 1200 . 1 1 99 99 ASP CB C 13 43.0 0.1 . 1 . . . . 99 ASP CB . 6626 1 1201 . 1 1 99 99 ASP N N 15 115.6 0.1 . 1 . . . . 99 ASP N . 6626 1 1202 . 1 1 100 100 GLU H H 1 8.96 0.01 . 1 . . . . 100 GLU HN . 6626 1 1203 . 1 1 100 100 GLU HA H 1 3.70 0.01 . 1 . . . . 100 GLU HA . 6626 1 1204 . 1 1 100 100 GLU HB2 H 1 2.08 0.01 . 1 . . . . 100 GLU HB2 . 6626 1 1205 . 1 1 100 100 GLU HB3 H 1 2.08 0.01 . 1 . . . . 100 GLU HB3 . 6626 1 1206 . 1 1 100 100 GLU HG2 H 1 2.38 0.01 . 2 . . . . 100 GLU HG2 . 6626 1 1207 . 1 1 100 100 GLU HG3 H 1 2.29 0.01 . 2 . . . . 100 GLU HG3 . 6626 1 1208 . 1 1 100 100 GLU C C 13 178.3 0.1 . 1 . . . . 100 GLU C . 6626 1 1209 . 1 1 100 100 GLU CA C 13 60.1 0.1 . 1 . . . . 100 GLU CA . 6626 1 1210 . 1 1 100 100 GLU CB C 13 29.9 0.1 . 1 . . . . 100 GLU CB . 6626 1 1211 . 1 1 100 100 GLU CG C 13 36.4 0.1 . 1 . . . . 100 GLU CG . 6626 1 1212 . 1 1 100 100 GLU N N 15 124.6 0.1 . 1 . . . . 100 GLU N . 6626 1 1213 . 1 1 101 101 THR H H 1 8.07 0.01 . 1 . . . . 101 THR HN . 6626 1 1214 . 1 1 101 101 THR HA H 1 3.88 0.01 . 1 . . . . 101 THR HA . 6626 1 1215 . 1 1 101 101 THR HB H 1 4.27 0.01 . 1 . . . . 101 THR HB . 6626 1 1216 . 1 1 101 101 THR HG21 H 1 1.14 0.01 . 1 . . . . 101 THR HG2 . 6626 1 1217 . 1 1 101 101 THR HG22 H 1 1.14 0.01 . 1 . . . . 101 THR HG2 . 6626 1 1218 . 1 1 101 101 THR HG23 H 1 1.14 0.01 . 1 . . . . 101 THR HG2 . 6626 1 1219 . 1 1 101 101 THR C C 13 176.7 0.1 . 1 . . . . 101 THR C . 6626 1 1220 . 1 1 101 101 THR CA C 13 66.5 0.1 . 1 . . . . 101 THR CA . 6626 1 1221 . 1 1 101 101 THR CB C 13 67.8 0.1 . 1 . . . . 101 THR CB . 6626 1 1222 . 1 1 101 101 THR CG2 C 13 21.8 0.1 . 1 . . . . 101 THR CG2 . 6626 1 1223 . 1 1 101 101 THR N N 15 115.6 0.1 . 1 . . . . 101 THR N . 6626 1 1224 . 1 1 102 102 GLU H H 1 8.40 0.01 . 1 . . . . 102 GLU HN . 6626 1 1225 . 1 1 102 102 GLU HA H 1 4.03 0.01 . 1 . . . . 102 GLU HA . 6626 1 1226 . 1 1 102 102 GLU HB2 H 1 1.92 0.01 . 1 . . . . 102 GLU HB2 . 6626 1 1227 . 1 1 102 102 GLU HB3 H 1 1.92 0.01 . 1 . . . . 102 GLU HB3 . 6626 1 1228 . 1 1 102 102 GLU HG2 H 1 2.29 0.01 . 2 . . . . 102 GLU HG2 . 6626 1 1229 . 1 1 102 102 GLU HG3 H 1 2.10 0.01 . 2 . . . . 102 GLU HG3 . 6626 1 1230 . 1 1 102 102 GLU C C 13 180.0 0.1 . 1 . . . . 102 GLU C . 6626 1 1231 . 1 1 102 102 GLU CA C 13 58.8 0.1 . 1 . . . . 102 GLU CA . 6626 1 1232 . 1 1 102 102 GLU CB C 13 29.6 0.1 . 1 . . . . 102 GLU CB . 6626 1 1233 . 1 1 102 102 GLU CG C 13 36.3 0.1 . 1 . . . . 102 GLU CG . 6626 1 1234 . 1 1 102 102 GLU N N 15 122.7 0.1 . 1 . . . . 102 GLU N . 6626 1 1235 . 1 1 103 103 ALA H H 1 8.84 0.01 . 1 . . . . 103 ALA HN . 6626 1 1236 . 1 1 103 103 ALA HA H 1 3.52 0.01 . 1 . . . . 103 ALA HA . 6626 1 1237 . 1 1 103 103 ALA HB1 H 1 0.84 0.01 . 1 . . . . 103 ALA HB . 6626 1 1238 . 1 1 103 103 ALA HB2 H 1 0.84 0.01 . 1 . . . . 103 ALA HB . 6626 1 1239 . 1 1 103 103 ALA HB3 H 1 0.84 0.01 . 1 . . . . 103 ALA HB . 6626 1 1240 . 1 1 103 103 ALA C C 13 178.4 0.1 . 1 . . . . 103 ALA C . 6626 1 1241 . 1 1 103 103 ALA CA C 13 56.3 0.1 . 1 . . . . 103 ALA CA . 6626 1 1242 . 1 1 103 103 ALA CB C 13 16.9 0.1 . 1 . . . . 103 ALA CB . 6626 1 1243 . 1 1 103 103 ALA N N 15 121.6 0.1 . 1 . . . . 103 ALA N . 6626 1 1244 . 1 1 104 104 LYS H H 1 7.93 0.01 . 1 . . . . 104 LYS HN . 6626 1 1245 . 1 1 104 104 LYS HA H 1 4.03 0.01 . 1 . . . . 104 LYS HA . 6626 1 1246 . 1 1 104 104 LYS HB2 H 1 2.00 0.01 . 1 . . . . 104 LYS HB2 . 6626 1 1247 . 1 1 104 104 LYS HB3 H 1 2.00 0.01 . 1 . . . . 104 LYS HB3 . 6626 1 1248 . 1 1 104 104 LYS HG2 H 1 1.54 0.01 . 2 . . . . 104 LYS HG2 . 6626 1 1249 . 1 1 104 104 LYS HG3 H 1 1.44 0.01 . 2 . . . . 104 LYS HG3 . 6626 1 1250 . 1 1 104 104 LYS HD2 H 1 1.81 0.01 . 1 . . . . 104 LYS HD2 . 6626 1 1251 . 1 1 104 104 LYS HD3 H 1 1.81 0.01 . 1 . . . . 104 LYS HD3 . 6626 1 1252 . 1 1 104 104 LYS HE2 H 1 2.99 0.01 . 1 . . . . 104 LYS HE2 . 6626 1 1253 . 1 1 104 104 LYS HE3 H 1 2.99 0.01 . 1 . . . . 104 LYS HE3 . 6626 1 1254 . 1 1 104 104 LYS C C 13 177.7 0.1 . 1 . . . . 104 LYS C . 6626 1 1255 . 1 1 104 104 LYS CA C 13 59.8 0.1 . 1 . . . . 104 LYS CA . 6626 1 1256 . 1 1 104 104 LYS CB C 13 31.9 0.1 . 1 . . . . 104 LYS CB . 6626 1 1257 . 1 1 104 104 LYS CG C 13 25.2 0.1 . 1 . . . . 104 LYS CG . 6626 1 1258 . 1 1 104 104 LYS CE C 13 42.3 0.1 . 1 . . . . 104 LYS CE . 6626 1 1259 . 1 1 104 104 LYS N N 15 115.7 0.1 . 1 . . . . 104 LYS N . 6626 1 1260 . 1 1 105 105 HIS H H 1 7.66 0.01 . 1 . . . . 105 HIS HN . 6626 1 1261 . 1 1 105 105 HIS HA H 1 4.33 0.01 . 1 . . . . 105 HIS HA . 6626 1 1262 . 1 1 105 105 HIS HB2 H 1 3.24 0.01 . 2 . . . . 105 HIS HB2 . 6626 1 1263 . 1 1 105 105 HIS HB3 H 1 3.14 0.01 . 2 . . . . 105 HIS HB3 . 6626 1 1264 . 1 1 105 105 HIS HD2 H 1 6.77 0.01 . 1 . . . . 105 HIS HD2 . 6626 1 1265 . 1 1 105 105 HIS C C 13 177.4 0.1 . 1 . . . . 105 HIS C . 6626 1 1266 . 1 1 105 105 HIS CA C 13 59.4 0.1 . 1 . . . . 105 HIS CA . 6626 1 1267 . 1 1 105 105 HIS CB C 13 29.8 0.1 . 1 . . . . 105 HIS CB . 6626 1 1268 . 1 1 105 105 HIS CD2 C 13 119.5 0.1 . 1 . . . . 105 HIS CD2 . 6626 1 1269 . 1 1 105 105 HIS N N 15 114.9 0.1 . 1 . . . . 105 HIS N . 6626 1 1270 . 1 1 106 106 ASN H H 1 7.36 0.01 . 1 . . . . 106 ASN HN . 6626 1 1271 . 1 1 106 106 ASN HA H 1 4.20 0.01 . 1 . . . . 106 ASN HA . 6626 1 1272 . 1 1 106 106 ASN HB2 H 1 2.88 0.01 . 2 . . . . 106 ASN HB2 . 6626 1 1273 . 1 1 106 106 ASN HB3 H 1 2.45 0.01 . 2 . . . . 106 ASN HB3 . 6626 1 1274 . 1 1 106 106 ASN HD21 H 1 6.87 0.01 . 2 . . . . 106 ASN HD21 . 6626 1 1275 . 1 1 106 106 ASN HD22 H 1 7.18 0.01 . 2 . . . . 106 ASN HD22 . 6626 1 1276 . 1 1 106 106 ASN C C 13 177.2 0.1 . 1 . . . . 106 ASN C . 6626 1 1277 . 1 1 106 106 ASN CA C 13 57.5 0.1 . 1 . . . . 106 ASN CA . 6626 1 1278 . 1 1 106 106 ASN CB C 13 40.3 0.1 . 1 . . . . 106 ASN CB . 6626 1 1279 . 1 1 106 106 ASN N N 15 114.5 0.1 . 1 . . . . 106 ASN N . 6626 1 1280 . 1 1 106 106 ASN ND2 N 15 109.3 0.1 . 1 . . . . 106 ASN ND2 . 6626 1 1281 . 1 1 107 107 PHE H H 1 9.08 0.01 . 1 . . . . 107 PHE HN . 6626 1 1282 . 1 1 107 107 PHE HA H 1 4.45 0.01 . 1 . . . . 107 PHE HA . 6626 1 1283 . 1 1 107 107 PHE HB2 H 1 3.32 0.01 . 2 . . . . 107 PHE HB2 . 6626 1 1284 . 1 1 107 107 PHE HB3 H 1 3.00 0.01 . 2 . . . . 107 PHE HB3 . 6626 1 1285 . 1 1 107 107 PHE HD1 H 1 6.95 0.01 . 1 . . . . 107 PHE HD1 . 6626 1 1286 . 1 1 107 107 PHE HD2 H 1 6.95 0.01 . 1 . . . . 107 PHE HD2 . 6626 1 1287 . 1 1 107 107 PHE C C 13 178.9 0.1 . 1 . . . . 107 PHE C . 6626 1 1288 . 1 1 107 107 PHE CA C 13 60.5 0.1 . 1 . . . . 107 PHE CA . 6626 1 1289 . 1 1 107 107 PHE CB C 13 37.8 0.1 . 1 . . . . 107 PHE CB . 6626 1 1290 . 1 1 107 107 PHE CD1 C 13 130.9 0.1 . 1 . . . . 107 PHE CD1 . 6626 1 1291 . 1 1 107 107 PHE N N 15 119.1 0.1 . 1 . . . . 107 PHE N . 6626 1 1292 . 1 1 108 108 ASP H H 1 8.93 0.01 . 1 . . . . 108 ASP HN . 6626 1 1293 . 1 1 108 108 ASP HA H 1 4.37 0.01 . 1 . . . . 108 ASP HA . 6626 1 1294 . 1 1 108 108 ASP HB2 H 1 2.81 0.01 . 2 . . . . 108 ASP HB2 . 6626 1 1295 . 1 1 108 108 ASP HB3 H 1 2.52 0.01 . 2 . . . . 108 ASP HB3 . 6626 1 1296 . 1 1 108 108 ASP C C 13 179.6 0.1 . 1 . . . . 108 ASP C . 6626 1 1297 . 1 1 108 108 ASP CA C 13 57.6 0.1 . 1 . . . . 108 ASP CA . 6626 1 1298 . 1 1 108 108 ASP CB C 13 39.3 0.1 . 1 . . . . 108 ASP CB . 6626 1 1299 . 1 1 108 108 ASP N N 15 120.0 0.1 . 1 . . . . 108 ASP N . 6626 1 1300 . 1 1 109 109 LEU H H 1 7.31 0.01 . 1 . . . . 109 LEU HN . 6626 1 1301 . 1 1 109 109 LEU HA H 1 3.77 0.01 . 1 . . . . 109 LEU HA . 6626 1 1302 . 1 1 109 109 LEU HB2 H 1 1.12 0.01 . 2 . . . . 109 LEU HB2 . 6626 1 1303 . 1 1 109 109 LEU HB3 H 1 0.32 0.01 . 2 . . . . 109 LEU HB3 . 6626 1 1304 . 1 1 109 109 LEU HG H 1 1.08 0.01 . 1 . . . . 109 LEU HG . 6626 1 1305 . 1 1 109 109 LEU HD11 H 1 0.22 0.01 . 2 . . . . 109 LEU HD1 . 6626 1 1306 . 1 1 109 109 LEU HD12 H 1 0.22 0.01 . 2 . . . . 109 LEU HD1 . 6626 1 1307 . 1 1 109 109 LEU HD13 H 1 0.22 0.01 . 2 . . . . 109 LEU HD1 . 6626 1 1308 . 1 1 109 109 LEU HD21 H 1 0.47 0.01 . 2 . . . . 109 LEU HD2 . 6626 1 1309 . 1 1 109 109 LEU HD22 H 1 0.47 0.01 . 2 . . . . 109 LEU HD2 . 6626 1 1310 . 1 1 109 109 LEU HD23 H 1 0.47 0.01 . 2 . . . . 109 LEU HD2 . 6626 1 1311 . 1 1 109 109 LEU C C 13 178.6 0.1 . 1 . . . . 109 LEU C . 6626 1 1312 . 1 1 109 109 LEU CA C 13 58.0 0.1 . 1 . . . . 109 LEU CA . 6626 1 1313 . 1 1 109 109 LEU CB C 13 40.9 0.1 . 1 . . . . 109 LEU CB . 6626 1 1314 . 1 1 109 109 LEU CG C 13 26.8 0.1 . 1 . . . . 109 LEU CG . 6626 1 1315 . 1 1 109 109 LEU CD1 C 13 25.1 0.1 . 1 . . . . 109 LEU CD1 . 6626 1 1316 . 1 1 109 109 LEU CD2 C 13 22.9 0.1 . 1 . . . . 109 LEU CD2 . 6626 1 1317 . 1 1 109 109 LEU N N 15 120.5 0.1 . 1 . . . . 109 LEU N . 6626 1 1318 . 1 1 110 110 ALA H H 1 8.32 0.01 . 1 . . . . 110 ALA HN . 6626 1 1319 . 1 1 110 110 ALA HA H 1 3.80 0.01 . 1 . . . . 110 ALA HA . 6626 1 1320 . 1 1 110 110 ALA HB1 H 1 1.54 0.01 . 1 . . . . 110 ALA HB . 6626 1 1321 . 1 1 110 110 ALA HB2 H 1 1.54 0.01 . 1 . . . . 110 ALA HB . 6626 1 1322 . 1 1 110 110 ALA HB3 H 1 1.54 0.01 . 1 . . . . 110 ALA HB . 6626 1 1323 . 1 1 110 110 ALA C C 13 178.7 0.1 . 1 . . . . 110 ALA C . 6626 1 1324 . 1 1 110 110 ALA CA C 13 56.2 0.1 . 1 . . . . 110 ALA CA . 6626 1 1325 . 1 1 110 110 ALA CB C 13 18.6 0.1 . 1 . . . . 110 ALA CB . 6626 1 1326 . 1 1 110 110 ALA N N 15 118.6 0.1 . 1 . . . . 110 ALA N . 6626 1 1327 . 1 1 111 111 THR H H 1 8.47 0.01 . 1 . . . . 111 THR HN . 6626 1 1328 . 1 1 111 111 THR HA H 1 3.86 0.01 . 1 . . . . 111 THR HA . 6626 1 1329 . 1 1 111 111 THR HB H 1 4.36 0.01 . 1 . . . . 111 THR HB . 6626 1 1330 . 1 1 111 111 THR HG1 H 1 5.14 0.01 . 1 . . . . 111 THR HG1 . 6626 1 1331 . 1 1 111 111 THR HG21 H 1 1.24 0.01 . 1 . . . . 111 THR HG2 . 6626 1 1332 . 1 1 111 111 THR HG22 H 1 1.24 0.01 . 1 . . . . 111 THR HG2 . 6626 1 1333 . 1 1 111 111 THR HG23 H 1 1.24 0.01 . 1 . . . . 111 THR HG2 . 6626 1 1334 . 1 1 111 111 THR C C 13 175.2 0.1 . 1 . . . . 111 THR C . 6626 1 1335 . 1 1 111 111 THR CA C 13 67.8 0.1 . 1 . . . . 111 THR CA . 6626 1 1336 . 1 1 111 111 THR CB C 13 68.8 0.1 . 1 . . . . 111 THR CB . 6626 1 1337 . 1 1 111 111 THR CG2 C 13 21.8 0.1 . 1 . . . . 111 THR CG2 . 6626 1 1338 . 1 1 111 111 THR N N 15 110.7 0.1 . 1 . . . . 111 THR N . 6626 1 1339 . 1 1 112 112 GLN H H 1 7.49 0.01 . 1 . . . . 112 GLN HN . 6626 1 1340 . 1 1 112 112 GLN HA H 1 3.90 0.01 . 1 . . . . 112 GLN HA . 6626 1 1341 . 1 1 112 112 GLN HB2 H 1 2.00 0.01 . 2 . . . . 112 GLN HB2 . 6626 1 1342 . 1 1 112 112 GLN HB3 H 1 1.94 0.01 . 2 . . . . 112 GLN HB3 . 6626 1 1343 . 1 1 112 112 GLN HG2 H 1 2.22 0.01 . 2 . . . . 112 GLN HG2 . 6626 1 1344 . 1 1 112 112 GLN HG3 H 1 1.98 0.01 . 2 . . . . 112 GLN HG3 . 6626 1 1345 . 1 1 112 112 GLN HE21 H 1 6.84 0.01 . 2 . . . . 112 GLN HE21 . 6626 1 1346 . 1 1 112 112 GLN HE22 H 1 6.53 0.01 . 2 . . . . 112 GLN HE22 . 6626 1 1347 . 1 1 112 112 GLN C C 13 179.4 0.1 . 1 . . . . 112 GLN C . 6626 1 1348 . 1 1 112 112 GLN CA C 13 59.3 0.1 . 1 . . . . 112 GLN CA . 6626 1 1349 . 1 1 112 112 GLN CB C 13 28.4 0.1 . 1 . . . . 112 GLN CB . 6626 1 1350 . 1 1 112 112 GLN CG C 13 33.7 0.1 . 1 . . . . 112 GLN CG . 6626 1 1351 . 1 1 112 112 GLN N N 15 117.5 0.1 . 1 . . . . 112 GLN N . 6626 1 1352 . 1 1 112 112 GLN NE2 N 15 108.6 0.1 . 1 . . . . 112 GLN NE2 . 6626 1 1353 . 1 1 113 113 PHE H H 1 7.79 0.01 . 1 . . . . 113 PHE HN . 6626 1 1354 . 1 1 113 113 PHE HA H 1 3.98 0.01 . 1 . . . . 113 PHE HA . 6626 1 1355 . 1 1 113 113 PHE HB2 H 1 2.37 0.01 . 2 . . . . 113 PHE HB2 . 6626 1 1356 . 1 1 113 113 PHE HB3 H 1 3.19 0.01 . 2 . . . . 113 PHE HB3 . 6626 1 1357 . 1 1 113 113 PHE HD1 H 1 7.34 0.01 . 1 . . . . 113 PHE HD1 . 6626 1 1358 . 1 1 113 113 PHE HD2 H 1 7.34 0.01 . 1 . . . . 113 PHE HD2 . 6626 1 1359 . 1 1 113 113 PHE HE1 H 1 7.17 0.01 . 1 . . . . 113 PHE HE1 . 6626 1 1360 . 1 1 113 113 PHE HE2 H 1 7.17 0.01 . 1 . . . . 113 PHE HE2 . 6626 1 1361 . 1 1 113 113 PHE C C 13 178.0 0.1 . 1 . . . . 113 PHE C . 6626 1 1362 . 1 1 113 113 PHE CA C 13 63.2 0.1 . 1 . . . . 113 PHE CA . 6626 1 1363 . 1 1 113 113 PHE CB C 13 38.0 0.1 . 1 . . . . 113 PHE CB . 6626 1 1364 . 1 1 113 113 PHE CD1 C 13 132.0 0.1 . 1 . . . . 113 PHE CD1 . 6626 1 1365 . 1 1 113 113 PHE CE1 C 13 131.9 0.1 . 1 . . . . 113 PHE CE1 . 6626 1 1366 . 1 1 113 113 PHE N N 15 117.1 0.1 . 1 . . . . 113 PHE N . 6626 1 1367 . 1 1 114 114 PHE H H 1 9.11 0.01 . 1 . . . . 114 PHE HN . 6626 1 1368 . 1 1 114 114 PHE HA H 1 4.78 0.01 . 1 . . . . 114 PHE HA . 6626 1 1369 . 1 1 114 114 PHE HB2 H 1 3.15 0.01 . 2 . . . . 114 PHE HB2 . 6626 1 1370 . 1 1 114 114 PHE HB3 H 1 3.04 0.01 . 2 . . . . 114 PHE HB3 . 6626 1 1371 . 1 1 114 114 PHE HD1 H 1 7.12 0.01 . 1 . . . . 114 PHE HD1 . 6626 1 1372 . 1 1 114 114 PHE HD2 H 1 7.12 0.01 . 1 . . . . 114 PHE HD2 . 6626 1 1373 . 1 1 114 114 PHE HE1 H 1 7.11 0.01 . 1 . . . . 114 PHE HE1 . 6626 1 1374 . 1 1 114 114 PHE HE2 H 1 7.11 0.01 . 1 . . . . 114 PHE HE2 . 6626 1 1375 . 1 1 114 114 PHE C C 13 179.7 0.1 . 1 . . . . 114 PHE C . 6626 1 1376 . 1 1 114 114 PHE CA C 13 58.8 0.1 . 1 . . . . 114 PHE CA . 6626 1 1377 . 1 1 114 114 PHE CB C 13 38.1 0.1 . 1 . . . . 114 PHE CB . 6626 1 1378 . 1 1 114 114 PHE CE1 C 13 130.3 0.1 . 1 . . . . 114 PHE CE1 . 6626 1 1379 . 1 1 114 114 PHE N N 15 116.4 0.1 . 1 . . . . 114 PHE N . 6626 1 1380 . 1 1 115 115 GLN H H 1 9.05 0.01 . 1 . . . . 115 GLN HN . 6626 1 1381 . 1 1 115 115 GLN HA H 1 3.95 0.01 . 1 . . . . 115 GLN HA . 6626 1 1382 . 1 1 115 115 GLN HB2 H 1 2.23 0.01 . 2 . . . . 115 GLN HB2 . 6626 1 1383 . 1 1 115 115 GLN HB3 H 1 2.11 0.01 . 2 . . . . 115 GLN HB3 . 6626 1 1384 . 1 1 115 115 GLN HG2 H 1 2.25 0.01 . 1 . . . . 115 GLN HG2 . 6626 1 1385 . 1 1 115 115 GLN HG3 H 1 2.25 0.01 . 1 . . . . 115 GLN HG3 . 6626 1 1386 . 1 1 115 115 GLN HE21 H 1 7.51 0.01 . 2 . . . . 115 GLN HE21 . 6626 1 1387 . 1 1 115 115 GLN HE22 H 1 6.78 0.01 . 2 . . . . 115 GLN HE22 . 6626 1 1388 . 1 1 115 115 GLN C C 13 177.1 0.1 . 1 . . . . 115 GLN C . 6626 1 1389 . 1 1 115 115 GLN CA C 13 58.5 0.1 . 1 . . . . 115 GLN CA . 6626 1 1390 . 1 1 115 115 GLN CB C 13 28.7 0.1 . 1 . . . . 115 GLN CB . 6626 1 1391 . 1 1 115 115 GLN CG C 13 34.1 0.1 . 1 . . . . 115 GLN CG . 6626 1 1392 . 1 1 115 115 GLN N N 15 117.7 0.1 . 1 . . . . 115 GLN N . 6626 1 1393 . 1 1 115 115 GLN NE2 N 15 112.8 0.1 . 1 . . . . 115 GLN NE2 . 6626 1 1394 . 1 1 116 116 GLN H H 1 7.67 0.01 . 1 . . . . 116 GLN HN . 6626 1 1395 . 1 1 116 116 GLN HA H 1 4.07 0.01 . 1 . . . . 116 GLN HA . 6626 1 1396 . 1 1 116 116 GLN HB2 H 1 2.10 0.01 . 1 . . . . 116 GLN HB2 . 6626 1 1397 . 1 1 116 116 GLN HB3 H 1 2.10 0.01 . 1 . . . . 116 GLN HB3 . 6626 1 1398 . 1 1 116 116 GLN HG2 H 1 2.52 0.01 . 2 . . . . 116 GLN HG2 . 6626 1 1399 . 1 1 116 116 GLN HG3 H 1 2.26 0.01 . 2 . . . . 116 GLN HG3 . 6626 1 1400 . 1 1 116 116 GLN HE21 H 1 6.43 0.01 . 2 . . . . 116 GLN HE21 . 6626 1 1401 . 1 1 116 116 GLN HE22 H 1 7.39 0.01 . 2 . . . . 116 GLN HE22 . 6626 1 1402 . 1 1 116 116 GLN C C 13 178.1 0.1 . 1 . . . . 116 GLN C . 6626 1 1403 . 1 1 116 116 GLN CA C 13 59.1 0.1 . 1 . . . . 116 GLN CA . 6626 1 1404 . 1 1 116 116 GLN CB C 13 27.9 0.1 . 1 . . . . 116 GLN CB . 6626 1 1405 . 1 1 116 116 GLN CG C 13 33.7 0.1 . 1 . . . . 116 GLN CG . 6626 1 1406 . 1 1 116 116 GLN N N 15 117.7 0.1 . 1 . . . . 116 GLN N . 6626 1 1407 . 1 1 116 116 GLN NE2 N 15 107.8 0.1 . 1 . . . . 116 GLN NE2 . 6626 1 1408 . 1 1 117 117 ALA H H 1 8.14 0.01 . 1 . . . . 117 ALA HN . 6626 1 1409 . 1 1 117 117 ALA HA H 1 3.81 0.01 . 1 . . . . 117 ALA HA . 6626 1 1410 . 1 1 117 117 ALA HB1 H 1 1.07 0.01 . 1 . . . . 117 ALA HB . 6626 1 1411 . 1 1 117 117 ALA HB2 H 1 1.07 0.01 . 1 . . . . 117 ALA HB . 6626 1 1412 . 1 1 117 117 ALA HB3 H 1 1.07 0.01 . 1 . . . . 117 ALA HB . 6626 1 1413 . 1 1 117 117 ALA C C 13 178.8 0.1 . 1 . . . . 117 ALA C . 6626 1 1414 . 1 1 117 117 ALA CA C 13 56.1 0.1 . 1 . . . . 117 ALA CA . 6626 1 1415 . 1 1 117 117 ALA CB C 13 16.1 0.1 . 1 . . . . 117 ALA CB . 6626 1 1416 . 1 1 117 117 ALA N N 15 119.7 0.1 . 1 . . . . 117 ALA N . 6626 1 1417 . 1 1 118 118 VAL H H 1 7.70 0.01 . 1 . . . . 118 VAL HN . 6626 1 1418 . 1 1 118 118 VAL HA H 1 3.68 0.01 . 1 . . . . 118 VAL HA . 6626 1 1419 . 1 1 118 118 VAL HB H 1 2.14 0.01 . 1 . . . . 118 VAL HB . 6626 1 1420 . 1 1 118 118 VAL HG11 H 1 1.05 0.01 . 2 . . . . 118 VAL HG1 . 6626 1 1421 . 1 1 118 118 VAL HG12 H 1 1.05 0.01 . 2 . . . . 118 VAL HG1 . 6626 1 1422 . 1 1 118 118 VAL HG13 H 1 1.05 0.01 . 2 . . . . 118 VAL HG1 . 6626 1 1423 . 1 1 118 118 VAL HG21 H 1 0.94 0.01 . 2 . . . . 118 VAL HG2 . 6626 1 1424 . 1 1 118 118 VAL HG22 H 1 0.94 0.01 . 2 . . . . 118 VAL HG2 . 6626 1 1425 . 1 1 118 118 VAL HG23 H 1 0.94 0.01 . 2 . . . . 118 VAL HG2 . 6626 1 1426 . 1 1 118 118 VAL C C 13 177.0 0.1 . 1 . . . . 118 VAL C . 6626 1 1427 . 1 1 118 118 VAL CA C 13 66.0 0.1 . 1 . . . . 118 VAL CA . 6626 1 1428 . 1 1 118 118 VAL CB C 13 31.9 0.1 . 1 . . . . 118 VAL CB . 6626 1 1429 . 1 1 118 118 VAL CG1 C 13 25.2 0.1 . 1 . . . . 118 VAL CG1 . 6626 1 1430 . 1 1 118 118 VAL CG2 C 13 21.6 0.1 . 1 . . . . 118 VAL CG2 . 6626 1 1431 . 1 1 118 118 VAL N N 15 115.7 0.1 . 1 . . . . 118 VAL N . 6626 1 1432 . 1 1 119 119 ASP H H 1 8.38 0.01 . 1 . . . . 119 ASP HN . 6626 1 1433 . 1 1 119 119 ASP HA H 1 4.26 0.01 . 1 . . . . 119 ASP HA . 6626 1 1434 . 1 1 119 119 ASP HB2 H 1 2.88 0.01 . 2 . . . . 119 ASP HB2 . 6626 1 1435 . 1 1 119 119 ASP HB3 H 1 2.58 0.01 . 2 . . . . 119 ASP HB3 . 6626 1 1436 . 1 1 119 119 ASP C C 13 179.4 0.1 . 1 . . . . 119 ASP C . 6626 1 1437 . 1 1 119 119 ASP CA C 13 57.0 0.1 . 1 . . . . 119 ASP CA . 6626 1 1438 . 1 1 119 119 ASP CB C 13 40.2 0.1 . 1 . . . . 119 ASP CB . 6626 1 1439 . 1 1 119 119 ASP N N 15 115.5 0.1 . 1 . . . . 119 ASP N . 6626 1 1440 . 1 1 120 120 GLU H H 1 7.67 0.01 . 1 . . . . 120 GLU HN . 6626 1 1441 . 1 1 120 120 GLU HA H 1 4.25 0.01 . 1 . . . . 120 GLU HA . 6626 1 1442 . 1 1 120 120 GLU HB2 H 1 2.32 0.01 . 2 . . . . 120 GLU HB2 . 6626 1 1443 . 1 1 120 120 GLU HB3 H 1 2.18 0.01 . 2 . . . . 120 GLU HB3 . 6626 1 1444 . 1 1 120 120 GLU HG2 H 1 2.58 0.01 . 2 . . . . 120 GLU HG2 . 6626 1 1445 . 1 1 120 120 GLU HG3 H 1 2.42 0.01 . 2 . . . . 120 GLU HG3 . 6626 1 1446 . 1 1 120 120 GLU C C 13 177.6 0.1 . 1 . . . . 120 GLU C . 6626 1 1447 . 1 1 120 120 GLU CA C 13 57.7 0.1 . 1 . . . . 120 GLU CA . 6626 1 1448 . 1 1 120 120 GLU CB C 13 30.7 0.1 . 1 . . . . 120 GLU CB . 6626 1 1449 . 1 1 120 120 GLU CG C 13 35.9 0.1 . 1 . . . . 120 GLU CG . 6626 1 1450 . 1 1 120 120 GLU N N 15 114.6 0.1 . 1 . . . . 120 GLU N . 6626 1 1451 . 1 1 121 121 GLN H H 1 7.98 0.01 . 1 . . . . 121 GLN HN . 6626 1 1452 . 1 1 121 121 GLN HA H 1 4.90 0.01 . 1 . . . . 121 GLN HA . 6626 1 1453 . 1 1 121 121 GLN HB2 H 1 2.16 0.01 . 2 . . . . 121 GLN HB2 . 6626 1 1454 . 1 1 121 121 GLN HB3 H 1 2.09 0.01 . 2 . . . . 121 GLN HB3 . 6626 1 1455 . 1 1 121 121 GLN HG2 H 1 2.62 0.01 . 2 . . . . 121 GLN HG2 . 6626 1 1456 . 1 1 121 121 GLN HG3 H 1 2.25 0.01 . 2 . . . . 121 GLN HG3 . 6626 1 1457 . 1 1 121 121 GLN HE21 H 1 6.80 0.01 . 2 . . . . 121 GLN HE21 . 6626 1 1458 . 1 1 121 121 GLN HE22 H 1 7.93 0.01 . 2 . . . . 121 GLN HE22 . 6626 1 1459 . 1 1 121 121 GLN CA C 13 52.7 0.1 . 1 . . . . 121 GLN CA . 6626 1 1460 . 1 1 121 121 GLN CB C 13 29.6 0.1 . 1 . . . . 121 GLN CB . 6626 1 1461 . 1 1 121 121 GLN CG C 13 32.7 0.1 . 1 . . . . 121 GLN CG . 6626 1 1462 . 1 1 121 121 GLN N N 15 115.5 0.1 . 1 . . . . 121 GLN N . 6626 1 1463 . 1 1 121 121 GLN NE2 N 15 110.8 0.1 . 1 . . . . 121 GLN NE2 . 6626 1 1464 . 1 1 122 122 PRO HA H 1 4.68 0.01 . 1 . . . . 122 PRO HA . 6626 1 1465 . 1 1 122 122 PRO HB2 H 1 2.36 0.01 . 2 . . . . 122 PRO HB2 . 6626 1 1466 . 1 1 122 122 PRO HB3 H 1 1.88 0.01 . 2 . . . . 122 PRO HB3 . 6626 1 1467 . 1 1 122 122 PRO HG2 H 1 2.01 0.01 . 2 . . . . 122 PRO HG2 . 6626 1 1468 . 1 1 122 122 PRO HG3 H 1 1.82 0.01 . 2 . . . . 122 PRO HG3 . 6626 1 1469 . 1 1 122 122 PRO HD2 H 1 3.62 0.01 . 2 . . . . 122 PRO HD2 . 6626 1 1470 . 1 1 122 122 PRO HD3 H 1 3.41 0.01 . 2 . . . . 122 PRO HD3 . 6626 1 1471 . 1 1 122 122 PRO C C 13 176.9 0.1 . 1 . . . . 122 PRO C . 6626 1 1472 . 1 1 122 122 PRO CA C 13 64.8 0.1 . 1 . . . . 122 PRO CA . 6626 1 1473 . 1 1 122 122 PRO CB C 13 32.3 0.1 . 1 . . . . 122 PRO CB . 6626 1 1474 . 1 1 122 122 PRO CG C 13 27.0 0.1 . 1 . . . . 122 PRO CG . 6626 1 1475 . 1 1 122 122 PRO CD C 13 50.3 0.1 . 1 . . . . 122 PRO CD . 6626 1 1476 . 1 1 123 123 ASP H H 1 8.05 0.01 . 1 . . . . 123 ASP HN . 6626 1 1477 . 1 1 123 123 ASP HA H 1 4.70 0.01 . 1 . . . . 123 ASP HA . 6626 1 1478 . 1 1 123 123 ASP HB2 H 1 2.64 0.01 . 2 . . . . 123 ASP HB2 . 6626 1 1479 . 1 1 123 123 ASP HB3 H 1 2.56 0.01 . 2 . . . . 123 ASP HB3 . 6626 1 1480 . 1 1 123 123 ASP C C 13 176.2 0.1 . 1 . . . . 123 ASP C . 6626 1 1481 . 1 1 123 123 ASP CA C 13 52.8 0.1 . 1 . . . . 123 ASP CA . 6626 1 1482 . 1 1 123 123 ASP CB C 13 41.1 0.1 . 1 . . . . 123 ASP CB . 6626 1 1483 . 1 1 123 123 ASP N N 15 112.0 0.1 . 1 . . . . 123 ASP N . 6626 1 1484 . 1 1 124 124 ASN H H 1 7.63 0.01 . 1 . . . . 124 ASN HN . 6626 1 1485 . 1 1 124 124 ASN HA H 1 4.34 0.01 . 1 . . . . 124 ASN HA . 6626 1 1486 . 1 1 124 124 ASN HB2 H 1 2.65 0.01 . 2 . . . . 124 ASN HB2 . 6626 1 1487 . 1 1 124 124 ASN HB3 H 1 2.21 0.01 . 2 . . . . 124 ASN HB3 . 6626 1 1488 . 1 1 124 124 ASN HD21 H 1 6.67 0.01 . 2 . . . . 124 ASN HD21 . 6626 1 1489 . 1 1 124 124 ASN HD22 H 1 6.07 0.01 . 2 . . . . 124 ASN HD22 . 6626 1 1490 . 1 1 124 124 ASN C C 13 175.8 0.1 . 1 . . . . 124 ASN C . 6626 1 1491 . 1 1 124 124 ASN CA C 13 53.7 0.1 . 1 . . . . 124 ASN CA . 6626 1 1492 . 1 1 124 124 ASN CB C 13 38.3 0.1 . 1 . . . . 124 ASN CB . 6626 1 1493 . 1 1 124 124 ASN N N 15 118.0 0.1 . 1 . . . . 124 ASN N . 6626 1 1494 . 1 1 124 124 ASN ND2 N 15 110.4 0.1 . 1 . . . . 124 ASN ND2 . 6626 1 1495 . 1 1 125 125 THR H H 1 8.28 0.01 . 1 . . . . 125 THR HN . 6626 1 1496 . 1 1 125 125 THR HA H 1 3.78 0.01 . 1 . . . . 125 THR HA . 6626 1 1497 . 1 1 125 125 THR HB H 1 3.95 0.01 . 1 . . . . 125 THR HB . 6626 1 1498 . 1 1 125 125 THR HG21 H 1 1.10 0.01 . 1 . . . . 125 THR HG2 . 6626 1 1499 . 1 1 125 125 THR HG22 H 1 1.10 0.01 . 1 . . . . 125 THR HG2 . 6626 1 1500 . 1 1 125 125 THR HG23 H 1 1.10 0.01 . 1 . . . . 125 THR HG2 . 6626 1 1501 . 1 1 125 125 THR C C 13 176.3 0.1 . 1 . . . . 125 THR C . 6626 1 1502 . 1 1 125 125 THR CA C 13 65.3 0.1 . 1 . . . . 125 THR CA . 6626 1 1503 . 1 1 125 125 THR CB C 13 68.4 0.1 . 1 . . . . 125 THR CB . 6626 1 1504 . 1 1 125 125 THR CG2 C 13 21.7 0.1 . 1 . . . . 125 THR CG2 . 6626 1 1505 . 1 1 125 125 THR N N 15 118.5 0.1 . 1 . . . . 125 THR N . 6626 1 1506 . 1 1 126 126 HIS H H 1 7.74 0.01 . 1 . . . . 126 HIS HN . 6626 1 1507 . 1 1 126 126 HIS HA H 1 4.33 0.01 . 1 . . . . 126 HIS HA . 6626 1 1508 . 1 1 126 126 HIS HB2 H 1 2.78 0.01 . 1 . . . . 126 HIS HB2 . 6626 1 1509 . 1 1 126 126 HIS HB3 H 1 2.78 0.01 . 1 . . . . 126 HIS HB3 . 6626 1 1510 . 1 1 126 126 HIS HD2 H 1 6.62 0.01 . 1 . . . . 126 HIS HD2 . 6626 1 1511 . 1 1 126 126 HIS C C 13 178.4 0.1 . 1 . . . . 126 HIS C . 6626 1 1512 . 1 1 126 126 HIS CA C 13 58.7 0.1 . 1 . . . . 126 HIS CA . 6626 1 1513 . 1 1 126 126 HIS CB C 13 29.3 0.1 . 1 . . . . 126 HIS CB . 6626 1 1514 . 1 1 126 126 HIS CD2 C 13 119.2 0.1 . 1 . . . . 126 HIS CD2 . 6626 1 1515 . 1 1 126 126 HIS N N 15 120.6 0.1 . 1 . . . . 126 HIS N . 6626 1 1516 . 1 1 127 127 TYR H H 1 7.77 0.01 . 1 . . . . 127 TYR HN . 6626 1 1517 . 1 1 127 127 TYR HA H 1 4.40 0.01 . 1 . . . . 127 TYR HA . 6626 1 1518 . 1 1 127 127 TYR HB2 H 1 3.29 0.01 . 2 . . . . 127 TYR HB2 . 6626 1 1519 . 1 1 127 127 TYR HB3 H 1 3.12 0.01 . 2 . . . . 127 TYR HB3 . 6626 1 1520 . 1 1 127 127 TYR HD1 H 1 6.19 0.01 . 1 . . . . 127 TYR HD1 . 6626 1 1521 . 1 1 127 127 TYR HD2 H 1 6.19 0.01 . 1 . . . . 127 TYR HD2 . 6626 1 1522 . 1 1 127 127 TYR HE1 H 1 6.13 0.01 . 1 . . . . 127 TYR HE1 . 6626 1 1523 . 1 1 127 127 TYR HE2 H 1 6.13 0.01 . 1 . . . . 127 TYR HE2 . 6626 1 1524 . 1 1 127 127 TYR C C 13 179.4 0.1 . 1 . . . . 127 TYR C . 6626 1 1525 . 1 1 127 127 TYR CA C 13 57.0 0.1 . 1 . . . . 127 TYR CA . 6626 1 1526 . 1 1 127 127 TYR CB C 13 35.3 0.1 . 1 . . . . 127 TYR CB . 6626 1 1527 . 1 1 127 127 TYR CD1 C 13 131.6 0.1 . 1 . . . . 127 TYR CD1 . 6626 1 1528 . 1 1 127 127 TYR CE1 C 13 117.0 0.1 . 1 . . . . 127 TYR CE1 . 6626 1 1529 . 1 1 127 127 TYR N N 15 118.5 0.1 . 1 . . . . 127 TYR N . 6626 1 1530 . 1 1 128 128 LEU H H 1 8.05 0.01 . 1 . . . . 128 LEU HN . 6626 1 1531 . 1 1 128 128 LEU HA H 1 3.93 0.01 . 1 . . . . 128 LEU HA . 6626 1 1532 . 1 1 128 128 LEU HB2 H 1 1.70 0.01 . 2 . . . . 128 LEU HB2 . 6626 1 1533 . 1 1 128 128 LEU HB3 H 1 1.51 0.01 . 2 . . . . 128 LEU HB3 . 6626 1 1534 . 1 1 128 128 LEU HD11 H 1 0.83 0.01 . 2 . . . . 128 LEU HD1 . 6626 1 1535 . 1 1 128 128 LEU HD12 H 1 0.83 0.01 . 2 . . . . 128 LEU HD1 . 6626 1 1536 . 1 1 128 128 LEU HD13 H 1 0.83 0.01 . 2 . . . . 128 LEU HD1 . 6626 1 1537 . 1 1 128 128 LEU HD21 H 1 0.91 0.01 . 2 . . . . 128 LEU HD2 . 6626 1 1538 . 1 1 128 128 LEU HD22 H 1 0.91 0.01 . 2 . . . . 128 LEU HD2 . 6626 1 1539 . 1 1 128 128 LEU HD23 H 1 0.91 0.01 . 2 . . . . 128 LEU HD2 . 6626 1 1540 . 1 1 128 128 LEU C C 13 179.6 0.1 . 1 . . . . 128 LEU C . 6626 1 1541 . 1 1 128 128 LEU CA C 13 58.2 0.1 . 1 . . . . 128 LEU CA . 6626 1 1542 . 1 1 128 128 LEU CB C 13 42.1 0.1 . 1 . . . . 128 LEU CB . 6626 1 1543 . 1 1 128 128 LEU CD1 C 13 24.7 0.1 . 1 . . . . 128 LEU CD1 . 6626 1 1544 . 1 1 128 128 LEU CD2 C 13 24.2 0.1 . 1 . . . . 128 LEU CD2 . 6626 1 1545 . 1 1 128 128 LEU N N 15 118.3 0.1 . 1 . . . . 128 LEU N . 6626 1 1546 . 1 1 129 129 LYS H H 1 7.96 0.01 . 1 . . . . 129 LYS HN . 6626 1 1547 . 1 1 129 129 LYS HA H 1 4.08 0.01 . 1 . . . . 129 LYS HA . 6626 1 1548 . 1 1 129 129 LYS HB2 H 1 1.98 0.01 . 1 . . . . 129 LYS HB2 . 6626 1 1549 . 1 1 129 129 LYS HB3 H 1 1.98 0.01 . 1 . . . . 129 LYS HB3 . 6626 1 1550 . 1 1 129 129 LYS HG2 H 1 1.49 0.01 . 1 . . . . 129 LYS HG2 . 6626 1 1551 . 1 1 129 129 LYS HG3 H 1 1.49 0.01 . 1 . . . . 129 LYS HG3 . 6626 1 1552 . 1 1 129 129 LYS HD2 H 1 1.68 0.01 . 1 . . . . 129 LYS HD2 . 6626 1 1553 . 1 1 129 129 LYS HD3 H 1 1.68 0.01 . 1 . . . . 129 LYS HD3 . 6626 1 1554 . 1 1 129 129 LYS HE2 H 1 2.92 0.01 . 1 . . . . 129 LYS HE2 . 6626 1 1555 . 1 1 129 129 LYS HE3 H 1 2.92 0.01 . 1 . . . . 129 LYS HE3 . 6626 1 1556 . 1 1 129 129 LYS C C 13 179.1 0.1 . 1 . . . . 129 LYS C . 6626 1 1557 . 1 1 129 129 LYS CA C 13 58.8 0.1 . 1 . . . . 129 LYS CA . 6626 1 1558 . 1 1 129 129 LYS CB C 13 31.5 0.1 . 1 . . . . 129 LYS CB . 6626 1 1559 . 1 1 129 129 LYS CG C 13 25.0 0.1 . 1 . . . . 129 LYS CG . 6626 1 1560 . 1 1 129 129 LYS CD C 13 28.6 0.1 . 1 . . . . 129 LYS CD . 6626 1 1561 . 1 1 129 129 LYS N N 15 118.1 0.1 . 1 . . . . 129 LYS N . 6626 1 1562 . 1 1 130 130 SER H H 1 8.01 0.01 . 1 . . . . 130 SER HN . 6626 1 1563 . 1 1 130 130 SER HA H 1 3.86 0.01 . 1 . . . . 130 SER HA . 6626 1 1564 . 1 1 130 130 SER HB2 H 1 3.40 0.01 . 2 . . . . 130 SER HB2 . 6626 1 1565 . 1 1 130 130 SER HB3 H 1 2.10 0.01 . 2 . . . . 130 SER HB3 . 6626 1 1566 . 1 1 130 130 SER C C 13 175.8 0.1 . 1 . . . . 130 SER C . 6626 1 1567 . 1 1 130 130 SER CA C 13 63.0 0.1 . 1 . . . . 130 SER CA . 6626 1 1568 . 1 1 130 130 SER CB C 13 61.3 0.1 . 1 . . . . 130 SER CB . 6626 1 1569 . 1 1 130 130 SER N N 15 114.0 0.1 . 1 . . . . 130 SER N . 6626 1 1570 . 1 1 131 131 LEU H H 1 7.53 0.01 . 1 . . . . 131 LEU HN . 6626 1 1571 . 1 1 131 131 LEU HA H 1 4.08 0.01 . 1 . . . . 131 LEU HA . 6626 1 1572 . 1 1 131 131 LEU HB2 H 1 2.05 0.01 . 2 . . . . 131 LEU HB2 . 6626 1 1573 . 1 1 131 131 LEU HB3 H 1 1.36 0.01 . 2 . . . . 131 LEU HB3 . 6626 1 1574 . 1 1 131 131 LEU HG H 1 1.63 0.01 . 1 . . . . 131 LEU HG . 6626 1 1575 . 1 1 131 131 LEU HD11 H 1 0.98 0.01 . 2 . . . . 131 LEU HD1 . 6626 1 1576 . 1 1 131 131 LEU HD12 H 1 0.98 0.01 . 2 . . . . 131 LEU HD1 . 6626 1 1577 . 1 1 131 131 LEU HD13 H 1 0.98 0.01 . 2 . . . . 131 LEU HD1 . 6626 1 1578 . 1 1 131 131 LEU HD21 H 1 0.96 0.01 . 2 . . . . 131 LEU HD2 . 6626 1 1579 . 1 1 131 131 LEU HD22 H 1 0.96 0.01 . 2 . . . . 131 LEU HD2 . 6626 1 1580 . 1 1 131 131 LEU HD23 H 1 0.96 0.01 . 2 . . . . 131 LEU HD2 . 6626 1 1581 . 1 1 131 131 LEU C C 13 179.4 0.1 . 1 . . . . 131 LEU C . 6626 1 1582 . 1 1 131 131 LEU CA C 13 57.8 0.1 . 1 . . . . 131 LEU CA . 6626 1 1583 . 1 1 131 131 LEU CB C 13 42.4 0.1 . 1 . . . . 131 LEU CB . 6626 1 1584 . 1 1 131 131 LEU CD1 C 13 23.8 0.1 . 1 . . . . 131 LEU CD1 . 6626 1 1585 . 1 1 131 131 LEU CD2 C 13 26.4 0.1 . 1 . . . . 131 LEU CD2 . 6626 1 1586 . 1 1 131 131 LEU N N 15 118.7 0.1 . 1 . . . . 131 LEU N . 6626 1 1587 . 1 1 132 132 GLU H H 1 8.29 0.01 . 1 . . . . 132 GLU HN . 6626 1 1588 . 1 1 132 132 GLU HA H 1 4.01 0.01 . 1 . . . . 132 GLU HA . 6626 1 1589 . 1 1 132 132 GLU HB2 H 1 2.15 0.01 . 1 . . . . 132 GLU HB2 . 6626 1 1590 . 1 1 132 132 GLU HB3 H 1 2.15 0.01 . 1 . . . . 132 GLU HB3 . 6626 1 1591 . 1 1 132 132 GLU HG2 H 1 2.37 0.01 . 2 . . . . 132 GLU HG2 . 6626 1 1592 . 1 1 132 132 GLU HG3 H 1 2.13 0.01 . 2 . . . . 132 GLU HG3 . 6626 1 1593 . 1 1 132 132 GLU C C 13 179.6 0.1 . 1 . . . . 132 GLU C . 6626 1 1594 . 1 1 132 132 GLU CA C 13 59.5 0.1 . 1 . . . . 132 GLU CA . 6626 1 1595 . 1 1 132 132 GLU CB C 13 29.7 0.1 . 1 . . . . 132 GLU CB . 6626 1 1596 . 1 1 132 132 GLU CG C 13 36.3 0.1 . 1 . . . . 132 GLU CG . 6626 1 1597 . 1 1 132 132 GLU N N 15 119.5 0.1 . 1 . . . . 132 GLU N . 6626 1 1598 . 1 1 133 133 MET H H 1 8.16 0.01 . 1 . . . . 133 MET HN . 6626 1 1599 . 1 1 133 133 MET HA H 1 4.27 0.01 . 1 . . . . 133 MET HA . 6626 1 1600 . 1 1 133 133 MET HB2 H 1 2.20 0.01 . 1 . . . . 133 MET HB2 . 6626 1 1601 . 1 1 133 133 MET HB3 H 1 2.20 0.01 . 1 . . . . 133 MET HB3 . 6626 1 1602 . 1 1 133 133 MET HG2 H 1 2.75 0.01 . 2 . . . . 133 MET HG2 . 6626 1 1603 . 1 1 133 133 MET HG3 H 1 2.61 0.01 . 2 . . . . 133 MET HG3 . 6626 1 1604 . 1 1 133 133 MET HE1 H 1 2.06 0.01 . 1 . . . . 133 MET HE . 6626 1 1605 . 1 1 133 133 MET HE2 H 1 2.06 0.01 . 1 . . . . 133 MET HE . 6626 1 1606 . 1 1 133 133 MET HE3 H 1 2.06 0.01 . 1 . . . . 133 MET HE . 6626 1 1607 . 1 1 133 133 MET C C 13 179.2 0.1 . 1 . . . . 133 MET C . 6626 1 1608 . 1 1 133 133 MET CA C 13 57.3 0.1 . 1 . . . . 133 MET CA . 6626 1 1609 . 1 1 133 133 MET CB C 13 31.7 0.1 . 1 . . . . 133 MET CB . 6626 1 1610 . 1 1 133 133 MET CG C 13 32.3 0.1 . 1 . . . . 133 MET CG . 6626 1 1611 . 1 1 133 133 MET CE C 13 16.7 0.1 . 1 . . . . 133 MET CE . 6626 1 1612 . 1 1 133 133 MET N N 15 114.7 0.1 . 1 . . . . 133 MET N . 6626 1 1613 . 1 1 134 134 THR H H 1 7.79 0.01 . 1 . . . . 134 THR HN . 6626 1 1614 . 1 1 134 134 THR HA H 1 3.97 0.01 . 1 . . . . 134 THR HA . 6626 1 1615 . 1 1 134 134 THR HB H 1 4.34 0.01 . 1 . . . . 134 THR HB . 6626 1 1616 . 1 1 134 134 THR HG21 H 1 1.72 0.01 . 1 . . . . 134 THR HG2 . 6626 1 1617 . 1 1 134 134 THR HG22 H 1 1.72 0.01 . 1 . . . . 134 THR HG2 . 6626 1 1618 . 1 1 134 134 THR HG23 H 1 1.72 0.01 . 1 . . . . 134 THR HG2 . 6626 1 1619 . 1 1 134 134 THR C C 13 176.8 0.1 . 1 . . . . 134 THR C . 6626 1 1620 . 1 1 134 134 THR CA C 13 65.6 0.1 . 1 . . . . 134 THR CA . 6626 1 1621 . 1 1 134 134 THR CB C 13 69.0 0.1 . 1 . . . . 134 THR CB . 6626 1 1622 . 1 1 134 134 THR CG2 C 13 23.4 0.1 . 1 . . . . 134 THR CG2 . 6626 1 1623 . 1 1 134 134 THR N N 15 111.2 0.1 . 1 . . . . 134 THR N . 6626 1 1624 . 1 1 135 135 ALA H H 1 7.27 0.01 . 1 . . . . 135 ALA HN . 6626 1 1625 . 1 1 135 135 ALA HA H 1 4.18 0.01 . 1 . . . . 135 ALA HA . 6626 1 1626 . 1 1 135 135 ALA HB1 H 1 1.50 0.01 . 1 . . . . 135 ALA HB . 6626 1 1627 . 1 1 135 135 ALA HB2 H 1 1.50 0.01 . 1 . . . . 135 ALA HB . 6626 1 1628 . 1 1 135 135 ALA HB3 H 1 1.50 0.01 . 1 . . . . 135 ALA HB . 6626 1 1629 . 1 1 135 135 ALA C C 13 178.8 0.1 . 1 . . . . 135 ALA C . 6626 1 1630 . 1 1 135 135 ALA CA C 13 54.4 0.1 . 1 . . . . 135 ALA CA . 6626 1 1631 . 1 1 135 135 ALA CB C 13 18.8 0.1 . 1 . . . . 135 ALA CB . 6626 1 1632 . 1 1 135 135 ALA N N 15 120.6 0.1 . 1 . . . . 135 ALA N . 6626 1 1633 . 1 1 136 136 LYS H H 1 7.31 0.01 . 1 . . . . 136 LYS HN . 6626 1 1634 . 1 1 136 136 LYS HA H 1 4.46 0.01 . 1 . . . . 136 LYS HA . 6626 1 1635 . 1 1 136 136 LYS HB2 H 1 1.96 0.01 . 2 . . . . 136 LYS HB2 . 6626 1 1636 . 1 1 136 136 LYS HB3 H 1 1.80 0.01 . 2 . . . . 136 LYS HB3 . 6626 1 1637 . 1 1 136 136 LYS HG2 H 1 1.47 0.01 . 1 . . . . 136 LYS HG2 . 6626 1 1638 . 1 1 136 136 LYS HG3 H 1 1.47 0.01 . 1 . . . . 136 LYS HG3 . 6626 1 1639 . 1 1 136 136 LYS HD2 H 1 1.65 0.01 . 1 . . . . 136 LYS HD2 . 6626 1 1640 . 1 1 136 136 LYS HD3 H 1 1.65 0.01 . 1 . . . . 136 LYS HD3 . 6626 1 1641 . 1 1 136 136 LYS HE2 H 1 2.94 0.01 . 1 . . . . 136 LYS HE2 . 6626 1 1642 . 1 1 136 136 LYS HE3 H 1 2.94 0.01 . 1 . . . . 136 LYS HE3 . 6626 1 1643 . 1 1 136 136 LYS C C 13 176.5 0.1 . 1 . . . . 136 LYS C . 6626 1 1644 . 1 1 136 136 LYS CA C 13 55.4 0.1 . 1 . . . . 136 LYS CA . 6626 1 1645 . 1 1 136 136 LYS CB C 13 33.5 0.1 . 1 . . . . 136 LYS CB . 6626 1 1646 . 1 1 136 136 LYS CG C 13 25.1 0.1 . 1 . . . . 136 LYS CG . 6626 1 1647 . 1 1 136 136 LYS CD C 13 29.1 0.1 . 1 . . . . 136 LYS CD . 6626 1 1648 . 1 1 136 136 LYS N N 15 112.2 0.1 . 1 . . . . 136 LYS N . 6626 1 1649 . 1 1 137 137 ALA H H 1 7.33 0.01 . 1 . . . . 137 ALA HN . 6626 1 1650 . 1 1 137 137 ALA HA H 1 4.08 0.01 . 1 . . . . 137 ALA HA . 6626 1 1651 . 1 1 137 137 ALA HB1 H 1 0.86 0.01 . 1 . . . . 137 ALA HB . 6626 1 1652 . 1 1 137 137 ALA HB2 H 1 0.86 0.01 . 1 . . . . 137 ALA HB . 6626 1 1653 . 1 1 137 137 ALA HB3 H 1 0.86 0.01 . 1 . . . . 137 ALA HB . 6626 1 1654 . 1 1 137 137 ALA CA C 13 56.6 0.1 . 1 . . . . 137 ALA CA . 6626 1 1655 . 1 1 137 137 ALA CB C 13 15.7 0.1 . 1 . . . . 137 ALA CB . 6626 1 1656 . 1 1 137 137 ALA N N 15 121.1 0.1 . 1 . . . . 137 ALA N . 6626 1 1657 . 1 1 138 138 PRO HA H 1 4.04 0.01 . 1 . . . . 138 PRO HA . 6626 1 1658 . 1 1 138 138 PRO HB2 H 1 2.23 0.01 . 2 . . . . 138 PRO HB2 . 6626 1 1659 . 1 1 138 138 PRO HB3 H 1 1.75 0.01 . 2 . . . . 138 PRO HB3 . 6626 1 1660 . 1 1 138 138 PRO HG2 H 1 2.01 0.01 . 2 . . . . 138 PRO HG2 . 6626 1 1661 . 1 1 138 138 PRO HG3 H 1 1.52 0.01 . 2 . . . . 138 PRO HG3 . 6626 1 1662 . 1 1 138 138 PRO HD2 H 1 3.31 0.01 . 1 . . . . 138 PRO HD2 . 6626 1 1663 . 1 1 138 138 PRO HD3 H 1 3.31 0.01 . 1 . . . . 138 PRO HD3 . 6626 1 1664 . 1 1 138 138 PRO C C 13 179.5 0.1 . 1 . . . . 138 PRO C . 6626 1 1665 . 1 1 138 138 PRO CA C 13 66.2 0.1 . 1 . . . . 138 PRO CA . 6626 1 1666 . 1 1 138 138 PRO CB C 13 30.7 0.1 . 1 . . . . 138 PRO CB . 6626 1 1667 . 1 1 138 138 PRO CG C 13 28.6 0.1 . 1 . . . . 138 PRO CG . 6626 1 1668 . 1 1 138 138 PRO CD C 13 50.1 0.1 . 1 . . . . 138 PRO CD . 6626 1 1669 . 1 1 139 139 GLN H H 1 7.63 0.01 . 1 . . . . 139 GLN HN . 6626 1 1670 . 1 1 139 139 GLN HA H 1 4.22 0.01 . 1 . . . . 139 GLN HA . 6626 1 1671 . 1 1 139 139 GLN HB2 H 1 2.17 0.01 . 1 . . . . 139 GLN HB2 . 6626 1 1672 . 1 1 139 139 GLN HB3 H 1 2.17 0.01 . 1 . . . . 139 GLN HB3 . 6626 1 1673 . 1 1 139 139 GLN HG2 H 1 2.40 0.01 . 1 . . . . 139 GLN HG2 . 6626 1 1674 . 1 1 139 139 GLN HG3 H 1 2.40 0.01 . 1 . . . . 139 GLN HG3 . 6626 1 1675 . 1 1 139 139 GLN C C 13 178.3 0.1 . 1 . . . . 139 GLN C . 6626 1 1676 . 1 1 139 139 GLN CA C 13 58.7 0.1 . 1 . . . . 139 GLN CA . 6626 1 1677 . 1 1 139 139 GLN CB C 13 28.2 0.1 . 1 . . . . 139 GLN CB . 6626 1 1678 . 1 1 139 139 GLN CG C 13 34.0 0.1 . 1 . . . . 139 GLN CG . 6626 1 1679 . 1 1 139 139 GLN N N 15 115.6 0.1 . 1 . . . . 139 GLN N . 6626 1 1680 . 1 1 140 140 LEU H H 1 7.93 0.01 . 1 . . . . 140 LEU HN . 6626 1 1681 . 1 1 140 140 LEU HA H 1 4.18 0.01 . 1 . . . . 140 LEU HA . 6626 1 1682 . 1 1 140 140 LEU HB2 H 1 2.08 0.01 . 2 . . . . 140 LEU HB2 . 6626 1 1683 . 1 1 140 140 LEU HB3 H 1 1.67 0.01 . 2 . . . . 140 LEU HB3 . 6626 1 1684 . 1 1 140 140 LEU HG H 1 1.75 0.01 . 1 . . . . 140 LEU HG . 6626 1 1685 . 1 1 140 140 LEU HD11 H 1 0.89 0.01 . 2 . . . . 140 LEU HD1 . 6626 1 1686 . 1 1 140 140 LEU HD12 H 1 0.89 0.01 . 2 . . . . 140 LEU HD1 . 6626 1 1687 . 1 1 140 140 LEU HD13 H 1 0.89 0.01 . 2 . . . . 140 LEU HD1 . 6626 1 1688 . 1 1 140 140 LEU HD21 H 1 0.85 0.01 . 2 . . . . 140 LEU HD2 . 6626 1 1689 . 1 1 140 140 LEU HD22 H 1 0.85 0.01 . 2 . . . . 140 LEU HD2 . 6626 1 1690 . 1 1 140 140 LEU HD23 H 1 0.85 0.01 . 2 . . . . 140 LEU HD2 . 6626 1 1691 . 1 1 140 140 LEU C C 13 180.0 0.1 . 1 . . . . 140 LEU C . 6626 1 1692 . 1 1 140 140 LEU CA C 13 57.6 0.1 . 1 . . . . 140 LEU CA . 6626 1 1693 . 1 1 140 140 LEU CB C 13 41.9 0.1 . 1 . . . . 140 LEU CB . 6626 1 1694 . 1 1 140 140 LEU CD1 C 13 25.3 0.1 . 1 . . . . 140 LEU CD1 . 6626 1 1695 . 1 1 140 140 LEU CD2 C 13 22.9 0.1 . 1 . . . . 140 LEU CD2 . 6626 1 1696 . 1 1 140 140 LEU N N 15 119.0 0.1 . 1 . . . . 140 LEU N . 6626 1 1697 . 1 1 141 141 HIS H H 1 8.86 0.01 . 1 . . . . 141 HIS HN . 6626 1 1698 . 1 1 141 141 HIS HA H 1 4.16 0.01 . 1 . . . . 141 HIS HA . 6626 1 1699 . 1 1 141 141 HIS HB2 H 1 3.37 0.01 . 2 . . . . 141 HIS HB2 . 6626 1 1700 . 1 1 141 141 HIS HB3 H 1 3.01 0.01 . 2 . . . . 141 HIS HB3 . 6626 1 1701 . 1 1 141 141 HIS HD2 H 1 6.59 0.01 . 1 . . . . 141 HIS HD2 . 6626 1 1702 . 1 1 141 141 HIS HE1 H 1 7.20 0.01 . 1 . . . . 141 HIS HE1 . 6626 1 1703 . 1 1 141 141 HIS C C 13 176.3 0.1 . 1 . . . . 141 HIS C . 6626 1 1704 . 1 1 141 141 HIS CA C 13 61.7 0.1 . 1 . . . . 141 HIS CA . 6626 1 1705 . 1 1 141 141 HIS CB C 13 31.7 0.1 . 1 . . . . 141 HIS CB . 6626 1 1706 . 1 1 141 141 HIS CD2 C 13 117.2 0.1 . 1 . . . . 141 HIS CD2 . 6626 1 1707 . 1 1 141 141 HIS CE1 C 13 138.7 0.1 . 1 . . . . 141 HIS CE1 . 6626 1 1708 . 1 1 141 141 HIS N N 15 119.7 0.1 . 1 . . . . 141 HIS N . 6626 1 1709 . 1 1 142 142 ALA H H 1 7.99 0.01 . 1 . . . . 142 ALA HN . 6626 1 1710 . 1 1 142 142 ALA HA H 1 4.33 0.01 . 1 . . . . 142 ALA HA . 6626 1 1711 . 1 1 142 142 ALA HB1 H 1 1.58 0.01 . 1 . . . . 142 ALA HB . 6626 1 1712 . 1 1 142 142 ALA HB2 H 1 1.58 0.01 . 1 . . . . 142 ALA HB . 6626 1 1713 . 1 1 142 142 ALA HB3 H 1 1.58 0.01 . 1 . . . . 142 ALA HB . 6626 1 1714 . 1 1 142 142 ALA C C 13 181.0 0.1 . 1 . . . . 142 ALA C . 6626 1 1715 . 1 1 142 142 ALA CA C 13 55.0 0.1 . 1 . . . . 142 ALA CA . 6626 1 1716 . 1 1 142 142 ALA CB C 13 18.1 0.1 . 1 . . . . 142 ALA CB . 6626 1 1717 . 1 1 142 142 ALA N N 15 118.7 0.1 . 1 . . . . 142 ALA N . 6626 1 1718 . 1 1 143 143 GLU H H 1 8.06 0.01 . 1 . . . . 143 GLU HN . 6626 1 1719 . 1 1 143 143 GLU HA H 1 4.01 0.01 . 1 . . . . 143 GLU HA . 6626 1 1720 . 1 1 143 143 GLU HB2 H 1 2.06 0.01 . 1 . . . . 143 GLU HB2 . 6626 1 1721 . 1 1 143 143 GLU HB3 H 1 2.06 0.01 . 1 . . . . 143 GLU HB3 . 6626 1 1722 . 1 1 143 143 GLU HG2 H 1 2.43 0.01 . 2 . . . . 143 GLU HG2 . 6626 1 1723 . 1 1 143 143 GLU HG3 H 1 2.29 0.01 . 2 . . . . 143 GLU HG3 . 6626 1 1724 . 1 1 143 143 GLU C C 13 178.4 0.1 . 1 . . . . 143 GLU C . 6626 1 1725 . 1 1 143 143 GLU CA C 13 58.9 0.1 . 1 . . . . 143 GLU CA . 6626 1 1726 . 1 1 143 143 GLU CB C 13 29.8 0.1 . 1 . . . . 143 GLU CB . 6626 1 1727 . 1 1 143 143 GLU CG C 13 36.4 0.1 . 1 . . . . 143 GLU CG . 6626 1 1728 . 1 1 143 143 GLU N N 15 114.9 0.1 . 1 . . . . 143 GLU N . 6626 1 1729 . 1 1 144 144 ALA H H 1 7.95 0.01 . 1 . . . . 144 ALA HN . 6626 1 1730 . 1 1 144 144 ALA HA H 1 4.01 0.01 . 1 . . . . 144 ALA HA . 6626 1 1731 . 1 1 144 144 ALA HB1 H 1 1.26 0.01 . 1 . . . . 144 ALA HB . 6626 1 1732 . 1 1 144 144 ALA HB2 H 1 1.26 0.01 . 1 . . . . 144 ALA HB . 6626 1 1733 . 1 1 144 144 ALA HB3 H 1 1.26 0.01 . 1 . . . . 144 ALA HB . 6626 1 1734 . 1 1 144 144 ALA C C 13 179.6 0.1 . 1 . . . . 144 ALA C . 6626 1 1735 . 1 1 144 144 ALA CA C 13 54.6 0.1 . 1 . . . . 144 ALA CA . 6626 1 1736 . 1 1 144 144 ALA CB C 13 18.1 0.1 . 1 . . . . 144 ALA CB . 6626 1 1737 . 1 1 144 144 ALA N N 15 119.4 0.1 . 1 . . . . 144 ALA N . 6626 1 1738 . 1 1 145 145 TYR H H 1 7.88 0.01 . 1 . . . . 145 TYR HN . 6626 1 1739 . 1 1 145 145 TYR HA H 1 4.29 0.01 . 1 . . . . 145 TYR HA . 6626 1 1740 . 1 1 145 145 TYR HB2 H 1 3.14 0.01 . 2 . . . . 145 TYR HB2 . 6626 1 1741 . 1 1 145 145 TYR HB3 H 1 2.61 0.01 . 2 . . . . 145 TYR HB3 . 6626 1 1742 . 1 1 145 145 TYR HD1 H 1 6.79 0.01 . 1 . . . . 145 TYR HD1 . 6626 1 1743 . 1 1 145 145 TYR HD2 H 1 6.79 0.01 . 1 . . . . 145 TYR HD2 . 6626 1 1744 . 1 1 145 145 TYR HE1 H 1 6.51 0.01 . 1 . . . . 145 TYR HE1 . 6626 1 1745 . 1 1 145 145 TYR HE2 H 1 6.51 0.01 . 1 . . . . 145 TYR HE2 . 6626 1 1746 . 1 1 145 145 TYR C C 13 177.1 0.1 . 1 . . . . 145 TYR C . 6626 1 1747 . 1 1 145 145 TYR CA C 13 60.8 0.1 . 1 . . . . 145 TYR CA . 6626 1 1748 . 1 1 145 145 TYR CB C 13 38.4 0.1 . 1 . . . . 145 TYR CB . 6626 1 1749 . 1 1 145 145 TYR CD1 C 13 133.2 0.1 . 1 . . . . 145 TYR CD1 . 6626 1 1750 . 1 1 145 145 TYR CE1 C 13 117.2 0.1 . 1 . . . . 145 TYR CE1 . 6626 1 1751 . 1 1 145 145 TYR N N 15 112.5 0.1 . 1 . . . . 145 TYR N . 6626 1 1752 . 1 1 146 146 LYS H H 1 7.91 0.01 . 1 . . . . 146 LYS HN . 6626 1 1753 . 1 1 146 146 LYS HA H 1 4.24 0.01 . 1 . . . . 146 LYS HA . 6626 1 1754 . 1 1 146 146 LYS HB2 H 1 1.91 0.01 . 1 . . . . 146 LYS HB2 . 6626 1 1755 . 1 1 146 146 LYS HB3 H 1 1.91 0.01 . 1 . . . . 146 LYS HB3 . 6626 1 1756 . 1 1 146 146 LYS HG2 H 1 1.46 0.01 . 1 . . . . 146 LYS HG2 . 6626 1 1757 . 1 1 146 146 LYS HG3 H 1 1.46 0.01 . 1 . . . . 146 LYS HG3 . 6626 1 1758 . 1 1 146 146 LYS HD2 H 1 1.68 0.01 . 1 . . . . 146 LYS HD2 . 6626 1 1759 . 1 1 146 146 LYS HD3 H 1 1.68 0.01 . 1 . . . . 146 LYS HD3 . 6626 1 1760 . 1 1 146 146 LYS HE2 H 1 2.96 0.01 . 1 . . . . 146 LYS HE2 . 6626 1 1761 . 1 1 146 146 LYS HE3 H 1 2.96 0.01 . 1 . . . . 146 LYS HE3 . 6626 1 1762 . 1 1 146 146 LYS C C 13 177.5 0.1 . 1 . . . . 146 LYS C . 6626 1 1763 . 1 1 146 146 LYS CA C 13 57.9 0.1 . 1 . . . . 146 LYS CA . 6626 1 1764 . 1 1 146 146 LYS CB C 13 32.6 0.1 . 1 . . . . 146 LYS CB . 6626 1 1765 . 1 1 146 146 LYS CG C 13 25.1 0.1 . 1 . . . . 146 LYS CG . 6626 1 1766 . 1 1 146 146 LYS CD C 13 29.4 0.1 . 1 . . . . 146 LYS CD . 6626 1 1767 . 1 1 146 146 LYS N N 15 118.9 0.1 . 1 . . . . 146 LYS N . 6626 1 1768 . 1 1 147 147 GLN H H 1 8.09 0.01 . 1 . . . . 147 GLN HN . 6626 1 1769 . 1 1 147 147 GLN HA H 1 4.31 0.01 . 1 . . . . 147 GLN HA . 6626 1 1770 . 1 1 147 147 GLN HB2 H 1 2.16 0.01 . 2 . . . . 147 GLN HB2 . 6626 1 1771 . 1 1 147 147 GLN HB3 H 1 2.01 0.01 . 2 . . . . 147 GLN HB3 . 6626 1 1772 . 1 1 147 147 GLN HG2 H 1 2.38 0.01 . 1 . . . . 147 GLN HG2 . 6626 1 1773 . 1 1 147 147 GLN HG3 H 1 2.38 0.01 . 1 . . . . 147 GLN HG3 . 6626 1 1774 . 1 1 147 147 GLN C C 13 176.7 0.1 . 1 . . . . 147 GLN C . 6626 1 1775 . 1 1 147 147 GLN CA C 13 56.2 0.1 . 1 . . . . 147 GLN CA . 6626 1 1776 . 1 1 147 147 GLN CB C 13 29.3 0.1 . 1 . . . . 147 GLN CB . 6626 1 1777 . 1 1 147 147 GLN CG C 13 34.0 0.1 . 1 . . . . 147 GLN CG . 6626 1 1778 . 1 1 147 147 GLN N N 15 115.8 0.1 . 1 . . . . 147 GLN N . 6626 1 1779 . 1 1 148 148 GLY H H 1 8.05 0.01 . 1 . . . . 148 GLY HN . 6626 1 1780 . 1 1 148 148 GLY HA2 H 1 3.97 0.01 . 2 . . . . 148 GLY HA1 . 6626 1 1781 . 1 1 148 148 GLY HA3 H 1 3.90 0.01 . 2 . . . . 148 GLY HA2 . 6626 1 1782 . 1 1 148 148 GLY C C 13 174.6 0.1 . 1 . . . . 148 GLY C . 6626 1 1783 . 1 1 148 148 GLY CA C 13 45.5 0.1 . 1 . . . . 148 GLY CA . 6626 1 1784 . 1 1 148 148 GLY N N 15 106.3 0.1 . 1 . . . . 148 GLY N . 6626 1 1785 . 1 1 149 149 LEU H H 1 8.10 0.01 . 1 . . . . 149 LEU HN . 6626 1 1786 . 1 1 149 149 LEU HA H 1 4.28 0.01 . 1 . . . . 149 LEU HA . 6626 1 1787 . 1 1 149 149 LEU HB2 H 1 1.54 0.01 . 1 . . . . 149 LEU HB2 . 6626 1 1788 . 1 1 149 149 LEU HB3 H 1 1.54 0.01 . 1 . . . . 149 LEU HB3 . 6626 1 1789 . 1 1 149 149 LEU HG H 1 1.56 0.01 . 1 . . . . 149 LEU HG . 6626 1 1790 . 1 1 149 149 LEU HD11 H 1 0.84 0.01 . 2 . . . . 149 LEU HD1 . 6626 1 1791 . 1 1 149 149 LEU HD12 H 1 0.84 0.01 . 2 . . . . 149 LEU HD1 . 6626 1 1792 . 1 1 149 149 LEU HD13 H 1 0.84 0.01 . 2 . . . . 149 LEU HD1 . 6626 1 1793 . 1 1 149 149 LEU HD21 H 1 0.84 0.01 . 2 . . . . 149 LEU HD2 . 6626 1 1794 . 1 1 149 149 LEU HD22 H 1 0.84 0.01 . 2 . . . . 149 LEU HD2 . 6626 1 1795 . 1 1 149 149 LEU HD23 H 1 0.84 0.01 . 2 . . . . 149 LEU HD2 . 6626 1 1796 . 1 1 149 149 LEU CA C 13 55.3 0.1 . 1 . . . . 149 LEU CA . 6626 1 1797 . 1 1 149 149 LEU CB C 13 42.2 0.1 . 1 . . . . 149 LEU CB . 6626 1 1798 . 1 1 149 149 LEU CD1 C 13 32.2 0.1 . 1 . . . . 149 LEU CD1 . 6626 1 1799 . 1 1 149 149 LEU CD2 C 13 27.1 0.1 . 1 . . . . 149 LEU CD2 . 6626 1 1800 . 1 1 149 149 LEU N N 15 118.8 0.1 . 1 . . . . 149 LEU N . 6626 1 1801 . 1 1 150 150 GLY H H 1 8.54 0.01 . 1 . . . . 150 GLY HN . 6626 1 1802 . 1 1 150 150 GLY CA C 13 45.4 0.1 . 1 . . . . 150 GLY CA . 6626 1 1803 . 1 1 150 150 GLY N N 15 108.0 0.1 . 1 . . . . 150 GLY N . 6626 1 1804 . 1 1 151 151 GLY H H 1 8.19 0.01 . 1 . . . . 151 GLY HN . 6626 1 1805 . 1 1 151 151 GLY C C 13 174.3 0.1 . 1 . . . . 151 GLY C . 6626 1 1806 . 1 1 151 151 GLY N N 15 106.3 0.1 . 1 . . . . 151 GLY N . 6626 1 1807 . 1 1 157 157 HIS HA H 1 4.34 0.01 . 1 . . . . 157 HIS HA . 6626 1 1808 . 1 1 157 157 HIS HB2 H 1 3.08 0.01 . 2 . . . . 157 HIS HB2 . 6626 1 1809 . 1 1 157 157 HIS HB3 H 1 2.95 0.01 . 2 . . . . 157 HIS HB3 . 6626 1 1810 . 1 1 157 157 HIS HD2 H 1 6.90 0.01 . 1 . . . . 157 HIS HD2 . 6626 1 1811 . 1 1 157 157 HIS CA C 13 57.6 0.1 . 1 . . . . 157 HIS CA . 6626 1 1812 . 1 1 157 157 HIS CB C 13 31.0 0.1 . 1 . . . . 157 HIS CB . 6626 1 1813 . 1 1 157 157 HIS CD2 C 13 120.1 0.1 . 1 . . . . 157 HIS CD2 . 6626 1 1814 . 1 1 158 158 HIS H H 1 7.86 0.01 . 1 . . . . 158 HIS HN . 6626 1 1815 . 1 1 158 158 HIS HA H 1 4.52 0.01 . 1 . . . . 158 HIS HA . 6626 1 1816 . 1 1 158 158 HIS HB2 H 1 2.96 0.01 . 2 . . . . 158 HIS HB2 . 6626 1 1817 . 1 1 158 158 HIS HB3 H 1 2.52 0.01 . 2 . . . . 158 HIS HB3 . 6626 1 1818 . 1 1 158 158 HIS N N 15 123.2 0.1 . 1 . . . . 158 HIS N . 6626 1 stop_ save_