data_11534 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11534 _Entry.Title ; Solution structure of the GGQ domain of YaeJ protein from Escherichia coli ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2013-09-21 _Entry.Accession_date 2013-09-23 _Entry.Last_release_date 2013-12-23 _Entry.Original_release_date 2013-12-23 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1.1.61 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Nobukazu Nameki . . . 11534 2 Mayu Enomoto . . . 11534 3 Hiroyuki Kogure . . . 11534 4 Naoya Tochio . . . 11534 5 Peter Guntert . . . 11534 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 11534 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'GGC domain' . 11534 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11534 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 536 11534 '15N chemical shifts' 123 11534 '1H chemical shifts' 864 11534 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 . . 2013-12-23 2013-09-21 original author . 11534 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 11534 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 24322300 _Citation.Full_citation . _Citation.Title 'Identification of residues required for stalled-ribosome rescue in the codon-independent release factor YaeJ' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nucleic Acids Res.' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _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 . _Citation.Page_last . _Citation.Year 2013 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Hiroyuki Kogure . . . 11534 1 2 Nobukazu Nameki . . . 11534 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11534 _Assembly.ID 1 _Assembly.Name 'the GGQ domain of YaeJ protein' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'the GGQ domain of YaeJ protein' 1 $entity A . yes native no no . . . 11534 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 2RTX . . . . 'Structure from this entry' . 11534 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 11534 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MIVISRHVAIPDGELEITAI RAQGAGGQHVNKTSTAIHLR FDIRASSLPEYYKERLLAAS HHLISSDGVIVIKAQEYRSQ ELNREAALARLVAMIKELTT EKKARRPTRSGPSSGENLYF Q ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Residues 110-121 represent a non-native affinity tag.' _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 121 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 13473.514 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 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 2RTX . "Solution Structure Of The Ggq Domain Of Yaej Protein From Escherichia Coli" . . . . . 100.00 121 100.00 100.00 9.87e-81 . . . . 11534 1 2 no DBJ BAI29068 . "conserved predicted protein [Escherichia coli O103:H2 str. 12009]" . . . . . 90.08 140 97.25 100.00 9.21e-69 . . . . 11534 1 3 no EMBL CSE40362 . "peptidyl-tRNA hydrolase domain-containing protein [Shigella sonnei]" . . . . . 53.72 68 100.00 100.00 1.57e-37 . . . . 11534 1 4 no EMBL CSE41074 . "peptidyl-tRNA hydrolase domain-containing protein [Shigella sonnei]" . . . . . 53.72 68 100.00 100.00 1.57e-37 . . . . 11534 1 5 no EMBL CSE45877 . "peptidyl-tRNA hydrolase domain-containing protein [Shigella sonnei]" . . . . . 53.72 68 100.00 100.00 1.57e-37 . . . . 11534 1 6 no EMBL CSE47218 . "peptidyl-tRNA hydrolase domain-containing protein [Shigella sonnei]" . . . . . 53.72 68 100.00 100.00 1.57e-37 . . . . 11534 1 7 no EMBL CSE48511 . "peptidyl-tRNA hydrolase domain-containing protein [Shigella sonnei]" . . . . . 53.72 68 100.00 100.00 1.57e-37 . . . . 11534 1 8 no GB EFZ51677 . "peptidyl-tRNA hydrolase domain protein [Shigella sonnei 53G]" . . . . . 53.72 68 100.00 100.00 1.57e-37 . . . . 11534 1 9 no GB EGX13540 . "peptidyl-tRNA hydrolase domain protein [Escherichia coli G58-1]" . . . . . 89.26 147 97.22 98.15 2.99e-65 . . . . 11534 1 10 no GB EIQ48412 . "putative-tRNA hydrolase domain protein [Shigella sonnei 3226-85]" . . . . . 53.72 68 100.00 100.00 1.57e-37 . . . . 11534 1 11 no GB EIQ48742 . "putative-tRNA hydrolase domain protein [Shigella sonnei 3233-85]" . . . . . 53.72 68 100.00 100.00 1.57e-37 . . . . 11534 1 12 no GB EIQ55363 . "putative-tRNA hydrolase domain protein [Shigella sonnei 4822-66]" . . . . . 53.72 68 100.00 100.00 1.57e-37 . . . . 11534 1 13 no REF WP_000635548 . "hypothetical protein [Escherichia coli]" . . . . . 90.08 140 97.25 100.00 9.21e-69 . . . . 11534 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 1 MET . 11534 1 2 2 ILE . 11534 1 3 3 VAL . 11534 1 4 4 ILE . 11534 1 5 5 SER . 11534 1 6 6 ARG . 11534 1 7 7 HIS . 11534 1 8 8 VAL . 11534 1 9 9 ALA . 11534 1 10 10 ILE . 11534 1 11 11 PRO . 11534 1 12 12 ASP . 11534 1 13 13 GLY . 11534 1 14 14 GLU . 11534 1 15 15 LEU . 11534 1 16 16 GLU . 11534 1 17 17 ILE . 11534 1 18 18 THR . 11534 1 19 19 ALA . 11534 1 20 20 ILE . 11534 1 21 21 ARG . 11534 1 22 22 ALA . 11534 1 23 23 GLN . 11534 1 24 24 GLY . 11534 1 25 25 ALA . 11534 1 26 26 GLY . 11534 1 27 27 GLY . 11534 1 28 28 GLN . 11534 1 29 29 HIS . 11534 1 30 30 VAL . 11534 1 31 31 ASN . 11534 1 32 32 LYS . 11534 1 33 33 THR . 11534 1 34 34 SER . 11534 1 35 35 THR . 11534 1 36 36 ALA . 11534 1 37 37 ILE . 11534 1 38 38 HIS . 11534 1 39 39 LEU . 11534 1 40 40 ARG . 11534 1 41 41 PHE . 11534 1 42 42 ASP . 11534 1 43 43 ILE . 11534 1 44 44 ARG . 11534 1 45 45 ALA . 11534 1 46 46 SER . 11534 1 47 47 SER . 11534 1 48 48 LEU . 11534 1 49 49 PRO . 11534 1 50 50 GLU . 11534 1 51 51 TYR . 11534 1 52 52 TYR . 11534 1 53 53 LYS . 11534 1 54 54 GLU . 11534 1 55 55 ARG . 11534 1 56 56 LEU . 11534 1 57 57 LEU . 11534 1 58 58 ALA . 11534 1 59 59 ALA . 11534 1 60 60 SER . 11534 1 61 61 HIS . 11534 1 62 62 HIS . 11534 1 63 63 LEU . 11534 1 64 64 ILE . 11534 1 65 65 SER . 11534 1 66 66 SER . 11534 1 67 67 ASP . 11534 1 68 68 GLY . 11534 1 69 69 VAL . 11534 1 70 70 ILE . 11534 1 71 71 VAL . 11534 1 72 72 ILE . 11534 1 73 73 LYS . 11534 1 74 74 ALA . 11534 1 75 75 GLN . 11534 1 76 76 GLU . 11534 1 77 77 TYR . 11534 1 78 78 ARG . 11534 1 79 79 SER . 11534 1 80 80 GLN . 11534 1 81 81 GLU . 11534 1 82 82 LEU . 11534 1 83 83 ASN . 11534 1 84 84 ARG . 11534 1 85 85 GLU . 11534 1 86 86 ALA . 11534 1 87 87 ALA . 11534 1 88 88 LEU . 11534 1 89 89 ALA . 11534 1 90 90 ARG . 11534 1 91 91 LEU . 11534 1 92 92 VAL . 11534 1 93 93 ALA . 11534 1 94 94 MET . 11534 1 95 95 ILE . 11534 1 96 96 LYS . 11534 1 97 97 GLU . 11534 1 98 98 LEU . 11534 1 99 99 THR . 11534 1 100 100 THR . 11534 1 101 101 GLU . 11534 1 102 102 LYS . 11534 1 103 103 LYS . 11534 1 104 104 ALA . 11534 1 105 105 ARG . 11534 1 106 106 ARG . 11534 1 107 107 PRO . 11534 1 108 108 THR . 11534 1 109 109 ARG . 11534 1 110 110 SER . 11534 1 111 111 GLY . 11534 1 112 112 PRO . 11534 1 113 113 SER . 11534 1 114 114 SER . 11534 1 115 115 GLY . 11534 1 116 116 GLU . 11534 1 117 117 ASN . 11534 1 118 118 LEU . 11534 1 119 119 TYR . 11534 1 120 120 PHE . 11534 1 121 121 GLN . 11534 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 11534 1 . ILE 2 2 11534 1 . VAL 3 3 11534 1 . ILE 4 4 11534 1 . SER 5 5 11534 1 . ARG 6 6 11534 1 . HIS 7 7 11534 1 . VAL 8 8 11534 1 . ALA 9 9 11534 1 . ILE 10 10 11534 1 . PRO 11 11 11534 1 . ASP 12 12 11534 1 . GLY 13 13 11534 1 . GLU 14 14 11534 1 . LEU 15 15 11534 1 . GLU 16 16 11534 1 . ILE 17 17 11534 1 . THR 18 18 11534 1 . ALA 19 19 11534 1 . ILE 20 20 11534 1 . ARG 21 21 11534 1 . ALA 22 22 11534 1 . GLN 23 23 11534 1 . GLY 24 24 11534 1 . ALA 25 25 11534 1 . GLY 26 26 11534 1 . GLY 27 27 11534 1 . GLN 28 28 11534 1 . HIS 29 29 11534 1 . VAL 30 30 11534 1 . ASN 31 31 11534 1 . LYS 32 32 11534 1 . THR 33 33 11534 1 . SER 34 34 11534 1 . THR 35 35 11534 1 . ALA 36 36 11534 1 . ILE 37 37 11534 1 . HIS 38 38 11534 1 . LEU 39 39 11534 1 . ARG 40 40 11534 1 . PHE 41 41 11534 1 . ASP 42 42 11534 1 . ILE 43 43 11534 1 . ARG 44 44 11534 1 . ALA 45 45 11534 1 . SER 46 46 11534 1 . SER 47 47 11534 1 . LEU 48 48 11534 1 . PRO 49 49 11534 1 . GLU 50 50 11534 1 . TYR 51 51 11534 1 . TYR 52 52 11534 1 . LYS 53 53 11534 1 . GLU 54 54 11534 1 . ARG 55 55 11534 1 . LEU 56 56 11534 1 . LEU 57 57 11534 1 . ALA 58 58 11534 1 . ALA 59 59 11534 1 . SER 60 60 11534 1 . HIS 61 61 11534 1 . HIS 62 62 11534 1 . LEU 63 63 11534 1 . ILE 64 64 11534 1 . SER 65 65 11534 1 . SER 66 66 11534 1 . ASP 67 67 11534 1 . GLY 68 68 11534 1 . VAL 69 69 11534 1 . ILE 70 70 11534 1 . VAL 71 71 11534 1 . ILE 72 72 11534 1 . LYS 73 73 11534 1 . ALA 74 74 11534 1 . GLN 75 75 11534 1 . GLU 76 76 11534 1 . TYR 77 77 11534 1 . ARG 78 78 11534 1 . SER 79 79 11534 1 . GLN 80 80 11534 1 . GLU 81 81 11534 1 . LEU 82 82 11534 1 . ASN 83 83 11534 1 . ARG 84 84 11534 1 . GLU 85 85 11534 1 . ALA 86 86 11534 1 . ALA 87 87 11534 1 . LEU 88 88 11534 1 . ALA 89 89 11534 1 . ARG 90 90 11534 1 . LEU 91 91 11534 1 . VAL 92 92 11534 1 . ALA 93 93 11534 1 . MET 94 94 11534 1 . ILE 95 95 11534 1 . LYS 96 96 11534 1 . GLU 97 97 11534 1 . LEU 98 98 11534 1 . THR 99 99 11534 1 . THR 100 100 11534 1 . GLU 101 101 11534 1 . LYS 102 102 11534 1 . LYS 103 103 11534 1 . ALA 104 104 11534 1 . ARG 105 105 11534 1 . ARG 106 106 11534 1 . PRO 107 107 11534 1 . THR 108 108 11534 1 . ARG 109 109 11534 1 . SER 110 110 11534 1 . GLY 111 111 11534 1 . PRO 112 112 11534 1 . SER 113 113 11534 1 . SER 114 114 11534 1 . GLY 115 115 11534 1 . GLU 116 116 11534 1 . ASN 117 117 11534 1 . LEU 118 118 11534 1 . TYR 119 119 11534 1 . PHE 120 120 11534 1 . GLN 121 121 11534 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 11534 _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 $entity . 562 organism . 'Escherichia coli' 'E. coli' . . Eubacteria . Escherichia coli . . . . . . . . . . . . . . . . . . . . . 11534 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 11534 _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 $entity . 'cell free synthesis' 'Escherichia coli' 'E. coli' . 562 Escherichia coli . . . . . . . . . . . . . . . . 'not applicable' . . . . . . 11534 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11534 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'GGQ domain' '[U-13C; U-15N]' . . 1 $entity . protein 1 . . mM . . . . 11534 1 2 TRIS [U-2H] . . . . . buffer 20 . . mM . . . . 11534 1 3 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 11534 1 4 DTT [U-2H] . . . . . . 1 . . mM . . . . 11534 1 5 NaN3 'natural abundance' . . . . . . 0.02 . . % . . . . 11534 1 6 H2O [U-2H] . . . . . solvent 90 . . % . . . . 11534 1 7 D2O . . . . . . solvent 10 . . % . . . . 11534 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 11534 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 120 . mM 11534 1 pH 7.0 . pH 11534 1 pressure 1 . atm 11534 1 temperature 298 . K 11534 1 stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11534 _Software.ID 1 _Software.Name CYANA _Software.Version 3.93 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert et al.' . . 11534 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 11534 1 stop_ save_ save_xwinnmr _Software.Sf_category software _Software.Sf_framecode xwinnmr _Software.Entry_ID 11534 _Software.ID 2 _Software.Name xwinnmr _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 11534 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11534 2 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11534 _Software.ID 3 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 11534 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11534 3 stop_ save_ save_OPALp _Software.Sf_category software _Software.Sf_framecode OPALp _Software.Entry_ID 11534 _Software.ID 4 _Software.Name OPALp _Software.Version 1.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Koradi, Guntert, Billeter' . . 11534 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 11534 4 stop_ save_ save_Kujira _Software.Sf_category software _Software.Sf_framecode Kujira _Software.Entry_ID 11534 _Software.ID 5 _Software.Name Kujira _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 11534 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11534 5 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 11534 _Software.ID 6 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 11534 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11534 6 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 11534 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 11534 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 700 . . . 11534 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 11534 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11534 1 2 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11534 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 11534 _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 water protons . . . . ppm 4.780 internal indirect 0.251449530 . . . . . . . . . 11534 1 H 1 water protons . . . . ppm 4.780 internal direct 1.0 . . . . . . . . . 11534 1 N 15 water protons . . . . ppm 4.780 internal indirect 0.101329118 . . . . . . . . . 11534 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 11534 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 1H-15N NOESY' 1 $sample_1 isotropic 11534 1 2 '3D 1H-13C NOESY' 1 $sample_1 isotropic 11534 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET H H 1 9.027 0.030 . 1 . . . A 1 MET H1 . 11534 1 2 . 1 1 1 1 MET HA H 1 4.118 0.030 . 1 . . . A 1 MET HA . 11534 1 3 . 1 1 1 1 MET HB2 H 1 2.422 0.030 . 2 . . . A 1 MET HB2 . 11534 1 4 . 1 1 1 1 MET HB3 H 1 2.327 0.030 . 2 . . . A 1 MET HB3 . 11534 1 5 . 1 1 1 1 MET HG2 H 1 1.905 0.030 . 1 . . . A 1 MET HG2 . 11534 1 6 . 1 1 1 1 MET HG3 H 1 1.905 0.030 . 1 . . . A 1 MET HG3 . 11534 1 7 . 1 1 1 1 MET HE1 H 1 1.925 0.030 . 1 . . . A 1 MET HE1 . 11534 1 8 . 1 1 1 1 MET HE2 H 1 1.925 0.030 . 1 . . . A 1 MET HE2 . 11534 1 9 . 1 1 1 1 MET HE3 H 1 1.925 0.030 . 1 . . . A 1 MET HE3 . 11534 1 10 . 1 1 1 1 MET CA C 13 54.703 0.300 . 1 . . . A 1 MET CA . 11534 1 11 . 1 1 1 1 MET CB C 13 30.930 0.300 . 1 . . . A 1 MET CB . 11534 1 12 . 1 1 1 1 MET CG C 13 33.660 0.300 . 1 . . . A 1 MET CG . 11534 1 13 . 1 1 1 1 MET CE C 13 16.930 0.300 . 1 . . . A 1 MET CE . 11534 1 14 . 1 1 1 1 MET N N 15 124.230 0.300 . 1 . . . A 1 MET N . 11534 1 15 . 1 1 2 2 ILE H H 1 8.797 0.030 . 1 . . . A 2 ILE H . 11534 1 16 . 1 1 2 2 ILE HA H 1 4.261 0.030 . 1 . . . A 2 ILE HA . 11534 1 17 . 1 1 2 2 ILE HB H 1 1.843 0.030 . 1 . . . A 2 ILE HB . 11534 1 18 . 1 1 2 2 ILE HG12 H 1 1.285 0.030 . 2 . . . A 2 ILE HG12 . 11534 1 19 . 1 1 2 2 ILE HG13 H 1 1.189 0.030 . 2 . . . A 2 ILE HG13 . 11534 1 20 . 1 1 2 2 ILE HG21 H 1 0.594 0.030 . 1 . . . A 2 ILE HG21 . 11534 1 21 . 1 1 2 2 ILE HG22 H 1 0.594 0.030 . 1 . . . A 2 ILE HG22 . 11534 1 22 . 1 1 2 2 ILE HG23 H 1 0.594 0.030 . 1 . . . A 2 ILE HG23 . 11534 1 23 . 1 1 2 2 ILE HD11 H 1 0.675 0.030 . 1 . . . A 2 ILE HD11 . 11534 1 24 . 1 1 2 2 ILE HD12 H 1 0.675 0.030 . 1 . . . A 2 ILE HD12 . 11534 1 25 . 1 1 2 2 ILE HD13 H 1 0.675 0.030 . 1 . . . A 2 ILE HD13 . 11534 1 26 . 1 1 2 2 ILE CA C 13 59.582 0.300 . 1 . . . A 2 ILE CA . 11534 1 27 . 1 1 2 2 ILE CB C 13 37.533 0.300 . 1 . . . A 2 ILE CB . 11534 1 28 . 1 1 2 2 ILE CG1 C 13 27.169 0.300 . 1 . . . A 2 ILE CG1 . 11534 1 29 . 1 1 2 2 ILE CG2 C 13 17.717 0.300 . 1 . . . A 2 ILE CG2 . 11534 1 30 . 1 1 2 2 ILE CD1 C 13 13.032 0.300 . 1 . . . A 2 ILE CD1 . 11534 1 31 . 1 1 2 2 ILE N N 15 119.558 0.300 . 1 . . . A 2 ILE N . 11534 1 32 . 1 1 3 3 VAL H H 1 8.644 0.030 . 1 . . . A 3 VAL H . 11534 1 33 . 1 1 3 3 VAL HA H 1 3.725 0.030 . 1 . . . A 3 VAL HA . 11534 1 34 . 1 1 3 3 VAL HB H 1 1.884 0.030 . 1 . . . A 3 VAL HB . 11534 1 35 . 1 1 3 3 VAL HG11 H 1 0.846 0.030 . 2 . . . A 3 VAL HG11 . 11534 1 36 . 1 1 3 3 VAL HG12 H 1 0.846 0.030 . 2 . . . A 3 VAL HG12 . 11534 1 37 . 1 1 3 3 VAL HG13 H 1 0.846 0.030 . 2 . . . A 3 VAL HG13 . 11534 1 38 . 1 1 3 3 VAL HG21 H 1 0.713 0.030 . 2 . . . A 3 VAL HG21 . 11534 1 39 . 1 1 3 3 VAL HG22 H 1 0.713 0.030 . 2 . . . A 3 VAL HG22 . 11534 1 40 . 1 1 3 3 VAL HG23 H 1 0.713 0.030 . 2 . . . A 3 VAL HG23 . 11534 1 41 . 1 1 3 3 VAL C C 13 175.418 0.300 . 1 . . . A 3 VAL C . 11534 1 42 . 1 1 3 3 VAL CA C 13 64.245 0.300 . 1 . . . A 3 VAL CA . 11534 1 43 . 1 1 3 3 VAL CB C 13 32.195 0.300 . 1 . . . A 3 VAL CB . 11534 1 44 . 1 1 3 3 VAL CG1 C 13 21.528 0.300 . 2 . . . A 3 VAL CG1 . 11534 1 45 . 1 1 3 3 VAL CG2 C 13 20.984 0.300 . 2 . . . A 3 VAL CG2 . 11534 1 46 . 1 1 3 3 VAL N N 15 128.542 0.300 . 1 . . . A 3 VAL N . 11534 1 47 . 1 1 4 4 ILE H H 1 8.470 0.030 . 1 . . . A 4 ILE H . 11534 1 48 . 1 1 4 4 ILE HA H 1 4.070 0.030 . 1 . . . A 4 ILE HA . 11534 1 49 . 1 1 4 4 ILE HB H 1 1.767 0.030 . 1 . . . A 4 ILE HB . 11534 1 50 . 1 1 4 4 ILE HG12 H 1 1.287 0.030 . 2 . . . A 4 ILE HG12 . 11534 1 51 . 1 1 4 4 ILE HG13 H 1 1.179 0.030 . 2 . . . A 4 ILE HG13 . 11534 1 52 . 1 1 4 4 ILE HG21 H 1 0.830 0.030 . 1 . . . A 4 ILE HG21 . 11534 1 53 . 1 1 4 4 ILE HG22 H 1 0.830 0.030 . 1 . . . A 4 ILE HG22 . 11534 1 54 . 1 1 4 4 ILE HG23 H 1 0.830 0.030 . 1 . . . A 4 ILE HG23 . 11534 1 55 . 1 1 4 4 ILE HD11 H 1 0.597 0.030 . 1 . . . A 4 ILE HD11 . 11534 1 56 . 1 1 4 4 ILE HD12 H 1 0.597 0.030 . 1 . . . A 4 ILE HD12 . 11534 1 57 . 1 1 4 4 ILE HD13 H 1 0.597 0.030 . 1 . . . A 4 ILE HD13 . 11534 1 58 . 1 1 4 4 ILE C C 13 175.168 0.300 . 1 . . . A 4 ILE C . 11534 1 59 . 1 1 4 4 ILE CA C 13 61.186 0.300 . 1 . . . A 4 ILE CA . 11534 1 60 . 1 1 4 4 ILE CB C 13 37.474 0.300 . 1 . . . A 4 ILE CB . 11534 1 61 . 1 1 4 4 ILE CG1 C 13 27.981 0.300 . 1 . . . A 4 ILE CG1 . 11534 1 62 . 1 1 4 4 ILE CG2 C 13 17.509 0.300 . 1 . . . A 4 ILE CG2 . 11534 1 63 . 1 1 4 4 ILE CD1 C 13 11.764 0.300 . 1 . . . A 4 ILE CD1 . 11534 1 64 . 1 1 4 4 ILE N N 15 127.771 0.300 . 1 . . . A 4 ILE N . 11534 1 65 . 1 1 5 5 SER H H 1 8.561 0.030 . 1 . . . A 5 SER H . 11534 1 66 . 1 1 5 5 SER HA H 1 4.619 0.030 . 1 . . . A 5 SER HA . 11534 1 67 . 1 1 5 5 SER HB2 H 1 3.810 0.030 . 2 . . . A 5 SER HB2 . 11534 1 68 . 1 1 5 5 SER HB3 H 1 4.177 0.030 . 2 . . . A 5 SER HB3 . 11534 1 69 . 1 1 5 5 SER C C 13 173.692 0.300 . 1 . . . A 5 SER C . 11534 1 70 . 1 1 5 5 SER CA C 13 56.352 0.300 . 1 . . . A 5 SER CA . 11534 1 71 . 1 1 5 5 SER CB C 13 65.705 0.300 . 1 . . . A 5 SER CB . 11534 1 72 . 1 1 5 5 SER N N 15 113.989 0.300 . 1 . . . A 5 SER N . 11534 1 73 . 1 1 6 6 ARG HA H 1 3.898 0.030 . 1 . . . A 6 ARG HA . 11534 1 74 . 1 1 6 6 ARG HB2 H 1 1.681 0.030 . 2 . . . A 6 ARG HB2 . 11534 1 75 . 1 1 6 6 ARG HB3 H 1 1.475 0.030 . 2 . . . A 6 ARG HB3 . 11534 1 76 . 1 1 6 6 ARG HG2 H 1 1.176 0.030 . 1 . . . A 6 ARG HG2 . 11534 1 77 . 1 1 6 6 ARG HG3 H 1 1.176 0.030 . 1 . . . A 6 ARG HG3 . 11534 1 78 . 1 1 6 6 ARG HD2 H 1 3.043 0.030 . 1 . . . A 6 ARG HD2 . 11534 1 79 . 1 1 6 6 ARG HD3 H 1 3.043 0.030 . 1 . . . A 6 ARG HD3 . 11534 1 80 . 1 1 6 6 ARG C C 13 176.299 0.300 . 1 . . . A 6 ARG C . 11534 1 81 . 1 1 6 6 ARG CA C 13 58.797 0.300 . 1 . . . A 6 ARG CA . 11534 1 82 . 1 1 6 6 ARG CB C 13 29.529 0.300 . 1 . . . A 6 ARG CB . 11534 1 83 . 1 1 6 6 ARG CG C 13 26.572 0.300 . 1 . . . A 6 ARG CG . 11534 1 84 . 1 1 6 6 ARG CD C 13 43.206 0.300 . 1 . . . A 6 ARG CD . 11534 1 85 . 1 1 7 7 HIS H H 1 8.020 0.030 . 1 . . . A 7 HIS H . 11534 1 86 . 1 1 7 7 HIS HA H 1 4.743 0.030 . 1 . . . A 7 HIS HA . 11534 1 87 . 1 1 7 7 HIS HB2 H 1 3.308 0.030 . 2 . . . A 7 HIS HB2 . 11534 1 88 . 1 1 7 7 HIS HB3 H 1 2.903 0.030 . 2 . . . A 7 HIS HB3 . 11534 1 89 . 1 1 7 7 HIS HD2 H 1 6.972 0.030 . 1 . . . A 7 HIS HD2 . 11534 1 90 . 1 1 7 7 HIS HE1 H 1 7.741 0.030 . 1 . . . A 7 HIS HE1 . 11534 1 91 . 1 1 7 7 HIS C C 13 174.860 0.300 . 1 . . . A 7 HIS C . 11534 1 92 . 1 1 7 7 HIS CA C 13 55.998 0.300 . 1 . . . A 7 HIS CA . 11534 1 93 . 1 1 7 7 HIS CB C 13 31.905 0.300 . 1 . . . A 7 HIS CB . 11534 1 94 . 1 1 7 7 HIS CD2 C 13 120.144 0.300 . 1 . . . A 7 HIS CD2 . 11534 1 95 . 1 1 7 7 HIS CE1 C 13 138.454 0.300 . 1 . . . A 7 HIS CE1 . 11534 1 96 . 1 1 7 7 HIS N N 15 114.055 0.300 . 1 . . . A 7 HIS N . 11534 1 97 . 1 1 8 8 VAL H H 1 7.438 0.030 . 1 . . . A 8 VAL H . 11534 1 98 . 1 1 8 8 VAL HA H 1 4.206 0.030 . 1 . . . A 8 VAL HA . 11534 1 99 . 1 1 8 8 VAL HB H 1 1.745 0.030 . 1 . . . A 8 VAL HB . 11534 1 100 . 1 1 8 8 VAL HG11 H 1 0.393 0.030 . 2 . . . A 8 VAL HG11 . 11534 1 101 . 1 1 8 8 VAL HG12 H 1 0.393 0.030 . 2 . . . A 8 VAL HG12 . 11534 1 102 . 1 1 8 8 VAL HG13 H 1 0.393 0.030 . 2 . . . A 8 VAL HG13 . 11534 1 103 . 1 1 8 8 VAL HG21 H 1 0.529 0.030 . 2 . . . A 8 VAL HG21 . 11534 1 104 . 1 1 8 8 VAL HG22 H 1 0.529 0.030 . 2 . . . A 8 VAL HG22 . 11534 1 105 . 1 1 8 8 VAL HG23 H 1 0.529 0.030 . 2 . . . A 8 VAL HG23 . 11534 1 106 . 1 1 8 8 VAL C C 13 172.645 0.300 . 1 . . . A 8 VAL C . 11534 1 107 . 1 1 8 8 VAL CA C 13 62.280 0.300 . 1 . . . A 8 VAL CA . 11534 1 108 . 1 1 8 8 VAL CB C 13 33.783 0.300 . 1 . . . A 8 VAL CB . 11534 1 109 . 1 1 8 8 VAL CG1 C 13 21.116 0.300 . 2 . . . A 8 VAL CG1 . 11534 1 110 . 1 1 8 8 VAL CG2 C 13 20.945 0.300 . 2 . . . A 8 VAL CG2 . 11534 1 111 . 1 1 8 8 VAL N N 15 120.360 0.300 . 1 . . . A 8 VAL N . 11534 1 112 . 1 1 9 9 ALA H H 1 8.358 0.030 . 1 . . . A 9 ALA H . 11534 1 113 . 1 1 9 9 ALA HA H 1 5.030 0.030 . 1 . . . A 9 ALA HA . 11534 1 114 . 1 1 9 9 ALA HB1 H 1 1.216 0.030 . 1 . . . A 9 ALA HB1 . 11534 1 115 . 1 1 9 9 ALA HB2 H 1 1.216 0.030 . 1 . . . A 9 ALA HB2 . 11534 1 116 . 1 1 9 9 ALA HB3 H 1 1.216 0.030 . 1 . . . A 9 ALA HB3 . 11534 1 117 . 1 1 9 9 ALA C C 13 175.649 0.300 . 1 . . . A 9 ALA C . 11534 1 118 . 1 1 9 9 ALA CA C 13 50.531 0.300 . 1 . . . A 9 ALA CA . 11534 1 119 . 1 1 9 9 ALA CB C 13 22.981 0.300 . 1 . . . A 9 ALA CB . 11534 1 120 . 1 1 9 9 ALA N N 15 130.292 0.300 . 1 . . . A 9 ALA N . 11534 1 121 . 1 1 10 10 ILE H H 1 8.881 0.030 . 1 . . . A 10 ILE H . 11534 1 122 . 1 1 10 10 ILE HA H 1 4.620 0.030 . 1 . . . A 10 ILE HA . 11534 1 123 . 1 1 10 10 ILE HB H 1 1.655 0.030 . 1 . . . A 10 ILE HB . 11534 1 124 . 1 1 10 10 ILE HG12 H 1 1.326 0.030 . 2 . . . A 10 ILE HG12 . 11534 1 125 . 1 1 10 10 ILE HG13 H 1 0.855 0.030 . 2 . . . A 10 ILE HG13 . 11534 1 126 . 1 1 10 10 ILE HG21 H 1 0.841 0.030 . 1 . . . A 10 ILE HG21 . 11534 1 127 . 1 1 10 10 ILE HG22 H 1 0.841 0.030 . 1 . . . A 10 ILE HG22 . 11534 1 128 . 1 1 10 10 ILE HG23 H 1 0.841 0.030 . 1 . . . A 10 ILE HG23 . 11534 1 129 . 1 1 10 10 ILE HD11 H 1 0.351 0.030 . 1 . . . A 10 ILE HD11 . 11534 1 130 . 1 1 10 10 ILE HD12 H 1 0.351 0.030 . 1 . . . A 10 ILE HD12 . 11534 1 131 . 1 1 10 10 ILE HD13 H 1 0.351 0.030 . 1 . . . A 10 ILE HD13 . 11534 1 132 . 1 1 10 10 ILE C C 13 173.569 0.300 . 1 . . . A 10 ILE C . 11534 1 133 . 1 1 10 10 ILE CA C 13 58.036 0.300 . 1 . . . A 10 ILE CA . 11534 1 134 . 1 1 10 10 ILE CB C 13 40.755 0.300 . 1 . . . A 10 ILE CB . 11534 1 135 . 1 1 10 10 ILE CG1 C 13 26.487 0.300 . 1 . . . A 10 ILE CG1 . 11534 1 136 . 1 1 10 10 ILE CG2 C 13 17.297 0.300 . 1 . . . A 10 ILE CG2 . 11534 1 137 . 1 1 10 10 ILE CD1 C 13 13.648 0.300 . 1 . . . A 10 ILE CD1 . 11534 1 138 . 1 1 10 10 ILE N N 15 120.089 0.300 . 1 . . . A 10 ILE N . 11534 1 139 . 1 1 11 11 PRO HA H 1 4.510 0.030 . 1 . . . A 11 PRO HA . 11534 1 140 . 1 1 11 11 PRO HB2 H 1 1.898 0.030 . 2 . . . A 11 PRO HB2 . 11534 1 141 . 1 1 11 11 PRO HB3 H 1 2.394 0.030 . 2 . . . A 11 PRO HB3 . 11534 1 142 . 1 1 11 11 PRO HG2 H 1 2.035 0.030 . 2 . . . A 11 PRO HG2 . 11534 1 143 . 1 1 11 11 PRO HG3 H 1 1.891 0.030 . 2 . . . A 11 PRO HG3 . 11534 1 144 . 1 1 11 11 PRO HD2 H 1 3.653 0.030 . 2 . . . A 11 PRO HD2 . 11534 1 145 . 1 1 11 11 PRO HD3 H 1 3.839 0.030 . 2 . . . A 11 PRO HD3 . 11534 1 146 . 1 1 11 11 PRO C C 13 176.998 0.300 . 1 . . . A 11 PRO C . 11534 1 147 . 1 1 11 11 PRO CA C 13 62.800 0.300 . 1 . . . A 11 PRO CA . 11534 1 148 . 1 1 11 11 PRO CB C 13 32.850 0.300 . 1 . . . A 11 PRO CB . 11534 1 149 . 1 1 11 11 PRO CG C 13 28.043 0.300 . 1 . . . A 11 PRO CG . 11534 1 150 . 1 1 11 11 PRO CD C 13 51.412 0.300 . 1 . . . A 11 PRO CD . 11534 1 151 . 1 1 12 12 ASP H H 1 8.592 0.030 . 1 . . . A 12 ASP H . 11534 1 152 . 1 1 12 12 ASP HA H 1 4.077 0.030 . 1 . . . A 12 ASP HA . 11534 1 153 . 1 1 12 12 ASP HB2 H 1 2.599 0.030 . 2 . . . A 12 ASP HB2 . 11534 1 154 . 1 1 12 12 ASP HB3 H 1 2.479 0.030 . 2 . . . A 12 ASP HB3 . 11534 1 155 . 1 1 12 12 ASP C C 13 178.507 0.300 . 1 . . . A 12 ASP C . 11534 1 156 . 1 1 12 12 ASP CA C 13 57.602 0.300 . 1 . . . A 12 ASP CA . 11534 1 157 . 1 1 12 12 ASP CB C 13 40.286 0.300 . 1 . . . A 12 ASP CB . 11534 1 158 . 1 1 12 12 ASP N N 15 121.124 0.300 . 1 . . . A 12 ASP N . 11534 1 159 . 1 1 13 13 GLY H H 1 8.549 0.030 . 1 . . . A 13 GLY H . 11534 1 160 . 1 1 13 13 GLY HA2 H 1 4.077 0.030 . 2 . . . A 13 GLY HA2 . 11534 1 161 . 1 1 13 13 GLY HA3 H 1 3.839 0.030 . 2 . . . A 13 GLY HA3 . 11534 1 162 . 1 1 13 13 GLY C C 13 175.061 0.300 . 1 . . . A 13 GLY C . 11534 1 163 . 1 1 13 13 GLY CA C 13 45.952 0.300 . 1 . . . A 13 GLY CA . 11534 1 164 . 1 1 13 13 GLY N N 15 102.929 0.300 . 1 . . . A 13 GLY N . 11534 1 165 . 1 1 14 14 GLU H H 1 7.679 0.030 . 1 . . . A 14 GLU H . 11534 1 166 . 1 1 14 14 GLU HA H 1 4.282 0.030 . 1 . . . A 14 GLU HA . 11534 1 167 . 1 1 14 14 GLU HB2 H 1 2.564 0.030 . 2 . . . A 14 GLU HB2 . 11534 1 168 . 1 1 14 14 GLU HB3 H 1 1.969 0.030 . 2 . . . A 14 GLU HB3 . 11534 1 169 . 1 1 14 14 GLU HG2 H 1 2.319 0.030 . 1 . . . A 14 GLU HG2 . 11534 1 170 . 1 1 14 14 GLU HG3 H 1 2.319 0.030 . 1 . . . A 14 GLU HG3 . 11534 1 171 . 1 1 14 14 GLU C C 13 175.134 0.300 . 1 . . . A 14 GLU C . 11534 1 172 . 1 1 14 14 GLU CA C 13 57.061 0.300 . 1 . . . A 14 GLU CA . 11534 1 173 . 1 1 14 14 GLU CB C 13 28.998 0.300 . 1 . . . A 14 GLU CB . 11534 1 174 . 1 1 14 14 GLU CG C 13 37.362 0.300 . 1 . . . A 14 GLU CG . 11534 1 175 . 1 1 14 14 GLU N N 15 118.296 0.300 . 1 . . . A 14 GLU N . 11534 1 176 . 1 1 15 15 LEU H H 1 7.659 0.030 . 1 . . . A 15 LEU H . 11534 1 177 . 1 1 15 15 LEU HA H 1 4.865 0.030 . 1 . . . A 15 LEU HA . 11534 1 178 . 1 1 15 15 LEU HB2 H 1 1.876 0.030 . 2 . . . A 15 LEU HB2 . 11534 1 179 . 1 1 15 15 LEU HB3 H 1 1.286 0.030 . 2 . . . A 15 LEU HB3 . 11534 1 180 . 1 1 15 15 LEU HG H 1 1.543 0.030 . 1 . . . A 15 LEU HG . 11534 1 181 . 1 1 15 15 LEU HD11 H 1 0.601 0.030 . 2 . . . A 15 LEU HD11 . 11534 1 182 . 1 1 15 15 LEU HD12 H 1 0.601 0.030 . 2 . . . A 15 LEU HD12 . 11534 1 183 . 1 1 15 15 LEU HD13 H 1 0.601 0.030 . 2 . . . A 15 LEU HD13 . 11534 1 184 . 1 1 15 15 LEU HD21 H 1 0.717 0.030 . 2 . . . A 15 LEU HD21 . 11534 1 185 . 1 1 15 15 LEU HD22 H 1 0.717 0.030 . 2 . . . A 15 LEU HD22 . 11534 1 186 . 1 1 15 15 LEU HD23 H 1 0.717 0.030 . 2 . . . A 15 LEU HD23 . 11534 1 187 . 1 1 15 15 LEU C C 13 175.169 0.300 . 1 . . . A 15 LEU C . 11534 1 188 . 1 1 15 15 LEU CA C 13 53.836 0.300 . 1 . . . A 15 LEU CA . 11534 1 189 . 1 1 15 15 LEU CB C 13 44.176 0.300 . 1 . . . A 15 LEU CB . 11534 1 190 . 1 1 15 15 LEU CG C 13 27.150 0.300 . 1 . . . A 15 LEU CG . 11534 1 191 . 1 1 15 15 LEU CD1 C 13 25.863 0.300 . 2 . . . A 15 LEU CD1 . 11534 1 192 . 1 1 15 15 LEU CD2 C 13 26.152 0.300 . 2 . . . A 15 LEU CD2 . 11534 1 193 . 1 1 15 15 LEU N N 15 119.675 0.300 . 1 . . . A 15 LEU N . 11534 1 194 . 1 1 16 16 GLU H H 1 8.477 0.030 . 1 . . . A 16 GLU H . 11534 1 195 . 1 1 16 16 GLU HA H 1 4.658 0.030 . 1 . . . A 16 GLU HA . 11534 1 196 . 1 1 16 16 GLU HB2 H 1 2.060 0.030 . 1 . . . A 16 GLU HB2 . 11534 1 197 . 1 1 16 16 GLU HB3 H 1 2.060 0.030 . 1 . . . A 16 GLU HB3 . 11534 1 198 . 1 1 16 16 GLU HG2 H 1 2.194 0.030 . 2 . . . A 16 GLU HG2 . 11534 1 199 . 1 1 16 16 GLU HG3 H 1 2.090 0.030 . 2 . . . A 16 GLU HG3 . 11534 1 200 . 1 1 16 16 GLU C C 13 175.538 0.300 . 1 . . . A 16 GLU C . 11534 1 201 . 1 1 16 16 GLU CA C 13 55.282 0.300 . 1 . . . A 16 GLU CA . 11534 1 202 . 1 1 16 16 GLU CB C 13 31.345 0.300 . 1 . . . A 16 GLU CB . 11534 1 203 . 1 1 16 16 GLU CG C 13 36.028 0.300 . 1 . . . A 16 GLU CG . 11534 1 204 . 1 1 16 16 GLU N N 15 121.878 0.300 . 1 . . . A 16 GLU N . 11534 1 205 . 1 1 17 17 ILE H H 1 8.973 0.030 . 1 . . . A 17 ILE H . 11534 1 206 . 1 1 17 17 ILE HA H 1 5.028 0.030 . 1 . . . A 17 ILE HA . 11534 1 207 . 1 1 17 17 ILE HB H 1 1.830 0.030 . 1 . . . A 17 ILE HB . 11534 1 208 . 1 1 17 17 ILE HG12 H 1 1.547 0.030 . 2 . . . A 17 ILE HG12 . 11534 1 209 . 1 1 17 17 ILE HG13 H 1 0.873 0.030 . 2 . . . A 17 ILE HG13 . 11534 1 210 . 1 1 17 17 ILE HG21 H 1 0.818 0.030 . 1 . . . A 17 ILE HG21 . 11534 1 211 . 1 1 17 17 ILE HG22 H 1 0.818 0.030 . 1 . . . A 17 ILE HG22 . 11534 1 212 . 1 1 17 17 ILE HG23 H 1 0.818 0.030 . 1 . . . A 17 ILE HG23 . 11534 1 213 . 1 1 17 17 ILE HD11 H 1 0.821 0.030 . 1 . . . A 17 ILE HD11 . 11534 1 214 . 1 1 17 17 ILE HD12 H 1 0.821 0.030 . 1 . . . A 17 ILE HD12 . 11534 1 215 . 1 1 17 17 ILE HD13 H 1 0.821 0.030 . 1 . . . A 17 ILE HD13 . 11534 1 216 . 1 1 17 17 ILE C C 13 175.679 0.300 . 1 . . . A 17 ILE C . 11534 1 217 . 1 1 17 17 ILE CA C 13 60.533 0.300 . 1 . . . A 17 ILE CA . 11534 1 218 . 1 1 17 17 ILE CB C 13 38.998 0.300 . 1 . . . A 17 ILE CB . 11534 1 219 . 1 1 17 17 ILE CG1 C 13 28.032 0.300 . 1 . . . A 17 ILE CG1 . 11534 1 220 . 1 1 17 17 ILE CG2 C 13 18.090 0.300 . 1 . . . A 17 ILE CG2 . 11534 1 221 . 1 1 17 17 ILE CD1 C 13 13.087 0.300 . 1 . . . A 17 ILE CD1 . 11534 1 222 . 1 1 17 17 ILE N N 15 129.285 0.300 . 1 . . . A 17 ILE N . 11534 1 223 . 1 1 18 18 THR H H 1 9.301 0.030 . 1 . . . A 18 THR H . 11534 1 224 . 1 1 18 18 THR HA H 1 4.603 0.030 . 1 . . . A 18 THR HA . 11534 1 225 . 1 1 18 18 THR HB H 1 4.008 0.030 . 1 . . . A 18 THR HB . 11534 1 226 . 1 1 18 18 THR HG21 H 1 1.162 0.030 . 1 . . . A 18 THR HG21 . 11534 1 227 . 1 1 18 18 THR HG22 H 1 1.162 0.030 . 1 . . . A 18 THR HG22 . 11534 1 228 . 1 1 18 18 THR HG23 H 1 1.162 0.030 . 1 . . . A 18 THR HG23 . 11534 1 229 . 1 1 18 18 THR C C 13 172.397 0.300 . 1 . . . A 18 THR C . 11534 1 230 . 1 1 18 18 THR CA C 13 60.645 0.300 . 1 . . . A 18 THR CA . 11534 1 231 . 1 1 18 18 THR CB C 13 71.866 0.300 . 1 . . . A 18 THR CB . 11534 1 232 . 1 1 18 18 THR CG2 C 13 21.965 0.300 . 1 . . . A 18 THR CG2 . 11534 1 233 . 1 1 18 18 THR N N 15 122.478 0.300 . 1 . . . A 18 THR N . 11534 1 234 . 1 1 19 19 ALA H H 1 8.577 0.030 . 1 . . . A 19 ALA H . 11534 1 235 . 1 1 19 19 ALA HA H 1 4.979 0.030 . 1 . . . A 19 ALA HA . 11534 1 236 . 1 1 19 19 ALA HB1 H 1 1.275 0.030 . 1 . . . A 19 ALA HB1 . 11534 1 237 . 1 1 19 19 ALA HB2 H 1 1.275 0.030 . 1 . . . A 19 ALA HB2 . 11534 1 238 . 1 1 19 19 ALA HB3 H 1 1.275 0.030 . 1 . . . A 19 ALA HB3 . 11534 1 239 . 1 1 19 19 ALA C C 13 177.312 0.300 . 1 . . . A 19 ALA C . 11534 1 240 . 1 1 19 19 ALA CA C 13 51.137 0.300 . 1 . . . A 19 ALA CA . 11534 1 241 . 1 1 19 19 ALA CB C 13 19.302 0.300 . 1 . . . A 19 ALA CB . 11534 1 242 . 1 1 19 19 ALA N N 15 127.137 0.300 . 1 . . . A 19 ALA N . 11534 1 243 . 1 1 20 20 ILE H H 1 8.249 0.030 . 1 . . . A 20 ILE H . 11534 1 244 . 1 1 20 20 ILE HA H 1 4.206 0.030 . 1 . . . A 20 ILE HA . 11534 1 245 . 1 1 20 20 ILE HB H 1 1.653 0.030 . 1 . . . A 20 ILE HB . 11534 1 246 . 1 1 20 20 ILE HG12 H 1 1.080 0.030 . 2 . . . A 20 ILE HG12 . 11534 1 247 . 1 1 20 20 ILE HG13 H 1 0.875 0.030 . 2 . . . A 20 ILE HG13 . 11534 1 248 . 1 1 20 20 ILE HG21 H 1 0.739 0.030 . 1 . . . A 20 ILE HG21 . 11534 1 249 . 1 1 20 20 ILE HG22 H 1 0.739 0.030 . 1 . . . A 20 ILE HG22 . 11534 1 250 . 1 1 20 20 ILE HG23 H 1 0.739 0.030 . 1 . . . A 20 ILE HG23 . 11534 1 251 . 1 1 20 20 ILE HD11 H 1 0.550 0.030 . 1 . . . A 20 ILE HD11 . 11534 1 252 . 1 1 20 20 ILE HD12 H 1 0.550 0.030 . 1 . . . A 20 ILE HD12 . 11534 1 253 . 1 1 20 20 ILE HD13 H 1 0.550 0.030 . 1 . . . A 20 ILE HD13 . 11534 1 254 . 1 1 20 20 ILE C C 13 175.463 0.300 . 1 . . . A 20 ILE C . 11534 1 255 . 1 1 20 20 ILE CA C 13 60.131 0.300 . 1 . . . A 20 ILE CA . 11534 1 256 . 1 1 20 20 ILE CB C 13 39.514 0.300 . 1 . . . A 20 ILE CB . 11534 1 257 . 1 1 20 20 ILE CG1 C 13 26.836 0.300 . 1 . . . A 20 ILE CG1 . 11534 1 258 . 1 1 20 20 ILE CG2 C 13 17.385 0.300 . 1 . . . A 20 ILE CG2 . 11534 1 259 . 1 1 20 20 ILE CD1 C 13 12.368 0.300 . 1 . . . A 20 ILE CD1 . 11534 1 260 . 1 1 20 20 ILE N N 15 122.236 0.300 . 1 . . . A 20 ILE N . 11534 1 261 . 1 1 21 21 ARG H H 1 8.497 0.030 . 1 . . . A 21 ARG H . 11534 1 262 . 1 1 21 21 ARG HA H 1 4.425 0.030 . 1 . . . A 21 ARG HA . 11534 1 263 . 1 1 21 21 ARG HB2 H 1 1.784 0.030 . 2 . . . A 21 ARG HB2 . 11534 1 264 . 1 1 21 21 ARG HB3 H 1 1.704 0.030 . 2 . . . A 21 ARG HB3 . 11534 1 265 . 1 1 21 21 ARG HG2 H 1 1.612 0.030 . 1 . . . A 21 ARG HG2 . 11534 1 266 . 1 1 21 21 ARG HG3 H 1 1.612 0.030 . 1 . . . A 21 ARG HG3 . 11534 1 267 . 1 1 21 21 ARG HD2 H 1 3.156 0.030 . 1 . . . A 21 ARG HD2 . 11534 1 268 . 1 1 21 21 ARG HD3 H 1 3.156 0.030 . 1 . . . A 21 ARG HD3 . 11534 1 269 . 1 1 21 21 ARG C C 13 175.911 0.300 . 1 . . . A 21 ARG C . 11534 1 270 . 1 1 21 21 ARG CA C 13 55.956 0.300 . 1 . . . A 21 ARG CA . 11534 1 271 . 1 1 21 21 ARG CB C 13 30.933 0.300 . 1 . . . A 21 ARG CB . 11534 1 272 . 1 1 21 21 ARG CG C 13 27.150 0.300 . 1 . . . A 21 ARG CG . 11534 1 273 . 1 1 21 21 ARG CD C 13 43.364 0.300 . 1 . . . A 21 ARG CD . 11534 1 274 . 1 1 21 21 ARG N N 15 125.936 0.300 . 1 . . . A 21 ARG N . 11534 1 275 . 1 1 22 22 ALA H H 1 8.511 0.030 . 1 . . . A 22 ALA H . 11534 1 276 . 1 1 22 22 ALA HA H 1 4.275 0.030 . 1 . . . A 22 ALA HA . 11534 1 277 . 1 1 22 22 ALA HB1 H 1 1.318 0.030 . 1 . . . A 22 ALA HB1 . 11534 1 278 . 1 1 22 22 ALA HB2 H 1 1.318 0.030 . 1 . . . A 22 ALA HB2 . 11534 1 279 . 1 1 22 22 ALA HB3 H 1 1.318 0.030 . 1 . . . A 22 ALA HB3 . 11534 1 280 . 1 1 22 22 ALA C C 13 177.215 0.300 . 1 . . . A 22 ALA C . 11534 1 281 . 1 1 22 22 ALA CA C 13 52.006 0.300 . 1 . . . A 22 ALA CA . 11534 1 282 . 1 1 22 22 ALA CB C 13 19.548 0.300 . 1 . . . A 22 ALA CB . 11534 1 283 . 1 1 22 22 ALA N N 15 126.725 0.300 . 1 . . . A 22 ALA N . 11534 1 284 . 1 1 23 23 GLN H H 1 8.490 0.030 . 1 . . . A 23 GLN H . 11534 1 285 . 1 1 23 23 GLN HA H 1 4.355 0.030 . 1 . . . A 23 GLN HA . 11534 1 286 . 1 1 23 23 GLN HB2 H 1 2.043 0.030 . 2 . . . A 23 GLN HB2 . 11534 1 287 . 1 1 23 23 GLN HB3 H 1 1.952 0.030 . 2 . . . A 23 GLN HB3 . 11534 1 288 . 1 1 23 23 GLN HG2 H 1 2.333 0.030 . 1 . . . A 23 GLN HG2 . 11534 1 289 . 1 1 23 23 GLN HG3 H 1 2.333 0.030 . 1 . . . A 23 GLN HG3 . 11534 1 290 . 1 1 23 23 GLN HE21 H 1 6.845 0.030 . 2 . . . A 23 GLN HE21 . 11534 1 291 . 1 1 23 23 GLN HE22 H 1 7.520 0.030 . 2 . . . A 23 GLN HE22 . 11534 1 292 . 1 1 23 23 GLN C C 13 176.479 0.300 . 1 . . . A 23 GLN C . 11534 1 293 . 1 1 23 23 GLN CA C 13 55.814 0.300 . 1 . . . A 23 GLN CA . 11534 1 294 . 1 1 23 23 GLN CB C 13 29.988 0.300 . 1 . . . A 23 GLN CB . 11534 1 295 . 1 1 23 23 GLN CG C 13 33.821 0.300 . 1 . . . A 23 GLN CG . 11534 1 296 . 1 1 23 23 GLN N N 15 120.319 0.300 . 1 . . . A 23 GLN N . 11534 1 297 . 1 1 23 23 GLN NE2 N 15 112.449 0.300 . 1 . . . A 23 GLN NE2 . 11534 1 298 . 1 1 24 24 GLY H H 1 8.485 0.030 . 1 . . . A 24 GLY H . 11534 1 299 . 1 1 24 24 GLY HA2 H 1 3.969 0.030 . 2 . . . A 24 GLY HA2 . 11534 1 300 . 1 1 24 24 GLY HA3 H 1 3.906 0.030 . 2 . . . A 24 GLY HA3 . 11534 1 301 . 1 1 24 24 GLY C C 13 173.855 0.300 . 1 . . . A 24 GLY C . 11534 1 302 . 1 1 24 24 GLY CA C 13 45.123 0.300 . 1 . . . A 24 GLY CA . 11534 1 303 . 1 1 24 24 GLY N N 15 110.694 0.300 . 1 . . . A 24 GLY N . 11534 1 304 . 1 1 25 25 ALA H H 1 8.300 0.030 . 1 . . . A 25 ALA H . 11534 1 305 . 1 1 25 25 ALA HA H 1 4.323 0.030 . 1 . . . A 25 ALA HA . 11534 1 306 . 1 1 25 25 ALA HB1 H 1 1.354 0.030 . 1 . . . A 25 ALA HB1 . 11534 1 307 . 1 1 25 25 ALA HB2 H 1 1.354 0.030 . 1 . . . A 25 ALA HB2 . 11534 1 308 . 1 1 25 25 ALA HB3 H 1 1.354 0.030 . 1 . . . A 25 ALA HB3 . 11534 1 309 . 1 1 25 25 ALA C C 13 178.416 0.300 . 1 . . . A 25 ALA C . 11534 1 310 . 1 1 25 25 ALA CA C 13 52.667 0.300 . 1 . . . A 25 ALA CA . 11534 1 311 . 1 1 25 25 ALA CB C 13 19.302 0.300 . 1 . . . A 25 ALA CB . 11534 1 312 . 1 1 25 25 ALA N N 15 124.008 0.300 . 1 . . . A 25 ALA N . 11534 1 313 . 1 1 26 26 GLY H H 1 8.522 0.030 . 1 . . . A 26 GLY H . 11534 1 314 . 1 1 26 26 GLY HA2 H 1 3.959 0.030 . 2 . . . A 26 GLY HA2 . 11534 1 315 . 1 1 26 26 GLY HA3 H 1 3.907 0.030 . 2 . . . A 26 GLY HA3 . 11534 1 316 . 1 1 26 26 GLY C C 13 174.877 0.300 . 1 . . . A 26 GLY C . 11534 1 317 . 1 1 26 26 GLY CA C 13 45.455 0.300 . 1 . . . A 26 GLY CA . 11534 1 318 . 1 1 26 26 GLY N N 15 108.454 0.300 . 1 . . . A 26 GLY N . 11534 1 319 . 1 1 27 27 GLY H H 1 8.266 0.030 . 1 . . . A 27 GLY H . 11534 1 320 . 1 1 27 27 GLY HA2 H 1 3.938 0.030 . 1 . . . A 27 GLY HA2 . 11534 1 321 . 1 1 27 27 GLY HA3 H 1 3.938 0.030 . 1 . . . A 27 GLY HA3 . 11534 1 322 . 1 1 27 27 GLY C C 13 174.436 0.300 . 1 . . . A 27 GLY C . 11534 1 323 . 1 1 27 27 GLY CA C 13 45.372 0.300 . 1 . . . A 27 GLY CA . 11534 1 324 . 1 1 27 27 GLY N N 15 108.479 0.300 . 1 . . . A 27 GLY N . 11534 1 325 . 1 1 28 28 GLN H H 1 8.255 0.030 . 1 . . . A 28 GLN H . 11534 1 326 . 1 1 28 28 GLN HA H 1 4.224 0.030 . 1 . . . A 28 GLN HA . 11534 1 327 . 1 1 28 28 GLN HB2 H 1 1.977 0.030 . 1 . . . A 28 GLN HB2 . 11534 1 328 . 1 1 28 28 GLN HB3 H 1 1.977 0.030 . 1 . . . A 28 GLN HB3 . 11534 1 329 . 1 1 28 28 GLN HG2 H 1 2.216 0.030 . 2 . . . A 28 GLN HG2 . 11534 1 330 . 1 1 28 28 GLN HG3 H 1 2.250 0.030 . 2 . . . A 28 GLN HG3 . 11534 1 331 . 1 1 28 28 GLN HE21 H 1 6.808 0.030 . 2 . . . A 28 GLN HE21 . 11534 1 332 . 1 1 28 28 GLN HE22 H 1 7.489 0.030 . 2 . . . A 28 GLN HE22 . 11534 1 333 . 1 1 28 28 GLN C C 13 175.915 0.300 . 1 . . . A 28 GLN C . 11534 1 334 . 1 1 28 28 GLN CA C 13 56.175 0.300 . 1 . . . A 28 GLN CA . 11534 1 335 . 1 1 28 28 GLN CB C 13 29.291 0.300 . 1 . . . A 28 GLN CB . 11534 1 336 . 1 1 28 28 GLN CG C 13 33.657 0.300 . 1 . . . A 28 GLN CG . 11534 1 337 . 1 1 28 28 GLN N N 15 119.532 0.300 . 1 . . . A 28 GLN N . 11534 1 338 . 1 1 28 28 GLN NE2 N 15 112.303 0.300 . 1 . . . A 28 GLN NE2 . 11534 1 339 . 1 1 29 29 HIS HA H 1 4.601 0.030 . 1 . . . A 29 HIS HA . 11534 1 340 . 1 1 29 29 HIS HB2 H 1 3.092 0.030 . 2 . . . A 29 HIS HB2 . 11534 1 341 . 1 1 29 29 HIS HB3 H 1 3.037 0.030 . 2 . . . A 29 HIS HB3 . 11534 1 342 . 1 1 29 29 HIS HD2 H 1 6.971 0.030 . 1 . . . A 29 HIS HD2 . 11534 1 343 . 1 1 29 29 HIS C C 13 175.735 0.300 . 1 . . . A 29 HIS C . 11534 1 344 . 1 1 29 29 HIS CA C 13 56.546 0.300 . 1 . . . A 29 HIS CA . 11534 1 345 . 1 1 29 29 HIS CB C 13 30.798 0.300 . 1 . . . A 29 HIS CB . 11534 1 346 . 1 1 29 29 HIS CD2 C 13 119.383 0.300 . 1 . . . A 29 HIS CD2 . 11534 1 347 . 1 1 30 30 VAL H H 1 7.888 0.030 . 1 . . . A 30 VAL H . 11534 1 348 . 1 1 30 30 VAL HA H 1 4.040 0.030 . 1 . . . A 30 VAL HA . 11534 1 349 . 1 1 30 30 VAL HB H 1 2.028 0.030 . 1 . . . A 30 VAL HB . 11534 1 350 . 1 1 30 30 VAL HG11 H 1 0.849 0.030 . 2 . . . A 30 VAL HG11 . 11534 1 351 . 1 1 30 30 VAL HG12 H 1 0.849 0.030 . 2 . . . A 30 VAL HG12 . 11534 1 352 . 1 1 30 30 VAL HG13 H 1 0.849 0.030 . 2 . . . A 30 VAL HG13 . 11534 1 353 . 1 1 30 30 VAL HG21 H 1 0.869 0.030 . 2 . . . A 30 VAL HG21 . 11534 1 354 . 1 1 30 30 VAL HG22 H 1 0.869 0.030 . 2 . . . A 30 VAL HG22 . 11534 1 355 . 1 1 30 30 VAL HG23 H 1 0.869 0.030 . 2 . . . A 30 VAL HG23 . 11534 1 356 . 1 1 30 30 VAL C C 13 175.787 0.300 . 1 . . . A 30 VAL C . 11534 1 357 . 1 1 30 30 VAL CA C 13 62.659 0.300 . 1 . . . A 30 VAL CA . 11534 1 358 . 1 1 30 30 VAL CB C 13 32.662 0.300 . 1 . . . A 30 VAL CB . 11534 1 359 . 1 1 30 30 VAL CG1 C 13 20.390 0.300 . 2 . . . A 30 VAL CG1 . 11534 1 360 . 1 1 30 30 VAL CG2 C 13 21.057 0.300 . 2 . . . A 30 VAL CG2 . 11534 1 361 . 1 1 30 30 VAL N N 15 120.292 0.300 . 1 . . . A 30 VAL N . 11534 1 362 . 1 1 31 31 ASN H H 1 8.612 0.030 . 1 . . . A 31 ASN H . 11534 1 363 . 1 1 31 31 ASN HA H 1 4.708 0.030 . 1 . . . A 31 ASN HA . 11534 1 364 . 1 1 31 31 ASN HB2 H 1 2.879 0.030 . 2 . . . A 31 ASN HB2 . 11534 1 365 . 1 1 31 31 ASN HB3 H 1 2.786 0.030 . 2 . . . A 31 ASN HB3 . 11534 1 366 . 1 1 31 31 ASN HD21 H 1 6.936 0.030 . 2 . . . A 31 ASN HD21 . 11534 1 367 . 1 1 31 31 ASN HD22 H 1 7.605 0.030 . 2 . . . A 31 ASN HD22 . 11534 1 368 . 1 1 31 31 ASN C C 13 175.317 0.300 . 1 . . . A 31 ASN C . 11534 1 369 . 1 1 31 31 ASN CA C 13 53.411 0.300 . 1 . . . A 31 ASN CA . 11534 1 370 . 1 1 31 31 ASN CB C 13 38.751 0.300 . 1 . . . A 31 ASN CB . 11534 1 371 . 1 1 31 31 ASN N N 15 121.472 0.300 . 1 . . . A 31 ASN N . 11534 1 372 . 1 1 31 31 ASN ND2 N 15 112.921 0.300 . 1 . . . A 31 ASN ND2 . 11534 1 373 . 1 1 32 32 LYS H H 1 8.267 0.030 . 1 . . . A 32 LYS H . 11534 1 374 . 1 1 32 32 LYS HA H 1 4.350 0.030 . 1 . . . A 32 LYS HA . 11534 1 375 . 1 1 32 32 LYS HB2 H 1 1.880 0.030 . 2 . . . A 32 LYS HB2 . 11534 1 376 . 1 1 32 32 LYS HB3 H 1 1.756 0.030 . 2 . . . A 32 LYS HB3 . 11534 1 377 . 1 1 32 32 LYS HG2 H 1 1.434 0.030 . 2 . . . A 32 LYS HG2 . 11534 1 378 . 1 1 32 32 LYS HG3 H 1 1.390 0.030 . 2 . . . A 32 LYS HG3 . 11534 1 379 . 1 1 32 32 LYS HD2 H 1 1.656 0.030 . 1 . . . A 32 LYS HD2 . 11534 1 380 . 1 1 32 32 LYS HD3 H 1 1.656 0.030 . 1 . . . A 32 LYS HD3 . 11534 1 381 . 1 1 32 32 LYS C C 13 176.562 0.300 . 1 . . . A 32 LYS C . 11534 1 382 . 1 1 32 32 LYS CA C 13 56.653 0.300 . 1 . . . A 32 LYS CA . 11534 1 383 . 1 1 32 32 LYS CB C 13 33.189 0.300 . 1 . . . A 32 LYS CB . 11534 1 384 . 1 1 32 32 LYS CG C 13 24.803 0.300 . 1 . . . A 32 LYS CG . 11534 1 385 . 1 1 32 32 LYS CD C 13 29.059 0.300 . 1 . . . A 32 LYS CD . 11534 1 386 . 1 1 32 32 LYS N N 15 121.146 0.300 . 1 . . . A 32 LYS N . 11534 1 387 . 1 1 33 33 THR H H 1 8.089 0.030 . 1 . . . A 33 THR H . 11534 1 388 . 1 1 33 33 THR HA H 1 4.383 0.030 . 1 . . . A 33 THR HA . 11534 1 389 . 1 1 33 33 THR HB H 1 4.197 0.030 . 1 . . . A 33 THR HB . 11534 1 390 . 1 1 33 33 THR HG21 H 1 1.192 0.030 . 1 . . . A 33 THR HG21 . 11534 1 391 . 1 1 33 33 THR HG22 H 1 1.192 0.030 . 1 . . . A 33 THR HG22 . 11534 1 392 . 1 1 33 33 THR HG23 H 1 1.192 0.030 . 1 . . . A 33 THR HG23 . 11534 1 393 . 1 1 33 33 THR C C 13 174.458 0.300 . 1 . . . A 33 THR C . 11534 1 394 . 1 1 33 33 THR CA C 13 61.826 0.300 . 1 . . . A 33 THR CA . 11534 1 395 . 1 1 33 33 THR CB C 13 69.860 0.300 . 1 . . . A 33 THR CB . 11534 1 396 . 1 1 33 33 THR CG2 C 13 21.736 0.300 . 1 . . . A 33 THR CG2 . 11534 1 397 . 1 1 33 33 THR N N 15 113.985 0.300 . 1 . . . A 33 THR N . 11534 1 398 . 1 1 34 34 SER H H 1 8.450 0.030 . 1 . . . A 34 SER H . 11534 1 399 . 1 1 34 34 SER HA H 1 4.631 0.030 . 1 . . . A 34 SER HA . 11534 1 400 . 1 1 34 34 SER HB2 H 1 3.766 0.030 . 2 . . . A 34 SER HB2 . 11534 1 401 . 1 1 34 34 SER HB3 H 1 3.868 0.030 . 2 . . . A 34 SER HB3 . 11534 1 402 . 1 1 34 34 SER C C 13 174.562 0.300 . 1 . . . A 34 SER C . 11534 1 403 . 1 1 34 34 SER CA C 13 58.105 0.300 . 1 . . . A 34 SER CA . 11534 1 404 . 1 1 34 34 SER CB C 13 63.846 0.300 . 1 . . . A 34 SER CB . 11534 1 405 . 1 1 34 34 SER N N 15 119.190 0.300 . 1 . . . A 34 SER N . 11534 1 406 . 1 1 35 35 THR H H 1 8.259 0.030 . 1 . . . A 35 THR H . 11534 1 407 . 1 1 35 35 THR HA H 1 4.395 0.030 . 1 . . . A 35 THR HA . 11534 1 408 . 1 1 35 35 THR HB H 1 4.049 0.030 . 1 . . . A 35 THR HB . 11534 1 409 . 1 1 35 35 THR HG21 H 1 1.150 0.030 . 1 . . . A 35 THR HG21 . 11534 1 410 . 1 1 35 35 THR HG22 H 1 1.150 0.030 . 1 . . . A 35 THR HG22 . 11534 1 411 . 1 1 35 35 THR HG23 H 1 1.150 0.030 . 1 . . . A 35 THR HG23 . 11534 1 412 . 1 1 35 35 THR C C 13 173.641 0.300 . 1 . . . A 35 THR C . 11534 1 413 . 1 1 35 35 THR CA C 13 61.950 0.300 . 1 . . . A 35 THR CA . 11534 1 414 . 1 1 35 35 THR CB C 13 69.934 0.300 . 1 . . . A 35 THR CB . 11534 1 415 . 1 1 35 35 THR CG2 C 13 22.243 0.300 . 1 . . . A 35 THR CG2 . 11534 1 416 . 1 1 35 35 THR N N 15 115.002 0.300 . 1 . . . A 35 THR N . 11534 1 417 . 1 1 36 36 ALA H H 1 8.130 0.030 . 1 . . . A 36 ALA H . 11534 1 418 . 1 1 36 36 ALA HA H 1 4.682 0.030 . 1 . . . A 36 ALA HA . 11534 1 419 . 1 1 36 36 ALA HB1 H 1 1.354 0.030 . 1 . . . A 36 ALA HB1 . 11534 1 420 . 1 1 36 36 ALA HB2 H 1 1.354 0.030 . 1 . . . A 36 ALA HB2 . 11534 1 421 . 1 1 36 36 ALA HB3 H 1 1.354 0.030 . 1 . . . A 36 ALA HB3 . 11534 1 422 . 1 1 36 36 ALA C C 13 176.547 0.300 . 1 . . . A 36 ALA C . 11534 1 423 . 1 1 36 36 ALA CA C 13 51.888 0.300 . 1 . . . A 36 ALA CA . 11534 1 424 . 1 1 36 36 ALA CB C 13 21.302 0.300 . 1 . . . A 36 ALA CB . 11534 1 425 . 1 1 36 36 ALA N N 15 125.571 0.300 . 1 . . . A 36 ALA N . 11534 1 426 . 1 1 37 37 ILE H H 1 8.470 0.030 . 1 . . . A 37 ILE H . 11534 1 427 . 1 1 37 37 ILE HA H 1 4.941 0.030 . 1 . . . A 37 ILE HA . 11534 1 428 . 1 1 37 37 ILE HB H 1 1.815 0.030 . 1 . . . A 37 ILE HB . 11534 1 429 . 1 1 37 37 ILE HG12 H 1 1.308 0.030 . 2 . . . A 37 ILE HG12 . 11534 1 430 . 1 1 37 37 ILE HG13 H 1 1.543 0.030 . 2 . . . A 37 ILE HG13 . 11534 1 431 . 1 1 37 37 ILE HG21 H 1 0.764 0.030 . 1 . . . A 37 ILE HG21 . 11534 1 432 . 1 1 37 37 ILE HG22 H 1 0.764 0.030 . 1 . . . A 37 ILE HG22 . 11534 1 433 . 1 1 37 37 ILE HG23 H 1 0.764 0.030 . 1 . . . A 37 ILE HG23 . 11534 1 434 . 1 1 37 37 ILE HD11 H 1 0.706 0.030 . 1 . . . A 37 ILE HD11 . 11534 1 435 . 1 1 37 37 ILE HD12 H 1 0.706 0.030 . 1 . . . A 37 ILE HD12 . 11534 1 436 . 1 1 37 37 ILE HD13 H 1 0.706 0.030 . 1 . . . A 37 ILE HD13 . 11534 1 437 . 1 1 37 37 ILE C C 13 173.773 0.300 . 1 . . . A 37 ILE C . 11534 1 438 . 1 1 37 37 ILE CA C 13 56.849 0.300 . 1 . . . A 37 ILE CA . 11534 1 439 . 1 1 37 37 ILE CB C 13 40.315 0.300 . 1 . . . A 37 ILE CB . 11534 1 440 . 1 1 37 37 ILE CG1 C 13 26.574 0.300 . 1 . . . A 37 ILE CG1 . 11534 1 441 . 1 1 37 37 ILE CG2 C 13 18.457 0.300 . 1 . . . A 37 ILE CG2 . 11534 1 442 . 1 1 37 37 ILE CD1 C 13 9.874 0.300 . 1 . . . A 37 ILE CD1 . 11534 1 443 . 1 1 37 37 ILE N N 15 118.824 0.300 . 1 . . . A 37 ILE N . 11534 1 444 . 1 1 38 38 HIS H H 1 9.188 0.030 . 1 . . . A 38 HIS H . 11534 1 445 . 1 1 38 38 HIS HA H 1 5.144 0.030 . 1 . . . A 38 HIS HA . 11534 1 446 . 1 1 38 38 HIS HB2 H 1 3.063 0.030 . 2 . . . A 38 HIS HB2 . 11534 1 447 . 1 1 38 38 HIS HB3 H 1 2.803 0.030 . 2 . . . A 38 HIS HB3 . 11534 1 448 . 1 1 38 38 HIS HD2 H 1 6.706 0.030 . 1 . . . A 38 HIS HD2 . 11534 1 449 . 1 1 38 38 HIS HE1 H 1 7.570 0.030 . 1 . . . A 38 HIS HE1 . 11534 1 450 . 1 1 38 38 HIS C C 13 172.859 0.300 . 1 . . . A 38 HIS C . 11534 1 451 . 1 1 38 38 HIS CA C 13 54.711 0.300 . 1 . . . A 38 HIS CA . 11534 1 452 . 1 1 38 38 HIS CB C 13 32.949 0.300 . 1 . . . A 38 HIS CB . 11534 1 453 . 1 1 38 38 HIS CD2 C 13 118.034 0.300 . 1 . . . A 38 HIS CD2 . 11534 1 454 . 1 1 38 38 HIS CE1 C 13 138.134 0.300 . 1 . . . A 38 HIS CE1 . 11534 1 455 . 1 1 38 38 HIS N N 15 127.085 0.300 . 1 . . . A 38 HIS N . 11534 1 456 . 1 1 39 39 LEU H H 1 9.313 0.030 . 1 . . . A 39 LEU H . 11534 1 457 . 1 1 39 39 LEU HA H 1 5.191 0.030 . 1 . . . A 39 LEU HA . 11534 1 458 . 1 1 39 39 LEU HB2 H 1 1.729 0.030 . 2 . . . A 39 LEU HB2 . 11534 1 459 . 1 1 39 39 LEU HB3 H 1 1.270 0.030 . 2 . . . A 39 LEU HB3 . 11534 1 460 . 1 1 39 39 LEU HG H 1 1.488 0.030 . 1 . . . A 39 LEU HG . 11534 1 461 . 1 1 39 39 LEU HD11 H 1 0.755 0.030 . 2 . . . A 39 LEU HD11 . 11534 1 462 . 1 1 39 39 LEU HD12 H 1 0.755 0.030 . 2 . . . A 39 LEU HD12 . 11534 1 463 . 1 1 39 39 LEU HD13 H 1 0.755 0.030 . 2 . . . A 39 LEU HD13 . 11534 1 464 . 1 1 39 39 LEU HD21 H 1 0.713 0.030 . 2 . . . A 39 LEU HD21 . 11534 1 465 . 1 1 39 39 LEU HD22 H 1 0.713 0.030 . 2 . . . A 39 LEU HD22 . 11534 1 466 . 1 1 39 39 LEU HD23 H 1 0.713 0.030 . 2 . . . A 39 LEU HD23 . 11534 1 467 . 1 1 39 39 LEU C C 13 173.662 0.300 . 1 . . . A 39 LEU C . 11534 1 468 . 1 1 39 39 LEU CA C 13 53.925 0.300 . 1 . . . A 39 LEU CA . 11534 1 469 . 1 1 39 39 LEU CB C 13 45.295 0.300 . 1 . . . A 39 LEU CB . 11534 1 470 . 1 1 39 39 LEU CG C 13 28.032 0.300 . 1 . . . A 39 LEU CG . 11534 1 471 . 1 1 39 39 LEU CD1 C 13 27.441 0.300 . 2 . . . A 39 LEU CD1 . 11534 1 472 . 1 1 39 39 LEU CD2 C 13 25.400 0.300 . 2 . . . A 39 LEU CD2 . 11534 1 473 . 1 1 39 39 LEU N N 15 128.907 0.300 . 1 . . . A 39 LEU N . 11534 1 474 . 1 1 40 40 ARG H H 1 9.122 0.030 . 1 . . . A 40 ARG H . 11534 1 475 . 1 1 40 40 ARG HA H 1 5.473 0.030 . 1 . . . A 40 ARG HA . 11534 1 476 . 1 1 40 40 ARG HB2 H 1 1.812 0.030 . 2 . . . A 40 ARG HB2 . 11534 1 477 . 1 1 40 40 ARG HB3 H 1 1.629 0.030 . 2 . . . A 40 ARG HB3 . 11534 1 478 . 1 1 40 40 ARG HG2 H 1 1.446 0.030 . 1 . . . A 40 ARG HG2 . 11534 1 479 . 1 1 40 40 ARG HG3 H 1 1.446 0.030 . 1 . . . A 40 ARG HG3 . 11534 1 480 . 1 1 40 40 ARG HD2 H 1 3.177 0.030 . 1 . . . A 40 ARG HD2 . 11534 1 481 . 1 1 40 40 ARG HD3 H 1 3.177 0.030 . 1 . . . A 40 ARG HD3 . 11534 1 482 . 1 1 40 40 ARG HE H 1 7.360 0.030 . 1 . . . A 40 ARG HE . 11534 1 483 . 1 1 40 40 ARG C C 13 174.894 0.300 . 1 . . . A 40 ARG C . 11534 1 484 . 1 1 40 40 ARG CA C 13 54.555 0.300 . 1 . . . A 40 ARG CA . 11534 1 485 . 1 1 40 40 ARG CB C 13 34.225 0.300 . 1 . . . A 40 ARG CB . 11534 1 486 . 1 1 40 40 ARG CG C 13 28.483 0.300 . 1 . . . A 40 ARG CG . 11534 1 487 . 1 1 40 40 ARG CD C 13 43.388 0.300 . 1 . . . A 40 ARG CD . 11534 1 488 . 1 1 40 40 ARG N N 15 126.222 0.300 . 1 . . . A 40 ARG N . 11534 1 489 . 1 1 40 40 ARG NE N 15 84.602 0.300 . 1 . . . A 40 ARG NE . 11534 1 490 . 1 1 41 41 PHE H H 1 9.286 0.030 . 1 . . . A 41 PHE H . 11534 1 491 . 1 1 41 41 PHE HA H 1 5.268 0.030 . 1 . . . A 41 PHE HA . 11534 1 492 . 1 1 41 41 PHE HB2 H 1 2.777 0.030 . 1 . . . A 41 PHE HB2 . 11534 1 493 . 1 1 41 41 PHE HB3 H 1 2.777 0.030 . 1 . . . A 41 PHE HB3 . 11534 1 494 . 1 1 41 41 PHE HD1 H 1 7.216 0.030 . 1 . . . A 41 PHE HD1 . 11534 1 495 . 1 1 41 41 PHE HD2 H 1 7.216 0.030 . 1 . . . A 41 PHE HD2 . 11534 1 496 . 1 1 41 41 PHE HE1 H 1 7.127 0.030 . 1 . . . A 41 PHE HE1 . 11534 1 497 . 1 1 41 41 PHE HE2 H 1 7.127 0.030 . 1 . . . A 41 PHE HE2 . 11534 1 498 . 1 1 41 41 PHE HZ H 1 7.194 0.030 . 1 . . . A 41 PHE HZ . 11534 1 499 . 1 1 41 41 PHE C C 13 172.725 0.300 . 1 . . . A 41 PHE C . 11534 1 500 . 1 1 41 41 PHE CA C 13 55.378 0.300 . 1 . . . A 41 PHE CA . 11534 1 501 . 1 1 41 41 PHE CB C 13 41.753 0.300 . 1 . . . A 41 PHE CB . 11534 1 502 . 1 1 41 41 PHE CD1 C 13 131.666 0.300 . 1 . . . A 41 PHE CD1 . 11534 1 503 . 1 1 41 41 PHE CD2 C 13 131.666 0.300 . 1 . . . A 41 PHE CD2 . 11534 1 504 . 1 1 41 41 PHE CE1 C 13 130.794 0.300 . 1 . . . A 41 PHE CE1 . 11534 1 505 . 1 1 41 41 PHE CE2 C 13 130.794 0.300 . 1 . . . A 41 PHE CE2 . 11534 1 506 . 1 1 41 41 PHE CZ C 13 129.753 0.300 . 1 . . . A 41 PHE CZ . 11534 1 507 . 1 1 41 41 PHE N N 15 125.249 0.300 . 1 . . . A 41 PHE N . 11534 1 508 . 1 1 42 42 ASP H H 1 9.044 0.030 . 1 . . . A 42 ASP H . 11534 1 509 . 1 1 42 42 ASP HA H 1 4.350 0.030 . 1 . . . A 42 ASP HA . 11534 1 510 . 1 1 42 42 ASP HB2 H 1 2.259 0.030 . 2 . . . A 42 ASP HB2 . 11534 1 511 . 1 1 42 42 ASP HB3 H 1 2.833 0.030 . 2 . . . A 42 ASP HB3 . 11534 1 512 . 1 1 42 42 ASP C C 13 175.472 0.300 . 1 . . . A 42 ASP C . 11534 1 513 . 1 1 42 42 ASP CA C 13 53.517 0.300 . 1 . . . A 42 ASP CA . 11534 1 514 . 1 1 42 42 ASP CB C 13 40.725 0.300 . 1 . . . A 42 ASP CB . 11534 1 515 . 1 1 42 42 ASP N N 15 129.366 0.300 . 1 . . . A 42 ASP N . 11534 1 516 . 1 1 43 43 ILE H H 1 7.823 0.030 . 1 . . . A 43 ILE H . 11534 1 517 . 1 1 43 43 ILE HA H 1 2.813 0.030 . 1 . . . A 43 ILE HA . 11534 1 518 . 1 1 43 43 ILE HB H 1 1.748 0.030 . 1 . . . A 43 ILE HB . 11534 1 519 . 1 1 43 43 ILE HG12 H 1 1.741 0.030 . 2 . . . A 43 ILE HG12 . 11534 1 520 . 1 1 43 43 ILE HG13 H 1 0.762 0.030 . 2 . . . A 43 ILE HG13 . 11534 1 521 . 1 1 43 43 ILE HG21 H 1 0.773 0.030 . 1 . . . A 43 ILE HG21 . 11534 1 522 . 1 1 43 43 ILE HG22 H 1 0.773 0.030 . 1 . . . A 43 ILE HG22 . 11534 1 523 . 1 1 43 43 ILE HG23 H 1 0.773 0.030 . 1 . . . A 43 ILE HG23 . 11534 1 524 . 1 1 43 43 ILE HD11 H 1 0.741 0.030 . 1 . . . A 43 ILE HD11 . 11534 1 525 . 1 1 43 43 ILE HD12 H 1 0.741 0.030 . 1 . . . A 43 ILE HD12 . 11534 1 526 . 1 1 43 43 ILE HD13 H 1 0.741 0.030 . 1 . . . A 43 ILE HD13 . 11534 1 527 . 1 1 43 43 ILE C C 13 179.450 0.300 . 1 . . . A 43 ILE C . 11534 1 528 . 1 1 43 43 ILE CA C 13 65.562 0.300 . 1 . . . A 43 ILE CA . 11534 1 529 . 1 1 43 43 ILE CB C 13 39.343 0.300 . 1 . . . A 43 ILE CB . 11534 1 530 . 1 1 43 43 ILE CG1 C 13 28.806 0.300 . 1 . . . A 43 ILE CG1 . 11534 1 531 . 1 1 43 43 ILE CG2 C 13 18.392 0.300 . 1 . . . A 43 ILE CG2 . 11534 1 532 . 1 1 43 43 ILE CD1 C 13 14.678 0.300 . 1 . . . A 43 ILE CD1 . 11534 1 533 . 1 1 43 43 ILE N N 15 125.925 0.300 . 1 . . . A 43 ILE N . 11534 1 534 . 1 1 44 44 ARG H H 1 8.537 0.030 . 1 . . . A 44 ARG H . 11534 1 535 . 1 1 44 44 ARG HA H 1 3.752 0.030 . 1 . . . A 44 ARG HA . 11534 1 536 . 1 1 44 44 ARG HB2 H 1 1.874 0.030 . 2 . . . A 44 ARG HB2 . 11534 1 537 . 1 1 44 44 ARG HB3 H 1 1.780 0.030 . 2 . . . A 44 ARG HB3 . 11534 1 538 . 1 1 44 44 ARG HG2 H 1 1.599 0.030 . 2 . . . A 44 ARG HG2 . 11534 1 539 . 1 1 44 44 ARG HG3 H 1 1.778 0.030 . 2 . . . A 44 ARG HG3 . 11534 1 540 . 1 1 44 44 ARG HD2 H 1 3.191 0.030 . 1 . . . A 44 ARG HD2 . 11534 1 541 . 1 1 44 44 ARG HD3 H 1 3.191 0.030 . 1 . . . A 44 ARG HD3 . 11534 1 542 . 1 1 44 44 ARG HE H 1 7.237 0.030 . 1 . . . A 44 ARG HE . 11534 1 543 . 1 1 44 44 ARG C C 13 177.701 0.300 . 1 . . . A 44 ARG C . 11534 1 544 . 1 1 44 44 ARG CA C 13 60.394 0.300 . 1 . . . A 44 ARG CA . 11534 1 545 . 1 1 44 44 ARG CB C 13 29.699 0.300 . 1 . . . A 44 ARG CB . 11534 1 546 . 1 1 44 44 ARG CG C 13 29.538 0.300 . 1 . . . A 44 ARG CG . 11534 1 547 . 1 1 44 44 ARG CD C 13 43.284 0.300 . 1 . . . A 44 ARG CD . 11534 1 548 . 1 1 44 44 ARG N N 15 118.762 0.300 . 1 . . . A 44 ARG N . 11534 1 549 . 1 1 44 44 ARG NE N 15 84.708 0.300 . 1 . . . A 44 ARG NE . 11534 1 550 . 1 1 45 45 ALA H H 1 7.304 0.030 . 1 . . . A 45 ALA H . 11534 1 551 . 1 1 45 45 ALA HA H 1 4.176 0.030 . 1 . . . A 45 ALA HA . 11534 1 552 . 1 1 45 45 ALA HB1 H 1 1.210 0.030 . 1 . . . A 45 ALA HB1 . 11534 1 553 . 1 1 45 45 ALA HB2 H 1 1.210 0.030 . 1 . . . A 45 ALA HB2 . 11534 1 554 . 1 1 45 45 ALA HB3 H 1 1.210 0.030 . 1 . . . A 45 ALA HB3 . 11534 1 555 . 1 1 45 45 ALA C C 13 177.131 0.300 . 1 . . . A 45 ALA C . 11534 1 556 . 1 1 45 45 ALA CA C 13 52.051 0.300 . 1 . . . A 45 ALA CA . 11534 1 557 . 1 1 45 45 ALA CB C 13 18.946 0.300 . 1 . . . A 45 ALA CB . 11534 1 558 . 1 1 45 45 ALA N N 15 119.163 0.300 . 1 . . . A 45 ALA N . 11534 1 559 . 1 1 46 46 SER H H 1 7.015 0.030 . 1 . . . A 46 SER H . 11534 1 560 . 1 1 46 46 SER HA H 1 4.281 0.030 . 1 . . . A 46 SER HA . 11534 1 561 . 1 1 46 46 SER HB2 H 1 3.999 0.030 . 2 . . . A 46 SER HB2 . 11534 1 562 . 1 1 46 46 SER HB3 H 1 4.448 0.030 . 2 . . . A 46 SER HB3 . 11534 1 563 . 1 1 46 46 SER C C 13 173.864 0.300 . 1 . . . A 46 SER C . 11534 1 564 . 1 1 46 46 SER CA C 13 59.275 0.300 . 1 . . . A 46 SER CA . 11534 1 565 . 1 1 46 46 SER CB C 13 67.368 0.300 . 1 . . . A 46 SER CB . 11534 1 566 . 1 1 46 46 SER N N 15 114.465 0.300 . 1 . . . A 46 SER N . 11534 1 567 . 1 1 47 47 SER H H 1 10.300 0.030 . 1 . . . A 47 SER H . 11534 1 568 . 1 1 47 47 SER HA H 1 4.651 0.030 . 1 . . . A 47 SER HA . 11534 1 569 . 1 1 47 47 SER HB2 H 1 4.173 0.030 . 2 . . . A 47 SER HB2 . 11534 1 570 . 1 1 47 47 SER HB3 H 1 3.950 0.030 . 2 . . . A 47 SER HB3 . 11534 1 571 . 1 1 47 47 SER C C 13 175.532 0.300 . 1 . . . A 47 SER C . 11534 1 572 . 1 1 47 47 SER CA C 13 57.872 0.300 . 1 . . . A 47 SER CA . 11534 1 573 . 1 1 47 47 SER CB C 13 62.406 0.300 . 1 . . . A 47 SER CB . 11534 1 574 . 1 1 47 47 SER N N 15 115.307 0.300 . 1 . . . A 47 SER N . 11534 1 575 . 1 1 48 48 LEU H H 1 7.548 0.030 . 1 . . . A 48 LEU H . 11534 1 576 . 1 1 48 48 LEU HA H 1 4.319 0.030 . 1 . . . A 48 LEU HA . 11534 1 577 . 1 1 48 48 LEU HB2 H 1 1.570 0.030 . 2 . . . A 48 LEU HB2 . 11534 1 578 . 1 1 48 48 LEU HB3 H 1 1.239 0.030 . 2 . . . A 48 LEU HB3 . 11534 1 579 . 1 1 48 48 LEU HG H 1 2.084 0.030 . 1 . . . A 48 LEU HG . 11534 1 580 . 1 1 48 48 LEU HD11 H 1 0.950 0.030 . 2 . . . A 48 LEU HD11 . 11534 1 581 . 1 1 48 48 LEU HD12 H 1 0.950 0.030 . 2 . . . A 48 LEU HD12 . 11534 1 582 . 1 1 48 48 LEU HD13 H 1 0.950 0.030 . 2 . . . A 48 LEU HD13 . 11534 1 583 . 1 1 48 48 LEU HD21 H 1 0.711 0.030 . 2 . . . A 48 LEU HD21 . 11534 1 584 . 1 1 48 48 LEU HD22 H 1 0.711 0.030 . 2 . . . A 48 LEU HD22 . 11534 1 585 . 1 1 48 48 LEU HD23 H 1 0.711 0.030 . 2 . . . A 48 LEU HD23 . 11534 1 586 . 1 1 48 48 LEU C C 13 173.936 0.300 . 1 . . . A 48 LEU C . 11534 1 587 . 1 1 48 48 LEU CA C 13 53.765 0.300 . 1 . . . A 48 LEU CA . 11534 1 588 . 1 1 48 48 LEU CB C 13 42.274 0.300 . 1 . . . A 48 LEU CB . 11534 1 589 . 1 1 48 48 LEU CG C 13 26.926 0.300 . 1 . . . A 48 LEU CG . 11534 1 590 . 1 1 48 48 LEU CD1 C 13 26.967 0.300 . 2 . . . A 48 LEU CD1 . 11534 1 591 . 1 1 48 48 LEU CD2 C 13 23.184 0.300 . 2 . . . A 48 LEU CD2 . 11534 1 592 . 1 1 48 48 LEU N N 15 121.545 0.300 . 1 . . . A 48 LEU N . 11534 1 593 . 1 1 49 49 PRO HA H 1 4.533 0.030 . 1 . . . A 49 PRO HA . 11534 1 594 . 1 1 49 49 PRO HB2 H 1 2.619 0.030 . 2 . . . A 49 PRO HB2 . 11534 1 595 . 1 1 49 49 PRO HB3 H 1 1.743 0.030 . 2 . . . A 49 PRO HB3 . 11534 1 596 . 1 1 49 49 PRO HG2 H 1 2.135 0.030 . 2 . . . A 49 PRO HG2 . 11534 1 597 . 1 1 49 49 PRO HG3 H 1 1.855 0.030 . 2 . . . A 49 PRO HG3 . 11534 1 598 . 1 1 49 49 PRO HD2 H 1 3.964 0.030 . 2 . . . A 49 PRO HD2 . 11534 1 599 . 1 1 49 49 PRO HD3 H 1 3.008 0.030 . 2 . . . A 49 PRO HD3 . 11534 1 600 . 1 1 49 49 PRO C C 13 177.909 0.300 . 1 . . . A 49 PRO C . 11534 1 601 . 1 1 49 49 PRO CA C 13 62.588 0.300 . 1 . . . A 49 PRO CA . 11534 1 602 . 1 1 49 49 PRO CB C 13 32.684 0.300 . 1 . . . A 49 PRO CB . 11534 1 603 . 1 1 49 49 PRO CG C 13 27.971 0.300 . 1 . . . A 49 PRO CG . 11534 1 604 . 1 1 49 49 PRO CD C 13 50.048 0.300 . 1 . . . A 49 PRO CD . 11534 1 605 . 1 1 50 50 GLU H H 1 9.174 0.030 . 1 . . . A 50 GLU H . 11534 1 606 . 1 1 50 50 GLU HA H 1 3.879 0.030 . 1 . . . A 50 GLU HA . 11534 1 607 . 1 1 50 50 GLU HB2 H 1 2.126 0.030 . 1 . . . A 50 GLU HB2 . 11534 1 608 . 1 1 50 50 GLU HB3 H 1 2.126 0.030 . 1 . . . A 50 GLU HB3 . 11534 1 609 . 1 1 50 50 GLU HG2 H 1 2.408 0.030 . 1 . . . A 50 GLU HG2 . 11534 1 610 . 1 1 50 50 GLU HG3 H 1 2.408 0.030 . 1 . . . A 50 GLU HG3 . 11534 1 611 . 1 1 50 50 GLU C C 13 177.909 0.300 . 1 . . . A 50 GLU C . 11534 1 612 . 1 1 50 50 GLU CA C 13 60.462 0.300 . 1 . . . A 50 GLU CA . 11534 1 613 . 1 1 50 50 GLU CB C 13 29.204 0.300 . 1 . . . A 50 GLU CB . 11534 1 614 . 1 1 50 50 GLU CG C 13 36.048 0.300 . 1 . . . A 50 GLU CG . 11534 1 615 . 1 1 50 50 GLU N N 15 125.219 0.300 . 1 . . . A 50 GLU N . 11534 1 616 . 1 1 51 51 TYR H H 1 8.667 0.030 . 1 . . . A 51 TYR H . 11534 1 617 . 1 1 51 51 TYR HA H 1 4.337 0.030 . 1 . . . A 51 TYR HA . 11534 1 618 . 1 1 51 51 TYR HB2 H 1 3.246 0.030 . 2 . . . A 51 TYR HB2 . 11534 1 619 . 1 1 51 51 TYR HB3 H 1 2.754 0.030 . 2 . . . A 51 TYR HB3 . 11534 1 620 . 1 1 51 51 TYR HD1 H 1 6.828 0.030 . 1 . . . A 51 TYR HD1 . 11534 1 621 . 1 1 51 51 TYR HD2 H 1 6.828 0.030 . 1 . . . A 51 TYR HD2 . 11534 1 622 . 1 1 51 51 TYR HE1 H 1 6.679 0.030 . 1 . . . A 51 TYR HE1 . 11534 1 623 . 1 1 51 51 TYR HE2 H 1 6.679 0.030 . 1 . . . A 51 TYR HE2 . 11534 1 624 . 1 1 51 51 TYR C C 13 177.980 0.300 . 1 . . . A 51 TYR C . 11534 1 625 . 1 1 51 51 TYR CA C 13 60.645 0.300 . 1 . . . A 51 TYR CA . 11534 1 626 . 1 1 51 51 TYR CB C 13 38.265 0.300 . 1 . . . A 51 TYR CB . 11534 1 627 . 1 1 51 51 TYR CD1 C 13 133.354 0.300 . 1 . . . A 51 TYR CD1 . 11534 1 628 . 1 1 51 51 TYR CD2 C 13 133.354 0.300 . 1 . . . A 51 TYR CD2 . 11534 1 629 . 1 1 51 51 TYR CE1 C 13 118.116 0.300 . 1 . . . A 51 TYR CE1 . 11534 1 630 . 1 1 51 51 TYR CE2 C 13 118.116 0.300 . 1 . . . A 51 TYR CE2 . 11534 1 631 . 1 1 51 51 TYR N N 15 115.895 0.300 . 1 . . . A 51 TYR N . 11534 1 632 . 1 1 52 52 TYR H H 1 7.173 0.030 . 1 . . . A 52 TYR H . 11534 1 633 . 1 1 52 52 TYR HA H 1 3.876 0.030 . 1 . . . A 52 TYR HA . 11534 1 634 . 1 1 52 52 TYR HB2 H 1 3.288 0.030 . 2 . . . A 52 TYR HB2 . 11534 1 635 . 1 1 52 52 TYR HB3 H 1 2.614 0.030 . 2 . . . A 52 TYR HB3 . 11534 1 636 . 1 1 52 52 TYR HD1 H 1 6.849 0.030 . 1 . . . A 52 TYR HD1 . 11534 1 637 . 1 1 52 52 TYR HD2 H 1 6.849 0.030 . 1 . . . A 52 TYR HD2 . 11534 1 638 . 1 1 52 52 TYR HE1 H 1 6.842 0.030 . 1 . . . A 52 TYR HE1 . 11534 1 639 . 1 1 52 52 TYR HE2 H 1 6.842 0.030 . 1 . . . A 52 TYR HE2 . 11534 1 640 . 1 1 52 52 TYR C C 13 177.758 0.300 . 1 . . . A 52 TYR C . 11534 1 641 . 1 1 52 52 TYR CA C 13 61.161 0.300 . 1 . . . A 52 TYR CA . 11534 1 642 . 1 1 52 52 TYR CB C 13 39.455 0.300 . 1 . . . A 52 TYR CB . 11534 1 643 . 1 1 52 52 TYR CD1 C 13 131.383 0.300 . 1 . . . A 52 TYR CD1 . 11534 1 644 . 1 1 52 52 TYR CD2 C 13 131.383 0.300 . 1 . . . A 52 TYR CD2 . 11534 1 645 . 1 1 52 52 TYR CE1 C 13 119.119 0.300 . 1 . . . A 52 TYR CE1 . 11534 1 646 . 1 1 52 52 TYR CE2 C 13 119.119 0.300 . 1 . . . A 52 TYR CE2 . 11534 1 647 . 1 1 52 52 TYR N N 15 117.020 0.300 . 1 . . . A 52 TYR N . 11534 1 648 . 1 1 53 53 LYS H H 1 7.803 0.030 . 1 . . . A 53 LYS H . 11534 1 649 . 1 1 53 53 LYS HA H 1 3.504 0.030 . 1 . . . A 53 LYS HA . 11534 1 650 . 1 1 53 53 LYS HB2 H 1 1.592 0.030 . 2 . . . A 53 LYS HB2 . 11534 1 651 . 1 1 53 53 LYS HB3 H 1 1.977 0.030 . 2 . . . A 53 LYS HB3 . 11534 1 652 . 1 1 53 53 LYS HG2 H 1 1.386 0.030 . 2 . . . A 53 LYS HG2 . 11534 1 653 . 1 1 53 53 LYS HG3 H 1 0.950 0.030 . 2 . . . A 53 LYS HG3 . 11534 1 654 . 1 1 53 53 LYS HD2 H 1 1.637 0.030 . 2 . . . A 53 LYS HD2 . 11534 1 655 . 1 1 53 53 LYS HD3 H 1 1.580 0.030 . 2 . . . A 53 LYS HD3 . 11534 1 656 . 1 1 53 53 LYS HE2 H 1 3.076 0.030 . 2 . . . A 53 LYS HE2 . 11534 1 657 . 1 1 53 53 LYS HE3 H 1 3.183 0.030 . 2 . . . A 53 LYS HE3 . 11534 1 658 . 1 1 53 53 LYS C C 13 177.634 0.300 . 1 . . . A 53 LYS C . 11534 1 659 . 1 1 53 53 LYS CA C 13 61.386 0.300 . 1 . . . A 53 LYS CA . 11534 1 660 . 1 1 53 53 LYS CB C 13 32.972 0.300 . 1 . . . A 53 LYS CB . 11534 1 661 . 1 1 53 53 LYS CG C 13 26.809 0.300 . 1 . . . A 53 LYS CG . 11534 1 662 . 1 1 53 53 LYS CD C 13 30.611 0.300 . 1 . . . A 53 LYS CD . 11534 1 663 . 1 1 53 53 LYS CE C 13 42.161 0.300 . 1 . . . A 53 LYS CE . 11534 1 664 . 1 1 53 53 LYS N N 15 117.947 0.300 . 1 . . . A 53 LYS N . 11534 1 665 . 1 1 54 54 GLU H H 1 8.511 0.030 . 1 . . . A 54 GLU H . 11534 1 666 . 1 1 54 54 GLU HA H 1 3.826 0.030 . 1 . . . A 54 GLU HA . 11534 1 667 . 1 1 54 54 GLU HB2 H 1 2.040 0.030 . 2 . . . A 54 GLU HB2 . 11534 1 668 . 1 1 54 54 GLU HB3 H 1 1.965 0.030 . 2 . . . A 54 GLU HB3 . 11534 1 669 . 1 1 54 54 GLU HG2 H 1 2.348 0.030 . 2 . . . A 54 GLU HG2 . 11534 1 670 . 1 1 54 54 GLU HG3 H 1 2.197 0.030 . 2 . . . A 54 GLU HG3 . 11534 1 671 . 1 1 54 54 GLU C C 13 179.743 0.300 . 1 . . . A 54 GLU C . 11534 1 672 . 1 1 54 54 GLU CA C 13 59.293 0.300 . 1 . . . A 54 GLU CA . 11534 1 673 . 1 1 54 54 GLU CB C 13 29.369 0.300 . 1 . . . A 54 GLU CB . 11534 1 674 . 1 1 54 54 GLU CG C 13 36.167 0.300 . 1 . . . A 54 GLU CG . 11534 1 675 . 1 1 54 54 GLU N N 15 115.641 0.300 . 1 . . . A 54 GLU N . 11534 1 676 . 1 1 55 55 ARG H H 1 7.202 0.030 . 1 . . . A 55 ARG H . 11534 1 677 . 1 1 55 55 ARG HA H 1 3.968 0.030 . 1 . . . A 55 ARG HA . 11534 1 678 . 1 1 55 55 ARG HB2 H 1 1.810 0.030 . 2 . . . A 55 ARG HB2 . 11534 1 679 . 1 1 55 55 ARG HB3 H 1 1.587 0.030 . 2 . . . A 55 ARG HB3 . 11534 1 680 . 1 1 55 55 ARG HG2 H 1 1.488 0.030 . 1 . . . A 55 ARG HG2 . 11534 1 681 . 1 1 55 55 ARG HG3 H 1 1.488 0.030 . 1 . . . A 55 ARG HG3 . 11534 1 682 . 1 1 55 55 ARG HD2 H 1 2.885 0.030 . 2 . . . A 55 ARG HD2 . 11534 1 683 . 1 1 55 55 ARG HD3 H 1 3.002 0.030 . 2 . . . A 55 ARG HD3 . 11534 1 684 . 1 1 55 55 ARG C C 13 179.284 0.300 . 1 . . . A 55 ARG C . 11534 1 685 . 1 1 55 55 ARG CA C 13 58.218 0.300 . 1 . . . A 55 ARG CA . 11534 1 686 . 1 1 55 55 ARG CB C 13 30.138 0.300 . 1 . . . A 55 ARG CB . 11534 1 687 . 1 1 55 55 ARG CG C 13 26.963 0.300 . 1 . . . A 55 ARG CG . 11534 1 688 . 1 1 55 55 ARG CD C 13 42.683 0.300 . 1 . . . A 55 ARG CD . 11534 1 689 . 1 1 55 55 ARG N N 15 116.875 0.300 . 1 . . . A 55 ARG N . 11534 1 690 . 1 1 56 56 LEU H H 1 8.032 0.030 . 1 . . . A 56 LEU H . 11534 1 691 . 1 1 56 56 LEU HA H 1 3.875 0.030 . 1 . . . A 56 LEU HA . 11534 1 692 . 1 1 56 56 LEU HB2 H 1 1.947 0.030 . 2 . . . A 56 LEU HB2 . 11534 1 693 . 1 1 56 56 LEU HB3 H 1 1.312 0.030 . 2 . . . A 56 LEU HB3 . 11534 1 694 . 1 1 56 56 LEU HG H 1 1.801 0.030 . 1 . . . A 56 LEU HG . 11534 1 695 . 1 1 56 56 LEU HD11 H 1 0.774 0.030 . 2 . . . A 56 LEU HD11 . 11534 1 696 . 1 1 56 56 LEU HD12 H 1 0.774 0.030 . 2 . . . A 56 LEU HD12 . 11534 1 697 . 1 1 56 56 LEU HD13 H 1 0.774 0.030 . 2 . . . A 56 LEU HD13 . 11534 1 698 . 1 1 56 56 LEU HD21 H 1 0.795 0.030 . 2 . . . A 56 LEU HD21 . 11534 1 699 . 1 1 56 56 LEU HD22 H 1 0.795 0.030 . 2 . . . A 56 LEU HD22 . 11534 1 700 . 1 1 56 56 LEU HD23 H 1 0.795 0.030 . 2 . . . A 56 LEU HD23 . 11534 1 701 . 1 1 56 56 LEU C C 13 178.063 0.300 . 1 . . . A 56 LEU C . 11534 1 702 . 1 1 56 56 LEU CA C 13 57.982 0.300 . 1 . . . A 56 LEU CA . 11534 1 703 . 1 1 56 56 LEU CB C 13 42.595 0.300 . 1 . . . A 56 LEU CB . 11534 1 704 . 1 1 56 56 LEU CG C 13 27.023 0.300 . 1 . . . A 56 LEU CG . 11534 1 705 . 1 1 56 56 LEU CD1 C 13 24.518 0.300 . 2 . . . A 56 LEU CD1 . 11534 1 706 . 1 1 56 56 LEU CD2 C 13 26.542 0.300 . 2 . . . A 56 LEU CD2 . 11534 1 707 . 1 1 56 56 LEU N N 15 118.431 0.300 . 1 . . . A 56 LEU N . 11534 1 708 . 1 1 57 57 LEU H H 1 8.225 0.030 . 1 . . . A 57 LEU H . 11534 1 709 . 1 1 57 57 LEU HA H 1 4.090 0.030 . 1 . . . A 57 LEU HA . 11534 1 710 . 1 1 57 57 LEU HB2 H 1 1.443 0.030 . 2 . . . A 57 LEU HB2 . 11534 1 711 . 1 1 57 57 LEU HB3 H 1 1.758 0.030 . 2 . . . A 57 LEU HB3 . 11534 1 712 . 1 1 57 57 LEU HG H 1 1.802 0.030 . 1 . . . A 57 LEU HG . 11534 1 713 . 1 1 57 57 LEU HD11 H 1 0.745 0.030 . 2 . . . A 57 LEU HD11 . 11534 1 714 . 1 1 57 57 LEU HD12 H 1 0.745 0.030 . 2 . . . A 57 LEU HD12 . 11534 1 715 . 1 1 57 57 LEU HD13 H 1 0.745 0.030 . 2 . . . A 57 LEU HD13 . 11534 1 716 . 1 1 57 57 LEU HD21 H 1 0.808 0.030 . 2 . . . A 57 LEU HD21 . 11534 1 717 . 1 1 57 57 LEU HD22 H 1 0.808 0.030 . 2 . . . A 57 LEU HD22 . 11534 1 718 . 1 1 57 57 LEU HD23 H 1 0.808 0.030 . 2 . . . A 57 LEU HD23 . 11534 1 719 . 1 1 57 57 LEU C C 13 177.886 0.300 . 1 . . . A 57 LEU C . 11534 1 720 . 1 1 57 57 LEU CA C 13 56.489 0.300 . 1 . . . A 57 LEU CA . 11534 1 721 . 1 1 57 57 LEU CB C 13 41.096 0.300 . 1 . . . A 57 LEU CB . 11534 1 722 . 1 1 57 57 LEU CG C 13 27.099 0.300 . 1 . . . A 57 LEU CG . 11534 1 723 . 1 1 57 57 LEU CD1 C 13 25.611 0.300 . 2 . . . A 57 LEU CD1 . 11534 1 724 . 1 1 57 57 LEU CD2 C 13 23.397 0.300 . 2 . . . A 57 LEU CD2 . 11534 1 725 . 1 1 57 57 LEU N N 15 115.523 0.300 . 1 . . . A 57 LEU N . 11534 1 726 . 1 1 58 58 ALA H H 1 7.251 0.030 . 1 . . . A 58 ALA H . 11534 1 727 . 1 1 58 58 ALA HA H 1 4.372 0.030 . 1 . . . A 58 ALA HA . 11534 1 728 . 1 1 58 58 ALA HB1 H 1 1.426 0.030 . 1 . . . A 58 ALA HB1 . 11534 1 729 . 1 1 58 58 ALA HB2 H 1 1.426 0.030 . 1 . . . A 58 ALA HB2 . 11534 1 730 . 1 1 58 58 ALA HB3 H 1 1.426 0.030 . 1 . . . A 58 ALA HB3 . 11534 1 731 . 1 1 58 58 ALA C C 13 177.531 0.300 . 1 . . . A 58 ALA C . 11534 1 732 . 1 1 58 58 ALA CA C 13 52.075 0.300 . 1 . . . A 58 ALA CA . 11534 1 733 . 1 1 58 58 ALA CB C 13 19.478 0.300 . 1 . . . A 58 ALA CB . 11534 1 734 . 1 1 58 58 ALA N N 15 119.157 0.300 . 1 . . . A 58 ALA N . 11534 1 735 . 1 1 59 59 ALA H H 1 7.099 0.030 . 1 . . . A 59 ALA H . 11534 1 736 . 1 1 59 59 ALA HA H 1 4.287 0.030 . 1 . . . A 59 ALA HA . 11534 1 737 . 1 1 59 59 ALA HB1 H 1 1.530 0.030 . 1 . . . A 59 ALA HB1 . 11534 1 738 . 1 1 59 59 ALA HB2 H 1 1.530 0.030 . 1 . . . A 59 ALA HB2 . 11534 1 739 . 1 1 59 59 ALA HB3 H 1 1.530 0.030 . 1 . . . A 59 ALA HB3 . 11534 1 740 . 1 1 59 59 ALA C C 13 176.896 0.300 . 1 . . . A 59 ALA C . 11534 1 741 . 1 1 59 59 ALA CA C 13 52.313 0.300 . 1 . . . A 59 ALA CA . 11534 1 742 . 1 1 59 59 ALA CB C 13 20.532 0.300 . 1 . . . A 59 ALA CB . 11534 1 743 . 1 1 59 59 ALA N N 15 120.957 0.300 . 1 . . . A 59 ALA N . 11534 1 744 . 1 1 60 60 SER H H 1 8.500 0.030 . 1 . . . A 60 SER H . 11534 1 745 . 1 1 60 60 SER HA H 1 4.621 0.030 . 1 . . . A 60 SER HA . 11534 1 746 . 1 1 60 60 SER HB2 H 1 3.866 0.030 . 2 . . . A 60 SER HB2 . 11534 1 747 . 1 1 60 60 SER HB3 H 1 3.793 0.030 . 2 . . . A 60 SER HB3 . 11534 1 748 . 1 1 60 60 SER C C 13 173.705 0.300 . 1 . . . A 60 SER C . 11534 1 749 . 1 1 60 60 SER CA C 13 57.040 0.300 . 1 . . . A 60 SER CA . 11534 1 750 . 1 1 60 60 SER CB C 13 62.985 0.300 . 1 . . . A 60 SER CB . 11534 1 751 . 1 1 60 60 SER N N 15 115.627 0.300 . 1 . . . A 60 SER N . 11534 1 752 . 1 1 61 61 HIS H H 1 8.594 0.030 . 1 . . . A 61 HIS H . 11534 1 753 . 1 1 61 61 HIS HA H 1 4.521 0.030 . 1 . . . A 61 HIS HA . 11534 1 754 . 1 1 61 61 HIS HB2 H 1 2.899 0.030 . 2 . . . A 61 HIS HB2 . 11534 1 755 . 1 1 61 61 HIS HB3 H 1 2.667 0.030 . 2 . . . A 61 HIS HB3 . 11534 1 756 . 1 1 61 61 HIS HD2 H 1 7.158 0.030 . 1 . . . A 61 HIS HD2 . 11534 1 757 . 1 1 61 61 HIS HE1 H 1 7.210 0.030 . 1 . . . A 61 HIS HE1 . 11534 1 758 . 1 1 61 61 HIS C C 13 176.160 0.300 . 1 . . . A 61 HIS C . 11534 1 759 . 1 1 61 61 HIS CA C 13 57.734 0.300 . 1 . . . A 61 HIS CA . 11534 1 760 . 1 1 61 61 HIS CB C 13 34.315 0.300 . 1 . . . A 61 HIS CB . 11534 1 761 . 1 1 61 61 HIS CD2 C 13 118.076 0.300 . 1 . . . A 61 HIS CD2 . 11534 1 762 . 1 1 61 61 HIS CE1 C 13 137.863 0.300 . 1 . . . A 61 HIS CE1 . 11534 1 763 . 1 1 61 61 HIS N N 15 126.378 0.300 . 1 . . . A 61 HIS N . 11534 1 764 . 1 1 62 62 HIS HA H 1 4.449 0.030 . 1 . . . A 62 HIS HA . 11534 1 765 . 1 1 62 62 HIS HB2 H 1 3.212 0.030 . 2 . . . A 62 HIS HB2 . 11534 1 766 . 1 1 62 62 HIS HB3 H 1 2.999 0.030 . 2 . . . A 62 HIS HB3 . 11534 1 767 . 1 1 62 62 HIS HD2 H 1 6.839 0.030 . 1 . . . A 62 HIS HD2 . 11534 1 768 . 1 1 62 62 HIS HE1 H 1 7.708 0.030 . 1 . . . A 62 HIS HE1 . 11534 1 769 . 1 1 62 62 HIS CA C 13 59.144 0.300 . 1 . . . A 62 HIS CA . 11534 1 770 . 1 1 62 62 HIS CB C 13 29.679 0.300 . 1 . . . A 62 HIS CB . 11534 1 771 . 1 1 62 62 HIS CD2 C 13 120.173 0.300 . 1 . . . A 62 HIS CD2 . 11534 1 772 . 1 1 62 62 HIS CE1 C 13 138.426 0.300 . 1 . . . A 62 HIS CE1 . 11534 1 773 . 1 1 63 63 LEU H H 1 10.308 0.030 . 1 . . . A 63 LEU H . 11534 1 774 . 1 1 63 63 LEU HA H 1 4.554 0.030 . 1 . . . A 63 LEU HA . 11534 1 775 . 1 1 63 63 LEU HB2 H 1 1.788 0.030 . 2 . . . A 63 LEU HB2 . 11534 1 776 . 1 1 63 63 LEU HB3 H 1 1.619 0.030 . 2 . . . A 63 LEU HB3 . 11534 1 777 . 1 1 63 63 LEU HG H 1 1.041 0.030 . 1 . . . A 63 LEU HG . 11534 1 778 . 1 1 63 63 LEU HD11 H 1 0.931 0.030 . 2 . . . A 63 LEU HD11 . 11534 1 779 . 1 1 63 63 LEU HD12 H 1 0.931 0.030 . 2 . . . A 63 LEU HD12 . 11534 1 780 . 1 1 63 63 LEU HD13 H 1 0.931 0.030 . 2 . . . A 63 LEU HD13 . 11534 1 781 . 1 1 63 63 LEU HD21 H 1 0.965 0.030 . 2 . . . A 63 LEU HD21 . 11534 1 782 . 1 1 63 63 LEU HD22 H 1 0.965 0.030 . 2 . . . A 63 LEU HD22 . 11534 1 783 . 1 1 63 63 LEU HD23 H 1 0.965 0.030 . 2 . . . A 63 LEU HD23 . 11534 1 784 . 1 1 63 63 LEU CA C 13 55.089 0.300 . 1 . . . A 63 LEU CA . 11534 1 785 . 1 1 63 63 LEU CB C 13 41.092 0.300 . 1 . . . A 63 LEU CB . 11534 1 786 . 1 1 63 63 LEU CG C 13 26.335 0.300 . 1 . . . A 63 LEU CG . 11534 1 787 . 1 1 63 63 LEU CD1 C 13 25.562 0.300 . 2 . . . A 63 LEU CD1 . 11534 1 788 . 1 1 63 63 LEU CD2 C 13 22.524 0.300 . 2 . . . A 63 LEU CD2 . 11534 1 789 . 1 1 63 63 LEU N N 15 122.940 0.300 . 1 . . . A 63 LEU N . 11534 1 790 . 1 1 64 64 ILE H H 1 7.758 0.030 . 1 . . . A 64 ILE H . 11534 1 791 . 1 1 64 64 ILE HA H 1 4.468 0.030 . 1 . . . A 64 ILE HA . 11534 1 792 . 1 1 64 64 ILE HB H 1 1.897 0.030 . 1 . . . A 64 ILE HB . 11534 1 793 . 1 1 64 64 ILE HG12 H 1 1.447 0.030 . 2 . . . A 64 ILE HG12 . 11534 1 794 . 1 1 64 64 ILE HG13 H 1 0.659 0.030 . 2 . . . A 64 ILE HG13 . 11534 1 795 . 1 1 64 64 ILE HG21 H 1 0.901 0.030 . 1 . . . A 64 ILE HG21 . 11534 1 796 . 1 1 64 64 ILE HG22 H 1 0.901 0.030 . 1 . . . A 64 ILE HG22 . 11534 1 797 . 1 1 64 64 ILE HG23 H 1 0.901 0.030 . 1 . . . A 64 ILE HG23 . 11534 1 798 . 1 1 64 64 ILE HD11 H 1 0.722 0.030 . 1 . . . A 64 ILE HD11 . 11534 1 799 . 1 1 64 64 ILE HD12 H 1 0.722 0.030 . 1 . . . A 64 ILE HD12 . 11534 1 800 . 1 1 64 64 ILE HD13 H 1 0.722 0.030 . 1 . . . A 64 ILE HD13 . 11534 1 801 . 1 1 64 64 ILE C C 13 176.204 0.300 . 1 . . . A 64 ILE C . 11534 1 802 . 1 1 64 64 ILE CA C 13 61.020 0.300 . 1 . . . A 64 ILE CA . 11534 1 803 . 1 1 64 64 ILE CB C 13 38.331 0.300 . 1 . . . A 64 ILE CB . 11534 1 804 . 1 1 64 64 ILE CG1 C 13 27.921 0.300 . 1 . . . A 64 ILE CG1 . 11534 1 805 . 1 1 64 64 ILE CG2 C 13 17.388 0.300 . 1 . . . A 64 ILE CG2 . 11534 1 806 . 1 1 64 64 ILE CD1 C 13 13.560 0.300 . 1 . . . A 64 ILE CD1 . 11534 1 807 . 1 1 64 64 ILE N N 15 118.271 0.300 . 1 . . . A 64 ILE N . 11534 1 808 . 1 1 65 65 SER H H 1 9.049 0.030 . 1 . . . A 65 SER H . 11534 1 809 . 1 1 65 65 SER HA H 1 4.635 0.030 . 1 . . . A 65 SER HA . 11534 1 810 . 1 1 65 65 SER HB2 H 1 4.156 0.030 . 2 . . . A 65 SER HB2 . 11534 1 811 . 1 1 65 65 SER HB3 H 1 4.414 0.030 . 2 . . . A 65 SER HB3 . 11534 1 812 . 1 1 65 65 SER C C 13 177.064 0.300 . 1 . . . A 65 SER C . 11534 1 813 . 1 1 65 65 SER CA C 13 57.873 0.300 . 1 . . . A 65 SER CA . 11534 1 814 . 1 1 65 65 SER CB C 13 65.367 0.300 . 1 . . . A 65 SER CB . 11534 1 815 . 1 1 65 65 SER N N 15 123.910 0.300 . 1 . . . A 65 SER N . 11534 1 816 . 1 1 66 66 SER HA H 1 4.279 0.030 . 1 . . . A 66 SER HA . 11534 1 817 . 1 1 66 66 SER HB2 H 1 3.966 0.030 . 2 . . . A 66 SER HB2 . 11534 1 818 . 1 1 66 66 SER HB3 H 1 4.020 0.030 . 2 . . . A 66 SER HB3 . 11534 1 819 . 1 1 66 66 SER C C 13 174.752 0.300 . 1 . . . A 66 SER C . 11534 1 820 . 1 1 66 66 SER CA C 13 60.996 0.300 . 1 . . . A 66 SER CA . 11534 1 821 . 1 1 66 66 SER CB C 13 62.677 0.300 . 1 . . . A 66 SER CB . 11534 1 822 . 1 1 67 67 ASP H H 1 8.013 0.030 . 1 . . . A 67 ASP H . 11534 1 823 . 1 1 67 67 ASP HA H 1 4.745 0.030 . 1 . . . A 67 ASP HA . 11534 1 824 . 1 1 67 67 ASP HB2 H 1 2.715 0.030 . 2 . . . A 67 ASP HB2 . 11534 1 825 . 1 1 67 67 ASP HB3 H 1 2.606 0.030 . 2 . . . A 67 ASP HB3 . 11534 1 826 . 1 1 67 67 ASP C C 13 176.059 0.300 . 1 . . . A 67 ASP C . 11534 1 827 . 1 1 67 67 ASP CA C 13 53.586 0.300 . 1 . . . A 67 ASP CA . 11534 1 828 . 1 1 67 67 ASP CB C 13 40.397 0.300 . 1 . . . A 67 ASP CB . 11534 1 829 . 1 1 67 67 ASP N N 15 117.492 0.300 . 1 . . . A 67 ASP N . 11534 1 830 . 1 1 68 68 GLY H H 1 8.197 0.030 . 1 . . . A 68 GLY H . 11534 1 831 . 1 1 68 68 GLY HA2 H 1 3.838 0.030 . 2 . . . A 68 GLY HA2 . 11534 1 832 . 1 1 68 68 GLY HA3 H 1 3.493 0.030 . 2 . . . A 68 GLY HA3 . 11534 1 833 . 1 1 68 68 GLY C C 13 172.833 0.300 . 1 . . . A 68 GLY C . 11534 1 834 . 1 1 68 68 GLY CA C 13 47.246 0.300 . 1 . . . A 68 GLY CA . 11534 1 835 . 1 1 68 68 GLY N N 15 108.979 0.300 . 1 . . . A 68 GLY N . 11534 1 836 . 1 1 69 69 VAL H H 1 7.675 0.030 . 1 . . . A 69 VAL H . 11534 1 837 . 1 1 69 69 VAL HA H 1 4.621 0.030 . 1 . . . A 69 VAL HA . 11534 1 838 . 1 1 69 69 VAL HB H 1 1.946 0.030 . 1 . . . A 69 VAL HB . 11534 1 839 . 1 1 69 69 VAL HG11 H 1 0.637 0.030 . 2 . . . A 69 VAL HG11 . 11534 1 840 . 1 1 69 69 VAL HG12 H 1 0.637 0.030 . 2 . . . A 69 VAL HG12 . 11534 1 841 . 1 1 69 69 VAL HG13 H 1 0.637 0.030 . 2 . . . A 69 VAL HG13 . 11534 1 842 . 1 1 69 69 VAL HG21 H 1 0.709 0.030 . 2 . . . A 69 VAL HG21 . 11534 1 843 . 1 1 69 69 VAL HG22 H 1 0.709 0.030 . 2 . . . A 69 VAL HG22 . 11534 1 844 . 1 1 69 69 VAL HG23 H 1 0.709 0.030 . 2 . . . A 69 VAL HG23 . 11534 1 845 . 1 1 69 69 VAL C C 13 175.803 0.300 . 1 . . . A 69 VAL C . 11534 1 846 . 1 1 69 69 VAL CA C 13 60.745 0.300 . 1 . . . A 69 VAL CA . 11534 1 847 . 1 1 69 69 VAL CB C 13 33.730 0.300 . 1 . . . A 69 VAL CB . 11534 1 848 . 1 1 69 69 VAL CG1 C 13 21.240 0.300 . 2 . . . A 69 VAL CG1 . 11534 1 849 . 1 1 69 69 VAL CG2 C 13 21.942 0.300 . 2 . . . A 69 VAL CG2 . 11534 1 850 . 1 1 69 69 VAL N N 15 120.112 0.300 . 1 . . . A 69 VAL N . 11534 1 851 . 1 1 70 70 ILE H H 1 9.095 0.030 . 1 . . . A 70 ILE H . 11534 1 852 . 1 1 70 70 ILE HA H 1 4.794 0.030 . 1 . . . A 70 ILE HA . 11534 1 853 . 1 1 70 70 ILE HB H 1 1.942 0.030 . 1 . . . A 70 ILE HB . 11534 1 854 . 1 1 70 70 ILE HG12 H 1 1.835 0.030 . 2 . . . A 70 ILE HG12 . 11534 1 855 . 1 1 70 70 ILE HG13 H 1 0.971 0.030 . 2 . . . A 70 ILE HG13 . 11534 1 856 . 1 1 70 70 ILE HG21 H 1 0.794 0.030 . 1 . . . A 70 ILE HG21 . 11534 1 857 . 1 1 70 70 ILE HG22 H 1 0.794 0.030 . 1 . . . A 70 ILE HG22 . 11534 1 858 . 1 1 70 70 ILE HG23 H 1 0.794 0.030 . 1 . . . A 70 ILE HG23 . 11534 1 859 . 1 1 70 70 ILE HD11 H 1 0.889 0.030 . 1 . . . A 70 ILE HD11 . 11534 1 860 . 1 1 70 70 ILE HD12 H 1 0.889 0.030 . 1 . . . A 70 ILE HD12 . 11534 1 861 . 1 1 70 70 ILE HD13 H 1 0.889 0.030 . 1 . . . A 70 ILE HD13 . 11534 1 862 . 1 1 70 70 ILE C C 13 175.069 0.300 . 1 . . . A 70 ILE C . 11534 1 863 . 1 1 70 70 ILE CA C 13 61.419 0.300 . 1 . . . A 70 ILE CA . 11534 1 864 . 1 1 70 70 ILE CB C 13 39.505 0.300 . 1 . . . A 70 ILE CB . 11534 1 865 . 1 1 70 70 ILE CG1 C 13 28.844 0.300 . 1 . . . A 70 ILE CG1 . 11534 1 866 . 1 1 70 70 ILE CG2 C 13 17.251 0.300 . 1 . . . A 70 ILE CG2 . 11534 1 867 . 1 1 70 70 ILE CD1 C 13 13.488 0.300 . 1 . . . A 70 ILE CD1 . 11534 1 868 . 1 1 70 70 ILE N N 15 128.715 0.300 . 1 . . . A 70 ILE N . 11534 1 869 . 1 1 71 71 VAL H H 1 7.945 0.030 . 1 . . . A 71 VAL H . 11534 1 870 . 1 1 71 71 VAL HA H 1 5.124 0.030 . 1 . . . A 71 VAL HA . 11534 1 871 . 1 1 71 71 VAL HB H 1 1.946 0.030 . 1 . . . A 71 VAL HB . 11534 1 872 . 1 1 71 71 VAL HG11 H 1 0.678 0.030 . 2 . . . A 71 VAL HG11 . 11534 1 873 . 1 1 71 71 VAL HG12 H 1 0.678 0.030 . 2 . . . A 71 VAL HG12 . 11534 1 874 . 1 1 71 71 VAL HG13 H 1 0.678 0.030 . 2 . . . A 71 VAL HG13 . 11534 1 875 . 1 1 71 71 VAL HG21 H 1 0.914 0.030 . 2 . . . A 71 VAL HG21 . 11534 1 876 . 1 1 71 71 VAL HG22 H 1 0.914 0.030 . 2 . . . A 71 VAL HG22 . 11534 1 877 . 1 1 71 71 VAL HG23 H 1 0.914 0.030 . 2 . . . A 71 VAL HG23 . 11534 1 878 . 1 1 71 71 VAL C C 13 175.337 0.300 . 1 . . . A 71 VAL C . 11534 1 879 . 1 1 71 71 VAL CA C 13 61.221 0.300 . 1 . . . A 71 VAL CA . 11534 1 880 . 1 1 71 71 VAL CB C 13 33.813 0.300 . 1 . . . A 71 VAL CB . 11534 1 881 . 1 1 71 71 VAL CG1 C 13 21.163 0.300 . 2 . . . A 71 VAL CG1 . 11534 1 882 . 1 1 71 71 VAL CG2 C 13 21.483 0.300 . 2 . . . A 71 VAL CG2 . 11534 1 883 . 1 1 71 71 VAL N N 15 127.208 0.300 . 1 . . . A 71 VAL N . 11534 1 884 . 1 1 72 72 ILE H H 1 9.058 0.030 . 1 . . . A 72 ILE H . 11534 1 885 . 1 1 72 72 ILE HA H 1 4.267 0.030 . 1 . . . A 72 ILE HA . 11534 1 886 . 1 1 72 72 ILE HB H 1 1.589 0.030 . 1 . . . A 72 ILE HB . 11534 1 887 . 1 1 72 72 ILE HG12 H 1 1.494 0.030 . 2 . . . A 72 ILE HG12 . 11534 1 888 . 1 1 72 72 ILE HG13 H 1 1.036 0.030 . 2 . . . A 72 ILE HG13 . 11534 1 889 . 1 1 72 72 ILE HG21 H 1 0.917 0.030 . 1 . . . A 72 ILE HG21 . 11534 1 890 . 1 1 72 72 ILE HG22 H 1 0.917 0.030 . 1 . . . A 72 ILE HG22 . 11534 1 891 . 1 1 72 72 ILE HG23 H 1 0.917 0.030 . 1 . . . A 72 ILE HG23 . 11534 1 892 . 1 1 72 72 ILE HD11 H 1 0.775 0.030 . 1 . . . A 72 ILE HD11 . 11534 1 893 . 1 1 72 72 ILE HD12 H 1 0.775 0.030 . 1 . . . A 72 ILE HD12 . 11534 1 894 . 1 1 72 72 ILE HD13 H 1 0.775 0.030 . 1 . . . A 72 ILE HD13 . 11534 1 895 . 1 1 72 72 ILE C C 13 173.781 0.300 . 1 . . . A 72 ILE C . 11534 1 896 . 1 1 72 72 ILE CA C 13 59.901 0.300 . 1 . . . A 72 ILE CA . 11534 1 897 . 1 1 72 72 ILE CB C 13 42.587 0.300 . 1 . . . A 72 ILE CB . 11534 1 898 . 1 1 72 72 ILE CG1 C 13 28.411 0.300 . 1 . . . A 72 ILE CG1 . 11534 1 899 . 1 1 72 72 ILE CG2 C 13 17.344 0.300 . 1 . . . A 72 ILE CG2 . 11534 1 900 . 1 1 72 72 ILE CD1 C 13 13.914 0.300 . 1 . . . A 72 ILE CD1 . 11534 1 901 . 1 1 72 72 ILE N N 15 127.201 0.300 . 1 . . . A 72 ILE N . 11534 1 902 . 1 1 73 73 LYS H H 1 8.525 0.030 . 1 . . . A 73 LYS H . 11534 1 903 . 1 1 73 73 LYS HA H 1 5.153 0.030 . 1 . . . A 73 LYS HA . 11534 1 904 . 1 1 73 73 LYS HB2 H 1 1.638 0.030 . 2 . . . A 73 LYS HB2 . 11534 1 905 . 1 1 73 73 LYS HB3 H 1 1.583 0.030 . 2 . . . A 73 LYS HB3 . 11534 1 906 . 1 1 73 73 LYS HG2 H 1 1.164 0.030 . 2 . . . A 73 LYS HG2 . 11534 1 907 . 1 1 73 73 LYS HG3 H 1 0.825 0.030 . 2 . . . A 73 LYS HG3 . 11534 1 908 . 1 1 73 73 LYS HD2 H 1 1.521 0.030 . 1 . . . A 73 LYS HD2 . 11534 1 909 . 1 1 73 73 LYS HD3 H 1 1.521 0.030 . 1 . . . A 73 LYS HD3 . 11534 1 910 . 1 1 73 73 LYS HE2 H 1 2.655 0.030 . 2 . . . A 73 LYS HE2 . 11534 1 911 . 1 1 73 73 LYS HE3 H 1 2.724 0.030 . 2 . . . A 73 LYS HE3 . 11534 1 912 . 1 1 73 73 LYS C C 13 175.388 0.300 . 1 . . . A 73 LYS C . 11534 1 913 . 1 1 73 73 LYS CA C 13 54.793 0.300 . 1 . . . A 73 LYS CA . 11534 1 914 . 1 1 73 73 LYS CB C 13 34.184 0.300 . 1 . . . A 73 LYS CB . 11534 1 915 . 1 1 73 73 LYS CG C 13 25.134 0.300 . 1 . . . A 73 LYS CG . 11534 1 916 . 1 1 73 73 LYS CD C 13 29.530 0.300 . 1 . . . A 73 LYS CD . 11534 1 917 . 1 1 73 73 LYS CE C 13 41.869 0.300 . 1 . . . A 73 LYS CE . 11534 1 918 . 1 1 73 73 LYS N N 15 126.670 0.300 . 1 . . . A 73 LYS N . 11534 1 919 . 1 1 74 74 ALA H H 1 9.188 0.030 . 1 . . . A 74 ALA H . 11534 1 920 . 1 1 74 74 ALA HA H 1 4.824 0.030 . 1 . . . A 74 ALA HA . 11534 1 921 . 1 1 74 74 ALA HB1 H 1 1.433 0.030 . 1 . . . A 74 ALA HB1 . 11534 1 922 . 1 1 74 74 ALA HB2 H 1 1.433 0.030 . 1 . . . A 74 ALA HB2 . 11534 1 923 . 1 1 74 74 ALA HB3 H 1 1.433 0.030 . 1 . . . A 74 ALA HB3 . 11534 1 924 . 1 1 74 74 ALA C C 13 175.266 0.300 . 1 . . . A 74 ALA C . 11534 1 925 . 1 1 74 74 ALA CA C 13 51.728 0.300 . 1 . . . A 74 ALA CA . 11534 1 926 . 1 1 74 74 ALA CB C 13 22.358 0.300 . 1 . . . A 74 ALA CB . 11534 1 927 . 1 1 74 74 ALA N N 15 128.778 0.300 . 1 . . . A 74 ALA N . 11534 1 928 . 1 1 75 75 GLN H H 1 8.666 0.030 . 1 . . . A 75 GLN H . 11534 1 929 . 1 1 75 75 GLN HA H 1 4.809 0.030 . 1 . . . A 75 GLN HA . 11534 1 930 . 1 1 75 75 GLN HB2 H 1 2.151 0.030 . 2 . . . A 75 GLN HB2 . 11534 1 931 . 1 1 75 75 GLN HB3 H 1 1.869 0.030 . 2 . . . A 75 GLN HB3 . 11534 1 932 . 1 1 75 75 GLN HG2 H 1 2.156 0.030 . 2 . . . A 75 GLN HG2 . 11534 1 933 . 1 1 75 75 GLN HG3 H 1 2.097 0.030 . 2 . . . A 75 GLN HG3 . 11534 1 934 . 1 1 75 75 GLN HE21 H 1 6.795 0.030 . 2 . . . A 75 GLN HE21 . 11534 1 935 . 1 1 75 75 GLN HE22 H 1 7.561 0.030 . 2 . . . A 75 GLN HE22 . 11534 1 936 . 1 1 75 75 GLN C C 13 174.926 0.300 . 1 . . . A 75 GLN C . 11534 1 937 . 1 1 75 75 GLN CA C 13 54.156 0.300 . 1 . . . A 75 GLN CA . 11534 1 938 . 1 1 75 75 GLN CB C 13 30.752 0.300 . 1 . . . A 75 GLN CB . 11534 1 939 . 1 1 75 75 GLN CG C 13 32.602 0.300 . 1 . . . A 75 GLN CG . 11534 1 940 . 1 1 75 75 GLN N N 15 120.213 0.300 . 1 . . . A 75 GLN N . 11534 1 941 . 1 1 75 75 GLN NE2 N 15 111.673 0.300 . 1 . . . A 75 GLN NE2 . 11534 1 942 . 1 1 76 76 GLU H H 1 8.438 0.030 . 1 . . . A 76 GLU H . 11534 1 943 . 1 1 76 76 GLU HA H 1 3.906 0.030 . 1 . . . A 76 GLU HA . 11534 1 944 . 1 1 76 76 GLU HB2 H 1 1.588 0.030 . 2 . . . A 76 GLU HB2 . 11534 1 945 . 1 1 76 76 GLU HB3 H 1 1.475 0.030 . 2 . . . A 76 GLU HB3 . 11534 1 946 . 1 1 76 76 GLU HG2 H 1 1.999 0.030 . 1 . . . A 76 GLU HG2 . 11534 1 947 . 1 1 76 76 GLU HG3 H 1 1.999 0.030 . 1 . . . A 76 GLU HG3 . 11534 1 948 . 1 1 76 76 GLU C C 13 176.812 0.300 . 1 . . . A 76 GLU C . 11534 1 949 . 1 1 76 76 GLU CA C 13 59.062 0.300 . 1 . . . A 76 GLU CA . 11534 1 950 . 1 1 76 76 GLU CB C 13 30.114 0.300 . 1 . . . A 76 GLU CB . 11534 1 951 . 1 1 76 76 GLU CG C 13 36.770 0.300 . 1 . . . A 76 GLU CG . 11534 1 952 . 1 1 76 76 GLU N N 15 121.718 0.300 . 1 . . . A 76 GLU N . 11534 1 953 . 1 1 77 77 TYR H H 1 8.844 0.030 . 1 . . . A 77 TYR H . 11534 1 954 . 1 1 77 77 TYR HA H 1 4.818 0.030 . 1 . . . A 77 TYR HA . 11534 1 955 . 1 1 77 77 TYR HB2 H 1 3.240 0.030 . 2 . . . A 77 TYR HB2 . 11534 1 956 . 1 1 77 77 TYR HB3 H 1 2.542 0.030 . 2 . . . A 77 TYR HB3 . 11534 1 957 . 1 1 77 77 TYR HD1 H 1 7.128 0.030 . 1 . . . A 77 TYR HD1 . 11534 1 958 . 1 1 77 77 TYR HD2 H 1 7.128 0.030 . 1 . . . A 77 TYR HD2 . 11534 1 959 . 1 1 77 77 TYR HE1 H 1 6.764 0.030 . 1 . . . A 77 TYR HE1 . 11534 1 960 . 1 1 77 77 TYR HE2 H 1 6.764 0.030 . 1 . . . A 77 TYR HE2 . 11534 1 961 . 1 1 77 77 TYR C C 13 176.893 0.300 . 1 . . . A 77 TYR C . 11534 1 962 . 1 1 77 77 TYR CA C 13 57.025 0.300 . 1 . . . A 77 TYR CA . 11534 1 963 . 1 1 77 77 TYR CB C 13 40.317 0.300 . 1 . . . A 77 TYR CB . 11534 1 964 . 1 1 77 77 TYR CD1 C 13 133.121 0.300 . 1 . . . A 77 TYR CD1 . 11534 1 965 . 1 1 77 77 TYR CD2 C 13 133.121 0.300 . 1 . . . A 77 TYR CD2 . 11534 1 966 . 1 1 77 77 TYR CE1 C 13 118.270 0.300 . 1 . . . A 77 TYR CE1 . 11534 1 967 . 1 1 77 77 TYR CE2 C 13 118.270 0.300 . 1 . . . A 77 TYR CE2 . 11534 1 968 . 1 1 77 77 TYR N N 15 117.440 0.300 . 1 . . . A 77 TYR N . 11534 1 969 . 1 1 78 78 ARG HA H 1 4.343 0.030 . 1 . . . A 78 ARG HA . 11534 1 970 . 1 1 78 78 ARG HB2 H 1 2.014 0.030 . 2 . . . A 78 ARG HB2 . 11534 1 971 . 1 1 78 78 ARG HB3 H 1 1.865 0.030 . 2 . . . A 78 ARG HB3 . 11534 1 972 . 1 1 78 78 ARG HG2 H 1 1.681 0.030 . 1 . . . A 78 ARG HG2 . 11534 1 973 . 1 1 78 78 ARG HG3 H 1 1.681 0.030 . 1 . . . A 78 ARG HG3 . 11534 1 974 . 1 1 78 78 ARG HD2 H 1 3.212 0.030 . 1 . . . A 78 ARG HD2 . 11534 1 975 . 1 1 78 78 ARG HD3 H 1 3.212 0.030 . 1 . . . A 78 ARG HD3 . 11534 1 976 . 1 1 78 78 ARG C C 13 175.490 0.300 . 1 . . . A 78 ARG C . 11534 1 977 . 1 1 78 78 ARG CA C 13 56.883 0.300 . 1 . . . A 78 ARG CA . 11534 1 978 . 1 1 78 78 ARG CB C 13 29.974 0.300 . 1 . . . A 78 ARG CB . 11534 1 979 . 1 1 78 78 ARG CG C 13 27.270 0.300 . 1 . . . A 78 ARG CG . 11534 1 980 . 1 1 78 78 ARG CD C 13 43.267 0.300 . 1 . . . A 78 ARG CD . 11534 1 981 . 1 1 79 79 SER H H 1 7.141 0.030 . 1 . . . A 79 SER H . 11534 1 982 . 1 1 79 79 SER HA H 1 4.834 0.030 . 1 . . . A 79 SER HA . 11534 1 983 . 1 1 79 79 SER HB2 H 1 3.736 0.030 . 2 . . . A 79 SER HB2 . 11534 1 984 . 1 1 79 79 SER HB3 H 1 4.227 0.030 . 2 . . . A 79 SER HB3 . 11534 1 985 . 1 1 79 79 SER C C 13 174.107 0.300 . 1 . . . A 79 SER C . 11534 1 986 . 1 1 79 79 SER CA C 13 55.750 0.300 . 1 . . . A 79 SER CA . 11534 1 987 . 1 1 79 79 SER CB C 13 66.188 0.300 . 1 . . . A 79 SER CB . 11534 1 988 . 1 1 79 79 SER N N 15 111.089 0.300 . 1 . . . A 79 SER N . 11534 1 989 . 1 1 80 80 GLN H H 1 9.390 0.030 . 1 . . . A 80 GLN H . 11534 1 990 . 1 1 80 80 GLN HA H 1 4.289 0.030 . 1 . . . A 80 GLN HA . 11534 1 991 . 1 1 80 80 GLN HB2 H 1 2.101 0.030 . 2 . . . A 80 GLN HB2 . 11534 1 992 . 1 1 80 80 GLN HB3 H 1 2.030 0.030 . 2 . . . A 80 GLN HB3 . 11534 1 993 . 1 1 80 80 GLN HG2 H 1 2.238 0.030 . 2 . . . A 80 GLN HG2 . 11534 1 994 . 1 1 80 80 GLN HG3 H 1 2.422 0.030 . 2 . . . A 80 GLN HG3 . 11534 1 995 . 1 1 80 80 GLN HE21 H 1 6.896 0.030 . 2 . . . A 80 GLN HE21 . 11534 1 996 . 1 1 80 80 GLN HE22 H 1 7.574 0.030 . 2 . . . A 80 GLN HE22 . 11534 1 997 . 1 1 80 80 GLN C C 13 178.077 0.300 . 1 . . . A 80 GLN C . 11534 1 998 . 1 1 80 80 GLN CA C 13 59.364 0.300 . 1 . . . A 80 GLN CA . 11534 1 999 . 1 1 80 80 GLN CB C 13 29.119 0.300 . 1 . . . A 80 GLN CB . 11534 1 1000 . 1 1 80 80 GLN CG C 13 34.542 0.300 . 1 . . . A 80 GLN CG . 11534 1 1001 . 1 1 80 80 GLN N N 15 125.448 0.300 . 1 . . . A 80 GLN N . 11534 1 1002 . 1 1 80 80 GLN NE2 N 15 111.560 0.300 . 1 . . . A 80 GLN NE2 . 11534 1 1003 . 1 1 81 81 GLU H H 1 8.939 0.030 . 1 . . . A 81 GLU H . 11534 1 1004 . 1 1 81 81 GLU HA H 1 3.954 0.030 . 1 . . . A 81 GLU HA . 11534 1 1005 . 1 1 81 81 GLU HB2 H 1 2.005 0.030 . 2 . . . A 81 GLU HB2 . 11534 1 1006 . 1 1 81 81 GLU HB3 H 1 1.902 0.030 . 2 . . . A 81 GLU HB3 . 11534 1 1007 . 1 1 81 81 GLU HG2 H 1 2.341 0.030 . 2 . . . A 81 GLU HG2 . 11534 1 1008 . 1 1 81 81 GLU HG3 H 1 2.258 0.030 . 2 . . . A 81 GLU HG3 . 11534 1 1009 . 1 1 81 81 GLU C C 13 179.294 0.300 . 1 . . . A 81 GLU C . 11534 1 1010 . 1 1 81 81 GLU CA C 13 60.249 0.300 . 1 . . . A 81 GLU CA . 11534 1 1011 . 1 1 81 81 GLU CB C 13 28.867 0.300 . 1 . . . A 81 GLU CB . 11534 1 1012 . 1 1 81 81 GLU CG C 13 36.540 0.300 . 1 . . . A 81 GLU CG . 11534 1 1013 . 1 1 81 81 GLU N N 15 118.906 0.300 . 1 . . . A 81 GLU N . 11534 1 1014 . 1 1 82 82 LEU H H 1 7.479 0.030 . 1 . . . A 82 LEU H . 11534 1 1015 . 1 1 82 82 LEU HA H 1 4.010 0.030 . 1 . . . A 82 LEU HA . 11534 1 1016 . 1 1 82 82 LEU HB2 H 1 1.591 0.030 . 2 . . . A 82 LEU HB2 . 11534 1 1017 . 1 1 82 82 LEU HB3 H 1 0.924 0.030 . 2 . . . A 82 LEU HB3 . 11534 1 1018 . 1 1 82 82 LEU HG H 1 1.467 0.030 . 1 . . . A 82 LEU HG . 11534 1 1019 . 1 1 82 82 LEU HD11 H 1 0.790 0.030 . 2 . . . A 82 LEU HD11 . 11534 1 1020 . 1 1 82 82 LEU HD12 H 1 0.790 0.030 . 2 . . . A 82 LEU HD12 . 11534 1 1021 . 1 1 82 82 LEU HD13 H 1 0.790 0.030 . 2 . . . A 82 LEU HD13 . 11534 1 1022 . 1 1 82 82 LEU HD21 H 1 0.623 0.030 . 2 . . . A 82 LEU HD21 . 11534 1 1023 . 1 1 82 82 LEU HD22 H 1 0.623 0.030 . 2 . . . A 82 LEU HD22 . 11534 1 1024 . 1 1 82 82 LEU HD23 H 1 0.623 0.030 . 2 . . . A 82 LEU HD23 . 11534 1 1025 . 1 1 82 82 LEU C C 13 180.617 0.300 . 1 . . . A 82 LEU C . 11534 1 1026 . 1 1 82 82 LEU CA C 13 57.273 0.300 . 1 . . . A 82 LEU CA . 11534 1 1027 . 1 1 82 82 LEU CB C 13 41.456 0.300 . 1 . . . A 82 LEU CB . 11534 1 1028 . 1 1 82 82 LEU CG C 13 27.095 0.300 . 1 . . . A 82 LEU CG . 11534 1 1029 . 1 1 82 82 LEU CD1 C 13 25.450 0.300 . 2 . . . A 82 LEU CD1 . 11534 1 1030 . 1 1 82 82 LEU CD2 C 13 22.175 0.300 . 2 . . . A 82 LEU CD2 . 11534 1 1031 . 1 1 82 82 LEU N N 15 118.747 0.300 . 1 . . . A 82 LEU N . 11534 1 1032 . 1 1 83 83 ASN H H 1 7.961 0.030 . 1 . . . A 83 ASN H . 11534 1 1033 . 1 1 83 83 ASN HA H 1 4.814 0.030 . 1 . . . A 83 ASN HA . 11534 1 1034 . 1 1 83 83 ASN HB2 H 1 2.822 0.030 . 1 . . . A 83 ASN HB2 . 11534 1 1035 . 1 1 83 83 ASN HB3 H 1 2.822 0.030 . 1 . . . A 83 ASN HB3 . 11534 1 1036 . 1 1 83 83 ASN HD21 H 1 6.842 0.030 . 2 . . . A 83 ASN HD21 . 11534 1 1037 . 1 1 83 83 ASN HD22 H 1 7.533 0.030 . 2 . . . A 83 ASN HD22 . 11534 1 1038 . 1 1 83 83 ASN C C 13 176.820 0.300 . 1 . . . A 83 ASN C . 11534 1 1039 . 1 1 83 83 ASN CA C 13 56.494 0.300 . 1 . . . A 83 ASN CA . 11534 1 1040 . 1 1 83 83 ASN CB C 13 37.496 0.300 . 1 . . . A 83 ASN CB . 11534 1 1041 . 1 1 83 83 ASN N N 15 119.014 0.300 . 1 . . . A 83 ASN N . 11534 1 1042 . 1 1 83 83 ASN ND2 N 15 115.253 0.300 . 1 . . . A 83 ASN ND2 . 11534 1 1043 . 1 1 84 84 ARG H H 1 8.910 0.030 . 1 . . . A 84 ARG H . 11534 1 1044 . 1 1 84 84 ARG HA H 1 3.796 0.030 . 1 . . . A 84 ARG HA . 11534 1 1045 . 1 1 84 84 ARG HB2 H 1 1.999 0.030 . 2 . . . A 84 ARG HB2 . 11534 1 1046 . 1 1 84 84 ARG HB3 H 1 1.827 0.030 . 2 . . . A 84 ARG HB3 . 11534 1 1047 . 1 1 84 84 ARG HG2 H 1 1.561 0.030 . 2 . . . A 84 ARG HG2 . 11534 1 1048 . 1 1 84 84 ARG HG3 H 1 1.446 0.030 . 2 . . . A 84 ARG HG3 . 11534 1 1049 . 1 1 84 84 ARG HD2 H 1 3.212 0.030 . 1 . . . A 84 ARG HD2 . 11534 1 1050 . 1 1 84 84 ARG HD3 H 1 3.212 0.030 . 1 . . . A 84 ARG HD3 . 11534 1 1051 . 1 1 84 84 ARG HE H 1 7.401 0.030 . 1 . . . A 84 ARG HE . 11534 1 1052 . 1 1 84 84 ARG C C 13 177.303 0.300 . 1 . . . A 84 ARG C . 11534 1 1053 . 1 1 84 84 ARG CA C 13 60.635 0.300 . 1 . . . A 84 ARG CA . 11534 1 1054 . 1 1 84 84 ARG CB C 13 29.823 0.300 . 1 . . . A 84 ARG CB . 11534 1 1055 . 1 1 84 84 ARG CG C 13 28.190 0.300 . 1 . . . A 84 ARG CG . 11534 1 1056 . 1 1 84 84 ARG CD C 13 43.267 0.300 . 1 . . . A 84 ARG CD . 11534 1 1057 . 1 1 84 84 ARG N N 15 123.267 0.300 . 1 . . . A 84 ARG N . 11534 1 1058 . 1 1 84 84 ARG NE N 15 83.850 0.300 . 1 . . . A 84 ARG NE . 11534 1 1059 . 1 1 85 85 GLU H H 1 7.713 0.030 . 1 . . . A 85 GLU H . 11534 1 1060 . 1 1 85 85 GLU HA H 1 3.916 0.030 . 1 . . . A 85 GLU HA . 11534 1 1061 . 1 1 85 85 GLU HB2 H 1 2.030 0.030 . 1 . . . A 85 GLU HB2 . 11534 1 1062 . 1 1 85 85 GLU HB3 H 1 2.030 0.030 . 1 . . . A 85 GLU HB3 . 11534 1 1063 . 1 1 85 85 GLU HG2 H 1 2.371 0.030 . 2 . . . A 85 GLU HG2 . 11534 1 1064 . 1 1 85 85 GLU HG3 H 1 2.218 0.030 . 2 . . . A 85 GLU HG3 . 11534 1 1065 . 1 1 85 85 GLU C C 13 179.352 0.300 . 1 . . . A 85 GLU C . 11534 1 1066 . 1 1 85 85 GLU CA C 13 59.293 0.300 . 1 . . . A 85 GLU CA . 11534 1 1067 . 1 1 85 85 GLU CB C 13 29.534 0.300 . 1 . . . A 85 GLU CB . 11534 1 1068 . 1 1 85 85 GLU CG C 13 36.236 0.300 . 1 . . . A 85 GLU CG . 11534 1 1069 . 1 1 85 85 GLU N N 15 117.163 0.300 . 1 . . . A 85 GLU N . 11534 1 1070 . 1 1 86 86 ALA H H 1 7.939 0.030 . 1 . . . A 86 ALA H . 11534 1 1071 . 1 1 86 86 ALA HA H 1 4.260 0.030 . 1 . . . A 86 ALA HA . 11534 1 1072 . 1 1 86 86 ALA HB1 H 1 1.679 0.030 . 1 . . . A 86 ALA HB1 . 11534 1 1073 . 1 1 86 86 ALA HB2 H 1 1.679 0.030 . 1 . . . A 86 ALA HB2 . 11534 1 1074 . 1 1 86 86 ALA HB3 H 1 1.679 0.030 . 1 . . . A 86 ALA HB3 . 11534 1 1075 . 1 1 86 86 ALA C C 13 180.191 0.300 . 1 . . . A 86 ALA C . 11534 1 1076 . 1 1 86 86 ALA CA C 13 54.867 0.300 . 1 . . . A 86 ALA CA . 11534 1 1077 . 1 1 86 86 ALA CB C 13 18.781 0.300 . 1 . . . A 86 ALA CB . 11534 1 1078 . 1 1 86 86 ALA N N 15 121.835 0.300 . 1 . . . A 86 ALA N . 11534 1 1079 . 1 1 87 87 ALA H H 1 8.436 0.030 . 1 . . . A 87 ALA H . 11534 1 1080 . 1 1 87 87 ALA HA H 1 3.900 0.030 . 1 . . . A 87 ALA HA . 11534 1 1081 . 1 1 87 87 ALA HB1 H 1 1.374 0.030 . 1 . . . A 87 ALA HB1 . 11534 1 1082 . 1 1 87 87 ALA HB2 H 1 1.374 0.030 . 1 . . . A 87 ALA HB2 . 11534 1 1083 . 1 1 87 87 ALA HB3 H 1 1.374 0.030 . 1 . . . A 87 ALA HB3 . 11534 1 1084 . 1 1 87 87 ALA C C 13 178.910 0.300 . 1 . . . A 87 ALA C . 11534 1 1085 . 1 1 87 87 ALA CA C 13 55.361 0.300 . 1 . . . A 87 ALA CA . 11534 1 1086 . 1 1 87 87 ALA CB C 13 17.963 0.300 . 1 . . . A 87 ALA CB . 11534 1 1087 . 1 1 87 87 ALA N N 15 121.964 0.300 . 1 . . . A 87 ALA N . 11534 1 1088 . 1 1 88 88 LEU H H 1 7.989 0.030 . 1 . . . A 88 LEU H . 11534 1 1089 . 1 1 88 88 LEU HA H 1 3.744 0.030 . 1 . . . A 88 LEU HA . 11534 1 1090 . 1 1 88 88 LEU HB2 H 1 1.769 0.030 . 2 . . . A 88 LEU HB2 . 11534 1 1091 . 1 1 88 88 LEU HB3 H 1 1.401 0.030 . 2 . . . A 88 LEU HB3 . 11534 1 1092 . 1 1 88 88 LEU HG H 1 1.637 0.030 . 1 . . . A 88 LEU HG . 11534 1 1093 . 1 1 88 88 LEU HD11 H 1 0.724 0.030 . 2 . . . A 88 LEU HD11 . 11534 1 1094 . 1 1 88 88 LEU HD12 H 1 0.724 0.030 . 2 . . . A 88 LEU HD12 . 11534 1 1095 . 1 1 88 88 LEU HD13 H 1 0.724 0.030 . 2 . . . A 88 LEU HD13 . 11534 1 1096 . 1 1 88 88 LEU HD21 H 1 0.789 0.030 . 2 . . . A 88 LEU HD21 . 11534 1 1097 . 1 1 88 88 LEU HD22 H 1 0.789 0.030 . 2 . . . A 88 LEU HD22 . 11534 1 1098 . 1 1 88 88 LEU HD23 H 1 0.789 0.030 . 2 . . . A 88 LEU HD23 . 11534 1 1099 . 1 1 88 88 LEU C C 13 178.566 0.300 . 1 . . . A 88 LEU C . 11534 1 1100 . 1 1 88 88 LEU CA C 13 57.911 0.300 . 1 . . . A 88 LEU CA . 11534 1 1101 . 1 1 88 88 LEU CB C 13 41.838 0.300 . 1 . . . A 88 LEU CB . 11534 1 1102 . 1 1 88 88 LEU CG C 13 27.329 0.300 . 1 . . . A 88 LEU CG . 11534 1 1103 . 1 1 88 88 LEU CD1 C 13 23.813 0.300 . 2 . . . A 88 LEU CD1 . 11534 1 1104 . 1 1 88 88 LEU CD2 C 13 25.285 0.300 . 2 . . . A 88 LEU CD2 . 11534 1 1105 . 1 1 88 88 LEU N N 15 117.351 0.300 . 1 . . . A 88 LEU N . 11534 1 1106 . 1 1 89 89 ALA H H 1 8.152 0.030 . 1 . . . A 89 ALA H . 11534 1 1107 . 1 1 89 89 ALA HA H 1 4.037 0.030 . 1 . . . A 89 ALA HA . 11534 1 1108 . 1 1 89 89 ALA HB1 H 1 1.489 0.030 . 1 . . . A 89 ALA HB1 . 11534 1 1109 . 1 1 89 89 ALA HB2 H 1 1.489 0.030 . 1 . . . A 89 ALA HB2 . 11534 1 1110 . 1 1 89 89 ALA HB3 H 1 1.489 0.030 . 1 . . . A 89 ALA HB3 . 11534 1 1111 . 1 1 89 89 ALA C C 13 181.475 0.300 . 1 . . . A 89 ALA C . 11534 1 1112 . 1 1 89 89 ALA CA C 13 55.042 0.300 . 1 . . . A 89 ALA CA . 11534 1 1113 . 1 1 89 89 ALA CB C 13 17.730 0.300 . 1 . . . A 89 ALA CB . 11534 1 1114 . 1 1 89 89 ALA N N 15 120.564 0.300 . 1 . . . A 89 ALA N . 11534 1 1115 . 1 1 90 90 ARG H H 1 8.136 0.030 . 1 . . . A 90 ARG H . 11534 1 1116 . 1 1 90 90 ARG HA H 1 4.075 0.030 . 1 . . . A 90 ARG HA . 11534 1 1117 . 1 1 90 90 ARG HB2 H 1 1.970 0.030 . 1 . . . A 90 ARG HB2 . 11534 1 1118 . 1 1 90 90 ARG HB3 H 1 1.970 0.030 . 1 . . . A 90 ARG HB3 . 11534 1 1119 . 1 1 90 90 ARG HG2 H 1 1.856 0.030 . 2 . . . A 90 ARG HG2 . 11534 1 1120 . 1 1 90 90 ARG HG3 H 1 1.727 0.030 . 2 . . . A 90 ARG HG3 . 11534 1 1121 . 1 1 90 90 ARG HD2 H 1 3.201 0.030 . 2 . . . A 90 ARG HD2 . 11534 1 1122 . 1 1 90 90 ARG HD3 H 1 3.156 0.030 . 2 . . . A 90 ARG HD3 . 11534 1 1123 . 1 1 90 90 ARG C C 13 178.588 0.300 . 1 . . . A 90 ARG C . 11534 1 1124 . 1 1 90 90 ARG CA C 13 58.920 0.300 . 1 . . . A 90 ARG CA . 11534 1 1125 . 1 1 90 90 ARG CB C 13 29.946 0.300 . 1 . . . A 90 ARG CB . 11534 1 1126 . 1 1 90 90 ARG CG C 13 27.413 0.300 . 1 . . . A 90 ARG CG . 11534 1 1127 . 1 1 90 90 ARG CD C 13 43.849 0.300 . 1 . . . A 90 ARG CD . 11534 1 1128 . 1 1 90 90 ARG N N 15 119.667 0.300 . 1 . . . A 90 ARG N . 11534 1 1129 . 1 1 91 91 LEU H H 1 7.985 0.030 . 1 . . . A 91 LEU H . 11534 1 1130 . 1 1 91 91 LEU HA H 1 3.812 0.030 . 1 . . . A 91 LEU HA . 11534 1 1131 . 1 1 91 91 LEU HB2 H 1 2.085 0.030 . 2 . . . A 91 LEU HB2 . 11534 1 1132 . 1 1 91 91 LEU HB3 H 1 1.355 0.030 . 2 . . . A 91 LEU HB3 . 11534 1 1133 . 1 1 91 91 LEU HG H 1 1.187 0.030 . 1 . . . A 91 LEU HG . 11534 1 1134 . 1 1 91 91 LEU HD11 H 1 0.690 0.030 . 2 . . . A 91 LEU HD11 . 11534 1 1135 . 1 1 91 91 LEU HD12 H 1 0.690 0.030 . 2 . . . A 91 LEU HD12 . 11534 1 1136 . 1 1 91 91 LEU HD13 H 1 0.690 0.030 . 2 . . . A 91 LEU HD13 . 11534 1 1137 . 1 1 91 91 LEU HD21 H 1 0.460 0.030 . 2 . . . A 91 LEU HD21 . 11534 1 1138 . 1 1 91 91 LEU HD22 H 1 0.460 0.030 . 2 . . . A 91 LEU HD22 . 11534 1 1139 . 1 1 91 91 LEU HD23 H 1 0.460 0.030 . 2 . . . A 91 LEU HD23 . 11534 1 1140 . 1 1 91 91 LEU C C 13 177.575 0.300 . 1 . . . A 91 LEU C . 11534 1 1141 . 1 1 91 91 LEU CA C 13 58.247 0.300 . 1 . . . A 91 LEU CA . 11534 1 1142 . 1 1 91 91 LEU CB C 13 41.222 0.300 . 1 . . . A 91 LEU CB . 11534 1 1143 . 1 1 91 91 LEU CG C 13 26.860 0.300 . 1 . . . A 91 LEU CG . 11534 1 1144 . 1 1 91 91 LEU CD1 C 13 23.648 0.300 . 2 . . . A 91 LEU CD1 . 11534 1 1145 . 1 1 91 91 LEU CD2 C 13 26.286 0.300 . 2 . . . A 91 LEU CD2 . 11534 1 1146 . 1 1 91 91 LEU N N 15 121.942 0.300 . 1 . . . A 91 LEU N . 11534 1 1147 . 1 1 92 92 VAL H H 1 8.136 0.030 . 1 . . . A 92 VAL H . 11534 1 1148 . 1 1 92 92 VAL HA H 1 3.191 0.030 . 1 . . . A 92 VAL HA . 11534 1 1149 . 1 1 92 92 VAL HB H 1 1.995 0.030 . 1 . . . A 92 VAL HB . 11534 1 1150 . 1 1 92 92 VAL HG11 H 1 0.954 0.030 . 2 . . . A 92 VAL HG11 . 11534 1 1151 . 1 1 92 92 VAL HG12 H 1 0.954 0.030 . 2 . . . A 92 VAL HG12 . 11534 1 1152 . 1 1 92 92 VAL HG13 H 1 0.954 0.030 . 2 . . . A 92 VAL HG13 . 11534 1 1153 . 1 1 92 92 VAL HG21 H 1 0.903 0.030 . 2 . . . A 92 VAL HG21 . 11534 1 1154 . 1 1 92 92 VAL HG22 H 1 0.903 0.030 . 2 . . . A 92 VAL HG22 . 11534 1 1155 . 1 1 92 92 VAL HG23 H 1 0.903 0.030 . 2 . . . A 92 VAL HG23 . 11534 1 1156 . 1 1 92 92 VAL C C 13 177.550 0.300 . 1 . . . A 92 VAL C . 11534 1 1157 . 1 1 92 92 VAL CA C 13 67.481 0.300 . 1 . . . A 92 VAL CA . 11534 1 1158 . 1 1 92 92 VAL CB C 13 32.002 0.300 . 1 . . . A 92 VAL CB . 11534 1 1159 . 1 1 92 92 VAL CG1 C 13 21.467 0.300 . 2 . . . A 92 VAL CG1 . 11534 1 1160 . 1 1 92 92 VAL CG2 C 13 23.083 0.300 . 2 . . . A 92 VAL CG2 . 11534 1 1161 . 1 1 92 92 VAL N N 15 117.831 0.300 . 1 . . . A 92 VAL N . 11534 1 1162 . 1 1 93 93 ALA H H 1 7.980 0.030 . 1 . . . A 93 ALA H . 11534 1 1163 . 1 1 93 93 ALA HA H 1 4.040 0.030 . 1 . . . A 93 ALA HA . 11534 1 1164 . 1 1 93 93 ALA HB1 H 1 1.481 0.030 . 1 . . . A 93 ALA HB1 . 11534 1 1165 . 1 1 93 93 ALA HB2 H 1 1.481 0.030 . 1 . . . A 93 ALA HB2 . 11534 1 1166 . 1 1 93 93 ALA HB3 H 1 1.481 0.030 . 1 . . . A 93 ALA HB3 . 11534 1 1167 . 1 1 93 93 ALA C C 13 180.665 0.300 . 1 . . . A 93 ALA C . 11534 1 1168 . 1 1 93 93 ALA CA C 13 55.306 0.300 . 1 . . . A 93 ALA CA . 11534 1 1169 . 1 1 93 93 ALA CB C 13 18.234 0.300 . 1 . . . A 93 ALA CB . 11534 1 1170 . 1 1 93 93 ALA N N 15 119.709 0.300 . 1 . . . A 93 ALA N . 11534 1 1171 . 1 1 94 94 MET H H 1 8.119 0.030 . 1 . . . A 94 MET H . 11534 1 1172 . 1 1 94 94 MET HA H 1 4.193 0.030 . 1 . . . A 94 MET HA . 11534 1 1173 . 1 1 94 94 MET HB2 H 1 2.034 0.030 . 2 . . . A 94 MET HB2 . 11534 1 1174 . 1 1 94 94 MET HB3 H 1 1.997 0.030 . 2 . . . A 94 MET HB3 . 11534 1 1175 . 1 1 94 94 MET HG2 H 1 2.348 0.030 . 2 . . . A 94 MET HG2 . 11534 1 1176 . 1 1 94 94 MET HG3 H 1 2.314 0.030 . 2 . . . A 94 MET HG3 . 11534 1 1177 . 1 1 94 94 MET HE1 H 1 1.319 0.030 . 1 . . . A 94 MET HE1 . 11534 1 1178 . 1 1 94 94 MET HE2 H 1 1.319 0.030 . 1 . . . A 94 MET HE2 . 11534 1 1179 . 1 1 94 94 MET HE3 H 1 1.319 0.030 . 1 . . . A 94 MET HE3 . 11534 1 1180 . 1 1 94 94 MET C C 13 177.606 0.300 . 1 . . . A 94 MET C . 11534 1 1181 . 1 1 94 94 MET CA C 13 58.779 0.300 . 1 . . . A 94 MET CA . 11534 1 1182 . 1 1 94 94 MET CB C 13 32.250 0.300 . 1 . . . A 94 MET CB . 11534 1 1183 . 1 1 94 94 MET CG C 13 31.593 0.300 . 1 . . . A 94 MET CG . 11534 1 1184 . 1 1 94 94 MET CE C 13 17.084 0.300 . 1 . . . A 94 MET CE . 11534 1 1185 . 1 1 94 94 MET N N 15 117.983 0.300 . 1 . . . A 94 MET N . 11534 1 1186 . 1 1 95 95 ILE H H 1 8.183 0.030 . 1 . . . A 95 ILE H . 11534 1 1187 . 1 1 95 95 ILE HA H 1 3.512 0.030 . 1 . . . A 95 ILE HA . 11534 1 1188 . 1 1 95 95 ILE HB H 1 1.822 0.030 . 1 . . . A 95 ILE HB . 11534 1 1189 . 1 1 95 95 ILE HG12 H 1 1.893 0.030 . 2 . . . A 95 ILE HG12 . 11534 1 1190 . 1 1 95 95 ILE HG13 H 1 0.842 0.030 . 2 . . . A 95 ILE HG13 . 11534 1 1191 . 1 1 95 95 ILE HG21 H 1 0.875 0.030 . 1 . . . A 95 ILE HG21 . 11534 1 1192 . 1 1 95 95 ILE HG22 H 1 0.875 0.030 . 1 . . . A 95 ILE HG22 . 11534 1 1193 . 1 1 95 95 ILE HG23 H 1 0.875 0.030 . 1 . . . A 95 ILE HG23 . 11534 1 1194 . 1 1 95 95 ILE HD11 H 1 0.530 0.030 . 1 . . . A 95 ILE HD11 . 11534 1 1195 . 1 1 95 95 ILE HD12 H 1 0.530 0.030 . 1 . . . A 95 ILE HD12 . 11534 1 1196 . 1 1 95 95 ILE HD13 H 1 0.530 0.030 . 1 . . . A 95 ILE HD13 . 11534 1 1197 . 1 1 95 95 ILE C C 13 179.533 0.300 . 1 . . . A 95 ILE C . 11534 1 1198 . 1 1 95 95 ILE CA C 13 66.186 0.300 . 1 . . . A 95 ILE CA . 11534 1 1199 . 1 1 95 95 ILE CB C 13 37.352 0.300 . 1 . . . A 95 ILE CB . 11534 1 1200 . 1 1 95 95 ILE CG1 C 13 29.153 0.300 . 1 . . . A 95 ILE CG1 . 11534 1 1201 . 1 1 95 95 ILE CG2 C 13 17.662 0.300 . 1 . . . A 95 ILE CG2 . 11534 1 1202 . 1 1 95 95 ILE CD1 C 13 13.191 0.300 . 1 . . . A 95 ILE CD1 . 11534 1 1203 . 1 1 95 95 ILE N N 15 119.395 0.300 . 1 . . . A 95 ILE N . 11534 1 1204 . 1 1 96 96 LYS H H 1 8.490 0.030 . 1 . . . A 96 LYS H . 11534 1 1205 . 1 1 96 96 LYS HA H 1 3.778 0.030 . 1 . . . A 96 LYS HA . 11534 1 1206 . 1 1 96 96 LYS HB2 H 1 1.863 0.030 . 1 . . . A 96 LYS HB2 . 11534 1 1207 . 1 1 96 96 LYS HB3 H 1 1.863 0.030 . 1 . . . A 96 LYS HB3 . 11534 1 1208 . 1 1 96 96 LYS HG2 H 1 1.666 0.030 . 2 . . . A 96 LYS HG2 . 11534 1 1209 . 1 1 96 96 LYS HG3 H 1 1.370 0.030 . 2 . . . A 96 LYS HG3 . 11534 1 1210 . 1 1 96 96 LYS HD2 H 1 1.660 0.030 . 2 . . . A 96 LYS HD2 . 11534 1 1211 . 1 1 96 96 LYS HD3 H 1 1.714 0.030 . 2 . . . A 96 LYS HD3 . 11534 1 1212 . 1 1 96 96 LYS HE2 H 1 3.000 0.030 . 2 . . . A 96 LYS HE2 . 11534 1 1213 . 1 1 96 96 LYS HE3 H 1 2.914 0.030 . 2 . . . A 96 LYS HE3 . 11534 1 1214 . 1 1 96 96 LYS C C 13 178.852 0.300 . 1 . . . A 96 LYS C . 11534 1 1215 . 1 1 96 96 LYS CA C 13 60.639 0.300 . 1 . . . A 96 LYS CA . 11534 1 1216 . 1 1 96 96 LYS CB C 13 32.373 0.300 . 1 . . . A 96 LYS CB . 11534 1 1217 . 1 1 96 96 LYS CG C 13 25.901 0.300 . 1 . . . A 96 LYS CG . 11534 1 1218 . 1 1 96 96 LYS CD C 13 29.673 0.300 . 1 . . . A 96 LYS CD . 11534 1 1219 . 1 1 96 96 LYS CE C 13 41.997 0.300 . 1 . . . A 96 LYS CE . 11534 1 1220 . 1 1 96 96 LYS N N 15 120.998 0.300 . 1 . . . A 96 LYS N . 11534 1 1221 . 1 1 97 97 GLU H H 1 8.211 0.030 . 1 . . . A 97 GLU H . 11534 1 1222 . 1 1 97 97 GLU HA H 1 3.998 0.030 . 1 . . . A 97 GLU HA . 11534 1 1223 . 1 1 97 97 GLU HB2 H 1 2.223 0.030 . 2 . . . A 97 GLU HB2 . 11534 1 1224 . 1 1 97 97 GLU HB3 H 1 2.121 0.030 . 2 . . . A 97 GLU HB3 . 11534 1 1225 . 1 1 97 97 GLU HG2 H 1 2.357 0.030 . 2 . . . A 97 GLU HG2 . 11534 1 1226 . 1 1 97 97 GLU HG3 H 1 2.237 0.030 . 2 . . . A 97 GLU HG3 . 11534 1 1227 . 1 1 97 97 GLU C C 13 179.068 0.300 . 1 . . . A 97 GLU C . 11534 1 1228 . 1 1 97 97 GLU CA C 13 59.413 0.300 . 1 . . . A 97 GLU CA . 11534 1 1229 . 1 1 97 97 GLU CB C 13 29.791 0.300 . 1 . . . A 97 GLU CB . 11534 1 1230 . 1 1 97 97 GLU CG C 13 35.999 0.300 . 1 . . . A 97 GLU CG . 11534 1 1231 . 1 1 97 97 GLU N N 15 119.575 0.300 . 1 . . . A 97 GLU N . 11534 1 1232 . 1 1 98 98 LEU H H 1 7.951 0.030 . 1 . . . A 98 LEU H . 11534 1 1233 . 1 1 98 98 LEU HA H 1 4.305 0.030 . 1 . . . A 98 LEU HA . 11534 1 1234 . 1 1 98 98 LEU HB2 H 1 1.734 0.030 . 2 . . . A 98 LEU HB2 . 11534 1 1235 . 1 1 98 98 LEU HB3 H 1 1.380 0.030 . 2 . . . A 98 LEU HB3 . 11534 1 1236 . 1 1 98 98 LEU HG H 1 1.932 0.030 . 1 . . . A 98 LEU HG . 11534 1 1237 . 1 1 98 98 LEU HD11 H 1 0.936 0.030 . 2 . . . A 98 LEU HD11 . 11534 1 1238 . 1 1 98 98 LEU HD12 H 1 0.936 0.030 . 2 . . . A 98 LEU HD12 . 11534 1 1239 . 1 1 98 98 LEU HD13 H 1 0.936 0.030 . 2 . . . A 98 LEU HD13 . 11534 1 1240 . 1 1 98 98 LEU HD21 H 1 0.652 0.030 . 2 . . . A 98 LEU HD21 . 11534 1 1241 . 1 1 98 98 LEU HD22 H 1 0.652 0.030 . 2 . . . A 98 LEU HD22 . 11534 1 1242 . 1 1 98 98 LEU HD23 H 1 0.652 0.030 . 2 . . . A 98 LEU HD23 . 11534 1 1243 . 1 1 98 98 LEU C C 13 177.950 0.300 . 1 . . . A 98 LEU C . 11534 1 1244 . 1 1 98 98 LEU CA C 13 56.175 0.300 . 1 . . . A 98 LEU CA . 11534 1 1245 . 1 1 98 98 LEU CB C 13 42.947 0.300 . 1 . . . A 98 LEU CB . 11534 1 1246 . 1 1 98 98 LEU CG C 13 27.095 0.300 . 1 . . . A 98 LEU CG . 11534 1 1247 . 1 1 98 98 LEU CD1 C 13 22.679 0.300 . 2 . . . A 98 LEU CD1 . 11534 1 1248 . 1 1 98 98 LEU CD2 C 13 25.925 0.300 . 2 . . . A 98 LEU CD2 . 11534 1 1249 . 1 1 98 98 LEU N N 15 115.294 0.300 . 1 . . . A 98 LEU N . 11534 1 1250 . 1 1 99 99 THR H H 1 7.444 0.030 . 1 . . . A 99 THR H . 11534 1 1251 . 1 1 99 99 THR HA H 1 4.235 0.030 . 1 . . . A 99 THR HA . 11534 1 1252 . 1 1 99 99 THR HB H 1 3.961 0.030 . 1 . . . A 99 THR HB . 11534 1 1253 . 1 1 99 99 THR HG21 H 1 0.921 0.030 . 1 . . . A 99 THR HG21 . 11534 1 1254 . 1 1 99 99 THR HG22 H 1 0.921 0.030 . 1 . . . A 99 THR HG22 . 11534 1 1255 . 1 1 99 99 THR HG23 H 1 0.921 0.030 . 1 . . . A 99 THR HG23 . 11534 1 1256 . 1 1 99 99 THR C C 13 174.226 0.300 . 1 . . . A 99 THR C . 11534 1 1257 . 1 1 99 99 THR CA C 13 61.606 0.300 . 1 . . . A 99 THR CA . 11534 1 1258 . 1 1 99 99 THR CB C 13 69.638 0.300 . 1 . . . A 99 THR CB . 11534 1 1259 . 1 1 99 99 THR CG2 C 13 21.407 0.300 . 1 . . . A 99 THR CG2 . 11534 1 1260 . 1 1 99 99 THR N N 15 125.508 0.300 . 1 . . . A 99 THR N . 11534 1 1261 . 1 1 100 100 THR H H 1 7.313 0.030 . 1 . . . A 100 THR H . 11534 1 1262 . 1 1 100 100 THR HA H 1 4.320 0.030 . 1 . . . A 100 THR HA . 11534 1 1263 . 1 1 100 100 THR HB H 1 4.219 0.030 . 1 . . . A 100 THR HB . 11534 1 1264 . 1 1 100 100 THR HG21 H 1 1.268 0.030 . 1 . . . A 100 THR HG21 . 11534 1 1265 . 1 1 100 100 THR HG22 H 1 1.268 0.030 . 1 . . . A 100 THR HG22 . 11534 1 1266 . 1 1 100 100 THR HG23 H 1 1.268 0.030 . 1 . . . A 100 THR HG23 . 11534 1 1267 . 1 1 100 100 THR C C 13 174.251 0.300 . 1 . . . A 100 THR C . 11534 1 1268 . 1 1 100 100 THR CA C 13 62.876 0.300 . 1 . . . A 100 THR CA . 11534 1 1269 . 1 1 100 100 THR CB C 13 69.963 0.300 . 1 . . . A 100 THR CB . 11534 1 1270 . 1 1 100 100 THR CG2 C 13 21.189 0.300 . 1 . . . A 100 THR CG2 . 11534 1 1271 . 1 1 100 100 THR N N 15 116.774 0.300 . 1 . . . A 100 THR N . 11534 1 1272 . 1 1 101 101 GLU H H 1 8.596 0.030 . 1 . . . A 101 GLU H . 11534 1 1273 . 1 1 101 101 GLU HA H 1 4.284 0.030 . 1 . . . A 101 GLU HA . 11534 1 1274 . 1 1 101 101 GLU HB2 H 1 2.036 0.030 . 2 . . . A 101 GLU HB2 . 11534 1 1275 . 1 1 101 101 GLU HB3 H 1 1.953 0.030 . 2 . . . A 101 GLU HB3 . 11534 1 1276 . 1 1 101 101 GLU HG2 H 1 2.289 0.030 . 1 . . . A 101 GLU HG2 . 11534 1 1277 . 1 1 101 101 GLU HG3 H 1 2.289 0.030 . 1 . . . A 101 GLU HG3 . 11534 1 1278 . 1 1 101 101 GLU C C 13 176.340 0.300 . 1 . . . A 101 GLU C . 11534 1 1279 . 1 1 101 101 GLU CA C 13 56.635 0.300 . 1 . . . A 101 GLU CA . 11534 1 1280 . 1 1 101 101 GLU CB C 13 30.358 0.300 . 1 . . . A 101 GLU CB . 11534 1 1281 . 1 1 101 101 GLU CG C 13 36.250 0.300 . 1 . . . A 101 GLU CG . 11534 1 1282 . 1 1 101 101 GLU N N 15 125.589 0.300 . 1 . . . A 101 GLU N . 11534 1 1283 . 1 1 102 102 LYS H H 1 8.497 0.030 . 1 . . . A 102 LYS H . 11534 1 1284 . 1 1 102 102 LYS HA H 1 4.273 0.030 . 1 . . . A 102 LYS HA . 11534 1 1285 . 1 1 102 102 LYS HB2 H 1 1.800 0.030 . 2 . . . A 102 LYS HB2 . 11534 1 1286 . 1 1 102 102 LYS HB3 H 1 1.724 0.030 . 2 . . . A 102 LYS HB3 . 11534 1 1287 . 1 1 102 102 LYS HG2 H 1 1.429 0.030 . 2 . . . A 102 LYS HG2 . 11534 1 1288 . 1 1 102 102 LYS HG3 H 1 1.393 0.030 . 2 . . . A 102 LYS HG3 . 11534 1 1289 . 1 1 102 102 LYS HE2 H 1 2.974 0.030 . 1 . . . A 102 LYS HE2 . 11534 1 1290 . 1 1 102 102 LYS HE3 H 1 2.974 0.030 . 1 . . . A 102 LYS HE3 . 11534 1 1291 . 1 1 102 102 LYS C C 13 176.540 0.300 . 1 . . . A 102 LYS C . 11534 1 1292 . 1 1 102 102 LYS CA C 13 56.547 0.300 . 1 . . . A 102 LYS CA . 11534 1 1293 . 1 1 102 102 LYS CB C 13 32.868 0.300 . 1 . . . A 102 LYS CB . 11534 1 1294 . 1 1 102 102 LYS CG C 13 24.804 0.300 . 1 . . . A 102 LYS CG . 11534 1 1295 . 1 1 102 102 LYS CE C 13 42.162 0.300 . 1 . . . A 102 LYS CE . 11534 1 1296 . 1 1 102 102 LYS N N 15 123.846 0.300 . 1 . . . A 102 LYS N . 11534 1 1297 . 1 1 103 103 LYS H H 1 8.338 0.030 . 1 . . . A 103 LYS H . 11534 1 1298 . 1 1 103 103 LYS HA H 1 4.281 0.030 . 1 . . . A 103 LYS HA . 11534 1 1299 . 1 1 103 103 LYS HB2 H 1 1.787 0.030 . 2 . . . A 103 LYS HB2 . 11534 1 1300 . 1 1 103 103 LYS HB3 H 1 1.735 0.030 . 2 . . . A 103 LYS HB3 . 11534 1 1301 . 1 1 103 103 LYS HG2 H 1 1.433 0.030 . 2 . . . A 103 LYS HG2 . 11534 1 1302 . 1 1 103 103 LYS HG3 H 1 1.382 0.030 . 2 . . . A 103 LYS HG3 . 11534 1 1303 . 1 1 103 103 LYS HD2 H 1 1.661 0.030 . 1 . . . A 103 LYS HD2 . 11534 1 1304 . 1 1 103 103 LYS HD3 H 1 1.661 0.030 . 1 . . . A 103 LYS HD3 . 11534 1 1305 . 1 1 103 103 LYS HE2 H 1 2.974 0.030 . 1 . . . A 103 LYS HE2 . 11534 1 1306 . 1 1 103 103 LYS HE3 H 1 2.974 0.030 . 1 . . . A 103 LYS HE3 . 11534 1 1307 . 1 1 103 103 LYS C C 13 176.115 0.300 . 1 . . . A 103 LYS C . 11534 1 1308 . 1 1 103 103 LYS CA C 13 56.157 0.300 . 1 . . . A 103 LYS CA . 11534 1 1309 . 1 1 103 103 LYS CB C 13 33.032 0.300 . 1 . . . A 103 LYS CB . 11534 1 1310 . 1 1 103 103 LYS CG C 13 24.724 0.300 . 1 . . . A 103 LYS CG . 11534 1 1311 . 1 1 103 103 LYS CD C 13 28.970 0.300 . 1 . . . A 103 LYS CD . 11534 1 1312 . 1 1 103 103 LYS CE C 13 42.055 0.300 . 1 . . . A 103 LYS CE . 11534 1 1313 . 1 1 103 103 LYS N N 15 122.552 0.300 . 1 . . . A 103 LYS N . 11534 1 1314 . 1 1 104 104 ALA H H 1 8.306 0.030 . 1 . . . A 104 ALA H . 11534 1 1315 . 1 1 104 104 ALA HA H 1 4.274 0.030 . 1 . . . A 104 ALA HA . 11534 1 1316 . 1 1 104 104 ALA HB1 H 1 1.353 0.030 . 1 . . . A 104 ALA HB1 . 11534 1 1317 . 1 1 104 104 ALA HB2 H 1 1.353 0.030 . 1 . . . A 104 ALA HB2 . 11534 1 1318 . 1 1 104 104 ALA HB3 H 1 1.353 0.030 . 1 . . . A 104 ALA HB3 . 11534 1 1319 . 1 1 104 104 ALA C C 13 177.493 0.300 . 1 . . . A 104 ALA C . 11534 1 1320 . 1 1 104 104 ALA CA C 13 52.313 0.300 . 1 . . . A 104 ALA CA . 11534 1 1321 . 1 1 104 104 ALA CB C 13 19.249 0.300 . 1 . . . A 104 ALA CB . 11534 1 1322 . 1 1 104 104 ALA N N 15 125.394 0.300 . 1 . . . A 104 ALA N . 11534 1 1323 . 1 1 105 105 ARG H H 1 8.327 0.030 . 1 . . . A 105 ARG H . 11534 1 1324 . 1 1 105 105 ARG HA H 1 4.288 0.030 . 1 . . . A 105 ARG HA . 11534 1 1325 . 1 1 105 105 ARG HB2 H 1 1.792 0.030 . 2 . . . A 105 ARG HB2 . 11534 1 1326 . 1 1 105 105 ARG HB3 H 1 1.724 0.030 . 2 . . . A 105 ARG HB3 . 11534 1 1327 . 1 1 105 105 ARG HG2 H 1 1.624 0.030 . 2 . . . A 105 ARG HG2 . 11534 1 1328 . 1 1 105 105 ARG HG3 H 1 1.583 0.030 . 2 . . . A 105 ARG HG3 . 11534 1 1329 . 1 1 105 105 ARG HD2 H 1 3.157 0.030 . 1 . . . A 105 ARG HD2 . 11534 1 1330 . 1 1 105 105 ARG HD3 H 1 3.157 0.030 . 1 . . . A 105 ARG HD3 . 11534 1 1331 . 1 1 105 105 ARG C C 13 176.060 0.300 . 1 . . . A 105 ARG C . 11534 1 1332 . 1 1 105 105 ARG CA C 13 55.926 0.300 . 1 . . . A 105 ARG CA . 11534 1 1333 . 1 1 105 105 ARG CB C 13 30.933 0.300 . 1 . . . A 105 ARG CB . 11534 1 1334 . 1 1 105 105 ARG CG C 13 27.120 0.300 . 1 . . . A 105 ARG CG . 11534 1 1335 . 1 1 105 105 ARG CD C 13 43.465 0.300 . 1 . . . A 105 ARG CD . 11534 1 1336 . 1 1 105 105 ARG N N 15 121.050 0.300 . 1 . . . A 105 ARG N . 11534 1 1337 . 1 1 106 106 ARG H H 1 8.408 0.030 . 1 . . . A 106 ARG H . 11534 1 1338 . 1 1 106 106 ARG HA H 1 4.587 0.030 . 1 . . . A 106 ARG HA . 11534 1 1339 . 1 1 106 106 ARG HB2 H 1 1.817 0.030 . 2 . . . A 106 ARG HB2 . 11534 1 1340 . 1 1 106 106 ARG HB3 H 1 1.706 0.030 . 2 . . . A 106 ARG HB3 . 11534 1 1341 . 1 1 106 106 ARG HG2 H 1 1.641 0.030 . 1 . . . A 106 ARG HG2 . 11534 1 1342 . 1 1 106 106 ARG HG3 H 1 1.641 0.030 . 1 . . . A 106 ARG HG3 . 11534 1 1343 . 1 1 106 106 ARG HD2 H 1 3.177 0.030 . 2 . . . A 106 ARG HD2 . 11534 1 1344 . 1 1 106 106 ARG HD3 H 1 3.165 0.030 . 2 . . . A 106 ARG HD3 . 11534 1 1345 . 1 1 106 106 ARG C C 13 174.205 0.300 . 1 . . . A 106 ARG C . 11534 1 1346 . 1 1 106 106 ARG CA C 13 53.907 0.300 . 1 . . . A 106 ARG CA . 11534 1 1347 . 1 1 106 106 ARG CB C 13 30.205 0.300 . 1 . . . A 106 ARG CB . 11534 1 1348 . 1 1 106 106 ARG CG C 13 26.860 0.300 . 1 . . . A 106 ARG CG . 11534 1 1349 . 1 1 106 106 ARG CD C 13 43.363 0.300 . 1 . . . A 106 ARG CD . 11534 1 1350 . 1 1 106 106 ARG N N 15 123.882 0.300 . 1 . . . A 106 ARG N . 11534 1 1351 . 1 1 107 107 PRO HA H 1 4.470 0.030 . 1 . . . A 107 PRO HA . 11534 1 1352 . 1 1 107 107 PRO HB2 H 1 1.891 0.030 . 2 . . . A 107 PRO HB2 . 11534 1 1353 . 1 1 107 107 PRO HB3 H 1 2.278 0.030 . 2 . . . A 107 PRO HB3 . 11534 1 1354 . 1 1 107 107 PRO HG2 H 1 1.995 0.030 . 1 . . . A 107 PRO HG2 . 11534 1 1355 . 1 1 107 107 PRO HG3 H 1 1.995 0.030 . 1 . . . A 107 PRO HG3 . 11534 1 1356 . 1 1 107 107 PRO HD2 H 1 3.791 0.030 . 2 . . . A 107 PRO HD2 . 11534 1 1357 . 1 1 107 107 PRO HD3 H 1 3.617 0.030 . 2 . . . A 107 PRO HD3 . 11534 1 1358 . 1 1 107 107 PRO C C 13 176.976 0.300 . 1 . . . A 107 PRO C . 11534 1 1359 . 1 1 107 107 PRO CA C 13 63.128 0.300 . 1 . . . A 107 PRO CA . 11534 1 1360 . 1 1 107 107 PRO CB C 13 32.176 0.300 . 1 . . . A 107 PRO CB . 11534 1 1361 . 1 1 107 107 PRO CG C 13 27.332 0.300 . 1 . . . A 107 PRO CG . 11534 1 1362 . 1 1 107 107 PRO CD C 13 50.710 0.300 . 1 . . . A 107 PRO CD . 11534 1 1363 . 1 1 108 108 THR H H 1 8.310 0.030 . 1 . . . A 108 THR H . 11534 1 1364 . 1 1 108 108 THR HA H 1 4.288 0.030 . 1 . . . A 108 THR HA . 11534 1 1365 . 1 1 108 108 THR HB H 1 4.200 0.030 . 1 . . . A 108 THR HB . 11534 1 1366 . 1 1 108 108 THR HG21 H 1 1.192 0.030 . 1 . . . A 108 THR HG21 . 11534 1 1367 . 1 1 108 108 THR HG22 H 1 1.192 0.030 . 1 . . . A 108 THR HG22 . 11534 1 1368 . 1 1 108 108 THR HG23 H 1 1.192 0.030 . 1 . . . A 108 THR HG23 . 11534 1 1369 . 1 1 108 108 THR C C 13 174.533 0.300 . 1 . . . A 108 THR C . 11534 1 1370 . 1 1 108 108 THR CA C 13 61.932 0.300 . 1 . . . A 108 THR CA . 11534 1 1371 . 1 1 108 108 THR CB C 13 70.060 0.300 . 1 . . . A 108 THR CB . 11534 1 1372 . 1 1 108 108 THR CG2 C 13 21.739 0.300 . 1 . . . A 108 THR CG2 . 11534 1 1373 . 1 1 108 108 THR N N 15 115.242 0.300 . 1 . . . A 108 THR N . 11534 1 1374 . 1 1 109 109 ARG H H 1 8.391 0.030 . 1 . . . A 109 ARG H . 11534 1 1375 . 1 1 109 109 ARG HA H 1 4.402 0.030 . 1 . . . A 109 ARG HA . 11534 1 1376 . 1 1 109 109 ARG HB2 H 1 1.857 0.030 . 2 . . . A 109 ARG HB2 . 11534 1 1377 . 1 1 109 109 ARG HB3 H 1 1.753 0.030 . 2 . . . A 109 ARG HB3 . 11534 1 1378 . 1 1 109 109 ARG HG2 H 1 1.611 0.030 . 1 . . . A 109 ARG HG2 . 11534 1 1379 . 1 1 109 109 ARG HG3 H 1 1.611 0.030 . 1 . . . A 109 ARG HG3 . 11534 1 1380 . 1 1 109 109 ARG HD2 H 1 3.150 0.030 . 1 . . . A 109 ARG HD2 . 11534 1 1381 . 1 1 109 109 ARG HD3 H 1 3.150 0.030 . 1 . . . A 109 ARG HD3 . 11534 1 1382 . 1 1 109 109 ARG C C 13 176.007 0.300 . 1 . . . A 109 ARG C . 11534 1 1383 . 1 1 109 109 ARG CA C 13 55.998 0.300 . 1 . . . A 109 ARG CA . 11534 1 1384 . 1 1 109 109 ARG CB C 13 30.893 0.300 . 1 . . . A 109 ARG CB . 11534 1 1385 . 1 1 109 109 ARG CG C 13 27.045 0.300 . 1 . . . A 109 ARG CG . 11534 1 1386 . 1 1 109 109 ARG CD C 13 43.375 0.300 . 1 . . . A 109 ARG CD . 11534 1 1387 . 1 1 109 109 ARG N N 15 123.306 0.300 . 1 . . . A 109 ARG N . 11534 1 1388 . 1 1 110 110 SER H H 1 8.391 0.030 . 1 . . . A 110 SER H . 11534 1 1389 . 1 1 110 110 SER HA H 1 4.484 0.030 . 1 . . . A 110 SER HA . 11534 1 1390 . 1 1 110 110 SER HB2 H 1 3.839 0.030 . 1 . . . A 110 SER HB2 . 11534 1 1391 . 1 1 110 110 SER HB3 H 1 3.839 0.030 . 1 . . . A 110 SER HB3 . 11534 1 1392 . 1 1 110 110 SER C C 13 174.352 0.300 . 1 . . . A 110 SER C . 11534 1 1393 . 1 1 110 110 SER CA C 13 58.164 0.300 . 1 . . . A 110 SER CA . 11534 1 1394 . 1 1 110 110 SER CB C 13 63.893 0.300 . 1 . . . A 110 SER CB . 11534 1 1395 . 1 1 110 110 SER N N 15 117.327 0.300 . 1 . . . A 110 SER N . 11534 1 1396 . 1 1 111 111 GLY H H 1 8.262 0.030 . 1 . . . A 111 GLY H . 11534 1 1397 . 1 1 111 111 GLY HA2 H 1 4.104 0.030 . 1 . . . A 111 GLY HA2 . 11534 1 1398 . 1 1 111 111 GLY HA3 H 1 4.104 0.030 . 1 . . . A 111 GLY HA3 . 11534 1 1399 . 1 1 111 111 GLY C C 13 171.859 0.300 . 1 . . . A 111 GLY C . 11534 1 1400 . 1 1 111 111 GLY CA C 13 44.660 0.300 . 1 . . . A 111 GLY CA . 11534 1 1401 . 1 1 111 111 GLY N N 15 110.689 0.300 . 1 . . . A 111 GLY N . 11534 1 1402 . 1 1 112 112 PRO HA H 1 4.444 0.030 . 1 . . . A 112 PRO HA . 11534 1 1403 . 1 1 112 112 PRO HB2 H 1 1.950 0.030 . 2 . . . A 112 PRO HB2 . 11534 1 1404 . 1 1 112 112 PRO HB3 H 1 2.272 0.030 . 2 . . . A 112 PRO HB3 . 11534 1 1405 . 1 1 112 112 PRO HG2 H 1 1.987 0.030 . 1 . . . A 112 PRO HG2 . 11534 1 1406 . 1 1 112 112 PRO HG3 H 1 1.987 0.030 . 1 . . . A 112 PRO HG3 . 11534 1 1407 . 1 1 112 112 PRO HD2 H 1 3.616 0.030 . 2 . . . A 112 PRO HD2 . 11534 1 1408 . 1 1 112 112 PRO HD3 H 1 3.573 0.030 . 2 . . . A 112 PRO HD3 . 11534 1 1409 . 1 1 112 112 PRO C C 13 177.446 0.300 . 1 . . . A 112 PRO C . 11534 1 1410 . 1 1 112 112 PRO CA C 13 63.403 0.300 . 1 . . . A 112 PRO CA . 11534 1 1411 . 1 1 112 112 PRO CB C 13 32.251 0.300 . 1 . . . A 112 PRO CB . 11534 1 1412 . 1 1 112 112 PRO CG C 13 27.129 0.300 . 1 . . . A 112 PRO CG . 11534 1 1413 . 1 1 112 112 PRO CD C 13 49.767 0.300 . 1 . . . A 112 PRO CD . 11534 1 1414 . 1 1 113 113 SER H H 1 8.535 0.030 . 1 . . . A 113 SER H . 11534 1 1415 . 1 1 113 113 SER HA H 1 4.479 0.030 . 1 . . . A 113 SER HA . 11534 1 1416 . 1 1 113 113 SER HB2 H 1 3.840 0.030 . 1 . . . A 113 SER HB2 . 11534 1 1417 . 1 1 113 113 SER HB3 H 1 3.840 0.030 . 1 . . . A 113 SER HB3 . 11534 1 1418 . 1 1 113 113 SER C C 13 174.725 0.300 . 1 . . . A 113 SER C . 11534 1 1419 . 1 1 113 113 SER CA C 13 58.393 0.300 . 1 . . . A 113 SER CA . 11534 1 1420 . 1 1 113 113 SER CB C 13 63.893 0.300 . 1 . . . A 113 SER CB . 11534 1 1421 . 1 1 113 113 SER N N 15 116.204 0.300 . 1 . . . A 113 SER N . 11534 1 1422 . 1 1 114 114 SER H H 1 8.326 0.030 . 1 . . . A 114 SER H . 11534 1 1423 . 1 1 114 114 SER HA H 1 4.427 0.030 . 1 . . . A 114 SER HA . 11534 1 1424 . 1 1 114 114 SER HB2 H 1 3.900 0.030 . 2 . . . A 114 SER HB2 . 11534 1 1425 . 1 1 114 114 SER HB3 H 1 3.839 0.030 . 2 . . . A 114 SER HB3 . 11534 1 1426 . 1 1 114 114 SER C C 13 175.021 0.300 . 1 . . . A 114 SER C . 11534 1 1427 . 1 1 114 114 SER CA C 13 58.638 0.300 . 1 . . . A 114 SER CA . 11534 1 1428 . 1 1 114 114 SER CB C 13 63.887 0.300 . 1 . . . A 114 SER CB . 11534 1 1429 . 1 1 114 114 SER N N 15 117.464 0.300 . 1 . . . A 114 SER N . 11534 1 1430 . 1 1 115 115 GLY H H 1 8.401 0.030 . 1 . . . A 115 GLY H . 11534 1 1431 . 1 1 115 115 GLY HA2 H 1 3.949 0.030 . 1 . . . A 115 GLY HA2 . 11534 1 1432 . 1 1 115 115 GLY HA3 H 1 3.949 0.030 . 1 . . . A 115 GLY HA3 . 11534 1 1433 . 1 1 115 115 GLY C C 13 174.124 0.300 . 1 . . . A 115 GLY C . 11534 1 1434 . 1 1 115 115 GLY CA C 13 45.439 0.300 . 1 . . . A 115 GLY CA . 11534 1 1435 . 1 1 115 115 GLY N N 15 110.595 0.300 . 1 . . . A 115 GLY N . 11534 1 1436 . 1 1 116 116 GLU H H 1 8.239 0.030 . 1 . . . A 116 GLU H . 11534 1 1437 . 1 1 116 116 GLU HA H 1 4.220 0.030 . 1 . . . A 116 GLU HA . 11534 1 1438 . 1 1 116 116 GLU HB2 H 1 2.000 0.030 . 2 . . . A 116 GLU HB2 . 11534 1 1439 . 1 1 116 116 GLU HB3 H 1 1.882 0.030 . 2 . . . A 116 GLU HB3 . 11534 1 1440 . 1 1 116 116 GLU HG2 H 1 2.197 0.030 . 1 . . . A 116 GLU HG2 . 11534 1 1441 . 1 1 116 116 GLU HG3 H 1 2.197 0.030 . 1 . . . A 116 GLU HG3 . 11534 1 1442 . 1 1 116 116 GLU C C 13 176.125 0.300 . 1 . . . A 116 GLU C . 11534 1 1443 . 1 1 116 116 GLU CA C 13 56.629 0.300 . 1 . . . A 116 GLU CA . 11534 1 1444 . 1 1 116 116 GLU CB C 13 30.316 0.300 . 1 . . . A 116 GLU CB . 11534 1 1445 . 1 1 116 116 GLU CG C 13 36.348 0.300 . 1 . . . A 116 GLU CG . 11534 1 1446 . 1 1 116 116 GLU N N 15 120.336 0.300 . 1 . . . A 116 GLU N . 11534 1 1447 . 1 1 117 117 ASN H H 1 8.448 0.030 . 1 . . . A 117 ASN H . 11534 1 1448 . 1 1 117 117 ASN HA H 1 4.595 0.030 . 1 . . . A 117 ASN HA . 11534 1 1449 . 1 1 117 117 ASN HB2 H 1 2.728 0.030 . 2 . . . A 117 ASN HB2 . 11534 1 1450 . 1 1 117 117 ASN HB3 H 1 2.670 0.030 . 2 . . . A 117 ASN HB3 . 11534 1 1451 . 1 1 117 117 ASN HD21 H 1 6.883 0.030 . 2 . . . A 117 ASN HD21 . 11534 1 1452 . 1 1 117 117 ASN HD22 H 1 7.525 0.030 . 2 . . . A 117 ASN HD22 . 11534 1 1453 . 1 1 117 117 ASN C C 13 174.808 0.300 . 1 . . . A 117 ASN C . 11534 1 1454 . 1 1 117 117 ASN CA C 13 53.269 0.300 . 1 . . . A 117 ASN CA . 11534 1 1455 . 1 1 117 117 ASN CB C 13 38.704 0.300 . 1 . . . A 117 ASN CB . 11534 1 1456 . 1 1 117 117 ASN N N 15 119.274 0.300 . 1 . . . A 117 ASN N . 11534 1 1457 . 1 1 117 117 ASN ND2 N 15 112.921 0.300 . 1 . . . A 117 ASN ND2 . 11534 1 1458 . 1 1 118 118 LEU H H 1 8.048 0.030 . 1 . . . A 118 LEU H . 11534 1 1459 . 1 1 118 118 LEU HA H 1 4.179 0.030 . 1 . . . A 118 LEU HA . 11534 1 1460 . 1 1 118 118 LEU HB2 H 1 1.394 0.030 . 2 . . . A 118 LEU HB2 . 11534 1 1461 . 1 1 118 118 LEU HB3 H 1 1.258 0.030 . 2 . . . A 118 LEU HB3 . 11534 1 1462 . 1 1 118 118 LEU HG H 1 1.402 0.030 . 1 . . . A 118 LEU HG . 11534 1 1463 . 1 1 118 118 LEU HD11 H 1 0.822 0.030 . 2 . . . A 118 LEU HD11 . 11534 1 1464 . 1 1 118 118 LEU HD12 H 1 0.822 0.030 . 2 . . . A 118 LEU HD12 . 11534 1 1465 . 1 1 118 118 LEU HD13 H 1 0.822 0.030 . 2 . . . A 118 LEU HD13 . 11534 1 1466 . 1 1 118 118 LEU HD21 H 1 0.748 0.030 . 2 . . . A 118 LEU HD21 . 11534 1 1467 . 1 1 118 118 LEU HD22 H 1 0.748 0.030 . 2 . . . A 118 LEU HD22 . 11534 1 1468 . 1 1 118 118 LEU HD23 H 1 0.748 0.030 . 2 . . . A 118 LEU HD23 . 11534 1 1469 . 1 1 118 118 LEU C C 13 176.698 0.300 . 1 . . . A 118 LEU C . 11534 1 1470 . 1 1 118 118 LEU CA C 13 55.224 0.300 . 1 . . . A 118 LEU CA . 11534 1 1471 . 1 1 118 118 LEU CB C 13 42.336 0.300 . 1 . . . A 118 LEU CB . 11534 1 1472 . 1 1 118 118 LEU CG C 13 26.917 0.300 . 1 . . . A 118 LEU CG . 11534 1 1473 . 1 1 118 118 LEU CD1 C 13 24.938 0.300 . 2 . . . A 118 LEU CD1 . 11534 1 1474 . 1 1 118 118 LEU CD2 C 13 23.318 0.300 . 2 . . . A 118 LEU CD2 . 11534 1 1475 . 1 1 118 118 LEU N N 15 122.037 0.300 . 1 . . . A 118 LEU N . 11534 1 1476 . 1 1 119 119 TYR H H 1 7.975 0.030 . 1 . . . A 119 TYR H . 11534 1 1477 . 1 1 119 119 TYR HA H 1 4.486 0.030 . 1 . . . A 119 TYR HA . 11534 1 1478 . 1 1 119 119 TYR HB2 H 1 2.919 0.030 . 2 . . . A 119 TYR HB2 . 11534 1 1479 . 1 1 119 119 TYR HB3 H 1 2.777 0.030 . 2 . . . A 119 TYR HB3 . 11534 1 1480 . 1 1 119 119 TYR HD1 H 1 6.991 0.030 . 1 . . . A 119 TYR HD1 . 11534 1 1481 . 1 1 119 119 TYR HD2 H 1 6.991 0.030 . 1 . . . A 119 TYR HD2 . 11534 1 1482 . 1 1 119 119 TYR HE1 H 1 6.749 0.030 . 1 . . . A 119 TYR HE1 . 11534 1 1483 . 1 1 119 119 TYR HE2 H 1 6.749 0.030 . 1 . . . A 119 TYR HE2 . 11534 1 1484 . 1 1 119 119 TYR C C 13 175.201 0.300 . 1 . . . A 119 TYR C . 11534 1 1485 . 1 1 119 119 TYR CA C 13 57.610 0.300 . 1 . . . A 119 TYR CA . 11534 1 1486 . 1 1 119 119 TYR CB C 13 38.821 0.300 . 1 . . . A 119 TYR CB . 11534 1 1487 . 1 1 119 119 TYR CD1 C 13 133.146 0.300 . 1 . . . A 119 TYR CD1 . 11534 1 1488 . 1 1 119 119 TYR CD2 C 13 133.146 0.300 . 1 . . . A 119 TYR CD2 . 11534 1 1489 . 1 1 119 119 TYR CE1 C 13 118.269 0.300 . 1 . . . A 119 TYR CE1 . 11534 1 1490 . 1 1 119 119 TYR CE2 C 13 118.269 0.300 . 1 . . . A 119 TYR CE2 . 11534 1 1491 . 1 1 119 119 TYR N N 15 119.525 0.300 . 1 . . . A 119 TYR N . 11534 1 1492 . 1 1 120 120 PHE H H 1 8.000 0.030 . 1 . . . A 120 PHE H . 11534 1 1493 . 1 1 120 120 PHE HA H 1 4.574 0.030 . 1 . . . A 120 PHE HA . 11534 1 1494 . 1 1 120 120 PHE HB2 H 1 3.125 0.030 . 2 . . . A 120 PHE HB2 . 11534 1 1495 . 1 1 120 120 PHE HB3 H 1 2.931 0.030 . 2 . . . A 120 PHE HB3 . 11534 1 1496 . 1 1 120 120 PHE HD1 H 1 7.190 0.030 . 1 . . . A 120 PHE HD1 . 11534 1 1497 . 1 1 120 120 PHE HD2 H 1 7.190 0.030 . 1 . . . A 120 PHE HD2 . 11534 1 1498 . 1 1 120 120 PHE HE1 H 1 7.299 0.030 . 1 . . . A 120 PHE HE1 . 11534 1 1499 . 1 1 120 120 PHE HE2 H 1 7.299 0.030 . 1 . . . A 120 PHE HE2 . 11534 1 1500 . 1 1 120 120 PHE HZ H 1 7.243 0.030 . 1 . . . A 120 PHE HZ . 11534 1 1501 . 1 1 120 120 PHE C C 13 174.457 0.300 . 1 . . . A 120 PHE C . 11534 1 1502 . 1 1 120 120 PHE CA C 13 57.557 0.300 . 1 . . . A 120 PHE CA . 11534 1 1503 . 1 1 120 120 PHE CB C 13 39.664 0.300 . 1 . . . A 120 PHE CB . 11534 1 1504 . 1 1 120 120 PHE CD1 C 13 131.926 0.300 . 1 . . . A 120 PHE CD1 . 11534 1 1505 . 1 1 120 120 PHE CD2 C 13 131.926 0.300 . 1 . . . A 120 PHE CD2 . 11534 1 1506 . 1 1 120 120 PHE CE1 C 13 131.652 0.300 . 1 . . . A 120 PHE CE1 . 11534 1 1507 . 1 1 120 120 PHE CE2 C 13 131.652 0.300 . 1 . . . A 120 PHE CE2 . 11534 1 1508 . 1 1 120 120 PHE CZ C 13 129.767 0.300 . 1 . . . A 120 PHE CZ . 11534 1 1509 . 1 1 120 120 PHE N N 15 121.291 0.300 . 1 . . . A 120 PHE N . 11534 1 1510 . 1 1 121 121 GLN H H 1 7.758 0.030 . 1 . . . A 121 GLN H . 11534 1 1511 . 1 1 121 121 GLN HA H 1 4.087 0.030 . 1 . . . A 121 GLN HA . 11534 1 1512 . 1 1 121 121 GLN HB2 H 1 2.043 0.030 . 2 . . . A 121 GLN HB2 . 11534 1 1513 . 1 1 121 121 GLN HB3 H 1 1.872 0.030 . 2 . . . A 121 GLN HB3 . 11534 1 1514 . 1 1 121 121 GLN HG2 H 1 2.210 0.030 . 1 . . . A 121 GLN HG2 . 11534 1 1515 . 1 1 121 121 GLN HG3 H 1 2.210 0.030 . 1 . . . A 121 GLN HG3 . 11534 1 1516 . 1 1 121 121 GLN HE21 H 1 6.854 0.030 . 2 . . . A 121 GLN HE21 . 11534 1 1517 . 1 1 121 121 GLN HE22 H 1 7.489 0.030 . 2 . . . A 121 GLN HE22 . 11534 1 1518 . 1 1 121 121 GLN C C 13 180.191 0.300 . 1 . . . A 121 GLN C . 11534 1 1519 . 1 1 121 121 GLN CA C 13 57.255 0.300 . 1 . . . A 121 GLN CA . 11534 1 1520 . 1 1 121 121 GLN CB C 13 30.591 0.300 . 1 . . . A 121 GLN CB . 11534 1 1521 . 1 1 121 121 GLN CG C 13 34.276 0.300 . 1 . . . A 121 GLN CG . 11534 1 1522 . 1 1 121 121 GLN N N 15 126.042 0.300 . 1 . . . A 121 GLN N . 11534 1 1523 . 1 1 121 121 GLN NE2 N 15 112.430 0.300 . 1 . . . A 121 GLN NE2 . 11534 1 stop_ save_