data_11090 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11090 _Entry.Title ; Solution structure of the N-terminal PapD-like domain of HYDIN protein from human ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-01-18 _Entry.Accession_date 2010-01-19 _Entry.Last_release_date 2011-01-19 _Entry.Original_release_date 2011-01-19 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.14 _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 H. Li . . . 11090 2 T. Tomizawa . . . 11090 3 S. Koshiba . . . 11090 4 S. Watanabe . . . 11090 5 T. Harada . . . 11090 6 T. Kigawa . . . 11090 7 S. Yokoyama . . . 11090 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 . 'Protein 3000' 'RIKEN Structural Genomics/Proteomics Initiative (RSGI)' . 11090 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11090 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 521 11090 '15N chemical shifts' 119 11090 '1H chemical shifts' 842 11090 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 . . 2011-01-19 2010-01-18 original author . 11090 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2YS4 'BMRB Entry Tracking System' 11090 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11090 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Solution structure of the N-terminal PapD-like domain of HYDIN protein from human ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _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 . _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 H. Li . . . 11090 1 2 T. Tomizawa . . . 11090 1 3 S. Koshiba . . . 11090 1 4 S. Watanabe . . . 11090 1 5 T. Harada . . . 11090 1 6 T. Kigawa . . . 11090 1 7 S. Yokoyama . . . 11090 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11090 _Assembly.ID 1 _Assembly.Name 'Hydrocephalus-inducing protein homolog' _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 'PapD-like, UNP residues 182-296' 1 $entity_1 A . yes native no no . . . 11090 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 2ys4 . . . . . . 11090 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11090 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'PapD-like, UNP residues 182-296' _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 ; GSSGSSGTEREKFIVPIKAR GARAILDFPDKLNFSTCPVK YSTQKILLVRNIGNKNAVFH IKTCRPFSIEPAIGTLNVGE SMQLEVEFEPQSVGDHSGRL IVCYDTGEKVFVSLYGAAID MN ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 122 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 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 2YS4 . "Solution Structure Of The N-Terminal Papd-Like Domain Of Hydin Protein From Human" . . . . . 100.00 122 100.00 100.00 2.32e-83 . . . . 11090 1 2 no DBJ BAB14314 . "unnamed protein product [Homo sapiens]" . . . . . 94.26 1017 100.00 100.00 6.37e-71 . . . . 11090 1 3 no DBJ BAG61096 . "unnamed protein product [Homo sapiens]" . . . . . 94.26 940 100.00 100.00 4.23e-71 . . . . 11090 1 4 no DBJ BAG61346 . "unnamed protein product [Homo sapiens]" . . . . . 94.26 950 100.00 100.00 4.98e-71 . . . . 11090 1 5 no EMBL CAD38687 . "hypothetical protein [Homo sapiens]" . . . . . 68.85 528 100.00 100.00 3.93e-49 . . . . 11090 1 6 no GB AAH28351 . "HYDIN protein, partial [Homo sapiens]" . . . . . 94.26 729 100.00 100.00 7.83e-72 . . . . 11090 1 7 no GB AIC60203 . "HYDIN, partial [synthetic construct]" . . . . . 94.26 708 100.00 100.00 4.33e-72 . . . . 11090 1 8 no REF NP_001185471 . "hydrocephalus-inducing protein homolog isoform c [Homo sapiens]" . . . . . 94.26 950 100.00 100.00 4.98e-71 . . . . 11090 1 9 no REF NP_001185472 . "hydrocephalus-inducing protein homolog isoform d [Homo sapiens]" . . . . . 94.26 940 100.00 100.00 4.23e-71 . . . . 11090 1 10 no REF NP_001257903 . "hydrocephalus-inducing protein homolog isoform a [Homo sapiens]" . . . . . 94.26 5121 100.00 100.00 6.27e-70 . . . . 11090 1 11 no REF NP_060028 . "hydrocephalus-inducing protein homolog isoform b [Homo sapiens]" . . . . . 94.26 1017 100.00 100.00 5.29e-71 . . . . 11090 1 12 no REF XP_004057985 . "PREDICTED: hydrocephalus-inducing protein homolog, partial [Gorilla gorilla gorilla]" . . . . . 94.26 4296 98.26 100.00 1.03e-69 . . . . 11090 1 13 no SP Q4G0P3 . "RecName: Full=Hydrocephalus-inducing protein homolog" . . . . . 94.26 5121 100.00 100.00 6.27e-70 . . . . 11090 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 11090 1 2 . SER . 11090 1 3 . SER . 11090 1 4 . GLY . 11090 1 5 . SER . 11090 1 6 . SER . 11090 1 7 . GLY . 11090 1 8 . THR . 11090 1 9 . GLU . 11090 1 10 . ARG . 11090 1 11 . GLU . 11090 1 12 . LYS . 11090 1 13 . PHE . 11090 1 14 . ILE . 11090 1 15 . VAL . 11090 1 16 . PRO . 11090 1 17 . ILE . 11090 1 18 . LYS . 11090 1 19 . ALA . 11090 1 20 . ARG . 11090 1 21 . GLY . 11090 1 22 . ALA . 11090 1 23 . ARG . 11090 1 24 . ALA . 11090 1 25 . ILE . 11090 1 26 . LEU . 11090 1 27 . ASP . 11090 1 28 . PHE . 11090 1 29 . PRO . 11090 1 30 . ASP . 11090 1 31 . LYS . 11090 1 32 . LEU . 11090 1 33 . ASN . 11090 1 34 . PHE . 11090 1 35 . SER . 11090 1 36 . THR . 11090 1 37 . CYS . 11090 1 38 . PRO . 11090 1 39 . VAL . 11090 1 40 . LYS . 11090 1 41 . TYR . 11090 1 42 . SER . 11090 1 43 . THR . 11090 1 44 . GLN . 11090 1 45 . LYS . 11090 1 46 . ILE . 11090 1 47 . LEU . 11090 1 48 . LEU . 11090 1 49 . VAL . 11090 1 50 . ARG . 11090 1 51 . ASN . 11090 1 52 . ILE . 11090 1 53 . GLY . 11090 1 54 . ASN . 11090 1 55 . LYS . 11090 1 56 . ASN . 11090 1 57 . ALA . 11090 1 58 . VAL . 11090 1 59 . PHE . 11090 1 60 . HIS . 11090 1 61 . ILE . 11090 1 62 . LYS . 11090 1 63 . THR . 11090 1 64 . CYS . 11090 1 65 . ARG . 11090 1 66 . PRO . 11090 1 67 . PHE . 11090 1 68 . SER . 11090 1 69 . ILE . 11090 1 70 . GLU . 11090 1 71 . PRO . 11090 1 72 . ALA . 11090 1 73 . ILE . 11090 1 74 . GLY . 11090 1 75 . THR . 11090 1 76 . LEU . 11090 1 77 . ASN . 11090 1 78 . VAL . 11090 1 79 . GLY . 11090 1 80 . GLU . 11090 1 81 . SER . 11090 1 82 . MET . 11090 1 83 . GLN . 11090 1 84 . LEU . 11090 1 85 . GLU . 11090 1 86 . VAL . 11090 1 87 . GLU . 11090 1 88 . PHE . 11090 1 89 . GLU . 11090 1 90 . PRO . 11090 1 91 . GLN . 11090 1 92 . SER . 11090 1 93 . VAL . 11090 1 94 . GLY . 11090 1 95 . ASP . 11090 1 96 . HIS . 11090 1 97 . SER . 11090 1 98 . GLY . 11090 1 99 . ARG . 11090 1 100 . LEU . 11090 1 101 . ILE . 11090 1 102 . VAL . 11090 1 103 . CYS . 11090 1 104 . TYR . 11090 1 105 . ASP . 11090 1 106 . THR . 11090 1 107 . GLY . 11090 1 108 . GLU . 11090 1 109 . LYS . 11090 1 110 . VAL . 11090 1 111 . PHE . 11090 1 112 . VAL . 11090 1 113 . SER . 11090 1 114 . LEU . 11090 1 115 . TYR . 11090 1 116 . GLY . 11090 1 117 . ALA . 11090 1 118 . ALA . 11090 1 119 . ILE . 11090 1 120 . ASP . 11090 1 121 . MET . 11090 1 122 . ASN . 11090 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 11090 1 . SER 2 2 11090 1 . SER 3 3 11090 1 . GLY 4 4 11090 1 . SER 5 5 11090 1 . SER 6 6 11090 1 . GLY 7 7 11090 1 . THR 8 8 11090 1 . GLU 9 9 11090 1 . ARG 10 10 11090 1 . GLU 11 11 11090 1 . LYS 12 12 11090 1 . PHE 13 13 11090 1 . ILE 14 14 11090 1 . VAL 15 15 11090 1 . PRO 16 16 11090 1 . ILE 17 17 11090 1 . LYS 18 18 11090 1 . ALA 19 19 11090 1 . ARG 20 20 11090 1 . GLY 21 21 11090 1 . ALA 22 22 11090 1 . ARG 23 23 11090 1 . ALA 24 24 11090 1 . ILE 25 25 11090 1 . LEU 26 26 11090 1 . ASP 27 27 11090 1 . PHE 28 28 11090 1 . PRO 29 29 11090 1 . ASP 30 30 11090 1 . LYS 31 31 11090 1 . LEU 32 32 11090 1 . ASN 33 33 11090 1 . PHE 34 34 11090 1 . SER 35 35 11090 1 . THR 36 36 11090 1 . CYS 37 37 11090 1 . PRO 38 38 11090 1 . VAL 39 39 11090 1 . LYS 40 40 11090 1 . TYR 41 41 11090 1 . SER 42 42 11090 1 . THR 43 43 11090 1 . GLN 44 44 11090 1 . LYS 45 45 11090 1 . ILE 46 46 11090 1 . LEU 47 47 11090 1 . LEU 48 48 11090 1 . VAL 49 49 11090 1 . ARG 50 50 11090 1 . ASN 51 51 11090 1 . ILE 52 52 11090 1 . GLY 53 53 11090 1 . ASN 54 54 11090 1 . LYS 55 55 11090 1 . ASN 56 56 11090 1 . ALA 57 57 11090 1 . VAL 58 58 11090 1 . PHE 59 59 11090 1 . HIS 60 60 11090 1 . ILE 61 61 11090 1 . LYS 62 62 11090 1 . THR 63 63 11090 1 . CYS 64 64 11090 1 . ARG 65 65 11090 1 . PRO 66 66 11090 1 . PHE 67 67 11090 1 . SER 68 68 11090 1 . ILE 69 69 11090 1 . GLU 70 70 11090 1 . PRO 71 71 11090 1 . ALA 72 72 11090 1 . ILE 73 73 11090 1 . GLY 74 74 11090 1 . THR 75 75 11090 1 . LEU 76 76 11090 1 . ASN 77 77 11090 1 . VAL 78 78 11090 1 . GLY 79 79 11090 1 . GLU 80 80 11090 1 . SER 81 81 11090 1 . MET 82 82 11090 1 . GLN 83 83 11090 1 . LEU 84 84 11090 1 . GLU 85 85 11090 1 . VAL 86 86 11090 1 . GLU 87 87 11090 1 . PHE 88 88 11090 1 . GLU 89 89 11090 1 . PRO 90 90 11090 1 . GLN 91 91 11090 1 . SER 92 92 11090 1 . VAL 93 93 11090 1 . GLY 94 94 11090 1 . ASP 95 95 11090 1 . HIS 96 96 11090 1 . SER 97 97 11090 1 . GLY 98 98 11090 1 . ARG 99 99 11090 1 . LEU 100 100 11090 1 . ILE 101 101 11090 1 . VAL 102 102 11090 1 . CYS 103 103 11090 1 . TYR 104 104 11090 1 . ASP 105 105 11090 1 . THR 106 106 11090 1 . GLY 107 107 11090 1 . GLU 108 108 11090 1 . LYS 109 109 11090 1 . VAL 110 110 11090 1 . PHE 111 111 11090 1 . VAL 112 112 11090 1 . SER 113 113 11090 1 . LEU 114 114 11090 1 . TYR 115 115 11090 1 . GLY 116 116 11090 1 . ALA 117 117 11090 1 . ALA 118 118 11090 1 . ILE 119 119 11090 1 . ASP 120 120 11090 1 . MET 121 121 11090 1 . ASN 122 122 11090 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 11090 _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_1 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 11090 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 11090 _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_1 . 'Cell free synthesis' 'E. coli - cell free' 'E. coli' . 562 Escherichia coli . . . . . . . . . . . . . . . . P060327-16 . . . . . . 11090 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11090 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.19mM sample PapD-like domain [U-15N,13C], 20mM d-Tris-HCl, 100mM NaCl, 1mM d-DTT, 0.02% NaN3, 90% H2O, 10% D2O ; _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 'PapD-like, UNP residues 182-296' '[U-13C; U-15N]' . . 1 $entity_1 . protein 1.19 . . mM . . . . 11090 1 2 TRIS [U-2H] . . . . . buffer 20 . . mM . . . . 11090 1 3 'sodium chloride' 'natural abundance' . . . . . salt 100 . . mM . . . . 11090 1 4 DTT [U-2H] . . . . . salt 1 . . mM . . . . 11090 1 5 'sodium azide' 'natural abundance' . . . . . salt 0.02 . . % . . . . 11090 1 6 H2O . . . . . . solvent 90 . . % . . . . 11090 1 7 D2O . . . . . . solvent 10 . . % . . . . 11090 1 stop_ save_ ####################### # Sample conditions # ####################### save_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_1 _Sample_condition_list.Entry_ID 11090 _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 0.1 mM 11090 1 pH 7.0 0.05 pH 11090 1 pressure 1 0.001 atm 11090 1 temperature 296 0.1 K 11090 1 stop_ save_ ############################ # Computer software used # ############################ save_XWINNMR _Software.Sf_category software _Software.Sf_framecode XWINNMR _Software.Entry_ID 11090 _Software.ID 1 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 11090 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11090 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11090 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20031121 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F.' . . 11090 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11090 2 stop_ save_ save_NMRVIEW _Software.Sf_category software _Software.Sf_framecode NMRVIEW _Software.Entry_ID 11090 _Software.ID 3 _Software.Name NMRView _Software.Version 5.0.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, B.A.' . . 11090 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11090 3 stop_ save_ save_Kujira _Software.Sf_category software _Software.Sf_framecode Kujira _Software.Entry_ID 11090 _Software.ID 4 _Software.Name Kujira _Software.Version 0.9820 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 11090 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11090 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11090 _Software.ID 5 _Software.Name CYANA _Software.Version 2.0.17 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 11090 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 11090 5 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 11090 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 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 11090 _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 . 900 . . . 11090 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 11090 _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 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11090 1 2 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11090 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode reference_1 _Chem_shift_reference.Entry_ID 11090 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.784ppm at 298K) and then those of 15N and 13C were calculated based on their gyromagnetic ratios. ; loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 11090 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11090 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11090 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 11090 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $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 15N-separated NOESY' 1 $sample_1 isotropic 11090 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11090 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $XWINNMR . . 11090 1 2 $NMRPipe . . 11090 1 3 $NMRVIEW . . 11090 1 4 $Kujira . . 11090 1 5 $CYANA . . 11090 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 6 6 SER HA H 1 4.513 0.030 . 1 . . . . 6 SER HA . 11090 1 2 . 1 1 6 6 SER HB2 H 1 3.920 0.030 . 1 . . . . 6 SER HB2 . 11090 1 3 . 1 1 6 6 SER HB3 H 1 3.920 0.030 . 1 . . . . 6 SER HB3 . 11090 1 4 . 1 1 6 6 SER C C 13 175.126 0.300 . 1 . . . . 6 SER C . 11090 1 5 . 1 1 6 6 SER CA C 13 58.653 0.300 . 1 . . . . 6 SER CA . 11090 1 6 . 1 1 6 6 SER CB C 13 63.760 0.300 . 1 . . . . 6 SER CB . 11090 1 7 . 1 1 7 7 GLY H H 1 8.505 0.030 . 1 . . . . 7 GLY H . 11090 1 8 . 1 1 7 7 GLY HA2 H 1 4.057 0.030 . 1 . . . . 7 GLY HA2 . 11090 1 9 . 1 1 7 7 GLY HA3 H 1 4.057 0.030 . 1 . . . . 7 GLY HA3 . 11090 1 10 . 1 1 7 7 GLY C C 13 174.646 0.300 . 1 . . . . 7 GLY C . 11090 1 11 . 1 1 7 7 GLY CA C 13 45.541 0.300 . 1 . . . . 7 GLY CA . 11090 1 12 . 1 1 7 7 GLY N N 15 110.986 0.300 . 1 . . . . 7 GLY N . 11090 1 13 . 1 1 8 8 THR H H 1 8.089 0.030 . 1 . . . . 8 THR H . 11090 1 14 . 1 1 8 8 THR HA H 1 4.349 0.030 . 1 . . . . 8 THR HA . 11090 1 15 . 1 1 8 8 THR HB H 1 4.264 0.030 . 1 . . . . 8 THR HB . 11090 1 16 . 1 1 8 8 THR HG21 H 1 1.191 0.030 . 1 . . . . 8 THR HG2 . 11090 1 17 . 1 1 8 8 THR HG22 H 1 1.191 0.030 . 1 . . . . 8 THR HG2 . 11090 1 18 . 1 1 8 8 THR HG23 H 1 1.191 0.030 . 1 . . . . 8 THR HG2 . 11090 1 19 . 1 1 8 8 THR C C 13 174.956 0.300 . 1 . . . . 8 THR C . 11090 1 20 . 1 1 8 8 THR CA C 13 62.113 0.300 . 1 . . . . 8 THR CA . 11090 1 21 . 1 1 8 8 THR CB C 13 69.817 0.300 . 1 . . . . 8 THR CB . 11090 1 22 . 1 1 8 8 THR CG2 C 13 21.654 0.300 . 1 . . . . 8 THR CG2 . 11090 1 23 . 1 1 8 8 THR N N 15 113.187 0.300 . 1 . . . . 8 THR N . 11090 1 24 . 1 1 9 9 GLU H H 1 8.572 0.030 . 1 . . . . 9 GLU H . 11090 1 25 . 1 1 9 9 GLU HA H 1 4.265 0.030 . 1 . . . . 9 GLU HA . 11090 1 26 . 1 1 9 9 GLU HB2 H 1 2.063 0.030 . 2 . . . . 9 GLU HB2 . 11090 1 27 . 1 1 9 9 GLU HB3 H 1 1.982 0.030 . 2 . . . . 9 GLU HB3 . 11090 1 28 . 1 1 9 9 GLU HG2 H 1 2.296 0.030 . 2 . . . . 9 GLU HG2 . 11090 1 29 . 1 1 9 9 GLU HG3 H 1 2.270 0.030 . 2 . . . . 9 GLU HG3 . 11090 1 30 . 1 1 9 9 GLU C C 13 176.741 0.300 . 1 . . . . 9 GLU C . 11090 1 31 . 1 1 9 9 GLU CA C 13 57.125 0.300 . 1 . . . . 9 GLU CA . 11090 1 32 . 1 1 9 9 GLU CB C 13 29.874 0.300 . 1 . . . . 9 GLU CB . 11090 1 33 . 1 1 9 9 GLU CG C 13 36.454 0.300 . 1 . . . . 9 GLU CG . 11090 1 34 . 1 1 9 9 GLU N N 15 123.293 0.300 . 1 . . . . 9 GLU N . 11090 1 35 . 1 1 10 10 ARG H H 1 8.288 0.030 . 1 . . . . 10 ARG H . 11090 1 36 . 1 1 10 10 ARG HA H 1 4.284 0.030 . 1 . . . . 10 ARG HA . 11090 1 37 . 1 1 10 10 ARG HB2 H 1 1.781 0.030 . 2 . . . . 10 ARG HB2 . 11090 1 38 . 1 1 10 10 ARG HB3 H 1 1.869 0.030 . 2 . . . . 10 ARG HB3 . 11090 1 39 . 1 1 10 10 ARG HD2 H 1 3.200 0.030 . 1 . . . . 10 ARG HD2 . 11090 1 40 . 1 1 10 10 ARG HD3 H 1 3.200 0.030 . 1 . . . . 10 ARG HD3 . 11090 1 41 . 1 1 10 10 ARG HG2 H 1 1.639 0.030 . 1 . . . . 10 ARG HG2 . 11090 1 42 . 1 1 10 10 ARG HG3 H 1 1.639 0.030 . 1 . . . . 10 ARG HG3 . 11090 1 43 . 1 1 10 10 ARG C C 13 176.579 0.300 . 1 . . . . 10 ARG C . 11090 1 44 . 1 1 10 10 ARG CA C 13 56.317 0.300 . 1 . . . . 10 ARG CA . 11090 1 45 . 1 1 10 10 ARG CB C 13 30.911 0.300 . 1 . . . . 10 ARG CB . 11090 1 46 . 1 1 10 10 ARG CD C 13 43.375 0.300 . 1 . . . . 10 ARG CD . 11090 1 47 . 1 1 10 10 ARG CG C 13 27.077 0.300 . 1 . . . . 10 ARG CG . 11090 1 48 . 1 1 10 10 ARG N N 15 121.374 0.300 . 1 . . . . 10 ARG N . 11090 1 49 . 1 1 11 11 GLU H H 1 8.355 0.030 . 1 . . . . 11 GLU H . 11090 1 50 . 1 1 11 11 GLU HA H 1 4.180 0.030 . 1 . . . . 11 GLU HA . 11090 1 51 . 1 1 11 11 GLU HB2 H 1 1.973 0.030 . 2 . . . . 11 GLU HB2 . 11090 1 52 . 1 1 11 11 GLU HB3 H 1 1.930 0.030 . 2 . . . . 11 GLU HB3 . 11090 1 53 . 1 1 11 11 GLU HG2 H 1 2.222 0.030 . 1 . . . . 11 GLU HG2 . 11090 1 54 . 1 1 11 11 GLU HG3 H 1 2.222 0.030 . 1 . . . . 11 GLU HG3 . 11090 1 55 . 1 1 11 11 GLU C C 13 176.343 0.300 . 1 . . . . 11 GLU C . 11090 1 56 . 1 1 11 11 GLU CA C 13 56.888 0.300 . 1 . . . . 11 GLU CA . 11090 1 57 . 1 1 11 11 GLU CB C 13 29.997 0.300 . 1 . . . . 11 GLU CB . 11090 1 58 . 1 1 11 11 GLU CG C 13 36.371 0.300 . 1 . . . . 11 GLU CG . 11090 1 59 . 1 1 11 11 GLU N N 15 121.298 0.300 . 1 . . . . 11 GLU N . 11090 1 60 . 1 1 12 12 LYS H H 1 8.162 0.030 . 1 . . . . 12 LYS H . 11090 1 61 . 1 1 12 12 LYS HA H 1 4.220 0.030 . 1 . . . . 12 LYS HA . 11090 1 62 . 1 1 12 12 LYS HB2 H 1 1.669 0.030 . 1 . . . . 12 LYS HB2 . 11090 1 63 . 1 1 12 12 LYS HB3 H 1 1.669 0.030 . 1 . . . . 12 LYS HB3 . 11090 1 64 . 1 1 12 12 LYS HD2 H 1 1.622 0.030 . 1 . . . . 12 LYS HD2 . 11090 1 65 . 1 1 12 12 LYS HD3 H 1 1.622 0.030 . 1 . . . . 12 LYS HD3 . 11090 1 66 . 1 1 12 12 LYS HE2 H 1 2.956 0.030 . 1 . . . . 12 LYS HE2 . 11090 1 67 . 1 1 12 12 LYS HE3 H 1 2.956 0.030 . 1 . . . . 12 LYS HE3 . 11090 1 68 . 1 1 12 12 LYS HG2 H 1 1.279 0.030 . 2 . . . . 12 LYS HG2 . 11090 1 69 . 1 1 12 12 LYS HG3 H 1 1.348 0.030 . 2 . . . . 12 LYS HG3 . 11090 1 70 . 1 1 12 12 LYS C C 13 176.153 0.300 . 1 . . . . 12 LYS C . 11090 1 71 . 1 1 12 12 LYS CA C 13 56.430 0.300 . 1 . . . . 12 LYS CA . 11090 1 72 . 1 1 12 12 LYS CB C 13 33.070 0.300 . 1 . . . . 12 LYS CB . 11090 1 73 . 1 1 12 12 LYS CD C 13 29.114 0.300 . 1 . . . . 12 LYS CD . 11090 1 74 . 1 1 12 12 LYS CE C 13 42.046 0.300 . 1 . . . . 12 LYS CE . 11090 1 75 . 1 1 12 12 LYS CG C 13 24.732 0.300 . 1 . . . . 12 LYS CG . 11090 1 76 . 1 1 12 12 LYS N N 15 121.510 0.300 . 1 . . . . 12 LYS N . 11090 1 77 . 1 1 13 13 PHE H H 1 8.120 0.030 . 1 . . . . 13 PHE H . 11090 1 78 . 1 1 13 13 PHE HA H 1 4.642 0.030 . 1 . . . . 13 PHE HA . 11090 1 79 . 1 1 13 13 PHE HB2 H 1 3.111 0.030 . 2 . . . . 13 PHE HB2 . 11090 1 80 . 1 1 13 13 PHE HB3 H 1 2.990 0.030 . 2 . . . . 13 PHE HB3 . 11090 1 81 . 1 1 13 13 PHE HD1 H 1 7.223 0.030 . 1 . . . . 13 PHE HD1 . 11090 1 82 . 1 1 13 13 PHE HD2 H 1 7.223 0.030 . 1 . . . . 13 PHE HD2 . 11090 1 83 . 1 1 13 13 PHE C C 13 175.170 0.300 . 1 . . . . 13 PHE C . 11090 1 84 . 1 1 13 13 PHE CA C 13 57.436 0.300 . 1 . . . . 13 PHE CA . 11090 1 85 . 1 1 13 13 PHE CB C 13 39.619 0.300 . 1 . . . . 13 PHE CB . 11090 1 86 . 1 1 13 13 PHE CD1 C 13 131.852 0.300 . 1 . . . . 13 PHE CD1 . 11090 1 87 . 1 1 13 13 PHE CD2 C 13 131.852 0.300 . 1 . . . . 13 PHE CD2 . 11090 1 88 . 1 1 13 13 PHE N N 15 120.891 0.300 . 1 . . . . 13 PHE N . 11090 1 89 . 1 1 14 14 ILE H H 1 8.050 0.030 . 1 . . . . 14 ILE H . 11090 1 90 . 1 1 14 14 ILE HA H 1 4.129 0.030 . 1 . . . . 14 ILE HA . 11090 1 91 . 1 1 14 14 ILE HB H 1 1.770 0.030 . 1 . . . . 14 ILE HB . 11090 1 92 . 1 1 14 14 ILE HD11 H 1 0.824 0.030 . 1 . . . . 14 ILE HD1 . 11090 1 93 . 1 1 14 14 ILE HD12 H 1 0.824 0.030 . 1 . . . . 14 ILE HD1 . 11090 1 94 . 1 1 14 14 ILE HD13 H 1 0.824 0.030 . 1 . . . . 14 ILE HD1 . 11090 1 95 . 1 1 14 14 ILE HG12 H 1 1.134 0.030 . 2 . . . . 14 ILE HG12 . 11090 1 96 . 1 1 14 14 ILE HG13 H 1 1.443 0.030 . 2 . . . . 14 ILE HG13 . 11090 1 97 . 1 1 14 14 ILE HG21 H 1 0.819 0.030 . 1 . . . . 14 ILE HG2 . 11090 1 98 . 1 1 14 14 ILE HG22 H 1 0.819 0.030 . 1 . . . . 14 ILE HG2 . 11090 1 99 . 1 1 14 14 ILE HG23 H 1 0.819 0.030 . 1 . . . . 14 ILE HG2 . 11090 1 100 . 1 1 14 14 ILE C C 13 175.550 0.300 . 1 . . . . 14 ILE C . 11090 1 101 . 1 1 14 14 ILE CA C 13 60.648 0.300 . 1 . . . . 14 ILE CA . 11090 1 102 . 1 1 14 14 ILE CB C 13 38.716 0.300 . 1 . . . . 14 ILE CB . 11090 1 103 . 1 1 14 14 ILE CD1 C 13 12.700 0.300 . 1 . . . . 14 ILE CD1 . 11090 1 104 . 1 1 14 14 ILE CG1 C 13 27.221 0.300 . 1 . . . . 14 ILE CG1 . 11090 1 105 . 1 1 14 14 ILE CG2 C 13 17.414 0.300 . 1 . . . . 14 ILE CG2 . 11090 1 106 . 1 1 14 14 ILE N N 15 123.756 0.300 . 1 . . . . 14 ILE N . 11090 1 107 . 1 1 15 15 VAL H H 1 8.191 0.030 . 1 . . . . 15 VAL H . 11090 1 108 . 1 1 15 15 VAL HA H 1 4.320 0.030 . 1 . . . . 15 VAL HA . 11090 1 109 . 1 1 15 15 VAL HB H 1 2.047 0.030 . 1 . . . . 15 VAL HB . 11090 1 110 . 1 1 15 15 VAL HG11 H 1 0.980 0.030 . 1 . . . . 15 VAL HG1 . 11090 1 111 . 1 1 15 15 VAL HG12 H 1 0.980 0.030 . 1 . . . . 15 VAL HG1 . 11090 1 112 . 1 1 15 15 VAL HG13 H 1 0.980 0.030 . 1 . . . . 15 VAL HG1 . 11090 1 113 . 1 1 15 15 VAL HG21 H 1 0.980 0.030 . 1 . . . . 15 VAL HG2 . 11090 1 114 . 1 1 15 15 VAL HG22 H 1 0.980 0.030 . 1 . . . . 15 VAL HG2 . 11090 1 115 . 1 1 15 15 VAL HG23 H 1 0.980 0.030 . 1 . . . . 15 VAL HG2 . 11090 1 116 . 1 1 15 15 VAL C C 13 174.344 0.300 . 1 . . . . 15 VAL C . 11090 1 117 . 1 1 15 15 VAL CA C 13 60.030 0.300 . 1 . . . . 15 VAL CA . 11090 1 118 . 1 1 15 15 VAL CB C 13 32.593 0.300 . 1 . . . . 15 VAL CB . 11090 1 119 . 1 1 15 15 VAL CG1 C 13 20.919 0.300 . 2 . . . . 15 VAL CG1 . 11090 1 120 . 1 1 15 15 VAL CG2 C 13 20.919 0.300 . 2 . . . . 15 VAL CG2 . 11090 1 121 . 1 1 15 15 VAL N N 15 126.773 0.300 . 1 . . . . 15 VAL N . 11090 1 122 . 1 1 16 16 PRO HA H 1 4.410 0.030 . 1 . . . . 16 PRO HA . 11090 1 123 . 1 1 16 16 PRO HB2 H 1 2.280 0.030 . 2 . . . . 16 PRO HB2 . 11090 1 124 . 1 1 16 16 PRO HB3 H 1 1.871 0.030 . 2 . . . . 16 PRO HB3 . 11090 1 125 . 1 1 16 16 PRO HD2 H 1 3.710 0.030 . 2 . . . . 16 PRO HD2 . 11090 1 126 . 1 1 16 16 PRO HD3 H 1 3.919 0.030 . 2 . . . . 16 PRO HD3 . 11090 1 127 . 1 1 16 16 PRO HG2 H 1 2.051 0.030 . 2 . . . . 16 PRO HG2 . 11090 1 128 . 1 1 16 16 PRO HG3 H 1 1.990 0.030 . 2 . . . . 16 PRO HG3 . 11090 1 129 . 1 1 16 16 PRO C C 13 176.885 0.300 . 1 . . . . 16 PRO C . 11090 1 130 . 1 1 16 16 PRO CA C 13 63.065 0.300 . 1 . . . . 16 PRO CA . 11090 1 131 . 1 1 16 16 PRO CB C 13 32.188 0.300 . 1 . . . . 16 PRO CB . 11090 1 132 . 1 1 16 16 PRO CD C 13 51.105 0.300 . 1 . . . . 16 PRO CD . 11090 1 133 . 1 1 16 16 PRO CG C 13 27.470 0.300 . 1 . . . . 16 PRO CG . 11090 1 134 . 1 1 17 17 ILE H H 1 8.200 0.030 . 1 . . . . 17 ILE H . 11090 1 135 . 1 1 17 17 ILE HA H 1 4.064 0.030 . 1 . . . . 17 ILE HA . 11090 1 136 . 1 1 17 17 ILE HB H 1 1.820 0.030 . 1 . . . . 17 ILE HB . 11090 1 137 . 1 1 17 17 ILE HD11 H 1 0.870 0.030 . 1 . . . . 17 ILE HD1 . 11090 1 138 . 1 1 17 17 ILE HD12 H 1 0.870 0.030 . 1 . . . . 17 ILE HD1 . 11090 1 139 . 1 1 17 17 ILE HD13 H 1 0.870 0.030 . 1 . . . . 17 ILE HD1 . 11090 1 140 . 1 1 17 17 ILE HG12 H 1 1.208 0.030 . 2 . . . . 17 ILE HG12 . 11090 1 141 . 1 1 17 17 ILE HG13 H 1 1.508 0.030 . 2 . . . . 17 ILE HG13 . 11090 1 142 . 1 1 17 17 ILE HG21 H 1 0.910 0.030 . 1 . . . . 17 ILE HG2 . 11090 1 143 . 1 1 17 17 ILE HG22 H 1 0.910 0.030 . 1 . . . . 17 ILE HG2 . 11090 1 144 . 1 1 17 17 ILE HG23 H 1 0.910 0.030 . 1 . . . . 17 ILE HG2 . 11090 1 145 . 1 1 17 17 ILE C C 13 176.682 0.300 . 1 . . . . 17 ILE C . 11090 1 146 . 1 1 17 17 ILE CA C 13 61.582 0.300 . 1 . . . . 17 ILE CA . 11090 1 147 . 1 1 17 17 ILE CB C 13 38.755 0.300 . 1 . . . . 17 ILE CB . 11090 1 148 . 1 1 17 17 ILE CD1 C 13 13.001 0.300 . 1 . . . . 17 ILE CD1 . 11090 1 149 . 1 1 17 17 ILE CG1 C 13 27.653 0.300 . 1 . . . . 17 ILE CG1 . 11090 1 150 . 1 1 17 17 ILE CG2 C 13 17.535 0.300 . 1 . . . . 17 ILE CG2 . 11090 1 151 . 1 1 17 17 ILE N N 15 121.532 0.300 . 1 . . . . 17 ILE N . 11090 1 152 . 1 1 18 18 LYS H H 1 8.355 0.030 . 1 . . . . 18 LYS H . 11090 1 153 . 1 1 18 18 LYS HA H 1 4.289 0.030 . 1 . . . . 18 LYS HA . 11090 1 154 . 1 1 18 18 LYS HB2 H 1 1.740 0.030 . 2 . . . . 18 LYS HB2 . 11090 1 155 . 1 1 18 18 LYS HB3 H 1 1.811 0.030 . 2 . . . . 18 LYS HB3 . 11090 1 156 . 1 1 18 18 LYS HD2 H 1 1.679 0.030 . 1 . . . . 18 LYS HD2 . 11090 1 157 . 1 1 18 18 LYS HD3 H 1 1.679 0.030 . 1 . . . . 18 LYS HD3 . 11090 1 158 . 1 1 18 18 LYS HE2 H 1 2.991 0.030 . 1 . . . . 18 LYS HE2 . 11090 1 159 . 1 1 18 18 LYS HE3 H 1 2.991 0.030 . 1 . . . . 18 LYS HE3 . 11090 1 160 . 1 1 18 18 LYS HG2 H 1 1.449 0.030 . 2 . . . . 18 LYS HG2 . 11090 1 161 . 1 1 18 18 LYS HG3 H 1 1.400 0.030 . 2 . . . . 18 LYS HG3 . 11090 1 162 . 1 1 18 18 LYS C C 13 176.178 0.300 . 1 . . . . 18 LYS C . 11090 1 163 . 1 1 18 18 LYS CA C 13 56.364 0.300 . 1 . . . . 18 LYS CA . 11090 1 164 . 1 1 18 18 LYS CB C 13 32.960 0.300 . 1 . . . . 18 LYS CB . 11090 1 165 . 1 1 18 18 LYS CD C 13 29.216 0.300 . 1 . . . . 18 LYS CD . 11090 1 166 . 1 1 18 18 LYS CE C 13 42.129 0.300 . 1 . . . . 18 LYS CE . 11090 1 167 . 1 1 18 18 LYS CG C 13 24.857 0.300 . 1 . . . . 18 LYS CG . 11090 1 168 . 1 1 18 18 LYS N N 15 125.057 0.300 . 1 . . . . 18 LYS N . 11090 1 169 . 1 1 19 19 ALA H H 1 8.257 0.030 . 1 . . . . 19 ALA H . 11090 1 170 . 1 1 19 19 ALA HA H 1 4.302 0.030 . 1 . . . . 19 ALA HA . 11090 1 171 . 1 1 19 19 ALA HB1 H 1 1.381 0.030 . 1 . . . . 19 ALA HB . 11090 1 172 . 1 1 19 19 ALA HB2 H 1 1.381 0.030 . 1 . . . . 19 ALA HB . 11090 1 173 . 1 1 19 19 ALA HB3 H 1 1.381 0.030 . 1 . . . . 19 ALA HB . 11090 1 174 . 1 1 19 19 ALA C C 13 177.652 0.300 . 1 . . . . 19 ALA C . 11090 1 175 . 1 1 19 19 ALA CA C 13 52.450 0.300 . 1 . . . . 19 ALA CA . 11090 1 176 . 1 1 19 19 ALA CB C 13 19.264 0.300 . 1 . . . . 19 ALA CB . 11090 1 177 . 1 1 19 19 ALA N N 15 125.403 0.300 . 1 . . . . 19 ALA N . 11090 1 178 . 1 1 20 20 ARG H H 1 8.292 0.030 . 1 . . . . 20 ARG H . 11090 1 179 . 1 1 20 20 ARG HA H 1 4.289 0.030 . 1 . . . . 20 ARG HA . 11090 1 180 . 1 1 20 20 ARG HB2 H 1 1.871 0.030 . 2 . . . . 20 ARG HB2 . 11090 1 181 . 1 1 20 20 ARG HB3 H 1 1.780 0.030 . 2 . . . . 20 ARG HB3 . 11090 1 182 . 1 1 20 20 ARG HD2 H 1 3.200 0.030 . 1 . . . . 20 ARG HD2 . 11090 1 183 . 1 1 20 20 ARG HD3 H 1 3.200 0.030 . 1 . . . . 20 ARG HD3 . 11090 1 184 . 1 1 20 20 ARG HG2 H 1 1.698 0.030 . 2 . . . . 20 ARG HG2 . 11090 1 185 . 1 1 20 20 ARG HG3 H 1 1.631 0.030 . 2 . . . . 20 ARG HG3 . 11090 1 186 . 1 1 20 20 ARG C C 13 176.833 0.300 . 1 . . . . 20 ARG C . 11090 1 187 . 1 1 20 20 ARG CA C 13 56.341 0.300 . 1 . . . . 20 ARG CA . 11090 1 188 . 1 1 20 20 ARG CB C 13 30.891 0.300 . 1 . . . . 20 ARG CB . 11090 1 189 . 1 1 20 20 ARG CD C 13 43.459 0.300 . 1 . . . . 20 ARG CD . 11090 1 190 . 1 1 20 20 ARG CG C 13 27.160 0.300 . 1 . . . . 20 ARG CG . 11090 1 191 . 1 1 20 20 ARG N N 15 120.596 0.300 . 1 . . . . 20 ARG N . 11090 1 192 . 1 1 21 21 GLY H H 1 8.350 0.030 . 1 . . . . 21 GLY H . 11090 1 193 . 1 1 21 21 GLY HA2 H 1 3.931 0.030 . 1 . . . . 21 GLY HA2 . 11090 1 194 . 1 1 21 21 GLY HA3 H 1 3.931 0.030 . 1 . . . . 21 GLY HA3 . 11090 1 195 . 1 1 21 21 GLY C C 13 173.562 0.300 . 1 . . . . 21 GLY C . 11090 1 196 . 1 1 21 21 GLY CA C 13 45.065 0.300 . 1 . . . . 21 GLY CA . 11090 1 197 . 1 1 21 21 GLY N N 15 109.809 0.300 . 1 . . . . 21 GLY N . 11090 1 198 . 1 1 22 22 ALA H H 1 8.161 0.030 . 1 . . . . 22 ALA H . 11090 1 199 . 1 1 22 22 ALA HA H 1 4.440 0.030 . 1 . . . . 22 ALA HA . 11090 1 200 . 1 1 22 22 ALA HB1 H 1 1.271 0.030 . 1 . . . . 22 ALA HB . 11090 1 201 . 1 1 22 22 ALA HB2 H 1 1.271 0.030 . 1 . . . . 22 ALA HB . 11090 1 202 . 1 1 22 22 ALA HB3 H 1 1.271 0.030 . 1 . . . . 22 ALA HB . 11090 1 203 . 1 1 22 22 ALA C C 13 177.073 0.300 . 1 . . . . 22 ALA C . 11090 1 204 . 1 1 22 22 ALA CA C 13 52.194 0.300 . 1 . . . . 22 ALA CA . 11090 1 205 . 1 1 22 22 ALA CB C 13 19.264 0.300 . 1 . . . . 22 ALA CB . 11090 1 206 . 1 1 22 22 ALA N N 15 124.471 0.300 . 1 . . . . 22 ALA N . 11090 1 207 . 1 1 23 23 ARG H H 1 8.608 0.030 . 1 . . . . 23 ARG H . 11090 1 208 . 1 1 23 23 ARG HA H 1 4.419 0.030 . 1 . . . . 23 ARG HA . 11090 1 209 . 1 1 23 23 ARG HB2 H 1 1.690 0.030 . 2 . . . . 23 ARG HB2 . 11090 1 210 . 1 1 23 23 ARG HB3 H 1 1.819 0.030 . 2 . . . . 23 ARG HB3 . 11090 1 211 . 1 1 23 23 ARG HD2 H 1 3.143 0.030 . 1 . . . . 23 ARG HD2 . 11090 1 212 . 1 1 23 23 ARG HD3 H 1 3.143 0.030 . 1 . . . . 23 ARG HD3 . 11090 1 213 . 1 1 23 23 ARG HG2 H 1 1.590 0.030 . 2 . . . . 23 ARG HG2 . 11090 1 214 . 1 1 23 23 ARG HG3 H 1 1.499 0.030 . 2 . . . . 23 ARG HG3 . 11090 1 215 . 1 1 23 23 ARG C C 13 175.047 0.300 . 1 . . . . 23 ARG C . 11090 1 216 . 1 1 23 23 ARG CA C 13 55.353 0.300 . 1 . . . . 23 ARG CA . 11090 1 217 . 1 1 23 23 ARG CB C 13 32.597 0.300 . 1 . . . . 23 ARG CB . 11090 1 218 . 1 1 23 23 ARG CD C 13 43.618 0.300 . 1 . . . . 23 ARG CD . 11090 1 219 . 1 1 23 23 ARG CG C 13 26.337 0.300 . 1 . . . . 23 ARG CG . 11090 1 220 . 1 1 23 23 ARG N N 15 119.574 0.300 . 1 . . . . 23 ARG N . 11090 1 221 . 1 1 24 24 ALA H H 1 8.649 0.030 . 1 . . . . 24 ALA H . 11090 1 222 . 1 1 24 24 ALA HA H 1 4.351 0.030 . 1 . . . . 24 ALA HA . 11090 1 223 . 1 1 24 24 ALA HB1 H 1 1.070 0.030 . 1 . . . . 24 ALA HB . 11090 1 224 . 1 1 24 24 ALA HB2 H 1 1.070 0.030 . 1 . . . . 24 ALA HB . 11090 1 225 . 1 1 24 24 ALA HB3 H 1 1.070 0.030 . 1 . . . . 24 ALA HB . 11090 1 226 . 1 1 24 24 ALA C C 13 176.437 0.300 . 1 . . . . 24 ALA C . 11090 1 227 . 1 1 24 24 ALA CA C 13 52.265 0.300 . 1 . . . . 24 ALA CA . 11090 1 228 . 1 1 24 24 ALA CB C 13 19.644 0.300 . 1 . . . . 24 ALA CB . 11090 1 229 . 1 1 24 24 ALA N N 15 126.475 0.300 . 1 . . . . 24 ALA N . 11090 1 230 . 1 1 25 25 ILE H H 1 7.197 0.030 . 1 . . . . 25 ILE H . 11090 1 231 . 1 1 25 25 ILE HA H 1 4.010 0.030 . 1 . . . . 25 ILE HA . 11090 1 232 . 1 1 25 25 ILE HB H 1 1.448 0.030 . 1 . . . . 25 ILE HB . 11090 1 233 . 1 1 25 25 ILE HD11 H 1 0.719 0.030 . 1 . . . . 25 ILE HD1 . 11090 1 234 . 1 1 25 25 ILE HD12 H 1 0.719 0.030 . 1 . . . . 25 ILE HD1 . 11090 1 235 . 1 1 25 25 ILE HD13 H 1 0.719 0.030 . 1 . . . . 25 ILE HD1 . 11090 1 236 . 1 1 25 25 ILE HG12 H 1 1.348 0.030 . 2 . . . . 25 ILE HG12 . 11090 1 237 . 1 1 25 25 ILE HG13 H 1 0.829 0.030 . 2 . . . . 25 ILE HG13 . 11090 1 238 . 1 1 25 25 ILE HG21 H 1 0.701 0.030 . 1 . . . . 25 ILE HG2 . 11090 1 239 . 1 1 25 25 ILE HG22 H 1 0.701 0.030 . 1 . . . . 25 ILE HG2 . 11090 1 240 . 1 1 25 25 ILE HG23 H 1 0.701 0.030 . 1 . . . . 25 ILE HG2 . 11090 1 241 . 1 1 25 25 ILE C C 13 174.150 0.300 . 1 . . . . 25 ILE C . 11090 1 242 . 1 1 25 25 ILE CA C 13 61.971 0.300 . 1 . . . . 25 ILE CA . 11090 1 243 . 1 1 25 25 ILE CB C 13 41.107 0.300 . 1 . . . . 25 ILE CB . 11090 1 244 . 1 1 25 25 ILE CD1 C 13 13.572 0.300 . 1 . . . . 25 ILE CD1 . 11090 1 245 . 1 1 25 25 ILE CG1 C 13 26.955 0.300 . 1 . . . . 25 ILE CG1 . 11090 1 246 . 1 1 25 25 ILE CG2 C 13 17.312 0.300 . 1 . . . . 25 ILE CG2 . 11090 1 247 . 1 1 25 25 ILE N N 15 118.962 0.300 . 1 . . . . 25 ILE N . 11090 1 248 . 1 1 26 26 LEU H H 1 8.000 0.030 . 1 . . . . 26 LEU H . 11090 1 249 . 1 1 26 26 LEU HA H 1 5.270 0.030 . 1 . . . . 26 LEU HA . 11090 1 250 . 1 1 26 26 LEU HB2 H 1 1.728 0.030 . 2 . . . . 26 LEU HB2 . 11090 1 251 . 1 1 26 26 LEU HB3 H 1 0.849 0.030 . 2 . . . . 26 LEU HB3 . 11090 1 252 . 1 1 26 26 LEU HD11 H 1 0.483 0.030 . 1 . . . . 26 LEU HD1 . 11090 1 253 . 1 1 26 26 LEU HD12 H 1 0.483 0.030 . 1 . . . . 26 LEU HD1 . 11090 1 254 . 1 1 26 26 LEU HD13 H 1 0.483 0.030 . 1 . . . . 26 LEU HD1 . 11090 1 255 . 1 1 26 26 LEU HD21 H 1 0.485 0.030 . 1 . . . . 26 LEU HD2 . 11090 1 256 . 1 1 26 26 LEU HD22 H 1 0.485 0.030 . 1 . . . . 26 LEU HD2 . 11090 1 257 . 1 1 26 26 LEU HD23 H 1 0.485 0.030 . 1 . . . . 26 LEU HD2 . 11090 1 258 . 1 1 26 26 LEU HG H 1 1.462 0.030 . 1 . . . . 26 LEU HG . 11090 1 259 . 1 1 26 26 LEU C C 13 178.027 0.300 . 1 . . . . 26 LEU C . 11090 1 260 . 1 1 26 26 LEU CA C 13 53.006 0.300 . 1 . . . . 26 LEU CA . 11090 1 261 . 1 1 26 26 LEU CB C 13 42.293 0.300 . 1 . . . . 26 LEU CB . 11090 1 262 . 1 1 26 26 LEU CD1 C 13 24.883 0.300 . 2 . . . . 26 LEU CD1 . 11090 1 263 . 1 1 26 26 LEU CD2 C 13 23.704 0.300 . 2 . . . . 26 LEU CD2 . 11090 1 264 . 1 1 26 26 LEU CG C 13 29.242 0.300 . 1 . . . . 26 LEU CG . 11090 1 265 . 1 1 27 27 ASP H H 1 8.498 0.030 . 1 . . . . 27 ASP H . 11090 1 266 . 1 1 27 27 ASP HA H 1 4.550 0.030 . 1 . . . . 27 ASP HA . 11090 1 267 . 1 1 27 27 ASP HB2 H 1 2.789 0.030 . 2 . . . . 27 ASP HB2 . 11090 1 268 . 1 1 27 27 ASP HB3 H 1 2.290 0.030 . 2 . . . . 27 ASP HB3 . 11090 1 269 . 1 1 27 27 ASP C C 13 177.080 0.300 . 1 . . . . 27 ASP C . 11090 1 270 . 1 1 27 27 ASP CA C 13 53.553 0.300 . 1 . . . . 27 ASP CA . 11090 1 271 . 1 1 27 27 ASP CB C 13 38.921 0.300 . 1 . . . . 27 ASP CB . 11090 1 272 . 1 1 27 27 ASP N N 15 126.746 0.300 . 1 . . . . 27 ASP N . 11090 1 273 . 1 1 28 28 PHE H H 1 7.519 0.030 . 1 . . . . 28 PHE H . 11090 1 274 . 1 1 28 28 PHE HA H 1 4.203 0.030 . 1 . . . . 28 PHE HA . 11090 1 275 . 1 1 28 28 PHE HB2 H 1 3.041 0.030 . 2 . . . . 28 PHE HB2 . 11090 1 276 . 1 1 28 28 PHE HB3 H 1 2.543 0.030 . 2 . . . . 28 PHE HB3 . 11090 1 277 . 1 1 28 28 PHE HD1 H 1 6.910 0.030 . 1 . . . . 28 PHE HD1 . 11090 1 278 . 1 1 28 28 PHE HD2 H 1 6.910 0.030 . 1 . . . . 28 PHE HD2 . 11090 1 279 . 1 1 28 28 PHE HE1 H 1 6.844 0.030 . 1 . . . . 28 PHE HE1 . 11090 1 280 . 1 1 28 28 PHE HE2 H 1 6.844 0.030 . 1 . . . . 28 PHE HE2 . 11090 1 281 . 1 1 28 28 PHE HZ H 1 6.432 0.030 . 1 . . . . 28 PHE HZ . 11090 1 282 . 1 1 28 28 PHE C C 13 174.514 0.300 . 1 . . . . 28 PHE C . 11090 1 283 . 1 1 28 28 PHE CA C 13 58.291 0.300 . 1 . . . . 28 PHE CA . 11090 1 284 . 1 1 28 28 PHE CB C 13 39.413 0.300 . 1 . . . . 28 PHE CB . 11090 1 285 . 1 1 28 28 PHE CD1 C 13 131.123 0.300 . 1 . . . . 28 PHE CD1 . 11090 1 286 . 1 1 28 28 PHE CD2 C 13 131.123 0.300 . 1 . . . . 28 PHE CD2 . 11090 1 287 . 1 1 28 28 PHE CE1 C 13 131.659 0.300 . 1 . . . . 28 PHE CE1 . 11090 1 288 . 1 1 28 28 PHE CE2 C 13 131.659 0.300 . 1 . . . . 28 PHE CE2 . 11090 1 289 . 1 1 28 28 PHE CZ C 13 128.909 0.300 . 1 . . . . 28 PHE CZ . 11090 1 290 . 1 1 28 28 PHE N N 15 119.825 0.300 . 1 . . . . 28 PHE N . 11090 1 291 . 1 1 29 29 PRO HA H 1 4.754 0.030 . 1 . . . . 29 PRO HA . 11090 1 292 . 1 1 29 29 PRO HB2 H 1 2.401 0.030 . 2 . . . . 29 PRO HB2 . 11090 1 293 . 1 1 29 29 PRO HB3 H 1 2.210 0.030 . 2 . . . . 29 PRO HB3 . 11090 1 294 . 1 1 29 29 PRO HD2 H 1 3.500 0.030 . 2 . . . . 29 PRO HD2 . 11090 1 295 . 1 1 29 29 PRO HD3 H 1 4.010 0.030 . 2 . . . . 29 PRO HD3 . 11090 1 296 . 1 1 29 29 PRO HG2 H 1 1.751 0.030 . 2 . . . . 29 PRO HG2 . 11090 1 297 . 1 1 29 29 PRO HG3 H 1 2.112 0.030 . 2 . . . . 29 PRO HG3 . 11090 1 298 . 1 1 29 29 PRO C C 13 175.092 0.300 . 1 . . . . 29 PRO C . 11090 1 299 . 1 1 29 29 PRO CA C 13 62.112 0.300 . 1 . . . . 29 PRO CA . 11090 1 300 . 1 1 29 29 PRO CB C 13 32.249 0.300 . 1 . . . . 29 PRO CB . 11090 1 301 . 1 1 29 29 PRO CD C 13 49.629 0.300 . 1 . . . . 29 PRO CD . 11090 1 302 . 1 1 29 29 PRO CG C 13 26.464 0.300 . 1 . . . . 29 PRO CG . 11090 1 303 . 1 1 30 30 ASP H H 1 8.549 0.030 . 1 . . . . 30 ASP H . 11090 1 304 . 1 1 30 30 ASP HA H 1 4.580 0.030 . 1 . . . . 30 ASP HA . 11090 1 305 . 1 1 30 30 ASP HB2 H 1 2.768 0.030 . 2 . . . . 30 ASP HB2 . 11090 1 306 . 1 1 30 30 ASP HB3 H 1 2.747 0.030 . 2 . . . . 30 ASP HB3 . 11090 1 307 . 1 1 30 30 ASP C C 13 176.850 0.300 . 1 . . . . 30 ASP C . 11090 1 308 . 1 1 30 30 ASP CA C 13 56.165 0.300 . 1 . . . . 30 ASP CA . 11090 1 309 . 1 1 30 30 ASP CB C 13 40.854 0.300 . 1 . . . . 30 ASP CB . 11090 1 310 . 1 1 30 30 ASP N N 15 116.326 0.300 . 1 . . . . 30 ASP N . 11090 1 311 . 1 1 31 31 LYS H H 1 7.621 0.030 . 1 . . . . 31 LYS H . 11090 1 312 . 1 1 31 31 LYS HA H 1 5.400 0.030 . 1 . . . . 31 LYS HA . 11090 1 313 . 1 1 31 31 LYS HB2 H 1 1.840 0.030 . 2 . . . . 31 LYS HB2 . 11090 1 314 . 1 1 31 31 LYS HB3 H 1 1.640 0.030 . 2 . . . . 31 LYS HB3 . 11090 1 315 . 1 1 31 31 LYS HD2 H 1 1.623 0.030 . 1 . . . . 31 LYS HD2 . 11090 1 316 . 1 1 31 31 LYS HD3 H 1 1.623 0.030 . 1 . . . . 31 LYS HD3 . 11090 1 317 . 1 1 31 31 LYS HE2 H 1 2.954 0.030 . 1 . . . . 31 LYS HE2 . 11090 1 318 . 1 1 31 31 LYS HE3 H 1 2.954 0.030 . 1 . . . . 31 LYS HE3 . 11090 1 319 . 1 1 31 31 LYS HG2 H 1 1.208 0.030 . 2 . . . . 31 LYS HG2 . 11090 1 320 . 1 1 31 31 LYS HG3 H 1 1.383 0.030 . 2 . . . . 31 LYS HG3 . 11090 1 321 . 1 1 31 31 LYS C C 13 173.862 0.300 . 1 . . . . 31 LYS C . 11090 1 322 . 1 1 31 31 LYS CA C 13 54.047 0.300 . 1 . . . . 31 LYS CA . 11090 1 323 . 1 1 31 31 LYS CB C 13 36.282 0.300 . 1 . . . . 31 LYS CB . 11090 1 324 . 1 1 31 31 LYS CD C 13 29.847 0.300 . 1 . . . . 31 LYS CD . 11090 1 325 . 1 1 31 31 LYS CE C 13 42.129 0.300 . 1 . . . . 31 LYS CE . 11090 1 326 . 1 1 31 31 LYS CG C 13 23.614 0.300 . 1 . . . . 31 LYS CG . 11090 1 327 . 1 1 31 31 LYS N N 15 115.769 0.300 . 1 . . . . 31 LYS N . 11090 1 328 . 1 1 32 32 LEU H H 1 8.640 0.030 . 1 . . . . 32 LEU H . 11090 1 329 . 1 1 32 32 LEU HA H 1 4.393 0.030 . 1 . . . . 32 LEU HA . 11090 1 330 . 1 1 32 32 LEU HB2 H 1 1.178 0.030 . 2 . . . . 32 LEU HB2 . 11090 1 331 . 1 1 32 32 LEU HB3 H 1 1.271 0.030 . 2 . . . . 32 LEU HB3 . 11090 1 332 . 1 1 32 32 LEU HD11 H 1 0.597 0.030 . 1 . . . . 32 LEU HD1 . 11090 1 333 . 1 1 32 32 LEU HD12 H 1 0.597 0.030 . 1 . . . . 32 LEU HD1 . 11090 1 334 . 1 1 32 32 LEU HD13 H 1 0.597 0.030 . 1 . . . . 32 LEU HD1 . 11090 1 335 . 1 1 32 32 LEU HD21 H 1 0.677 0.030 . 1 . . . . 32 LEU HD2 . 11090 1 336 . 1 1 32 32 LEU HD22 H 1 0.677 0.030 . 1 . . . . 32 LEU HD2 . 11090 1 337 . 1 1 32 32 LEU HD23 H 1 0.677 0.030 . 1 . . . . 32 LEU HD2 . 11090 1 338 . 1 1 32 32 LEU HG H 1 1.131 0.030 . 1 . . . . 32 LEU HG . 11090 1 339 . 1 1 32 32 LEU C C 13 173.520 0.300 . 1 . . . . 32 LEU C . 11090 1 340 . 1 1 32 32 LEU CA C 13 54.526 0.300 . 1 . . . . 32 LEU CA . 11090 1 341 . 1 1 32 32 LEU CB C 13 45.445 0.300 . 1 . . . . 32 LEU CB . 11090 1 342 . 1 1 32 32 LEU CD1 C 13 25.173 0.300 . 2 . . . . 32 LEU CD1 . 11090 1 343 . 1 1 32 32 LEU CD2 C 13 24.838 0.300 . 2 . . . . 32 LEU CD2 . 11090 1 344 . 1 1 32 32 LEU CG C 13 26.946 0.300 . 1 . . . . 32 LEU CG . 11090 1 345 . 1 1 32 32 LEU N N 15 121.579 0.300 . 1 . . . . 32 LEU N . 11090 1 346 . 1 1 33 33 ASN H H 1 8.700 0.030 . 1 . . . . 33 ASN H . 11090 1 347 . 1 1 33 33 ASN HA H 1 5.399 0.030 . 1 . . . . 33 ASN HA . 11090 1 348 . 1 1 33 33 ASN HB2 H 1 2.890 0.030 . 2 . . . . 33 ASN HB2 . 11090 1 349 . 1 1 33 33 ASN HB3 H 1 2.519 0.030 . 2 . . . . 33 ASN HB3 . 11090 1 350 . 1 1 33 33 ASN HD21 H 1 6.790 0.030 . 2 . . . . 33 ASN HD21 . 11090 1 351 . 1 1 33 33 ASN HD22 H 1 7.588 0.030 . 2 . . . . 33 ASN HD22 . 11090 1 352 . 1 1 33 33 ASN C C 13 175.497 0.300 . 1 . . . . 33 ASN C . 11090 1 353 . 1 1 33 33 ASN CA C 13 51.489 0.300 . 1 . . . . 33 ASN CA . 11090 1 354 . 1 1 33 33 ASN CB C 13 40.401 0.300 . 1 . . . . 33 ASN CB . 11090 1 355 . 1 1 33 33 ASN N N 15 122.982 0.300 . 1 . . . . 33 ASN N . 11090 1 356 . 1 1 33 33 ASN ND2 N 15 112.009 0.300 . 1 . . . . 33 ASN ND2 . 11090 1 357 . 1 1 34 34 PHE H H 1 9.631 0.030 . 1 . . . . 34 PHE H . 11090 1 358 . 1 1 34 34 PHE HA H 1 4.090 0.030 . 1 . . . . 34 PHE HA . 11090 1 359 . 1 1 34 34 PHE HB2 H 1 3.369 0.030 . 2 . . . . 34 PHE HB2 . 11090 1 360 . 1 1 34 34 PHE HB3 H 1 2.781 0.030 . 2 . . . . 34 PHE HB3 . 11090 1 361 . 1 1 34 34 PHE HD1 H 1 7.288 0.030 . 1 . . . . 34 PHE HD1 . 11090 1 362 . 1 1 34 34 PHE HD2 H 1 7.288 0.030 . 1 . . . . 34 PHE HD2 . 11090 1 363 . 1 1 34 34 PHE HE1 H 1 7.181 0.030 . 1 . . . . 34 PHE HE1 . 11090 1 364 . 1 1 34 34 PHE HE2 H 1 7.181 0.030 . 1 . . . . 34 PHE HE2 . 11090 1 365 . 1 1 34 34 PHE HZ H 1 7.076 0.030 . 1 . . . . 34 PHE HZ . 11090 1 366 . 1 1 34 34 PHE C C 13 175.558 0.300 . 1 . . . . 34 PHE C . 11090 1 367 . 1 1 34 34 PHE CA C 13 59.482 0.300 . 1 . . . . 34 PHE CA . 11090 1 368 . 1 1 34 34 PHE CB C 13 40.176 0.300 . 1 . . . . 34 PHE CB . 11090 1 369 . 1 1 34 34 PHE CD1 C 13 131.651 0.300 . 1 . . . . 34 PHE CD1 . 11090 1 370 . 1 1 34 34 PHE CD2 C 13 131.651 0.300 . 1 . . . . 34 PHE CD2 . 11090 1 371 . 1 1 34 34 PHE CE1 C 13 131.525 0.300 . 1 . . . . 34 PHE CE1 . 11090 1 372 . 1 1 34 34 PHE CE2 C 13 131.525 0.300 . 1 . . . . 34 PHE CE2 . 11090 1 373 . 1 1 34 34 PHE CZ C 13 128.759 0.300 . 1 . . . . 34 PHE CZ . 11090 1 374 . 1 1 34 34 PHE N N 15 124.038 0.300 . 1 . . . . 34 PHE N . 11090 1 375 . 1 1 35 35 SER H H 1 8.820 0.030 . 1 . . . . 35 SER H . 11090 1 376 . 1 1 35 35 SER HA H 1 4.140 0.030 . 1 . . . . 35 SER HA . 11090 1 377 . 1 1 35 35 SER HB2 H 1 4.339 0.030 . 2 . . . . 35 SER HB2 . 11090 1 378 . 1 1 35 35 SER HB3 H 1 3.911 0.030 . 2 . . . . 35 SER HB3 . 11090 1 379 . 1 1 35 35 SER C C 13 173.535 0.300 . 1 . . . . 35 SER C . 11090 1 380 . 1 1 35 35 SER CA C 13 58.477 0.300 . 1 . . . . 35 SER CA . 11090 1 381 . 1 1 35 35 SER CB C 13 62.786 0.300 . 1 . . . . 35 SER CB . 11090 1 382 . 1 1 35 35 SER N N 15 114.893 0.300 . 1 . . . . 35 SER N . 11090 1 383 . 1 1 36 36 THR H H 1 8.261 0.030 . 1 . . . . 36 THR H . 11090 1 384 . 1 1 36 36 THR HA H 1 4.769 0.030 . 1 . . . . 36 THR HA . 11090 1 385 . 1 1 36 36 THR HB H 1 4.058 0.030 . 1 . . . . 36 THR HB . 11090 1 386 . 1 1 36 36 THR HG21 H 1 1.172 0.030 . 1 . . . . 36 THR HG2 . 11090 1 387 . 1 1 36 36 THR HG22 H 1 1.172 0.030 . 1 . . . . 36 THR HG2 . 11090 1 388 . 1 1 36 36 THR HG23 H 1 1.172 0.030 . 1 . . . . 36 THR HG2 . 11090 1 389 . 1 1 36 36 THR C C 13 175.049 0.300 . 1 . . . . 36 THR C . 11090 1 390 . 1 1 36 36 THR CA C 13 63.223 0.300 . 1 . . . . 36 THR CA . 11090 1 391 . 1 1 36 36 THR CB C 13 69.059 0.300 . 1 . . . . 36 THR CB . 11090 1 392 . 1 1 36 36 THR CG2 C 13 23.025 0.300 . 1 . . . . 36 THR CG2 . 11090 1 393 . 1 1 36 36 THR N N 15 117.327 0.300 . 1 . . . . 36 THR N . 11090 1 394 . 1 1 37 37 CYS H H 1 9.210 0.030 . 1 . . . . 37 CYS H . 11090 1 395 . 1 1 37 37 CYS HA H 1 5.100 0.030 . 1 . . . . 37 CYS HA . 11090 1 396 . 1 1 37 37 CYS HB2 H 1 2.750 0.030 . 2 . . . . 37 CYS HB2 . 11090 1 397 . 1 1 37 37 CYS HB3 H 1 3.030 0.030 . 2 . . . . 37 CYS HB3 . 11090 1 398 . 1 1 37 37 CYS C C 13 171.364 0.300 . 1 . . . . 37 CYS C . 11090 1 399 . 1 1 37 37 CYS CA C 13 56.494 0.300 . 1 . . . . 37 CYS CA . 11090 1 400 . 1 1 37 37 CYS CB C 13 31.251 0.300 . 1 . . . . 37 CYS CB . 11090 1 401 . 1 1 37 37 CYS N N 15 127.526 0.300 . 1 . . . . 37 CYS N . 11090 1 402 . 1 1 38 38 PRO HA H 1 4.769 0.030 . 1 . . . . 38 PRO HA . 11090 1 403 . 1 1 38 38 PRO HB2 H 1 2.159 0.030 . 2 . . . . 38 PRO HB2 . 11090 1 404 . 1 1 38 38 PRO HB3 H 1 1.713 0.030 . 2 . . . . 38 PRO HB3 . 11090 1 405 . 1 1 38 38 PRO HD2 H 1 3.551 0.030 . 2 . . . . 38 PRO HD2 . 11090 1 406 . 1 1 38 38 PRO HD3 H 1 3.785 0.030 . 2 . . . . 38 PRO HD3 . 11090 1 407 . 1 1 38 38 PRO HG2 H 1 1.760 0.030 . 1 . . . . 38 PRO HG2 . 11090 1 408 . 1 1 38 38 PRO HG3 H 1 1.760 0.030 . 1 . . . . 38 PRO HG3 . 11090 1 409 . 1 1 38 38 PRO CA C 13 61.961 0.300 . 1 . . . . 38 PRO CA . 11090 1 410 . 1 1 38 38 PRO CB C 13 31.799 0.300 . 1 . . . . 38 PRO CB . 11090 1 411 . 1 1 38 38 PRO CD C 13 50.871 0.300 . 1 . . . . 38 PRO CD . 11090 1 412 . 1 1 38 38 PRO CG C 13 27.712 0.300 . 1 . . . . 38 PRO CG . 11090 1 413 . 1 1 39 39 VAL H H 1 8.226 0.030 . 1 . . . . 39 VAL H . 11090 1 414 . 1 1 39 39 VAL HA H 1 3.551 0.030 . 1 . . . . 39 VAL HA . 11090 1 415 . 1 1 39 39 VAL HB H 1 1.611 0.030 . 1 . . . . 39 VAL HB . 11090 1 416 . 1 1 39 39 VAL HG11 H 1 0.771 0.030 . 1 . . . . 39 VAL HG1 . 11090 1 417 . 1 1 39 39 VAL HG12 H 1 0.771 0.030 . 1 . . . . 39 VAL HG1 . 11090 1 418 . 1 1 39 39 VAL HG13 H 1 0.771 0.030 . 1 . . . . 39 VAL HG1 . 11090 1 419 . 1 1 39 39 VAL HG21 H 1 0.662 0.030 . 1 . . . . 39 VAL HG2 . 11090 1 420 . 1 1 39 39 VAL HG22 H 1 0.662 0.030 . 1 . . . . 39 VAL HG2 . 11090 1 421 . 1 1 39 39 VAL HG23 H 1 0.662 0.030 . 1 . . . . 39 VAL HG2 . 11090 1 422 . 1 1 39 39 VAL C C 13 174.038 0.300 . 1 . . . . 39 VAL C . 11090 1 423 . 1 1 39 39 VAL CA C 13 62.849 0.300 . 1 . . . . 39 VAL CA . 11090 1 424 . 1 1 39 39 VAL CB C 13 32.381 0.300 . 1 . . . . 39 VAL CB . 11090 1 425 . 1 1 39 39 VAL CG1 C 13 20.390 0.300 . 2 . . . . 39 VAL CG1 . 11090 1 426 . 1 1 39 39 VAL CG2 C 13 21.728 0.300 . 2 . . . . 39 VAL CG2 . 11090 1 427 . 1 1 39 39 VAL N N 15 121.335 0.300 . 1 . . . . 39 VAL N . 11090 1 428 . 1 1 40 40 LYS H H 1 8.370 0.030 . 1 . . . . 40 LYS H . 11090 1 429 . 1 1 40 40 LYS HA H 1 3.496 0.030 . 1 . . . . 40 LYS HA . 11090 1 430 . 1 1 40 40 LYS HB2 H 1 2.039 0.030 . 2 . . . . 40 LYS HB2 . 11090 1 431 . 1 1 40 40 LYS HB3 H 1 1.880 0.030 . 2 . . . . 40 LYS HB3 . 11090 1 432 . 1 1 40 40 LYS HD2 H 1 1.650 0.030 . 2 . . . . 40 LYS HD2 . 11090 1 433 . 1 1 40 40 LYS HD3 H 1 1.601 0.030 . 2 . . . . 40 LYS HD3 . 11090 1 434 . 1 1 40 40 LYS HE2 H 1 2.954 0.030 . 1 . . . . 40 LYS HE2 . 11090 1 435 . 1 1 40 40 LYS HE3 H 1 2.954 0.030 . 1 . . . . 40 LYS HE3 . 11090 1 436 . 1 1 40 40 LYS HG2 H 1 1.300 0.030 . 1 . . . . 40 LYS HG2 . 11090 1 437 . 1 1 40 40 LYS HG3 H 1 1.300 0.030 . 1 . . . . 40 LYS HG3 . 11090 1 438 . 1 1 40 40 LYS C C 13 174.674 0.300 . 1 . . . . 40 LYS C . 11090 1 439 . 1 1 40 40 LYS CA C 13 58.980 0.300 . 1 . . . . 40 LYS CA . 11090 1 440 . 1 1 40 40 LYS CB C 13 29.421 0.300 . 1 . . . . 40 LYS CB . 11090 1 441 . 1 1 40 40 LYS CD C 13 29.185 0.300 . 1 . . . . 40 LYS CD . 11090 1 442 . 1 1 40 40 LYS CE C 13 42.375 0.300 . 1 . . . . 40 LYS CE . 11090 1 443 . 1 1 40 40 LYS CG C 13 26.666 0.300 . 1 . . . . 40 LYS CG . 11090 1 444 . 1 1 40 40 LYS N N 15 116.779 0.300 . 1 . . . . 40 LYS N . 11090 1 445 . 1 1 41 41 TYR H H 1 7.418 0.030 . 1 . . . . 41 TYR H . 11090 1 446 . 1 1 41 41 TYR HA H 1 4.511 0.030 . 1 . . . . 41 TYR HA . 11090 1 447 . 1 1 41 41 TYR HB2 H 1 2.848 0.030 . 2 . . . . 41 TYR HB2 . 11090 1 448 . 1 1 41 41 TYR HB3 H 1 2.802 0.030 . 2 . . . . 41 TYR HB3 . 11090 1 449 . 1 1 41 41 TYR HD1 H 1 7.140 0.030 . 1 . . . . 41 TYR HD1 . 11090 1 450 . 1 1 41 41 TYR HD2 H 1 7.140 0.030 . 1 . . . . 41 TYR HD2 . 11090 1 451 . 1 1 41 41 TYR HE1 H 1 6.839 0.030 . 1 . . . . 41 TYR HE1 . 11090 1 452 . 1 1 41 41 TYR HE2 H 1 6.839 0.030 . 1 . . . . 41 TYR HE2 . 11090 1 453 . 1 1 41 41 TYR C C 13 173.851 0.300 . 1 . . . . 41 TYR C . 11090 1 454 . 1 1 41 41 TYR CA C 13 57.030 0.300 . 1 . . . . 41 TYR CA . 11090 1 455 . 1 1 41 41 TYR CB C 13 41.051 0.300 . 1 . . . . 41 TYR CB . 11090 1 456 . 1 1 41 41 TYR CD1 C 13 133.435 0.300 . 1 . . . . 41 TYR CD1 . 11090 1 457 . 1 1 41 41 TYR CD2 C 13 133.435 0.300 . 1 . . . . 41 TYR CD2 . 11090 1 458 . 1 1 41 41 TYR CE1 C 13 118.247 0.300 . 1 . . . . 41 TYR CE1 . 11090 1 459 . 1 1 41 41 TYR CE2 C 13 118.247 0.300 . 1 . . . . 41 TYR CE2 . 11090 1 460 . 1 1 41 41 TYR N N 15 118.993 0.300 . 1 . . . . 41 TYR N . 11090 1 461 . 1 1 42 42 SER H H 1 7.953 0.030 . 1 . . . . 42 SER H . 11090 1 462 . 1 1 42 42 SER HA H 1 5.010 0.030 . 1 . . . . 42 SER HA . 11090 1 463 . 1 1 42 42 SER HB2 H 1 3.548 0.030 . 2 . . . . 42 SER HB2 . 11090 1 464 . 1 1 42 42 SER HB3 H 1 3.505 0.030 . 2 . . . . 42 SER HB3 . 11090 1 465 . 1 1 42 42 SER C C 13 174.177 0.300 . 1 . . . . 42 SER C . 11090 1 466 . 1 1 42 42 SER CA C 13 56.853 0.300 . 1 . . . . 42 SER CA . 11090 1 467 . 1 1 42 42 SER CB C 13 64.081 0.300 . 1 . . . . 42 SER CB . 11090 1 468 . 1 1 42 42 SER N N 15 117.043 0.300 . 1 . . . . 42 SER N . 11090 1 469 . 1 1 43 43 THR H H 1 8.891 0.030 . 1 . . . . 43 THR H . 11090 1 470 . 1 1 43 43 THR HA H 1 4.648 0.030 . 1 . . . . 43 THR HA . 11090 1 471 . 1 1 43 43 THR HB H 1 4.329 0.030 . 1 . . . . 43 THR HB . 11090 1 472 . 1 1 43 43 THR HG21 H 1 1.730 0.030 . 1 . . . . 43 THR HG2 . 11090 1 473 . 1 1 43 43 THR HG22 H 1 1.730 0.030 . 1 . . . . 43 THR HG2 . 11090 1 474 . 1 1 43 43 THR HG23 H 1 1.730 0.030 . 1 . . . . 43 THR HG2 . 11090 1 475 . 1 1 43 43 THR C C 13 172.717 0.300 . 1 . . . . 43 THR C . 11090 1 476 . 1 1 43 43 THR CA C 13 62.606 0.300 . 1 . . . . 43 THR CA . 11090 1 477 . 1 1 43 43 THR CB C 13 70.705 0.300 . 1 . . . . 43 THR CB . 11090 1 478 . 1 1 43 43 THR CG2 C 13 21.876 0.300 . 1 . . . . 43 THR CG2 . 11090 1 479 . 1 1 43 43 THR N N 15 122.297 0.300 . 1 . . . . 43 THR N . 11090 1 480 . 1 1 44 44 GLN H H 1 8.623 0.030 . 1 . . . . 44 GLN H . 11090 1 481 . 1 1 44 44 GLN HA H 1 5.660 0.030 . 1 . . . . 44 GLN HA . 11090 1 482 . 1 1 44 44 GLN HB2 H 1 2.025 0.030 . 2 . . . . 44 GLN HB2 . 11090 1 483 . 1 1 44 44 GLN HB3 H 1 2.140 0.030 . 2 . . . . 44 GLN HB3 . 11090 1 484 . 1 1 44 44 GLN HE21 H 1 7.898 0.030 . 2 . . . . 44 GLN HE21 . 11090 1 485 . 1 1 44 44 GLN HE22 H 1 6.591 0.030 . 2 . . . . 44 GLN HE22 . 11090 1 486 . 1 1 44 44 GLN HG2 H 1 2.250 0.030 . 2 . . . . 44 GLN HG2 . 11090 1 487 . 1 1 44 44 GLN HG3 H 1 2.173 0.030 . 2 . . . . 44 GLN HG3 . 11090 1 488 . 1 1 44 44 GLN C C 13 175.699 0.300 . 1 . . . . 44 GLN C . 11090 1 489 . 1 1 44 44 GLN CA C 13 54.965 0.300 . 1 . . . . 44 GLN CA . 11090 1 490 . 1 1 44 44 GLN CB C 13 32.917 0.300 . 1 . . . . 44 GLN CB . 11090 1 491 . 1 1 44 44 GLN CG C 13 34.726 0.300 . 1 . . . . 44 GLN CG . 11090 1 492 . 1 1 44 44 GLN N N 15 124.814 0.300 . 1 . . . . 44 GLN N . 11090 1 493 . 1 1 44 44 GLN NE2 N 15 112.250 0.300 . 1 . . . . 44 GLN NE2 . 11090 1 494 . 1 1 45 45 LYS H H 1 9.580 0.030 . 1 . . . . 45 LYS H . 11090 1 495 . 1 1 45 45 LYS HA H 1 4.647 0.030 . 1 . . . . 45 LYS HA . 11090 1 496 . 1 1 45 45 LYS HB2 H 1 1.549 0.030 . 2 . . . . 45 LYS HB2 . 11090 1 497 . 1 1 45 45 LYS HB3 H 1 1.302 0.030 . 2 . . . . 45 LYS HB3 . 11090 1 498 . 1 1 45 45 LYS HD2 H 1 1.192 0.030 . 2 . . . . 45 LYS HD2 . 11090 1 499 . 1 1 45 45 LYS HD3 H 1 1.270 0.030 . 2 . . . . 45 LYS HD3 . 11090 1 500 . 1 1 45 45 LYS HE2 H 1 2.602 0.030 . 2 . . . . 45 LYS HE2 . 11090 1 501 . 1 1 45 45 LYS HE3 H 1 2.741 0.030 . 2 . . . . 45 LYS HE3 . 11090 1 502 . 1 1 45 45 LYS HG2 H 1 1.211 0.030 . 2 . . . . 45 LYS HG2 . 11090 1 503 . 1 1 45 45 LYS HG3 H 1 1.006 0.030 . 2 . . . . 45 LYS HG3 . 11090 1 504 . 1 1 45 45 LYS C C 13 174.278 0.300 . 1 . . . . 45 LYS C . 11090 1 505 . 1 1 45 45 LYS CA C 13 55.088 0.300 . 1 . . . . 45 LYS CA . 11090 1 506 . 1 1 45 45 LYS CB C 13 36.375 0.300 . 1 . . . . 45 LYS CB . 11090 1 507 . 1 1 45 45 LYS CD C 13 28.558 0.300 . 1 . . . . 45 LYS CD . 11090 1 508 . 1 1 45 45 LYS CE C 13 41.553 0.300 . 1 . . . . 45 LYS CE . 11090 1 509 . 1 1 45 45 LYS CG C 13 24.965 0.300 . 1 . . . . 45 LYS CG . 11090 1 510 . 1 1 45 45 LYS N N 15 124.436 0.300 . 1 . . . . 45 LYS N . 11090 1 511 . 1 1 46 46 ILE H H 1 8.490 0.030 . 1 . . . . 46 ILE H . 11090 1 512 . 1 1 46 46 ILE HA H 1 4.847 0.030 . 1 . . . . 46 ILE HA . 11090 1 513 . 1 1 46 46 ILE HB H 1 1.801 0.030 . 1 . . . . 46 ILE HB . 11090 1 514 . 1 1 46 46 ILE HD11 H 1 0.814 0.030 . 1 . . . . 46 ILE HD1 . 11090 1 515 . 1 1 46 46 ILE HD12 H 1 0.814 0.030 . 1 . . . . 46 ILE HD1 . 11090 1 516 . 1 1 46 46 ILE HD13 H 1 0.814 0.030 . 1 . . . . 46 ILE HD1 . 11090 1 517 . 1 1 46 46 ILE HG12 H 1 1.514 0.030 . 2 . . . . 46 ILE HG12 . 11090 1 518 . 1 1 46 46 ILE HG13 H 1 1.220 0.030 . 2 . . . . 46 ILE HG13 . 11090 1 519 . 1 1 46 46 ILE HG21 H 1 0.795 0.030 . 1 . . . . 46 ILE HG2 . 11090 1 520 . 1 1 46 46 ILE HG22 H 1 0.795 0.030 . 1 . . . . 46 ILE HG2 . 11090 1 521 . 1 1 46 46 ILE HG23 H 1 0.795 0.030 . 1 . . . . 46 ILE HG2 . 11090 1 522 . 1 1 46 46 ILE C C 13 175.966 0.300 . 1 . . . . 46 ILE C . 11090 1 523 . 1 1 46 46 ILE CA C 13 59.588 0.300 . 1 . . . . 46 ILE CA . 11090 1 524 . 1 1 46 46 ILE CB C 13 38.510 0.300 . 1 . . . . 46 ILE CB . 11090 1 525 . 1 1 46 46 ILE CD1 C 13 12.216 0.300 . 1 . . . . 46 ILE CD1 . 11090 1 526 . 1 1 46 46 ILE CG1 C 13 27.738 0.300 . 1 . . . . 46 ILE CG1 . 11090 1 527 . 1 1 46 46 ILE CG2 C 13 17.896 0.300 . 1 . . . . 46 ILE CG2 . 11090 1 528 . 1 1 46 46 ILE N N 15 122.537 0.300 . 1 . . . . 46 ILE N . 11090 1 529 . 1 1 47 47 LEU H H 1 9.229 0.030 . 1 . . . . 47 LEU H . 11090 1 530 . 1 1 47 47 LEU HA H 1 4.640 0.030 . 1 . . . . 47 LEU HA . 11090 1 531 . 1 1 47 47 LEU HB2 H 1 1.470 0.030 . 2 . . . . 47 LEU HB2 . 11090 1 532 . 1 1 47 47 LEU HB3 H 1 1.380 0.030 . 2 . . . . 47 LEU HB3 . 11090 1 533 . 1 1 47 47 LEU HD11 H 1 0.810 0.030 . 1 . . . . 47 LEU HD1 . 11090 1 534 . 1 1 47 47 LEU HD12 H 1 0.810 0.030 . 1 . . . . 47 LEU HD1 . 11090 1 535 . 1 1 47 47 LEU HD13 H 1 0.810 0.030 . 1 . . . . 47 LEU HD1 . 11090 1 536 . 1 1 47 47 LEU HD21 H 1 0.801 0.030 . 1 . . . . 47 LEU HD2 . 11090 1 537 . 1 1 47 47 LEU HD22 H 1 0.801 0.030 . 1 . . . . 47 LEU HD2 . 11090 1 538 . 1 1 47 47 LEU HD23 H 1 0.801 0.030 . 1 . . . . 47 LEU HD2 . 11090 1 539 . 1 1 47 47 LEU HG H 1 1.481 0.030 . 1 . . . . 47 LEU HG . 11090 1 540 . 1 1 47 47 LEU C C 13 174.009 0.300 . 1 . . . . 47 LEU C . 11090 1 541 . 1 1 47 47 LEU CA C 13 53.288 0.300 . 1 . . . . 47 LEU CA . 11090 1 542 . 1 1 47 47 LEU CB C 13 45.378 0.300 . 1 . . . . 47 LEU CB . 11090 1 543 . 1 1 47 47 LEU CD1 C 13 25.074 0.300 . 2 . . . . 47 LEU CD1 . 11090 1 544 . 1 1 47 47 LEU CD2 C 13 24.215 0.300 . 2 . . . . 47 LEU CD2 . 11090 1 545 . 1 1 47 47 LEU CG C 13 26.666 0.300 . 1 . . . . 47 LEU CG . 11090 1 546 . 1 1 47 47 LEU N N 15 129.137 0.300 . 1 . . . . 47 LEU N . 11090 1 547 . 1 1 48 48 LEU H H 1 8.571 0.030 . 1 . . . . 48 LEU H . 11090 1 548 . 1 1 48 48 LEU HA H 1 4.884 0.030 . 1 . . . . 48 LEU HA . 11090 1 549 . 1 1 48 48 LEU HB2 H 1 1.670 0.030 . 2 . . . . 48 LEU HB2 . 11090 1 550 . 1 1 48 48 LEU HB3 H 1 1.420 0.030 . 2 . . . . 48 LEU HB3 . 11090 1 551 . 1 1 48 48 LEU HD11 H 1 0.802 0.030 . 1 . . . . 48 LEU HD1 . 11090 1 552 . 1 1 48 48 LEU HD12 H 1 0.802 0.030 . 1 . . . . 48 LEU HD1 . 11090 1 553 . 1 1 48 48 LEU HD13 H 1 0.802 0.030 . 1 . . . . 48 LEU HD1 . 11090 1 554 . 1 1 48 48 LEU HD21 H 1 0.813 0.030 . 1 . . . . 48 LEU HD2 . 11090 1 555 . 1 1 48 48 LEU HD22 H 1 0.813 0.030 . 1 . . . . 48 LEU HD2 . 11090 1 556 . 1 1 48 48 LEU HD23 H 1 0.813 0.030 . 1 . . . . 48 LEU HD2 . 11090 1 557 . 1 1 48 48 LEU HG H 1 1.375 0.030 . 1 . . . . 48 LEU HG . 11090 1 558 . 1 1 48 48 LEU C C 13 176.341 0.300 . 1 . . . . 48 LEU C . 11090 1 559 . 1 1 48 48 LEU CA C 13 54.047 0.300 . 1 . . . . 48 LEU CA . 11090 1 560 . 1 1 48 48 LEU CB C 13 42.730 0.300 . 1 . . . . 48 LEU CB . 11090 1 561 . 1 1 48 48 LEU CD1 C 13 23.975 0.300 . 2 . . . . 48 LEU CD1 . 11090 1 562 . 1 1 48 48 LEU CD2 C 13 24.692 0.300 . 2 . . . . 48 LEU CD2 . 11090 1 563 . 1 1 48 48 LEU CG C 13 27.653 0.300 . 1 . . . . 48 LEU CG . 11090 1 564 . 1 1 48 48 LEU N N 15 127.239 0.300 . 1 . . . . 48 LEU N . 11090 1 565 . 1 1 49 49 VAL H H 1 8.761 0.030 . 1 . . . . 49 VAL H . 11090 1 566 . 1 1 49 49 VAL HA H 1 4.529 0.030 . 1 . . . . 49 VAL HA . 11090 1 567 . 1 1 49 49 VAL HB H 1 1.272 0.030 . 1 . . . . 49 VAL HB . 11090 1 568 . 1 1 49 49 VAL HG11 H 1 0.070 0.030 . 1 . . . . 49 VAL HG1 . 11090 1 569 . 1 1 49 49 VAL HG12 H 1 0.070 0.030 . 1 . . . . 49 VAL HG1 . 11090 1 570 . 1 1 49 49 VAL HG13 H 1 0.070 0.030 . 1 . . . . 49 VAL HG1 . 11090 1 571 . 1 1 49 49 VAL HG21 H 1 0.230 0.030 . 1 . . . . 49 VAL HG2 . 11090 1 572 . 1 1 49 49 VAL HG22 H 1 0.230 0.030 . 1 . . . . 49 VAL HG2 . 11090 1 573 . 1 1 49 49 VAL HG23 H 1 0.230 0.030 . 1 . . . . 49 VAL HG2 . 11090 1 574 . 1 1 49 49 VAL C C 13 172.624 0.300 . 1 . . . . 49 VAL C . 11090 1 575 . 1 1 49 49 VAL CA C 13 59.448 0.300 . 1 . . . . 49 VAL CA . 11090 1 576 . 1 1 49 49 VAL CB C 13 34.816 0.300 . 1 . . . . 49 VAL CB . 11090 1 577 . 1 1 49 49 VAL CG1 C 13 20.972 0.300 . 2 . . . . 49 VAL CG1 . 11090 1 578 . 1 1 49 49 VAL CG2 C 13 20.443 0.300 . 2 . . . . 49 VAL CG2 . 11090 1 579 . 1 1 49 49 VAL N N 15 125.440 0.300 . 1 . . . . 49 VAL N . 11090 1 580 . 1 1 50 50 ARG H H 1 9.361 0.030 . 1 . . . . 50 ARG H . 11090 1 581 . 1 1 50 50 ARG HA H 1 5.004 0.030 . 1 . . . . 50 ARG HA . 11090 1 582 . 1 1 50 50 ARG HB2 H 1 1.540 0.030 . 2 . . . . 50 ARG HB2 . 11090 1 583 . 1 1 50 50 ARG HB3 H 1 1.429 0.030 . 2 . . . . 50 ARG HB3 . 11090 1 584 . 1 1 50 50 ARG HD2 H 1 3.035 0.030 . 2 . . . . 50 ARG HD2 . 11090 1 585 . 1 1 50 50 ARG HD3 H 1 2.970 0.030 . 2 . . . . 50 ARG HD3 . 11090 1 586 . 1 1 50 50 ARG HE H 1 7.050 0.030 . 1 . . . . 50 ARG HE . 11090 1 587 . 1 1 50 50 ARG HG2 H 1 1.230 0.030 . 2 . . . . 50 ARG HG2 . 11090 1 588 . 1 1 50 50 ARG HG3 H 1 1.340 0.030 . 2 . . . . 50 ARG HG3 . 11090 1 589 . 1 1 50 50 ARG C C 13 175.218 0.300 . 1 . . . . 50 ARG C . 11090 1 590 . 1 1 50 50 ARG CA C 13 53.641 0.300 . 1 . . . . 50 ARG CA . 11090 1 591 . 1 1 50 50 ARG CB C 13 34.189 0.300 . 1 . . . . 50 ARG CB . 11090 1 592 . 1 1 50 50 ARG CD C 13 43.410 0.300 . 1 . . . . 50 ARG CD . 11090 1 593 . 1 1 50 50 ARG CG C 13 27.445 0.300 . 1 . . . . 50 ARG CG . 11090 1 594 . 1 1 50 50 ARG N N 15 125.783 0.300 . 1 . . . . 50 ARG N . 11090 1 595 . 1 1 50 50 ARG NE N 15 84.322 0.300 . 1 . . . . 50 ARG NE . 11090 1 596 . 1 1 51 51 ASN H H 1 7.856 0.030 . 1 . . . . 51 ASN H . 11090 1 597 . 1 1 51 51 ASN HA H 1 5.229 0.030 . 1 . . . . 51 ASN HA . 11090 1 598 . 1 1 51 51 ASN HB2 H 1 3.487 0.030 . 2 . . . . 51 ASN HB2 . 11090 1 599 . 1 1 51 51 ASN HB3 H 1 2.144 0.030 . 2 . . . . 51 ASN HB3 . 11090 1 600 . 1 1 51 51 ASN HD21 H 1 6.772 0.030 . 2 . . . . 51 ASN HD21 . 11090 1 601 . 1 1 51 51 ASN HD22 H 1 7.605 0.030 . 2 . . . . 51 ASN HD22 . 11090 1 602 . 1 1 51 51 ASN C C 13 176.282 0.300 . 1 . . . . 51 ASN C . 11090 1 603 . 1 1 51 51 ASN CA C 13 51.541 0.300 . 1 . . . . 51 ASN CA . 11090 1 604 . 1 1 51 51 ASN CB C 13 37.593 0.300 . 1 . . . . 51 ASN CB . 11090 1 605 . 1 1 51 51 ASN N N 15 118.110 0.300 . 1 . . . . 51 ASN N . 11090 1 606 . 1 1 51 51 ASN ND2 N 15 108.251 0.300 . 1 . . . . 51 ASN ND2 . 11090 1 607 . 1 1 52 52 ILE H H 1 8.651 0.030 . 1 . . . . 52 ILE H . 11090 1 608 . 1 1 52 52 ILE HA H 1 4.610 0.030 . 1 . . . . 52 ILE HA . 11090 1 609 . 1 1 52 52 ILE HB H 1 2.250 0.030 . 1 . . . . 52 ILE HB . 11090 1 610 . 1 1 52 52 ILE HD11 H 1 0.818 0.030 . 1 . . . . 52 ILE HD1 . 11090 1 611 . 1 1 52 52 ILE HD12 H 1 0.818 0.030 . 1 . . . . 52 ILE HD1 . 11090 1 612 . 1 1 52 52 ILE HD13 H 1 0.818 0.030 . 1 . . . . 52 ILE HD1 . 11090 1 613 . 1 1 52 52 ILE HG12 H 1 1.092 0.030 . 2 . . . . 52 ILE HG12 . 11090 1 614 . 1 1 52 52 ILE HG13 H 1 0.820 0.030 . 2 . . . . 52 ILE HG13 . 11090 1 615 . 1 1 52 52 ILE HG21 H 1 0.810 0.030 . 1 . . . . 52 ILE HG2 . 11090 1 616 . 1 1 52 52 ILE HG22 H 1 0.810 0.030 . 1 . . . . 52 ILE HG2 . 11090 1 617 . 1 1 52 52 ILE HG23 H 1 0.810 0.030 . 1 . . . . 52 ILE HG2 . 11090 1 618 . 1 1 52 52 ILE C C 13 176.498 0.300 . 1 . . . . 52 ILE C . 11090 1 619 . 1 1 52 52 ILE CA C 13 61.070 0.300 . 1 . . . . 52 ILE CA . 11090 1 620 . 1 1 52 52 ILE CB C 13 37.276 0.300 . 1 . . . . 52 ILE CB . 11090 1 621 . 1 1 52 52 ILE CD1 C 13 14.127 0.300 . 1 . . . . 52 ILE CD1 . 11090 1 622 . 1 1 52 52 ILE CG1 C 13 26.401 0.300 . 1 . . . . 52 ILE CG1 . 11090 1 623 . 1 1 52 52 ILE CG2 C 13 18.015 0.300 . 1 . . . . 52 ILE CG2 . 11090 1 624 . 1 1 52 52 ILE N N 15 121.249 0.300 . 1 . . . . 52 ILE N . 11090 1 625 . 1 1 53 53 GLY H H 1 8.549 0.030 . 1 . . . . 53 GLY H . 11090 1 626 . 1 1 53 53 GLY HA2 H 1 4.553 0.030 . 2 . . . . 53 GLY HA2 . 11090 1 627 . 1 1 53 53 GLY HA3 H 1 3.963 0.030 . 2 . . . . 53 GLY HA3 . 11090 1 628 . 1 1 53 53 GLY C C 13 172.285 0.300 . 1 . . . . 53 GLY C . 11090 1 629 . 1 1 53 53 GLY CA C 13 44.076 0.300 . 1 . . . . 53 GLY CA . 11090 1 630 . 1 1 53 53 GLY N N 15 111.948 0.300 . 1 . . . . 53 GLY N . 11090 1 631 . 1 1 54 54 ASN H H 1 8.251 0.030 . 1 . . . . 54 ASN H . 11090 1 632 . 1 1 54 54 ASN HA H 1 4.849 0.030 . 1 . . . . 54 ASN HA . 11090 1 633 . 1 1 54 54 ASN HB2 H 1 2.970 0.030 . 2 . . . . 54 ASN HB2 . 11090 1 634 . 1 1 54 54 ASN HB3 H 1 2.751 0.030 . 2 . . . . 54 ASN HB3 . 11090 1 635 . 1 1 54 54 ASN HD21 H 1 7.529 0.030 . 2 . . . . 54 ASN HD21 . 11090 1 636 . 1 1 54 54 ASN HD22 H 1 6.870 0.030 . 2 . . . . 54 ASN HD22 . 11090 1 637 . 1 1 54 54 ASN C C 13 174.170 0.300 . 1 . . . . 54 ASN C . 11090 1 638 . 1 1 54 54 ASN CA C 13 52.229 0.300 . 1 . . . . 54 ASN CA . 11090 1 639 . 1 1 54 54 ASN CB C 13 38.492 0.300 . 1 . . . . 54 ASN CB . 11090 1 640 . 1 1 54 54 ASN N N 15 114.713 0.300 . 1 . . . . 54 ASN N . 11090 1 641 . 1 1 54 54 ASN ND2 N 15 110.447 0.300 . 1 . . . . 54 ASN ND2 . 11090 1 642 . 1 1 55 55 LYS H H 1 7.211 0.030 . 1 . . . . 55 LYS H . 11090 1 643 . 1 1 55 55 LYS HA H 1 4.425 0.030 . 1 . . . . 55 LYS HA . 11090 1 644 . 1 1 55 55 LYS HB2 H 1 1.550 0.030 . 2 . . . . 55 LYS HB2 . 11090 1 645 . 1 1 55 55 LYS HB3 H 1 1.450 0.030 . 2 . . . . 55 LYS HB3 . 11090 1 646 . 1 1 55 55 LYS HD2 H 1 1.598 0.030 . 1 . . . . 55 LYS HD2 . 11090 1 647 . 1 1 55 55 LYS HD3 H 1 1.598 0.030 . 1 . . . . 55 LYS HD3 . 11090 1 648 . 1 1 55 55 LYS HE2 H 1 3.020 0.030 . 1 . . . . 55 LYS HE2 . 11090 1 649 . 1 1 55 55 LYS HE3 H 1 3.020 0.030 . 1 . . . . 55 LYS HE3 . 11090 1 650 . 1 1 55 55 LYS HG2 H 1 1.380 0.030 . 2 . . . . 55 LYS HG2 . 11090 1 651 . 1 1 55 55 LYS HG3 H 1 1.543 0.030 . 2 . . . . 55 LYS HG3 . 11090 1 652 . 1 1 55 55 LYS C C 13 174.611 0.300 . 1 . . . . 55 LYS C . 11090 1 653 . 1 1 55 55 LYS CA C 13 54.312 0.300 . 1 . . . . 55 LYS CA . 11090 1 654 . 1 1 55 55 LYS CB C 13 36.536 0.300 . 1 . . . . 55 LYS CB . 11090 1 655 . 1 1 55 55 LYS CD C 13 29.338 0.300 . 1 . . . . 55 LYS CD . 11090 1 656 . 1 1 55 55 LYS CE C 13 42.062 0.300 . 1 . . . . 55 LYS CE . 11090 1 657 . 1 1 55 55 LYS CG C 13 24.100 0.300 . 1 . . . . 55 LYS CG . 11090 1 658 . 1 1 55 55 LYS N N 15 118.695 0.300 . 1 . . . . 55 LYS N . 11090 1 659 . 1 1 56 56 ASN H H 1 8.832 0.030 . 1 . . . . 56 ASN H . 11090 1 660 . 1 1 56 56 ASN HA H 1 4.291 0.030 . 1 . . . . 56 ASN HA . 11090 1 661 . 1 1 56 56 ASN HB2 H 1 2.781 0.030 . 2 . . . . 56 ASN HB2 . 11090 1 662 . 1 1 56 56 ASN HB3 H 1 2.737 0.030 . 2 . . . . 56 ASN HB3 . 11090 1 663 . 1 1 56 56 ASN HD21 H 1 6.582 0.030 . 2 . . . . 56 ASN HD21 . 11090 1 664 . 1 1 56 56 ASN HD22 H 1 7.519 0.030 . 2 . . . . 56 ASN HD22 . 11090 1 665 . 1 1 56 56 ASN C C 13 173.483 0.300 . 1 . . . . 56 ASN C . 11090 1 666 . 1 1 56 56 ASN CA C 13 54.700 0.300 . 1 . . . . 56 ASN CA . 11090 1 667 . 1 1 56 56 ASN CB C 13 38.016 0.300 . 1 . . . . 56 ASN CB . 11090 1 668 . 1 1 56 56 ASN N N 15 123.524 0.300 . 1 . . . . 56 ASN N . 11090 1 669 . 1 1 56 56 ASN ND2 N 15 112.049 0.300 . 1 . . . . 56 ASN ND2 . 11090 1 670 . 1 1 57 57 ALA H H 1 8.500 0.030 . 1 . . . . 57 ALA H . 11090 1 671 . 1 1 57 57 ALA HA H 1 4.837 0.030 . 1 . . . . 57 ALA HA . 11090 1 672 . 1 1 57 57 ALA HB1 H 1 1.510 0.030 . 1 . . . . 57 ALA HB . 11090 1 673 . 1 1 57 57 ALA HB2 H 1 1.510 0.030 . 1 . . . . 57 ALA HB . 11090 1 674 . 1 1 57 57 ALA HB3 H 1 1.510 0.030 . 1 . . . . 57 ALA HB . 11090 1 675 . 1 1 57 57 ALA C C 13 175.683 0.300 . 1 . . . . 57 ALA C . 11090 1 676 . 1 1 57 57 ALA CA C 13 51.030 0.300 . 1 . . . . 57 ALA CA . 11090 1 677 . 1 1 57 57 ALA CB C 13 22.719 0.300 . 1 . . . . 57 ALA CB . 11090 1 678 . 1 1 57 57 ALA N N 15 125.327 0.300 . 1 . . . . 57 ALA N . 11090 1 679 . 1 1 58 58 VAL H H 1 8.717 0.030 . 1 . . . . 58 VAL H . 11090 1 680 . 1 1 58 58 VAL HA H 1 4.530 0.030 . 1 . . . . 58 VAL HA . 11090 1 681 . 1 1 58 58 VAL HB H 1 1.983 0.030 . 1 . . . . 58 VAL HB . 11090 1 682 . 1 1 58 58 VAL HG11 H 1 0.900 0.030 . 1 . . . . 58 VAL HG1 . 11090 1 683 . 1 1 58 58 VAL HG12 H 1 0.900 0.030 . 1 . . . . 58 VAL HG1 . 11090 1 684 . 1 1 58 58 VAL HG13 H 1 0.900 0.030 . 1 . . . . 58 VAL HG1 . 11090 1 685 . 1 1 58 58 VAL HG21 H 1 0.900 0.030 . 1 . . . . 58 VAL HG2 . 11090 1 686 . 1 1 58 58 VAL HG22 H 1 0.900 0.030 . 1 . . . . 58 VAL HG2 . 11090 1 687 . 1 1 58 58 VAL HG23 H 1 0.900 0.030 . 1 . . . . 58 VAL HG2 . 11090 1 688 . 1 1 58 58 VAL C C 13 175.377 0.300 . 1 . . . . 58 VAL C . 11090 1 689 . 1 1 58 58 VAL CA C 13 62.689 0.300 . 1 . . . . 58 VAL CA . 11090 1 690 . 1 1 58 58 VAL CB C 13 33.698 0.300 . 1 . . . . 58 VAL CB . 11090 1 691 . 1 1 58 58 VAL CG1 C 13 21.073 0.300 . 2 . . . . 58 VAL CG1 . 11090 1 692 . 1 1 58 58 VAL CG2 C 13 21.073 0.300 . 2 . . . . 58 VAL CG2 . 11090 1 693 . 1 1 58 58 VAL N N 15 125.453 0.300 . 1 . . . . 58 VAL N . 11090 1 694 . 1 1 59 59 PHE H H 1 8.333 0.030 . 1 . . . . 59 PHE H . 11090 1 695 . 1 1 59 59 PHE HA H 1 5.820 0.030 . 1 . . . . 59 PHE HA . 11090 1 696 . 1 1 59 59 PHE HB2 H 1 2.590 0.030 . 2 . . . . 59 PHE HB2 . 11090 1 697 . 1 1 59 59 PHE HB3 H 1 2.458 0.030 . 2 . . . . 59 PHE HB3 . 11090 1 698 . 1 1 59 59 PHE HD1 H 1 6.668 0.030 . 1 . . . . 59 PHE HD1 . 11090 1 699 . 1 1 59 59 PHE HD2 H 1 6.668 0.030 . 1 . . . . 59 PHE HD2 . 11090 1 700 . 1 1 59 59 PHE HE1 H 1 6.851 0.030 . 1 . . . . 59 PHE HE1 . 11090 1 701 . 1 1 59 59 PHE HE2 H 1 6.851 0.030 . 1 . . . . 59 PHE HE2 . 11090 1 702 . 1 1 59 59 PHE HZ H 1 7.172 0.030 . 1 . . . . 59 PHE HZ . 11090 1 703 . 1 1 59 59 PHE C C 13 173.443 0.300 . 1 . . . . 59 PHE C . 11090 1 704 . 1 1 59 59 PHE CA C 13 54.982 0.300 . 1 . . . . 59 PHE CA . 11090 1 705 . 1 1 59 59 PHE CB C 13 42.910 0.300 . 1 . . . . 59 PHE CB . 11090 1 706 . 1 1 59 59 PHE CD1 C 13 132.327 0.300 . 1 . . . . 59 PHE CD1 . 11090 1 707 . 1 1 59 59 PHE CD2 C 13 132.327 0.300 . 1 . . . . 59 PHE CD2 . 11090 1 708 . 1 1 59 59 PHE CE1 C 13 129.987 0.300 . 1 . . . . 59 PHE CE1 . 11090 1 709 . 1 1 59 59 PHE CE2 C 13 129.987 0.300 . 1 . . . . 59 PHE CE2 . 11090 1 710 . 1 1 59 59 PHE CZ C 13 129.521 0.300 . 1 . . . . 59 PHE CZ . 11090 1 711 . 1 1 59 59 PHE N N 15 121.406 0.300 . 1 . . . . 59 PHE N . 11090 1 712 . 1 1 60 60 HIS H H 1 8.532 0.030 . 1 . . . . 60 HIS H . 11090 1 713 . 1 1 60 60 HIS HA H 1 5.489 0.030 . 1 . . . . 60 HIS HA . 11090 1 714 . 1 1 60 60 HIS HB2 H 1 3.123 0.030 . 1 . . . . 60 HIS HB2 . 11090 1 715 . 1 1 60 60 HIS HB3 H 1 3.123 0.030 . 1 . . . . 60 HIS HB3 . 11090 1 716 . 1 1 60 60 HIS HD2 H 1 6.902 0.030 . 1 . . . . 60 HIS HD2 . 11090 1 717 . 1 1 60 60 HIS HE1 H 1 7.776 0.030 . 1 . . . . 60 HIS HE1 . 11090 1 718 . 1 1 60 60 HIS C C 13 174.216 0.300 . 1 . . . . 60 HIS C . 11090 1 719 . 1 1 60 60 HIS CA C 13 54.718 0.300 . 1 . . . . 60 HIS CA . 11090 1 720 . 1 1 60 60 HIS CB C 13 33.492 0.300 . 1 . . . . 60 HIS CB . 11090 1 721 . 1 1 60 60 HIS CD2 C 13 120.411 0.300 . 1 . . . . 60 HIS CD2 . 11090 1 722 . 1 1 60 60 HIS CE1 C 13 138.022 0.300 . 1 . . . . 60 HIS CE1 . 11090 1 723 . 1 1 60 60 HIS N N 15 118.477 0.300 . 1 . . . . 60 HIS N . 11090 1 724 . 1 1 61 61 ILE H H 1 9.560 0.030 . 1 . . . . 61 ILE H . 11090 1 725 . 1 1 61 61 ILE HA H 1 5.070 0.030 . 1 . . . . 61 ILE HA . 11090 1 726 . 1 1 61 61 ILE HB H 1 1.750 0.030 . 1 . . . . 61 ILE HB . 11090 1 727 . 1 1 61 61 ILE HD11 H 1 0.820 0.030 . 1 . . . . 61 ILE HD1 . 11090 1 728 . 1 1 61 61 ILE HD12 H 1 0.820 0.030 . 1 . . . . 61 ILE HD1 . 11090 1 729 . 1 1 61 61 ILE HD13 H 1 0.820 0.030 . 1 . . . . 61 ILE HD1 . 11090 1 730 . 1 1 61 61 ILE HG12 H 1 0.810 0.030 . 2 . . . . 61 ILE HG12 . 11090 1 731 . 1 1 61 61 ILE HG13 H 1 1.750 0.030 . 2 . . . . 61 ILE HG13 . 11090 1 732 . 1 1 61 61 ILE HG21 H 1 0.750 0.030 . 1 . . . . 61 ILE HG2 . 11090 1 733 . 1 1 61 61 ILE HG22 H 1 0.750 0.030 . 1 . . . . 61 ILE HG2 . 11090 1 734 . 1 1 61 61 ILE HG23 H 1 0.750 0.030 . 1 . . . . 61 ILE HG2 . 11090 1 735 . 1 1 61 61 ILE C C 13 174.401 0.300 . 1 . . . . 61 ILE C . 11090 1 736 . 1 1 61 61 ILE CA C 13 60.576 0.300 . 1 . . . . 61 ILE CA . 11090 1 737 . 1 1 61 61 ILE CB C 13 40.073 0.300 . 1 . . . . 61 ILE CB . 11090 1 738 . 1 1 61 61 ILE CD1 C 13 14.507 0.300 . 1 . . . . 61 ILE CD1 . 11090 1 739 . 1 1 61 61 ILE CG1 C 13 28.195 0.300 . 1 . . . . 61 ILE CG1 . 11090 1 740 . 1 1 61 61 ILE CG2 C 13 19.651 0.300 . 1 . . . . 61 ILE CG2 . 11090 1 741 . 1 1 61 61 ILE N N 15 124.133 0.300 . 1 . . . . 61 ILE N . 11090 1 742 . 1 1 62 62 LYS H H 1 8.927 0.030 . 1 . . . . 62 LYS H . 11090 1 743 . 1 1 62 62 LYS HA H 1 4.742 0.030 . 1 . . . . 62 LYS HA . 11090 1 744 . 1 1 62 62 LYS HB2 H 1 1.940 0.030 . 2 . . . . 62 LYS HB2 . 11090 1 745 . 1 1 62 62 LYS HB3 H 1 1.720 0.030 . 2 . . . . 62 LYS HB3 . 11090 1 746 . 1 1 62 62 LYS HD2 H 1 1.666 0.030 . 1 . . . . 62 LYS HD2 . 11090 1 747 . 1 1 62 62 LYS HD3 H 1 1.666 0.030 . 1 . . . . 62 LYS HD3 . 11090 1 748 . 1 1 62 62 LYS HE2 H 1 2.823 0.030 . 1 . . . . 62 LYS HE2 . 11090 1 749 . 1 1 62 62 LYS HE3 H 1 2.823 0.030 . 1 . . . . 62 LYS HE3 . 11090 1 750 . 1 1 62 62 LYS HG2 H 1 1.398 0.030 . 1 . . . . 62 LYS HG2 . 11090 1 751 . 1 1 62 62 LYS HG3 H 1 1.398 0.030 . 1 . . . . 62 LYS HG3 . 11090 1 752 . 1 1 62 62 LYS C C 13 175.196 0.300 . 1 . . . . 62 LYS C . 11090 1 753 . 1 1 62 62 LYS CA C 13 54.718 0.300 . 1 . . . . 62 LYS CA . 11090 1 754 . 1 1 62 62 LYS CB C 13 35.717 0.300 . 1 . . . . 62 LYS CB . 11090 1 755 . 1 1 62 62 LYS CD C 13 29.355 0.300 . 1 . . . . 62 LYS CD . 11090 1 756 . 1 1 62 62 LYS CE C 13 42.102 0.300 . 1 . . . . 62 LYS CE . 11090 1 757 . 1 1 62 62 LYS CG C 13 24.857 0.300 . 1 . . . . 62 LYS CG . 11090 1 758 . 1 1 62 62 LYS N N 15 126.572 0.300 . 1 . . . . 62 LYS N . 11090 1 759 . 1 1 63 63 THR H H 1 8.491 0.030 . 1 . . . . 63 THR H . 11090 1 760 . 1 1 63 63 THR HA H 1 4.778 0.030 . 1 . . . . 63 THR HA . 11090 1 761 . 1 1 63 63 THR HB H 1 4.264 0.030 . 1 . . . . 63 THR HB . 11090 1 762 . 1 1 63 63 THR HG21 H 1 0.920 0.030 . 1 . . . . 63 THR HG2 . 11090 1 763 . 1 1 63 63 THR HG22 H 1 0.920 0.030 . 1 . . . . 63 THR HG2 . 11090 1 764 . 1 1 63 63 THR HG23 H 1 0.920 0.030 . 1 . . . . 63 THR HG2 . 11090 1 765 . 1 1 63 63 THR C C 13 172.235 0.300 . 1 . . . . 63 THR C . 11090 1 766 . 1 1 63 63 THR CA C 13 62.052 0.300 . 1 . . . . 63 THR CA . 11090 1 767 . 1 1 63 63 THR CB C 13 69.181 0.300 . 1 . . . . 63 THR CB . 11090 1 768 . 1 1 63 63 THR CG2 C 13 17.036 0.300 . 1 . . . . 63 THR CG2 . 11090 1 769 . 1 1 63 63 THR N N 15 116.257 0.300 . 1 . . . . 63 THR N . 11090 1 770 . 1 1 64 64 CYS H H 1 8.540 0.030 . 1 . . . . 64 CYS H . 11090 1 771 . 1 1 64 64 CYS HA H 1 5.050 0.030 . 1 . . . . 64 CYS HA . 11090 1 772 . 1 1 64 64 CYS HB2 H 1 3.128 0.030 . 2 . . . . 64 CYS HB2 . 11090 1 773 . 1 1 64 64 CYS HB3 H 1 3.035 0.030 . 2 . . . . 64 CYS HB3 . 11090 1 774 . 1 1 64 64 CYS C C 13 173.699 0.300 . 1 . . . . 64 CYS C . 11090 1 775 . 1 1 64 64 CYS CA C 13 56.712 0.300 . 1 . . . . 64 CYS CA . 11090 1 776 . 1 1 64 64 CYS CB C 13 30.961 0.300 . 1 . . . . 64 CYS CB . 11090 1 777 . 1 1 64 64 CYS N N 15 118.818 0.300 . 1 . . . . 64 CYS N . 11090 1 778 . 1 1 65 65 ARG H H 1 8.730 0.030 . 1 . . . . 65 ARG H . 11090 1 779 . 1 1 65 65 ARG HA H 1 4.433 0.030 . 1 . . . . 65 ARG HA . 11090 1 780 . 1 1 65 65 ARG HB2 H 1 1.848 0.030 . 2 . . . . 65 ARG HB2 . 11090 1 781 . 1 1 65 65 ARG HB3 H 1 1.820 0.030 . 2 . . . . 65 ARG HB3 . 11090 1 782 . 1 1 65 65 ARG HD2 H 1 3.160 0.030 . 1 . . . . 65 ARG HD2 . 11090 1 783 . 1 1 65 65 ARG HD3 H 1 3.160 0.030 . 1 . . . . 65 ARG HD3 . 11090 1 784 . 1 1 65 65 ARG HG2 H 1 1.870 0.030 . 2 . . . . 65 ARG HG2 . 11090 1 785 . 1 1 65 65 ARG HG3 H 1 1.770 0.030 . 2 . . . . 65 ARG HG3 . 11090 1 786 . 1 1 65 65 ARG C C 13 175.289 0.300 . 1 . . . . 65 ARG C . 11090 1 787 . 1 1 65 65 ARG CA C 13 56.142 0.300 . 1 . . . . 65 ARG CA . 11090 1 788 . 1 1 65 65 ARG CB C 13 28.819 0.300 . 1 . . . . 65 ARG CB . 11090 1 789 . 1 1 65 65 ARG CD C 13 43.301 0.300 . 1 . . . . 65 ARG CD . 11090 1 790 . 1 1 65 65 ARG CG C 13 26.939 0.300 . 1 . . . . 65 ARG CG . 11090 1 791 . 1 1 65 65 ARG N N 15 124.375 0.300 . 1 . . . . 65 ARG N . 11090 1 792 . 1 1 66 66 PRO HA H 1 4.484 0.030 . 1 . . . . 66 PRO HA . 11090 1 793 . 1 1 66 66 PRO HB2 H 1 1.978 0.030 . 2 . . . . 66 PRO HB2 . 11090 1 794 . 1 1 66 66 PRO HB3 H 1 1.459 0.030 . 2 . . . . 66 PRO HB3 . 11090 1 795 . 1 1 66 66 PRO HD2 H 1 3.593 0.030 . 2 . . . . 66 PRO HD2 . 11090 1 796 . 1 1 66 66 PRO HD3 H 1 3.565 0.030 . 2 . . . . 66 PRO HD3 . 11090 1 797 . 1 1 66 66 PRO HG2 H 1 0.541 0.030 . 2 . . . . 66 PRO HG2 . 11090 1 798 . 1 1 66 66 PRO HG3 H 1 1.780 0.030 . 2 . . . . 66 PRO HG3 . 11090 1 799 . 1 1 66 66 PRO C C 13 174.199 0.300 . 1 . . . . 66 PRO C . 11090 1 800 . 1 1 66 66 PRO CA C 13 63.474 0.300 . 1 . . . . 66 PRO CA . 11090 1 801 . 1 1 66 66 PRO CB C 13 32.994 0.300 . 1 . . . . 66 PRO CB . 11090 1 802 . 1 1 66 66 PRO CD C 13 50.421 0.300 . 1 . . . . 66 PRO CD . 11090 1 803 . 1 1 66 66 PRO CG C 13 23.655 0.300 . 1 . . . . 66 PRO CG . 11090 1 804 . 1 1 67 67 PHE H H 1 9.044 0.030 . 1 . . . . 67 PHE H . 11090 1 805 . 1 1 67 67 PHE HA H 1 5.858 0.030 . 1 . . . . 67 PHE HA . 11090 1 806 . 1 1 67 67 PHE HB2 H 1 3.082 0.030 . 2 . . . . 67 PHE HB2 . 11090 1 807 . 1 1 67 67 PHE HB3 H 1 2.824 0.030 . 2 . . . . 67 PHE HB3 . 11090 1 808 . 1 1 67 67 PHE HD1 H 1 6.900 0.030 . 1 . . . . 67 PHE HD1 . 11090 1 809 . 1 1 67 67 PHE HD2 H 1 6.900 0.030 . 1 . . . . 67 PHE HD2 . 11090 1 810 . 1 1 67 67 PHE HE1 H 1 6.780 0.030 . 1 . . . . 67 PHE HE1 . 11090 1 811 . 1 1 67 67 PHE HE2 H 1 6.780 0.030 . 1 . . . . 67 PHE HE2 . 11090 1 812 . 1 1 67 67 PHE HZ H 1 6.280 0.030 . 1 . . . . 67 PHE HZ . 11090 1 813 . 1 1 67 67 PHE C C 13 174.176 0.300 . 1 . . . . 67 PHE C . 11090 1 814 . 1 1 67 67 PHE CA C 13 56.924 0.300 . 1 . . . . 67 PHE CA . 11090 1 815 . 1 1 67 67 PHE CB C 13 41.552 0.300 . 1 . . . . 67 PHE CB . 11090 1 816 . 1 1 67 67 PHE CZ C 13 128.404 0.300 . 1 . . . . 67 PHE CZ . 11090 1 817 . 1 1 67 67 PHE N N 15 128.699 0.300 . 1 . . . . 67 PHE N . 11090 1 818 . 1 1 68 68 SER H H 1 8.609 0.030 . 1 . . . . 68 SER H . 11090 1 819 . 1 1 68 68 SER HA H 1 4.421 0.030 . 1 . . . . 68 SER HA . 11090 1 820 . 1 1 68 68 SER HB2 H 1 3.777 0.030 . 1 . . . . 68 SER HB2 . 11090 1 821 . 1 1 68 68 SER HB3 H 1 3.777 0.030 . 1 . . . . 68 SER HB3 . 11090 1 822 . 1 1 68 68 SER C C 13 171.561 0.300 . 1 . . . . 68 SER C . 11090 1 823 . 1 1 68 68 SER CA C 13 57.753 0.300 . 1 . . . . 68 SER CA . 11090 1 824 . 1 1 68 68 SER CB C 13 65.191 0.300 . 1 . . . . 68 SER CB . 11090 1 825 . 1 1 68 68 SER N N 15 112.301 0.300 . 1 . . . . 68 SER N . 11090 1 826 . 1 1 69 69 ILE H H 1 8.368 0.030 . 1 . . . . 69 ILE H . 11090 1 827 . 1 1 69 69 ILE HA H 1 5.504 0.030 . 1 . . . . 69 ILE HA . 11090 1 828 . 1 1 69 69 ILE HB H 1 1.546 0.030 . 1 . . . . 69 ILE HB . 11090 1 829 . 1 1 69 69 ILE HD11 H 1 0.820 0.030 . 1 . . . . 69 ILE HD1 . 11090 1 830 . 1 1 69 69 ILE HD12 H 1 0.820 0.030 . 1 . . . . 69 ILE HD1 . 11090 1 831 . 1 1 69 69 ILE HD13 H 1 0.820 0.030 . 1 . . . . 69 ILE HD1 . 11090 1 832 . 1 1 69 69 ILE HG12 H 1 1.470 0.030 . 2 . . . . 69 ILE HG12 . 11090 1 833 . 1 1 69 69 ILE HG13 H 1 1.221 0.030 . 2 . . . . 69 ILE HG13 . 11090 1 834 . 1 1 69 69 ILE HG21 H 1 0.922 0.030 . 1 . . . . 69 ILE HG2 . 11090 1 835 . 1 1 69 69 ILE HG22 H 1 0.922 0.030 . 1 . . . . 69 ILE HG2 . 11090 1 836 . 1 1 69 69 ILE HG23 H 1 0.922 0.030 . 1 . . . . 69 ILE HG2 . 11090 1 837 . 1 1 69 69 ILE C C 13 171.675 0.300 . 1 . . . . 69 ILE C . 11090 1 838 . 1 1 69 69 ILE CA C 13 58.477 0.300 . 1 . . . . 69 ILE CA . 11090 1 839 . 1 1 69 69 ILE CB C 13 42.993 0.300 . 1 . . . . 69 ILE CB . 11090 1 840 . 1 1 69 69 ILE CD1 C 13 15.630 0.300 . 1 . . . . 69 ILE CD1 . 11090 1 841 . 1 1 69 69 ILE CG1 C 13 28.286 0.300 . 1 . . . . 69 ILE CG1 . 11090 1 842 . 1 1 69 69 ILE CG2 C 13 16.562 0.300 . 1 . . . . 69 ILE CG2 . 11090 1 843 . 1 1 69 69 ILE N N 15 119.731 0.300 . 1 . . . . 69 ILE N . 11090 1 844 . 1 1 70 70 GLU H H 1 8.448 0.030 . 1 . . . . 70 GLU H . 11090 1 845 . 1 1 70 70 GLU HA H 1 4.781 0.030 . 1 . . . . 70 GLU HA . 11090 1 846 . 1 1 70 70 GLU HB2 H 1 1.990 0.030 . 1 . . . . 70 GLU HB2 . 11090 1 847 . 1 1 70 70 GLU HB3 H 1 1.990 0.030 . 1 . . . . 70 GLU HB3 . 11090 1 848 . 1 1 70 70 GLU HG2 H 1 2.344 0.030 . 2 . . . . 70 GLU HG2 . 11090 1 849 . 1 1 70 70 GLU HG3 H 1 2.172 0.030 . 2 . . . . 70 GLU HG3 . 11090 1 850 . 1 1 70 70 GLU C C 13 174.441 0.300 . 1 . . . . 70 GLU C . 11090 1 851 . 1 1 70 70 GLU CA C 13 53.077 0.300 . 1 . . . . 70 GLU CA . 11090 1 852 . 1 1 70 70 GLU CB C 13 34.103 0.300 . 1 . . . . 70 GLU CB . 11090 1 853 . 1 1 70 70 GLU CG C 13 35.408 0.300 . 1 . . . . 70 GLU CG . 11090 1 854 . 1 1 70 70 GLU N N 15 125.256 0.300 . 1 . . . . 70 GLU N . 11090 1 855 . 1 1 71 71 PRO HA H 1 4.891 0.030 . 1 . . . . 71 PRO HA . 11090 1 856 . 1 1 71 71 PRO HB2 H 1 2.541 0.030 . 2 . . . . 71 PRO HB2 . 11090 1 857 . 1 1 71 71 PRO HB3 H 1 2.309 0.030 . 2 . . . . 71 PRO HB3 . 11090 1 858 . 1 1 71 71 PRO HD2 H 1 3.660 0.030 . 2 . . . . 71 PRO HD2 . 11090 1 859 . 1 1 71 71 PRO HD3 H 1 3.970 0.030 . 2 . . . . 71 PRO HD3 . 11090 1 860 . 1 1 71 71 PRO HG2 H 1 2.110 0.030 . 2 . . . . 71 PRO HG2 . 11090 1 861 . 1 1 71 71 PRO HG3 H 1 1.919 0.030 . 2 . . . . 71 PRO HG3 . 11090 1 862 . 1 1 71 71 PRO C C 13 173.607 0.300 . 1 . . . . 71 PRO C . 11090 1 863 . 1 1 71 71 PRO CA C 13 63.289 0.300 . 1 . . . . 71 PRO CA . 11090 1 864 . 1 1 71 71 PRO CB C 13 34.673 0.300 . 1 . . . . 71 PRO CB . 11090 1 865 . 1 1 71 71 PRO CD C 13 49.875 0.300 . 1 . . . . 71 PRO CD . 11090 1 866 . 1 1 71 71 PRO CG C 13 25.005 0.300 . 1 . . . . 71 PRO CG . 11090 1 867 . 1 1 72 72 ALA H H 1 8.402 0.030 . 1 . . . . 72 ALA H . 11090 1 868 . 1 1 72 72 ALA HA H 1 4.502 0.030 . 1 . . . . 72 ALA HA . 11090 1 869 . 1 1 72 72 ALA HB1 H 1 1.639 0.030 . 1 . . . . 72 ALA HB . 11090 1 870 . 1 1 72 72 ALA HB2 H 1 1.639 0.030 . 1 . . . . 72 ALA HB . 11090 1 871 . 1 1 72 72 ALA HB3 H 1 1.639 0.030 . 1 . . . . 72 ALA HB . 11090 1 872 . 1 1 72 72 ALA C C 13 176.496 0.300 . 1 . . . . 72 ALA C . 11090 1 873 . 1 1 72 72 ALA CA C 13 51.947 0.300 . 1 . . . . 72 ALA CA . 11090 1 874 . 1 1 72 72 ALA CB C 13 20.046 0.300 . 1 . . . . 72 ALA CB . 11090 1 875 . 1 1 72 72 ALA N N 15 116.852 0.300 . 1 . . . . 72 ALA N . 11090 1 876 . 1 1 73 73 ILE H H 1 7.321 0.030 . 1 . . . . 73 ILE H . 11090 1 877 . 1 1 73 73 ILE HA H 1 4.766 0.030 . 1 . . . . 73 ILE HA . 11090 1 878 . 1 1 73 73 ILE HB H 1 1.650 0.030 . 1 . . . . 73 ILE HB . 11090 1 879 . 1 1 73 73 ILE HD11 H 1 0.739 0.030 . 1 . . . . 73 ILE HD1 . 11090 1 880 . 1 1 73 73 ILE HD12 H 1 0.739 0.030 . 1 . . . . 73 ILE HD1 . 11090 1 881 . 1 1 73 73 ILE HD13 H 1 0.739 0.030 . 1 . . . . 73 ILE HD1 . 11090 1 882 . 1 1 73 73 ILE HG12 H 1 1.383 0.030 . 2 . . . . 73 ILE HG12 . 11090 1 883 . 1 1 73 73 ILE HG13 H 1 0.839 0.030 . 2 . . . . 73 ILE HG13 . 11090 1 884 . 1 1 73 73 ILE HG21 H 1 0.770 0.030 . 1 . . . . 73 ILE HG2 . 11090 1 885 . 1 1 73 73 ILE HG22 H 1 0.770 0.030 . 1 . . . . 73 ILE HG2 . 11090 1 886 . 1 1 73 73 ILE HG23 H 1 0.770 0.030 . 1 . . . . 73 ILE HG2 . 11090 1 887 . 1 1 73 73 ILE C C 13 174.634 0.300 . 1 . . . . 73 ILE C . 11090 1 888 . 1 1 73 73 ILE CA C 13 58.918 0.300 . 1 . . . . 73 ILE CA . 11090 1 889 . 1 1 73 73 ILE CB C 13 41.706 0.300 . 1 . . . . 73 ILE CB . 11090 1 890 . 1 1 73 73 ILE CD1 C 13 13.857 0.300 . 1 . . . . 73 ILE CD1 . 11090 1 891 . 1 1 73 73 ILE CG1 C 13 27.274 0.300 . 1 . . . . 73 ILE CG1 . 11090 1 892 . 1 1 73 73 ILE CG2 C 13 17.043 0.300 . 1 . . . . 73 ILE CG2 . 11090 1 893 . 1 1 73 73 ILE N N 15 114.719 0.300 . 1 . . . . 73 ILE N . 11090 1 894 . 1 1 74 74 GLY H H 1 7.390 0.030 . 1 . . . . 74 GLY H . 11090 1 895 . 1 1 74 74 GLY HA2 H 1 3.960 0.030 . 2 . . . . 74 GLY HA2 . 11090 1 896 . 1 1 74 74 GLY HA3 H 1 3.128 0.030 . 2 . . . . 74 GLY HA3 . 11090 1 897 . 1 1 74 74 GLY C C 13 169.901 0.300 . 1 . . . . 74 GLY C . 11090 1 898 . 1 1 74 74 GLY CA C 13 45.167 0.300 . 1 . . . . 74 GLY CA . 11090 1 899 . 1 1 74 74 GLY N N 15 109.849 0.300 . 1 . . . . 74 GLY N . 11090 1 900 . 1 1 75 75 THR H H 1 7.806 0.030 . 1 . . . . 75 THR H . 11090 1 901 . 1 1 75 75 THR HA H 1 5.134 0.030 . 1 . . . . 75 THR HA . 11090 1 902 . 1 1 75 75 THR HB H 1 4.013 0.030 . 1 . . . . 75 THR HB . 11090 1 903 . 1 1 75 75 THR HG21 H 1 1.118 0.030 . 1 . . . . 75 THR HG2 . 11090 1 904 . 1 1 75 75 THR HG22 H 1 1.118 0.030 . 1 . . . . 75 THR HG2 . 11090 1 905 . 1 1 75 75 THR HG23 H 1 1.118 0.030 . 1 . . . . 75 THR HG2 . 11090 1 906 . 1 1 75 75 THR C C 13 173.242 0.300 . 1 . . . . 75 THR C . 11090 1 907 . 1 1 75 75 THR CA C 13 59.844 0.300 . 1 . . . . 75 THR CA . 11090 1 908 . 1 1 75 75 THR CB C 13 71.388 0.300 . 1 . . . . 75 THR CB . 11090 1 909 . 1 1 75 75 THR CG2 C 13 21.153 0.300 . 1 . . . . 75 THR CG2 . 11090 1 910 . 1 1 75 75 THR N N 15 112.458 0.300 . 1 . . . . 75 THR N . 11090 1 911 . 1 1 76 76 LEU H H 1 9.030 0.030 . 1 . . . . 76 LEU H . 11090 1 912 . 1 1 76 76 LEU HA H 1 4.851 0.030 . 1 . . . . 76 LEU HA . 11090 1 913 . 1 1 76 76 LEU HB2 H 1 1.799 0.030 . 2 . . . . 76 LEU HB2 . 11090 1 914 . 1 1 76 76 LEU HB3 H 1 1.520 0.030 . 2 . . . . 76 LEU HB3 . 11090 1 915 . 1 1 76 76 LEU HD11 H 1 0.862 0.030 . 1 . . . . 76 LEU HD1 . 11090 1 916 . 1 1 76 76 LEU HD12 H 1 0.862 0.030 . 1 . . . . 76 LEU HD1 . 11090 1 917 . 1 1 76 76 LEU HD13 H 1 0.862 0.030 . 1 . . . . 76 LEU HD1 . 11090 1 918 . 1 1 76 76 LEU HD21 H 1 0.767 0.030 . 1 . . . . 76 LEU HD2 . 11090 1 919 . 1 1 76 76 LEU HD22 H 1 0.767 0.030 . 1 . . . . 76 LEU HD2 . 11090 1 920 . 1 1 76 76 LEU HD23 H 1 0.767 0.030 . 1 . . . . 76 LEU HD2 . 11090 1 921 . 1 1 76 76 LEU HG H 1 1.614 0.030 . 1 . . . . 76 LEU HG . 11090 1 922 . 1 1 76 76 LEU C C 13 176.277 0.300 . 1 . . . . 76 LEU C . 11090 1 923 . 1 1 76 76 LEU CA C 13 53.835 0.300 . 1 . . . . 76 LEU CA . 11090 1 924 . 1 1 76 76 LEU CB C 13 46.894 0.300 . 1 . . . . 76 LEU CB . 11090 1 925 . 1 1 76 76 LEU CD1 C 13 24.965 0.300 . 2 . . . . 76 LEU CD1 . 11090 1 926 . 1 1 76 76 LEU CD2 C 13 25.800 0.300 . 2 . . . . 76 LEU CD2 . 11090 1 927 . 1 1 76 76 LEU CG C 13 26.564 0.300 . 1 . . . . 76 LEU CG . 11090 1 928 . 1 1 76 76 LEU N N 15 124.311 0.300 . 1 . . . . 76 LEU N . 11090 1 929 . 1 1 77 77 ASN H H 1 9.511 0.030 . 1 . . . . 77 ASN H . 11090 1 930 . 1 1 77 77 ASN HA H 1 4.825 0.030 . 1 . . . . 77 ASN HA . 11090 1 931 . 1 1 77 77 ASN HB2 H 1 2.820 0.030 . 2 . . . . 77 ASN HB2 . 11090 1 932 . 1 1 77 77 ASN HB3 H 1 2.610 0.030 . 2 . . . . 77 ASN HB3 . 11090 1 933 . 1 1 77 77 ASN HD21 H 1 7.571 0.030 . 2 . . . . 77 ASN HD21 . 11090 1 934 . 1 1 77 77 ASN HD22 H 1 6.760 0.030 . 2 . . . . 77 ASN HD22 . 11090 1 935 . 1 1 77 77 ASN C C 13 175.395 0.300 . 1 . . . . 77 ASN C . 11090 1 936 . 1 1 77 77 ASN CA C 13 52.318 0.300 . 1 . . . . 77 ASN CA . 11090 1 937 . 1 1 77 77 ASN CB C 13 38.515 0.300 . 1 . . . . 77 ASN CB . 11090 1 938 . 1 1 77 77 ASN N N 15 129.863 0.300 . 1 . . . . 77 ASN N . 11090 1 939 . 1 1 77 77 ASN ND2 N 15 110.831 0.300 . 1 . . . . 77 ASN ND2 . 11090 1 940 . 1 1 78 78 VAL H H 1 8.210 0.030 . 1 . . . . 78 VAL H . 11090 1 941 . 1 1 78 78 VAL HA H 1 3.131 0.030 . 1 . . . . 78 VAL HA . 11090 1 942 . 1 1 78 78 VAL HB H 1 1.826 0.030 . 1 . . . . 78 VAL HB . 11090 1 943 . 1 1 78 78 VAL HG11 H 1 0.879 0.030 . 1 . . . . 78 VAL HG1 . 11090 1 944 . 1 1 78 78 VAL HG12 H 1 0.879 0.030 . 1 . . . . 78 VAL HG1 . 11090 1 945 . 1 1 78 78 VAL HG13 H 1 0.879 0.030 . 1 . . . . 78 VAL HG1 . 11090 1 946 . 1 1 78 78 VAL HG21 H 1 0.700 0.030 . 1 . . . . 78 VAL HG2 . 11090 1 947 . 1 1 78 78 VAL HG22 H 1 0.700 0.030 . 1 . . . . 78 VAL HG2 . 11090 1 948 . 1 1 78 78 VAL HG23 H 1 0.700 0.030 . 1 . . . . 78 VAL HG2 . 11090 1 949 . 1 1 78 78 VAL C C 13 177.405 0.300 . 1 . . . . 78 VAL C . 11090 1 950 . 1 1 78 78 VAL CA C 13 65.959 0.300 . 1 . . . . 78 VAL CA . 11090 1 951 . 1 1 78 78 VAL CB C 13 32.050 0.300 . 1 . . . . 78 VAL CB . 11090 1 952 . 1 1 78 78 VAL CG1 C 13 21.257 0.300 . 2 . . . . 78 VAL CG1 . 11090 1 953 . 1 1 78 78 VAL CG2 C 13 21.150 0.300 . 2 . . . . 78 VAL CG2 . 11090 1 954 . 1 1 78 78 VAL N N 15 119.171 0.300 . 1 . . . . 78 VAL N . 11090 1 955 . 1 1 79 79 GLY H H 1 8.642 0.030 . 1 . . . . 79 GLY H . 11090 1 956 . 1 1 79 79 GLY HA2 H 1 4.253 0.030 . 2 . . . . 79 GLY HA2 . 11090 1 957 . 1 1 79 79 GLY HA3 H 1 3.751 0.030 . 2 . . . . 79 GLY HA3 . 11090 1 958 . 1 1 79 79 GLY C C 13 173.990 0.300 . 1 . . . . 79 GLY C . 11090 1 959 . 1 1 79 79 GLY CA C 13 45.676 0.300 . 1 . . . . 79 GLY CA . 11090 1 960 . 1 1 79 79 GLY N N 15 115.319 0.300 . 1 . . . . 79 GLY N . 11090 1 961 . 1 1 80 80 GLU H H 1 8.050 0.030 . 1 . . . . 80 GLU H . 11090 1 962 . 1 1 80 80 GLU HA H 1 4.519 0.030 . 1 . . . . 80 GLU HA . 11090 1 963 . 1 1 80 80 GLU HB2 H 1 2.210 0.030 . 2 . . . . 80 GLU HB2 . 11090 1 964 . 1 1 80 80 GLU HB3 H 1 2.095 0.030 . 2 . . . . 80 GLU HB3 . 11090 1 965 . 1 1 80 80 GLU HG2 H 1 2.260 0.030 . 1 . . . . 80 GLU HG2 . 11090 1 966 . 1 1 80 80 GLU HG3 H 1 2.260 0.030 . 1 . . . . 80 GLU HG3 . 11090 1 967 . 1 1 80 80 GLU C C 13 174.446 0.300 . 1 . . . . 80 GLU C . 11090 1 968 . 1 1 80 80 GLU CA C 13 55.795 0.300 . 1 . . . . 80 GLU CA . 11090 1 969 . 1 1 80 80 GLU CB C 13 31.613 0.300 . 1 . . . . 80 GLU CB . 11090 1 970 . 1 1 80 80 GLU CG C 13 37.194 0.300 . 1 . . . . 80 GLU CG . 11090 1 971 . 1 1 80 80 GLU N N 15 121.071 0.300 . 1 . . . . 80 GLU N . 11090 1 972 . 1 1 81 81 SER H H 1 8.414 0.030 . 1 . . . . 81 SER H . 11090 1 973 . 1 1 81 81 SER HA H 1 5.788 0.030 . 1 . . . . 81 SER HA . 11090 1 974 . 1 1 81 81 SER HB2 H 1 3.650 0.030 . 2 . . . . 81 SER HB2 . 11090 1 975 . 1 1 81 81 SER HB3 H 1 3.570 0.030 . 2 . . . . 81 SER HB3 . 11090 1 976 . 1 1 81 81 SER C C 13 173.600 0.300 . 1 . . . . 81 SER C . 11090 1 977 . 1 1 81 81 SER CA C 13 56.505 0.300 . 1 . . . . 81 SER CA . 11090 1 978 . 1 1 81 81 SER CB C 13 67.282 0.300 . 1 . . . . 81 SER CB . 11090 1 979 . 1 1 81 81 SER N N 15 113.610 0.300 . 1 . . . . 81 SER N . 11090 1 980 . 1 1 82 82 MET H H 1 9.220 0.030 . 1 . . . . 82 MET H . 11090 1 981 . 1 1 82 82 MET HA H 1 4.778 0.030 . 1 . . . . 82 MET HA . 11090 1 982 . 1 1 82 82 MET HB2 H 1 1.960 0.030 . 2 . . . . 82 MET HB2 . 11090 1 983 . 1 1 82 82 MET HB3 H 1 2.271 0.030 . 2 . . . . 82 MET HB3 . 11090 1 984 . 1 1 82 82 MET HE1 H 1 2.043 0.030 . 1 . . . . 82 MET HE . 11090 1 985 . 1 1 82 82 MET HE2 H 1 2.043 0.030 . 1 . . . . 82 MET HE . 11090 1 986 . 1 1 82 82 MET HE3 H 1 2.043 0.030 . 1 . . . . 82 MET HE . 11090 1 987 . 1 1 82 82 MET HG2 H 1 2.379 0.030 . 2 . . . . 82 MET HG2 . 11090 1 988 . 1 1 82 82 MET HG3 H 1 2.211 0.030 . 2 . . . . 82 MET HG3 . 11090 1 989 . 1 1 82 82 MET C C 13 172.619 0.300 . 1 . . . . 82 MET C . 11090 1 990 . 1 1 82 82 MET CA C 13 54.841 0.300 . 1 . . . . 82 MET CA . 11090 1 991 . 1 1 82 82 MET CB C 13 36.495 0.300 . 1 . . . . 82 MET CB . 11090 1 992 . 1 1 82 82 MET CE C 13 16.948 0.300 . 1 . . . . 82 MET CE . 11090 1 993 . 1 1 82 82 MET CG C 13 30.460 0.300 . 1 . . . . 82 MET CG . 11090 1 994 . 1 1 82 82 MET N N 15 117.946 0.300 . 1 . . . . 82 MET N . 11090 1 995 . 1 1 83 83 GLN H H 1 8.490 0.030 . 1 . . . . 83 GLN H . 11090 1 996 . 1 1 83 83 GLN HA H 1 5.152 0.030 . 1 . . . . 83 GLN HA . 11090 1 997 . 1 1 83 83 GLN HB2 H 1 1.970 0.030 . 2 . . . . 83 GLN HB2 . 11090 1 998 . 1 1 83 83 GLN HB3 H 1 1.880 0.030 . 2 . . . . 83 GLN HB3 . 11090 1 999 . 1 1 83 83 GLN HE21 H 1 7.579 0.030 . 2 . . . . 83 GLN HE21 . 11090 1 1000 . 1 1 83 83 GLN HE22 H 1 6.878 0.030 . 2 . . . . 83 GLN HE22 . 11090 1 1001 . 1 1 83 83 GLN HG2 H 1 2.290 0.030 . 2 . . . . 83 GLN HG2 . 11090 1 1002 . 1 1 83 83 GLN HG3 H 1 2.099 0.030 . 2 . . . . 83 GLN HG3 . 11090 1 1003 . 1 1 83 83 GLN C C 13 175.186 0.300 . 1 . . . . 83 GLN C . 11090 1 1004 . 1 1 83 83 GLN CA C 13 54.771 0.300 . 1 . . . . 83 GLN CA . 11090 1 1005 . 1 1 83 83 GLN CB C 13 30.820 0.300 . 1 . . . . 83 GLN CB . 11090 1 1006 . 1 1 83 83 GLN CG C 13 35.138 0.300 . 1 . . . . 83 GLN CG . 11090 1 1007 . 1 1 83 83 GLN N N 15 119.939 0.300 . 1 . . . . 83 GLN N . 11090 1 1008 . 1 1 83 83 GLN NE2 N 15 112.198 0.300 . 1 . . . . 83 GLN NE2 . 11090 1 1009 . 1 1 84 84 LEU H H 1 9.151 0.030 . 1 . . . . 84 LEU H . 11090 1 1010 . 1 1 84 84 LEU HA H 1 4.934 0.030 . 1 . . . . 84 LEU HA . 11090 1 1011 . 1 1 84 84 LEU HB2 H 1 1.613 0.030 . 2 . . . . 84 LEU HB2 . 11090 1 1012 . 1 1 84 84 LEU HB3 H 1 1.467 0.030 . 2 . . . . 84 LEU HB3 . 11090 1 1013 . 1 1 84 84 LEU HD11 H 1 0.815 0.030 . 1 . . . . 84 LEU HD1 . 11090 1 1014 . 1 1 84 84 LEU HD12 H 1 0.815 0.030 . 1 . . . . 84 LEU HD1 . 11090 1 1015 . 1 1 84 84 LEU HD13 H 1 0.815 0.030 . 1 . . . . 84 LEU HD1 . 11090 1 1016 . 1 1 84 84 LEU HD21 H 1 0.981 0.030 . 1 . . . . 84 LEU HD2 . 11090 1 1017 . 1 1 84 84 LEU HD22 H 1 0.981 0.030 . 1 . . . . 84 LEU HD2 . 11090 1 1018 . 1 1 84 84 LEU HD23 H 1 0.981 0.030 . 1 . . . . 84 LEU HD2 . 11090 1 1019 . 1 1 84 84 LEU HG H 1 1.620 0.030 . 1 . . . . 84 LEU HG . 11090 1 1020 . 1 1 84 84 LEU C C 13 175.037 0.300 . 1 . . . . 84 LEU C . 11090 1 1021 . 1 1 84 84 LEU CA C 13 54.047 0.300 . 1 . . . . 84 LEU CA . 11090 1 1022 . 1 1 84 84 LEU CB C 13 44.555 0.300 . 1 . . . . 84 LEU CB . 11090 1 1023 . 1 1 84 84 LEU CD1 C 13 27.201 0.300 . 2 . . . . 84 LEU CD1 . 11090 1 1024 . 1 1 84 84 LEU CD2 C 13 24.823 0.300 . 2 . . . . 84 LEU CD2 . 11090 1 1025 . 1 1 84 84 LEU CG C 13 27.636 0.300 . 1 . . . . 84 LEU CG . 11090 1 1026 . 1 1 84 84 LEU N N 15 123.659 0.300 . 1 . . . . 84 LEU N . 11090 1 1027 . 1 1 85 85 GLU H H 1 8.941 0.030 . 1 . . . . 85 GLU H . 11090 1 1028 . 1 1 85 85 GLU HA H 1 4.825 0.030 . 1 . . . . 85 GLU HA . 11090 1 1029 . 1 1 85 85 GLU HB2 H 1 1.970 0.030 . 2 . . . . 85 GLU HB2 . 11090 1 1030 . 1 1 85 85 GLU HB3 H 1 2.089 0.030 . 2 . . . . 85 GLU HB3 . 11090 1 1031 . 1 1 85 85 GLU HG2 H 1 2.019 0.030 . 2 . . . . 85 GLU HG2 . 11090 1 1032 . 1 1 85 85 GLU HG3 H 1 2.184 0.030 . 2 . . . . 85 GLU HG3 . 11090 1 1033 . 1 1 85 85 GLU C C 13 175.038 0.300 . 1 . . . . 85 GLU C . 11090 1 1034 . 1 1 85 85 GLU CA C 13 55.512 0.300 . 1 . . . . 85 GLU CA . 11090 1 1035 . 1 1 85 85 GLU CB C 13 31.491 0.300 . 1 . . . . 85 GLU CB . 11090 1 1036 . 1 1 85 85 GLU CG C 13 36.618 0.300 . 1 . . . . 85 GLU CG . 11090 1 1037 . 1 1 85 85 GLU N N 15 122.121 0.300 . 1 . . . . 85 GLU N . 11090 1 1038 . 1 1 86 86 VAL H H 1 9.297 0.030 . 1 . . . . 86 VAL H . 11090 1 1039 . 1 1 86 86 VAL HA H 1 5.070 0.030 . 1 . . . . 86 VAL HA . 11090 1 1040 . 1 1 86 86 VAL HB H 1 2.208 0.030 . 1 . . . . 86 VAL HB . 11090 1 1041 . 1 1 86 86 VAL HG11 H 1 1.271 0.030 . 1 . . . . 86 VAL HG1 . 11090 1 1042 . 1 1 86 86 VAL HG12 H 1 1.271 0.030 . 1 . . . . 86 VAL HG1 . 11090 1 1043 . 1 1 86 86 VAL HG13 H 1 1.271 0.030 . 1 . . . . 86 VAL HG1 . 11090 1 1044 . 1 1 86 86 VAL HG21 H 1 0.874 0.030 . 1 . . . . 86 VAL HG2 . 11090 1 1045 . 1 1 86 86 VAL HG22 H 1 0.874 0.030 . 1 . . . . 86 VAL HG2 . 11090 1 1046 . 1 1 86 86 VAL HG23 H 1 0.874 0.030 . 1 . . . . 86 VAL HG2 . 11090 1 1047 . 1 1 86 86 VAL C C 13 174.742 0.300 . 1 . . . . 86 VAL C . 11090 1 1048 . 1 1 86 86 VAL CA C 13 60.401 0.300 . 1 . . . . 86 VAL CA . 11090 1 1049 . 1 1 86 86 VAL CB C 13 32.876 0.300 . 1 . . . . 86 VAL CB . 11090 1 1050 . 1 1 86 86 VAL CG1 C 13 22.676 0.300 . 2 . . . . 86 VAL CG1 . 11090 1 1051 . 1 1 86 86 VAL CG2 C 13 21.163 0.300 . 2 . . . . 86 VAL CG2 . 11090 1 1052 . 1 1 86 86 VAL N N 15 128.003 0.300 . 1 . . . . 86 VAL N . 11090 1 1053 . 1 1 87 87 GLU H H 1 9.081 0.030 . 1 . . . . 87 GLU H . 11090 1 1054 . 1 1 87 87 GLU HA H 1 5.490 0.030 . 1 . . . . 87 GLU HA . 11090 1 1055 . 1 1 87 87 GLU HB2 H 1 1.890 0.030 . 2 . . . . 87 GLU HB2 . 11090 1 1056 . 1 1 87 87 GLU HB3 H 1 1.950 0.030 . 2 . . . . 87 GLU HB3 . 11090 1 1057 . 1 1 87 87 GLU HG2 H 1 2.210 0.030 . 2 . . . . 87 GLU HG2 . 11090 1 1058 . 1 1 87 87 GLU HG3 H 1 2.019 0.030 . 2 . . . . 87 GLU HG3 . 11090 1 1059 . 1 1 87 87 GLU C C 13 173.948 0.300 . 1 . . . . 87 GLU C . 11090 1 1060 . 1 1 87 87 GLU CA C 13 54.735 0.300 . 1 . . . . 87 GLU CA . 11090 1 1061 . 1 1 87 87 GLU CB C 13 33.313 0.300 . 1 . . . . 87 GLU CB . 11090 1 1062 . 1 1 87 87 GLU CG C 13 37.358 0.300 . 1 . . . . 87 GLU CG . 11090 1 1063 . 1 1 87 87 GLU N N 15 126.906 0.300 . 1 . . . . 87 GLU N . 11090 1 1064 . 1 1 88 88 PHE H H 1 8.590 0.030 . 1 . . . . 88 PHE H . 11090 1 1065 . 1 1 88 88 PHE HA H 1 4.723 0.030 . 1 . . . . 88 PHE HA . 11090 1 1066 . 1 1 88 88 PHE HB2 H 1 2.181 0.030 . 2 . . . . 88 PHE HB2 . 11090 1 1067 . 1 1 88 88 PHE HB3 H 1 1.321 0.030 . 2 . . . . 88 PHE HB3 . 11090 1 1068 . 1 1 88 88 PHE HD1 H 1 7.289 0.030 . 1 . . . . 88 PHE HD1 . 11090 1 1069 . 1 1 88 88 PHE HD2 H 1 7.289 0.030 . 1 . . . . 88 PHE HD2 . 11090 1 1070 . 1 1 88 88 PHE HE1 H 1 6.042 0.030 . 1 . . . . 88 PHE HE1 . 11090 1 1071 . 1 1 88 88 PHE HE2 H 1 6.042 0.030 . 1 . . . . 88 PHE HE2 . 11090 1 1072 . 1 1 88 88 PHE HZ H 1 6.615 0.030 . 1 . . . . 88 PHE HZ . 11090 1 1073 . 1 1 88 88 PHE C C 13 172.873 0.300 . 1 . . . . 88 PHE C . 11090 1 1074 . 1 1 88 88 PHE CA C 13 53.341 0.300 . 1 . . . . 88 PHE CA . 11090 1 1075 . 1 1 88 88 PHE CB C 13 41.106 0.300 . 1 . . . . 88 PHE CB . 11090 1 1076 . 1 1 88 88 PHE CD1 C 13 131.646 0.300 . 1 . . . . 88 PHE CD1 . 11090 1 1077 . 1 1 88 88 PHE CD2 C 13 131.646 0.300 . 1 . . . . 88 PHE CD2 . 11090 1 1078 . 1 1 88 88 PHE CZ C 13 127.962 0.300 . 1 . . . . 88 PHE CZ . 11090 1 1079 . 1 1 88 88 PHE N N 15 123.126 0.300 . 1 . . . . 88 PHE N . 11090 1 1080 . 1 1 89 89 GLU H H 1 8.233 0.030 . 1 . . . . 89 GLU H . 11090 1 1081 . 1 1 89 89 GLU HA H 1 4.910 0.030 . 1 . . . . 89 GLU HA . 11090 1 1082 . 1 1 89 89 GLU HB2 H 1 1.374 0.030 . 2 . . . . 89 GLU HB2 . 11090 1 1083 . 1 1 89 89 GLU HB3 H 1 1.759 0.030 . 2 . . . . 89 GLU HB3 . 11090 1 1084 . 1 1 89 89 GLU HG2 H 1 1.550 0.030 . 1 . . . . 89 GLU HG2 . 11090 1 1085 . 1 1 89 89 GLU HG3 H 1 1.550 0.030 . 1 . . . . 89 GLU HG3 . 11090 1 1086 . 1 1 89 89 GLU C C 13 171.921 0.300 . 1 . . . . 89 GLU C . 11090 1 1087 . 1 1 89 89 GLU CA C 13 51.947 0.300 . 1 . . . . 89 GLU CA . 11090 1 1088 . 1 1 89 89 GLU CB C 13 30.658 0.300 . 1 . . . . 89 GLU CB . 11090 1 1089 . 1 1 89 89 GLU CG C 13 36.035 0.300 . 1 . . . . 89 GLU CG . 11090 1 1090 . 1 1 89 89 GLU N N 15 127.313 0.300 . 1 . . . . 89 GLU N . 11090 1 1091 . 1 1 90 90 PRO HA H 1 3.610 0.030 . 1 . . . . 90 PRO HA . 11090 1 1092 . 1 1 90 90 PRO HB2 H 1 1.290 0.030 . 2 . . . . 90 PRO HB2 . 11090 1 1093 . 1 1 90 90 PRO HB3 H 1 0.875 0.030 . 2 . . . . 90 PRO HB3 . 11090 1 1094 . 1 1 90 90 PRO HD2 H 1 3.450 0.030 . 2 . . . . 90 PRO HD2 . 11090 1 1095 . 1 1 90 90 PRO HD3 H 1 0.673 0.030 . 2 . . . . 90 PRO HD3 . 11090 1 1096 . 1 1 90 90 PRO HG2 H 1 0.844 0.030 . 2 . . . . 90 PRO HG2 . 11090 1 1097 . 1 1 90 90 PRO HG3 H 1 1.723 0.030 . 2 . . . . 90 PRO HG3 . 11090 1 1098 . 1 1 90 90 PRO CA C 13 62.025 0.300 . 1 . . . . 90 PRO CA . 11090 1 1099 . 1 1 90 90 PRO CB C 13 32.062 0.300 . 1 . . . . 90 PRO CB . 11090 1 1100 . 1 1 90 90 PRO CD C 13 48.467 0.300 . 1 . . . . 90 PRO CD . 11090 1 1101 . 1 1 91 91 GLN H H 1 9.228 0.030 . 1 . . . . 91 GLN H . 11090 1 1102 . 1 1 91 91 GLN HA H 1 4.210 0.030 . 1 . . . . 91 GLN HA . 11090 1 1103 . 1 1 91 91 GLN HB2 H 1 1.838 0.030 . 2 . . . . 91 GLN HB2 . 11090 1 1104 . 1 1 91 91 GLN HB3 H 1 2.310 0.030 . 2 . . . . 91 GLN HB3 . 11090 1 1105 . 1 1 91 91 GLN HE21 H 1 7.100 0.030 . 2 . . . . 91 GLN HE21 . 11090 1 1106 . 1 1 91 91 GLN HE22 H 1 6.688 0.030 . 2 . . . . 91 GLN HE22 . 11090 1 1107 . 1 1 91 91 GLN HG2 H 1 2.221 0.030 . 2 . . . . 91 GLN HG2 . 11090 1 1108 . 1 1 91 91 GLN HG3 H 1 2.331 0.030 . 2 . . . . 91 GLN HG3 . 11090 1 1109 . 1 1 91 91 GLN CA C 13 54.297 0.300 . 1 . . . . 91 GLN CA . 11090 1 1110 . 1 1 91 91 GLN CB C 13 29.446 0.300 . 1 . . . . 91 GLN CB . 11090 1 1111 . 1 1 91 91 GLN CG C 13 33.655 0.300 . 1 . . . . 91 GLN CG . 11090 1 1112 . 1 1 91 91 GLN N N 15 117.632 0.300 . 1 . . . . 91 GLN N . 11090 1 1113 . 1 1 91 91 GLN NE2 N 15 113.879 0.300 . 1 . . . . 91 GLN NE2 . 11090 1 1114 . 1 1 92 92 SER H H 1 7.203 0.030 . 1 . . . . 92 SER H . 11090 1 1115 . 1 1 92 92 SER HA H 1 4.690 0.030 . 1 . . . . 92 SER HA . 11090 1 1116 . 1 1 92 92 SER HB2 H 1 3.905 0.030 . 2 . . . . 92 SER HB2 . 11090 1 1117 . 1 1 92 92 SER HB3 H 1 3.829 0.030 . 2 . . . . 92 SER HB3 . 11090 1 1118 . 1 1 92 92 SER CA C 13 56.078 0.300 . 1 . . . . 92 SER CA . 11090 1 1119 . 1 1 92 92 SER CB C 13 65.519 0.300 . 1 . . . . 92 SER CB . 11090 1 1120 . 1 1 92 92 SER N N 15 110.702 0.300 . 1 . . . . 92 SER N . 11090 1 1121 . 1 1 93 93 VAL H H 1 8.590 0.030 . 1 . . . . 93 VAL H . 11090 1 1122 . 1 1 93 93 VAL HA H 1 3.738 0.030 . 1 . . . . 93 VAL HA . 11090 1 1123 . 1 1 93 93 VAL HB H 1 2.160 0.030 . 1 . . . . 93 VAL HB . 11090 1 1124 . 1 1 93 93 VAL HG11 H 1 1.026 0.030 . 1 . . . . 93 VAL HG1 . 11090 1 1125 . 1 1 93 93 VAL HG12 H 1 1.026 0.030 . 1 . . . . 93 VAL HG1 . 11090 1 1126 . 1 1 93 93 VAL HG13 H 1 1.026 0.030 . 1 . . . . 93 VAL HG1 . 11090 1 1127 . 1 1 93 93 VAL HG21 H 1 0.975 0.030 . 1 . . . . 93 VAL HG2 . 11090 1 1128 . 1 1 93 93 VAL HG22 H 1 0.975 0.030 . 1 . . . . 93 VAL HG2 . 11090 1 1129 . 1 1 93 93 VAL HG23 H 1 0.975 0.030 . 1 . . . . 93 VAL HG2 . 11090 1 1130 . 1 1 93 93 VAL C C 13 175.682 0.300 . 1 . . . . 93 VAL C . 11090 1 1131 . 1 1 93 93 VAL CA C 13 63.337 0.300 . 1 . . . . 93 VAL CA . 11090 1 1132 . 1 1 93 93 VAL CB C 13 32.917 0.300 . 1 . . . . 93 VAL CB . 11090 1 1133 . 1 1 93 93 VAL CG1 C 13 21.624 0.300 . 2 . . . . 93 VAL CG1 . 11090 1 1134 . 1 1 93 93 VAL CG2 C 13 20.995 0.300 . 2 . . . . 93 VAL CG2 . 11090 1 1135 . 1 1 93 93 VAL N N 15 120.669 0.300 . 1 . . . . 93 VAL N . 11090 1 1136 . 1 1 94 94 GLY H H 1 8.610 0.030 . 1 . . . . 94 GLY H . 11090 1 1137 . 1 1 94 94 GLY HA2 H 1 3.920 0.030 . 2 . . . . 94 GLY HA2 . 11090 1 1138 . 1 1 94 94 GLY HA3 H 1 4.592 0.030 . 2 . . . . 94 GLY HA3 . 11090 1 1139 . 1 1 94 94 GLY CA C 13 43.724 0.300 . 1 . . . . 94 GLY CA . 11090 1 1140 . 1 1 94 94 GLY N N 15 112.390 0.300 . 1 . . . . 94 GLY N . 11090 1 1141 . 1 1 95 95 ASP H H 1 8.425 0.030 . 1 . . . . 95 ASP H . 11090 1 1142 . 1 1 95 95 ASP HA H 1 5.065 0.030 . 1 . . . . 95 ASP HA . 11090 1 1143 . 1 1 95 95 ASP HB2 H 1 2.800 0.030 . 2 . . . . 95 ASP HB2 . 11090 1 1144 . 1 1 95 95 ASP HB3 H 1 2.562 0.030 . 2 . . . . 95 ASP HB3 . 11090 1 1145 . 1 1 95 95 ASP C C 13 176.118 0.300 . 1 . . . . 95 ASP C . 11090 1 1146 . 1 1 95 95 ASP CA C 13 55.018 0.300 . 1 . . . . 95 ASP CA . 11090 1 1147 . 1 1 95 95 ASP CB C 13 42.458 0.300 . 1 . . . . 95 ASP CB . 11090 1 1148 . 1 1 95 95 ASP N N 15 119.949 0.300 . 1 . . . . 95 ASP N . 11090 1 1149 . 1 1 96 96 HIS H H 1 9.131 0.030 . 1 . . . . 96 HIS H . 11090 1 1150 . 1 1 96 96 HIS HA H 1 4.813 0.030 . 1 . . . . 96 HIS HA . 11090 1 1151 . 1 1 96 96 HIS HB2 H 1 3.010 0.030 . 2 . . . . 96 HIS HB2 . 11090 1 1152 . 1 1 96 96 HIS HB3 H 1 2.876 0.030 . 2 . . . . 96 HIS HB3 . 11090 1 1153 . 1 1 96 96 HIS HD2 H 1 7.110 0.030 . 1 . . . . 96 HIS HD2 . 11090 1 1154 . 1 1 96 96 HIS HE1 H 1 7.654 0.030 . 1 . . . . 96 HIS HE1 . 11090 1 1155 . 1 1 96 96 HIS C C 13 174.448 0.300 . 1 . . . . 96 HIS C . 11090 1 1156 . 1 1 96 96 HIS CA C 13 56.271 0.300 . 1 . . . . 96 HIS CA . 11090 1 1157 . 1 1 96 96 HIS CB C 13 35.286 0.300 . 1 . . . . 96 HIS CB . 11090 1 1158 . 1 1 96 96 HIS CD2 C 13 117.427 0.300 . 1 . . . . 96 HIS CD2 . 11090 1 1159 . 1 1 96 96 HIS CE1 C 13 138.837 0.300 . 1 . . . . 96 HIS CE1 . 11090 1 1160 . 1 1 96 96 HIS N N 15 121.356 0.300 . 1 . . . . 96 HIS N . 11090 1 1161 . 1 1 97 97 SER H H 1 8.910 0.030 . 1 . . . . 97 SER H . 11090 1 1162 . 1 1 97 97 SER HA H 1 5.539 0.030 . 1 . . . . 97 SER HA . 11090 1 1163 . 1 1 97 97 SER HB2 H 1 4.019 0.030 . 2 . . . . 97 SER HB2 . 11090 1 1164 . 1 1 97 97 SER HB3 H 1 3.941 0.030 . 2 . . . . 97 SER HB3 . 11090 1 1165 . 1 1 97 97 SER C C 13 174.018 0.300 . 1 . . . . 97 SER C . 11090 1 1166 . 1 1 97 97 SER CA C 13 56.659 0.300 . 1 . . . . 97 SER CA . 11090 1 1167 . 1 1 97 97 SER CB C 13 65.900 0.300 . 1 . . . . 97 SER CB . 11090 1 1168 . 1 1 97 97 SER N N 15 117.005 0.300 . 1 . . . . 97 SER N . 11090 1 1169 . 1 1 98 98 GLY H H 1 8.642 0.030 . 1 . . . . 98 GLY H . 11090 1 1170 . 1 1 98 98 GLY HA2 H 1 4.494 0.030 . 2 . . . . 98 GLY HA2 . 11090 1 1171 . 1 1 98 98 GLY HA3 H 1 3.878 0.030 . 2 . . . . 98 GLY HA3 . 11090 1 1172 . 1 1 98 98 GLY C C 13 172.576 0.300 . 1 . . . . 98 GLY C . 11090 1 1173 . 1 1 98 98 GLY CA C 13 45.030 0.300 . 1 . . . . 98 GLY CA . 11090 1 1174 . 1 1 98 98 GLY N N 15 111.059 0.300 . 1 . . . . 98 GLY N . 11090 1 1175 . 1 1 99 99 ARG H H 1 8.799 0.030 . 1 . . . . 99 ARG H . 11090 1 1176 . 1 1 99 99 ARG HA H 1 5.282 0.030 . 1 . . . . 99 ARG HA . 11090 1 1177 . 1 1 99 99 ARG HB2 H 1 1.610 0.030 . 2 . . . . 99 ARG HB2 . 11090 1 1178 . 1 1 99 99 ARG HB3 H 1 1.789 0.030 . 2 . . . . 99 ARG HB3 . 11090 1 1179 . 1 1 99 99 ARG HD2 H 1 2.871 0.030 . 1 . . . . 99 ARG HD2 . 11090 1 1180 . 1 1 99 99 ARG HD3 H 1 2.871 0.030 . 1 . . . . 99 ARG HD3 . 11090 1 1181 . 1 1 99 99 ARG HG2 H 1 1.500 0.030 . 2 . . . . 99 ARG HG2 . 11090 1 1182 . 1 1 99 99 ARG HG3 H 1 1.589 0.030 . 2 . . . . 99 ARG HG3 . 11090 1 1183 . 1 1 99 99 ARG C C 13 176.793 0.300 . 1 . . . . 99 ARG C . 11090 1 1184 . 1 1 99 99 ARG CA C 13 55.424 0.300 . 1 . . . . 99 ARG CA . 11090 1 1185 . 1 1 99 99 ARG CB C 13 34.048 0.300 . 1 . . . . 99 ARG CB . 11090 1 1186 . 1 1 99 99 ARG CD C 13 44.020 0.300 . 1 . . . . 99 ARG CD . 11090 1 1187 . 1 1 99 99 ARG CG C 13 26.470 0.300 . 1 . . . . 99 ARG CG . 11090 1 1188 . 1 1 99 99 ARG N N 15 119.347 0.300 . 1 . . . . 99 ARG N . 11090 1 1189 . 1 1 100 100 LEU H H 1 9.269 0.030 . 1 . . . . 100 LEU H . 11090 1 1190 . 1 1 100 100 LEU HA H 1 4.730 0.030 . 1 . . . . 100 LEU HA . 11090 1 1191 . 1 1 100 100 LEU HB2 H 1 1.521 0.030 . 2 . . . . 100 LEU HB2 . 11090 1 1192 . 1 1 100 100 LEU HB3 H 1 1.053 0.030 . 2 . . . . 100 LEU HB3 . 11090 1 1193 . 1 1 100 100 LEU HD11 H 1 0.590 0.030 . 1 . . . . 100 LEU HD1 . 11090 1 1194 . 1 1 100 100 LEU HD12 H 1 0.590 0.030 . 1 . . . . 100 LEU HD1 . 11090 1 1195 . 1 1 100 100 LEU HD13 H 1 0.590 0.030 . 1 . . . . 100 LEU HD1 . 11090 1 1196 . 1 1 100 100 LEU HD21 H 1 0.673 0.030 . 1 . . . . 100 LEU HD2 . 11090 1 1197 . 1 1 100 100 LEU HD22 H 1 0.673 0.030 . 1 . . . . 100 LEU HD2 . 11090 1 1198 . 1 1 100 100 LEU HD23 H 1 0.673 0.030 . 1 . . . . 100 LEU HD2 . 11090 1 1199 . 1 1 100 100 LEU HG H 1 1.520 0.030 . 1 . . . . 100 LEU HG . 11090 1 1200 . 1 1 100 100 LEU C C 13 175.478 0.300 . 1 . . . . 100 LEU C . 11090 1 1201 . 1 1 100 100 LEU CA C 13 53.765 0.300 . 1 . . . . 100 LEU CA . 11090 1 1202 . 1 1 100 100 LEU CB C 13 42.741 0.300 . 1 . . . . 100 LEU CB . 11090 1 1203 . 1 1 100 100 LEU CD1 C 13 24.610 0.300 . 2 . . . . 100 LEU CD1 . 11090 1 1204 . 1 1 100 100 LEU CD2 C 13 23.212 0.300 . 2 . . . . 100 LEU CD2 . 11090 1 1205 . 1 1 100 100 LEU CG C 13 25.955 0.300 . 1 . . . . 100 LEU CG . 11090 1 1206 . 1 1 100 100 LEU N N 15 122.346 0.300 . 1 . . . . 100 LEU N . 11090 1 1207 . 1 1 101 101 ILE H H 1 8.999 0.030 . 1 . . . . 101 ILE H . 11090 1 1208 . 1 1 101 101 ILE HA H 1 4.260 0.030 . 1 . . . . 101 ILE HA . 11090 1 1209 . 1 1 101 101 ILE HB H 1 1.769 0.030 . 1 . . . . 101 ILE HB . 11090 1 1210 . 1 1 101 101 ILE HD11 H 1 0.870 0.030 . 1 . . . . 101 ILE HD1 . 11090 1 1211 . 1 1 101 101 ILE HD12 H 1 0.870 0.030 . 1 . . . . 101 ILE HD1 . 11090 1 1212 . 1 1 101 101 ILE HD13 H 1 0.870 0.030 . 1 . . . . 101 ILE HD1 . 11090 1 1213 . 1 1 101 101 ILE HG12 H 1 0.990 0.030 . 2 . . . . 101 ILE HG12 . 11090 1 1214 . 1 1 101 101 ILE HG13 H 1 1.471 0.030 . 2 . . . . 101 ILE HG13 . 11090 1 1215 . 1 1 101 101 ILE HG21 H 1 0.639 0.030 . 1 . . . . 101 ILE HG2 . 11090 1 1216 . 1 1 101 101 ILE HG22 H 1 0.639 0.030 . 1 . . . . 101 ILE HG2 . 11090 1 1217 . 1 1 101 101 ILE HG23 H 1 0.639 0.030 . 1 . . . . 101 ILE HG2 . 11090 1 1218 . 1 1 101 101 ILE C C 13 174.690 0.300 . 1 . . . . 101 ILE C . 11090 1 1219 . 1 1 101 101 ILE CA C 13 61.177 0.300 . 1 . . . . 101 ILE CA . 11090 1 1220 . 1 1 101 101 ILE CB C 13 38.798 0.300 . 1 . . . . 101 ILE CB . 11090 1 1221 . 1 1 101 101 ILE CD1 C 13 14.137 0.300 . 1 . . . . 101 ILE CD1 . 11090 1 1222 . 1 1 101 101 ILE CG1 C 13 26.955 0.300 . 1 . . . . 101 ILE CG1 . 11090 1 1223 . 1 1 101 101 ILE CG2 C 13 17.682 0.300 . 1 . . . . 101 ILE CG2 . 11090 1 1224 . 1 1 101 101 ILE N N 15 123.392 0.300 . 1 . . . . 101 ILE N . 11090 1 1225 . 1 1 102 102 VAL H H 1 9.072 0.030 . 1 . . . . 102 VAL H . 11090 1 1226 . 1 1 102 102 VAL HA H 1 3.878 0.030 . 1 . . . . 102 VAL HA . 11090 1 1227 . 1 1 102 102 VAL HB H 1 1.711 0.030 . 1 . . . . 102 VAL HB . 11090 1 1228 . 1 1 102 102 VAL HG11 H 1 0.117 0.030 . 1 . . . . 102 VAL HG1 . 11090 1 1229 . 1 1 102 102 VAL HG12 H 1 0.117 0.030 . 1 . . . . 102 VAL HG1 . 11090 1 1230 . 1 1 102 102 VAL HG13 H 1 0.117 0.030 . 1 . . . . 102 VAL HG1 . 11090 1 1231 . 1 1 102 102 VAL HG21 H 1 -0.180 0.030 . 1 . . . . 102 VAL HG2 . 11090 1 1232 . 1 1 102 102 VAL HG22 H 1 -0.180 0.030 . 1 . . . . 102 VAL HG2 . 11090 1 1233 . 1 1 102 102 VAL HG23 H 1 -0.180 0.030 . 1 . . . . 102 VAL HG2 . 11090 1 1234 . 1 1 102 102 VAL C C 13 174.247 0.300 . 1 . . . . 102 VAL C . 11090 1 1235 . 1 1 102 102 VAL CA C 13 61.890 0.300 . 1 . . . . 102 VAL CA . 11090 1 1236 . 1 1 102 102 VAL CB C 13 31.216 0.300 . 1 . . . . 102 VAL CB . 11090 1 1237 . 1 1 102 102 VAL CG1 C 13 19.506 0.300 . 2 . . . . 102 VAL CG1 . 11090 1 1238 . 1 1 102 102 VAL CG2 C 13 18.511 0.300 . 2 . . . . 102 VAL CG2 . 11090 1 1239 . 1 1 102 102 VAL N N 15 129.974 0.300 . 1 . . . . 102 VAL N . 11090 1 1240 . 1 1 103 103 CYS H H 1 8.699 0.030 . 1 . . . . 103 CYS H . 11090 1 1241 . 1 1 103 103 CYS HA H 1 4.887 0.030 . 1 . . . . 103 CYS HA . 11090 1 1242 . 1 1 103 103 CYS HB2 H 1 2.700 0.030 . 2 . . . . 103 CYS HB2 . 11090 1 1243 . 1 1 103 103 CYS HB3 H 1 2.580 0.030 . 2 . . . . 103 CYS HB3 . 11090 1 1244 . 1 1 103 103 CYS C C 13 175.434 0.300 . 1 . . . . 103 CYS C . 11090 1 1245 . 1 1 103 103 CYS CA C 13 57.118 0.300 . 1 . . . . 103 CYS CA . 11090 1 1246 . 1 1 103 103 CYS CB C 13 28.429 0.300 . 1 . . . . 103 CYS CB . 11090 1 1247 . 1 1 103 103 CYS N N 15 124.418 0.300 . 1 . . . . 103 CYS N . 11090 1 1248 . 1 1 104 104 TYR H H 1 8.697 0.030 . 1 . . . . 104 TYR H . 11090 1 1249 . 1 1 104 104 TYR HA H 1 5.502 0.030 . 1 . . . . 104 TYR HA . 11090 1 1250 . 1 1 104 104 TYR HB2 H 1 3.560 0.030 . 2 . . . . 104 TYR HB2 . 11090 1 1251 . 1 1 104 104 TYR HB3 H 1 3.089 0.030 . 2 . . . . 104 TYR HB3 . 11090 1 1252 . 1 1 104 104 TYR HD1 H 1 7.090 0.030 . 1 . . . . 104 TYR HD1 . 11090 1 1253 . 1 1 104 104 TYR HD2 H 1 7.090 0.030 . 1 . . . . 104 TYR HD2 . 11090 1 1254 . 1 1 104 104 TYR HE1 H 1 6.511 0.030 . 1 . . . . 104 TYR HE1 . 11090 1 1255 . 1 1 104 104 TYR HE2 H 1 6.511 0.030 . 1 . . . . 104 TYR HE2 . 11090 1 1256 . 1 1 104 104 TYR C C 13 178.866 0.300 . 1 . . . . 104 TYR C . 11090 1 1257 . 1 1 104 104 TYR CA C 13 57.942 0.300 . 1 . . . . 104 TYR CA . 11090 1 1258 . 1 1 104 104 TYR CB C 13 40.073 0.300 . 1 . . . . 104 TYR CB . 11090 1 1259 . 1 1 104 104 TYR CD1 C 13 132.313 0.300 . 1 . . . . 104 TYR CD1 . 11090 1 1260 . 1 1 104 104 TYR CD2 C 13 132.313 0.300 . 1 . . . . 104 TYR CD2 . 11090 1 1261 . 1 1 104 104 TYR CE1 C 13 118.139 0.300 . 1 . . . . 104 TYR CE1 . 11090 1 1262 . 1 1 104 104 TYR CE2 C 13 118.139 0.300 . 1 . . . . 104 TYR CE2 . 11090 1 1263 . 1 1 104 104 TYR N N 15 124.512 0.300 . 1 . . . . 104 TYR N . 11090 1 1264 . 1 1 105 105 ASP H H 1 9.028 0.030 . 1 . . . . 105 ASP H . 11090 1 1265 . 1 1 105 105 ASP HA H 1 4.379 0.030 . 1 . . . . 105 ASP HA . 11090 1 1266 . 1 1 105 105 ASP HB2 H 1 2.930 0.030 . 2 . . . . 105 ASP HB2 . 11090 1 1267 . 1 1 105 105 ASP HB3 H 1 2.748 0.030 . 2 . . . . 105 ASP HB3 . 11090 1 1268 . 1 1 105 105 ASP C C 13 176.992 0.300 . 1 . . . . 105 ASP C . 11090 1 1269 . 1 1 105 105 ASP CA C 13 56.783 0.300 . 1 . . . . 105 ASP CA . 11090 1 1270 . 1 1 105 105 ASP CB C 13 39.455 0.300 . 1 . . . . 105 ASP CB . 11090 1 1271 . 1 1 105 105 ASP N N 15 124.327 0.300 . 1 . . . . 105 ASP N . 11090 1 1272 . 1 1 106 106 THR H H 1 7.500 0.030 . 1 . . . . 106 THR H . 11090 1 1273 . 1 1 106 106 THR HA H 1 4.253 0.030 . 1 . . . . 106 THR HA . 11090 1 1274 . 1 1 106 106 THR HB H 1 4.603 0.030 . 1 . . . . 106 THR HB . 11090 1 1275 . 1 1 106 106 THR HG21 H 1 1.360 0.030 . 1 . . . . 106 THR HG2 . 11090 1 1276 . 1 1 106 106 THR HG22 H 1 1.360 0.030 . 1 . . . . 106 THR HG2 . 11090 1 1277 . 1 1 106 106 THR HG23 H 1 1.360 0.030 . 1 . . . . 106 THR HG2 . 11090 1 1278 . 1 1 106 106 THR C C 13 176.103 0.300 . 1 . . . . 106 THR C . 11090 1 1279 . 1 1 106 106 THR CA C 13 61.824 0.300 . 1 . . . . 106 THR CA . 11090 1 1280 . 1 1 106 106 THR CB C 13 69.551 0.300 . 1 . . . . 106 THR CB . 11090 1 1281 . 1 1 106 106 THR CG2 C 13 22.885 0.300 . 1 . . . . 106 THR CG2 . 11090 1 1282 . 1 1 106 106 THR N N 15 108.294 0.300 . 1 . . . . 106 THR N . 11090 1 1283 . 1 1 107 107 GLY H H 1 8.217 0.030 . 1 . . . . 107 GLY H . 11090 1 1284 . 1 1 107 107 GLY HA2 H 1 4.529 0.030 . 2 . . . . 107 GLY HA2 . 11090 1 1285 . 1 1 107 107 GLY HA3 H 1 3.688 0.030 . 2 . . . . 107 GLY HA3 . 11090 1 1286 . 1 1 107 107 GLY C C 13 174.300 0.300 . 1 . . . . 107 GLY C . 11090 1 1287 . 1 1 107 107 GLY CA C 13 45.132 0.300 . 1 . . . . 107 GLY CA . 11090 1 1288 . 1 1 107 107 GLY N N 15 109.979 0.300 . 1 . . . . 107 GLY N . 11090 1 1289 . 1 1 108 108 GLU H H 1 8.242 0.030 . 1 . . . . 108 GLU H . 11090 1 1290 . 1 1 108 108 GLU HA H 1 4.273 0.030 . 1 . . . . 108 GLU HA . 11090 1 1291 . 1 1 108 108 GLU HB2 H 1 1.970 0.030 . 1 . . . . 108 GLU HB2 . 11090 1 1292 . 1 1 108 108 GLU HB3 H 1 1.970 0.030 . 1 . . . . 108 GLU HB3 . 11090 1 1293 . 1 1 108 108 GLU HG2 H 1 2.275 0.030 . 1 . . . . 108 GLU HG2 . 11090 1 1294 . 1 1 108 108 GLU HG3 H 1 2.275 0.030 . 1 . . . . 108 GLU HG3 . 11090 1 1295 . 1 1 108 108 GLU C C 13 175.030 0.300 . 1 . . . . 108 GLU C . 11090 1 1296 . 1 1 108 108 GLU CA C 13 57.564 0.300 . 1 . . . . 108 GLU CA . 11090 1 1297 . 1 1 108 108 GLU CB C 13 30.175 0.300 . 1 . . . . 108 GLU CB . 11090 1 1298 . 1 1 108 108 GLU CG C 13 36.545 0.300 . 1 . . . . 108 GLU CG . 11090 1 1299 . 1 1 108 108 GLU N N 15 122.150 0.300 . 1 . . . . 108 GLU N . 11090 1 1300 . 1 1 109 109 LYS H H 1 8.240 0.030 . 1 . . . . 109 LYS H . 11090 1 1301 . 1 1 109 109 LYS HA H 1 5.584 0.030 . 1 . . . . 109 LYS HA . 11090 1 1302 . 1 1 109 109 LYS HB2 H 1 1.459 0.030 . 2 . . . . 109 LYS HB2 . 11090 1 1303 . 1 1 109 109 LYS HB3 H 1 1.220 0.030 . 2 . . . . 109 LYS HB3 . 11090 1 1304 . 1 1 109 109 LYS HD2 H 1 1.590 0.030 . 1 . . . . 109 LYS HD2 . 11090 1 1305 . 1 1 109 109 LYS HD3 H 1 1.590 0.030 . 1 . . . . 109 LYS HD3 . 11090 1 1306 . 1 1 109 109 LYS HE2 H 1 2.990 0.030 . 1 . . . . 109 LYS HE2 . 11090 1 1307 . 1 1 109 109 LYS HE3 H 1 2.990 0.030 . 1 . . . . 109 LYS HE3 . 11090 1 1308 . 1 1 109 109 LYS HG2 H 1 1.389 0.030 . 2 . . . . 109 LYS HG2 . 11090 1 1309 . 1 1 109 109 LYS HG3 H 1 1.299 0.030 . 2 . . . . 109 LYS HG3 . 11090 1 1310 . 1 1 109 109 LYS C C 13 176.321 0.300 . 1 . . . . 109 LYS C . 11090 1 1311 . 1 1 109 109 LYS CA C 13 54.736 0.300 . 1 . . . . 109 LYS CA . 11090 1 1312 . 1 1 109 109 LYS CB C 13 36.659 0.300 . 1 . . . . 109 LYS CB . 11090 1 1313 . 1 1 109 109 LYS CD C 13 29.627 0.300 . 1 . . . . 109 LYS CD . 11090 1 1314 . 1 1 109 109 LYS CE C 13 42.458 0.300 . 1 . . . . 109 LYS CE . 11090 1 1315 . 1 1 109 109 LYS CG C 13 25.215 0.300 . 1 . . . . 109 LYS CG . 11090 1 1316 . 1 1 109 109 LYS N N 15 121.119 0.300 . 1 . . . . 109 LYS N . 11090 1 1317 . 1 1 110 110 VAL H H 1 8.610 0.030 . 1 . . . . 110 VAL H . 11090 1 1318 . 1 1 110 110 VAL HA H 1 4.218 0.030 . 1 . . . . 110 VAL HA . 11090 1 1319 . 1 1 110 110 VAL HB H 1 1.801 0.030 . 1 . . . . 110 VAL HB . 11090 1 1320 . 1 1 110 110 VAL HG11 H 1 0.903 0.030 . 1 . . . . 110 VAL HG1 . 11090 1 1321 . 1 1 110 110 VAL HG12 H 1 0.903 0.030 . 1 . . . . 110 VAL HG1 . 11090 1 1322 . 1 1 110 110 VAL HG13 H 1 0.903 0.030 . 1 . . . . 110 VAL HG1 . 11090 1 1323 . 1 1 110 110 VAL HG21 H 1 0.903 0.030 . 1 . . . . 110 VAL HG2 . 11090 1 1324 . 1 1 110 110 VAL HG22 H 1 0.903 0.030 . 1 . . . . 110 VAL HG2 . 11090 1 1325 . 1 1 110 110 VAL HG23 H 1 0.903 0.030 . 1 . . . . 110 VAL HG2 . 11090 1 1326 . 1 1 110 110 VAL C C 13 173.028 0.300 . 1 . . . . 110 VAL C . 11090 1 1327 . 1 1 110 110 VAL CA C 13 60.603 0.300 . 1 . . . . 110 VAL CA . 11090 1 1328 . 1 1 110 110 VAL CB C 13 35.709 0.300 . 1 . . . . 110 VAL CB . 11090 1 1329 . 1 1 110 110 VAL CG1 C 13 20.995 0.300 . 2 . . . . 110 VAL CG1 . 11090 1 1330 . 1 1 110 110 VAL CG2 C 13 20.995 0.300 . 2 . . . . 110 VAL CG2 . 11090 1 1331 . 1 1 110 110 VAL N N 15 120.235 0.300 . 1 . . . . 110 VAL N . 11090 1 1332 . 1 1 111 111 PHE H H 1 8.492 0.030 . 1 . . . . 111 PHE H . 11090 1 1333 . 1 1 111 111 PHE HA H 1 5.494 0.030 . 1 . . . . 111 PHE HA . 11090 1 1334 . 1 1 111 111 PHE HB2 H 1 2.863 0.030 . 1 . . . . 111 PHE HB2 . 11090 1 1335 . 1 1 111 111 PHE HB3 H 1 2.863 0.030 . 1 . . . . 111 PHE HB3 . 11090 1 1336 . 1 1 111 111 PHE HD1 H 1 7.090 0.030 . 1 . . . . 111 PHE HD1 . 11090 1 1337 . 1 1 111 111 PHE HD2 H 1 7.090 0.030 . 1 . . . . 111 PHE HD2 . 11090 1 1338 . 1 1 111 111 PHE HE1 H 1 7.248 0.030 . 1 . . . . 111 PHE HE1 . 11090 1 1339 . 1 1 111 111 PHE HE2 H 1 7.248 0.030 . 1 . . . . 111 PHE HE2 . 11090 1 1340 . 1 1 111 111 PHE HZ H 1 7.213 0.030 . 1 . . . . 111 PHE HZ . 11090 1 1341 . 1 1 111 111 PHE C C 13 175.944 0.300 . 1 . . . . 111 PHE C . 11090 1 1342 . 1 1 111 111 PHE CA C 13 55.619 0.300 . 1 . . . . 111 PHE CA . 11090 1 1343 . 1 1 111 111 PHE CB C 13 42.097 0.300 . 1 . . . . 111 PHE CB . 11090 1 1344 . 1 1 111 111 PHE CD1 C 13 131.705 0.300 . 1 . . . . 111 PHE CD1 . 11090 1 1345 . 1 1 111 111 PHE CD2 C 13 131.705 0.300 . 1 . . . . 111 PHE CD2 . 11090 1 1346 . 1 1 111 111 PHE CE1 C 13 131.273 0.300 . 1 . . . . 111 PHE CE1 . 11090 1 1347 . 1 1 111 111 PHE CE2 C 13 131.273 0.300 . 1 . . . . 111 PHE CE2 . 11090 1 1348 . 1 1 111 111 PHE CZ C 13 129.551 0.300 . 1 . . . . 111 PHE CZ . 11090 1 1349 . 1 1 111 111 PHE N N 15 121.322 0.300 . 1 . . . . 111 PHE N . 11090 1 1350 . 1 1 112 112 VAL H H 1 8.588 0.030 . 1 . . . . 112 VAL H . 11090 1 1351 . 1 1 112 112 VAL HA H 1 4.209 0.030 . 1 . . . . 112 VAL HA . 11090 1 1352 . 1 1 112 112 VAL HB H 1 1.668 0.030 . 1 . . . . 112 VAL HB . 11090 1 1353 . 1 1 112 112 VAL HG11 H 1 0.650 0.030 . 1 . . . . 112 VAL HG1 . 11090 1 1354 . 1 1 112 112 VAL HG12 H 1 0.650 0.030 . 1 . . . . 112 VAL HG1 . 11090 1 1355 . 1 1 112 112 VAL HG13 H 1 0.650 0.030 . 1 . . . . 112 VAL HG1 . 11090 1 1356 . 1 1 112 112 VAL HG21 H 1 0.609 0.030 . 1 . . . . 112 VAL HG2 . 11090 1 1357 . 1 1 112 112 VAL HG22 H 1 0.609 0.030 . 1 . . . . 112 VAL HG2 . 11090 1 1358 . 1 1 112 112 VAL HG23 H 1 0.609 0.030 . 1 . . . . 112 VAL HG2 . 11090 1 1359 . 1 1 112 112 VAL C C 13 176.357 0.300 . 1 . . . . 112 VAL C . 11090 1 1360 . 1 1 112 112 VAL CA C 13 60.771 0.300 . 1 . . . . 112 VAL CA . 11090 1 1361 . 1 1 112 112 VAL CB C 13 34.746 0.300 . 1 . . . . 112 VAL CB . 11090 1 1362 . 1 1 112 112 VAL CG1 C 13 19.563 0.300 . 2 . . . . 112 VAL CG1 . 11090 1 1363 . 1 1 112 112 VAL CG2 C 13 19.398 0.300 . 2 . . . . 112 VAL CG2 . 11090 1 1364 . 1 1 112 112 VAL N N 15 122.668 0.300 . 1 . . . . 112 VAL N . 11090 1 1365 . 1 1 113 113 SER H H 1 8.459 0.030 . 1 . . . . 113 SER H . 11090 1 1366 . 1 1 113 113 SER HA H 1 4.470 0.030 . 1 . . . . 113 SER HA . 11090 1 1367 . 1 1 113 113 SER HB2 H 1 3.890 0.030 . 1 . . . . 113 SER HB2 . 11090 1 1368 . 1 1 113 113 SER HB3 H 1 3.890 0.030 . 1 . . . . 113 SER HB3 . 11090 1 1369 . 1 1 113 113 SER C C 13 171.577 0.300 . 1 . . . . 113 SER C . 11090 1 1370 . 1 1 113 113 SER CA C 13 60.524 0.300 . 1 . . . . 113 SER CA . 11090 1 1371 . 1 1 113 113 SER CB C 13 63.899 0.300 . 1 . . . . 113 SER CB . 11090 1 1372 . 1 1 113 113 SER N N 15 124.541 0.300 . 1 . . . . 113 SER N . 11090 1 1373 . 1 1 114 114 LEU H H 1 8.049 0.030 . 1 . . . . 114 LEU H . 11090 1 1374 . 1 1 114 114 LEU HA H 1 4.993 0.030 . 1 . . . . 114 LEU HA . 11090 1 1375 . 1 1 114 114 LEU HB2 H 1 0.173 0.030 . 2 . . . . 114 LEU HB2 . 11090 1 1376 . 1 1 114 114 LEU HB3 H 1 0.130 0.030 . 2 . . . . 114 LEU HB3 . 11090 1 1377 . 1 1 114 114 LEU HD11 H 1 0.071 0.030 . 1 . . . . 114 LEU HD1 . 11090 1 1378 . 1 1 114 114 LEU HD12 H 1 0.071 0.030 . 1 . . . . 114 LEU HD1 . 11090 1 1379 . 1 1 114 114 LEU HD13 H 1 0.071 0.030 . 1 . . . . 114 LEU HD1 . 11090 1 1380 . 1 1 114 114 LEU HD21 H 1 0.620 0.030 . 1 . . . . 114 LEU HD2 . 11090 1 1381 . 1 1 114 114 LEU HD22 H 1 0.620 0.030 . 1 . . . . 114 LEU HD2 . 11090 1 1382 . 1 1 114 114 LEU HD23 H 1 0.620 0.030 . 1 . . . . 114 LEU HD2 . 11090 1 1383 . 1 1 114 114 LEU HG H 1 1.150 0.030 . 1 . . . . 114 LEU HG . 11090 1 1384 . 1 1 114 114 LEU C C 13 175.662 0.300 . 1 . . . . 114 LEU C . 11090 1 1385 . 1 1 114 114 LEU CA C 13 52.812 0.300 . 1 . . . . 114 LEU CA . 11090 1 1386 . 1 1 114 114 LEU CB C 13 44.299 0.300 . 1 . . . . 114 LEU CB . 11090 1 1387 . 1 1 114 114 LEU CD1 C 13 26.174 0.300 . 2 . . . . 114 LEU CD1 . 11090 1 1388 . 1 1 114 114 LEU CD2 C 13 24.610 0.300 . 2 . . . . 114 LEU CD2 . 11090 1 1389 . 1 1 114 114 LEU CG C 13 25.721 0.300 . 1 . . . . 114 LEU CG . 11090 1 1390 . 1 1 114 114 LEU N N 15 123.151 0.300 . 1 . . . . 114 LEU N . 11090 1 1391 . 1 1 115 115 TYR H H 1 8.129 0.030 . 1 . . . . 115 TYR H . 11090 1 1392 . 1 1 115 115 TYR HA H 1 5.490 0.030 . 1 . . . . 115 TYR HA . 11090 1 1393 . 1 1 115 115 TYR HB2 H 1 3.051 0.030 . 2 . . . . 115 TYR HB2 . 11090 1 1394 . 1 1 115 115 TYR HB3 H 1 2.941 0.030 . 2 . . . . 115 TYR HB3 . 11090 1 1395 . 1 1 115 115 TYR HD1 H 1 7.089 0.030 . 1 . . . . 115 TYR HD1 . 11090 1 1396 . 1 1 115 115 TYR HD2 H 1 7.089 0.030 . 1 . . . . 115 TYR HD2 . 11090 1 1397 . 1 1 115 115 TYR HE1 H 1 6.679 0.030 . 1 . . . . 115 TYR HE1 . 11090 1 1398 . 1 1 115 115 TYR HE2 H 1 6.679 0.030 . 1 . . . . 115 TYR HE2 . 11090 1 1399 . 1 1 115 115 TYR C C 13 174.220 0.300 . 1 . . . . 115 TYR C . 11090 1 1400 . 1 1 115 115 TYR CA C 13 56.659 0.300 . 1 . . . . 115 TYR CA . 11090 1 1401 . 1 1 115 115 TYR CB C 13 42.622 0.300 . 1 . . . . 115 TYR CB . 11090 1 1402 . 1 1 115 115 TYR CD1 C 13 133.476 0.300 . 1 . . . . 115 TYR CD1 . 11090 1 1403 . 1 1 115 115 TYR CD2 C 13 133.476 0.300 . 1 . . . . 115 TYR CD2 . 11090 1 1404 . 1 1 115 115 TYR CE1 C 13 117.666 0.300 . 1 . . . . 115 TYR CE1 . 11090 1 1405 . 1 1 115 115 TYR CE2 C 13 117.666 0.300 . 1 . . . . 115 TYR CE2 . 11090 1 1406 . 1 1 115 115 TYR N N 15 119.430 0.300 . 1 . . . . 115 TYR N . 11090 1 1407 . 1 1 116 116 GLY H H 1 8.281 0.030 . 1 . . . . 116 GLY H . 11090 1 1408 . 1 1 116 116 GLY HA2 H 1 4.141 0.030 . 2 . . . . 116 GLY HA2 . 11090 1 1409 . 1 1 116 116 GLY HA3 H 1 3.050 0.030 . 2 . . . . 116 GLY HA3 . 11090 1 1410 . 1 1 116 116 GLY C C 13 169.262 0.300 . 1 . . . . 116 GLY C . 11090 1 1411 . 1 1 116 116 GLY CA C 13 46.247 0.300 . 1 . . . . 116 GLY CA . 11090 1 1412 . 1 1 116 116 GLY N N 15 109.567 0.300 . 1 . . . . 116 GLY N . 11090 1 1413 . 1 1 117 117 ALA H H 1 8.489 0.030 . 1 . . . . 117 ALA H . 11090 1 1414 . 1 1 117 117 ALA HA H 1 5.560 0.030 . 1 . . . . 117 ALA HA . 11090 1 1415 . 1 1 117 117 ALA HB1 H 1 1.489 0.030 . 1 . . . . 117 ALA HB . 11090 1 1416 . 1 1 117 117 ALA HB2 H 1 1.489 0.030 . 1 . . . . 117 ALA HB . 11090 1 1417 . 1 1 117 117 ALA HB3 H 1 1.489 0.030 . 1 . . . . 117 ALA HB . 11090 1 1418 . 1 1 117 117 ALA C C 13 175.639 0.300 . 1 . . . . 117 ALA C . 11090 1 1419 . 1 1 117 117 ALA CA C 13 50.641 0.300 . 1 . . . . 117 ALA CA . 11090 1 1420 . 1 1 117 117 ALA CB C 13 21.819 0.300 . 1 . . . . 117 ALA CB . 11090 1 1421 . 1 1 117 117 ALA N N 15 124.315 0.300 . 1 . . . . 117 ALA N . 11090 1 1422 . 1 1 118 118 ALA H H 1 9.271 0.030 . 1 . . . . 118 ALA H . 11090 1 1423 . 1 1 118 118 ALA HA H 1 6.007 0.030 . 1 . . . . 118 ALA HA . 11090 1 1424 . 1 1 118 118 ALA HB1 H 1 1.403 0.030 . 1 . . . . 118 ALA HB . 11090 1 1425 . 1 1 118 118 ALA HB2 H 1 1.403 0.030 . 1 . . . . 118 ALA HB . 11090 1 1426 . 1 1 118 118 ALA HB3 H 1 1.403 0.030 . 1 . . . . 118 ALA HB . 11090 1 1427 . 1 1 118 118 ALA C C 13 177.848 0.300 . 1 . . . . 118 ALA C . 11090 1 1428 . 1 1 118 118 ALA CA C 13 49.610 0.300 . 1 . . . . 118 ALA CA . 11090 1 1429 . 1 1 118 118 ALA CB C 13 23.958 0.300 . 1 . . . . 118 ALA CB . 11090 1 1430 . 1 1 118 118 ALA N N 15 123.388 0.300 . 1 . . . . 118 ALA N . 11090 1 1431 . 1 1 119 119 ILE H H 1 8.370 0.030 . 1 . . . . 119 ILE H . 11090 1 1432 . 1 1 119 119 ILE HA H 1 4.754 0.030 . 1 . . . . 119 ILE HA . 11090 1 1433 . 1 1 119 119 ILE HB H 1 1.861 0.030 . 1 . . . . 119 ILE HB . 11090 1 1434 . 1 1 119 119 ILE HD11 H 1 0.800 0.030 . 1 . . . . 119 ILE HD1 . 11090 1 1435 . 1 1 119 119 ILE HD12 H 1 0.800 0.030 . 1 . . . . 119 ILE HD1 . 11090 1 1436 . 1 1 119 119 ILE HD13 H 1 0.800 0.030 . 1 . . . . 119 ILE HD1 . 11090 1 1437 . 1 1 119 119 ILE HG12 H 1 1.240 0.030 . 2 . . . . 119 ILE HG12 . 11090 1 1438 . 1 1 119 119 ILE HG13 H 1 0.812 0.030 . 2 . . . . 119 ILE HG13 . 11090 1 1439 . 1 1 119 119 ILE HG21 H 1 0.837 0.030 . 1 . . . . 119 ILE HG2 . 11090 1 1440 . 1 1 119 119 ILE HG22 H 1 0.837 0.030 . 1 . . . . 119 ILE HG2 . 11090 1 1441 . 1 1 119 119 ILE HG23 H 1 0.837 0.030 . 1 . . . . 119 ILE HG2 . 11090 1 1442 . 1 1 119 119 ILE C C 13 174.196 0.300 . 1 . . . . 119 ILE C . 11090 1 1443 . 1 1 119 119 ILE CA C 13 59.306 0.300 . 1 . . . . 119 ILE CA . 11090 1 1444 . 1 1 119 119 ILE CB C 13 42.611 0.300 . 1 . . . . 119 ILE CB . 11090 1 1445 . 1 1 119 119 ILE CD1 C 13 13.857 0.300 . 1 . . . . 119 ILE CD1 . 11090 1 1446 . 1 1 119 119 ILE CG1 C 13 25.737 0.300 . 1 . . . . 119 ILE CG1 . 11090 1 1447 . 1 1 119 119 ILE CG2 C 13 18.111 0.300 . 1 . . . . 119 ILE CG2 . 11090 1 1448 . 1 1 119 119 ILE N N 15 117.812 0.300 . 1 . . . . 119 ILE N . 11090 1 1449 . 1 1 120 120 ASP H H 1 8.610 0.030 . 1 . . . . 120 ASP H . 11090 1 1450 . 1 1 120 120 ASP HA H 1 4.720 0.030 . 1 . . . . 120 ASP HA . 11090 1 1451 . 1 1 120 120 ASP HB2 H 1 2.719 0.030 . 2 . . . . 120 ASP HB2 . 11090 1 1452 . 1 1 120 120 ASP HB3 H 1 2.411 0.030 . 2 . . . . 120 ASP HB3 . 11090 1 1453 . 1 1 120 120 ASP C C 13 175.995 0.300 . 1 . . . . 120 ASP C . 11090 1 1454 . 1 1 120 120 ASP CA C 13 53.959 0.300 . 1 . . . . 120 ASP CA . 11090 1 1455 . 1 1 120 120 ASP CB C 13 41.656 0.300 . 1 . . . . 120 ASP CB . 11090 1 1456 . 1 1 120 120 ASP N N 15 122.403 0.300 . 1 . . . . 120 ASP N . 11090 1 1457 . 1 1 121 121 MET H H 1 8.432 0.030 . 1 . . . . 121 MET H . 11090 1 1458 . 1 1 121 121 MET HA H 1 4.508 0.030 . 1 . . . . 121 MET HA . 11090 1 1459 . 1 1 121 121 MET HB2 H 1 2.150 0.030 . 2 . . . . 121 MET HB2 . 11090 1 1460 . 1 1 121 121 MET HB3 H 1 1.893 0.030 . 2 . . . . 121 MET HB3 . 11090 1 1461 . 1 1 121 121 MET HE1 H 1 2.001 0.030 . 1 . . . . 121 MET HE . 11090 1 1462 . 1 1 121 121 MET HE2 H 1 2.001 0.030 . 1 . . . . 121 MET HE . 11090 1 1463 . 1 1 121 121 MET HE3 H 1 2.001 0.030 . 1 . . . . 121 MET HE . 11090 1 1464 . 1 1 121 121 MET HG2 H 1 2.541 0.030 . 2 . . . . 121 MET HG2 . 11090 1 1465 . 1 1 121 121 MET HG3 H 1 2.489 0.030 . 2 . . . . 121 MET HG3 . 11090 1 1466 . 1 1 121 121 MET C C 13 175.011 0.300 . 1 . . . . 121 MET C . 11090 1 1467 . 1 1 121 121 MET CA C 13 55.230 0.300 . 1 . . . . 121 MET CA . 11090 1 1468 . 1 1 121 121 MET CB C 13 33.081 0.300 . 1 . . . . 121 MET CB . 11090 1 1469 . 1 1 121 121 MET CE C 13 16.852 0.300 . 1 . . . . 121 MET CE . 11090 1 1470 . 1 1 121 121 MET CG C 13 32.177 0.300 . 1 . . . . 121 MET CG . 11090 1 1471 . 1 1 121 121 MET N N 15 122.569 0.300 . 1 . . . . 121 MET N . 11090 1 1472 . 1 1 122 122 ASN H H 1 8.121 0.030 . 1 . . . . 122 ASN H . 11090 1 1473 . 1 1 122 122 ASN HA H 1 4.430 0.030 . 1 . . . . 122 ASN HA . 11090 1 1474 . 1 1 122 122 ASN HB2 H 1 2.679 0.030 . 2 . . . . 122 ASN HB2 . 11090 1 1475 . 1 1 122 122 ASN HB3 H 1 2.761 0.030 . 2 . . . . 122 ASN HB3 . 11090 1 1476 . 1 1 122 122 ASN HD21 H 1 7.583 0.030 . 2 . . . . 122 ASN HD21 . 11090 1 1477 . 1 1 122 122 ASN HD22 H 1 6.790 0.030 . 2 . . . . 122 ASN HD22 . 11090 1 1478 . 1 1 122 122 ASN C C 13 179.481 0.300 . 1 . . . . 122 ASN C . 11090 1 1479 . 1 1 122 122 ASN CA C 13 55.088 0.300 . 1 . . . . 122 ASN CA . 11090 1 1480 . 1 1 122 122 ASN CB C 13 40.401 0.300 . 1 . . . . 122 ASN CB . 11090 1 1481 . 1 1 122 122 ASN N N 15 125.412 0.300 . 1 . . . . 122 ASN N . 11090 1 1482 . 1 1 122 122 ASN ND2 N 15 113.319 0.300 . 1 . . . . 122 ASN ND2 . 11090 1 stop_ save_