data_11202 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11202 _Entry.Title ; Solution structure of the PDZ domain of Spinophilin/NeurabinII protein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-07-22 _Entry.Accession_date 2010-07-23 _Entry.Last_release_date 2011-07-21 _Entry.Original_release_date 2011-07-21 _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 X. Qin . . . 11202 2 F. Hayashi . . . 11202 3 S. Yokoyama . . . 11202 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)' . 11202 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11202 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 433 11202 '15N chemical shifts' 113 11202 '1H chemical shifts' 711 11202 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 . . 2011-07-21 2010-07-22 original author . 11202 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1WF8 'BMRB Entry Tracking System' 11202 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11202 _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 PDZ domain of Spinophilin/NeurabinII protein' _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 X. Qin . . . 11202 1 2 F. Hayashi . . . 11202 1 3 S. Yokoyama . . . 11202 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11202 _Assembly.ID 1 _Assembly.Name Neurabin-I _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 'PDZ domain' 1 $entity_1 A . yes native no no . . . 11202 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 1wf8 . . . . . . 11202 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11202 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'PDZ domain' _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 ; GSSGSSGLELFPVELEKDED GLGISIIGMGVGADAGLEKL GIFVKTVTEGGAAQRDGRIQ VNDQIVEVDGISLVGVTQNF AATVLRNTKGNVRFVIGREK PSGPSSG ; _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 107 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _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 1WF8 . "Solution Structure Of The Pdz Domain Of SpinophilinNEURABINII PROTEIN" . . . . . 100.00 107 100.00 100.00 1.34e-65 . . . . 11202 1 2 no PDB 2FN5 . "Nmr Structure Of The Neurabin Pdz Domain (502-594)" . . . . . 85.98 94 98.91 100.00 1.51e-54 . . . . 11202 1 3 no PDB 3HVQ . "Crystal Structure Of A Complex Between Protein Phosphatase 1 Alpha (Pp1) And The Pp1 Binding And Pdz Domains Of Neurabin" . . . . . 85.98 170 100.00 100.00 8.60e-55 . . . . 11202 1 4 no DBJ BAA86536 . "KIAA1222 protein [Homo sapiens]" . . . . . 87.85 742 100.00 100.00 1.50e-54 . . . . 11202 1 5 no DBJ BAC77245 . "neural tissue-specific F-actin binding protein [Mus musculus]" . . . . . 87.85 1095 98.94 100.00 2.58e-53 . . . . 11202 1 6 no DBJ BAE22449 . "unnamed protein product [Mus musculus]" . . . . . 87.85 642 98.94 100.00 3.12e-54 . . . . 11202 1 7 no DBJ BAE23620 . "unnamed protein product [Mus musculus]" . . . . . 87.85 1042 98.94 100.00 3.56e-53 . . . . 11202 1 8 no GB AAC53454 . "neurabin [Rattus norvegicus]" . . . . . 87.85 1095 100.00 100.00 9.91e-54 . . . . 11202 1 9 no GB AAH53748 . "Ppp1r9a protein [Mus musculus]" . . . . . 87.85 969 98.94 100.00 4.10e-53 . . . . 11202 1 10 no GB AAI18112 . "Protein phosphatase 1, regulatory (inhibitor) subunit 9A [Bos taurus]" . . . . . 87.85 647 100.00 100.00 9.01e-55 . . . . 11202 1 11 no GB AAI30450 . "PPP1R9A protein [Homo sapiens]" . . . . . 87.85 1253 100.00 100.00 1.42e-50 . . . . 11202 1 12 no GB AAI44110 . "PPP1R9A protein [Homo sapiens]" . . . . . 87.85 1090 100.00 100.00 7.77e-54 . . . . 11202 1 13 no REF NP_001069621 . "neurabin-1 [Bos taurus]" . . . . . 87.85 1097 100.00 100.00 7.80e-54 . . . . 11202 1 14 no REF NP_001159632 . "neurabin-1 isoform 1 [Homo sapiens]" . . . . . 87.85 1374 100.00 100.00 6.62e-51 . . . . 11202 1 15 no REF NP_001159633 . "neurabin-1 isoform 2 [Homo sapiens]" . . . . . 87.85 1296 100.00 100.00 1.07e-53 . . . . 11202 1 16 no REF NP_001159634 . "neurabin-1 isoform 3 [Homo sapiens]" . . . . . 87.85 1253 100.00 100.00 1.26e-50 . . . . 11202 1 17 no REF NP_001159635 . "neurabin-1 isoform 5 [Homo sapiens]" . . . . . 87.85 1090 100.00 100.00 7.77e-54 . . . . 11202 1 18 no SP O35867 . "RecName: Full=Neurabin-1; AltName: Full=Neurabin-I; AltName: Full=Neural tissue-specific F-actin-binding protein I; AltName: Fu" . . . . . 87.85 1095 100.00 100.00 9.91e-54 . . . . 11202 1 19 no SP Q9ULJ8 . "RecName: Full=Neurabin-1; AltName: Full=Neurabin-I; AltName: Full=Neural tissue-specific F-actin-binding protein I; AltName: Fu" . . . . . 87.85 1098 100.00 100.00 7.60e-54 . . . . 11202 1 20 no TPG DAA30807 . "TPA: protein phosphatase 1, regulatory (inhibitor) subunit 9A [Bos taurus]" . . . . . 87.85 1312 100.00 100.00 9.73e-54 . . . . 11202 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'PDZ domain' . 11202 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 . 11202 1 2 . SER . 11202 1 3 . SER . 11202 1 4 . GLY . 11202 1 5 . SER . 11202 1 6 . SER . 11202 1 7 . GLY . 11202 1 8 . LEU . 11202 1 9 . GLU . 11202 1 10 . LEU . 11202 1 11 . PHE . 11202 1 12 . PRO . 11202 1 13 . VAL . 11202 1 14 . GLU . 11202 1 15 . LEU . 11202 1 16 . GLU . 11202 1 17 . LYS . 11202 1 18 . ASP . 11202 1 19 . GLU . 11202 1 20 . ASP . 11202 1 21 . GLY . 11202 1 22 . LEU . 11202 1 23 . GLY . 11202 1 24 . ILE . 11202 1 25 . SER . 11202 1 26 . ILE . 11202 1 27 . ILE . 11202 1 28 . GLY . 11202 1 29 . MET . 11202 1 30 . GLY . 11202 1 31 . VAL . 11202 1 32 . GLY . 11202 1 33 . ALA . 11202 1 34 . ASP . 11202 1 35 . ALA . 11202 1 36 . GLY . 11202 1 37 . LEU . 11202 1 38 . GLU . 11202 1 39 . LYS . 11202 1 40 . LEU . 11202 1 41 . GLY . 11202 1 42 . ILE . 11202 1 43 . PHE . 11202 1 44 . VAL . 11202 1 45 . LYS . 11202 1 46 . THR . 11202 1 47 . VAL . 11202 1 48 . THR . 11202 1 49 . GLU . 11202 1 50 . GLY . 11202 1 51 . GLY . 11202 1 52 . ALA . 11202 1 53 . ALA . 11202 1 54 . GLN . 11202 1 55 . ARG . 11202 1 56 . ASP . 11202 1 57 . GLY . 11202 1 58 . ARG . 11202 1 59 . ILE . 11202 1 60 . GLN . 11202 1 61 . VAL . 11202 1 62 . ASN . 11202 1 63 . ASP . 11202 1 64 . GLN . 11202 1 65 . ILE . 11202 1 66 . VAL . 11202 1 67 . GLU . 11202 1 68 . VAL . 11202 1 69 . ASP . 11202 1 70 . GLY . 11202 1 71 . ILE . 11202 1 72 . SER . 11202 1 73 . LEU . 11202 1 74 . VAL . 11202 1 75 . GLY . 11202 1 76 . VAL . 11202 1 77 . THR . 11202 1 78 . GLN . 11202 1 79 . ASN . 11202 1 80 . PHE . 11202 1 81 . ALA . 11202 1 82 . ALA . 11202 1 83 . THR . 11202 1 84 . VAL . 11202 1 85 . LEU . 11202 1 86 . ARG . 11202 1 87 . ASN . 11202 1 88 . THR . 11202 1 89 . LYS . 11202 1 90 . GLY . 11202 1 91 . ASN . 11202 1 92 . VAL . 11202 1 93 . ARG . 11202 1 94 . PHE . 11202 1 95 . VAL . 11202 1 96 . ILE . 11202 1 97 . GLY . 11202 1 98 . ARG . 11202 1 99 . GLU . 11202 1 100 . LYS . 11202 1 101 . PRO . 11202 1 102 . SER . 11202 1 103 . GLY . 11202 1 104 . PRO . 11202 1 105 . SER . 11202 1 106 . SER . 11202 1 107 . GLY . 11202 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 11202 1 . SER 2 2 11202 1 . SER 3 3 11202 1 . GLY 4 4 11202 1 . SER 5 5 11202 1 . SER 6 6 11202 1 . GLY 7 7 11202 1 . LEU 8 8 11202 1 . GLU 9 9 11202 1 . LEU 10 10 11202 1 . PHE 11 11 11202 1 . PRO 12 12 11202 1 . VAL 13 13 11202 1 . GLU 14 14 11202 1 . LEU 15 15 11202 1 . GLU 16 16 11202 1 . LYS 17 17 11202 1 . ASP 18 18 11202 1 . GLU 19 19 11202 1 . ASP 20 20 11202 1 . GLY 21 21 11202 1 . LEU 22 22 11202 1 . GLY 23 23 11202 1 . ILE 24 24 11202 1 . SER 25 25 11202 1 . ILE 26 26 11202 1 . ILE 27 27 11202 1 . GLY 28 28 11202 1 . MET 29 29 11202 1 . GLY 30 30 11202 1 . VAL 31 31 11202 1 . GLY 32 32 11202 1 . ALA 33 33 11202 1 . ASP 34 34 11202 1 . ALA 35 35 11202 1 . GLY 36 36 11202 1 . LEU 37 37 11202 1 . GLU 38 38 11202 1 . LYS 39 39 11202 1 . LEU 40 40 11202 1 . GLY 41 41 11202 1 . ILE 42 42 11202 1 . PHE 43 43 11202 1 . VAL 44 44 11202 1 . LYS 45 45 11202 1 . THR 46 46 11202 1 . VAL 47 47 11202 1 . THR 48 48 11202 1 . GLU 49 49 11202 1 . GLY 50 50 11202 1 . GLY 51 51 11202 1 . ALA 52 52 11202 1 . ALA 53 53 11202 1 . GLN 54 54 11202 1 . ARG 55 55 11202 1 . ASP 56 56 11202 1 . GLY 57 57 11202 1 . ARG 58 58 11202 1 . ILE 59 59 11202 1 . GLN 60 60 11202 1 . VAL 61 61 11202 1 . ASN 62 62 11202 1 . ASP 63 63 11202 1 . GLN 64 64 11202 1 . ILE 65 65 11202 1 . VAL 66 66 11202 1 . GLU 67 67 11202 1 . VAL 68 68 11202 1 . ASP 69 69 11202 1 . GLY 70 70 11202 1 . ILE 71 71 11202 1 . SER 72 72 11202 1 . LEU 73 73 11202 1 . VAL 74 74 11202 1 . GLY 75 75 11202 1 . VAL 76 76 11202 1 . THR 77 77 11202 1 . GLN 78 78 11202 1 . ASN 79 79 11202 1 . PHE 80 80 11202 1 . ALA 81 81 11202 1 . ALA 82 82 11202 1 . THR 83 83 11202 1 . VAL 84 84 11202 1 . LEU 85 85 11202 1 . ARG 86 86 11202 1 . ASN 87 87 11202 1 . THR 88 88 11202 1 . LYS 89 89 11202 1 . GLY 90 90 11202 1 . ASN 91 91 11202 1 . VAL 92 92 11202 1 . ARG 93 93 11202 1 . PHE 94 94 11202 1 . VAL 95 95 11202 1 . ILE 96 96 11202 1 . GLY 97 97 11202 1 . ARG 98 98 11202 1 . GLU 99 99 11202 1 . LYS 100 100 11202 1 . PRO 101 101 11202 1 . SER 102 102 11202 1 . GLY 103 103 11202 1 . PRO 104 104 11202 1 . SER 105 105 11202 1 . SER 106 106 11202 1 . GLY 107 107 11202 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 11202 _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 . . . . . . . . . . . . . . . . . . . . . 11202 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 11202 _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 . . . . . . . . . . . . . plasmid . . P021030-40 . . . . . . 11202 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11202 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.05mM 13C, 15N-labeled {protein;} 20mM {PiNa(pH6.0);} 100mM {NaCl;} 1mM {d-DTT;} 0.02% NaN3 ; _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 'PDZ domain' '[U-13C; U-15N]' . . 1 $entity_1 . protein 1.05 . . mM . . . . 11202 1 2 PiNa 'natural abundance' . . . . . buffer 20 . . mM . . . . 11202 1 3 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 11202 1 4 d-DTT 'natural abundance' . . . . . salt 1 . . mM . . . . 11202 1 5 NaN3 'natural abundance' . . . . . salt 0.02 . . % . . . . 11202 1 6 H2O . . . . . . solvent 90 . . % . . . . 11202 1 7 D2O . . . . . . solvent 10 . . % . . . . 11202 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 11202 _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 11202 1 pH 6.0 0.05 pH 11202 1 pressure 1 0.001 atm 11202 1 temperature 298 0.1 K 11202 1 stop_ save_ ############################ # Computer software used # ############################ save_VNMR _Software.Sf_category software _Software.Sf_framecode VNMR _Software.Entry_ID 11202 _Software.ID 1 _Software.Name VNMR _Software.Version 6.1C _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . 11202 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11202 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11202 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20020425 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Delaglio.F. . . 11202 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11202 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 11202 _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.' . . 11202 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11202 3 stop_ save_ save_Kujira _Software.Sf_category software _Software.Sf_framecode Kujira _Software.Entry_ID 11202 _Software.ID 4 _Software.Name Kujira _Software.Version 0.854 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 11202 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11202 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11202 _Software.ID 5 _Software.Name CYANA _Software.Version 1.0.7 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 11202 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 11202 5 'structure solution' 11202 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 11202 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 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 11202 _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 Varian INOVA . 800 . . . 11202 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 11202 _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 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11202 1 2 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11202 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 11202 _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 . . . . . . . . . 11202 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11202 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11202 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 11202 _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 13C-separated NOESY' 1 $sample_1 isotropic 11202 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 11202 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 $VNMR . . 11202 1 2 $NMRPipe . . 11202 1 3 $NMRView . . 11202 1 4 $Kujira . . 11202 1 5 $CYANA . . 11202 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 GLY HA2 H 1 3.911 0.030 . 1 . . . . 1 GLY HA2 . 11202 1 2 . 1 1 1 1 GLY HA3 H 1 3.911 0.030 . 1 . . . . 1 GLY HA3 . 11202 1 3 . 1 1 1 1 GLY CA C 13 43.521 0.300 . 1 . . . . 1 GLY CA . 11202 1 4 . 1 1 3 3 SER C C 13 174.697 0.300 . 1 . . . . 3 SER C . 11202 1 5 . 1 1 3 3 SER CA C 13 58.369 0.300 . 1 . . . . 3 SER CA . 11202 1 6 . 1 1 3 3 SER CB C 13 63.811 0.300 . 1 . . . . 3 SER CB . 11202 1 7 . 1 1 4 4 GLY H H 1 8.467 0.030 . 1 . . . . 4 GLY H . 11202 1 8 . 1 1 4 4 GLY C C 13 171.785 0.300 . 1 . . . . 4 GLY C . 11202 1 9 . 1 1 4 4 GLY CA C 13 44.620 0.300 . 1 . . . . 4 GLY CA . 11202 1 10 . 1 1 4 4 GLY N N 15 110.921 0.300 . 1 . . . . 4 GLY N . 11202 1 11 . 1 1 5 5 SER H H 1 8.311 0.030 . 1 . . . . 5 SER H . 11202 1 12 . 1 1 5 5 SER HA H 1 4.547 0.030 . 1 . . . . 5 SER HA . 11202 1 13 . 1 1 5 5 SER HB2 H 1 3.938 0.030 . 2 . . . . 5 SER HB2 . 11202 1 14 . 1 1 5 5 SER HB3 H 1 3.858 0.030 . 2 . . . . 5 SER HB3 . 11202 1 15 . 1 1 5 5 SER CA C 13 58.309 0.300 . 1 . . . . 5 SER CA . 11202 1 16 . 1 1 5 5 SER CB C 13 64.023 0.300 . 1 . . . . 5 SER CB . 11202 1 17 . 1 1 5 5 SER N N 15 115.763 0.300 . 1 . . . . 5 SER N . 11202 1 18 . 1 1 6 6 SER H H 1 8.485 0.030 . 1 . . . . 6 SER H . 11202 1 19 . 1 1 6 6 SER HA H 1 4.518 0.030 . 1 . . . . 6 SER HA . 11202 1 20 . 1 1 6 6 SER HB2 H 1 3.913 0.030 . 1 . . . . 6 SER HB2 . 11202 1 21 . 1 1 6 6 SER HB3 H 1 3.913 0.030 . 1 . . . . 6 SER HB3 . 11202 1 22 . 1 1 6 6 SER CA C 13 58.755 0.300 . 1 . . . . 6 SER CA . 11202 1 23 . 1 1 6 6 SER CB C 13 63.984 0.300 . 1 . . . . 6 SER CB . 11202 1 24 . 1 1 6 6 SER N N 15 118.016 0.300 . 1 . . . . 6 SER N . 11202 1 25 . 1 1 7 7 GLY H H 1 8.460 0.030 . 1 . . . . 7 GLY H . 11202 1 26 . 1 1 7 7 GLY HA2 H 1 4.053 0.030 . 2 . . . . 7 GLY HA2 . 11202 1 27 . 1 1 7 7 GLY HA3 H 1 4.016 0.030 . 2 . . . . 7 GLY HA3 . 11202 1 28 . 1 1 7 7 GLY C C 13 173.175 0.300 . 1 . . . . 7 GLY C . 11202 1 29 . 1 1 7 7 GLY CA C 13 45.246 0.300 . 1 . . . . 7 GLY CA . 11202 1 30 . 1 1 7 7 GLY N N 15 110.650 0.300 . 1 . . . . 7 GLY N . 11202 1 31 . 1 1 8 8 LEU H H 1 7.966 0.030 . 1 . . . . 8 LEU H . 11202 1 32 . 1 1 8 8 LEU HA H 1 4.528 0.030 . 1 . . . . 8 LEU HA . 11202 1 33 . 1 1 8 8 LEU HB2 H 1 1.492 0.030 . 2 . . . . 8 LEU HB2 . 11202 1 34 . 1 1 8 8 LEU HB3 H 1 1.396 0.030 . 2 . . . . 8 LEU HB3 . 11202 1 35 . 1 1 8 8 LEU HD11 H 1 0.772 0.030 . 1 . . . . 8 LEU HD1 . 11202 1 36 . 1 1 8 8 LEU HD12 H 1 0.772 0.030 . 1 . . . . 8 LEU HD1 . 11202 1 37 . 1 1 8 8 LEU HD13 H 1 0.772 0.030 . 1 . . . . 8 LEU HD1 . 11202 1 38 . 1 1 8 8 LEU HD21 H 1 0.759 0.030 . 1 . . . . 8 LEU HD2 . 11202 1 39 . 1 1 8 8 LEU HD22 H 1 0.759 0.030 . 1 . . . . 8 LEU HD2 . 11202 1 40 . 1 1 8 8 LEU HD23 H 1 0.759 0.030 . 1 . . . . 8 LEU HD2 . 11202 1 41 . 1 1 8 8 LEU HG H 1 1.461 0.030 . 1 . . . . 8 LEU HG . 11202 1 42 . 1 1 8 8 LEU C C 13 176.651 0.300 . 1 . . . . 8 LEU C . 11202 1 43 . 1 1 8 8 LEU CA C 13 54.647 0.300 . 1 . . . . 8 LEU CA . 11202 1 44 . 1 1 8 8 LEU CB C 13 43.962 0.300 . 1 . . . . 8 LEU CB . 11202 1 45 . 1 1 8 8 LEU CD1 C 13 25.010 0.300 . 2 . . . . 8 LEU CD1 . 11202 1 46 . 1 1 8 8 LEU CD2 C 13 24.186 0.300 . 2 . . . . 8 LEU CD2 . 11202 1 47 . 1 1 8 8 LEU CG C 13 26.922 0.300 . 1 . . . . 8 LEU CG . 11202 1 48 . 1 1 8 8 LEU N N 15 121.167 0.300 . 1 . . . . 8 LEU N . 11202 1 49 . 1 1 9 9 GLU H H 1 8.906 0.030 . 1 . . . . 9 GLU H . 11202 1 50 . 1 1 9 9 GLU HA H 1 4.536 0.030 . 1 . . . . 9 GLU HA . 11202 1 51 . 1 1 9 9 GLU HB2 H 1 2.166 0.030 . 2 . . . . 9 GLU HB2 . 11202 1 52 . 1 1 9 9 GLU HB3 H 1 2.017 0.030 . 2 . . . . 9 GLU HB3 . 11202 1 53 . 1 1 9 9 GLU HG2 H 1 2.313 0.030 . 2 . . . . 9 GLU HG2 . 11202 1 54 . 1 1 9 9 GLU HG3 H 1 2.227 0.030 . 2 . . . . 9 GLU HG3 . 11202 1 55 . 1 1 9 9 GLU C C 13 174.822 0.300 . 1 . . . . 9 GLU C . 11202 1 56 . 1 1 9 9 GLU CA C 13 55.702 0.300 . 1 . . . . 9 GLU CA . 11202 1 57 . 1 1 9 9 GLU CB C 13 31.300 0.300 . 1 . . . . 9 GLU CB . 11202 1 58 . 1 1 9 9 GLU CG C 13 36.383 0.300 . 1 . . . . 9 GLU CG . 11202 1 59 . 1 1 9 9 GLU N N 15 125.421 0.300 . 1 . . . . 9 GLU N . 11202 1 60 . 1 1 10 10 LEU H H 1 8.297 0.030 . 1 . . . . 10 LEU H . 11202 1 61 . 1 1 10 10 LEU HA H 1 5.672 0.030 . 1 . . . . 10 LEU HA . 11202 1 62 . 1 1 10 10 LEU HB2 H 1 1.666 0.030 . 2 . . . . 10 LEU HB2 . 11202 1 63 . 1 1 10 10 LEU HB3 H 1 1.117 0.030 . 2 . . . . 10 LEU HB3 . 11202 1 64 . 1 1 10 10 LEU HD11 H 1 0.818 0.030 . 1 . . . . 10 LEU HD1 . 11202 1 65 . 1 1 10 10 LEU HD12 H 1 0.818 0.030 . 1 . . . . 10 LEU HD1 . 11202 1 66 . 1 1 10 10 LEU HD13 H 1 0.818 0.030 . 1 . . . . 10 LEU HD1 . 11202 1 67 . 1 1 10 10 LEU HD21 H 1 0.692 0.030 . 1 . . . . 10 LEU HD2 . 11202 1 68 . 1 1 10 10 LEU HD22 H 1 0.692 0.030 . 1 . . . . 10 LEU HD2 . 11202 1 69 . 1 1 10 10 LEU HD23 H 1 0.692 0.030 . 1 . . . . 10 LEU HD2 . 11202 1 70 . 1 1 10 10 LEU HG H 1 1.543 0.030 . 1 . . . . 10 LEU HG . 11202 1 71 . 1 1 10 10 LEU C C 13 178.032 0.300 . 1 . . . . 10 LEU C . 11202 1 72 . 1 1 10 10 LEU CA C 13 53.360 0.300 . 1 . . . . 10 LEU CA . 11202 1 73 . 1 1 10 10 LEU CB C 13 43.990 0.300 . 1 . . . . 10 LEU CB . 11202 1 74 . 1 1 10 10 LEU CD1 C 13 25.460 0.300 . 2 . . . . 10 LEU CD1 . 11202 1 75 . 1 1 10 10 LEU CD2 C 13 24.234 0.300 . 2 . . . . 10 LEU CD2 . 11202 1 76 . 1 1 10 10 LEU CG C 13 27.100 0.300 . 1 . . . . 10 LEU CG . 11202 1 77 . 1 1 10 10 LEU N N 15 124.856 0.300 . 1 . . . . 10 LEU N . 11202 1 78 . 1 1 11 11 PHE H H 1 9.114 0.030 . 1 . . . . 11 PHE H . 11202 1 79 . 1 1 11 11 PHE HA H 1 5.205 0.030 . 1 . . . . 11 PHE HA . 11202 1 80 . 1 1 11 11 PHE HB2 H 1 3.162 0.030 . 2 . . . . 11 PHE HB2 . 11202 1 81 . 1 1 11 11 PHE HB3 H 1 2.995 0.030 . 2 . . . . 11 PHE HB3 . 11202 1 82 . 1 1 11 11 PHE HD1 H 1 6.912 0.030 . 1 . . . . 11 PHE HD1 . 11202 1 83 . 1 1 11 11 PHE HD2 H 1 6.912 0.030 . 1 . . . . 11 PHE HD2 . 11202 1 84 . 1 1 11 11 PHE HE1 H 1 6.904 0.030 . 1 . . . . 11 PHE HE1 . 11202 1 85 . 1 1 11 11 PHE HE2 H 1 6.904 0.030 . 1 . . . . 11 PHE HE2 . 11202 1 86 . 1 1 11 11 PHE HZ H 1 7.170 0.030 . 1 . . . . 11 PHE HZ . 11202 1 87 . 1 1 11 11 PHE C C 13 171.899 0.300 . 1 . . . . 11 PHE C . 11202 1 88 . 1 1 11 11 PHE CA C 13 54.273 0.300 . 1 . . . . 11 PHE CA . 11202 1 89 . 1 1 11 11 PHE CB C 13 39.111 0.300 . 1 . . . . 11 PHE CB . 11202 1 90 . 1 1 11 11 PHE CD1 C 13 133.207 0.300 . 1 . . . . 11 PHE CD1 . 11202 1 91 . 1 1 11 11 PHE CD2 C 13 133.207 0.300 . 1 . . . . 11 PHE CD2 . 11202 1 92 . 1 1 11 11 PHE CE1 C 13 130.085 0.300 . 1 . . . . 11 PHE CE1 . 11202 1 93 . 1 1 11 11 PHE CE2 C 13 130.085 0.300 . 1 . . . . 11 PHE CE2 . 11202 1 94 . 1 1 11 11 PHE CZ C 13 129.644 0.300 . 1 . . . . 11 PHE CZ . 11202 1 95 . 1 1 11 11 PHE N N 15 119.703 0.300 . 1 . . . . 11 PHE N . 11202 1 96 . 1 1 12 12 PRO HA H 1 5.462 0.030 . 1 . . . . 12 PRO HA . 11202 1 97 . 1 1 12 12 PRO HB2 H 1 2.197 0.030 . 2 . . . . 12 PRO HB2 . 11202 1 98 . 1 1 12 12 PRO HB3 H 1 2.078 0.030 . 2 . . . . 12 PRO HB3 . 11202 1 99 . 1 1 12 12 PRO HD2 H 1 3.993 0.030 . 2 . . . . 12 PRO HD2 . 11202 1 100 . 1 1 12 12 PRO HD3 H 1 3.848 0.030 . 2 . . . . 12 PRO HD3 . 11202 1 101 . 1 1 12 12 PRO HG2 H 1 2.273 0.030 . 2 . . . . 12 PRO HG2 . 11202 1 102 . 1 1 12 12 PRO HG3 H 1 2.162 0.030 . 2 . . . . 12 PRO HG3 . 11202 1 103 . 1 1 12 12 PRO C C 13 177.090 0.300 . 1 . . . . 12 PRO C . 11202 1 104 . 1 1 12 12 PRO CA C 13 61.495 0.300 . 1 . . . . 12 PRO CA . 11202 1 105 . 1 1 12 12 PRO CB C 13 32.446 0.300 . 1 . . . . 12 PRO CB . 11202 1 106 . 1 1 12 12 PRO CD C 13 50.546 0.300 . 1 . . . . 12 PRO CD . 11202 1 107 . 1 1 12 12 PRO CG C 13 27.047 0.300 . 1 . . . . 12 PRO CG . 11202 1 108 . 1 1 13 13 VAL H H 1 8.473 0.030 . 1 . . . . 13 VAL H . 11202 1 109 . 1 1 13 13 VAL HA H 1 4.036 0.030 . 1 . . . . 13 VAL HA . 11202 1 110 . 1 1 13 13 VAL HB H 1 1.725 0.030 . 1 . . . . 13 VAL HB . 11202 1 111 . 1 1 13 13 VAL HG11 H 1 0.928 0.030 . 1 . . . . 13 VAL HG1 . 11202 1 112 . 1 1 13 13 VAL HG12 H 1 0.928 0.030 . 1 . . . . 13 VAL HG1 . 11202 1 113 . 1 1 13 13 VAL HG13 H 1 0.928 0.030 . 1 . . . . 13 VAL HG1 . 11202 1 114 . 1 1 13 13 VAL HG21 H 1 0.907 0.030 . 1 . . . . 13 VAL HG2 . 11202 1 115 . 1 1 13 13 VAL HG22 H 1 0.907 0.030 . 1 . . . . 13 VAL HG2 . 11202 1 116 . 1 1 13 13 VAL HG23 H 1 0.907 0.030 . 1 . . . . 13 VAL HG2 . 11202 1 117 . 1 1 13 13 VAL C C 13 173.645 0.300 . 1 . . . . 13 VAL C . 11202 1 118 . 1 1 13 13 VAL CA C 13 62.756 0.300 . 1 . . . . 13 VAL CA . 11202 1 119 . 1 1 13 13 VAL CB C 13 37.618 0.300 . 1 . . . . 13 VAL CB . 11202 1 120 . 1 1 13 13 VAL CG1 C 13 23.944 0.300 . 2 . . . . 13 VAL CG1 . 11202 1 121 . 1 1 13 13 VAL CG2 C 13 21.140 0.300 . 2 . . . . 13 VAL CG2 . 11202 1 122 . 1 1 13 13 VAL N N 15 119.583 0.300 . 1 . . . . 13 VAL N . 11202 1 123 . 1 1 14 14 GLU H H 1 7.649 0.030 . 1 . . . . 14 GLU H . 11202 1 124 . 1 1 14 14 GLU HA H 1 5.579 0.030 . 1 . . . . 14 GLU HA . 11202 1 125 . 1 1 14 14 GLU HB2 H 1 2.074 0.030 . 2 . . . . 14 GLU HB2 . 11202 1 126 . 1 1 14 14 GLU HB3 H 1 2.010 0.030 . 2 . . . . 14 GLU HB3 . 11202 1 127 . 1 1 14 14 GLU HG2 H 1 2.201 0.030 . 2 . . . . 14 GLU HG2 . 11202 1 128 . 1 1 14 14 GLU HG3 H 1 2.164 0.030 . 2 . . . . 14 GLU HG3 . 11202 1 129 . 1 1 14 14 GLU C C 13 174.779 0.300 . 1 . . . . 14 GLU C . 11202 1 130 . 1 1 14 14 GLU CA C 13 55.137 0.300 . 1 . . . . 14 GLU CA . 11202 1 131 . 1 1 14 14 GLU CB C 13 31.137 0.300 . 1 . . . . 14 GLU CB . 11202 1 132 . 1 1 14 14 GLU CG C 13 36.534 0.300 . 1 . . . . 14 GLU CG . 11202 1 133 . 1 1 14 14 GLU N N 15 127.003 0.300 . 1 . . . . 14 GLU N . 11202 1 134 . 1 1 15 15 LEU H H 1 8.899 0.030 . 1 . . . . 15 LEU H . 11202 1 135 . 1 1 15 15 LEU HA H 1 4.833 0.030 . 1 . . . . 15 LEU HA . 11202 1 136 . 1 1 15 15 LEU HB2 H 1 1.526 0.030 . 2 . . . . 15 LEU HB2 . 11202 1 137 . 1 1 15 15 LEU HB3 H 1 1.420 0.030 . 2 . . . . 15 LEU HB3 . 11202 1 138 . 1 1 15 15 LEU HD11 H 1 0.784 0.030 . 1 . . . . 15 LEU HD1 . 11202 1 139 . 1 1 15 15 LEU HD12 H 1 0.784 0.030 . 1 . . . . 15 LEU HD1 . 11202 1 140 . 1 1 15 15 LEU HD13 H 1 0.784 0.030 . 1 . . . . 15 LEU HD1 . 11202 1 141 . 1 1 15 15 LEU HD21 H 1 0.879 0.030 . 1 . . . . 15 LEU HD2 . 11202 1 142 . 1 1 15 15 LEU HD22 H 1 0.879 0.030 . 1 . . . . 15 LEU HD2 . 11202 1 143 . 1 1 15 15 LEU HD23 H 1 0.879 0.030 . 1 . . . . 15 LEU HD2 . 11202 1 144 . 1 1 15 15 LEU HG H 1 1.543 0.030 . 1 . . . . 15 LEU HG . 11202 1 145 . 1 1 15 15 LEU C C 13 174.735 0.300 . 1 . . . . 15 LEU C . 11202 1 146 . 1 1 15 15 LEU CA C 13 53.130 0.300 . 1 . . . . 15 LEU CA . 11202 1 147 . 1 1 15 15 LEU CB C 13 46.766 0.300 . 1 . . . . 15 LEU CB . 11202 1 148 . 1 1 15 15 LEU CD1 C 13 25.650 0.300 . 2 . . . . 15 LEU CD1 . 11202 1 149 . 1 1 15 15 LEU CD2 C 13 24.883 0.300 . 2 . . . . 15 LEU CD2 . 11202 1 150 . 1 1 15 15 LEU CG C 13 26.760 0.300 . 1 . . . . 15 LEU CG . 11202 1 151 . 1 1 15 15 LEU N N 15 122.390 0.300 . 1 . . . . 15 LEU N . 11202 1 152 . 1 1 16 16 GLU H H 1 8.523 0.030 . 1 . . . . 16 GLU H . 11202 1 153 . 1 1 16 16 GLU HA H 1 4.842 0.030 . 1 . . . . 16 GLU HA . 11202 1 154 . 1 1 16 16 GLU HB2 H 1 1.931 0.030 . 2 . . . . 16 GLU HB2 . 11202 1 155 . 1 1 16 16 GLU HB3 H 1 1.852 0.030 . 2 . . . . 16 GLU HB3 . 11202 1 156 . 1 1 16 16 GLU HG2 H 1 2.185 0.030 . 1 . . . . 16 GLU HG2 . 11202 1 157 . 1 1 16 16 GLU HG3 H 1 2.185 0.030 . 1 . . . . 16 GLU HG3 . 11202 1 158 . 1 1 16 16 GLU C C 13 175.952 0.300 . 1 . . . . 16 GLU C . 11202 1 159 . 1 1 16 16 GLU CA C 13 54.609 0.300 . 1 . . . . 16 GLU CA . 11202 1 160 . 1 1 16 16 GLU CB C 13 30.723 0.300 . 1 . . . . 16 GLU CB . 11202 1 161 . 1 1 16 16 GLU CG C 13 36.064 0.300 . 1 . . . . 16 GLU CG . 11202 1 162 . 1 1 16 16 GLU N N 15 122.797 0.300 . 1 . . . . 16 GLU N . 11202 1 163 . 1 1 17 17 LYS H H 1 8.599 0.030 . 1 . . . . 17 LYS H . 11202 1 164 . 1 1 17 17 LYS HA H 1 3.828 0.030 . 1 . . . . 17 LYS HA . 11202 1 165 . 1 1 17 17 LYS HB2 H 1 1.938 0.030 . 2 . . . . 17 LYS HB2 . 11202 1 166 . 1 1 17 17 LYS HB3 H 1 1.639 0.030 . 2 . . . . 17 LYS HB3 . 11202 1 167 . 1 1 17 17 LYS HD2 H 1 1.625 0.030 . 2 . . . . 17 LYS HD2 . 11202 1 168 . 1 1 17 17 LYS HD3 H 1 1.572 0.030 . 2 . . . . 17 LYS HD3 . 11202 1 169 . 1 1 17 17 LYS HE2 H 1 2.896 0.030 . 1 . . . . 17 LYS HE2 . 11202 1 170 . 1 1 17 17 LYS HE3 H 1 2.896 0.030 . 1 . . . . 17 LYS HE3 . 11202 1 171 . 1 1 17 17 LYS HG2 H 1 1.303 0.030 . 2 . . . . 17 LYS HG2 . 11202 1 172 . 1 1 17 17 LYS HG3 H 1 1.250 0.030 . 2 . . . . 17 LYS HG3 . 11202 1 173 . 1 1 17 17 LYS C C 13 176.982 0.300 . 1 . . . . 17 LYS C . 11202 1 174 . 1 1 17 17 LYS CA C 13 57.767 0.300 . 1 . . . . 17 LYS CA . 11202 1 175 . 1 1 17 17 LYS CB C 13 34.310 0.300 . 1 . . . . 17 LYS CB . 11202 1 176 . 1 1 17 17 LYS CD C 13 30.095 0.300 . 1 . . . . 17 LYS CD . 11202 1 177 . 1 1 17 17 LYS CE C 13 42.479 0.300 . 1 . . . . 17 LYS CE . 11202 1 178 . 1 1 17 17 LYS CG C 13 26.423 0.300 . 1 . . . . 17 LYS CG . 11202 1 179 . 1 1 17 17 LYS N N 15 124.854 0.300 . 1 . . . . 17 LYS N . 11202 1 180 . 1 1 18 18 ASP H H 1 7.594 0.030 . 1 . . . . 18 ASP H . 11202 1 181 . 1 1 18 18 ASP HA H 1 4.964 0.030 . 1 . . . . 18 ASP HA . 11202 1 182 . 1 1 18 18 ASP HB2 H 1 3.207 0.030 . 2 . . . . 18 ASP HB2 . 11202 1 183 . 1 1 18 18 ASP HB3 H 1 2.807 0.030 . 2 . . . . 18 ASP HB3 . 11202 1 184 . 1 1 18 18 ASP C C 13 178.125 0.300 . 1 . . . . 18 ASP C . 11202 1 185 . 1 1 18 18 ASP CA C 13 52.820 0.300 . 1 . . . . 18 ASP CA . 11202 1 186 . 1 1 18 18 ASP CB C 13 41.939 0.300 . 1 . . . . 18 ASP CB . 11202 1 187 . 1 1 18 18 ASP N N 15 123.644 0.300 . 1 . . . . 18 ASP N . 11202 1 188 . 1 1 19 19 GLU H H 1 9.019 0.030 . 1 . . . . 19 GLU H . 11202 1 189 . 1 1 19 19 GLU HA H 1 4.065 0.030 . 1 . . . . 19 GLU HA . 11202 1 190 . 1 1 19 19 GLU HB2 H 1 2.061 0.030 . 1 . . . . 19 GLU HB2 . 11202 1 191 . 1 1 19 19 GLU HB3 H 1 2.061 0.030 . 1 . . . . 19 GLU HB3 . 11202 1 192 . 1 1 19 19 GLU HG2 H 1 2.337 0.030 . 1 . . . . 19 GLU HG2 . 11202 1 193 . 1 1 19 19 GLU HG3 H 1 2.337 0.030 . 1 . . . . 19 GLU HG3 . 11202 1 194 . 1 1 19 19 GLU C C 13 177.395 0.300 . 1 . . . . 19 GLU C . 11202 1 195 . 1 1 19 19 GLU CA C 13 59.557 0.300 . 1 . . . . 19 GLU CA . 11202 1 196 . 1 1 19 19 GLU CB C 13 29.172 0.300 . 1 . . . . 19 GLU CB . 11202 1 197 . 1 1 19 19 GLU CG C 13 36.318 0.300 . 1 . . . . 19 GLU CG . 11202 1 198 . 1 1 19 19 GLU N N 15 119.975 0.300 . 1 . . . . 19 GLU N . 11202 1 199 . 1 1 20 20 ASP H H 1 8.431 0.030 . 1 . . . . 20 ASP H . 11202 1 200 . 1 1 20 20 ASP HA H 1 4.827 0.030 . 1 . . . . 20 ASP HA . 11202 1 201 . 1 1 20 20 ASP HB2 H 1 2.838 0.030 . 2 . . . . 20 ASP HB2 . 11202 1 202 . 1 1 20 20 ASP HB3 H 1 2.670 0.030 . 2 . . . . 20 ASP HB3 . 11202 1 203 . 1 1 20 20 ASP C C 13 176.347 0.300 . 1 . . . . 20 ASP C . 11202 1 204 . 1 1 20 20 ASP CA C 13 54.365 0.300 . 1 . . . . 20 ASP CA . 11202 1 205 . 1 1 20 20 ASP CB C 13 41.492 0.300 . 1 . . . . 20 ASP CB . 11202 1 206 . 1 1 20 20 ASP N N 15 116.725 0.300 . 1 . . . . 20 ASP N . 11202 1 207 . 1 1 21 21 GLY H H 1 8.044 0.030 . 1 . . . . 21 GLY H . 11202 1 208 . 1 1 21 21 GLY HA2 H 1 4.608 0.030 . 2 . . . . 21 GLY HA2 . 11202 1 209 . 1 1 21 21 GLY HA3 H 1 3.605 0.030 . 2 . . . . 21 GLY HA3 . 11202 1 210 . 1 1 21 21 GLY C C 13 174.744 0.300 . 1 . . . . 21 GLY C . 11202 1 211 . 1 1 21 21 GLY CA C 13 45.227 0.300 . 1 . . . . 21 GLY CA . 11202 1 212 . 1 1 21 21 GLY N N 15 108.171 0.300 . 1 . . . . 21 GLY N . 11202 1 213 . 1 1 22 22 LEU H H 1 9.195 0.030 . 1 . . . . 22 LEU H . 11202 1 214 . 1 1 22 22 LEU HA H 1 4.183 0.030 . 1 . . . . 22 LEU HA . 11202 1 215 . 1 1 22 22 LEU HB2 H 1 1.944 0.030 . 2 . . . . 22 LEU HB2 . 11202 1 216 . 1 1 22 22 LEU HB3 H 1 1.434 0.030 . 2 . . . . 22 LEU HB3 . 11202 1 217 . 1 1 22 22 LEU HD11 H 1 1.100 0.030 . 1 . . . . 22 LEU HD1 . 11202 1 218 . 1 1 22 22 LEU HD12 H 1 1.100 0.030 . 1 . . . . 22 LEU HD1 . 11202 1 219 . 1 1 22 22 LEU HD13 H 1 1.100 0.030 . 1 . . . . 22 LEU HD1 . 11202 1 220 . 1 1 22 22 LEU HD21 H 1 0.925 0.030 . 1 . . . . 22 LEU HD2 . 11202 1 221 . 1 1 22 22 LEU HD22 H 1 0.925 0.030 . 1 . . . . 22 LEU HD2 . 11202 1 222 . 1 1 22 22 LEU HD23 H 1 0.925 0.030 . 1 . . . . 22 LEU HD2 . 11202 1 223 . 1 1 22 22 LEU HG H 1 1.707 0.030 . 1 . . . . 22 LEU HG . 11202 1 224 . 1 1 22 22 LEU C C 13 176.949 0.300 . 1 . . . . 22 LEU C . 11202 1 225 . 1 1 22 22 LEU CA C 13 56.299 0.300 . 1 . . . . 22 LEU CA . 11202 1 226 . 1 1 22 22 LEU CB C 13 44.275 0.300 . 1 . . . . 22 LEU CB . 11202 1 227 . 1 1 22 22 LEU CD1 C 13 26.285 0.300 . 2 . . . . 22 LEU CD1 . 11202 1 228 . 1 1 22 22 LEU CD2 C 13 23.852 0.300 . 2 . . . . 22 LEU CD2 . 11202 1 229 . 1 1 22 22 LEU CG C 13 27.237 0.300 . 1 . . . . 22 LEU CG . 11202 1 230 . 1 1 22 22 LEU N N 15 123.689 0.300 . 1 . . . . 22 LEU N . 11202 1 231 . 1 1 23 23 GLY H H 1 8.835 0.030 . 1 . . . . 23 GLY H . 11202 1 232 . 1 1 23 23 GLY HA2 H 1 4.225 0.030 . 2 . . . . 23 GLY HA2 . 11202 1 233 . 1 1 23 23 GLY HA3 H 1 3.911 0.030 . 2 . . . . 23 GLY HA3 . 11202 1 234 . 1 1 23 23 GLY C C 13 176.066 0.300 . 1 . . . . 23 GLY C . 11202 1 235 . 1 1 23 23 GLY CA C 13 46.355 0.300 . 1 . . . . 23 GLY CA . 11202 1 236 . 1 1 23 23 GLY N N 15 105.215 0.300 . 1 . . . . 23 GLY N . 11202 1 237 . 1 1 24 24 ILE H H 1 7.179 0.030 . 1 . . . . 24 ILE H . 11202 1 238 . 1 1 24 24 ILE HA H 1 5.162 0.030 . 1 . . . . 24 ILE HA . 11202 1 239 . 1 1 24 24 ILE HB H 1 1.729 0.030 . 1 . . . . 24 ILE HB . 11202 1 240 . 1 1 24 24 ILE HD11 H 1 0.556 0.030 . 1 . . . . 24 ILE HD1 . 11202 1 241 . 1 1 24 24 ILE HD12 H 1 0.556 0.030 . 1 . . . . 24 ILE HD1 . 11202 1 242 . 1 1 24 24 ILE HD13 H 1 0.556 0.030 . 1 . . . . 24 ILE HD1 . 11202 1 243 . 1 1 24 24 ILE HG12 H 1 1.300 0.030 . 2 . . . . 24 ILE HG12 . 11202 1 244 . 1 1 24 24 ILE HG13 H 1 0.715 0.030 . 2 . . . . 24 ILE HG13 . 11202 1 245 . 1 1 24 24 ILE HG21 H 1 0.761 0.030 . 1 . . . . 24 ILE HG2 . 11202 1 246 . 1 1 24 24 ILE HG22 H 1 0.761 0.030 . 1 . . . . 24 ILE HG2 . 11202 1 247 . 1 1 24 24 ILE HG23 H 1 0.761 0.030 . 1 . . . . 24 ILE HG2 . 11202 1 248 . 1 1 24 24 ILE C C 13 174.891 0.300 . 1 . . . . 24 ILE C . 11202 1 249 . 1 1 24 24 ILE CA C 13 59.399 0.300 . 1 . . . . 24 ILE CA . 11202 1 250 . 1 1 24 24 ILE CB C 13 43.299 0.300 . 1 . . . . 24 ILE CB . 11202 1 251 . 1 1 24 24 ILE CD1 C 13 13.849 0.300 . 1 . . . . 24 ILE CD1 . 11202 1 252 . 1 1 24 24 ILE CG1 C 13 25.523 0.300 . 1 . . . . 24 ILE CG1 . 11202 1 253 . 1 1 24 24 ILE CG2 C 13 18.741 0.300 . 1 . . . . 24 ILE CG2 . 11202 1 254 . 1 1 24 24 ILE N N 15 112.106 0.300 . 1 . . . . 24 ILE N . 11202 1 255 . 1 1 25 25 SER H H 1 8.321 0.030 . 1 . . . . 25 SER H . 11202 1 256 . 1 1 25 25 SER HA H 1 4.992 0.030 . 1 . . . . 25 SER HA . 11202 1 257 . 1 1 25 25 SER HB2 H 1 3.930 0.030 . 2 . . . . 25 SER HB2 . 11202 1 258 . 1 1 25 25 SER HB3 H 1 3.830 0.030 . 2 . . . . 25 SER HB3 . 11202 1 259 . 1 1 25 25 SER C C 13 174.490 0.300 . 1 . . . . 25 SER C . 11202 1 260 . 1 1 25 25 SER CA C 13 57.047 0.300 . 1 . . . . 25 SER CA . 11202 1 261 . 1 1 25 25 SER CB C 13 65.710 0.300 . 1 . . . . 25 SER CB . 11202 1 262 . 1 1 25 25 SER N N 15 117.096 0.300 . 1 . . . . 25 SER N . 11202 1 263 . 1 1 26 26 ILE H H 1 8.565 0.030 . 1 . . . . 26 ILE H . 11202 1 264 . 1 1 26 26 ILE HA H 1 5.565 0.030 . 1 . . . . 26 ILE HA . 11202 1 265 . 1 1 26 26 ILE HB H 1 1.891 0.030 . 1 . . . . 26 ILE HB . 11202 1 266 . 1 1 26 26 ILE HD11 H 1 0.788 0.030 . 1 . . . . 26 ILE HD1 . 11202 1 267 . 1 1 26 26 ILE HD12 H 1 0.788 0.030 . 1 . . . . 26 ILE HD1 . 11202 1 268 . 1 1 26 26 ILE HD13 H 1 0.788 0.030 . 1 . . . . 26 ILE HD1 . 11202 1 269 . 1 1 26 26 ILE HG12 H 1 1.433 0.030 . 2 . . . . 26 ILE HG12 . 11202 1 270 . 1 1 26 26 ILE HG13 H 1 1.113 0.030 . 2 . . . . 26 ILE HG13 . 11202 1 271 . 1 1 26 26 ILE HG21 H 1 0.633 0.030 . 1 . . . . 26 ILE HG2 . 11202 1 272 . 1 1 26 26 ILE HG22 H 1 0.633 0.030 . 1 . . . . 26 ILE HG2 . 11202 1 273 . 1 1 26 26 ILE HG23 H 1 0.633 0.030 . 1 . . . . 26 ILE HG2 . 11202 1 274 . 1 1 26 26 ILE C C 13 174.731 0.300 . 1 . . . . 26 ILE C . 11202 1 275 . 1 1 26 26 ILE CA C 13 59.659 0.300 . 1 . . . . 26 ILE CA . 11202 1 276 . 1 1 26 26 ILE CB C 13 42.779 0.300 . 1 . . . . 26 ILE CB . 11202 1 277 . 1 1 26 26 ILE CD1 C 13 15.045 0.300 . 1 . . . . 26 ILE CD1 . 11202 1 278 . 1 1 26 26 ILE CG1 C 13 25.523 0.300 . 1 . . . . 26 ILE CG1 . 11202 1 279 . 1 1 26 26 ILE CG2 C 13 19.182 0.300 . 1 . . . . 26 ILE CG2 . 11202 1 280 . 1 1 26 26 ILE N N 15 115.675 0.300 . 1 . . . . 26 ILE N . 11202 1 281 . 1 1 27 27 ILE H H 1 9.116 0.030 . 1 . . . . 27 ILE H . 11202 1 282 . 1 1 27 27 ILE HA H 1 4.606 0.030 . 1 . . . . 27 ILE HA . 11202 1 283 . 1 1 27 27 ILE HB H 1 1.772 0.030 . 1 . . . . 27 ILE HB . 11202 1 284 . 1 1 27 27 ILE HD11 H 1 0.989 0.030 . 1 . . . . 27 ILE HD1 . 11202 1 285 . 1 1 27 27 ILE HD12 H 1 0.989 0.030 . 1 . . . . 27 ILE HD1 . 11202 1 286 . 1 1 27 27 ILE HD13 H 1 0.989 0.030 . 1 . . . . 27 ILE HD1 . 11202 1 287 . 1 1 27 27 ILE HG12 H 1 1.652 0.030 . 2 . . . . 27 ILE HG12 . 11202 1 288 . 1 1 27 27 ILE HG13 H 1 1.249 0.030 . 2 . . . . 27 ILE HG13 . 11202 1 289 . 1 1 27 27 ILE HG21 H 1 0.932 0.030 . 1 . . . . 27 ILE HG2 . 11202 1 290 . 1 1 27 27 ILE HG22 H 1 0.932 0.030 . 1 . . . . 27 ILE HG2 . 11202 1 291 . 1 1 27 27 ILE HG23 H 1 0.932 0.030 . 1 . . . . 27 ILE HG2 . 11202 1 292 . 1 1 27 27 ILE C C 13 173.474 0.300 . 1 . . . . 27 ILE C . 11202 1 293 . 1 1 27 27 ILE CA C 13 59.629 0.300 . 1 . . . . 27 ILE CA . 11202 1 294 . 1 1 27 27 ILE CB C 13 42.843 0.300 . 1 . . . . 27 ILE CB . 11202 1 295 . 1 1 27 27 ILE CD1 C 13 14.602 0.300 . 1 . . . . 27 ILE CD1 . 11202 1 296 . 1 1 27 27 ILE CG1 C 13 28.519 0.300 . 1 . . . . 27 ILE CG1 . 11202 1 297 . 1 1 27 27 ILE CG2 C 13 17.141 0.300 . 1 . . . . 27 ILE CG2 . 11202 1 298 . 1 1 27 27 ILE N N 15 118.212 0.300 . 1 . . . . 27 ILE N . 11202 1 299 . 1 1 28 28 GLY H H 1 8.541 0.030 . 1 . . . . 28 GLY H . 11202 1 300 . 1 1 28 28 GLY HA2 H 1 5.478 0.030 . 2 . . . . 28 GLY HA2 . 11202 1 301 . 1 1 28 28 GLY HA3 H 1 3.555 0.030 . 2 . . . . 28 GLY HA3 . 11202 1 302 . 1 1 28 28 GLY C C 13 173.203 0.300 . 1 . . . . 28 GLY C . 11202 1 303 . 1 1 28 28 GLY CA C 13 44.782 0.300 . 1 . . . . 28 GLY CA . 11202 1 304 . 1 1 28 28 GLY N N 15 112.896 0.300 . 1 . . . . 28 GLY N . 11202 1 305 . 1 1 29 29 MET H H 1 8.992 0.030 . 1 . . . . 29 MET H . 11202 1 306 . 1 1 29 29 MET HA H 1 4.815 0.030 . 1 . . . . 29 MET HA . 11202 1 307 . 1 1 29 29 MET HB2 H 1 2.077 0.030 . 2 . . . . 29 MET HB2 . 11202 1 308 . 1 1 29 29 MET HB3 H 1 1.918 0.030 . 2 . . . . 29 MET HB3 . 11202 1 309 . 1 1 29 29 MET HE1 H 1 1.734 0.030 . 1 . . . . 29 MET HE . 11202 1 310 . 1 1 29 29 MET HE2 H 1 1.734 0.030 . 1 . . . . 29 MET HE . 11202 1 311 . 1 1 29 29 MET HE3 H 1 1.734 0.030 . 1 . . . . 29 MET HE . 11202 1 312 . 1 1 29 29 MET HG2 H 1 2.424 0.030 . 2 . . . . 29 MET HG2 . 11202 1 313 . 1 1 29 29 MET HG3 H 1 2.340 0.030 . 2 . . . . 29 MET HG3 . 11202 1 314 . 1 1 29 29 MET C C 13 175.184 0.300 . 1 . . . . 29 MET C . 11202 1 315 . 1 1 29 29 MET CA C 13 55.108 0.300 . 1 . . . . 29 MET CA . 11202 1 316 . 1 1 29 29 MET CB C 13 36.300 0.300 . 1 . . . . 29 MET CB . 11202 1 317 . 1 1 29 29 MET CE C 13 16.791 0.300 . 1 . . . . 29 MET CE . 11202 1 318 . 1 1 29 29 MET CG C 13 31.795 0.300 . 1 . . . . 29 MET CG . 11202 1 319 . 1 1 29 29 MET N N 15 121.850 0.300 . 1 . . . . 29 MET N . 11202 1 320 . 1 1 30 30 GLY H H 1 8.752 0.030 . 1 . . . . 30 GLY H . 11202 1 321 . 1 1 30 30 GLY HA2 H 1 4.364 0.030 . 2 . . . . 30 GLY HA2 . 11202 1 322 . 1 1 30 30 GLY HA3 H 1 3.830 0.030 . 2 . . . . 30 GLY HA3 . 11202 1 323 . 1 1 30 30 GLY C C 13 173.725 0.300 . 1 . . . . 30 GLY C . 11202 1 324 . 1 1 30 30 GLY CA C 13 45.512 0.300 . 1 . . . . 30 GLY CA . 11202 1 325 . 1 1 30 30 GLY N N 15 110.652 0.300 . 1 . . . . 30 GLY N . 11202 1 326 . 1 1 31 31 VAL H H 1 8.489 0.030 . 1 . . . . 31 VAL H . 11202 1 327 . 1 1 31 31 VAL HA H 1 4.364 0.030 . 1 . . . . 31 VAL HA . 11202 1 328 . 1 1 31 31 VAL HB H 1 2.189 0.030 . 1 . . . . 31 VAL HB . 11202 1 329 . 1 1 31 31 VAL HG11 H 1 0.984 0.030 . 1 . . . . 31 VAL HG1 . 11202 1 330 . 1 1 31 31 VAL HG12 H 1 0.984 0.030 . 1 . . . . 31 VAL HG1 . 11202 1 331 . 1 1 31 31 VAL HG13 H 1 0.984 0.030 . 1 . . . . 31 VAL HG1 . 11202 1 332 . 1 1 31 31 VAL HG21 H 1 0.932 0.030 . 1 . . . . 31 VAL HG2 . 11202 1 333 . 1 1 31 31 VAL HG22 H 1 0.932 0.030 . 1 . . . . 31 VAL HG2 . 11202 1 334 . 1 1 31 31 VAL HG23 H 1 0.932 0.030 . 1 . . . . 31 VAL HG2 . 11202 1 335 . 1 1 31 31 VAL C C 13 176.358 0.300 . 1 . . . . 31 VAL C . 11202 1 336 . 1 1 31 31 VAL CA C 13 61.603 0.300 . 1 . . . . 31 VAL CA . 11202 1 337 . 1 1 31 31 VAL CB C 13 33.468 0.300 . 1 . . . . 31 VAL CB . 11202 1 338 . 1 1 31 31 VAL CG1 C 13 21.367 0.300 . 2 . . . . 31 VAL CG1 . 11202 1 339 . 1 1 31 31 VAL CG2 C 13 20.069 0.300 . 2 . . . . 31 VAL CG2 . 11202 1 340 . 1 1 31 31 VAL N N 15 119.626 0.300 . 1 . . . . 31 VAL N . 11202 1 341 . 1 1 32 32 GLY H H 1 8.535 0.030 . 1 . . . . 32 GLY H . 11202 1 342 . 1 1 32 32 GLY HA2 H 1 4.093 0.030 . 2 . . . . 32 GLY HA2 . 11202 1 343 . 1 1 32 32 GLY HA3 H 1 3.924 0.030 . 2 . . . . 32 GLY HA3 . 11202 1 344 . 1 1 32 32 GLY C C 13 174.101 0.300 . 1 . . . . 32 GLY C . 11202 1 345 . 1 1 32 32 GLY CA C 13 45.284 0.300 . 1 . . . . 32 GLY CA . 11202 1 346 . 1 1 32 32 GLY N N 15 112.376 0.300 . 1 . . . . 32 GLY N . 11202 1 347 . 1 1 33 33 ALA H H 1 8.407 0.030 . 1 . . . . 33 ALA H . 11202 1 348 . 1 1 33 33 ALA HA H 1 4.334 0.030 . 1 . . . . 33 ALA HA . 11202 1 349 . 1 1 33 33 ALA HB1 H 1 1.374 0.030 . 1 . . . . 33 ALA HB . 11202 1 350 . 1 1 33 33 ALA HB2 H 1 1.374 0.030 . 1 . . . . 33 ALA HB . 11202 1 351 . 1 1 33 33 ALA HB3 H 1 1.374 0.030 . 1 . . . . 33 ALA HB . 11202 1 352 . 1 1 33 33 ALA C C 13 177.715 0.300 . 1 . . . . 33 ALA C . 11202 1 353 . 1 1 33 33 ALA CA C 13 53.015 0.300 . 1 . . . . 33 ALA CA . 11202 1 354 . 1 1 33 33 ALA CB C 13 19.518 0.300 . 1 . . . . 33 ALA CB . 11202 1 355 . 1 1 33 33 ALA N N 15 123.930 0.300 . 1 . . . . 33 ALA N . 11202 1 356 . 1 1 34 34 ASP H H 1 8.331 0.030 . 1 . . . . 34 ASP H . 11202 1 357 . 1 1 34 34 ASP HA H 1 4.559 0.030 . 1 . . . . 34 ASP HA . 11202 1 358 . 1 1 34 34 ASP HB2 H 1 2.719 0.030 . 2 . . . . 34 ASP HB2 . 11202 1 359 . 1 1 34 34 ASP HB3 H 1 2.630 0.030 . 2 . . . . 34 ASP HB3 . 11202 1 360 . 1 1 34 34 ASP C C 13 176.040 0.300 . 1 . . . . 34 ASP C . 11202 1 361 . 1 1 34 34 ASP CA C 13 54.514 0.300 . 1 . . . . 34 ASP CA . 11202 1 362 . 1 1 34 34 ASP CB C 13 41.172 0.300 . 1 . . . . 34 ASP CB . 11202 1 363 . 1 1 34 34 ASP N N 15 118.309 0.300 . 1 . . . . 34 ASP N . 11202 1 364 . 1 1 35 35 ALA H H 1 8.166 0.030 . 1 . . . . 35 ALA H . 11202 1 365 . 1 1 35 35 ALA HA H 1 4.256 0.030 . 1 . . . . 35 ALA HA . 11202 1 366 . 1 1 35 35 ALA HB1 H 1 1.397 0.030 . 1 . . . . 35 ALA HB . 11202 1 367 . 1 1 35 35 ALA HB2 H 1 1.397 0.030 . 1 . . . . 35 ALA HB . 11202 1 368 . 1 1 35 35 ALA HB3 H 1 1.397 0.030 . 1 . . . . 35 ALA HB . 11202 1 369 . 1 1 35 35 ALA C C 13 178.010 0.300 . 1 . . . . 35 ALA C . 11202 1 370 . 1 1 35 35 ALA CA C 13 52.904 0.300 . 1 . . . . 35 ALA CA . 11202 1 371 . 1 1 35 35 ALA CB C 13 18.938 0.300 . 1 . . . . 35 ALA CB . 11202 1 372 . 1 1 35 35 ALA N N 15 123.812 0.300 . 1 . . . . 35 ALA N . 11202 1 373 . 1 1 36 36 GLY H H 1 8.328 0.030 . 1 . . . . 36 GLY H . 11202 1 374 . 1 1 36 36 GLY HA2 H 1 4.023 0.030 . 2 . . . . 36 GLY HA2 . 11202 1 375 . 1 1 36 36 GLY HA3 H 1 3.883 0.030 . 2 . . . . 36 GLY HA3 . 11202 1 376 . 1 1 36 36 GLY C C 13 174.156 0.300 . 1 . . . . 36 GLY C . 11202 1 377 . 1 1 36 36 GLY CA C 13 45.520 0.300 . 1 . . . . 36 GLY CA . 11202 1 378 . 1 1 36 36 GLY N N 15 107.372 0.300 . 1 . . . . 36 GLY N . 11202 1 379 . 1 1 37 37 LEU H H 1 7.939 0.030 . 1 . . . . 37 LEU H . 11202 1 380 . 1 1 37 37 LEU HA H 1 4.382 0.030 . 1 . . . . 37 LEU HA . 11202 1 381 . 1 1 37 37 LEU HB2 H 1 1.622 0.030 . 1 . . . . 37 LEU HB2 . 11202 1 382 . 1 1 37 37 LEU HB3 H 1 1.622 0.030 . 1 . . . . 37 LEU HB3 . 11202 1 383 . 1 1 37 37 LEU HD11 H 1 0.925 0.030 . 1 . . . . 37 LEU HD1 . 11202 1 384 . 1 1 37 37 LEU HD12 H 1 0.925 0.030 . 1 . . . . 37 LEU HD1 . 11202 1 385 . 1 1 37 37 LEU HD13 H 1 0.925 0.030 . 1 . . . . 37 LEU HD1 . 11202 1 386 . 1 1 37 37 LEU HD21 H 1 0.873 0.030 . 1 . . . . 37 LEU HD2 . 11202 1 387 . 1 1 37 37 LEU HD22 H 1 0.873 0.030 . 1 . . . . 37 LEU HD2 . 11202 1 388 . 1 1 37 37 LEU HD23 H 1 0.873 0.030 . 1 . . . . 37 LEU HD2 . 11202 1 389 . 1 1 37 37 LEU HG H 1 1.597 0.030 . 1 . . . . 37 LEU HG . 11202 1 390 . 1 1 37 37 LEU C C 13 176.829 0.300 . 1 . . . . 37 LEU C . 11202 1 391 . 1 1 37 37 LEU CA C 13 55.003 0.300 . 1 . . . . 37 LEU CA . 11202 1 392 . 1 1 37 37 LEU CB C 13 42.703 0.300 . 1 . . . . 37 LEU CB . 11202 1 393 . 1 1 37 37 LEU CD1 C 13 25.087 0.300 . 2 . . . . 37 LEU CD1 . 11202 1 394 . 1 1 37 37 LEU CD2 C 13 23.618 0.300 . 2 . . . . 37 LEU CD2 . 11202 1 395 . 1 1 37 37 LEU CG C 13 26.983 0.300 . 1 . . . . 37 LEU CG . 11202 1 396 . 1 1 37 37 LEU N N 15 121.203 0.300 . 1 . . . . 37 LEU N . 11202 1 397 . 1 1 38 38 GLU H H 1 8.457 0.030 . 1 . . . . 38 GLU H . 11202 1 398 . 1 1 38 38 GLU HA H 1 4.243 0.030 . 1 . . . . 38 GLU HA . 11202 1 399 . 1 1 38 38 GLU HB2 H 1 1.996 0.030 . 2 . . . . 38 GLU HB2 . 11202 1 400 . 1 1 38 38 GLU HB3 H 1 1.912 0.030 . 2 . . . . 38 GLU HB3 . 11202 1 401 . 1 1 38 38 GLU HG2 H 1 2.222 0.030 . 2 . . . . 38 GLU HG2 . 11202 1 402 . 1 1 38 38 GLU HG3 H 1 2.161 0.030 . 2 . . . . 38 GLU HG3 . 11202 1 403 . 1 1 38 38 GLU C C 13 175.705 0.300 . 1 . . . . 38 GLU C . 11202 1 404 . 1 1 38 38 GLU CA C 13 56.915 0.300 . 1 . . . . 38 GLU CA . 11202 1 405 . 1 1 38 38 GLU CB C 13 30.330 0.300 . 1 . . . . 38 GLU CB . 11202 1 406 . 1 1 38 38 GLU CG C 13 36.508 0.300 . 1 . . . . 38 GLU CG . 11202 1 407 . 1 1 38 38 GLU N N 15 120.640 0.300 . 1 . . . . 38 GLU N . 11202 1 408 . 1 1 39 39 LYS H H 1 8.168 0.030 . 1 . . . . 39 LYS H . 11202 1 409 . 1 1 39 39 LYS HA H 1 4.372 0.030 . 1 . . . . 39 LYS HA . 11202 1 410 . 1 1 39 39 LYS HB2 H 1 1.685 0.030 . 1 . . . . 39 LYS HB2 . 11202 1 411 . 1 1 39 39 LYS HB3 H 1 1.685 0.030 . 1 . . . . 39 LYS HB3 . 11202 1 412 . 1 1 39 39 LYS HD2 H 1 1.620 0.030 . 2 . . . . 39 LYS HD2 . 11202 1 413 . 1 1 39 39 LYS HD3 H 1 1.586 0.030 . 2 . . . . 39 LYS HD3 . 11202 1 414 . 1 1 39 39 LYS HE2 H 1 2.915 0.030 . 1 . . . . 39 LYS HE2 . 11202 1 415 . 1 1 39 39 LYS HE3 H 1 2.915 0.030 . 1 . . . . 39 LYS HE3 . 11202 1 416 . 1 1 39 39 LYS HG2 H 1 1.372 0.030 . 2 . . . . 39 LYS HG2 . 11202 1 417 . 1 1 39 39 LYS HG3 H 1 1.306 0.030 . 2 . . . . 39 LYS HG3 . 11202 1 418 . 1 1 39 39 LYS C C 13 175.284 0.300 . 1 . . . . 39 LYS C . 11202 1 419 . 1 1 39 39 LYS CA C 13 55.140 0.300 . 1 . . . . 39 LYS CA . 11202 1 420 . 1 1 39 39 LYS CB C 13 33.625 0.300 . 1 . . . . 39 LYS CB . 11202 1 421 . 1 1 39 39 LYS CD C 13 29.269 0.300 . 1 . . . . 39 LYS CD . 11202 1 422 . 1 1 39 39 LYS CE C 13 42.200 0.300 . 1 . . . . 39 LYS CE . 11202 1 423 . 1 1 39 39 LYS CG C 13 24.789 0.300 . 1 . . . . 39 LYS CG . 11202 1 424 . 1 1 39 39 LYS N N 15 122.280 0.300 . 1 . . . . 39 LYS N . 11202 1 425 . 1 1 40 40 LEU H H 1 8.433 0.030 . 1 . . . . 40 LEU H . 11202 1 426 . 1 1 40 40 LEU HA H 1 4.693 0.030 . 1 . . . . 40 LEU HA . 11202 1 427 . 1 1 40 40 LEU HB2 H 1 1.657 0.030 . 2 . . . . 40 LEU HB2 . 11202 1 428 . 1 1 40 40 LEU HB3 H 1 1.612 0.030 . 2 . . . . 40 LEU HB3 . 11202 1 429 . 1 1 40 40 LEU HD11 H 1 0.815 0.030 . 1 . . . . 40 LEU HD1 . 11202 1 430 . 1 1 40 40 LEU HD12 H 1 0.815 0.030 . 1 . . . . 40 LEU HD1 . 11202 1 431 . 1 1 40 40 LEU HD13 H 1 0.815 0.030 . 1 . . . . 40 LEU HD1 . 11202 1 432 . 1 1 40 40 LEU HD21 H 1 0.759 0.030 . 1 . . . . 40 LEU HD2 . 11202 1 433 . 1 1 40 40 LEU HD22 H 1 0.759 0.030 . 1 . . . . 40 LEU HD2 . 11202 1 434 . 1 1 40 40 LEU HD23 H 1 0.759 0.030 . 1 . . . . 40 LEU HD2 . 11202 1 435 . 1 1 40 40 LEU HG H 1 1.650 0.030 . 1 . . . . 40 LEU HG . 11202 1 436 . 1 1 40 40 LEU C C 13 177.562 0.300 . 1 . . . . 40 LEU C . 11202 1 437 . 1 1 40 40 LEU CA C 13 55.186 0.300 . 1 . . . . 40 LEU CA . 11202 1 438 . 1 1 40 40 LEU CB C 13 43.270 0.300 . 1 . . . . 40 LEU CB . 11202 1 439 . 1 1 40 40 LEU CD1 C 13 25.542 0.300 . 2 . . . . 40 LEU CD1 . 11202 1 440 . 1 1 40 40 LEU CD2 C 13 23.173 0.300 . 2 . . . . 40 LEU CD2 . 11202 1 441 . 1 1 40 40 LEU CG C 13 27.038 0.300 . 1 . . . . 40 LEU CG . 11202 1 442 . 1 1 40 40 LEU N N 15 123.360 0.300 . 1 . . . . 40 LEU N . 11202 1 443 . 1 1 41 41 GLY H H 1 8.707 0.030 . 1 . . . . 41 GLY H . 11202 1 444 . 1 1 41 41 GLY HA2 H 1 4.536 0.030 . 2 . . . . 41 GLY HA2 . 11202 1 445 . 1 1 41 41 GLY HA3 H 1 3.621 0.030 . 2 . . . . 41 GLY HA3 . 11202 1 446 . 1 1 41 41 GLY C C 13 171.252 0.300 . 1 . . . . 41 GLY C . 11202 1 447 . 1 1 41 41 GLY CA C 13 44.025 0.300 . 1 . . . . 41 GLY CA . 11202 1 448 . 1 1 41 41 GLY N N 15 108.674 0.300 . 1 . . . . 41 GLY N . 11202 1 449 . 1 1 42 42 ILE H H 1 8.817 0.030 . 1 . . . . 42 ILE H . 11202 1 450 . 1 1 42 42 ILE HA H 1 4.762 0.030 . 1 . . . . 42 ILE HA . 11202 1 451 . 1 1 42 42 ILE HB H 1 2.210 0.030 . 1 . . . . 42 ILE HB . 11202 1 452 . 1 1 42 42 ILE HD11 H 1 0.630 0.030 . 1 . . . . 42 ILE HD1 . 11202 1 453 . 1 1 42 42 ILE HD12 H 1 0.630 0.030 . 1 . . . . 42 ILE HD1 . 11202 1 454 . 1 1 42 42 ILE HD13 H 1 0.630 0.030 . 1 . . . . 42 ILE HD1 . 11202 1 455 . 1 1 42 42 ILE HG12 H 1 1.902 0.030 . 2 . . . . 42 ILE HG12 . 11202 1 456 . 1 1 42 42 ILE HG13 H 1 1.177 0.030 . 2 . . . . 42 ILE HG13 . 11202 1 457 . 1 1 42 42 ILE HG21 H 1 0.762 0.030 . 1 . . . . 42 ILE HG2 . 11202 1 458 . 1 1 42 42 ILE HG22 H 1 0.762 0.030 . 1 . . . . 42 ILE HG2 . 11202 1 459 . 1 1 42 42 ILE HG23 H 1 0.762 0.030 . 1 . . . . 42 ILE HG2 . 11202 1 460 . 1 1 42 42 ILE C C 13 174.015 0.300 . 1 . . . . 42 ILE C . 11202 1 461 . 1 1 42 42 ILE CA C 13 57.527 0.300 . 1 . . . . 42 ILE CA . 11202 1 462 . 1 1 42 42 ILE CB C 13 36.034 0.300 . 1 . . . . 42 ILE CB . 11202 1 463 . 1 1 42 42 ILE CD1 C 13 8.759 0.300 . 1 . . . . 42 ILE CD1 . 11202 1 464 . 1 1 42 42 ILE CG1 C 13 26.416 0.300 . 1 . . . . 42 ILE CG1 . 11202 1 465 . 1 1 42 42 ILE CG2 C 13 18.333 0.300 . 1 . . . . 42 ILE CG2 . 11202 1 466 . 1 1 42 42 ILE N N 15 122.063 0.300 . 1 . . . . 42 ILE N . 11202 1 467 . 1 1 43 43 PHE H H 1 9.155 0.030 . 1 . . . . 43 PHE H . 11202 1 468 . 1 1 43 43 PHE HA H 1 5.402 0.030 . 1 . . . . 43 PHE HA . 11202 1 469 . 1 1 43 43 PHE HB2 H 1 2.743 0.030 . 2 . . . . 43 PHE HB2 . 11202 1 470 . 1 1 43 43 PHE HB3 H 1 2.698 0.030 . 2 . . . . 43 PHE HB3 . 11202 1 471 . 1 1 43 43 PHE HD1 H 1 7.089 0.030 . 1 . . . . 43 PHE HD1 . 11202 1 472 . 1 1 43 43 PHE HD2 H 1 7.089 0.030 . 1 . . . . 43 PHE HD2 . 11202 1 473 . 1 1 43 43 PHE HE1 H 1 7.245 0.030 . 1 . . . . 43 PHE HE1 . 11202 1 474 . 1 1 43 43 PHE HE2 H 1 7.245 0.030 . 1 . . . . 43 PHE HE2 . 11202 1 475 . 1 1 43 43 PHE HZ H 1 7.112 0.030 . 1 . . . . 43 PHE HZ . 11202 1 476 . 1 1 43 43 PHE C C 13 175.561 0.300 . 1 . . . . 43 PHE C . 11202 1 477 . 1 1 43 43 PHE CA C 13 55.633 0.300 . 1 . . . . 43 PHE CA . 11202 1 478 . 1 1 43 43 PHE CB C 13 43.128 0.300 . 1 . . . . 43 PHE CB . 11202 1 479 . 1 1 43 43 PHE CD1 C 13 132.200 0.300 . 1 . . . . 43 PHE CD1 . 11202 1 480 . 1 1 43 43 PHE CD2 C 13 132.200 0.300 . 1 . . . . 43 PHE CD2 . 11202 1 481 . 1 1 43 43 PHE CE1 C 13 130.888 0.300 . 1 . . . . 43 PHE CE1 . 11202 1 482 . 1 1 43 43 PHE CE2 C 13 130.888 0.300 . 1 . . . . 43 PHE CE2 . 11202 1 483 . 1 1 43 43 PHE CZ C 13 129.417 0.300 . 1 . . . . 43 PHE CZ . 11202 1 484 . 1 1 43 43 PHE N N 15 124.555 0.300 . 1 . . . . 43 PHE N . 11202 1 485 . 1 1 44 44 VAL H H 1 9.030 0.030 . 1 . . . . 44 VAL H . 11202 1 486 . 1 1 44 44 VAL HA H 1 3.893 0.030 . 1 . . . . 44 VAL HA . 11202 1 487 . 1 1 44 44 VAL HB H 1 2.236 0.030 . 1 . . . . 44 VAL HB . 11202 1 488 . 1 1 44 44 VAL HG11 H 1 0.683 0.030 . 1 . . . . 44 VAL HG1 . 11202 1 489 . 1 1 44 44 VAL HG12 H 1 0.683 0.030 . 1 . . . . 44 VAL HG1 . 11202 1 490 . 1 1 44 44 VAL HG13 H 1 0.683 0.030 . 1 . . . . 44 VAL HG1 . 11202 1 491 . 1 1 44 44 VAL HG21 H 1 0.770 0.030 . 1 . . . . 44 VAL HG2 . 11202 1 492 . 1 1 44 44 VAL HG22 H 1 0.770 0.030 . 1 . . . . 44 VAL HG2 . 11202 1 493 . 1 1 44 44 VAL HG23 H 1 0.770 0.030 . 1 . . . . 44 VAL HG2 . 11202 1 494 . 1 1 44 44 VAL C C 13 175.712 0.300 . 1 . . . . 44 VAL C . 11202 1 495 . 1 1 44 44 VAL CA C 13 63.810 0.300 . 1 . . . . 44 VAL CA . 11202 1 496 . 1 1 44 44 VAL CB C 13 31.680 0.300 . 1 . . . . 44 VAL CB . 11202 1 497 . 1 1 44 44 VAL CG1 C 13 22.516 0.300 . 2 . . . . 44 VAL CG1 . 11202 1 498 . 1 1 44 44 VAL CG2 C 13 21.318 0.300 . 2 . . . . 44 VAL CG2 . 11202 1 499 . 1 1 44 44 VAL N N 15 120.380 0.300 . 1 . . . . 44 VAL N . 11202 1 500 . 1 1 45 45 LYS H H 1 9.365 0.030 . 1 . . . . 45 LYS H . 11202 1 501 . 1 1 45 45 LYS HA H 1 4.420 0.030 . 1 . . . . 45 LYS HA . 11202 1 502 . 1 1 45 45 LYS HB2 H 1 1.769 0.030 . 2 . . . . 45 LYS HB2 . 11202 1 503 . 1 1 45 45 LYS HB3 H 1 1.463 0.030 . 2 . . . . 45 LYS HB3 . 11202 1 504 . 1 1 45 45 LYS HD2 H 1 1.725 0.030 . 2 . . . . 45 LYS HD2 . 11202 1 505 . 1 1 45 45 LYS HD3 H 1 1.556 0.030 . 2 . . . . 45 LYS HD3 . 11202 1 506 . 1 1 45 45 LYS HE2 H 1 2.953 0.030 . 1 . . . . 45 LYS HE2 . 11202 1 507 . 1 1 45 45 LYS HE3 H 1 2.953 0.030 . 1 . . . . 45 LYS HE3 . 11202 1 508 . 1 1 45 45 LYS HG2 H 1 1.396 0.030 . 1 . . . . 45 LYS HG2 . 11202 1 509 . 1 1 45 45 LYS HG3 H 1 1.396 0.030 . 1 . . . . 45 LYS HG3 . 11202 1 510 . 1 1 45 45 LYS C C 13 175.428 0.300 . 1 . . . . 45 LYS C . 11202 1 511 . 1 1 45 45 LYS CA C 13 57.240 0.300 . 1 . . . . 45 LYS CA . 11202 1 512 . 1 1 45 45 LYS CB C 13 34.084 0.300 . 1 . . . . 45 LYS CB . 11202 1 513 . 1 1 45 45 LYS CD C 13 29.079 0.300 . 1 . . . . 45 LYS CD . 11202 1 514 . 1 1 45 45 LYS CE C 13 42.273 0.300 . 1 . . . . 45 LYS CE . 11202 1 515 . 1 1 45 45 LYS CG C 13 24.779 0.300 . 1 . . . . 45 LYS CG . 11202 1 516 . 1 1 45 45 LYS N N 15 133.472 0.300 . 1 . . . . 45 LYS N . 11202 1 517 . 1 1 46 46 THR H H 1 7.279 0.030 . 1 . . . . 46 THR H . 11202 1 518 . 1 1 46 46 THR HA H 1 4.504 0.030 . 1 . . . . 46 THR HA . 11202 1 519 . 1 1 46 46 THR HB H 1 3.921 0.030 . 1 . . . . 46 THR HB . 11202 1 520 . 1 1 46 46 THR HG21 H 1 1.082 0.030 . 1 . . . . 46 THR HG2 . 11202 1 521 . 1 1 46 46 THR HG22 H 1 1.082 0.030 . 1 . . . . 46 THR HG2 . 11202 1 522 . 1 1 46 46 THR HG23 H 1 1.082 0.030 . 1 . . . . 46 THR HG2 . 11202 1 523 . 1 1 46 46 THR C C 13 171.961 0.300 . 1 . . . . 46 THR C . 11202 1 524 . 1 1 46 46 THR CA C 13 60.466 0.300 . 1 . . . . 46 THR CA . 11202 1 525 . 1 1 46 46 THR CB C 13 72.552 0.300 . 1 . . . . 46 THR CB . 11202 1 526 . 1 1 46 46 THR CG2 C 13 22.411 0.300 . 1 . . . . 46 THR CG2 . 11202 1 527 . 1 1 46 46 THR N N 15 107.187 0.300 . 1 . . . . 46 THR N . 11202 1 528 . 1 1 47 47 VAL H H 1 8.405 0.030 . 1 . . . . 47 VAL H . 11202 1 529 . 1 1 47 47 VAL HA H 1 4.442 0.030 . 1 . . . . 47 VAL HA . 11202 1 530 . 1 1 47 47 VAL HB H 1 1.891 0.030 . 1 . . . . 47 VAL HB . 11202 1 531 . 1 1 47 47 VAL HG11 H 1 0.795 0.030 . 1 . . . . 47 VAL HG1 . 11202 1 532 . 1 1 47 47 VAL HG12 H 1 0.795 0.030 . 1 . . . . 47 VAL HG1 . 11202 1 533 . 1 1 47 47 VAL HG13 H 1 0.795 0.030 . 1 . . . . 47 VAL HG1 . 11202 1 534 . 1 1 47 47 VAL HG21 H 1 0.693 0.030 . 1 . . . . 47 VAL HG2 . 11202 1 535 . 1 1 47 47 VAL HG22 H 1 0.693 0.030 . 1 . . . . 47 VAL HG2 . 11202 1 536 . 1 1 47 47 VAL HG23 H 1 0.693 0.030 . 1 . . . . 47 VAL HG2 . 11202 1 537 . 1 1 47 47 VAL C C 13 175.536 0.300 . 1 . . . . 47 VAL C . 11202 1 538 . 1 1 47 47 VAL CA C 13 61.443 0.300 . 1 . . . . 47 VAL CA . 11202 1 539 . 1 1 47 47 VAL CB C 13 33.367 0.300 . 1 . . . . 47 VAL CB . 11202 1 540 . 1 1 47 47 VAL CG1 C 13 21.698 0.300 . 2 . . . . 47 VAL CG1 . 11202 1 541 . 1 1 47 47 VAL CG2 C 13 21.154 0.300 . 2 . . . . 47 VAL CG2 . 11202 1 542 . 1 1 47 47 VAL N N 15 121.746 0.300 . 1 . . . . 47 VAL N . 11202 1 543 . 1 1 48 48 THR H H 1 8.062 0.030 . 1 . . . . 48 THR H . 11202 1 544 . 1 1 48 48 THR HA H 1 3.901 0.030 . 1 . . . . 48 THR HA . 11202 1 545 . 1 1 48 48 THR HB H 1 3.793 0.030 . 1 . . . . 48 THR HB . 11202 1 546 . 1 1 48 48 THR HG21 H 1 1.208 0.030 . 1 . . . . 48 THR HG2 . 11202 1 547 . 1 1 48 48 THR HG22 H 1 1.208 0.030 . 1 . . . . 48 THR HG2 . 11202 1 548 . 1 1 48 48 THR HG23 H 1 1.208 0.030 . 1 . . . . 48 THR HG2 . 11202 1 549 . 1 1 48 48 THR C C 13 175.603 0.300 . 1 . . . . 48 THR C . 11202 1 550 . 1 1 48 48 THR CA C 13 63.602 0.300 . 1 . . . . 48 THR CA . 11202 1 551 . 1 1 48 48 THR CB C 13 69.485 0.300 . 1 . . . . 48 THR CB . 11202 1 552 . 1 1 48 48 THR CG2 C 13 22.155 0.300 . 1 . . . . 48 THR CG2 . 11202 1 553 . 1 1 48 48 THR N N 15 123.165 0.300 . 1 . . . . 48 THR N . 11202 1 554 . 1 1 49 49 GLU H H 1 9.328 0.030 . 1 . . . . 49 GLU H . 11202 1 555 . 1 1 49 49 GLU HA H 1 3.938 0.030 . 1 . . . . 49 GLU HA . 11202 1 556 . 1 1 49 49 GLU HB2 H 1 2.044 0.030 . 2 . . . . 49 GLU HB2 . 11202 1 557 . 1 1 49 49 GLU HB3 H 1 1.958 0.030 . 2 . . . . 49 GLU HB3 . 11202 1 558 . 1 1 49 49 GLU HG2 H 1 2.292 0.030 . 2 . . . . 49 GLU HG2 . 11202 1 559 . 1 1 49 49 GLU HG3 H 1 2.259 0.030 . 2 . . . . 49 GLU HG3 . 11202 1 560 . 1 1 49 49 GLU C C 13 177.181 0.300 . 1 . . . . 49 GLU C . 11202 1 561 . 1 1 49 49 GLU CA C 13 58.626 0.300 . 1 . . . . 49 GLU CA . 11202 1 562 . 1 1 49 49 GLU CB C 13 28.970 0.300 . 1 . . . . 49 GLU CB . 11202 1 563 . 1 1 49 49 GLU CG C 13 35.635 0.300 . 1 . . . . 49 GLU CG . 11202 1 564 . 1 1 49 49 GLU N N 15 131.677 0.300 . 1 . . . . 49 GLU N . 11202 1 565 . 1 1 50 50 GLY H H 1 9.022 0.030 . 1 . . . . 50 GLY H . 11202 1 566 . 1 1 50 50 GLY HA2 H 1 4.257 0.030 . 2 . . . . 50 GLY HA2 . 11202 1 567 . 1 1 50 50 GLY HA3 H 1 3.742 0.030 . 2 . . . . 50 GLY HA3 . 11202 1 568 . 1 1 50 50 GLY C C 13 174.608 0.300 . 1 . . . . 50 GLY C . 11202 1 569 . 1 1 50 50 GLY CA C 13 45.523 0.300 . 1 . . . . 50 GLY CA . 11202 1 570 . 1 1 50 50 GLY N N 15 115.640 0.300 . 1 . . . . 50 GLY N . 11202 1 571 . 1 1 51 51 GLY H H 1 7.635 0.030 . 1 . . . . 51 GLY H . 11202 1 572 . 1 1 51 51 GLY HA2 H 1 4.350 0.030 . 2 . . . . 51 GLY HA2 . 11202 1 573 . 1 1 51 51 GLY HA3 H 1 3.891 0.030 . 2 . . . . 51 GLY HA3 . 11202 1 574 . 1 1 51 51 GLY C C 13 173.966 0.300 . 1 . . . . 51 GLY C . 11202 1 575 . 1 1 51 51 GLY CA C 13 45.017 0.300 . 1 . . . . 51 GLY CA . 11202 1 576 . 1 1 51 51 GLY N N 15 106.590 0.300 . 1 . . . . 51 GLY N . 11202 1 577 . 1 1 52 52 ALA H H 1 8.854 0.030 . 1 . . . . 52 ALA H . 11202 1 578 . 1 1 52 52 ALA HA H 1 3.915 0.030 . 1 . . . . 52 ALA HA . 11202 1 579 . 1 1 52 52 ALA HB1 H 1 1.507 0.030 . 1 . . . . 52 ALA HB . 11202 1 580 . 1 1 52 52 ALA HB2 H 1 1.507 0.030 . 1 . . . . 52 ALA HB . 11202 1 581 . 1 1 52 52 ALA HB3 H 1 1.507 0.030 . 1 . . . . 52 ALA HB . 11202 1 582 . 1 1 52 52 ALA C C 13 180.848 0.300 . 1 . . . . 52 ALA C . 11202 1 583 . 1 1 52 52 ALA CA C 13 55.874 0.300 . 1 . . . . 52 ALA CA . 11202 1 584 . 1 1 52 52 ALA CB C 13 18.239 0.300 . 1 . . . . 52 ALA CB . 11202 1 585 . 1 1 52 52 ALA N N 15 120.427 0.300 . 1 . . . . 52 ALA N . 11202 1 586 . 1 1 53 53 ALA H H 1 7.772 0.030 . 1 . . . . 53 ALA H . 11202 1 587 . 1 1 53 53 ALA HA H 1 4.129 0.030 . 1 . . . . 53 ALA HA . 11202 1 588 . 1 1 53 53 ALA HB1 H 1 1.268 0.030 . 1 . . . . 53 ALA HB . 11202 1 589 . 1 1 53 53 ALA HB2 H 1 1.268 0.030 . 1 . . . . 53 ALA HB . 11202 1 590 . 1 1 53 53 ALA HB3 H 1 1.268 0.030 . 1 . . . . 53 ALA HB . 11202 1 591 . 1 1 53 53 ALA C C 13 180.948 0.300 . 1 . . . . 53 ALA C . 11202 1 592 . 1 1 53 53 ALA CA C 13 54.926 0.300 . 1 . . . . 53 ALA CA . 11202 1 593 . 1 1 53 53 ALA CB C 13 18.555 0.300 . 1 . . . . 53 ALA CB . 11202 1 594 . 1 1 53 53 ALA N N 15 118.661 0.300 . 1 . . . . 53 ALA N . 11202 1 595 . 1 1 54 54 GLN H H 1 9.401 0.030 . 1 . . . . 54 GLN H . 11202 1 596 . 1 1 54 54 GLN HA H 1 3.932 0.030 . 1 . . . . 54 GLN HA . 11202 1 597 . 1 1 54 54 GLN HB2 H 1 2.244 0.030 . 2 . . . . 54 GLN HB2 . 11202 1 598 . 1 1 54 54 GLN HB3 H 1 1.971 0.030 . 2 . . . . 54 GLN HB3 . 11202 1 599 . 1 1 54 54 GLN HE21 H 1 7.556 0.030 . 2 . . . . 54 GLN HE21 . 11202 1 600 . 1 1 54 54 GLN HE22 H 1 7.067 0.030 . 2 . . . . 54 GLN HE22 . 11202 1 601 . 1 1 54 54 GLN HG2 H 1 2.510 0.030 . 2 . . . . 54 GLN HG2 . 11202 1 602 . 1 1 54 54 GLN HG3 H 1 2.310 0.030 . 2 . . . . 54 GLN HG3 . 11202 1 603 . 1 1 54 54 GLN C C 13 178.022 0.300 . 1 . . . . 54 GLN C . 11202 1 604 . 1 1 54 54 GLN CA C 13 59.744 0.300 . 1 . . . . 54 GLN CA . 11202 1 605 . 1 1 54 54 GLN CB C 13 28.142 0.300 . 1 . . . . 54 GLN CB . 11202 1 606 . 1 1 54 54 GLN CG C 13 34.487 0.300 . 1 . . . . 54 GLN CG . 11202 1 607 . 1 1 54 54 GLN N N 15 124.821 0.300 . 1 . . . . 54 GLN N . 11202 1 608 . 1 1 54 54 GLN NE2 N 15 114.451 0.300 . 1 . . . . 54 GLN NE2 . 11202 1 609 . 1 1 55 55 ARG H H 1 8.450 0.030 . 1 . . . . 55 ARG H . 11202 1 610 . 1 1 55 55 ARG HA H 1 3.862 0.030 . 1 . . . . 55 ARG HA . 11202 1 611 . 1 1 55 55 ARG HB2 H 1 1.825 0.030 . 2 . . . . 55 ARG HB2 . 11202 1 612 . 1 1 55 55 ARG HB3 H 1 1.797 0.030 . 2 . . . . 55 ARG HB3 . 11202 1 613 . 1 1 55 55 ARG HD2 H 1 3.288 0.030 . 2 . . . . 55 ARG HD2 . 11202 1 614 . 1 1 55 55 ARG HD3 H 1 3.174 0.030 . 2 . . . . 55 ARG HD3 . 11202 1 615 . 1 1 55 55 ARG HE H 1 7.103 0.030 . 1 . . . . 55 ARG HE . 11202 1 616 . 1 1 55 55 ARG HG2 H 1 1.836 0.030 . 2 . . . . 55 ARG HG2 . 11202 1 617 . 1 1 55 55 ARG HG3 H 1 1.478 0.030 . 2 . . . . 55 ARG HG3 . 11202 1 618 . 1 1 55 55 ARG C C 13 178.502 0.300 . 1 . . . . 55 ARG C . 11202 1 619 . 1 1 55 55 ARG CA C 13 59.684 0.300 . 1 . . . . 55 ARG CA . 11202 1 620 . 1 1 55 55 ARG CB C 13 30.157 0.300 . 1 . . . . 55 ARG CB . 11202 1 621 . 1 1 55 55 ARG CD C 13 43.430 0.300 . 1 . . . . 55 ARG CD . 11202 1 622 . 1 1 55 55 ARG CG C 13 28.198 0.300 . 1 . . . . 55 ARG CG . 11202 1 623 . 1 1 55 55 ARG N N 15 117.837 0.300 . 1 . . . . 55 ARG N . 11202 1 624 . 1 1 55 55 ARG NE N 15 82.995 0.300 . 1 . . . . 55 ARG NE . 11202 1 625 . 1 1 56 56 ASP H H 1 7.544 0.030 . 1 . . . . 56 ASP H . 11202 1 626 . 1 1 56 56 ASP HA H 1 4.424 0.030 . 1 . . . . 56 ASP HA . 11202 1 627 . 1 1 56 56 ASP HB2 H 1 2.784 0.030 . 2 . . . . 56 ASP HB2 . 11202 1 628 . 1 1 56 56 ASP HB3 H 1 2.588 0.030 . 2 . . . . 56 ASP HB3 . 11202 1 629 . 1 1 56 56 ASP C C 13 177.686 0.300 . 1 . . . . 56 ASP C . 11202 1 630 . 1 1 56 56 ASP CA C 13 57.160 0.300 . 1 . . . . 56 ASP CA . 11202 1 631 . 1 1 56 56 ASP CB C 13 44.221 0.300 . 1 . . . . 56 ASP CB . 11202 1 632 . 1 1 56 56 ASP N N 15 117.603 0.300 . 1 . . . . 56 ASP N . 11202 1 633 . 1 1 57 57 GLY H H 1 7.515 0.030 . 1 . . . . 57 GLY H . 11202 1 634 . 1 1 57 57 GLY HA2 H 1 4.083 0.030 . 2 . . . . 57 GLY HA2 . 11202 1 635 . 1 1 57 57 GLY HA3 H 1 3.912 0.030 . 2 . . . . 57 GLY HA3 . 11202 1 636 . 1 1 57 57 GLY C C 13 175.086 0.300 . 1 . . . . 57 GLY C . 11202 1 637 . 1 1 57 57 GLY CA C 13 46.410 0.300 . 1 . . . . 57 GLY CA . 11202 1 638 . 1 1 57 57 GLY N N 15 103.606 0.300 . 1 . . . . 57 GLY N . 11202 1 639 . 1 1 58 58 ARG H H 1 7.908 0.030 . 1 . . . . 58 ARG H . 11202 1 640 . 1 1 58 58 ARG HA H 1 4.271 0.030 . 1 . . . . 58 ARG HA . 11202 1 641 . 1 1 58 58 ARG HB2 H 1 2.075 0.030 . 2 . . . . 58 ARG HB2 . 11202 1 642 . 1 1 58 58 ARG HB3 H 1 1.755 0.030 . 2 . . . . 58 ARG HB3 . 11202 1 643 . 1 1 58 58 ARG HD2 H 1 3.449 0.030 . 2 . . . . 58 ARG HD2 . 11202 1 644 . 1 1 58 58 ARG HD3 H 1 3.165 0.030 . 2 . . . . 58 ARG HD3 . 11202 1 645 . 1 1 58 58 ARG HE H 1 9.191 0.030 . 1 . . . . 58 ARG HE . 11202 1 646 . 1 1 58 58 ARG HG2 H 1 1.731 0.030 . 1 . . . . 58 ARG HG2 . 11202 1 647 . 1 1 58 58 ARG HG3 H 1 1.731 0.030 . 1 . . . . 58 ARG HG3 . 11202 1 648 . 1 1 58 58 ARG C C 13 176.519 0.300 . 1 . . . . 58 ARG C . 11202 1 649 . 1 1 58 58 ARG CA C 13 59.140 0.300 . 1 . . . . 58 ARG CA . 11202 1 650 . 1 1 58 58 ARG CB C 13 33.452 0.300 . 1 . . . . 58 ARG CB . 11202 1 651 . 1 1 58 58 ARG CD C 13 44.257 0.300 . 1 . . . . 58 ARG CD . 11202 1 652 . 1 1 58 58 ARG CG C 13 27.753 0.300 . 1 . . . . 58 ARG CG . 11202 1 653 . 1 1 58 58 ARG N N 15 119.193 0.300 . 1 . . . . 58 ARG N . 11202 1 654 . 1 1 58 58 ARG NE N 15 87.724 0.300 . 1 . . . . 58 ARG NE . 11202 1 655 . 1 1 59 59 ILE H H 1 8.894 0.030 . 1 . . . . 59 ILE H . 11202 1 656 . 1 1 59 59 ILE HA H 1 3.919 0.030 . 1 . . . . 59 ILE HA . 11202 1 657 . 1 1 59 59 ILE HB H 1 1.386 0.030 . 1 . . . . 59 ILE HB . 11202 1 658 . 1 1 59 59 ILE HD11 H 1 0.313 0.030 . 1 . . . . 59 ILE HD1 . 11202 1 659 . 1 1 59 59 ILE HD12 H 1 0.313 0.030 . 1 . . . . 59 ILE HD1 . 11202 1 660 . 1 1 59 59 ILE HD13 H 1 0.313 0.030 . 1 . . . . 59 ILE HD1 . 11202 1 661 . 1 1 59 59 ILE HG12 H 1 1.722 0.030 . 2 . . . . 59 ILE HG12 . 11202 1 662 . 1 1 59 59 ILE HG13 H 1 0.667 0.030 . 2 . . . . 59 ILE HG13 . 11202 1 663 . 1 1 59 59 ILE HG21 H 1 0.705 0.030 . 1 . . . . 59 ILE HG2 . 11202 1 664 . 1 1 59 59 ILE HG22 H 1 0.705 0.030 . 1 . . . . 59 ILE HG2 . 11202 1 665 . 1 1 59 59 ILE HG23 H 1 0.705 0.030 . 1 . . . . 59 ILE HG2 . 11202 1 666 . 1 1 59 59 ILE C C 13 174.240 0.300 . 1 . . . . 59 ILE C . 11202 1 667 . 1 1 59 59 ILE CA C 13 62.696 0.300 . 1 . . . . 59 ILE CA . 11202 1 668 . 1 1 59 59 ILE CB C 13 38.888 0.300 . 1 . . . . 59 ILE CB . 11202 1 669 . 1 1 59 59 ILE CD1 C 13 13.107 0.300 . 1 . . . . 59 ILE CD1 . 11202 1 670 . 1 1 59 59 ILE CG1 C 13 29.607 0.300 . 1 . . . . 59 ILE CG1 . 11202 1 671 . 1 1 59 59 ILE CG2 C 13 18.474 0.300 . 1 . . . . 59 ILE CG2 . 11202 1 672 . 1 1 59 59 ILE N N 15 120.252 0.300 . 1 . . . . 59 ILE N . 11202 1 673 . 1 1 60 60 GLN H H 1 9.169 0.030 . 1 . . . . 60 GLN H . 11202 1 674 . 1 1 60 60 GLN HA H 1 4.608 0.030 . 1 . . . . 60 GLN HA . 11202 1 675 . 1 1 60 60 GLN HB2 H 1 2.078 0.030 . 2 . . . . 60 GLN HB2 . 11202 1 676 . 1 1 60 60 GLN HB3 H 1 1.855 0.030 . 2 . . . . 60 GLN HB3 . 11202 1 677 . 1 1 60 60 GLN HE21 H 1 7.106 0.030 . 2 . . . . 60 GLN HE21 . 11202 1 678 . 1 1 60 60 GLN HE22 H 1 6.768 0.030 . 2 . . . . 60 GLN HE22 . 11202 1 679 . 1 1 60 60 GLN HG2 H 1 2.399 0.030 . 2 . . . . 60 GLN HG2 . 11202 1 680 . 1 1 60 60 GLN HG3 H 1 2.326 0.030 . 2 . . . . 60 GLN HG3 . 11202 1 681 . 1 1 60 60 GLN C C 13 175.294 0.300 . 1 . . . . 60 GLN C . 11202 1 682 . 1 1 60 60 GLN CA C 13 53.031 0.300 . 1 . . . . 60 GLN CA . 11202 1 683 . 1 1 60 60 GLN CB C 13 32.288 0.300 . 1 . . . . 60 GLN CB . 11202 1 684 . 1 1 60 60 GLN CG C 13 33.444 0.300 . 1 . . . . 60 GLN CG . 11202 1 685 . 1 1 60 60 GLN N N 15 125.857 0.300 . 1 . . . . 60 GLN N . 11202 1 686 . 1 1 60 60 GLN NE2 N 15 111.422 0.300 . 1 . . . . 60 GLN NE2 . 11202 1 687 . 1 1 61 61 VAL H H 1 8.312 0.030 . 1 . . . . 61 VAL H . 11202 1 688 . 1 1 61 61 VAL HA H 1 3.267 0.030 . 1 . . . . 61 VAL HA . 11202 1 689 . 1 1 61 61 VAL HB H 1 1.866 0.030 . 1 . . . . 61 VAL HB . 11202 1 690 . 1 1 61 61 VAL HG11 H 1 0.957 0.030 . 1 . . . . 61 VAL HG1 . 11202 1 691 . 1 1 61 61 VAL HG12 H 1 0.957 0.030 . 1 . . . . 61 VAL HG1 . 11202 1 692 . 1 1 61 61 VAL HG13 H 1 0.957 0.030 . 1 . . . . 61 VAL HG1 . 11202 1 693 . 1 1 61 61 VAL HG21 H 1 0.973 0.030 . 1 . . . . 61 VAL HG2 . 11202 1 694 . 1 1 61 61 VAL HG22 H 1 0.973 0.030 . 1 . . . . 61 VAL HG2 . 11202 1 695 . 1 1 61 61 VAL HG23 H 1 0.973 0.030 . 1 . . . . 61 VAL HG2 . 11202 1 696 . 1 1 61 61 VAL C C 13 177.655 0.300 . 1 . . . . 61 VAL C . 11202 1 697 . 1 1 61 61 VAL CA C 13 65.460 0.300 . 1 . . . . 61 VAL CA . 11202 1 698 . 1 1 61 61 VAL CB C 13 31.796 0.300 . 1 . . . . 61 VAL CB . 11202 1 699 . 1 1 61 61 VAL CG1 C 13 21.395 0.300 . 2 . . . . 61 VAL CG1 . 11202 1 700 . 1 1 61 61 VAL CG2 C 13 23.047 0.300 . 2 . . . . 61 VAL CG2 . 11202 1 701 . 1 1 61 61 VAL N N 15 119.243 0.300 . 1 . . . . 61 VAL N . 11202 1 702 . 1 1 62 62 ASN H H 1 9.211 0.030 . 1 . . . . 62 ASN H . 11202 1 703 . 1 1 62 62 ASN HA H 1 4.335 0.030 . 1 . . . . 62 ASN HA . 11202 1 704 . 1 1 62 62 ASN HB2 H 1 3.425 0.030 . 2 . . . . 62 ASN HB2 . 11202 1 705 . 1 1 62 62 ASN HB3 H 1 3.146 0.030 . 2 . . . . 62 ASN HB3 . 11202 1 706 . 1 1 62 62 ASN HD21 H 1 7.666 0.030 . 2 . . . . 62 ASN HD21 . 11202 1 707 . 1 1 62 62 ASN HD22 H 1 6.812 0.030 . 2 . . . . 62 ASN HD22 . 11202 1 708 . 1 1 62 62 ASN C C 13 174.777 0.300 . 1 . . . . 62 ASN C . 11202 1 709 . 1 1 62 62 ASN CA C 13 56.309 0.300 . 1 . . . . 62 ASN CA . 11202 1 710 . 1 1 62 62 ASN CB C 13 37.390 0.300 . 1 . . . . 62 ASN CB . 11202 1 711 . 1 1 62 62 ASN N N 15 119.518 0.300 . 1 . . . . 62 ASN N . 11202 1 712 . 1 1 62 62 ASN ND2 N 15 113.036 0.300 . 1 . . . . 62 ASN ND2 . 11202 1 713 . 1 1 63 63 ASP H H 1 8.098 0.030 . 1 . . . . 63 ASP H . 11202 1 714 . 1 1 63 63 ASP HA H 1 4.845 0.030 . 1 . . . . 63 ASP HA . 11202 1 715 . 1 1 63 63 ASP HB2 H 1 2.730 0.030 . 2 . . . . 63 ASP HB2 . 11202 1 716 . 1 1 63 63 ASP HB3 H 1 2.593 0.030 . 2 . . . . 63 ASP HB3 . 11202 1 717 . 1 1 63 63 ASP C C 13 175.350 0.300 . 1 . . . . 63 ASP C . 11202 1 718 . 1 1 63 63 ASP CA C 13 55.937 0.300 . 1 . . . . 63 ASP CA . 11202 1 719 . 1 1 63 63 ASP CB C 13 40.999 0.300 . 1 . . . . 63 ASP CB . 11202 1 720 . 1 1 63 63 ASP N N 15 121.760 0.300 . 1 . . . . 63 ASP N . 11202 1 721 . 1 1 64 64 GLN H H 1 9.311 0.030 . 1 . . . . 64 GLN H . 11202 1 722 . 1 1 64 64 GLN HA H 1 4.378 0.030 . 1 . . . . 64 GLN HA . 11202 1 723 . 1 1 64 64 GLN HB2 H 1 1.763 0.030 . 2 . . . . 64 GLN HB2 . 11202 1 724 . 1 1 64 64 GLN HB3 H 1 1.613 0.030 . 2 . . . . 64 GLN HB3 . 11202 1 725 . 1 1 64 64 GLN HE21 H 1 7.493 0.030 . 2 . . . . 64 GLN HE21 . 11202 1 726 . 1 1 64 64 GLN HE22 H 1 6.593 0.030 . 2 . . . . 64 GLN HE22 . 11202 1 727 . 1 1 64 64 GLN HG2 H 1 1.428 0.030 . 2 . . . . 64 GLN HG2 . 11202 1 728 . 1 1 64 64 GLN HG3 H 1 1.326 0.030 . 2 . . . . 64 GLN HG3 . 11202 1 729 . 1 1 64 64 GLN C C 13 176.417 0.300 . 1 . . . . 64 GLN C . 11202 1 730 . 1 1 64 64 GLN CA C 13 54.146 0.300 . 1 . . . . 64 GLN CA . 11202 1 731 . 1 1 64 64 GLN CB C 13 29.840 0.300 . 1 . . . . 64 GLN CB . 11202 1 732 . 1 1 64 64 GLN CG C 13 32.952 0.300 . 1 . . . . 64 GLN CG . 11202 1 733 . 1 1 64 64 GLN N N 15 121.662 0.300 . 1 . . . . 64 GLN N . 11202 1 734 . 1 1 64 64 GLN NE2 N 15 105.991 0.300 . 1 . . . . 64 GLN NE2 . 11202 1 735 . 1 1 65 65 ILE H H 1 8.822 0.030 . 1 . . . . 65 ILE H . 11202 1 736 . 1 1 65 65 ILE HA H 1 4.124 0.030 . 1 . . . . 65 ILE HA . 11202 1 737 . 1 1 65 65 ILE HB H 1 1.614 0.030 . 1 . . . . 65 ILE HB . 11202 1 738 . 1 1 65 65 ILE HD11 H 1 0.500 0.030 . 1 . . . . 65 ILE HD1 . 11202 1 739 . 1 1 65 65 ILE HD12 H 1 0.500 0.030 . 1 . . . . 65 ILE HD1 . 11202 1 740 . 1 1 65 65 ILE HD13 H 1 0.500 0.030 . 1 . . . . 65 ILE HD1 . 11202 1 741 . 1 1 65 65 ILE HG12 H 1 1.304 0.030 . 2 . . . . 65 ILE HG12 . 11202 1 742 . 1 1 65 65 ILE HG13 H 1 0.547 0.030 . 2 . . . . 65 ILE HG13 . 11202 1 743 . 1 1 65 65 ILE HG21 H 1 0.750 0.030 . 1 . . . . 65 ILE HG2 . 11202 1 744 . 1 1 65 65 ILE HG22 H 1 0.750 0.030 . 1 . . . . 65 ILE HG2 . 11202 1 745 . 1 1 65 65 ILE HG23 H 1 0.750 0.030 . 1 . . . . 65 ILE HG2 . 11202 1 746 . 1 1 65 65 ILE C C 13 174.735 0.300 . 1 . . . . 65 ILE C . 11202 1 747 . 1 1 65 65 ILE CA C 13 61.184 0.300 . 1 . . . . 65 ILE CA . 11202 1 748 . 1 1 65 65 ILE CB C 13 36.668 0.300 . 1 . . . . 65 ILE CB . 11202 1 749 . 1 1 65 65 ILE CD1 C 13 13.204 0.300 . 1 . . . . 65 ILE CD1 . 11202 1 750 . 1 1 65 65 ILE CG1 C 13 26.503 0.300 . 1 . . . . 65 ILE CG1 . 11202 1 751 . 1 1 65 65 ILE CG2 C 13 20.261 0.300 . 1 . . . . 65 ILE CG2 . 11202 1 752 . 1 1 65 65 ILE N N 15 126.003 0.300 . 1 . . . . 65 ILE N . 11202 1 753 . 1 1 66 66 VAL H H 1 8.554 0.030 . 1 . . . . 66 VAL H . 11202 1 754 . 1 1 66 66 VAL HA H 1 3.739 0.030 . 1 . . . . 66 VAL HA . 11202 1 755 . 1 1 66 66 VAL HB H 1 1.705 0.030 . 1 . . . . 66 VAL HB . 11202 1 756 . 1 1 66 66 VAL HG11 H 1 0.781 0.030 . 1 . . . . 66 VAL HG1 . 11202 1 757 . 1 1 66 66 VAL HG12 H 1 0.781 0.030 . 1 . . . . 66 VAL HG1 . 11202 1 758 . 1 1 66 66 VAL HG13 H 1 0.781 0.030 . 1 . . . . 66 VAL HG1 . 11202 1 759 . 1 1 66 66 VAL HG21 H 1 0.600 0.030 . 1 . . . . 66 VAL HG2 . 11202 1 760 . 1 1 66 66 VAL HG22 H 1 0.600 0.030 . 1 . . . . 66 VAL HG2 . 11202 1 761 . 1 1 66 66 VAL HG23 H 1 0.600 0.030 . 1 . . . . 66 VAL HG2 . 11202 1 762 . 1 1 66 66 VAL C C 13 176.518 0.300 . 1 . . . . 66 VAL C . 11202 1 763 . 1 1 66 66 VAL CA C 13 64.731 0.300 . 1 . . . . 66 VAL CA . 11202 1 764 . 1 1 66 66 VAL CB C 13 32.603 0.300 . 1 . . . . 66 VAL CB . 11202 1 765 . 1 1 66 66 VAL CG1 C 13 20.959 0.300 . 2 . . . . 66 VAL CG1 . 11202 1 766 . 1 1 66 66 VAL CG2 C 13 21.392 0.300 . 2 . . . . 66 VAL CG2 . 11202 1 767 . 1 1 66 66 VAL N N 15 128.804 0.300 . 1 . . . . 66 VAL N . 11202 1 768 . 1 1 67 67 GLU H H 1 7.898 0.030 . 1 . . . . 67 GLU H . 11202 1 769 . 1 1 67 67 GLU HA H 1 5.138 0.030 . 1 . . . . 67 GLU HA . 11202 1 770 . 1 1 67 67 GLU HB2 H 1 1.788 0.030 . 2 . . . . 67 GLU HB2 . 11202 1 771 . 1 1 67 67 GLU HB3 H 1 1.723 0.030 . 2 . . . . 67 GLU HB3 . 11202 1 772 . 1 1 67 67 GLU HG2 H 1 1.868 0.030 . 1 . . . . 67 GLU HG2 . 11202 1 773 . 1 1 67 67 GLU HG3 H 1 1.868 0.030 . 1 . . . . 67 GLU HG3 . 11202 1 774 . 1 1 67 67 GLU C C 13 174.487 0.300 . 1 . . . . 67 GLU C . 11202 1 775 . 1 1 67 67 GLU CA C 13 55.200 0.300 . 1 . . . . 67 GLU CA . 11202 1 776 . 1 1 67 67 GLU CB C 13 35.738 0.300 . 1 . . . . 67 GLU CB . 11202 1 777 . 1 1 67 67 GLU CG C 13 37.223 0.300 . 1 . . . . 67 GLU CG . 11202 1 778 . 1 1 67 67 GLU N N 15 119.545 0.300 . 1 . . . . 67 GLU N . 11202 1 779 . 1 1 68 68 VAL H H 1 8.561 0.030 . 1 . . . . 68 VAL H . 11202 1 780 . 1 1 68 68 VAL HA H 1 4.518 0.030 . 1 . . . . 68 VAL HA . 11202 1 781 . 1 1 68 68 VAL HB H 1 1.646 0.030 . 1 . . . . 68 VAL HB . 11202 1 782 . 1 1 68 68 VAL HG11 H 1 0.474 0.030 . 1 . . . . 68 VAL HG1 . 11202 1 783 . 1 1 68 68 VAL HG12 H 1 0.474 0.030 . 1 . . . . 68 VAL HG1 . 11202 1 784 . 1 1 68 68 VAL HG13 H 1 0.474 0.030 . 1 . . . . 68 VAL HG1 . 11202 1 785 . 1 1 68 68 VAL HG21 H 1 0.582 0.030 . 1 . . . . 68 VAL HG2 . 11202 1 786 . 1 1 68 68 VAL HG22 H 1 0.582 0.030 . 1 . . . . 68 VAL HG2 . 11202 1 787 . 1 1 68 68 VAL HG23 H 1 0.582 0.030 . 1 . . . . 68 VAL HG2 . 11202 1 788 . 1 1 68 68 VAL C C 13 174.342 0.300 . 1 . . . . 68 VAL C . 11202 1 789 . 1 1 68 68 VAL CA C 13 60.403 0.300 . 1 . . . . 68 VAL CA . 11202 1 790 . 1 1 68 68 VAL CB C 13 34.663 0.300 . 1 . . . . 68 VAL CB . 11202 1 791 . 1 1 68 68 VAL CG1 C 13 20.614 0.300 . 2 . . . . 68 VAL CG1 . 11202 1 792 . 1 1 68 68 VAL CG2 C 13 22.750 0.300 . 2 . . . . 68 VAL CG2 . 11202 1 793 . 1 1 68 68 VAL N N 15 122.329 0.300 . 1 . . . . 68 VAL N . 11202 1 794 . 1 1 69 69 ASP H H 1 9.657 0.030 . 1 . . . . 69 ASP H . 11202 1 795 . 1 1 69 69 ASP HA H 1 4.190 0.030 . 1 . . . . 69 ASP HA . 11202 1 796 . 1 1 69 69 ASP HB2 H 1 2.862 0.030 . 2 . . . . 69 ASP HB2 . 11202 1 797 . 1 1 69 69 ASP HB3 H 1 2.565 0.030 . 2 . . . . 69 ASP HB3 . 11202 1 798 . 1 1 69 69 ASP C C 13 176.048 0.300 . 1 . . . . 69 ASP C . 11202 1 799 . 1 1 69 69 ASP CA C 13 55.660 0.300 . 1 . . . . 69 ASP CA . 11202 1 800 . 1 1 69 69 ASP CB C 13 39.609 0.300 . 1 . . . . 69 ASP CB . 11202 1 801 . 1 1 69 69 ASP N N 15 127.285 0.300 . 1 . . . . 69 ASP N . 11202 1 802 . 1 1 70 70 GLY H H 1 8.342 0.030 . 1 . . . . 70 GLY H . 11202 1 803 . 1 1 70 70 GLY HA2 H 1 4.058 0.030 . 2 . . . . 70 GLY HA2 . 11202 1 804 . 1 1 70 70 GLY HA3 H 1 3.572 0.030 . 2 . . . . 70 GLY HA3 . 11202 1 805 . 1 1 70 70 GLY C C 13 173.812 0.300 . 1 . . . . 70 GLY C . 11202 1 806 . 1 1 70 70 GLY CA C 13 45.411 0.300 . 1 . . . . 70 GLY CA . 11202 1 807 . 1 1 70 70 GLY N N 15 102.433 0.300 . 1 . . . . 70 GLY N . 11202 1 808 . 1 1 71 71 ILE H H 1 8.530 0.030 . 1 . . . . 71 ILE H . 11202 1 809 . 1 1 71 71 ILE HA H 1 4.066 0.030 . 1 . . . . 71 ILE HA . 11202 1 810 . 1 1 71 71 ILE HB H 1 2.197 0.030 . 1 . . . . 71 ILE HB . 11202 1 811 . 1 1 71 71 ILE HD11 H 1 0.865 0.030 . 1 . . . . 71 ILE HD1 . 11202 1 812 . 1 1 71 71 ILE HD12 H 1 0.865 0.030 . 1 . . . . 71 ILE HD1 . 11202 1 813 . 1 1 71 71 ILE HD13 H 1 0.865 0.030 . 1 . . . . 71 ILE HD1 . 11202 1 814 . 1 1 71 71 ILE HG12 H 1 1.542 0.030 . 2 . . . . 71 ILE HG12 . 11202 1 815 . 1 1 71 71 ILE HG13 H 1 1.031 0.030 . 2 . . . . 71 ILE HG13 . 11202 1 816 . 1 1 71 71 ILE HG21 H 1 1.033 0.030 . 1 . . . . 71 ILE HG2 . 11202 1 817 . 1 1 71 71 ILE HG22 H 1 1.033 0.030 . 1 . . . . 71 ILE HG2 . 11202 1 818 . 1 1 71 71 ILE HG23 H 1 1.033 0.030 . 1 . . . . 71 ILE HG2 . 11202 1 819 . 1 1 71 71 ILE C C 13 175.567 0.300 . 1 . . . . 71 ILE C . 11202 1 820 . 1 1 71 71 ILE CA C 13 60.493 0.300 . 1 . . . . 71 ILE CA . 11202 1 821 . 1 1 71 71 ILE CB C 13 38.196 0.300 . 1 . . . . 71 ILE CB . 11202 1 822 . 1 1 71 71 ILE CD1 C 13 13.450 0.300 . 1 . . . . 71 ILE CD1 . 11202 1 823 . 1 1 71 71 ILE CG1 C 13 27.419 0.300 . 1 . . . . 71 ILE CG1 . 11202 1 824 . 1 1 71 71 ILE CG2 C 13 17.141 0.300 . 1 . . . . 71 ILE CG2 . 11202 1 825 . 1 1 71 71 ILE N N 15 124.603 0.300 . 1 . . . . 71 ILE N . 11202 1 826 . 1 1 72 72 SER H H 1 8.658 0.030 . 1 . . . . 72 SER H . 11202 1 827 . 1 1 72 72 SER HA H 1 4.466 0.030 . 1 . . . . 72 SER HA . 11202 1 828 . 1 1 72 72 SER HB2 H 1 4.062 0.030 . 2 . . . . 72 SER HB2 . 11202 1 829 . 1 1 72 72 SER HB3 H 1 3.866 0.030 . 2 . . . . 72 SER HB3 . 11202 1 830 . 1 1 72 72 SER C C 13 175.643 0.300 . 1 . . . . 72 SER C . 11202 1 831 . 1 1 72 72 SER CA C 13 58.728 0.300 . 1 . . . . 72 SER CA . 11202 1 832 . 1 1 72 72 SER CB C 13 63.519 0.300 . 1 . . . . 72 SER CB . 11202 1 833 . 1 1 72 72 SER N N 15 120.492 0.300 . 1 . . . . 72 SER N . 11202 1 834 . 1 1 73 73 LEU H H 1 8.279 0.030 . 1 . . . . 73 LEU H . 11202 1 835 . 1 1 73 73 LEU HA H 1 4.837 0.030 . 1 . . . . 73 LEU HA . 11202 1 836 . 1 1 73 73 LEU HB2 H 1 1.865 0.030 . 2 . . . . 73 LEU HB2 . 11202 1 837 . 1 1 73 73 LEU HB3 H 1 1.538 0.030 . 2 . . . . 73 LEU HB3 . 11202 1 838 . 1 1 73 73 LEU HD11 H 1 0.786 0.030 . 1 . . . . 73 LEU HD1 . 11202 1 839 . 1 1 73 73 LEU HD12 H 1 0.786 0.030 . 1 . . . . 73 LEU HD1 . 11202 1 840 . 1 1 73 73 LEU HD13 H 1 0.786 0.030 . 1 . . . . 73 LEU HD1 . 11202 1 841 . 1 1 73 73 LEU HD21 H 1 0.901 0.030 . 1 . . . . 73 LEU HD2 . 11202 1 842 . 1 1 73 73 LEU HD22 H 1 0.901 0.030 . 1 . . . . 73 LEU HD2 . 11202 1 843 . 1 1 73 73 LEU HD23 H 1 0.901 0.030 . 1 . . . . 73 LEU HD2 . 11202 1 844 . 1 1 73 73 LEU HG H 1 1.633 0.030 . 1 . . . . 73 LEU HG . 11202 1 845 . 1 1 73 73 LEU C C 13 177.029 0.300 . 1 . . . . 73 LEU C . 11202 1 846 . 1 1 73 73 LEU CA C 13 53.277 0.300 . 1 . . . . 73 LEU CA . 11202 1 847 . 1 1 73 73 LEU CB C 13 40.161 0.300 . 1 . . . . 73 LEU CB . 11202 1 848 . 1 1 73 73 LEU CD1 C 13 25.824 0.300 . 2 . . . . 73 LEU CD1 . 11202 1 849 . 1 1 73 73 LEU CD2 C 13 23.673 0.300 . 2 . . . . 73 LEU CD2 . 11202 1 850 . 1 1 73 73 LEU CG C 13 27.525 0.300 . 1 . . . . 73 LEU CG . 11202 1 851 . 1 1 73 73 LEU N N 15 125.632 0.300 . 1 . . . . 73 LEU N . 11202 1 852 . 1 1 74 74 VAL H H 1 8.033 0.030 . 1 . . . . 74 VAL H . 11202 1 853 . 1 1 74 74 VAL HA H 1 3.975 0.030 . 1 . . . . 74 VAL HA . 11202 1 854 . 1 1 74 74 VAL HB H 1 1.915 0.030 . 1 . . . . 74 VAL HB . 11202 1 855 . 1 1 74 74 VAL HG11 H 1 0.908 0.030 . 1 . . . . 74 VAL HG1 . 11202 1 856 . 1 1 74 74 VAL HG12 H 1 0.908 0.030 . 1 . . . . 74 VAL HG1 . 11202 1 857 . 1 1 74 74 VAL HG13 H 1 0.908 0.030 . 1 . . . . 74 VAL HG1 . 11202 1 858 . 1 1 74 74 VAL HG21 H 1 1.035 0.030 . 1 . . . . 74 VAL HG2 . 11202 1 859 . 1 1 74 74 VAL HG22 H 1 1.035 0.030 . 1 . . . . 74 VAL HG2 . 11202 1 860 . 1 1 74 74 VAL HG23 H 1 1.035 0.030 . 1 . . . . 74 VAL HG2 . 11202 1 861 . 1 1 74 74 VAL C C 13 176.190 0.300 . 1 . . . . 74 VAL C . 11202 1 862 . 1 1 74 74 VAL CA C 13 63.655 0.300 . 1 . . . . 74 VAL CA . 11202 1 863 . 1 1 74 74 VAL CB C 13 31.968 0.300 . 1 . . . . 74 VAL CB . 11202 1 864 . 1 1 74 74 VAL CG1 C 13 21.171 0.300 . 2 . . . . 74 VAL CG1 . 11202 1 865 . 1 1 74 74 VAL CG2 C 13 21.937 0.300 . 2 . . . . 74 VAL CG2 . 11202 1 866 . 1 1 74 74 VAL N N 15 124.286 0.300 . 1 . . . . 74 VAL N . 11202 1 867 . 1 1 75 75 GLY H H 1 8.524 0.030 . 1 . . . . 75 GLY H . 11202 1 868 . 1 1 75 75 GLY HA2 H 1 4.026 0.030 . 2 . . . . 75 GLY HA2 . 11202 1 869 . 1 1 75 75 GLY HA3 H 1 3.805 0.030 . 2 . . . . 75 GLY HA3 . 11202 1 870 . 1 1 75 75 GLY C C 13 174.252 0.300 . 1 . . . . 75 GLY C . 11202 1 871 . 1 1 75 75 GLY CA C 13 46.777 0.300 . 1 . . . . 75 GLY CA . 11202 1 872 . 1 1 75 75 GLY N N 15 117.433 0.300 . 1 . . . . 75 GLY N . 11202 1 873 . 1 1 76 76 VAL H H 1 7.317 0.030 . 1 . . . . 76 VAL H . 11202 1 874 . 1 1 76 76 VAL HA H 1 4.729 0.030 . 1 . . . . 76 VAL HA . 11202 1 875 . 1 1 76 76 VAL HB H 1 2.246 0.030 . 1 . . . . 76 VAL HB . 11202 1 876 . 1 1 76 76 VAL HG11 H 1 0.603 0.030 . 1 . . . . 76 VAL HG1 . 11202 1 877 . 1 1 76 76 VAL HG12 H 1 0.603 0.030 . 1 . . . . 76 VAL HG1 . 11202 1 878 . 1 1 76 76 VAL HG13 H 1 0.603 0.030 . 1 . . . . 76 VAL HG1 . 11202 1 879 . 1 1 76 76 VAL HG21 H 1 0.888 0.030 . 1 . . . . 76 VAL HG2 . 11202 1 880 . 1 1 76 76 VAL HG22 H 1 0.888 0.030 . 1 . . . . 76 VAL HG2 . 11202 1 881 . 1 1 76 76 VAL HG23 H 1 0.888 0.030 . 1 . . . . 76 VAL HG2 . 11202 1 882 . 1 1 76 76 VAL C C 13 174.819 0.300 . 1 . . . . 76 VAL C . 11202 1 883 . 1 1 76 76 VAL CA C 13 58.319 0.300 . 1 . . . . 76 VAL CA . 11202 1 884 . 1 1 76 76 VAL CB C 13 34.311 0.300 . 1 . . . . 76 VAL CB . 11202 1 885 . 1 1 76 76 VAL CG1 C 13 21.205 0.300 . 2 . . . . 76 VAL CG1 . 11202 1 886 . 1 1 76 76 VAL CG2 C 13 17.817 0.300 . 2 . . . . 76 VAL CG2 . 11202 1 887 . 1 1 76 76 VAL N N 15 111.172 0.300 . 1 . . . . 76 VAL N . 11202 1 888 . 1 1 77 77 THR H H 1 8.026 0.030 . 1 . . . . 77 THR H . 11202 1 889 . 1 1 77 77 THR HA H 1 4.437 0.030 . 1 . . . . 77 THR HA . 11202 1 890 . 1 1 77 77 THR HB H 1 4.794 0.030 . 1 . . . . 77 THR HB . 11202 1 891 . 1 1 77 77 THR HG21 H 1 1.370 0.030 . 1 . . . . 77 THR HG2 . 11202 1 892 . 1 1 77 77 THR HG22 H 1 1.370 0.030 . 1 . . . . 77 THR HG2 . 11202 1 893 . 1 1 77 77 THR HG23 H 1 1.370 0.030 . 1 . . . . 77 THR HG2 . 11202 1 894 . 1 1 77 77 THR C C 13 175.736 0.300 . 1 . . . . 77 THR C . 11202 1 895 . 1 1 77 77 THR CA C 13 60.464 0.300 . 1 . . . . 77 THR CA . 11202 1 896 . 1 1 77 77 THR CB C 13 71.267 0.300 . 1 . . . . 77 THR CB . 11202 1 897 . 1 1 77 77 THR CG2 C 13 22.122 0.300 . 1 . . . . 77 THR CG2 . 11202 1 898 . 1 1 77 77 THR N N 15 108.244 0.300 . 1 . . . . 77 THR N . 11202 1 899 . 1 1 78 78 GLN H H 1 9.145 0.030 . 1 . . . . 78 GLN H . 11202 1 900 . 1 1 78 78 GLN HA H 1 3.855 0.030 . 1 . . . . 78 GLN HA . 11202 1 901 . 1 1 78 78 GLN HB2 H 1 2.119 0.030 . 1 . . . . 78 GLN HB2 . 11202 1 902 . 1 1 78 78 GLN HB3 H 1 2.119 0.030 . 1 . . . . 78 GLN HB3 . 11202 1 903 . 1 1 78 78 GLN HE21 H 1 7.621 0.030 . 2 . . . . 78 GLN HE21 . 11202 1 904 . 1 1 78 78 GLN HE22 H 1 6.873 0.030 . 2 . . . . 78 GLN HE22 . 11202 1 905 . 1 1 78 78 GLN HG2 H 1 2.451 0.030 . 2 . . . . 78 GLN HG2 . 11202 1 906 . 1 1 78 78 GLN HG3 H 1 2.189 0.030 . 2 . . . . 78 GLN HG3 . 11202 1 907 . 1 1 78 78 GLN C C 13 177.863 0.300 . 1 . . . . 78 GLN C . 11202 1 908 . 1 1 78 78 GLN CA C 13 60.071 0.300 . 1 . . . . 78 GLN CA . 11202 1 909 . 1 1 78 78 GLN CB C 13 28.538 0.300 . 1 . . . . 78 GLN CB . 11202 1 910 . 1 1 78 78 GLN CG C 13 34.222 0.300 . 1 . . . . 78 GLN CG . 11202 1 911 . 1 1 78 78 GLN N N 15 121.157 0.300 . 1 . . . . 78 GLN N . 11202 1 912 . 1 1 78 78 GLN NE2 N 15 111.699 0.300 . 1 . . . . 78 GLN NE2 . 11202 1 913 . 1 1 79 79 ASN H H 1 8.624 0.030 . 1 . . . . 79 ASN H . 11202 1 914 . 1 1 79 79 ASN HA H 1 4.460 0.030 . 1 . . . . 79 ASN HA . 11202 1 915 . 1 1 79 79 ASN HB2 H 1 2.831 0.030 . 2 . . . . 79 ASN HB2 . 11202 1 916 . 1 1 79 79 ASN HB3 H 1 2.778 0.030 . 2 . . . . 79 ASN HB3 . 11202 1 917 . 1 1 79 79 ASN HD21 H 1 7.718 0.030 . 2 . . . . 79 ASN HD21 . 11202 1 918 . 1 1 79 79 ASN HD22 H 1 7.030 0.030 . 2 . . . . 79 ASN HD22 . 11202 1 919 . 1 1 79 79 ASN C C 13 177.781 0.300 . 1 . . . . 79 ASN C . 11202 1 920 . 1 1 79 79 ASN CA C 13 56.493 0.300 . 1 . . . . 79 ASN CA . 11202 1 921 . 1 1 79 79 ASN CB C 13 38.439 0.300 . 1 . . . . 79 ASN CB . 11202 1 922 . 1 1 79 79 ASN N N 15 116.025 0.300 . 1 . . . . 79 ASN N . 11202 1 923 . 1 1 79 79 ASN ND2 N 15 113.274 0.300 . 1 . . . . 79 ASN ND2 . 11202 1 924 . 1 1 80 80 PHE H H 1 8.155 0.030 . 1 . . . . 80 PHE H . 11202 1 925 . 1 1 80 80 PHE HA H 1 4.172 0.030 . 1 . . . . 80 PHE HA . 11202 1 926 . 1 1 80 80 PHE HB2 H 1 3.230 0.030 . 2 . . . . 80 PHE HB2 . 11202 1 927 . 1 1 80 80 PHE HB3 H 1 3.174 0.030 . 2 . . . . 80 PHE HB3 . 11202 1 928 . 1 1 80 80 PHE HD1 H 1 7.081 0.030 . 1 . . . . 80 PHE HD1 . 11202 1 929 . 1 1 80 80 PHE HD2 H 1 7.081 0.030 . 1 . . . . 80 PHE HD2 . 11202 1 930 . 1 1 80 80 PHE HE1 H 1 7.271 0.030 . 1 . . . . 80 PHE HE1 . 11202 1 931 . 1 1 80 80 PHE HE2 H 1 7.271 0.030 . 1 . . . . 80 PHE HE2 . 11202 1 932 . 1 1 80 80 PHE HZ H 1 7.234 0.030 . 1 . . . . 80 PHE HZ . 11202 1 933 . 1 1 80 80 PHE C C 13 177.448 0.300 . 1 . . . . 80 PHE C . 11202 1 934 . 1 1 80 80 PHE CA C 13 61.799 0.300 . 1 . . . . 80 PHE CA . 11202 1 935 . 1 1 80 80 PHE CB C 13 39.465 0.300 . 1 . . . . 80 PHE CB . 11202 1 936 . 1 1 80 80 PHE CD1 C 13 131.569 0.300 . 1 . . . . 80 PHE CD1 . 11202 1 937 . 1 1 80 80 PHE CD2 C 13 131.569 0.300 . 1 . . . . 80 PHE CD2 . 11202 1 938 . 1 1 80 80 PHE CE1 C 13 131.544 0.300 . 1 . . . . 80 PHE CE1 . 11202 1 939 . 1 1 80 80 PHE CE2 C 13 131.544 0.300 . 1 . . . . 80 PHE CE2 . 11202 1 940 . 1 1 80 80 PHE CZ C 13 130.104 0.300 . 1 . . . . 80 PHE CZ . 11202 1 941 . 1 1 80 80 PHE N N 15 123.018 0.300 . 1 . . . . 80 PHE N . 11202 1 942 . 1 1 81 81 ALA H H 1 8.158 0.030 . 1 . . . . 81 ALA H . 11202 1 943 . 1 1 81 81 ALA HA H 1 3.762 0.030 . 1 . . . . 81 ALA HA . 11202 1 944 . 1 1 81 81 ALA HB1 H 1 1.472 0.030 . 1 . . . . 81 ALA HB . 11202 1 945 . 1 1 81 81 ALA HB2 H 1 1.472 0.030 . 1 . . . . 81 ALA HB . 11202 1 946 . 1 1 81 81 ALA HB3 H 1 1.472 0.030 . 1 . . . . 81 ALA HB . 11202 1 947 . 1 1 81 81 ALA C C 13 178.299 0.300 . 1 . . . . 81 ALA C . 11202 1 948 . 1 1 81 81 ALA CA C 13 55.062 0.300 . 1 . . . . 81 ALA CA . 11202 1 949 . 1 1 81 81 ALA CB C 13 19.959 0.300 . 1 . . . . 81 ALA CB . 11202 1 950 . 1 1 81 81 ALA N N 15 120.625 0.300 . 1 . . . . 81 ALA N . 11202 1 951 . 1 1 82 82 ALA H H 1 8.777 0.030 . 1 . . . . 82 ALA H . 11202 1 952 . 1 1 82 82 ALA HA H 1 3.975 0.030 . 1 . . . . 82 ALA HA . 11202 1 953 . 1 1 82 82 ALA HB1 H 1 1.548 0.030 . 1 . . . . 82 ALA HB . 11202 1 954 . 1 1 82 82 ALA HB2 H 1 1.548 0.030 . 1 . . . . 82 ALA HB . 11202 1 955 . 1 1 82 82 ALA HB3 H 1 1.548 0.030 . 1 . . . . 82 ALA HB . 11202 1 956 . 1 1 82 82 ALA C C 13 180.901 0.300 . 1 . . . . 82 ALA C . 11202 1 957 . 1 1 82 82 ALA CA C 13 55.161 0.300 . 1 . . . . 82 ALA CA . 11202 1 958 . 1 1 82 82 ALA CB C 13 18.193 0.300 . 1 . . . . 82 ALA CB . 11202 1 959 . 1 1 82 82 ALA N N 15 118.560 0.300 . 1 . . . . 82 ALA N . 11202 1 960 . 1 1 83 83 THR H H 1 7.813 0.030 . 1 . . . . 83 THR H . 11202 1 961 . 1 1 83 83 THR HA H 1 3.743 0.030 . 1 . . . . 83 THR HA . 11202 1 962 . 1 1 83 83 THR HB H 1 4.247 0.030 . 1 . . . . 83 THR HB . 11202 1 963 . 1 1 83 83 THR HG21 H 1 1.104 0.030 . 1 . . . . 83 THR HG2 . 11202 1 964 . 1 1 83 83 THR HG22 H 1 1.104 0.030 . 1 . . . . 83 THR HG2 . 11202 1 965 . 1 1 83 83 THR HG23 H 1 1.104 0.030 . 1 . . . . 83 THR HG2 . 11202 1 966 . 1 1 83 83 THR C C 13 175.551 0.300 . 1 . . . . 83 THR C . 11202 1 967 . 1 1 83 83 THR CA C 13 66.872 0.300 . 1 . . . . 83 THR CA . 11202 1 968 . 1 1 83 83 THR CB C 13 68.554 0.300 . 1 . . . . 83 THR CB . 11202 1 969 . 1 1 83 83 THR CG2 C 13 21.536 0.300 . 1 . . . . 83 THR CG2 . 11202 1 970 . 1 1 83 83 THR N N 15 117.232 0.300 . 1 . . . . 83 THR N . 11202 1 971 . 1 1 84 84 VAL H H 1 7.803 0.030 . 1 . . . . 84 VAL H . 11202 1 972 . 1 1 84 84 VAL HA H 1 3.380 0.030 . 1 . . . . 84 VAL HA . 11202 1 973 . 1 1 84 84 VAL HB H 1 1.936 0.030 . 1 . . . . 84 VAL HB . 11202 1 974 . 1 1 84 84 VAL HG11 H 1 0.709 0.030 . 1 . . . . 84 VAL HG1 . 11202 1 975 . 1 1 84 84 VAL HG12 H 1 0.709 0.030 . 1 . . . . 84 VAL HG1 . 11202 1 976 . 1 1 84 84 VAL HG13 H 1 0.709 0.030 . 1 . . . . 84 VAL HG1 . 11202 1 977 . 1 1 84 84 VAL HG21 H 1 0.428 0.030 . 1 . . . . 84 VAL HG2 . 11202 1 978 . 1 1 84 84 VAL HG22 H 1 0.428 0.030 . 1 . . . . 84 VAL HG2 . 11202 1 979 . 1 1 84 84 VAL HG23 H 1 0.428 0.030 . 1 . . . . 84 VAL HG2 . 11202 1 980 . 1 1 84 84 VAL C C 13 179.684 0.300 . 1 . . . . 84 VAL C . 11202 1 981 . 1 1 84 84 VAL CA C 13 66.448 0.300 . 1 . . . . 84 VAL CA . 11202 1 982 . 1 1 84 84 VAL CB C 13 31.360 0.300 . 1 . . . . 84 VAL CB . 11202 1 983 . 1 1 84 84 VAL CG1 C 13 21.332 0.300 . 2 . . . . 84 VAL CG1 . 11202 1 984 . 1 1 84 84 VAL CG2 C 13 23.146 0.300 . 2 . . . . 84 VAL CG2 . 11202 1 985 . 1 1 84 84 VAL N N 15 122.174 0.300 . 1 . . . . 84 VAL N . 11202 1 986 . 1 1 85 85 LEU H H 1 8.254 0.030 . 1 . . . . 85 LEU H . 11202 1 987 . 1 1 85 85 LEU HA H 1 3.911 0.030 . 1 . . . . 85 LEU HA . 11202 1 988 . 1 1 85 85 LEU HB2 H 1 1.866 0.030 . 2 . . . . 85 LEU HB2 . 11202 1 989 . 1 1 85 85 LEU HB3 H 1 1.467 0.030 . 2 . . . . 85 LEU HB3 . 11202 1 990 . 1 1 85 85 LEU HD11 H 1 0.825 0.030 . 1 . . . . 85 LEU HD1 . 11202 1 991 . 1 1 85 85 LEU HD12 H 1 0.825 0.030 . 1 . . . . 85 LEU HD1 . 11202 1 992 . 1 1 85 85 LEU HD13 H 1 0.825 0.030 . 1 . . . . 85 LEU HD1 . 11202 1 993 . 1 1 85 85 LEU HD21 H 1 0.850 0.030 . 1 . . . . 85 LEU HD2 . 11202 1 994 . 1 1 85 85 LEU HD22 H 1 0.850 0.030 . 1 . . . . 85 LEU HD2 . 11202 1 995 . 1 1 85 85 LEU HD23 H 1 0.850 0.030 . 1 . . . . 85 LEU HD2 . 11202 1 996 . 1 1 85 85 LEU HG H 1 1.765 0.030 . 1 . . . . 85 LEU HG . 11202 1 997 . 1 1 85 85 LEU C C 13 180.310 0.300 . 1 . . . . 85 LEU C . 11202 1 998 . 1 1 85 85 LEU CA C 13 58.256 0.300 . 1 . . . . 85 LEU CA . 11202 1 999 . 1 1 85 85 LEU CB C 13 40.974 0.300 . 1 . . . . 85 LEU CB . 11202 1 1000 . 1 1 85 85 LEU CD1 C 13 25.714 0.300 . 2 . . . . 85 LEU CD1 . 11202 1 1001 . 1 1 85 85 LEU CD2 C 13 23.785 0.300 . 2 . . . . 85 LEU CD2 . 11202 1 1002 . 1 1 85 85 LEU CG C 13 27.870 0.300 . 1 . . . . 85 LEU CG . 11202 1 1003 . 1 1 85 85 LEU N N 15 117.357 0.300 . 1 . . . . 85 LEU N . 11202 1 1004 . 1 1 86 86 ARG H H 1 8.153 0.030 . 1 . . . . 86 ARG H . 11202 1 1005 . 1 1 86 86 ARG HA H 1 4.138 0.030 . 1 . . . . 86 ARG HA . 11202 1 1006 . 1 1 86 86 ARG HB2 H 1 1.998 0.030 . 2 . . . . 86 ARG HB2 . 11202 1 1007 . 1 1 86 86 ARG HB3 H 1 1.935 0.030 . 2 . . . . 86 ARG HB3 . 11202 1 1008 . 1 1 86 86 ARG HD2 H 1 3.234 0.030 . 1 . . . . 86 ARG HD2 . 11202 1 1009 . 1 1 86 86 ARG HD3 H 1 3.234 0.030 . 1 . . . . 86 ARG HD3 . 11202 1 1010 . 1 1 86 86 ARG HG2 H 1 1.759 0.030 . 2 . . . . 86 ARG HG2 . 11202 1 1011 . 1 1 86 86 ARG HG3 H 1 1.710 0.030 . 2 . . . . 86 ARG HG3 . 11202 1 1012 . 1 1 86 86 ARG C C 13 177.033 0.300 . 1 . . . . 86 ARG C . 11202 1 1013 . 1 1 86 86 ARG CA C 13 58.953 0.300 . 1 . . . . 86 ARG CA . 11202 1 1014 . 1 1 86 86 ARG CB C 13 30.240 0.300 . 1 . . . . 86 ARG CB . 11202 1 1015 . 1 1 86 86 ARG CD C 13 43.653 0.300 . 1 . . . . 86 ARG CD . 11202 1 1016 . 1 1 86 86 ARG CG C 13 27.719 0.300 . 1 . . . . 86 ARG CG . 11202 1 1017 . 1 1 86 86 ARG N N 15 121.646 0.300 . 1 . . . . 86 ARG N . 11202 1 1018 . 1 1 87 87 ASN H H 1 7.491 0.030 . 1 . . . . 87 ASN H . 11202 1 1019 . 1 1 87 87 ASN HA H 1 4.762 0.030 . 1 . . . . 87 ASN HA . 11202 1 1020 . 1 1 87 87 ASN HB2 H 1 2.986 0.030 . 2 . . . . 87 ASN HB2 . 11202 1 1021 . 1 1 87 87 ASN HB3 H 1 2.718 0.030 . 2 . . . . 87 ASN HB3 . 11202 1 1022 . 1 1 87 87 ASN HD21 H 1 7.569 0.030 . 2 . . . . 87 ASN HD21 . 11202 1 1023 . 1 1 87 87 ASN HD22 H 1 6.867 0.030 . 2 . . . . 87 ASN HD22 . 11202 1 1024 . 1 1 87 87 ASN C C 13 175.502 0.300 . 1 . . . . 87 ASN C . 11202 1 1025 . 1 1 87 87 ASN CA C 13 53.367 0.300 . 1 . . . . 87 ASN CA . 11202 1 1026 . 1 1 87 87 ASN CB C 13 39.061 0.300 . 1 . . . . 87 ASN CB . 11202 1 1027 . 1 1 87 87 ASN N N 15 116.235 0.300 . 1 . . . . 87 ASN N . 11202 1 1028 . 1 1 87 87 ASN ND2 N 15 112.625 0.300 . 1 . . . . 87 ASN ND2 . 11202 1 1029 . 1 1 88 88 THR H H 1 7.053 0.030 . 1 . . . . 88 THR H . 11202 1 1030 . 1 1 88 88 THR HA H 1 4.120 0.030 . 1 . . . . 88 THR HA . 11202 1 1031 . 1 1 88 88 THR HB H 1 4.382 0.030 . 1 . . . . 88 THR HB . 11202 1 1032 . 1 1 88 88 THR HG21 H 1 1.372 0.030 . 1 . . . . 88 THR HG2 . 11202 1 1033 . 1 1 88 88 THR HG22 H 1 1.372 0.030 . 1 . . . . 88 THR HG2 . 11202 1 1034 . 1 1 88 88 THR HG23 H 1 1.372 0.030 . 1 . . . . 88 THR HG2 . 11202 1 1035 . 1 1 88 88 THR C C 13 174.923 0.300 . 1 . . . . 88 THR C . 11202 1 1036 . 1 1 88 88 THR CA C 13 61.787 0.300 . 1 . . . . 88 THR CA . 11202 1 1037 . 1 1 88 88 THR CB C 13 71.387 0.300 . 1 . . . . 88 THR CB . 11202 1 1038 . 1 1 88 88 THR CG2 C 13 22.735 0.300 . 1 . . . . 88 THR CG2 . 11202 1 1039 . 1 1 88 88 THR N N 15 110.937 0.300 . 1 . . . . 88 THR N . 11202 1 1040 . 1 1 89 89 LYS H H 1 8.850 0.030 . 1 . . . . 89 LYS H . 11202 1 1041 . 1 1 89 89 LYS HA H 1 4.495 0.030 . 1 . . . . 89 LYS HA . 11202 1 1042 . 1 1 89 89 LYS HB2 H 1 1.965 0.030 . 2 . . . . 89 LYS HB2 . 11202 1 1043 . 1 1 89 89 LYS HB3 H 1 1.783 0.030 . 2 . . . . 89 LYS HB3 . 11202 1 1044 . 1 1 89 89 LYS HD2 H 1 1.682 0.030 . 1 . . . . 89 LYS HD2 . 11202 1 1045 . 1 1 89 89 LYS HD3 H 1 1.682 0.030 . 1 . . . . 89 LYS HD3 . 11202 1 1046 . 1 1 89 89 LYS HE2 H 1 3.020 0.030 . 1 . . . . 89 LYS HE2 . 11202 1 1047 . 1 1 89 89 LYS HE3 H 1 3.020 0.030 . 1 . . . . 89 LYS HE3 . 11202 1 1048 . 1 1 89 89 LYS HG2 H 1 1.500 0.030 . 2 . . . . 89 LYS HG2 . 11202 1 1049 . 1 1 89 89 LYS HG3 H 1 1.427 0.030 . 2 . . . . 89 LYS HG3 . 11202 1 1050 . 1 1 89 89 LYS C C 13 175.282 0.300 . 1 . . . . 89 LYS C . 11202 1 1051 . 1 1 89 89 LYS CA C 13 55.367 0.300 . 1 . . . . 89 LYS CA . 11202 1 1052 . 1 1 89 89 LYS CB C 13 33.468 0.300 . 1 . . . . 89 LYS CB . 11202 1 1053 . 1 1 89 89 LYS CD C 13 28.923 0.300 . 1 . . . . 89 LYS CD . 11202 1 1054 . 1 1 89 89 LYS CE C 13 42.287 0.300 . 1 . . . . 89 LYS CE . 11202 1 1055 . 1 1 89 89 LYS CG C 13 24.694 0.300 . 1 . . . . 89 LYS CG . 11202 1 1056 . 1 1 89 89 LYS N N 15 121.403 0.300 . 1 . . . . 89 LYS N . 11202 1 1057 . 1 1 90 90 GLY H H 1 8.382 0.030 . 1 . . . . 90 GLY H . 11202 1 1058 . 1 1 90 90 GLY HA2 H 1 3.818 0.030 . 2 . . . . 90 GLY HA2 . 11202 1 1059 . 1 1 90 90 GLY HA3 H 1 3.709 0.030 . 2 . . . . 90 GLY HA3 . 11202 1 1060 . 1 1 90 90 GLY C C 13 172.879 0.300 . 1 . . . . 90 GLY C . 11202 1 1061 . 1 1 90 90 GLY CA C 13 47.305 0.300 . 1 . . . . 90 GLY CA . 11202 1 1062 . 1 1 90 90 GLY N N 15 107.847 0.300 . 1 . . . . 90 GLY N . 11202 1 1063 . 1 1 91 91 ASN H H 1 7.755 0.030 . 1 . . . . 91 ASN H . 11202 1 1064 . 1 1 91 91 ASN HA H 1 5.159 0.030 . 1 . . . . 91 ASN HA . 11202 1 1065 . 1 1 91 91 ASN HB2 H 1 2.610 0.030 . 1 . . . . 91 ASN HB2 . 11202 1 1066 . 1 1 91 91 ASN HB3 H 1 2.610 0.030 . 1 . . . . 91 ASN HB3 . 11202 1 1067 . 1 1 91 91 ASN HD21 H 1 7.545 0.030 . 2 . . . . 91 ASN HD21 . 11202 1 1068 . 1 1 91 91 ASN HD22 H 1 6.923 0.030 . 2 . . . . 91 ASN HD22 . 11202 1 1069 . 1 1 91 91 ASN C C 13 174.355 0.300 . 1 . . . . 91 ASN C . 11202 1 1070 . 1 1 91 91 ASN CA C 13 53.042 0.300 . 1 . . . . 91 ASN CA . 11202 1 1071 . 1 1 91 91 ASN CB C 13 40.041 0.300 . 1 . . . . 91 ASN CB . 11202 1 1072 . 1 1 91 91 ASN N N 15 120.013 0.300 . 1 . . . . 91 ASN N . 11202 1 1073 . 1 1 91 91 ASN ND2 N 15 112.282 0.300 . 1 . . . . 91 ASN ND2 . 11202 1 1074 . 1 1 92 92 VAL H H 1 9.171 0.030 . 1 . . . . 92 VAL H . 11202 1 1075 . 1 1 92 92 VAL HA H 1 4.273 0.030 . 1 . . . . 92 VAL HA . 11202 1 1076 . 1 1 92 92 VAL HB H 1 1.727 0.030 . 1 . . . . 92 VAL HB . 11202 1 1077 . 1 1 92 92 VAL HG11 H 1 0.288 0.030 . 1 . . . . 92 VAL HG1 . 11202 1 1078 . 1 1 92 92 VAL HG12 H 1 0.288 0.030 . 1 . . . . 92 VAL HG1 . 11202 1 1079 . 1 1 92 92 VAL HG13 H 1 0.288 0.030 . 1 . . . . 92 VAL HG1 . 11202 1 1080 . 1 1 92 92 VAL HG21 H 1 0.861 0.030 . 1 . . . . 92 VAL HG2 . 11202 1 1081 . 1 1 92 92 VAL HG22 H 1 0.861 0.030 . 1 . . . . 92 VAL HG2 . 11202 1 1082 . 1 1 92 92 VAL HG23 H 1 0.861 0.030 . 1 . . . . 92 VAL HG2 . 11202 1 1083 . 1 1 92 92 VAL C C 13 174.028 0.300 . 1 . . . . 92 VAL C . 11202 1 1084 . 1 1 92 92 VAL CA C 13 61.669 0.300 . 1 . . . . 92 VAL CA . 11202 1 1085 . 1 1 92 92 VAL CB C 13 34.263 0.300 . 1 . . . . 92 VAL CB . 11202 1 1086 . 1 1 92 92 VAL CG1 C 13 22.982 0.300 . 2 . . . . 92 VAL CG1 . 11202 1 1087 . 1 1 92 92 VAL CG2 C 13 22.378 0.300 . 2 . . . . 92 VAL CG2 . 11202 1 1088 . 1 1 92 92 VAL N N 15 127.038 0.300 . 1 . . . . 92 VAL N . 11202 1 1089 . 1 1 93 93 ARG H H 1 8.735 0.030 . 1 . . . . 93 ARG H . 11202 1 1090 . 1 1 93 93 ARG HA H 1 4.850 0.030 . 1 . . . . 93 ARG HA . 11202 1 1091 . 1 1 93 93 ARG HB2 H 1 1.887 0.030 . 2 . . . . 93 ARG HB2 . 11202 1 1092 . 1 1 93 93 ARG HB3 H 1 1.738 0.030 . 2 . . . . 93 ARG HB3 . 11202 1 1093 . 1 1 93 93 ARG HD2 H 1 3.161 0.030 . 1 . . . . 93 ARG HD2 . 11202 1 1094 . 1 1 93 93 ARG HD3 H 1 3.161 0.030 . 1 . . . . 93 ARG HD3 . 11202 1 1095 . 1 1 93 93 ARG HE H 1 7.272 0.030 . 1 . . . . 93 ARG HE . 11202 1 1096 . 1 1 93 93 ARG HG2 H 1 1.588 0.030 . 2 . . . . 93 ARG HG2 . 11202 1 1097 . 1 1 93 93 ARG HG3 H 1 1.480 0.030 . 2 . . . . 93 ARG HG3 . 11202 1 1098 . 1 1 93 93 ARG C C 13 175.349 0.300 . 1 . . . . 93 ARG C . 11202 1 1099 . 1 1 93 93 ARG CA C 13 55.194 0.300 . 1 . . . . 93 ARG CA . 11202 1 1100 . 1 1 93 93 ARG CB C 13 31.288 0.300 . 1 . . . . 93 ARG CB . 11202 1 1101 . 1 1 93 93 ARG CD C 13 43.493 0.300 . 1 . . . . 93 ARG CD . 11202 1 1102 . 1 1 93 93 ARG CG C 13 28.208 0.300 . 1 . . . . 93 ARG CG . 11202 1 1103 . 1 1 93 93 ARG N N 15 126.338 0.300 . 1 . . . . 93 ARG N . 11202 1 1104 . 1 1 93 93 ARG NE N 15 85.299 0.300 . 1 . . . . 93 ARG NE . 11202 1 1105 . 1 1 94 94 PHE H H 1 9.477 0.030 . 1 . . . . 94 PHE H . 11202 1 1106 . 1 1 94 94 PHE HA H 1 5.441 0.030 . 1 . . . . 94 PHE HA . 11202 1 1107 . 1 1 94 94 PHE HB2 H 1 3.023 0.030 . 2 . . . . 94 PHE HB2 . 11202 1 1108 . 1 1 94 94 PHE HB3 H 1 2.852 0.030 . 2 . . . . 94 PHE HB3 . 11202 1 1109 . 1 1 94 94 PHE HD1 H 1 7.148 0.030 . 1 . . . . 94 PHE HD1 . 11202 1 1110 . 1 1 94 94 PHE HD2 H 1 7.148 0.030 . 1 . . . . 94 PHE HD2 . 11202 1 1111 . 1 1 94 94 PHE HE1 H 1 6.925 0.030 . 1 . . . . 94 PHE HE1 . 11202 1 1112 . 1 1 94 94 PHE HE2 H 1 6.925 0.030 . 1 . . . . 94 PHE HE2 . 11202 1 1113 . 1 1 94 94 PHE HZ H 1 6.999 0.030 . 1 . . . . 94 PHE HZ . 11202 1 1114 . 1 1 94 94 PHE C C 13 178.144 0.300 . 1 . . . . 94 PHE C . 11202 1 1115 . 1 1 94 94 PHE CA C 13 56.673 0.300 . 1 . . . . 94 PHE CA . 11202 1 1116 . 1 1 94 94 PHE CB C 13 43.184 0.300 . 1 . . . . 94 PHE CB . 11202 1 1117 . 1 1 94 94 PHE CD1 C 13 131.864 0.300 . 1 . . . . 94 PHE CD1 . 11202 1 1118 . 1 1 94 94 PHE CD2 C 13 131.864 0.300 . 1 . . . . 94 PHE CD2 . 11202 1 1119 . 1 1 94 94 PHE CE1 C 13 129.981 0.300 . 1 . . . . 94 PHE CE1 . 11202 1 1120 . 1 1 94 94 PHE CE2 C 13 129.981 0.300 . 1 . . . . 94 PHE CE2 . 11202 1 1121 . 1 1 94 94 PHE CZ C 13 128.421 0.300 . 1 . . . . 94 PHE CZ . 11202 1 1122 . 1 1 94 94 PHE N N 15 122.234 0.300 . 1 . . . . 94 PHE N . 11202 1 1123 . 1 1 95 95 VAL H H 1 8.454 0.030 . 1 . . . . 95 VAL H . 11202 1 1124 . 1 1 95 95 VAL HA H 1 4.190 0.030 . 1 . . . . 95 VAL HA . 11202 1 1125 . 1 1 95 95 VAL HB H 1 1.687 0.030 . 1 . . . . 95 VAL HB . 11202 1 1126 . 1 1 95 95 VAL HG11 H 1 0.708 0.030 . 1 . . . . 95 VAL HG1 . 11202 1 1127 . 1 1 95 95 VAL HG12 H 1 0.708 0.030 . 1 . . . . 95 VAL HG1 . 11202 1 1128 . 1 1 95 95 VAL HG13 H 1 0.708 0.030 . 1 . . . . 95 VAL HG1 . 11202 1 1129 . 1 1 95 95 VAL HG21 H 1 0.783 0.030 . 1 . . . . 95 VAL HG2 . 11202 1 1130 . 1 1 95 95 VAL HG22 H 1 0.783 0.030 . 1 . . . . 95 VAL HG2 . 11202 1 1131 . 1 1 95 95 VAL HG23 H 1 0.783 0.030 . 1 . . . . 95 VAL HG2 . 11202 1 1132 . 1 1 95 95 VAL C C 13 174.108 0.300 . 1 . . . . 95 VAL C . 11202 1 1133 . 1 1 95 95 VAL CA C 13 64.526 0.300 . 1 . . . . 95 VAL CA . 11202 1 1134 . 1 1 95 95 VAL CB C 13 33.212 0.300 . 1 . . . . 95 VAL CB . 11202 1 1135 . 1 1 95 95 VAL CG1 C 13 21.668 0.300 . 2 . . . . 95 VAL CG1 . 11202 1 1136 . 1 1 95 95 VAL CG2 C 13 21.048 0.300 . 2 . . . . 95 VAL CG2 . 11202 1 1137 . 1 1 95 95 VAL N N 15 120.978 0.300 . 1 . . . . 95 VAL N . 11202 1 1138 . 1 1 96 96 ILE H H 1 8.807 0.030 . 1 . . . . 96 ILE H . 11202 1 1139 . 1 1 96 96 ILE HA H 1 4.774 0.030 . 1 . . . . 96 ILE HA . 11202 1 1140 . 1 1 96 96 ILE HB H 1 0.909 0.030 . 1 . . . . 96 ILE HB . 11202 1 1141 . 1 1 96 96 ILE HD11 H 1 0.443 0.030 . 1 . . . . 96 ILE HD1 . 11202 1 1142 . 1 1 96 96 ILE HD12 H 1 0.443 0.030 . 1 . . . . 96 ILE HD1 . 11202 1 1143 . 1 1 96 96 ILE HD13 H 1 0.443 0.030 . 1 . . . . 96 ILE HD1 . 11202 1 1144 . 1 1 96 96 ILE HG12 H 1 1.259 0.030 . 2 . . . . 96 ILE HG12 . 11202 1 1145 . 1 1 96 96 ILE HG13 H 1 0.928 0.030 . 2 . . . . 96 ILE HG13 . 11202 1 1146 . 1 1 96 96 ILE HG21 H 1 0.704 0.030 . 1 . . . . 96 ILE HG2 . 11202 1 1147 . 1 1 96 96 ILE HG22 H 1 0.704 0.030 . 1 . . . . 96 ILE HG2 . 11202 1 1148 . 1 1 96 96 ILE HG23 H 1 0.704 0.030 . 1 . . . . 96 ILE HG2 . 11202 1 1149 . 1 1 96 96 ILE C C 13 173.702 0.300 . 1 . . . . 96 ILE C . 11202 1 1150 . 1 1 96 96 ILE CA C 13 55.909 0.300 . 1 . . . . 96 ILE CA . 11202 1 1151 . 1 1 96 96 ILE CB C 13 36.979 0.300 . 1 . . . . 96 ILE CB . 11202 1 1152 . 1 1 96 96 ILE CD1 C 13 10.363 0.300 . 1 . . . . 96 ILE CD1 . 11202 1 1153 . 1 1 96 96 ILE CG1 C 13 27.171 0.300 . 1 . . . . 96 ILE CG1 . 11202 1 1154 . 1 1 96 96 ILE CG2 C 13 19.276 0.300 . 1 . . . . 96 ILE CG2 . 11202 1 1155 . 1 1 96 96 ILE N N 15 130.493 0.300 . 1 . . . . 96 ILE N . 11202 1 1156 . 1 1 97 97 GLY H H 1 9.311 0.030 . 1 . . . . 97 GLY H . 11202 1 1157 . 1 1 97 97 GLY HA2 H 1 5.499 0.030 . 2 . . . . 97 GLY HA2 . 11202 1 1158 . 1 1 97 97 GLY HA3 H 1 2.994 0.030 . 2 . . . . 97 GLY HA3 . 11202 1 1159 . 1 1 97 97 GLY C C 13 171.756 0.300 . 1 . . . . 97 GLY C . 11202 1 1160 . 1 1 97 97 GLY CA C 13 44.452 0.300 . 1 . . . . 97 GLY CA . 11202 1 1161 . 1 1 97 97 GLY N N 15 110.029 0.300 . 1 . . . . 97 GLY N . 11202 1 1162 . 1 1 98 98 ARG H H 1 9.049 0.030 . 1 . . . . 98 ARG H . 11202 1 1163 . 1 1 98 98 ARG HA H 1 4.913 0.030 . 1 . . . . 98 ARG HA . 11202 1 1164 . 1 1 98 98 ARG HB2 H 1 1.964 0.030 . 2 . . . . 98 ARG HB2 . 11202 1 1165 . 1 1 98 98 ARG HB3 H 1 1.892 0.030 . 2 . . . . 98 ARG HB3 . 11202 1 1166 . 1 1 98 98 ARG HD2 H 1 3.275 0.030 . 2 . . . . 98 ARG HD2 . 11202 1 1167 . 1 1 98 98 ARG HD3 H 1 3.087 0.030 . 2 . . . . 98 ARG HD3 . 11202 1 1168 . 1 1 98 98 ARG HE H 1 9.448 0.030 . 1 . . . . 98 ARG HE . 11202 1 1169 . 1 1 98 98 ARG HG2 H 1 1.847 0.030 . 2 . . . . 98 ARG HG2 . 11202 1 1170 . 1 1 98 98 ARG HG3 H 1 1.727 0.030 . 2 . . . . 98 ARG HG3 . 11202 1 1171 . 1 1 98 98 ARG C C 13 175.296 0.300 . 1 . . . . 98 ARG C . 11202 1 1172 . 1 1 98 98 ARG CA C 13 54.956 0.300 . 1 . . . . 98 ARG CA . 11202 1 1173 . 1 1 98 98 ARG CB C 13 34.997 0.300 . 1 . . . . 98 ARG CB . 11202 1 1174 . 1 1 98 98 ARG CD C 13 43.480 0.300 . 1 . . . . 98 ARG CD . 11202 1 1175 . 1 1 98 98 ARG CG C 13 26.579 0.300 . 1 . . . . 98 ARG CG . 11202 1 1176 . 1 1 98 98 ARG N N 15 125.626 0.300 . 1 . . . . 98 ARG N . 11202 1 1177 . 1 1 98 98 ARG NE N 15 85.239 0.300 . 1 . . . . 98 ARG NE . 11202 1 1178 . 1 1 99 99 GLU H H 1 8.818 0.030 . 1 . . . . 99 GLU H . 11202 1 1179 . 1 1 99 99 GLU HA H 1 4.408 0.030 . 1 . . . . 99 GLU HA . 11202 1 1180 . 1 1 99 99 GLU HB2 H 1 1.997 0.030 . 1 . . . . 99 GLU HB2 . 11202 1 1181 . 1 1 99 99 GLU HB3 H 1 1.997 0.030 . 1 . . . . 99 GLU HB3 . 11202 1 1182 . 1 1 99 99 GLU HG2 H 1 2.360 0.030 . 2 . . . . 99 GLU HG2 . 11202 1 1183 . 1 1 99 99 GLU HG3 H 1 2.257 0.030 . 2 . . . . 99 GLU HG3 . 11202 1 1184 . 1 1 99 99 GLU C C 13 176.397 0.300 . 1 . . . . 99 GLU C . 11202 1 1185 . 1 1 99 99 GLU CA C 13 57.097 0.300 . 1 . . . . 99 GLU CA . 11202 1 1186 . 1 1 99 99 GLU CB C 13 30.383 0.300 . 1 . . . . 99 GLU CB . 11202 1 1187 . 1 1 99 99 GLU CG C 13 36.258 0.300 . 1 . . . . 99 GLU CG . 11202 1 1188 . 1 1 99 99 GLU N N 15 127.463 0.300 . 1 . . . . 99 GLU N . 11202 1 1189 . 1 1 100 100 LYS H H 1 8.611 0.030 . 1 . . . . 100 LYS H . 11202 1 1190 . 1 1 100 100 LYS HA H 1 4.621 0.030 . 1 . . . . 100 LYS HA . 11202 1 1191 . 1 1 100 100 LYS HB2 H 1 1.842 0.030 . 2 . . . . 100 LYS HB2 . 11202 1 1192 . 1 1 100 100 LYS HB3 H 1 1.701 0.030 . 2 . . . . 100 LYS HB3 . 11202 1 1193 . 1 1 100 100 LYS HD2 H 1 1.683 0.030 . 1 . . . . 100 LYS HD2 . 11202 1 1194 . 1 1 100 100 LYS HD3 H 1 1.683 0.030 . 1 . . . . 100 LYS HD3 . 11202 1 1195 . 1 1 100 100 LYS HE2 H 1 2.958 0.030 . 1 . . . . 100 LYS HE2 . 11202 1 1196 . 1 1 100 100 LYS HE3 H 1 2.958 0.030 . 1 . . . . 100 LYS HE3 . 11202 1 1197 . 1 1 100 100 LYS HG2 H 1 1.502 0.030 . 1 . . . . 100 LYS HG2 . 11202 1 1198 . 1 1 100 100 LYS HG3 H 1 1.502 0.030 . 1 . . . . 100 LYS HG3 . 11202 1 1199 . 1 1 100 100 LYS C C 13 174.522 0.300 . 1 . . . . 100 LYS C . 11202 1 1200 . 1 1 100 100 LYS CA C 13 54.355 0.300 . 1 . . . . 100 LYS CA . 11202 1 1201 . 1 1 100 100 LYS CB C 13 32.807 0.300 . 1 . . . . 100 LYS CB . 11202 1 1202 . 1 1 100 100 LYS CD C 13 29.452 0.300 . 1 . . . . 100 LYS CD . 11202 1 1203 . 1 1 100 100 LYS CE C 13 42.119 0.300 . 1 . . . . 100 LYS CE . 11202 1 1204 . 1 1 100 100 LYS CG C 13 24.962 0.300 . 1 . . . . 100 LYS CG . 11202 1 1205 . 1 1 100 100 LYS N N 15 126.082 0.300 . 1 . . . . 100 LYS N . 11202 1 1206 . 1 1 101 101 PRO HA H 1 4.513 0.030 . 1 . . . . 101 PRO HA . 11202 1 1207 . 1 1 101 101 PRO HB2 H 1 2.345 0.030 . 2 . . . . 101 PRO HB2 . 11202 1 1208 . 1 1 101 101 PRO HB3 H 1 1.957 0.030 . 2 . . . . 101 PRO HB3 . 11202 1 1209 . 1 1 101 101 PRO HD2 H 1 3.678 0.030 . 2 . . . . 101 PRO HD2 . 11202 1 1210 . 1 1 101 101 PRO HD3 H 1 3.916 0.030 . 2 . . . . 101 PRO HD3 . 11202 1 1211 . 1 1 101 101 PRO HG2 H 1 2.047 0.030 . 1 . . . . 101 PRO HG2 . 11202 1 1212 . 1 1 101 101 PRO HG3 H 1 2.047 0.030 . 1 . . . . 101 PRO HG3 . 11202 1 1213 . 1 1 101 101 PRO CA C 13 63.183 0.300 . 1 . . . . 101 PRO CA . 11202 1 1214 . 1 1 101 101 PRO CB C 13 32.296 0.300 . 1 . . . . 101 PRO CB . 11202 1 1215 . 1 1 101 101 PRO CD C 13 50.839 0.300 . 1 . . . . 101 PRO CD . 11202 1 1216 . 1 1 101 101 PRO CG C 13 27.474 0.300 . 1 . . . . 101 PRO CG . 11202 1 1217 . 1 1 102 102 SER H H 1 8.512 0.030 . 1 . . . . 102 SER H . 11202 1 1218 . 1 1 102 102 SER HA H 1 4.479 0.030 . 1 . . . . 102 SER HA . 11202 1 1219 . 1 1 102 102 SER HB2 H 1 3.887 0.030 . 1 . . . . 102 SER HB2 . 11202 1 1220 . 1 1 102 102 SER HB3 H 1 3.887 0.030 . 1 . . . . 102 SER HB3 . 11202 1 1221 . 1 1 102 102 SER C C 13 175.048 0.300 . 1 . . . . 102 SER C . 11202 1 1222 . 1 1 102 102 SER CA C 13 58.360 0.300 . 1 . . . . 102 SER CA . 11202 1 1223 . 1 1 102 102 SER CB C 13 64.014 0.300 . 1 . . . . 102 SER CB . 11202 1 1224 . 1 1 102 102 SER N N 15 116.757 0.300 . 1 . . . . 102 SER N . 11202 1 1225 . 1 1 103 103 GLY H H 1 8.238 0.030 . 1 . . . . 103 GLY H . 11202 1 1226 . 1 1 103 103 GLY HA2 H 1 4.186 0.030 . 2 . . . . 103 GLY HA2 . 11202 1 1227 . 1 1 103 103 GLY HA3 H 1 4.098 0.030 . 2 . . . . 103 GLY HA3 . 11202 1 1228 . 1 1 103 103 GLY C C 13 174.294 0.300 . 1 . . . . 103 GLY C . 11202 1 1229 . 1 1 103 103 GLY CA C 13 44.744 0.300 . 1 . . . . 103 GLY CA . 11202 1 1230 . 1 1 103 103 GLY N N 15 110.628 0.300 . 1 . . . . 103 GLY N . 11202 1 1231 . 1 1 104 104 PRO HA H 1 4.494 0.030 . 1 . . . . 104 PRO HA . 11202 1 1232 . 1 1 104 104 PRO HB2 H 1 2.303 0.030 . 2 . . . . 104 PRO HB2 . 11202 1 1233 . 1 1 104 104 PRO HB3 H 1 1.984 0.030 . 2 . . . . 104 PRO HB3 . 11202 1 1234 . 1 1 104 104 PRO HD2 H 1 3.635 0.030 . 1 . . . . 104 PRO HD2 . 11202 1 1235 . 1 1 104 104 PRO HD3 H 1 3.635 0.030 . 1 . . . . 104 PRO HD3 . 11202 1 1236 . 1 1 104 104 PRO HG2 H 1 2.025 0.030 . 1 . . . . 104 PRO HG2 . 11202 1 1237 . 1 1 104 104 PRO HG3 H 1 2.025 0.030 . 1 . . . . 104 PRO HG3 . 11202 1 1238 . 1 1 104 104 PRO CA C 13 63.257 0.300 . 1 . . . . 104 PRO CA . 11202 1 1239 . 1 1 104 104 PRO CB C 13 32.274 0.300 . 1 . . . . 104 PRO CB . 11202 1 1240 . 1 1 104 104 PRO CD C 13 49.839 0.300 . 1 . . . . 104 PRO CD . 11202 1 1241 . 1 1 104 104 PRO CG C 13 27.243 0.300 . 1 . . . . 104 PRO CG . 11202 1 1242 . 1 1 105 105 SER H H 1 8.532 0.030 . 1 . . . . 105 SER H . 11202 1 1243 . 1 1 105 105 SER N N 15 116.440 0.300 . 1 . . . . 105 SER N . 11202 1 1244 . 1 1 106 106 SER H H 1 8.337 0.030 . 1 . . . . 106 SER H . 11202 1 1245 . 1 1 106 106 SER HA H 1 4.509 0.030 . 1 . . . . 106 SER HA . 11202 1 1246 . 1 1 106 106 SER HB2 H 1 3.908 0.030 . 1 . . . . 106 SER HB2 . 11202 1 1247 . 1 1 106 106 SER HB3 H 1 3.908 0.030 . 1 . . . . 106 SER HB3 . 11202 1 1248 . 1 1 106 106 SER C C 13 173.931 0.300 . 1 . . . . 106 SER C . 11202 1 1249 . 1 1 106 106 SER CA C 13 58.394 0.300 . 1 . . . . 106 SER CA . 11202 1 1250 . 1 1 106 106 SER CB C 13 63.986 0.300 . 1 . . . . 106 SER CB . 11202 1 1251 . 1 1 106 106 SER N N 15 117.886 0.300 . 1 . . . . 106 SER N . 11202 1 1252 . 1 1 107 107 GLY H H 1 8.051 0.030 . 1 . . . . 107 GLY H . 11202 1 1253 . 1 1 107 107 GLY HA2 H 1 3.804 0.030 . 2 . . . . 107 GLY HA2 . 11202 1 1254 . 1 1 107 107 GLY HA3 H 1 3.762 0.030 . 2 . . . . 107 GLY HA3 . 11202 1 1255 . 1 1 107 107 GLY C C 13 178.999 0.300 . 1 . . . . 107 GLY C . 11202 1 1256 . 1 1 107 107 GLY CA C 13 46.245 0.300 . 1 . . . . 107 GLY CA . 11202 1 1257 . 1 1 107 107 GLY N N 15 116.887 0.300 . 1 . . . . 107 GLY N . 11202 1 stop_ save_