data_10083 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 10083 _Entry.Title ; PDZ domain of human RIM2B ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-01-24 _Entry.Accession_date 2007-01-24 _Entry.Last_release_date 2008-08-14 _Entry.Original_release_date 2008-08-14 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 T. Nagashima . . . 10083 2 F. Hayashi . . . 10083 3 S. Yokoyama . . . 10083 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Protein Research Group, RIKEN Genomic Sciences Center' . 10083 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 10083 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 561 10083 '15N chemical shifts' 136 10083 '1H chemical shifts' 899 10083 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 . . 2008-08-14 2007-01-24 original author . 10083 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1WFG 'BMRB Entry Tracking System' 10083 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 10083 _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 'PDZ domain of human RIM2B' _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 T. Nagashima . . . 10083 1 2 F. Hayashi . . . 10083 1 3 S. Yokoyama . . . 10083 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 10083 _Assembly.ID 1 _Assembly.Name 'Regulating synaptic membrane exocytosis protein 2' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID 'protein monomer' 10083 1 stop_ loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'Regulating synaptic membrane exocytosis protein 2' 1 $entity_1 . . yes native no no . . . 10083 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 . PDB 1WFG . . . . . . 10083 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 10083 _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 . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSGSSGHSHSDKHPVTWQP SKDGDRLIGRILLNKRLKDG SVPRDSGAMLGLKVVGGKMT ESGRLCAFITKVKKGSLADT VGHLRPGDEVLEWNGRLLQG ATFEEVYNIILESKPEPQVE LVVSRSGPSSG ; _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 131 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _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 1WFG . "Pdz Domain Of Human Rim2b" . . . . . 100.00 131 100.00 100.00 2.88e-87 . . . . 10083 1 2 no DBJ BAA34471 . "KIAA0751 protein [Homo sapiens]" . . . . . 90.08 1188 100.00 100.00 6.56e-73 . . . . 10083 1 3 no DBJ BAB18975 . "Rim2 [Mus musculus]" . . . . . 90.08 1530 100.00 100.00 3.19e-72 . . . . 10083 1 4 no DBJ BAC98016 . "mKIAA0751 protein [Mus musculus]" . . . . . 85.50 1297 100.00 100.00 7.17e-68 . . . . 10083 1 5 no DBJ BAG10377 . "regulating synaptic membrane exocytosis protein 2 [synthetic construct]" . . . . . 90.08 1188 100.00 100.00 6.56e-73 . . . . 10083 1 6 no DBJ BAG54403 . "unnamed protein product [Homo sapiens]" . . . . . 85.50 1349 100.00 100.00 1.36e-67 . . . . 10083 1 7 no EMBL CAH18227 . "hypothetical protein [Homo sapiens]" . . . . . 85.50 471 100.00 100.00 1.08e-71 . . . . 10083 1 8 no GB AAC19157 . "unknown [Homo sapiens]" . . . . . 64.89 369 100.00 100.00 2.77e-49 . . . . 10083 1 9 no GB AAF81644 . "RIM2 [Rattus norvegicus]" . . . . . 85.50 1555 100.00 100.00 1.28e-67 . . . . 10083 1 10 no GB AAF81645 . "RIM2-2A [Rattus norvegicus]" . . . . . 85.50 1352 100.00 100.00 1.48e-67 . . . . 10083 1 11 no GB AAF81646 . "RIM2-2B [Rattus norvegicus]" . . . . . 89.31 1399 99.15 100.00 1.19e-70 . . . . 10083 1 12 no GB AAF81647 . "RIM2-3A [Rattus norvegicus]" . . . . . 85.50 1368 100.00 100.00 1.60e-67 . . . . 10083 1 13 no REF NP_001093587 . "regulating synaptic membrane exocytosis protein 2 isoform a [Homo sapiens]" . . . . . 85.50 1349 100.00 100.00 1.36e-67 . . . . 10083 1 14 no REF NP_001243311 . "regulating synaptic membrane exocytosis protein 2 isoform a [Mus musculus]" . . . . . 90.08 1572 100.00 100.00 2.54e-72 . . . . 10083 1 15 no REF NP_001243312 . "regulating synaptic membrane exocytosis protein 2 isoform b [Mus musculus]" . . . . . 90.08 1550 100.00 100.00 2.31e-72 . . . . 10083 1 16 no REF NP_001269810 . "regulating synaptic membrane exocytosis protein 2 isoform c [Homo sapiens]" . . . . . 90.08 1188 100.00 100.00 6.56e-73 . . . . 10083 1 17 no REF NP_055492 . "regulating synaptic membrane exocytosis protein 2 isoform b [Homo sapiens]" . . . . . 85.50 1163 100.00 100.00 4.50e-68 . . . . 10083 1 18 no SP Q9EQZ7 . "RecName: Full=Regulating synaptic membrane exocytosis protein 2; AltName: Full=Rab-3-interacting molecule 2; Short=RIM 2; AltNa" . . . . . 90.08 1530 100.00 100.00 3.19e-72 . . . . 10083 1 19 no SP Q9JIS1 . "RecName: Full=Regulating synaptic membrane exocytosis protein 2; AltName: Full=Rab-3-interacting molecule 2; Short=RIM 2" . . . . . 85.50 1555 100.00 100.00 1.28e-67 . . . . 10083 1 20 no SP Q9UQ26 . "RecName: Full=Regulating synaptic membrane exocytosis protein 2; AltName: Full=Rab-3-interacting molecule 2; Short=RIM 2; AltNa" . . . . . 90.08 1411 100.00 100.00 2.94e-72 . . . . 10083 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'PDZ domain' . 10083 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 . 10083 1 2 . SER . 10083 1 3 . SER . 10083 1 4 . GLY . 10083 1 5 . SER . 10083 1 6 . SER . 10083 1 7 . GLY . 10083 1 8 . HIS . 10083 1 9 . SER . 10083 1 10 . HIS . 10083 1 11 . SER . 10083 1 12 . ASP . 10083 1 13 . LYS . 10083 1 14 . HIS . 10083 1 15 . PRO . 10083 1 16 . VAL . 10083 1 17 . THR . 10083 1 18 . TRP . 10083 1 19 . GLN . 10083 1 20 . PRO . 10083 1 21 . SER . 10083 1 22 . LYS . 10083 1 23 . ASP . 10083 1 24 . GLY . 10083 1 25 . ASP . 10083 1 26 . ARG . 10083 1 27 . LEU . 10083 1 28 . ILE . 10083 1 29 . GLY . 10083 1 30 . ARG . 10083 1 31 . ILE . 10083 1 32 . LEU . 10083 1 33 . LEU . 10083 1 34 . ASN . 10083 1 35 . LYS . 10083 1 36 . ARG . 10083 1 37 . LEU . 10083 1 38 . LYS . 10083 1 39 . ASP . 10083 1 40 . GLY . 10083 1 41 . SER . 10083 1 42 . VAL . 10083 1 43 . PRO . 10083 1 44 . ARG . 10083 1 45 . ASP . 10083 1 46 . SER . 10083 1 47 . GLY . 10083 1 48 . ALA . 10083 1 49 . MET . 10083 1 50 . LEU . 10083 1 51 . GLY . 10083 1 52 . LEU . 10083 1 53 . LYS . 10083 1 54 . VAL . 10083 1 55 . VAL . 10083 1 56 . GLY . 10083 1 57 . GLY . 10083 1 58 . LYS . 10083 1 59 . MET . 10083 1 60 . THR . 10083 1 61 . GLU . 10083 1 62 . SER . 10083 1 63 . GLY . 10083 1 64 . ARG . 10083 1 65 . LEU . 10083 1 66 . CYS . 10083 1 67 . ALA . 10083 1 68 . PHE . 10083 1 69 . ILE . 10083 1 70 . THR . 10083 1 71 . LYS . 10083 1 72 . VAL . 10083 1 73 . LYS . 10083 1 74 . LYS . 10083 1 75 . GLY . 10083 1 76 . SER . 10083 1 77 . LEU . 10083 1 78 . ALA . 10083 1 79 . ASP . 10083 1 80 . THR . 10083 1 81 . VAL . 10083 1 82 . GLY . 10083 1 83 . HIS . 10083 1 84 . LEU . 10083 1 85 . ARG . 10083 1 86 . PRO . 10083 1 87 . GLY . 10083 1 88 . ASP . 10083 1 89 . GLU . 10083 1 90 . VAL . 10083 1 91 . LEU . 10083 1 92 . GLU . 10083 1 93 . TRP . 10083 1 94 . ASN . 10083 1 95 . GLY . 10083 1 96 . ARG . 10083 1 97 . LEU . 10083 1 98 . LEU . 10083 1 99 . GLN . 10083 1 100 . GLY . 10083 1 101 . ALA . 10083 1 102 . THR . 10083 1 103 . PHE . 10083 1 104 . GLU . 10083 1 105 . GLU . 10083 1 106 . VAL . 10083 1 107 . TYR . 10083 1 108 . ASN . 10083 1 109 . ILE . 10083 1 110 . ILE . 10083 1 111 . LEU . 10083 1 112 . GLU . 10083 1 113 . SER . 10083 1 114 . LYS . 10083 1 115 . PRO . 10083 1 116 . GLU . 10083 1 117 . PRO . 10083 1 118 . GLN . 10083 1 119 . VAL . 10083 1 120 . GLU . 10083 1 121 . LEU . 10083 1 122 . VAL . 10083 1 123 . VAL . 10083 1 124 . SER . 10083 1 125 . ARG . 10083 1 126 . SER . 10083 1 127 . GLY . 10083 1 128 . PRO . 10083 1 129 . SER . 10083 1 130 . SER . 10083 1 131 . GLY . 10083 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 10083 1 . SER 2 2 10083 1 . SER 3 3 10083 1 . GLY 4 4 10083 1 . SER 5 5 10083 1 . SER 6 6 10083 1 . GLY 7 7 10083 1 . HIS 8 8 10083 1 . SER 9 9 10083 1 . HIS 10 10 10083 1 . SER 11 11 10083 1 . ASP 12 12 10083 1 . LYS 13 13 10083 1 . HIS 14 14 10083 1 . PRO 15 15 10083 1 . VAL 16 16 10083 1 . THR 17 17 10083 1 . TRP 18 18 10083 1 . GLN 19 19 10083 1 . PRO 20 20 10083 1 . SER 21 21 10083 1 . LYS 22 22 10083 1 . ASP 23 23 10083 1 . GLY 24 24 10083 1 . ASP 25 25 10083 1 . ARG 26 26 10083 1 . LEU 27 27 10083 1 . ILE 28 28 10083 1 . GLY 29 29 10083 1 . ARG 30 30 10083 1 . ILE 31 31 10083 1 . LEU 32 32 10083 1 . LEU 33 33 10083 1 . ASN 34 34 10083 1 . LYS 35 35 10083 1 . ARG 36 36 10083 1 . LEU 37 37 10083 1 . LYS 38 38 10083 1 . ASP 39 39 10083 1 . GLY 40 40 10083 1 . SER 41 41 10083 1 . VAL 42 42 10083 1 . PRO 43 43 10083 1 . ARG 44 44 10083 1 . ASP 45 45 10083 1 . SER 46 46 10083 1 . GLY 47 47 10083 1 . ALA 48 48 10083 1 . MET 49 49 10083 1 . LEU 50 50 10083 1 . GLY 51 51 10083 1 . LEU 52 52 10083 1 . LYS 53 53 10083 1 . VAL 54 54 10083 1 . VAL 55 55 10083 1 . GLY 56 56 10083 1 . GLY 57 57 10083 1 . LYS 58 58 10083 1 . MET 59 59 10083 1 . THR 60 60 10083 1 . GLU 61 61 10083 1 . SER 62 62 10083 1 . GLY 63 63 10083 1 . ARG 64 64 10083 1 . LEU 65 65 10083 1 . CYS 66 66 10083 1 . ALA 67 67 10083 1 . PHE 68 68 10083 1 . ILE 69 69 10083 1 . THR 70 70 10083 1 . LYS 71 71 10083 1 . VAL 72 72 10083 1 . LYS 73 73 10083 1 . LYS 74 74 10083 1 . GLY 75 75 10083 1 . SER 76 76 10083 1 . LEU 77 77 10083 1 . ALA 78 78 10083 1 . ASP 79 79 10083 1 . THR 80 80 10083 1 . VAL 81 81 10083 1 . GLY 82 82 10083 1 . HIS 83 83 10083 1 . LEU 84 84 10083 1 . ARG 85 85 10083 1 . PRO 86 86 10083 1 . GLY 87 87 10083 1 . ASP 88 88 10083 1 . GLU 89 89 10083 1 . VAL 90 90 10083 1 . LEU 91 91 10083 1 . GLU 92 92 10083 1 . TRP 93 93 10083 1 . ASN 94 94 10083 1 . GLY 95 95 10083 1 . ARG 96 96 10083 1 . LEU 97 97 10083 1 . LEU 98 98 10083 1 . GLN 99 99 10083 1 . GLY 100 100 10083 1 . ALA 101 101 10083 1 . THR 102 102 10083 1 . PHE 103 103 10083 1 . GLU 104 104 10083 1 . GLU 105 105 10083 1 . VAL 106 106 10083 1 . TYR 107 107 10083 1 . ASN 108 108 10083 1 . ILE 109 109 10083 1 . ILE 110 110 10083 1 . LEU 111 111 10083 1 . GLU 112 112 10083 1 . SER 113 113 10083 1 . LYS 114 114 10083 1 . PRO 115 115 10083 1 . GLU 116 116 10083 1 . PRO 117 117 10083 1 . GLN 118 118 10083 1 . VAL 119 119 10083 1 . GLU 120 120 10083 1 . LEU 121 121 10083 1 . VAL 122 122 10083 1 . VAL 123 123 10083 1 . SER 124 124 10083 1 . ARG 125 125 10083 1 . SER 126 126 10083 1 . GLY 127 127 10083 1 . PRO 128 128 10083 1 . SER 129 129 10083 1 . SER 130 130 10083 1 . GLY 131 131 10083 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 10083 _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 . . . human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 10083 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 10083 _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' . . . . . . . . . . . . . . . . . . . plasmid . . P021030-35 . . . . . . 10083 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 10083 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'PDZ domain' '[U-13C; U-15N]' . . 1 $entity_1 . . 1.17 . . mM . . . . 10083 1 2 PiNa . . . . . . . 20 . . mM . . . . 10083 1 3 NaCl . . . . . . salt 100 . . mM . . . . 10083 1 4 DTT . . . . . . salt 1 . . mM . . . . 10083 1 5 NaN3 . . . . . . . 0.02 . . % . . . . 10083 1 6 H2O . . . . . . solvent 90 . . % . . . . 10083 1 7 D2O . . . . . . solvent 10 . . % . . . . 10083 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 10083 _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 10083 1 pH 6.0 0.05 pH 10083 1 pressure 1 0.001 atm 10083 1 temperature 298 0.1 K 10083 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 10083 _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 . . 10083 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 10083 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 10083 _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.' . . 10083 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 10083 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 10083 _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.' . . 10083 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10083 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 10083 _Software.ID 4 _Software.Name Kujira _Software.Version 0.8992 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 10083 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10083 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 10083 _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.' . . 10083 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 10083 5 'structure solution' 10083 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 10083 _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_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 10083 _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 . . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10083 1 2 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 . . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10083 1 stop_ save_ save_3D_13C-separated_NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_13C-separated_NOESY _NMR_spec_expt.Entry_ID 10083 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '3D 13C-separated NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_15N-separated_NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_15N-separated_NOESY _NMR_spec_expt.Entry_ID 10083 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '3D 15N-separated NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode reference_1 _Chem_shift_reference.Entry_ID 10083 _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 . . . . . . . . . 10083 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 10083 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 10083 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 10083 _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 10083 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10083 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 SER HA H 1 4.565 0.030 . 1 . . . . 2 SER HA . 10083 1 2 . 1 1 2 2 SER HB2 H 1 3.901 0.030 . 1 . . . . 2 SER HB2 . 10083 1 3 . 1 1 2 2 SER HB3 H 1 3.901 0.030 . 1 . . . . 2 SER HB3 . 10083 1 4 . 1 1 2 2 SER C C 13 174.787 0.300 . 1 . . . . 2 SER C . 10083 1 5 . 1 1 2 2 SER CA C 13 58.345 0.300 . 1 . . . . 2 SER CA . 10083 1 6 . 1 1 2 2 SER CB C 13 64.010 0.300 . 1 . . . . 2 SER CB . 10083 1 7 . 1 1 3 3 SER H H 1 8.585 0.030 . 1 . . . . 3 SER H . 10083 1 8 . 1 1 3 3 SER HA H 1 4.504 0.030 . 1 . . . . 3 SER HA . 10083 1 9 . 1 1 3 3 SER HB2 H 1 3.906 0.030 . 1 . . . . 3 SER HB2 . 10083 1 10 . 1 1 3 3 SER HB3 H 1 3.906 0.030 . 1 . . . . 3 SER HB3 . 10083 1 11 . 1 1 3 3 SER C C 13 175.096 0.300 . 1 . . . . 3 SER C . 10083 1 12 . 1 1 3 3 SER CA C 13 58.624 0.300 . 1 . . . . 3 SER CA . 10083 1 13 . 1 1 3 3 SER CB C 13 63.852 0.300 . 1 . . . . 3 SER CB . 10083 1 14 . 1 1 3 3 SER N N 15 118.136 0.300 . 1 . . . . 3 SER N . 10083 1 15 . 1 1 4 4 GLY H H 1 8.479 0.030 . 1 . . . . 4 GLY H . 10083 1 16 . 1 1 4 4 GLY HA2 H 1 4.015 0.030 . 1 . . . . 4 GLY HA2 . 10083 1 17 . 1 1 4 4 GLY HA3 H 1 4.015 0.030 . 1 . . . . 4 GLY HA3 . 10083 1 18 . 1 1 4 4 GLY C C 13 174.369 0.300 . 1 . . . . 4 GLY C . 10083 1 19 . 1 1 4 4 GLY CA C 13 45.460 0.300 . 1 . . . . 4 GLY CA . 10083 1 20 . 1 1 4 4 GLY N N 15 110.916 0.300 . 1 . . . . 4 GLY N . 10083 1 21 . 1 1 5 5 SER H H 1 8.290 0.030 . 1 . . . . 5 SER H . 10083 1 22 . 1 1 5 5 SER HA H 1 4.496 0.030 . 1 . . . . 5 SER HA . 10083 1 23 . 1 1 5 5 SER HB2 H 1 3.892 0.030 . 1 . . . . 5 SER HB2 . 10083 1 24 . 1 1 5 5 SER HB3 H 1 3.892 0.030 . 1 . . . . 5 SER HB3 . 10083 1 25 . 1 1 5 5 SER C C 13 174.887 0.300 . 1 . . . . 5 SER C . 10083 1 26 . 1 1 5 5 SER CA C 13 58.361 0.300 . 1 . . . . 5 SER CA . 10083 1 27 . 1 1 5 5 SER CB C 13 63.906 0.300 . 1 . . . . 5 SER CB . 10083 1 28 . 1 1 5 5 SER N N 15 115.761 0.300 . 1 . . . . 5 SER N . 10083 1 29 . 1 1 6 6 SER H H 1 8.433 0.030 . 1 . . . . 6 SER H . 10083 1 30 . 1 1 6 6 SER HA H 1 4.467 0.030 . 1 . . . . 6 SER HA . 10083 1 31 . 1 1 6 6 SER HB2 H 1 3.890 0.030 . 1 . . . . 6 SER HB2 . 10083 1 32 . 1 1 6 6 SER HB3 H 1 3.890 0.030 . 1 . . . . 6 SER HB3 . 10083 1 33 . 1 1 6 6 SER C C 13 175.047 0.300 . 1 . . . . 6 SER C . 10083 1 34 . 1 1 6 6 SER CA C 13 58.644 0.300 . 1 . . . . 6 SER CA . 10083 1 35 . 1 1 6 6 SER CB C 13 63.875 0.300 . 1 . . . . 6 SER CB . 10083 1 36 . 1 1 6 6 SER N N 15 117.855 0.300 . 1 . . . . 6 SER N . 10083 1 37 . 1 1 7 7 GLY H H 1 8.384 0.030 . 1 . . . . 7 GLY H . 10083 1 38 . 1 1 7 7 GLY HA2 H 1 3.913 0.030 . 1 . . . . 7 GLY HA2 . 10083 1 39 . 1 1 7 7 GLY HA3 H 1 3.913 0.030 . 1 . . . . 7 GLY HA3 . 10083 1 40 . 1 1 7 7 GLY C C 13 173.957 0.300 . 1 . . . . 7 GLY C . 10083 1 41 . 1 1 7 7 GLY CA C 13 45.408 0.300 . 1 . . . . 7 GLY CA . 10083 1 42 . 1 1 7 7 GLY N N 15 110.377 0.300 . 1 . . . . 7 GLY N . 10083 1 43 . 1 1 8 8 HIS H H 1 8.251 0.030 . 1 . . . . 8 HIS H . 10083 1 44 . 1 1 8 8 HIS HA H 1 4.702 0.030 . 1 . . . . 8 HIS HA . 10083 1 45 . 1 1 8 8 HIS HB2 H 1 3.184 0.030 . 2 . . . . 8 HIS HB2 . 10083 1 46 . 1 1 8 8 HIS HB3 H 1 3.070 0.030 . 2 . . . . 8 HIS HB3 . 10083 1 47 . 1 1 8 8 HIS HD2 H 1 7.117 0.030 . 1 . . . . 8 HIS HD2 . 10083 1 48 . 1 1 8 8 HIS C C 13 174.970 0.300 . 1 . . . . 8 HIS C . 10083 1 49 . 1 1 8 8 HIS CA C 13 55.565 0.300 . 1 . . . . 8 HIS CA . 10083 1 50 . 1 1 8 8 HIS CB C 13 29.947 0.300 . 1 . . . . 8 HIS CB . 10083 1 51 . 1 1 8 8 HIS CD2 C 13 120.034 0.300 . 1 . . . . 8 HIS CD2 . 10083 1 52 . 1 1 8 8 HIS N N 15 118.576 0.300 . 1 . . . . 8 HIS N . 10083 1 53 . 1 1 9 9 SER H H 1 8.407 0.030 . 1 . . . . 9 SER H . 10083 1 54 . 1 1 9 9 SER HA H 1 4.408 0.030 . 1 . . . . 9 SER HA . 10083 1 55 . 1 1 9 9 SER HB2 H 1 3.845 0.030 . 2 . . . . 9 SER HB2 . 10083 1 56 . 1 1 9 9 SER HB3 H 1 3.775 0.030 . 2 . . . . 9 SER HB3 . 10083 1 57 . 1 1 9 9 SER C C 13 174.453 0.300 . 1 . . . . 9 SER C . 10083 1 58 . 1 1 9 9 SER CA C 13 58.468 0.300 . 1 . . . . 9 SER CA . 10083 1 59 . 1 1 9 9 SER CB C 13 63.860 0.300 . 1 . . . . 9 SER CB . 10083 1 60 . 1 1 9 9 SER N N 15 117.100 0.300 . 1 . . . . 9 SER N . 10083 1 61 . 1 1 10 10 HIS HA H 1 4.691 0.030 . 1 . . . . 10 HIS HA . 10083 1 62 . 1 1 10 10 HIS HB2 H 1 3.217 0.030 . 2 . . . . 10 HIS HB2 . 10083 1 63 . 1 1 10 10 HIS HB3 H 1 3.132 0.030 . 2 . . . . 10 HIS HB3 . 10083 1 64 . 1 1 10 10 HIS HD2 H 1 7.146 0.030 . 1 . . . . 10 HIS HD2 . 10083 1 65 . 1 1 10 10 HIS C C 13 174.982 0.300 . 1 . . . . 10 HIS C . 10083 1 66 . 1 1 10 10 HIS CA C 13 56.160 0.300 . 1 . . . . 10 HIS CA . 10083 1 67 . 1 1 10 10 HIS CB C 13 29.870 0.300 . 1 . . . . 10 HIS CB . 10083 1 68 . 1 1 10 10 HIS CD2 C 13 120.109 0.300 . 1 . . . . 10 HIS CD2 . 10083 1 69 . 1 1 11 11 SER H H 1 8.300 0.030 . 1 . . . . 11 SER H . 10083 1 70 . 1 1 11 11 SER HA H 1 4.406 0.030 . 1 . . . . 11 SER HA . 10083 1 71 . 1 1 11 11 SER HB2 H 1 3.842 0.030 . 1 . . . . 11 SER HB2 . 10083 1 72 . 1 1 11 11 SER HB3 H 1 3.842 0.030 . 1 . . . . 11 SER HB3 . 10083 1 73 . 1 1 11 11 SER C C 13 174.215 0.300 . 1 . . . . 11 SER C . 10083 1 74 . 1 1 11 11 SER CA C 13 58.373 0.300 . 1 . . . . 11 SER CA . 10083 1 75 . 1 1 11 11 SER CB C 13 63.906 0.300 . 1 . . . . 11 SER CB . 10083 1 76 . 1 1 11 11 SER N N 15 116.746 0.300 . 1 . . . . 11 SER N . 10083 1 77 . 1 1 12 12 ASP H H 1 8.407 0.030 . 1 . . . . 12 ASP H . 10083 1 78 . 1 1 12 12 ASP HA H 1 4.527 0.030 . 1 . . . . 12 ASP HA . 10083 1 79 . 1 1 12 12 ASP HB2 H 1 2.620 0.030 . 1 . . . . 12 ASP HB2 . 10083 1 80 . 1 1 12 12 ASP HB3 H 1 2.620 0.030 . 1 . . . . 12 ASP HB3 . 10083 1 81 . 1 1 12 12 ASP C C 13 176.095 0.300 . 1 . . . . 12 ASP C . 10083 1 82 . 1 1 12 12 ASP CA C 13 54.546 0.300 . 1 . . . . 12 ASP CA . 10083 1 83 . 1 1 12 12 ASP CB C 13 41.045 0.300 . 1 . . . . 12 ASP CB . 10083 1 84 . 1 1 12 12 ASP N N 15 122.641 0.300 . 1 . . . . 12 ASP N . 10083 1 85 . 1 1 13 13 LYS H H 1 8.084 0.030 . 1 . . . . 13 LYS H . 10083 1 86 . 1 1 13 13 LYS HA H 1 4.196 0.030 . 1 . . . . 13 LYS HA . 10083 1 87 . 1 1 13 13 LYS HB2 H 1 1.680 0.030 . 2 . . . . 13 LYS HB2 . 10083 1 88 . 1 1 13 13 LYS HB3 H 1 1.617 0.030 . 2 . . . . 13 LYS HB3 . 10083 1 89 . 1 1 13 13 LYS HG2 H 1 1.351 0.030 . 2 . . . . 13 LYS HG2 . 10083 1 90 . 1 1 13 13 LYS HG3 H 1 1.291 0.030 . 2 . . . . 13 LYS HG3 . 10083 1 91 . 1 1 13 13 LYS HD2 H 1 1.600 0.030 . 1 . . . . 13 LYS HD2 . 10083 1 92 . 1 1 13 13 LYS HD3 H 1 1.600 0.030 . 1 . . . . 13 LYS HD3 . 10083 1 93 . 1 1 13 13 LYS HE2 H 1 2.937 0.030 . 1 . . . . 13 LYS HE2 . 10083 1 94 . 1 1 13 13 LYS HE3 H 1 2.937 0.030 . 1 . . . . 13 LYS HE3 . 10083 1 95 . 1 1 13 13 LYS C C 13 176.144 0.300 . 1 . . . . 13 LYS C . 10083 1 96 . 1 1 13 13 LYS CA C 13 56.182 0.300 . 1 . . . . 13 LYS CA . 10083 1 97 . 1 1 13 13 LYS CB C 13 32.951 0.300 . 1 . . . . 13 LYS CB . 10083 1 98 . 1 1 13 13 LYS CG C 13 24.730 0.300 . 1 . . . . 13 LYS CG . 10083 1 99 . 1 1 13 13 LYS CD C 13 28.890 0.300 . 1 . . . . 13 LYS CD . 10083 1 100 . 1 1 13 13 LYS CE C 13 42.144 0.300 . 1 . . . . 13 LYS CE . 10083 1 101 . 1 1 13 13 LYS N N 15 120.314 0.300 . 1 . . . . 13 LYS N . 10083 1 102 . 1 1 14 14 HIS H H 1 8.336 0.030 . 1 . . . . 14 HIS H . 10083 1 103 . 1 1 14 14 HIS HA H 1 4.949 0.030 . 1 . . . . 14 HIS HA . 10083 1 104 . 1 1 14 14 HIS HB2 H 1 3.169 0.030 . 2 . . . . 14 HIS HB2 . 10083 1 105 . 1 1 14 14 HIS HB3 H 1 3.041 0.030 . 2 . . . . 14 HIS HB3 . 10083 1 106 . 1 1 14 14 HIS HD2 H 1 7.194 0.030 . 1 . . . . 14 HIS HD2 . 10083 1 107 . 1 1 14 14 HIS C C 13 173.008 0.300 . 1 . . . . 14 HIS C . 10083 1 108 . 1 1 14 14 HIS CA C 13 53.567 0.300 . 1 . . . . 14 HIS CA . 10083 1 109 . 1 1 14 14 HIS CB C 13 29.416 0.300 . 1 . . . . 14 HIS CB . 10083 1 110 . 1 1 14 14 HIS CD2 C 13 120.443 0.300 . 1 . . . . 14 HIS CD2 . 10083 1 111 . 1 1 14 14 HIS N N 15 119.904 0.300 . 1 . . . . 14 HIS N . 10083 1 112 . 1 1 15 15 PRO HA H 1 4.470 0.030 . 1 . . . . 15 PRO HA . 10083 1 113 . 1 1 15 15 PRO HB2 H 1 2.286 0.030 . 2 . . . . 15 PRO HB2 . 10083 1 114 . 1 1 15 15 PRO HB3 H 1 2.073 0.030 . 2 . . . . 15 PRO HB3 . 10083 1 115 . 1 1 15 15 PRO HG2 H 1 2.004 0.030 . 1 . . . . 15 PRO HG2 . 10083 1 116 . 1 1 15 15 PRO HG3 H 1 2.004 0.030 . 1 . . . . 15 PRO HG3 . 10083 1 117 . 1 1 15 15 PRO HD2 H 1 3.663 0.030 . 2 . . . . 15 PRO HD2 . 10083 1 118 . 1 1 15 15 PRO HD3 H 1 3.626 0.030 . 2 . . . . 15 PRO HD3 . 10083 1 119 . 1 1 15 15 PRO C C 13 175.985 0.300 . 1 . . . . 15 PRO C . 10083 1 120 . 1 1 15 15 PRO CA C 13 64.070 0.300 . 1 . . . . 15 PRO CA . 10083 1 121 . 1 1 15 15 PRO CB C 13 32.294 0.300 . 1 . . . . 15 PRO CB . 10083 1 122 . 1 1 15 15 PRO CG C 13 27.291 0.300 . 1 . . . . 15 PRO CG . 10083 1 123 . 1 1 15 15 PRO CD C 13 50.650 0.300 . 1 . . . . 15 PRO CD . 10083 1 124 . 1 1 16 16 VAL H H 1 7.969 0.030 . 1 . . . . 16 VAL H . 10083 1 125 . 1 1 16 16 VAL HA H 1 4.539 0.030 . 1 . . . . 16 VAL HA . 10083 1 126 . 1 1 16 16 VAL HB H 1 2.010 0.030 . 1 . . . . 16 VAL HB . 10083 1 127 . 1 1 16 16 VAL HG11 H 1 0.971 0.030 . 1 . . . . 16 VAL HG1 . 10083 1 128 . 1 1 16 16 VAL HG12 H 1 0.971 0.030 . 1 . . . . 16 VAL HG1 . 10083 1 129 . 1 1 16 16 VAL HG13 H 1 0.971 0.030 . 1 . . . . 16 VAL HG1 . 10083 1 130 . 1 1 16 16 VAL HG21 H 1 0.831 0.030 . 1 . . . . 16 VAL HG2 . 10083 1 131 . 1 1 16 16 VAL HG22 H 1 0.831 0.030 . 1 . . . . 16 VAL HG2 . 10083 1 132 . 1 1 16 16 VAL HG23 H 1 0.831 0.030 . 1 . . . . 16 VAL HG2 . 10083 1 133 . 1 1 16 16 VAL C C 13 175.971 0.300 . 1 . . . . 16 VAL C . 10083 1 134 . 1 1 16 16 VAL CA C 13 61.903 0.300 . 1 . . . . 16 VAL CA . 10083 1 135 . 1 1 16 16 VAL CB C 13 34.165 0.300 . 1 . . . . 16 VAL CB . 10083 1 136 . 1 1 16 16 VAL CG1 C 13 21.659 0.300 . 2 . . . . 16 VAL CG1 . 10083 1 137 . 1 1 16 16 VAL CG2 C 13 21.166 0.300 . 2 . . . . 16 VAL CG2 . 10083 1 138 . 1 1 16 16 VAL N N 15 119.179 0.300 . 1 . . . . 16 VAL N . 10083 1 139 . 1 1 17 17 THR H H 1 8.260 0.030 . 1 . . . . 17 THR H . 10083 1 140 . 1 1 17 17 THR HA H 1 4.530 0.030 . 1 . . . . 17 THR HA . 10083 1 141 . 1 1 17 17 THR HB H 1 4.054 0.030 . 1 . . . . 17 THR HB . 10083 1 142 . 1 1 17 17 THR HG21 H 1 1.141 0.030 . 1 . . . . 17 THR HG2 . 10083 1 143 . 1 1 17 17 THR HG22 H 1 1.141 0.030 . 1 . . . . 17 THR HG2 . 10083 1 144 . 1 1 17 17 THR HG23 H 1 1.141 0.030 . 1 . . . . 17 THR HG2 . 10083 1 145 . 1 1 17 17 THR C C 13 172.839 0.300 . 1 . . . . 17 THR C . 10083 1 146 . 1 1 17 17 THR CA C 13 61.516 0.300 . 1 . . . . 17 THR CA . 10083 1 147 . 1 1 17 17 THR CB C 13 71.173 0.300 . 1 . . . . 17 THR CB . 10083 1 148 . 1 1 17 17 THR CG2 C 13 21.642 0.300 . 1 . . . . 17 THR CG2 . 10083 1 149 . 1 1 17 17 THR N N 15 120.522 0.300 . 1 . . . . 17 THR N . 10083 1 150 . 1 1 18 18 TRP H H 1 8.583 0.030 . 1 . . . . 18 TRP H . 10083 1 151 . 1 1 18 18 TRP HA H 1 5.242 0.030 . 1 . . . . 18 TRP HA . 10083 1 152 . 1 1 18 18 TRP HB2 H 1 2.984 0.030 . 1 . . . . 18 TRP HB2 . 10083 1 153 . 1 1 18 18 TRP HB3 H 1 2.984 0.030 . 1 . . . . 18 TRP HB3 . 10083 1 154 . 1 1 18 18 TRP HD1 H 1 7.169 0.030 . 1 . . . . 18 TRP HD1 . 10083 1 155 . 1 1 18 18 TRP HE1 H 1 10.043 0.030 . 1 . . . . 18 TRP HE1 . 10083 1 156 . 1 1 18 18 TRP HE3 H 1 7.139 0.030 . 1 . . . . 18 TRP HE3 . 10083 1 157 . 1 1 18 18 TRP HZ2 H 1 7.314 0.030 . 1 . . . . 18 TRP HZ2 . 10083 1 158 . 1 1 18 18 TRP HZ3 H 1 6.776 0.030 . 1 . . . . 18 TRP HZ3 . 10083 1 159 . 1 1 18 18 TRP HH2 H 1 6.856 0.030 . 1 . . . . 18 TRP HH2 . 10083 1 160 . 1 1 18 18 TRP C C 13 175.998 0.300 . 1 . . . . 18 TRP C . 10083 1 161 . 1 1 18 18 TRP CA C 13 56.130 0.300 . 1 . . . . 18 TRP CA . 10083 1 162 . 1 1 18 18 TRP CB C 13 31.557 0.300 . 1 . . . . 18 TRP CB . 10083 1 163 . 1 1 18 18 TRP CD1 C 13 127.062 0.300 . 1 . . . . 18 TRP CD1 . 10083 1 164 . 1 1 18 18 TRP CE3 C 13 119.855 0.300 . 1 . . . . 18 TRP CE3 . 10083 1 165 . 1 1 18 18 TRP CZ2 C 13 114.060 0.300 . 1 . . . . 18 TRP CZ2 . 10083 1 166 . 1 1 18 18 TRP CZ3 C 13 121.276 0.300 . 1 . . . . 18 TRP CZ3 . 10083 1 167 . 1 1 18 18 TRP CH2 C 13 124.011 0.300 . 1 . . . . 18 TRP CH2 . 10083 1 168 . 1 1 18 18 TRP N N 15 124.515 0.300 . 1 . . . . 18 TRP N . 10083 1 169 . 1 1 18 18 TRP NE1 N 15 129.119 0.300 . 1 . . . . 18 TRP NE1 . 10083 1 170 . 1 1 19 19 GLN H H 1 9.219 0.030 . 1 . . . . 19 GLN H . 10083 1 171 . 1 1 19 19 GLN HA H 1 5.055 0.030 . 1 . . . . 19 GLN HA . 10083 1 172 . 1 1 19 19 GLN HB2 H 1 2.135 0.030 . 2 . . . . 19 GLN HB2 . 10083 1 173 . 1 1 19 19 GLN HB3 H 1 2.004 0.030 . 2 . . . . 19 GLN HB3 . 10083 1 174 . 1 1 19 19 GLN HG2 H 1 2.391 0.030 . 2 . . . . 19 GLN HG2 . 10083 1 175 . 1 1 19 19 GLN HG3 H 1 2.331 0.030 . 2 . . . . 19 GLN HG3 . 10083 1 176 . 1 1 19 19 GLN HE21 H 1 7.473 0.030 . 2 . . . . 19 GLN HE21 . 10083 1 177 . 1 1 19 19 GLN HE22 H 1 6.863 0.030 . 2 . . . . 19 GLN HE22 . 10083 1 178 . 1 1 19 19 GLN C C 13 173.008 0.300 . 1 . . . . 19 GLN C . 10083 1 179 . 1 1 19 19 GLN CA C 13 52.878 0.300 . 1 . . . . 19 GLN CA . 10083 1 180 . 1 1 19 19 GLN CB C 13 31.557 0.300 . 1 . . . . 19 GLN CB . 10083 1 181 . 1 1 19 19 GLN CG C 13 33.327 0.300 . 1 . . . . 19 GLN CG . 10083 1 182 . 1 1 19 19 GLN N N 15 121.854 0.300 . 1 . . . . 19 GLN N . 10083 1 183 . 1 1 19 19 GLN NE2 N 15 111.944 0.300 . 1 . . . . 19 GLN NE2 . 10083 1 184 . 1 1 20 20 PRO HA H 1 4.991 0.030 . 1 . . . . 20 PRO HA . 10083 1 185 . 1 1 20 20 PRO HB2 H 1 2.391 0.030 . 2 . . . . 20 PRO HB2 . 10083 1 186 . 1 1 20 20 PRO HB3 H 1 2.076 0.030 . 2 . . . . 20 PRO HB3 . 10083 1 187 . 1 1 20 20 PRO HG2 H 1 2.163 0.030 . 2 . . . . 20 PRO HG2 . 10083 1 188 . 1 1 20 20 PRO HG3 H 1 2.024 0.030 . 2 . . . . 20 PRO HG3 . 10083 1 189 . 1 1 20 20 PRO HD2 H 1 3.857 0.030 . 2 . . . . 20 PRO HD2 . 10083 1 190 . 1 1 20 20 PRO HD3 H 1 3.776 0.030 . 2 . . . . 20 PRO HD3 . 10083 1 191 . 1 1 20 20 PRO C C 13 177.544 0.300 . 1 . . . . 20 PRO C . 10083 1 192 . 1 1 20 20 PRO CA C 13 62.909 0.300 . 1 . . . . 20 PRO CA . 10083 1 193 . 1 1 20 20 PRO CB C 13 32.294 0.300 . 1 . . . . 20 PRO CB . 10083 1 194 . 1 1 20 20 PRO CG C 13 27.636 0.300 . 1 . . . . 20 PRO CG . 10083 1 195 . 1 1 20 20 PRO CD C 13 50.745 0.300 . 1 . . . . 20 PRO CD . 10083 1 196 . 1 1 21 21 SER H H 1 8.688 0.030 . 1 . . . . 21 SER H . 10083 1 197 . 1 1 21 21 SER HA H 1 4.431 0.030 . 1 . . . . 21 SER HA . 10083 1 198 . 1 1 21 21 SER HB2 H 1 4.306 0.030 . 2 . . . . 21 SER HB2 . 10083 1 199 . 1 1 21 21 SER HB3 H 1 3.795 0.030 . 2 . . . . 21 SER HB3 . 10083 1 200 . 1 1 21 21 SER C C 13 175.690 0.300 . 1 . . . . 21 SER C . 10083 1 201 . 1 1 21 21 SER CA C 13 57.759 0.300 . 1 . . . . 21 SER CA . 10083 1 202 . 1 1 21 21 SER CB C 13 64.430 0.300 . 1 . . . . 21 SER CB . 10083 1 203 . 1 1 21 21 SER N N 15 117.174 0.300 . 1 . . . . 21 SER N . 10083 1 204 . 1 1 22 22 LYS H H 1 8.910 0.030 . 1 . . . . 22 LYS H . 10083 1 205 . 1 1 22 22 LYS HA H 1 4.111 0.030 . 1 . . . . 22 LYS HA . 10083 1 206 . 1 1 22 22 LYS HB2 H 1 1.896 0.030 . 2 . . . . 22 LYS HB2 . 10083 1 207 . 1 1 22 22 LYS HB3 H 1 1.844 0.030 . 2 . . . . 22 LYS HB3 . 10083 1 208 . 1 1 22 22 LYS HG2 H 1 1.490 0.030 . 2 . . . . 22 LYS HG2 . 10083 1 209 . 1 1 22 22 LYS HG3 H 1 1.465 0.030 . 2 . . . . 22 LYS HG3 . 10083 1 210 . 1 1 22 22 LYS HD2 H 1 1.693 0.030 . 1 . . . . 22 LYS HD2 . 10083 1 211 . 1 1 22 22 LYS HD3 H 1 1.693 0.030 . 1 . . . . 22 LYS HD3 . 10083 1 212 . 1 1 22 22 LYS HE2 H 1 3.012 0.030 . 1 . . . . 22 LYS HE2 . 10083 1 213 . 1 1 22 22 LYS HE3 H 1 3.012 0.030 . 1 . . . . 22 LYS HE3 . 10083 1 214 . 1 1 22 22 LYS C C 13 177.409 0.300 . 1 . . . . 22 LYS C . 10083 1 215 . 1 1 22 22 LYS CA C 13 59.081 0.300 . 1 . . . . 22 LYS CA . 10083 1 216 . 1 1 22 22 LYS CB C 13 32.138 0.300 . 1 . . . . 22 LYS CB . 10083 1 217 . 1 1 22 22 LYS CG C 13 24.586 0.300 . 1 . . . . 22 LYS CG . 10083 1 218 . 1 1 22 22 LYS CD C 13 29.098 0.300 . 1 . . . . 22 LYS CD . 10083 1 219 . 1 1 22 22 LYS CE C 13 42.163 0.300 . 1 . . . . 22 LYS CE . 10083 1 220 . 1 1 22 22 LYS N N 15 123.193 0.300 . 1 . . . . 22 LYS N . 10083 1 221 . 1 1 23 23 ASP H H 1 8.141 0.030 . 1 . . . . 23 ASP H . 10083 1 222 . 1 1 23 23 ASP HA H 1 4.683 0.030 . 1 . . . . 23 ASP HA . 10083 1 223 . 1 1 23 23 ASP HB2 H 1 2.720 0.030 . 1 . . . . 23 ASP HB2 . 10083 1 224 . 1 1 23 23 ASP HB3 H 1 2.720 0.030 . 1 . . . . 23 ASP HB3 . 10083 1 225 . 1 1 23 23 ASP C C 13 176.934 0.300 . 1 . . . . 23 ASP C . 10083 1 226 . 1 1 23 23 ASP CA C 13 54.172 0.300 . 1 . . . . 23 ASP CA . 10083 1 227 . 1 1 23 23 ASP CB C 13 41.289 0.300 . 1 . . . . 23 ASP CB . 10083 1 228 . 1 1 23 23 ASP N N 15 115.424 0.300 . 1 . . . . 23 ASP N . 10083 1 229 . 1 1 24 24 GLY H H 1 7.997 0.030 . 1 . . . . 24 GLY H . 10083 1 230 . 1 1 24 24 GLY HA2 H 1 4.144 0.030 . 2 . . . . 24 GLY HA2 . 10083 1 231 . 1 1 24 24 GLY HA3 H 1 3.724 0.030 . 2 . . . . 24 GLY HA3 . 10083 1 232 . 1 1 24 24 GLY C C 13 173.852 0.300 . 1 . . . . 24 GLY C . 10083 1 233 . 1 1 24 24 GLY CA C 13 45.910 0.300 . 1 . . . . 24 GLY CA . 10083 1 234 . 1 1 24 24 GLY N N 15 108.706 0.300 . 1 . . . . 24 GLY N . 10083 1 235 . 1 1 25 25 ASP H H 1 8.421 0.030 . 1 . . . . 25 ASP H . 10083 1 236 . 1 1 25 25 ASP HA H 1 4.613 0.030 . 1 . . . . 25 ASP HA . 10083 1 237 . 1 1 25 25 ASP HB2 H 1 2.721 0.030 . 2 . . . . 25 ASP HB2 . 10083 1 238 . 1 1 25 25 ASP HB3 H 1 2.674 0.030 . 2 . . . . 25 ASP HB3 . 10083 1 239 . 1 1 25 25 ASP C C 13 175.739 0.300 . 1 . . . . 25 ASP C . 10083 1 240 . 1 1 25 25 ASP CA C 13 54.520 0.300 . 1 . . . . 25 ASP CA . 10083 1 241 . 1 1 25 25 ASP CB C 13 40.886 0.300 . 1 . . . . 25 ASP CB . 10083 1 242 . 1 1 25 25 ASP N N 15 118.220 0.300 . 1 . . . . 25 ASP N . 10083 1 243 . 1 1 26 26 ARG H H 1 7.828 0.030 . 1 . . . . 26 ARG H . 10083 1 244 . 1 1 26 26 ARG HA H 1 4.895 0.030 . 1 . . . . 26 ARG HA . 10083 1 245 . 1 1 26 26 ARG HB2 H 1 1.911 0.030 . 2 . . . . 26 ARG HB2 . 10083 1 246 . 1 1 26 26 ARG HB3 H 1 1.649 0.030 . 2 . . . . 26 ARG HB3 . 10083 1 247 . 1 1 26 26 ARG HG2 H 1 1.562 0.030 . 1 . . . . 26 ARG HG2 . 10083 1 248 . 1 1 26 26 ARG HG3 H 1 1.562 0.030 . 1 . . . . 26 ARG HG3 . 10083 1 249 . 1 1 26 26 ARG HD2 H 1 3.180 0.030 . 2 . . . . 26 ARG HD2 . 10083 1 250 . 1 1 26 26 ARG HD3 H 1 3.116 0.030 . 2 . . . . 26 ARG HD3 . 10083 1 251 . 1 1 26 26 ARG HE H 1 7.192 0.030 . 1 . . . . 26 ARG HE . 10083 1 252 . 1 1 26 26 ARG C C 13 174.774 0.300 . 1 . . . . 26 ARG C . 10083 1 253 . 1 1 26 26 ARG CA C 13 54.407 0.300 . 1 . . . . 26 ARG CA . 10083 1 254 . 1 1 26 26 ARG CB C 13 33.541 0.300 . 1 . . . . 26 ARG CB . 10083 1 255 . 1 1 26 26 ARG CG C 13 27.120 0.300 . 1 . . . . 26 ARG CG . 10083 1 256 . 1 1 26 26 ARG CD C 13 43.300 0.300 . 1 . . . . 26 ARG CD . 10083 1 257 . 1 1 26 26 ARG N N 15 118.189 0.300 . 1 . . . . 26 ARG N . 10083 1 258 . 1 1 26 26 ARG NE N 15 84.888 0.300 . 1 . . . . 26 ARG NE . 10083 1 259 . 1 1 27 27 LEU H H 1 9.009 0.030 . 1 . . . . 27 LEU H . 10083 1 260 . 1 1 27 27 LEU HA H 1 4.882 0.030 . 1 . . . . 27 LEU HA . 10083 1 261 . 1 1 27 27 LEU HB2 H 1 1.638 0.030 . 1 . . . . 27 LEU HB2 . 10083 1 262 . 1 1 27 27 LEU HB3 H 1 1.638 0.030 . 1 . . . . 27 LEU HB3 . 10083 1 263 . 1 1 27 27 LEU HG H 1 1.624 0.030 . 1 . . . . 27 LEU HG . 10083 1 264 . 1 1 27 27 LEU HD11 H 1 0.695 0.030 . 1 . . . . 27 LEU HD1 . 10083 1 265 . 1 1 27 27 LEU HD12 H 1 0.695 0.030 . 1 . . . . 27 LEU HD1 . 10083 1 266 . 1 1 27 27 LEU HD13 H 1 0.695 0.030 . 1 . . . . 27 LEU HD1 . 10083 1 267 . 1 1 27 27 LEU HD21 H 1 0.733 0.030 . 1 . . . . 27 LEU HD2 . 10083 1 268 . 1 1 27 27 LEU HD22 H 1 0.733 0.030 . 1 . . . . 27 LEU HD2 . 10083 1 269 . 1 1 27 27 LEU HD23 H 1 0.733 0.030 . 1 . . . . 27 LEU HD2 . 10083 1 270 . 1 1 27 27 LEU C C 13 175.186 0.300 . 1 . . . . 27 LEU C . 10083 1 271 . 1 1 27 27 LEU CA C 13 54.166 0.300 . 1 . . . . 27 LEU CA . 10083 1 272 . 1 1 27 27 LEU CB C 13 45.547 0.300 . 1 . . . . 27 LEU CB . 10083 1 273 . 1 1 27 27 LEU CG C 13 27.214 0.300 . 1 . . . . 27 LEU CG . 10083 1 274 . 1 1 27 27 LEU CD1 C 13 24.910 0.300 . 2 . . . . 27 LEU CD1 . 10083 1 275 . 1 1 27 27 LEU CD2 C 13 23.916 0.300 . 2 . . . . 27 LEU CD2 . 10083 1 276 . 1 1 27 27 LEU N N 15 123.017 0.300 . 1 . . . . 27 LEU N . 10083 1 277 . 1 1 28 28 ILE H H 1 9.188 0.030 . 1 . . . . 28 ILE H . 10083 1 278 . 1 1 28 28 ILE HA H 1 5.293 0.030 . 1 . . . . 28 ILE HA . 10083 1 279 . 1 1 28 28 ILE HB H 1 1.953 0.030 . 1 . . . . 28 ILE HB . 10083 1 280 . 1 1 28 28 ILE HG12 H 1 1.431 0.030 . 2 . . . . 28 ILE HG12 . 10083 1 281 . 1 1 28 28 ILE HG13 H 1 1.305 0.030 . 2 . . . . 28 ILE HG13 . 10083 1 282 . 1 1 28 28 ILE HG21 H 1 0.761 0.030 . 1 . . . . 28 ILE HG2 . 10083 1 283 . 1 1 28 28 ILE HG22 H 1 0.761 0.030 . 1 . . . . 28 ILE HG2 . 10083 1 284 . 1 1 28 28 ILE HG23 H 1 0.761 0.030 . 1 . . . . 28 ILE HG2 . 10083 1 285 . 1 1 28 28 ILE HD11 H 1 0.785 0.030 . 1 . . . . 28 ILE HD1 . 10083 1 286 . 1 1 28 28 ILE HD12 H 1 0.785 0.030 . 1 . . . . 28 ILE HD1 . 10083 1 287 . 1 1 28 28 ILE HD13 H 1 0.785 0.030 . 1 . . . . 28 ILE HD1 . 10083 1 288 . 1 1 28 28 ILE C C 13 176.305 0.300 . 1 . . . . 28 ILE C . 10083 1 289 . 1 1 28 28 ILE CA C 13 58.617 0.300 . 1 . . . . 28 ILE CA . 10083 1 290 . 1 1 28 28 ILE CB C 13 38.312 0.300 . 1 . . . . 28 ILE CB . 10083 1 291 . 1 1 28 28 ILE CG1 C 13 27.141 0.300 . 1 . . . . 28 ILE CG1 . 10083 1 292 . 1 1 28 28 ILE CG2 C 13 17.293 0.300 . 1 . . . . 28 ILE CG2 . 10083 1 293 . 1 1 28 28 ILE CD1 C 13 11.207 0.300 . 1 . . . . 28 ILE CD1 . 10083 1 294 . 1 1 28 28 ILE N N 15 123.366 0.300 . 1 . . . . 28 ILE N . 10083 1 295 . 1 1 29 29 GLY H H 1 9.226 0.030 . 1 . . . . 29 GLY H . 10083 1 296 . 1 1 29 29 GLY HA2 H 1 4.366 0.030 . 2 . . . . 29 GLY HA2 . 10083 1 297 . 1 1 29 29 GLY HA3 H 1 1.502 0.030 . 2 . . . . 29 GLY HA3 . 10083 1 298 . 1 1 29 29 GLY C C 13 171.224 0.300 . 1 . . . . 29 GLY C . 10083 1 299 . 1 1 29 29 GLY CA C 13 43.437 0.300 . 1 . . . . 29 GLY CA . 10083 1 300 . 1 1 29 29 GLY N N 15 119.066 0.300 . 1 . . . . 29 GLY N . 10083 1 301 . 1 1 30 30 ARG H H 1 8.189 0.030 . 1 . . . . 30 ARG H . 10083 1 302 . 1 1 30 30 ARG HA H 1 4.912 0.030 . 1 . . . . 30 ARG HA . 10083 1 303 . 1 1 30 30 ARG HB2 H 1 1.619 0.030 . 2 . . . . 30 ARG HB2 . 10083 1 304 . 1 1 30 30 ARG HB3 H 1 1.505 0.030 . 2 . . . . 30 ARG HB3 . 10083 1 305 . 1 1 30 30 ARG HG2 H 1 1.396 0.030 . 2 . . . . 30 ARG HG2 . 10083 1 306 . 1 1 30 30 ARG HG3 H 1 1.235 0.030 . 2 . . . . 30 ARG HG3 . 10083 1 307 . 1 1 30 30 ARG HD2 H 1 3.087 0.030 . 2 . . . . 30 ARG HD2 . 10083 1 308 . 1 1 30 30 ARG HD3 H 1 2.974 0.030 . 2 . . . . 30 ARG HD3 . 10083 1 309 . 1 1 30 30 ARG HE H 1 7.239 0.030 . 1 . . . . 30 ARG HE . 10083 1 310 . 1 1 30 30 ARG C C 13 174.837 0.300 . 1 . . . . 30 ARG C . 10083 1 311 . 1 1 30 30 ARG CA C 13 55.371 0.300 . 1 . . . . 30 ARG CA . 10083 1 312 . 1 1 30 30 ARG CB C 13 31.121 0.300 . 1 . . . . 30 ARG CB . 10083 1 313 . 1 1 30 30 ARG CG C 13 28.017 0.300 . 1 . . . . 30 ARG CG . 10083 1 314 . 1 1 30 30 ARG CD C 13 42.989 0.300 . 1 . . . . 30 ARG CD . 10083 1 315 . 1 1 30 30 ARG N N 15 124.199 0.300 . 1 . . . . 30 ARG N . 10083 1 316 . 1 1 30 30 ARG NE N 15 83.551 0.300 . 1 . . . . 30 ARG NE . 10083 1 317 . 1 1 31 31 ILE H H 1 8.825 0.030 . 1 . . . . 31 ILE H . 10083 1 318 . 1 1 31 31 ILE HA H 1 4.459 0.030 . 1 . . . . 31 ILE HA . 10083 1 319 . 1 1 31 31 ILE HB H 1 1.657 0.030 . 1 . . . . 31 ILE HB . 10083 1 320 . 1 1 31 31 ILE HG12 H 1 1.137 0.030 . 1 . . . . 31 ILE HG12 . 10083 1 321 . 1 1 31 31 ILE HG13 H 1 1.137 0.030 . 1 . . . . 31 ILE HG13 . 10083 1 322 . 1 1 31 31 ILE HG21 H 1 0.703 0.030 . 1 . . . . 31 ILE HG2 . 10083 1 323 . 1 1 31 31 ILE HG22 H 1 0.703 0.030 . 1 . . . . 31 ILE HG2 . 10083 1 324 . 1 1 31 31 ILE HG23 H 1 0.703 0.030 . 1 . . . . 31 ILE HG2 . 10083 1 325 . 1 1 31 31 ILE HD11 H 1 0.535 0.030 . 1 . . . . 31 ILE HD1 . 10083 1 326 . 1 1 31 31 ILE HD12 H 1 0.535 0.030 . 1 . . . . 31 ILE HD1 . 10083 1 327 . 1 1 31 31 ILE HD13 H 1 0.535 0.030 . 1 . . . . 31 ILE HD1 . 10083 1 328 . 1 1 31 31 ILE C C 13 173.020 0.300 . 1 . . . . 31 ILE C . 10083 1 329 . 1 1 31 31 ILE CA C 13 59.571 0.300 . 1 . . . . 31 ILE CA . 10083 1 330 . 1 1 31 31 ILE CB C 13 41.588 0.300 . 1 . . . . 31 ILE CB . 10083 1 331 . 1 1 31 31 ILE CG1 C 13 28.314 0.300 . 1 . . . . 31 ILE CG1 . 10083 1 332 . 1 1 31 31 ILE CG2 C 13 18.965 0.300 . 1 . . . . 31 ILE CG2 . 10083 1 333 . 1 1 31 31 ILE CD1 C 13 14.110 0.300 . 1 . . . . 31 ILE CD1 . 10083 1 334 . 1 1 31 31 ILE N N 15 126.589 0.300 . 1 . . . . 31 ILE N . 10083 1 335 . 1 1 32 32 LEU H H 1 8.430 0.030 . 1 . . . . 32 LEU H . 10083 1 336 . 1 1 32 32 LEU HA H 1 4.808 0.030 . 1 . . . . 32 LEU HA . 10083 1 337 . 1 1 32 32 LEU HB2 H 1 1.661 0.030 . 2 . . . . 32 LEU HB2 . 10083 1 338 . 1 1 32 32 LEU HB3 H 1 1.356 0.030 . 2 . . . . 32 LEU HB3 . 10083 1 339 . 1 1 32 32 LEU HG H 1 1.232 0.030 . 1 . . . . 32 LEU HG . 10083 1 340 . 1 1 32 32 LEU HD11 H 1 0.683 0.030 . 1 . . . . 32 LEU HD1 . 10083 1 341 . 1 1 32 32 LEU HD12 H 1 0.683 0.030 . 1 . . . . 32 LEU HD1 . 10083 1 342 . 1 1 32 32 LEU HD13 H 1 0.683 0.030 . 1 . . . . 32 LEU HD1 . 10083 1 343 . 1 1 32 32 LEU HD21 H 1 0.649 0.030 . 1 . . . . 32 LEU HD2 . 10083 1 344 . 1 1 32 32 LEU HD22 H 1 0.649 0.030 . 1 . . . . 32 LEU HD2 . 10083 1 345 . 1 1 32 32 LEU HD23 H 1 0.649 0.030 . 1 . . . . 32 LEU HD2 . 10083 1 346 . 1 1 32 32 LEU C C 13 175.173 0.300 . 1 . . . . 32 LEU C . 10083 1 347 . 1 1 32 32 LEU CA C 13 53.836 0.300 . 1 . . . . 32 LEU CA . 10083 1 348 . 1 1 32 32 LEU CB C 13 43.456 0.300 . 1 . . . . 32 LEU CB . 10083 1 349 . 1 1 32 32 LEU CG C 13 27.762 0.300 . 1 . . . . 32 LEU CG . 10083 1 350 . 1 1 32 32 LEU CD1 C 13 24.932 0.300 . 2 . . . . 32 LEU CD1 . 10083 1 351 . 1 1 32 32 LEU CD2 C 13 24.062 0.300 . 2 . . . . 32 LEU CD2 . 10083 1 352 . 1 1 32 32 LEU N N 15 129.511 0.300 . 1 . . . . 32 LEU N . 10083 1 353 . 1 1 33 33 LEU H H 1 8.866 0.030 . 1 . . . . 33 LEU H . 10083 1 354 . 1 1 33 33 LEU HA H 1 4.556 0.030 . 1 . . . . 33 LEU HA . 10083 1 355 . 1 1 33 33 LEU HB2 H 1 1.732 0.030 . 2 . . . . 33 LEU HB2 . 10083 1 356 . 1 1 33 33 LEU HB3 H 1 0.942 0.030 . 2 . . . . 33 LEU HB3 . 10083 1 357 . 1 1 33 33 LEU HG H 1 1.365 0.030 . 1 . . . . 33 LEU HG . 10083 1 358 . 1 1 33 33 LEU HD11 H 1 0.587 0.030 . 1 . . . . 33 LEU HD1 . 10083 1 359 . 1 1 33 33 LEU HD12 H 1 0.587 0.030 . 1 . . . . 33 LEU HD1 . 10083 1 360 . 1 1 33 33 LEU HD13 H 1 0.587 0.030 . 1 . . . . 33 LEU HD1 . 10083 1 361 . 1 1 33 33 LEU HD21 H 1 0.554 0.030 . 1 . . . . 33 LEU HD2 . 10083 1 362 . 1 1 33 33 LEU HD22 H 1 0.554 0.030 . 1 . . . . 33 LEU HD2 . 10083 1 363 . 1 1 33 33 LEU HD23 H 1 0.554 0.030 . 1 . . . . 33 LEU HD2 . 10083 1 364 . 1 1 33 33 LEU C C 13 174.166 0.300 . 1 . . . . 33 LEU C . 10083 1 365 . 1 1 33 33 LEU CA C 13 52.819 0.300 . 1 . . . . 33 LEU CA . 10083 1 366 . 1 1 33 33 LEU CB C 13 42.291 0.300 . 1 . . . . 33 LEU CB . 10083 1 367 . 1 1 33 33 LEU CG C 13 26.273 0.300 . 1 . . . . 33 LEU CG . 10083 1 368 . 1 1 33 33 LEU CD1 C 13 26.171 0.300 . 2 . . . . 33 LEU CD1 . 10083 1 369 . 1 1 33 33 LEU CD2 C 13 23.611 0.300 . 2 . . . . 33 LEU CD2 . 10083 1 370 . 1 1 33 33 LEU N N 15 124.984 0.300 . 1 . . . . 33 LEU N . 10083 1 371 . 1 1 34 34 ASN H H 1 8.976 0.030 . 1 . . . . 34 ASN H . 10083 1 372 . 1 1 34 34 ASN HA H 1 4.685 0.030 . 1 . . . . 34 ASN HA . 10083 1 373 . 1 1 34 34 ASN HB2 H 1 2.976 0.030 . 2 . . . . 34 ASN HB2 . 10083 1 374 . 1 1 34 34 ASN HB3 H 1 2.634 0.030 . 2 . . . . 34 ASN HB3 . 10083 1 375 . 1 1 34 34 ASN HD21 H 1 7.561 0.030 . 2 . . . . 34 ASN HD21 . 10083 1 376 . 1 1 34 34 ASN HD22 H 1 6.886 0.030 . 2 . . . . 34 ASN HD22 . 10083 1 377 . 1 1 34 34 ASN C C 13 175.151 0.300 . 1 . . . . 34 ASN C . 10083 1 378 . 1 1 34 34 ASN CA C 13 52.858 0.300 . 1 . . . . 34 ASN CA . 10083 1 379 . 1 1 34 34 ASN CB C 13 39.330 0.300 . 1 . . . . 34 ASN CB . 10083 1 380 . 1 1 34 34 ASN N N 15 123.766 0.300 . 1 . . . . 34 ASN N . 10083 1 381 . 1 1 34 34 ASN ND2 N 15 111.702 0.300 . 1 . . . . 34 ASN ND2 . 10083 1 382 . 1 1 35 35 LYS H H 1 8.572 0.030 . 1 . . . . 35 LYS H . 10083 1 383 . 1 1 35 35 LYS HA H 1 4.083 0.030 . 1 . . . . 35 LYS HA . 10083 1 384 . 1 1 35 35 LYS HB2 H 1 2.076 0.030 . 2 . . . . 35 LYS HB2 . 10083 1 385 . 1 1 35 35 LYS HB3 H 1 1.498 0.030 . 2 . . . . 35 LYS HB3 . 10083 1 386 . 1 1 35 35 LYS HG2 H 1 1.271 0.030 . 2 . . . . 35 LYS HG2 . 10083 1 387 . 1 1 35 35 LYS HG3 H 1 1.239 0.030 . 2 . . . . 35 LYS HG3 . 10083 1 388 . 1 1 35 35 LYS HD2 H 1 1.776 0.030 . 2 . . . . 35 LYS HD2 . 10083 1 389 . 1 1 35 35 LYS HD3 H 1 1.539 0.030 . 2 . . . . 35 LYS HD3 . 10083 1 390 . 1 1 35 35 LYS HE2 H 1 2.868 0.030 . 2 . . . . 35 LYS HE2 . 10083 1 391 . 1 1 35 35 LYS HE3 H 1 2.722 0.030 . 2 . . . . 35 LYS HE3 . 10083 1 392 . 1 1 35 35 LYS C C 13 175.571 0.300 . 1 . . . . 35 LYS C . 10083 1 393 . 1 1 35 35 LYS CA C 13 56.750 0.300 . 1 . . . . 35 LYS CA . 10083 1 394 . 1 1 35 35 LYS CB C 13 33.448 0.300 . 1 . . . . 35 LYS CB . 10083 1 395 . 1 1 35 35 LYS CG C 13 25.104 0.300 . 1 . . . . 35 LYS CG . 10083 1 396 . 1 1 35 35 LYS CD C 13 30.315 0.300 . 1 . . . . 35 LYS CD . 10083 1 397 . 1 1 35 35 LYS CE C 13 42.144 0.300 . 1 . . . . 35 LYS CE . 10083 1 398 . 1 1 35 35 LYS N N 15 123.569 0.300 . 1 . . . . 35 LYS N . 10083 1 399 . 1 1 36 36 ARG H H 1 7.740 0.030 . 1 . . . . 36 ARG H . 10083 1 400 . 1 1 36 36 ARG HA H 1 4.365 0.030 . 1 . . . . 36 ARG HA . 10083 1 401 . 1 1 36 36 ARG HB2 H 1 1.745 0.030 . 2 . . . . 36 ARG HB2 . 10083 1 402 . 1 1 36 36 ARG HB3 H 1 1.717 0.030 . 2 . . . . 36 ARG HB3 . 10083 1 403 . 1 1 36 36 ARG HG2 H 1 1.749 0.030 . 2 . . . . 36 ARG HG2 . 10083 1 404 . 1 1 36 36 ARG HG3 H 1 1.540 0.030 . 2 . . . . 36 ARG HG3 . 10083 1 405 . 1 1 36 36 ARG HD2 H 1 3.203 0.030 . 2 . . . . 36 ARG HD2 . 10083 1 406 . 1 1 36 36 ARG HD3 H 1 3.173 0.030 . 2 . . . . 36 ARG HD3 . 10083 1 407 . 1 1 36 36 ARG HE H 1 7.367 0.030 . 1 . . . . 36 ARG HE . 10083 1 408 . 1 1 36 36 ARG C C 13 177.548 0.300 . 1 . . . . 36 ARG C . 10083 1 409 . 1 1 36 36 ARG CA C 13 56.337 0.300 . 1 . . . . 36 ARG CA . 10083 1 410 . 1 1 36 36 ARG CB C 13 31.424 0.300 . 1 . . . . 36 ARG CB . 10083 1 411 . 1 1 36 36 ARG CG C 13 27.895 0.300 . 1 . . . . 36 ARG CG . 10083 1 412 . 1 1 36 36 ARG CD C 13 43.843 0.300 . 1 . . . . 36 ARG CD . 10083 1 413 . 1 1 36 36 ARG N N 15 116.668 0.300 . 1 . . . . 36 ARG N . 10083 1 414 . 1 1 36 36 ARG NE N 15 85.109 0.300 . 1 . . . . 36 ARG NE . 10083 1 415 . 1 1 37 37 LEU H H 1 8.684 0.030 . 1 . . . . 37 LEU H . 10083 1 416 . 1 1 37 37 LEU HA H 1 4.447 0.030 . 1 . . . . 37 LEU HA . 10083 1 417 . 1 1 37 37 LEU HB2 H 1 1.873 0.030 . 2 . . . . 37 LEU HB2 . 10083 1 418 . 1 1 37 37 LEU HB3 H 1 1.625 0.030 . 2 . . . . 37 LEU HB3 . 10083 1 419 . 1 1 37 37 LEU HG H 1 1.641 0.030 . 1 . . . . 37 LEU HG . 10083 1 420 . 1 1 37 37 LEU HD11 H 1 0.879 0.030 . 1 . . . . 37 LEU HD1 . 10083 1 421 . 1 1 37 37 LEU HD12 H 1 0.879 0.030 . 1 . . . . 37 LEU HD1 . 10083 1 422 . 1 1 37 37 LEU HD13 H 1 0.879 0.030 . 1 . . . . 37 LEU HD1 . 10083 1 423 . 1 1 37 37 LEU HD21 H 1 0.854 0.030 . 1 . . . . 37 LEU HD2 . 10083 1 424 . 1 1 37 37 LEU HD22 H 1 0.854 0.030 . 1 . . . . 37 LEU HD2 . 10083 1 425 . 1 1 37 37 LEU HD23 H 1 0.854 0.030 . 1 . . . . 37 LEU HD2 . 10083 1 426 . 1 1 37 37 LEU C C 13 179.212 0.300 . 1 . . . . 37 LEU C . 10083 1 427 . 1 1 37 37 LEU CA C 13 54.210 0.300 . 1 . . . . 37 LEU CA . 10083 1 428 . 1 1 37 37 LEU CB C 13 42.147 0.300 . 1 . . . . 37 LEU CB . 10083 1 429 . 1 1 37 37 LEU CG C 13 27.322 0.300 . 1 . . . . 37 LEU CG . 10083 1 430 . 1 1 37 37 LEU CD1 C 13 25.361 0.300 . 2 . . . . 37 LEU CD1 . 10083 1 431 . 1 1 37 37 LEU CD2 C 13 22.506 0.300 . 2 . . . . 37 LEU CD2 . 10083 1 432 . 1 1 37 37 LEU N N 15 122.322 0.300 . 1 . . . . 37 LEU N . 10083 1 433 . 1 1 38 38 LYS H H 1 8.567 0.030 . 1 . . . . 38 LYS H . 10083 1 434 . 1 1 38 38 LYS HA H 1 4.106 0.030 . 1 . . . . 38 LYS HA . 10083 1 435 . 1 1 38 38 LYS HB2 H 1 1.835 0.030 . 1 . . . . 38 LYS HB2 . 10083 1 436 . 1 1 38 38 LYS HB3 H 1 1.835 0.030 . 1 . . . . 38 LYS HB3 . 10083 1 437 . 1 1 38 38 LYS HG2 H 1 1.468 0.030 . 1 . . . . 38 LYS HG2 . 10083 1 438 . 1 1 38 38 LYS HG3 H 1 1.468 0.030 . 1 . . . . 38 LYS HG3 . 10083 1 439 . 1 1 38 38 LYS HD2 H 1 1.695 0.030 . 1 . . . . 38 LYS HD2 . 10083 1 440 . 1 1 38 38 LYS HD3 H 1 1.695 0.030 . 1 . . . . 38 LYS HD3 . 10083 1 441 . 1 1 38 38 LYS HE2 H 1 2.994 0.030 . 1 . . . . 38 LYS HE2 . 10083 1 442 . 1 1 38 38 LYS HE3 H 1 2.994 0.030 . 1 . . . . 38 LYS HE3 . 10083 1 443 . 1 1 38 38 LYS C C 13 176.857 0.300 . 1 . . . . 38 LYS C . 10083 1 444 . 1 1 38 38 LYS CA C 13 58.519 0.300 . 1 . . . . 38 LYS CA . 10083 1 445 . 1 1 38 38 LYS CB C 13 32.325 0.300 . 1 . . . . 38 LYS CB . 10083 1 446 . 1 1 38 38 LYS CG C 13 24.790 0.300 . 1 . . . . 38 LYS CG . 10083 1 447 . 1 1 38 38 LYS CD C 13 29.126 0.300 . 1 . . . . 38 LYS CD . 10083 1 448 . 1 1 38 38 LYS CE C 13 42.139 0.300 . 1 . . . . 38 LYS CE . 10083 1 449 . 1 1 38 38 LYS N N 15 121.541 0.300 . 1 . . . . 38 LYS N . 10083 1 450 . 1 1 39 39 ASP H H 1 7.894 0.030 . 1 . . . . 39 ASP H . 10083 1 451 . 1 1 39 39 ASP HA H 1 4.506 0.030 . 1 . . . . 39 ASP HA . 10083 1 452 . 1 1 39 39 ASP HB2 H 1 2.985 0.030 . 2 . . . . 39 ASP HB2 . 10083 1 453 . 1 1 39 39 ASP HB3 H 1 2.621 0.030 . 2 . . . . 39 ASP HB3 . 10083 1 454 . 1 1 39 39 ASP C C 13 176.983 0.300 . 1 . . . . 39 ASP C . 10083 1 455 . 1 1 39 39 ASP CA C 13 53.721 0.300 . 1 . . . . 39 ASP CA . 10083 1 456 . 1 1 39 39 ASP CB C 13 40.184 0.300 . 1 . . . . 39 ASP CB . 10083 1 457 . 1 1 39 39 ASP N N 15 117.058 0.300 . 1 . . . . 39 ASP N . 10083 1 458 . 1 1 40 40 GLY H H 1 8.329 0.030 . 1 . . . . 40 GLY H . 10083 1 459 . 1 1 40 40 GLY HA2 H 1 4.296 0.030 . 2 . . . . 40 GLY HA2 . 10083 1 460 . 1 1 40 40 GLY HA3 H 1 3.659 0.030 . 2 . . . . 40 GLY HA3 . 10083 1 461 . 1 1 40 40 GLY C C 13 173.908 0.300 . 1 . . . . 40 GLY C . 10083 1 462 . 1 1 40 40 GLY CA C 13 45.344 0.300 . 1 . . . . 40 GLY CA . 10083 1 463 . 1 1 40 40 GLY N N 15 108.849 0.300 . 1 . . . . 40 GLY N . 10083 1 464 . 1 1 41 41 SER H H 1 8.231 0.030 . 1 . . . . 41 SER H . 10083 1 465 . 1 1 41 41 SER HA H 1 4.409 0.030 . 1 . . . . 41 SER HA . 10083 1 466 . 1 1 41 41 SER HB2 H 1 3.838 0.030 . 1 . . . . 41 SER HB2 . 10083 1 467 . 1 1 41 41 SER HB3 H 1 3.838 0.030 . 1 . . . . 41 SER HB3 . 10083 1 468 . 1 1 41 41 SER C C 13 172.678 0.300 . 1 . . . . 41 SER C . 10083 1 469 . 1 1 41 41 SER CA C 13 58.606 0.300 . 1 . . . . 41 SER CA . 10083 1 470 . 1 1 41 41 SER CB C 13 64.455 0.300 . 1 . . . . 41 SER CB . 10083 1 471 . 1 1 41 41 SER N N 15 117.295 0.300 . 1 . . . . 41 SER N . 10083 1 472 . 1 1 42 42 VAL H H 1 8.278 0.030 . 1 . . . . 42 VAL H . 10083 1 473 . 1 1 42 42 VAL HA H 1 4.574 0.030 . 1 . . . . 42 VAL HA . 10083 1 474 . 1 1 42 42 VAL HB H 1 2.010 0.030 . 1 . . . . 42 VAL HB . 10083 1 475 . 1 1 42 42 VAL HG11 H 1 0.937 0.030 . 1 . . . . 42 VAL HG1 . 10083 1 476 . 1 1 42 42 VAL HG12 H 1 0.937 0.030 . 1 . . . . 42 VAL HG1 . 10083 1 477 . 1 1 42 42 VAL HG13 H 1 0.937 0.030 . 1 . . . . 42 VAL HG1 . 10083 1 478 . 1 1 42 42 VAL HG21 H 1 0.903 0.030 . 1 . . . . 42 VAL HG2 . 10083 1 479 . 1 1 42 42 VAL HG22 H 1 0.903 0.030 . 1 . . . . 42 VAL HG2 . 10083 1 480 . 1 1 42 42 VAL HG23 H 1 0.903 0.030 . 1 . . . . 42 VAL HG2 . 10083 1 481 . 1 1 42 42 VAL C C 13 174.818 0.300 . 1 . . . . 42 VAL C . 10083 1 482 . 1 1 42 42 VAL CA C 13 59.485 0.300 . 1 . . . . 42 VAL CA . 10083 1 483 . 1 1 42 42 VAL CB C 13 33.233 0.300 . 1 . . . . 42 VAL CB . 10083 1 484 . 1 1 42 42 VAL CG1 C 13 21.045 0.300 . 2 . . . . 42 VAL CG1 . 10083 1 485 . 1 1 42 42 VAL CG2 C 13 21.455 0.300 . 2 . . . . 42 VAL CG2 . 10083 1 486 . 1 1 42 42 VAL N N 15 120.288 0.300 . 1 . . . . 42 VAL N . 10083 1 487 . 1 1 43 43 PRO HA H 1 4.435 0.030 . 1 . . . . 43 PRO HA . 10083 1 488 . 1 1 43 43 PRO HB2 H 1 2.325 0.030 . 2 . . . . 43 PRO HB2 . 10083 1 489 . 1 1 43 43 PRO HB3 H 1 1.880 0.030 . 2 . . . . 43 PRO HB3 . 10083 1 490 . 1 1 43 43 PRO HG2 H 1 2.003 0.030 . 1 . . . . 43 PRO HG2 . 10083 1 491 . 1 1 43 43 PRO HG3 H 1 2.003 0.030 . 1 . . . . 43 PRO HG3 . 10083 1 492 . 1 1 43 43 PRO HD2 H 1 3.949 0.030 . 2 . . . . 43 PRO HD2 . 10083 1 493 . 1 1 43 43 PRO HD3 H 1 3.728 0.030 . 2 . . . . 43 PRO HD3 . 10083 1 494 . 1 1 43 43 PRO C C 13 176.723 0.300 . 1 . . . . 43 PRO C . 10083 1 495 . 1 1 43 43 PRO CA C 13 62.922 0.300 . 1 . . . . 43 PRO CA . 10083 1 496 . 1 1 43 43 PRO CB C 13 32.529 0.300 . 1 . . . . 43 PRO CB . 10083 1 497 . 1 1 43 43 PRO CG C 13 27.613 0.300 . 1 . . . . 43 PRO CG . 10083 1 498 . 1 1 43 43 PRO CD C 13 51.508 0.300 . 1 . . . . 43 PRO CD . 10083 1 499 . 1 1 44 44 ARG H H 1 8.572 0.030 . 1 . . . . 44 ARG H . 10083 1 500 . 1 1 44 44 ARG HA H 1 4.206 0.030 . 1 . . . . 44 ARG HA . 10083 1 501 . 1 1 44 44 ARG HB2 H 1 1.858 0.030 . 2 . . . . 44 ARG HB2 . 10083 1 502 . 1 1 44 44 ARG HB3 H 1 1.814 0.030 . 2 . . . . 44 ARG HB3 . 10083 1 503 . 1 1 44 44 ARG HG2 H 1 1.727 0.030 . 2 . . . . 44 ARG HG2 . 10083 1 504 . 1 1 44 44 ARG HG3 H 1 1.669 0.030 . 2 . . . . 44 ARG HG3 . 10083 1 505 . 1 1 44 44 ARG HD2 H 1 3.230 0.030 . 1 . . . . 44 ARG HD2 . 10083 1 506 . 1 1 44 44 ARG HD3 H 1 3.230 0.030 . 1 . . . . 44 ARG HD3 . 10083 1 507 . 1 1 44 44 ARG HE H 1 7.242 0.030 . 1 . . . . 44 ARG HE . 10083 1 508 . 1 1 44 44 ARG C C 13 176.619 0.300 . 1 . . . . 44 ARG C . 10083 1 509 . 1 1 44 44 ARG CA C 13 57.330 0.300 . 1 . . . . 44 ARG CA . 10083 1 510 . 1 1 44 44 ARG CB C 13 30.420 0.300 . 1 . . . . 44 ARG CB . 10083 1 511 . 1 1 44 44 ARG CG C 13 27.248 0.300 . 1 . . . . 44 ARG CG . 10083 1 512 . 1 1 44 44 ARG CD C 13 43.327 0.300 . 1 . . . . 44 ARG CD . 10083 1 513 . 1 1 44 44 ARG N N 15 121.500 0.300 . 1 . . . . 44 ARG N . 10083 1 514 . 1 1 44 44 ARG NE N 15 84.707 0.300 . 1 . . . . 44 ARG NE . 10083 1 515 . 1 1 45 45 ASP H H 1 8.289 0.030 . 1 . . . . 45 ASP H . 10083 1 516 . 1 1 45 45 ASP HA H 1 4.751 0.030 . 1 . . . . 45 ASP HA . 10083 1 517 . 1 1 45 45 ASP HB2 H 1 2.778 0.030 . 2 . . . . 45 ASP HB2 . 10083 1 518 . 1 1 45 45 ASP HB3 H 1 2.706 0.030 . 2 . . . . 45 ASP HB3 . 10083 1 519 . 1 1 45 45 ASP C C 13 176.640 0.300 . 1 . . . . 45 ASP C . 10083 1 520 . 1 1 45 45 ASP CA C 13 53.465 0.300 . 1 . . . . 45 ASP CA . 10083 1 521 . 1 1 45 45 ASP CB C 13 40.805 0.300 . 1 . . . . 45 ASP CB . 10083 1 522 . 1 1 45 45 ASP N N 15 118.637 0.300 . 1 . . . . 45 ASP N . 10083 1 523 . 1 1 46 46 SER H H 1 8.232 0.030 . 1 . . . . 46 SER H . 10083 1 524 . 1 1 46 46 SER HA H 1 4.264 0.030 . 1 . . . . 46 SER HA . 10083 1 525 . 1 1 46 46 SER HB2 H 1 3.956 0.030 . 1 . . . . 46 SER HB2 . 10083 1 526 . 1 1 46 46 SER HB3 H 1 3.956 0.030 . 1 . . . . 46 SER HB3 . 10083 1 527 . 1 1 46 46 SER C C 13 175.906 0.300 . 1 . . . . 46 SER C . 10083 1 528 . 1 1 46 46 SER CA C 13 60.180 0.300 . 1 . . . . 46 SER CA . 10083 1 529 . 1 1 46 46 SER CB C 13 63.397 0.300 . 1 . . . . 46 SER CB . 10083 1 530 . 1 1 46 46 SER N N 15 116.708 0.300 . 1 . . . . 46 SER N . 10083 1 531 . 1 1 47 47 GLY H H 1 8.730 0.030 . 1 . . . . 47 GLY H . 10083 1 532 . 1 1 47 47 GLY HA2 H 1 4.055 0.030 . 2 . . . . 47 GLY HA2 . 10083 1 533 . 1 1 47 47 GLY HA3 H 1 3.965 0.030 . 2 . . . . 47 GLY HA3 . 10083 1 534 . 1 1 47 47 GLY C C 13 175.802 0.300 . 1 . . . . 47 GLY C . 10083 1 535 . 1 1 47 47 GLY CA C 13 46.706 0.300 . 1 . . . . 47 GLY CA . 10083 1 536 . 1 1 47 47 GLY N N 15 111.172 0.300 . 1 . . . . 47 GLY N . 10083 1 537 . 1 1 48 48 ALA H H 1 8.214 0.030 . 1 . . . . 48 ALA H . 10083 1 538 . 1 1 48 48 ALA HA H 1 4.280 0.030 . 1 . . . . 48 ALA HA . 10083 1 539 . 1 1 48 48 ALA HB1 H 1 1.428 0.030 . 1 . . . . 48 ALA HB . 10083 1 540 . 1 1 48 48 ALA HB2 H 1 1.428 0.030 . 1 . . . . 48 ALA HB . 10083 1 541 . 1 1 48 48 ALA HB3 H 1 1.428 0.030 . 1 . . . . 48 ALA HB . 10083 1 542 . 1 1 48 48 ALA C C 13 178.751 0.300 . 1 . . . . 48 ALA C . 10083 1 543 . 1 1 48 48 ALA CA C 13 53.903 0.300 . 1 . . . . 48 ALA CA . 10083 1 544 . 1 1 48 48 ALA CB C 13 18.962 0.300 . 1 . . . . 48 ALA CB . 10083 1 545 . 1 1 48 48 ALA N N 15 124.475 0.300 . 1 . . . . 48 ALA N . 10083 1 546 . 1 1 49 49 MET H H 1 7.990 0.030 . 1 . . . . 49 MET H . 10083 1 547 . 1 1 49 49 MET HA H 1 4.354 0.030 . 1 . . . . 49 MET HA . 10083 1 548 . 1 1 49 49 MET HB2 H 1 2.231 0.030 . 2 . . . . 49 MET HB2 . 10083 1 549 . 1 1 49 49 MET HB3 H 1 2.167 0.030 . 2 . . . . 49 MET HB3 . 10083 1 550 . 1 1 49 49 MET HG2 H 1 2.636 0.030 . 2 . . . . 49 MET HG2 . 10083 1 551 . 1 1 49 49 MET HG3 H 1 2.530 0.030 . 2 . . . . 49 MET HG3 . 10083 1 552 . 1 1 49 49 MET HE1 H 1 2.085 0.030 . 1 . . . . 49 MET HE . 10083 1 553 . 1 1 49 49 MET HE2 H 1 2.085 0.030 . 1 . . . . 49 MET HE . 10083 1 554 . 1 1 49 49 MET HE3 H 1 2.085 0.030 . 1 . . . . 49 MET HE . 10083 1 555 . 1 1 49 49 MET C C 13 177.231 0.300 . 1 . . . . 49 MET C . 10083 1 556 . 1 1 49 49 MET CA C 13 57.032 0.300 . 1 . . . . 49 MET CA . 10083 1 557 . 1 1 49 49 MET CB C 13 32.919 0.300 . 1 . . . . 49 MET CB . 10083 1 558 . 1 1 49 49 MET CG C 13 32.447 0.300 . 1 . . . . 49 MET CG . 10083 1 559 . 1 1 49 49 MET CE C 13 17.388 0.300 . 1 . . . . 49 MET CE . 10083 1 560 . 1 1 49 49 MET N N 15 116.154 0.300 . 1 . . . . 49 MET N . 10083 1 561 . 1 1 50 50 LEU H H 1 8.098 0.030 . 1 . . . . 50 LEU H . 10083 1 562 . 1 1 50 50 LEU HA H 1 4.098 0.030 . 1 . . . . 50 LEU HA . 10083 1 563 . 1 1 50 50 LEU HB2 H 1 2.050 0.030 . 2 . . . . 50 LEU HB2 . 10083 1 564 . 1 1 50 50 LEU HB3 H 1 1.552 0.030 . 2 . . . . 50 LEU HB3 . 10083 1 565 . 1 1 50 50 LEU HG H 1 1.745 0.030 . 1 . . . . 50 LEU HG . 10083 1 566 . 1 1 50 50 LEU HD11 H 1 0.875 0.030 . 1 . . . . 50 LEU HD1 . 10083 1 567 . 1 1 50 50 LEU HD12 H 1 0.875 0.030 . 1 . . . . 50 LEU HD1 . 10083 1 568 . 1 1 50 50 LEU HD13 H 1 0.875 0.030 . 1 . . . . 50 LEU HD1 . 10083 1 569 . 1 1 50 50 LEU HD21 H 1 0.821 0.030 . 1 . . . . 50 LEU HD2 . 10083 1 570 . 1 1 50 50 LEU HD22 H 1 0.821 0.030 . 1 . . . . 50 LEU HD2 . 10083 1 571 . 1 1 50 50 LEU HD23 H 1 0.821 0.030 . 1 . . . . 50 LEU HD2 . 10083 1 572 . 1 1 50 50 LEU C C 13 176.834 0.300 . 1 . . . . 50 LEU C . 10083 1 573 . 1 1 50 50 LEU CA C 13 57.657 0.300 . 1 . . . . 50 LEU CA . 10083 1 574 . 1 1 50 50 LEU CB C 13 42.021 0.300 . 1 . . . . 50 LEU CB . 10083 1 575 . 1 1 50 50 LEU CG C 13 27.065 0.300 . 1 . . . . 50 LEU CG . 10083 1 576 . 1 1 50 50 LEU CD1 C 13 26.072 0.300 . 2 . . . . 50 LEU CD1 . 10083 1 577 . 1 1 50 50 LEU CD2 C 13 24.325 0.300 . 2 . . . . 50 LEU CD2 . 10083 1 578 . 1 1 50 50 LEU N N 15 116.980 0.300 . 1 . . . . 50 LEU N . 10083 1 579 . 1 1 51 51 GLY H H 1 7.924 0.030 . 1 . . . . 51 GLY H . 10083 1 580 . 1 1 51 51 GLY HA2 H 1 4.742 0.030 . 2 . . . . 51 GLY HA2 . 10083 1 581 . 1 1 51 51 GLY HA3 H 1 3.696 0.030 . 2 . . . . 51 GLY HA3 . 10083 1 582 . 1 1 51 51 GLY C C 13 174.383 0.300 . 1 . . . . 51 GLY C . 10083 1 583 . 1 1 51 51 GLY CA C 13 45.610 0.300 . 1 . . . . 51 GLY CA . 10083 1 584 . 1 1 51 51 GLY N N 15 102.006 0.300 . 1 . . . . 51 GLY N . 10083 1 585 . 1 1 52 52 LEU H H 1 7.588 0.030 . 1 . . . . 52 LEU H . 10083 1 586 . 1 1 52 52 LEU HA H 1 5.171 0.030 . 1 . . . . 52 LEU HA . 10083 1 587 . 1 1 52 52 LEU HB2 H 1 1.837 0.030 . 2 . . . . 52 LEU HB2 . 10083 1 588 . 1 1 52 52 LEU HB3 H 1 1.321 0.030 . 2 . . . . 52 LEU HB3 . 10083 1 589 . 1 1 52 52 LEU HG H 1 1.606 0.030 . 1 . . . . 52 LEU HG . 10083 1 590 . 1 1 52 52 LEU HD11 H 1 0.899 0.030 . 1 . . . . 52 LEU HD1 . 10083 1 591 . 1 1 52 52 LEU HD12 H 1 0.899 0.030 . 1 . . . . 52 LEU HD1 . 10083 1 592 . 1 1 52 52 LEU HD13 H 1 0.899 0.030 . 1 . . . . 52 LEU HD1 . 10083 1 593 . 1 1 52 52 LEU HD21 H 1 0.853 0.030 . 1 . . . . 52 LEU HD2 . 10083 1 594 . 1 1 52 52 LEU HD22 H 1 0.853 0.030 . 1 . . . . 52 LEU HD2 . 10083 1 595 . 1 1 52 52 LEU HD23 H 1 0.853 0.030 . 1 . . . . 52 LEU HD2 . 10083 1 596 . 1 1 52 52 LEU C C 13 175.962 0.300 . 1 . . . . 52 LEU C . 10083 1 597 . 1 1 52 52 LEU CA C 13 53.669 0.300 . 1 . . . . 52 LEU CA . 10083 1 598 . 1 1 52 52 LEU CB C 13 46.030 0.300 . 1 . . . . 52 LEU CB . 10083 1 599 . 1 1 52 52 LEU CG C 13 26.871 0.300 . 1 . . . . 52 LEU CG . 10083 1 600 . 1 1 52 52 LEU CD1 C 13 26.081 0.300 . 2 . . . . 52 LEU CD1 . 10083 1 601 . 1 1 52 52 LEU CD2 C 13 25.742 0.300 . 2 . . . . 52 LEU CD2 . 10083 1 602 . 1 1 52 52 LEU N N 15 118.065 0.300 . 1 . . . . 52 LEU N . 10083 1 603 . 1 1 53 53 LYS H H 1 8.065 0.030 . 1 . . . . 53 LYS H . 10083 1 604 . 1 1 53 53 LYS HA H 1 4.663 0.030 . 1 . . . . 53 LYS HA . 10083 1 605 . 1 1 53 53 LYS HB2 H 1 1.832 0.030 . 2 . . . . 53 LYS HB2 . 10083 1 606 . 1 1 53 53 LYS HB3 H 1 1.663 0.030 . 2 . . . . 53 LYS HB3 . 10083 1 607 . 1 1 53 53 LYS HG2 H 1 1.375 0.030 . 2 . . . . 53 LYS HG2 . 10083 1 608 . 1 1 53 53 LYS HG3 H 1 1.283 0.030 . 2 . . . . 53 LYS HG3 . 10083 1 609 . 1 1 53 53 LYS HD2 H 1 1.649 0.030 . 1 . . . . 53 LYS HD2 . 10083 1 610 . 1 1 53 53 LYS HD3 H 1 1.649 0.030 . 1 . . . . 53 LYS HD3 . 10083 1 611 . 1 1 53 53 LYS HE2 H 1 2.964 0.030 . 2 . . . . 53 LYS HE2 . 10083 1 612 . 1 1 53 53 LYS HE3 H 1 2.939 0.030 . 2 . . . . 53 LYS HE3 . 10083 1 613 . 1 1 53 53 LYS C C 13 174.677 0.300 . 1 . . . . 53 LYS C . 10083 1 614 . 1 1 53 53 LYS CA C 13 56.028 0.300 . 1 . . . . 53 LYS CA . 10083 1 615 . 1 1 53 53 LYS CB C 13 34.958 0.300 . 1 . . . . 53 LYS CB . 10083 1 616 . 1 1 53 53 LYS CG C 13 25.264 0.300 . 1 . . . . 53 LYS CG . 10083 1 617 . 1 1 53 53 LYS CD C 13 29.092 0.300 . 1 . . . . 53 LYS CD . 10083 1 618 . 1 1 53 53 LYS CE C 13 42.368 0.300 . 1 . . . . 53 LYS CE . 10083 1 619 . 1 1 53 53 LYS N N 15 121.984 0.300 . 1 . . . . 53 LYS N . 10083 1 620 . 1 1 54 54 VAL H H 1 8.611 0.030 . 1 . . . . 54 VAL H . 10083 1 621 . 1 1 54 54 VAL HA H 1 4.800 0.030 . 1 . . . . 54 VAL HA . 10083 1 622 . 1 1 54 54 VAL HB H 1 1.583 0.030 . 1 . . . . 54 VAL HB . 10083 1 623 . 1 1 54 54 VAL HG11 H 1 0.868 0.030 . 1 . . . . 54 VAL HG1 . 10083 1 624 . 1 1 54 54 VAL HG12 H 1 0.868 0.030 . 1 . . . . 54 VAL HG1 . 10083 1 625 . 1 1 54 54 VAL HG13 H 1 0.868 0.030 . 1 . . . . 54 VAL HG1 . 10083 1 626 . 1 1 54 54 VAL HG21 H 1 0.496 0.030 . 1 . . . . 54 VAL HG2 . 10083 1 627 . 1 1 54 54 VAL HG22 H 1 0.496 0.030 . 1 . . . . 54 VAL HG2 . 10083 1 628 . 1 1 54 54 VAL HG23 H 1 0.496 0.030 . 1 . . . . 54 VAL HG2 . 10083 1 629 . 1 1 54 54 VAL C C 13 174.613 0.300 . 1 . . . . 54 VAL C . 10083 1 630 . 1 1 54 54 VAL CA C 13 60.590 0.300 . 1 . . . . 54 VAL CA . 10083 1 631 . 1 1 54 54 VAL CB C 13 34.683 0.300 . 1 . . . . 54 VAL CB . 10083 1 632 . 1 1 54 54 VAL CG1 C 13 22.452 0.300 . 2 . . . . 54 VAL CG1 . 10083 1 633 . 1 1 54 54 VAL CG2 C 13 21.053 0.300 . 2 . . . . 54 VAL CG2 . 10083 1 634 . 1 1 54 54 VAL N N 15 126.652 0.300 . 1 . . . . 54 VAL N . 10083 1 635 . 1 1 55 55 VAL H H 1 8.964 0.030 . 1 . . . . 55 VAL H . 10083 1 636 . 1 1 55 55 VAL HA H 1 4.262 0.030 . 1 . . . . 55 VAL HA . 10083 1 637 . 1 1 55 55 VAL HB H 1 2.103 0.030 . 1 . . . . 55 VAL HB . 10083 1 638 . 1 1 55 55 VAL HG11 H 1 1.117 0.030 . 1 . . . . 55 VAL HG1 . 10083 1 639 . 1 1 55 55 VAL HG12 H 1 1.117 0.030 . 1 . . . . 55 VAL HG1 . 10083 1 640 . 1 1 55 55 VAL HG13 H 1 1.117 0.030 . 1 . . . . 55 VAL HG1 . 10083 1 641 . 1 1 55 55 VAL HG21 H 1 1.256 0.030 . 1 . . . . 55 VAL HG2 . 10083 1 642 . 1 1 55 55 VAL HG22 H 1 1.256 0.030 . 1 . . . . 55 VAL HG2 . 10083 1 643 . 1 1 55 55 VAL HG23 H 1 1.256 0.030 . 1 . . . . 55 VAL HG2 . 10083 1 644 . 1 1 55 55 VAL C C 13 175.173 0.300 . 1 . . . . 55 VAL C . 10083 1 645 . 1 1 55 55 VAL CA C 13 62.061 0.300 . 1 . . . . 55 VAL CA . 10083 1 646 . 1 1 55 55 VAL CB C 13 34.091 0.300 . 1 . . . . 55 VAL CB . 10083 1 647 . 1 1 55 55 VAL CG1 C 13 22.024 0.300 . 2 . . . . 55 VAL CG1 . 10083 1 648 . 1 1 55 55 VAL CG2 C 13 21.651 0.300 . 2 . . . . 55 VAL CG2 . 10083 1 649 . 1 1 55 55 VAL N N 15 126.827 0.300 . 1 . . . . 55 VAL N . 10083 1 650 . 1 1 56 56 GLY H H 1 8.945 0.030 . 1 . . . . 56 GLY H . 10083 1 651 . 1 1 56 56 GLY HA2 H 1 4.749 0.030 . 2 . . . . 56 GLY HA2 . 10083 1 652 . 1 1 56 56 GLY HA3 H 1 3.315 0.030 . 2 . . . . 56 GLY HA3 . 10083 1 653 . 1 1 56 56 GLY C C 13 172.893 0.300 . 1 . . . . 56 GLY C . 10083 1 654 . 1 1 56 56 GLY CA C 13 43.233 0.300 . 1 . . . . 56 GLY CA . 10083 1 655 . 1 1 56 56 GLY N N 15 113.582 0.300 . 1 . . . . 56 GLY N . 10083 1 656 . 1 1 57 57 GLY H H 1 8.416 0.030 . 1 . . . . 57 GLY H . 10083 1 657 . 1 1 57 57 GLY HA2 H 1 4.049 0.030 . 2 . . . . 57 GLY HA2 . 10083 1 658 . 1 1 57 57 GLY HA3 H 1 3.885 0.030 . 2 . . . . 57 GLY HA3 . 10083 1 659 . 1 1 57 57 GLY C C 13 174.216 0.300 . 1 . . . . 57 GLY C . 10083 1 660 . 1 1 57 57 GLY CA C 13 47.406 0.300 . 1 . . . . 57 GLY CA . 10083 1 661 . 1 1 57 57 GLY N N 15 106.453 0.300 . 1 . . . . 57 GLY N . 10083 1 662 . 1 1 58 58 LYS H H 1 9.121 0.030 . 1 . . . . 58 LYS H . 10083 1 663 . 1 1 58 58 LYS HA H 1 4.409 0.030 . 1 . . . . 58 LYS HA . 10083 1 664 . 1 1 58 58 LYS HB2 H 1 2.095 0.030 . 2 . . . . 58 LYS HB2 . 10083 1 665 . 1 1 58 58 LYS HB3 H 1 1.992 0.030 . 2 . . . . 58 LYS HB3 . 10083 1 666 . 1 1 58 58 LYS HG2 H 1 1.522 0.030 . 2 . . . . 58 LYS HG2 . 10083 1 667 . 1 1 58 58 LYS HG3 H 1 1.408 0.030 . 2 . . . . 58 LYS HG3 . 10083 1 668 . 1 1 58 58 LYS HD2 H 1 1.715 0.030 . 2 . . . . 58 LYS HD2 . 10083 1 669 . 1 1 58 58 LYS HD3 H 1 1.625 0.030 . 2 . . . . 58 LYS HD3 . 10083 1 670 . 1 1 58 58 LYS HE2 H 1 2.896 0.030 . 1 . . . . 58 LYS HE2 . 10083 1 671 . 1 1 58 58 LYS HE3 H 1 2.896 0.030 . 1 . . . . 58 LYS HE3 . 10083 1 672 . 1 1 58 58 LYS C C 13 176.102 0.300 . 1 . . . . 58 LYS C . 10083 1 673 . 1 1 58 58 LYS CA C 13 55.653 0.300 . 1 . . . . 58 LYS CA . 10083 1 674 . 1 1 58 58 LYS CB C 13 32.605 0.300 . 1 . . . . 58 LYS CB . 10083 1 675 . 1 1 58 58 LYS CG C 13 24.893 0.300 . 1 . . . . 58 LYS CG . 10083 1 676 . 1 1 58 58 LYS CD C 13 29.099 0.300 . 1 . . . . 58 LYS CD . 10083 1 677 . 1 1 58 58 LYS CE C 13 42.087 0.300 . 1 . . . . 58 LYS CE . 10083 1 678 . 1 1 58 58 LYS N N 15 122.279 0.300 . 1 . . . . 58 LYS N . 10083 1 679 . 1 1 59 59 MET H H 1 8.739 0.030 . 1 . . . . 59 MET H . 10083 1 680 . 1 1 59 59 MET HA H 1 4.744 0.030 . 1 . . . . 59 MET HA . 10083 1 681 . 1 1 59 59 MET HB2 H 1 2.020 0.030 . 1 . . . . 59 MET HB2 . 10083 1 682 . 1 1 59 59 MET HB3 H 1 2.020 0.030 . 1 . . . . 59 MET HB3 . 10083 1 683 . 1 1 59 59 MET HG2 H 1 2.685 0.030 . 2 . . . . 59 MET HG2 . 10083 1 684 . 1 1 59 59 MET HG3 H 1 2.413 0.030 . 2 . . . . 59 MET HG3 . 10083 1 685 . 1 1 59 59 MET HE1 H 1 2.033 0.030 . 1 . . . . 59 MET HE . 10083 1 686 . 1 1 59 59 MET HE2 H 1 2.033 0.030 . 1 . . . . 59 MET HE . 10083 1 687 . 1 1 59 59 MET HE3 H 1 2.033 0.030 . 1 . . . . 59 MET HE . 10083 1 688 . 1 1 59 59 MET C C 13 176.598 0.300 . 1 . . . . 59 MET C . 10083 1 689 . 1 1 59 59 MET CA C 13 55.641 0.300 . 1 . . . . 59 MET CA . 10083 1 690 . 1 1 59 59 MET CB C 13 31.275 0.300 . 1 . . . . 59 MET CB . 10083 1 691 . 1 1 59 59 MET CG C 13 31.645 0.300 . 1 . . . . 59 MET CG . 10083 1 692 . 1 1 59 59 MET CE C 13 16.351 0.300 . 1 . . . . 59 MET CE . 10083 1 693 . 1 1 59 59 MET N N 15 126.166 0.300 . 1 . . . . 59 MET N . 10083 1 694 . 1 1 60 60 THR H H 1 7.983 0.030 . 1 . . . . 60 THR H . 10083 1 695 . 1 1 60 60 THR HA H 1 4.817 0.030 . 1 . . . . 60 THR HA . 10083 1 696 . 1 1 60 60 THR HB H 1 4.718 0.030 . 1 . . . . 60 THR HB . 10083 1 697 . 1 1 60 60 THR HG21 H 1 1.584 0.030 . 1 . . . . 60 THR HG2 . 10083 1 698 . 1 1 60 60 THR HG22 H 1 1.584 0.030 . 1 . . . . 60 THR HG2 . 10083 1 699 . 1 1 60 60 THR HG23 H 1 1.584 0.030 . 1 . . . . 60 THR HG2 . 10083 1 700 . 1 1 60 60 THR C C 13 176.745 0.300 . 1 . . . . 60 THR C . 10083 1 701 . 1 1 60 60 THR CA C 13 60.599 0.300 . 1 . . . . 60 THR CA . 10083 1 702 . 1 1 60 60 THR CB C 13 72.532 0.300 . 1 . . . . 60 THR CB . 10083 1 703 . 1 1 60 60 THR CG2 C 13 22.644 0.300 . 1 . . . . 60 THR CG2 . 10083 1 704 . 1 1 60 60 THR N N 15 117.318 0.300 . 1 . . . . 60 THR N . 10083 1 705 . 1 1 61 61 GLU H H 1 9.303 0.030 . 1 . . . . 61 GLU H . 10083 1 706 . 1 1 61 61 GLU HA H 1 4.101 0.030 . 1 . . . . 61 GLU HA . 10083 1 707 . 1 1 61 61 GLU HB2 H 1 2.118 0.030 . 1 . . . . 61 GLU HB2 . 10083 1 708 . 1 1 61 61 GLU HB3 H 1 2.118 0.030 . 1 . . . . 61 GLU HB3 . 10083 1 709 . 1 1 61 61 GLU HG2 H 1 2.382 0.030 . 1 . . . . 61 GLU HG2 . 10083 1 710 . 1 1 61 61 GLU HG3 H 1 2.382 0.030 . 1 . . . . 61 GLU HG3 . 10083 1 711 . 1 1 61 61 GLU C C 13 177.332 0.300 . 1 . . . . 61 GLU C . 10083 1 712 . 1 1 61 61 GLU CA C 13 59.288 0.300 . 1 . . . . 61 GLU CA . 10083 1 713 . 1 1 61 61 GLU CB C 13 29.173 0.300 . 1 . . . . 61 GLU CB . 10083 1 714 . 1 1 61 61 GLU CG C 13 36.359 0.300 . 1 . . . . 61 GLU CG . 10083 1 715 . 1 1 61 61 GLU N N 15 121.895 0.300 . 1 . . . . 61 GLU N . 10083 1 716 . 1 1 62 62 SER H H 1 8.018 0.030 . 1 . . . . 62 SER H . 10083 1 717 . 1 1 62 62 SER HA H 1 4.385 0.030 . 1 . . . . 62 SER HA . 10083 1 718 . 1 1 62 62 SER HB2 H 1 4.004 0.030 . 2 . . . . 62 SER HB2 . 10083 1 719 . 1 1 62 62 SER HB3 H 1 3.977 0.030 . 2 . . . . 62 SER HB3 . 10083 1 720 . 1 1 62 62 SER C C 13 175.397 0.300 . 1 . . . . 62 SER C . 10083 1 721 . 1 1 62 62 SER CA C 13 58.941 0.300 . 1 . . . . 62 SER CA . 10083 1 722 . 1 1 62 62 SER CB C 13 64.014 0.300 . 1 . . . . 62 SER CB . 10083 1 723 . 1 1 62 62 SER N N 15 111.919 0.300 . 1 . . . . 62 SER N . 10083 1 724 . 1 1 63 63 GLY H H 1 8.195 0.030 . 1 . . . . 63 GLY H . 10083 1 725 . 1 1 63 63 GLY HA2 H 1 4.290 0.030 . 2 . . . . 63 GLY HA2 . 10083 1 726 . 1 1 63 63 GLY HA3 H 1 3.838 0.030 . 2 . . . . 63 GLY HA3 . 10083 1 727 . 1 1 63 63 GLY C C 13 173.384 0.300 . 1 . . . . 63 GLY C . 10083 1 728 . 1 1 63 63 GLY CA C 13 45.499 0.300 . 1 . . . . 63 GLY CA . 10083 1 729 . 1 1 63 63 GLY N N 15 110.422 0.300 . 1 . . . . 63 GLY N . 10083 1 730 . 1 1 64 64 ARG H H 1 7.178 0.030 . 1 . . . . 64 ARG H . 10083 1 731 . 1 1 64 64 ARG HA H 1 4.485 0.030 . 1 . . . . 64 ARG HA . 10083 1 732 . 1 1 64 64 ARG HB2 H 1 1.634 0.030 . 2 . . . . 64 ARG HB2 . 10083 1 733 . 1 1 64 64 ARG HB3 H 1 1.507 0.030 . 2 . . . . 64 ARG HB3 . 10083 1 734 . 1 1 64 64 ARG HG2 H 1 1.511 0.030 . 1 . . . . 64 ARG HG2 . 10083 1 735 . 1 1 64 64 ARG HG3 H 1 1.511 0.030 . 1 . . . . 64 ARG HG3 . 10083 1 736 . 1 1 64 64 ARG HD2 H 1 3.065 0.030 . 2 . . . . 64 ARG HD2 . 10083 1 737 . 1 1 64 64 ARG HD3 H 1 3.023 0.030 . 2 . . . . 64 ARG HD3 . 10083 1 738 . 1 1 64 64 ARG HE H 1 7.020 0.030 . 1 . . . . 64 ARG HE . 10083 1 739 . 1 1 64 64 ARG C C 13 175.837 0.300 . 1 . . . . 64 ARG C . 10083 1 740 . 1 1 64 64 ARG CA C 13 54.718 0.300 . 1 . . . . 64 ARG CA . 10083 1 741 . 1 1 64 64 ARG CB C 13 31.977 0.300 . 1 . . . . 64 ARG CB . 10083 1 742 . 1 1 64 64 ARG CG C 13 27.143 0.300 . 1 . . . . 64 ARG CG . 10083 1 743 . 1 1 64 64 ARG CD C 13 43.408 0.300 . 1 . . . . 64 ARG CD . 10083 1 744 . 1 1 64 64 ARG N N 15 119.155 0.300 . 1 . . . . 64 ARG N . 10083 1 745 . 1 1 64 64 ARG NE N 15 84.295 0.300 . 1 . . . . 64 ARG NE . 10083 1 746 . 1 1 65 65 LEU H H 1 8.556 0.030 . 1 . . . . 65 LEU H . 10083 1 747 . 1 1 65 65 LEU HA H 1 4.692 0.030 . 1 . . . . 65 LEU HA . 10083 1 748 . 1 1 65 65 LEU HB2 H 1 1.503 0.030 . 2 . . . . 65 LEU HB2 . 10083 1 749 . 1 1 65 65 LEU HB3 H 1 1.161 0.030 . 2 . . . . 65 LEU HB3 . 10083 1 750 . 1 1 65 65 LEU HG H 1 1.672 0.030 . 1 . . . . 65 LEU HG . 10083 1 751 . 1 1 65 65 LEU HD11 H 1 0.768 0.030 . 1 . . . . 65 LEU HD1 . 10083 1 752 . 1 1 65 65 LEU HD12 H 1 0.768 0.030 . 1 . . . . 65 LEU HD1 . 10083 1 753 . 1 1 65 65 LEU HD13 H 1 0.768 0.030 . 1 . . . . 65 LEU HD1 . 10083 1 754 . 1 1 65 65 LEU HD21 H 1 0.726 0.030 . 1 . . . . 65 LEU HD2 . 10083 1 755 . 1 1 65 65 LEU HD22 H 1 0.726 0.030 . 1 . . . . 65 LEU HD2 . 10083 1 756 . 1 1 65 65 LEU HD23 H 1 0.726 0.030 . 1 . . . . 65 LEU HD2 . 10083 1 757 . 1 1 65 65 LEU C C 13 176.647 0.300 . 1 . . . . 65 LEU C . 10083 1 758 . 1 1 65 65 LEU CA C 13 54.509 0.300 . 1 . . . . 65 LEU CA . 10083 1 759 . 1 1 65 65 LEU CB C 13 42.764 0.300 . 1 . . . . 65 LEU CB . 10083 1 760 . 1 1 65 65 LEU CG C 13 26.714 0.300 . 1 . . . . 65 LEU CG . 10083 1 761 . 1 1 65 65 LEU CD1 C 13 25.291 0.300 . 2 . . . . 65 LEU CD1 . 10083 1 762 . 1 1 65 65 LEU CD2 C 13 22.824 0.300 . 2 . . . . 65 LEU CD2 . 10083 1 763 . 1 1 65 65 LEU N N 15 124.825 0.300 . 1 . . . . 65 LEU N . 10083 1 764 . 1 1 66 66 CYS H H 1 9.051 0.030 . 1 . . . . 66 CYS H . 10083 1 765 . 1 1 66 66 CYS HA H 1 4.879 0.030 . 1 . . . . 66 CYS HA . 10083 1 766 . 1 1 66 66 CYS HB2 H 1 2.531 0.030 . 2 . . . . 66 CYS HB2 . 10083 1 767 . 1 1 66 66 CYS HB3 H 1 2.396 0.030 . 2 . . . . 66 CYS HB3 . 10083 1 768 . 1 1 66 66 CYS C C 13 171.615 0.300 . 1 . . . . 66 CYS C . 10083 1 769 . 1 1 66 66 CYS CA C 13 57.785 0.300 . 1 . . . . 66 CYS CA . 10083 1 770 . 1 1 66 66 CYS CB C 13 33.728 0.300 . 1 . . . . 66 CYS CB . 10083 1 771 . 1 1 66 66 CYS N N 15 122.080 0.300 . 1 . . . . 66 CYS N . 10083 1 772 . 1 1 67 67 ALA H H 1 9.395 0.030 . 1 . . . . 67 ALA H . 10083 1 773 . 1 1 67 67 ALA HA H 1 5.455 0.030 . 1 . . . . 67 ALA HA . 10083 1 774 . 1 1 67 67 ALA HB1 H 1 1.247 0.030 . 1 . . . . 67 ALA HB . 10083 1 775 . 1 1 67 67 ALA HB2 H 1 1.247 0.030 . 1 . . . . 67 ALA HB . 10083 1 776 . 1 1 67 67 ALA HB3 H 1 1.247 0.030 . 1 . . . . 67 ALA HB . 10083 1 777 . 1 1 67 67 ALA C C 13 176.005 0.300 . 1 . . . . 67 ALA C . 10083 1 778 . 1 1 67 67 ALA CA C 13 49.468 0.300 . 1 . . . . 67 ALA CA . 10083 1 779 . 1 1 67 67 ALA CB C 13 22.002 0.300 . 1 . . . . 67 ALA CB . 10083 1 780 . 1 1 67 67 ALA N N 15 123.123 0.300 . 1 . . . . 67 ALA N . 10083 1 781 . 1 1 68 68 PHE H H 1 8.248 0.030 . 1 . . . . 68 PHE H . 10083 1 782 . 1 1 68 68 PHE HA H 1 5.417 0.030 . 1 . . . . 68 PHE HA . 10083 1 783 . 1 1 68 68 PHE HB2 H 1 2.941 0.030 . 2 . . . . 68 PHE HB2 . 10083 1 784 . 1 1 68 68 PHE HB3 H 1 2.585 0.030 . 2 . . . . 68 PHE HB3 . 10083 1 785 . 1 1 68 68 PHE HD1 H 1 7.105 0.030 . 1 . . . . 68 PHE HD1 . 10083 1 786 . 1 1 68 68 PHE HD2 H 1 7.105 0.030 . 1 . . . . 68 PHE HD2 . 10083 1 787 . 1 1 68 68 PHE HE1 H 1 7.226 0.030 . 1 . . . . 68 PHE HE1 . 10083 1 788 . 1 1 68 68 PHE HE2 H 1 7.226 0.030 . 1 . . . . 68 PHE HE2 . 10083 1 789 . 1 1 68 68 PHE HZ H 1 7.259 0.030 . 1 . . . . 68 PHE HZ . 10083 1 790 . 1 1 68 68 PHE C C 13 175.767 0.300 . 1 . . . . 68 PHE C . 10083 1 791 . 1 1 68 68 PHE CA C 13 56.553 0.300 . 1 . . . . 68 PHE CA . 10083 1 792 . 1 1 68 68 PHE CB C 13 43.933 0.300 . 1 . . . . 68 PHE CB . 10083 1 793 . 1 1 68 68 PHE CD1 C 13 131.938 0.300 . 1 . . . . 68 PHE CD1 . 10083 1 794 . 1 1 68 68 PHE CD2 C 13 131.938 0.300 . 1 . . . . 68 PHE CD2 . 10083 1 795 . 1 1 68 68 PHE CE1 C 13 131.190 0.300 . 1 . . . . 68 PHE CE1 . 10083 1 796 . 1 1 68 68 PHE CE2 C 13 131.190 0.300 . 1 . . . . 68 PHE CE2 . 10083 1 797 . 1 1 68 68 PHE CZ C 13 129.285 0.300 . 1 . . . . 68 PHE CZ . 10083 1 798 . 1 1 68 68 PHE N N 15 116.487 0.300 . 1 . . . . 68 PHE N . 10083 1 799 . 1 1 69 69 ILE H H 1 9.085 0.030 . 1 . . . . 69 ILE H . 10083 1 800 . 1 1 69 69 ILE HA H 1 4.579 0.030 . 1 . . . . 69 ILE HA . 10083 1 801 . 1 1 69 69 ILE HB H 1 2.119 0.030 . 1 . . . . 69 ILE HB . 10083 1 802 . 1 1 69 69 ILE HG12 H 1 1.879 0.030 . 2 . . . . 69 ILE HG12 . 10083 1 803 . 1 1 69 69 ILE HG13 H 1 0.943 0.030 . 2 . . . . 69 ILE HG13 . 10083 1 804 . 1 1 69 69 ILE HG21 H 1 0.744 0.030 . 1 . . . . 69 ILE HG2 . 10083 1 805 . 1 1 69 69 ILE HG22 H 1 0.744 0.030 . 1 . . . . 69 ILE HG2 . 10083 1 806 . 1 1 69 69 ILE HG23 H 1 0.744 0.030 . 1 . . . . 69 ILE HG2 . 10083 1 807 . 1 1 69 69 ILE HD11 H 1 0.948 0.030 . 1 . . . . 69 ILE HD1 . 10083 1 808 . 1 1 69 69 ILE HD12 H 1 0.948 0.030 . 1 . . . . 69 ILE HD1 . 10083 1 809 . 1 1 69 69 ILE HD13 H 1 0.948 0.030 . 1 . . . . 69 ILE HD1 . 10083 1 810 . 1 1 69 69 ILE C C 13 177.647 0.300 . 1 . . . . 69 ILE C . 10083 1 811 . 1 1 69 69 ILE CA C 13 61.981 0.300 . 1 . . . . 69 ILE CA . 10083 1 812 . 1 1 69 69 ILE CB C 13 38.070 0.300 . 1 . . . . 69 ILE CB . 10083 1 813 . 1 1 69 69 ILE CG1 C 13 29.007 0.300 . 1 . . . . 69 ILE CG1 . 10083 1 814 . 1 1 69 69 ILE CG2 C 13 19.444 0.300 . 1 . . . . 69 ILE CG2 . 10083 1 815 . 1 1 69 69 ILE CD1 C 13 15.464 0.300 . 1 . . . . 69 ILE CD1 . 10083 1 816 . 1 1 69 69 ILE N N 15 121.273 0.300 . 1 . . . . 69 ILE N . 10083 1 817 . 1 1 70 70 THR H H 1 9.286 0.030 . 1 . . . . 70 THR H . 10083 1 818 . 1 1 70 70 THR HA H 1 4.698 0.030 . 1 . . . . 70 THR HA . 10083 1 819 . 1 1 70 70 THR HB H 1 4.298 0.030 . 1 . . . . 70 THR HB . 10083 1 820 . 1 1 70 70 THR HG21 H 1 1.186 0.030 . 1 . . . . 70 THR HG2 . 10083 1 821 . 1 1 70 70 THR HG22 H 1 1.186 0.030 . 1 . . . . 70 THR HG2 . 10083 1 822 . 1 1 70 70 THR HG23 H 1 1.186 0.030 . 1 . . . . 70 THR HG2 . 10083 1 823 . 1 1 70 70 THR C C 13 175.137 0.300 . 1 . . . . 70 THR C . 10083 1 824 . 1 1 70 70 THR CA C 13 61.908 0.300 . 1 . . . . 70 THR CA . 10083 1 825 . 1 1 70 70 THR CB C 13 69.005 0.300 . 1 . . . . 70 THR CB . 10083 1 826 . 1 1 70 70 THR CG2 C 13 22.921 0.300 . 1 . . . . 70 THR CG2 . 10083 1 827 . 1 1 70 70 THR N N 15 120.377 0.300 . 1 . . . . 70 THR N . 10083 1 828 . 1 1 71 71 LYS H H 1 7.385 0.030 . 1 . . . . 71 LYS H . 10083 1 829 . 1 1 71 71 LYS HA H 1 4.515 0.030 . 1 . . . . 71 LYS HA . 10083 1 830 . 1 1 71 71 LYS HB2 H 1 1.727 0.030 . 2 . . . . 71 LYS HB2 . 10083 1 831 . 1 1 71 71 LYS HB3 H 1 1.671 0.030 . 2 . . . . 71 LYS HB3 . 10083 1 832 . 1 1 71 71 LYS HG2 H 1 1.431 0.030 . 2 . . . . 71 LYS HG2 . 10083 1 833 . 1 1 71 71 LYS HG3 H 1 1.312 0.030 . 2 . . . . 71 LYS HG3 . 10083 1 834 . 1 1 71 71 LYS HD2 H 1 1.683 0.030 . 2 . . . . 71 LYS HD2 . 10083 1 835 . 1 1 71 71 LYS HD3 H 1 1.630 0.030 . 2 . . . . 71 LYS HD3 . 10083 1 836 . 1 1 71 71 LYS HE2 H 1 2.939 0.030 . 1 . . . . 71 LYS HE2 . 10083 1 837 . 1 1 71 71 LYS HE3 H 1 2.939 0.030 . 1 . . . . 71 LYS HE3 . 10083 1 838 . 1 1 71 71 LYS C C 13 173.901 0.300 . 1 . . . . 71 LYS C . 10083 1 839 . 1 1 71 71 LYS CA C 13 56.358 0.300 . 1 . . . . 71 LYS CA . 10083 1 840 . 1 1 71 71 LYS CB C 13 37.052 0.300 . 1 . . . . 71 LYS CB . 10083 1 841 . 1 1 71 71 LYS CG C 13 25.020 0.300 . 1 . . . . 71 LYS CG . 10083 1 842 . 1 1 71 71 LYS CD C 13 29.289 0.300 . 1 . . . . 71 LYS CD . 10083 1 843 . 1 1 71 71 LYS CE C 13 42.262 0.300 . 1 . . . . 71 LYS CE . 10083 1 844 . 1 1 71 71 LYS N N 15 121.577 0.300 . 1 . . . . 71 LYS N . 10083 1 845 . 1 1 72 72 VAL H H 1 8.568 0.030 . 1 . . . . 72 VAL H . 10083 1 846 . 1 1 72 72 VAL HA H 1 4.424 0.030 . 1 . . . . 72 VAL HA . 10083 1 847 . 1 1 72 72 VAL HB H 1 1.798 0.030 . 1 . . . . 72 VAL HB . 10083 1 848 . 1 1 72 72 VAL HG11 H 1 0.533 0.030 . 1 . . . . 72 VAL HG1 . 10083 1 849 . 1 1 72 72 VAL HG12 H 1 0.533 0.030 . 1 . . . . 72 VAL HG1 . 10083 1 850 . 1 1 72 72 VAL HG13 H 1 0.533 0.030 . 1 . . . . 72 VAL HG1 . 10083 1 851 . 1 1 72 72 VAL HG21 H 1 0.618 0.030 . 1 . . . . 72 VAL HG2 . 10083 1 852 . 1 1 72 72 VAL HG22 H 1 0.618 0.030 . 1 . . . . 72 VAL HG2 . 10083 1 853 . 1 1 72 72 VAL HG23 H 1 0.618 0.030 . 1 . . . . 72 VAL HG2 . 10083 1 854 . 1 1 72 72 VAL C C 13 175.054 0.300 . 1 . . . . 72 VAL C . 10083 1 855 . 1 1 72 72 VAL CA C 13 61.357 0.300 . 1 . . . . 72 VAL CA . 10083 1 856 . 1 1 72 72 VAL CB C 13 35.029 0.300 . 1 . . . . 72 VAL CB . 10083 1 857 . 1 1 72 72 VAL CG1 C 13 21.486 0.300 . 2 . . . . 72 VAL CG1 . 10083 1 858 . 1 1 72 72 VAL CG2 C 13 20.543 0.300 . 2 . . . . 72 VAL CG2 . 10083 1 859 . 1 1 72 72 VAL N N 15 122.680 0.300 . 1 . . . . 72 VAL N . 10083 1 860 . 1 1 73 73 LYS H H 1 9.085 0.030 . 1 . . . . 73 LYS H . 10083 1 861 . 1 1 73 73 LYS HA H 1 4.293 0.030 . 1 . . . . 73 LYS HA . 10083 1 862 . 1 1 73 73 LYS HB2 H 1 1.831 0.030 . 2 . . . . 73 LYS HB2 . 10083 1 863 . 1 1 73 73 LYS HB3 H 1 1.735 0.030 . 2 . . . . 73 LYS HB3 . 10083 1 864 . 1 1 73 73 LYS HG2 H 1 1.483 0.030 . 2 . . . . 73 LYS HG2 . 10083 1 865 . 1 1 73 73 LYS HG3 H 1 1.426 0.030 . 2 . . . . 73 LYS HG3 . 10083 1 866 . 1 1 73 73 LYS HD2 H 1 1.774 0.030 . 2 . . . . 73 LYS HD2 . 10083 1 867 . 1 1 73 73 LYS HD3 H 1 1.709 0.030 . 2 . . . . 73 LYS HD3 . 10083 1 868 . 1 1 73 73 LYS HE2 H 1 3.029 0.030 . 1 . . . . 73 LYS HE2 . 10083 1 869 . 1 1 73 73 LYS HE3 H 1 3.029 0.030 . 1 . . . . 73 LYS HE3 . 10083 1 870 . 1 1 73 73 LYS C C 13 177.465 0.300 . 1 . . . . 73 LYS C . 10083 1 871 . 1 1 73 73 LYS CA C 13 56.130 0.300 . 1 . . . . 73 LYS CA . 10083 1 872 . 1 1 73 73 LYS CB C 13 32.986 0.300 . 1 . . . . 73 LYS CB . 10083 1 873 . 1 1 73 73 LYS CG C 13 24.676 0.300 . 1 . . . . 73 LYS CG . 10083 1 874 . 1 1 73 73 LYS CD C 13 29.320 0.300 . 1 . . . . 73 LYS CD . 10083 1 875 . 1 1 73 73 LYS CE C 13 42.252 0.300 . 1 . . . . 73 LYS CE . 10083 1 876 . 1 1 73 73 LYS N N 15 128.852 0.300 . 1 . . . . 73 LYS N . 10083 1 877 . 1 1 74 74 LYS H H 1 9.259 0.030 . 1 . . . . 74 LYS H . 10083 1 878 . 1 1 74 74 LYS HA H 1 4.155 0.030 . 1 . . . . 74 LYS HA . 10083 1 879 . 1 1 74 74 LYS HB2 H 1 1.884 0.030 . 2 . . . . 74 LYS HB2 . 10083 1 880 . 1 1 74 74 LYS HB3 H 1 1.790 0.030 . 2 . . . . 74 LYS HB3 . 10083 1 881 . 1 1 74 74 LYS HG2 H 1 1.537 0.030 . 2 . . . . 74 LYS HG2 . 10083 1 882 . 1 1 74 74 LYS HG3 H 1 1.439 0.030 . 2 . . . . 74 LYS HG3 . 10083 1 883 . 1 1 74 74 LYS HD2 H 1 1.723 0.030 . 1 . . . . 74 LYS HD2 . 10083 1 884 . 1 1 74 74 LYS HD3 H 1 1.723 0.030 . 1 . . . . 74 LYS HD3 . 10083 1 885 . 1 1 74 74 LYS HE2 H 1 3.029 0.030 . 1 . . . . 74 LYS HE2 . 10083 1 886 . 1 1 74 74 LYS HE3 H 1 3.029 0.030 . 1 . . . . 74 LYS HE3 . 10083 1 887 . 1 1 74 74 LYS C C 13 178.409 0.300 . 1 . . . . 74 LYS C . 10083 1 888 . 1 1 74 74 LYS CA C 13 57.842 0.300 . 1 . . . . 74 LYS CA . 10083 1 889 . 1 1 74 74 LYS CB C 13 31.672 0.300 . 1 . . . . 74 LYS CB . 10083 1 890 . 1 1 74 74 LYS CG C 13 24.538 0.300 . 1 . . . . 74 LYS CG . 10083 1 891 . 1 1 74 74 LYS CD C 13 28.885 0.300 . 1 . . . . 74 LYS CD . 10083 1 892 . 1 1 74 74 LYS CE C 13 42.109 0.300 . 1 . . . . 74 LYS CE . 10083 1 893 . 1 1 74 74 LYS N N 15 133.879 0.300 . 1 . . . . 74 LYS N . 10083 1 894 . 1 1 75 75 GLY H H 1 10.857 0.030 . 1 . . . . 75 GLY H . 10083 1 895 . 1 1 75 75 GLY HA2 H 1 4.334 0.030 . 2 . . . . 75 GLY HA2 . 10083 1 896 . 1 1 75 75 GLY HA3 H 1 3.615 0.030 . 2 . . . . 75 GLY HA3 . 10083 1 897 . 1 1 75 75 GLY C C 13 174.215 0.300 . 1 . . . . 75 GLY C . 10083 1 898 . 1 1 75 75 GLY CA C 13 45.551 0.300 . 1 . . . . 75 GLY CA . 10083 1 899 . 1 1 75 75 GLY N N 15 116.862 0.300 . 1 . . . . 75 GLY N . 10083 1 900 . 1 1 76 76 SER H H 1 7.865 0.030 . 1 . . . . 76 SER H . 10083 1 901 . 1 1 76 76 SER HA H 1 4.657 0.030 . 1 . . . . 76 SER HA . 10083 1 902 . 1 1 76 76 SER HB2 H 1 4.252 0.030 . 2 . . . . 76 SER HB2 . 10083 1 903 . 1 1 76 76 SER HB3 H 1 3.783 0.030 . 2 . . . . 76 SER HB3 . 10083 1 904 . 1 1 76 76 SER C C 13 175.298 0.300 . 1 . . . . 76 SER C . 10083 1 905 . 1 1 76 76 SER CA C 13 58.232 0.300 . 1 . . . . 76 SER CA . 10083 1 906 . 1 1 76 76 SER CB C 13 65.802 0.300 . 1 . . . . 76 SER CB . 10083 1 907 . 1 1 76 76 SER N N 15 116.081 0.300 . 1 . . . . 76 SER N . 10083 1 908 . 1 1 77 77 LEU H H 1 8.935 0.030 . 1 . . . . 77 LEU H . 10083 1 909 . 1 1 77 77 LEU HA H 1 4.180 0.030 . 1 . . . . 77 LEU HA . 10083 1 910 . 1 1 77 77 LEU HB2 H 1 1.833 0.030 . 2 . . . . 77 LEU HB2 . 10083 1 911 . 1 1 77 77 LEU HB3 H 1 1.427 0.030 . 2 . . . . 77 LEU HB3 . 10083 1 912 . 1 1 77 77 LEU HG H 1 1.790 0.030 . 1 . . . . 77 LEU HG . 10083 1 913 . 1 1 77 77 LEU HD11 H 1 0.887 0.030 . 1 . . . . 77 LEU HD1 . 10083 1 914 . 1 1 77 77 LEU HD12 H 1 0.887 0.030 . 1 . . . . 77 LEU HD1 . 10083 1 915 . 1 1 77 77 LEU HD13 H 1 0.887 0.030 . 1 . . . . 77 LEU HD1 . 10083 1 916 . 1 1 77 77 LEU HD21 H 1 0.902 0.030 . 1 . . . . 77 LEU HD2 . 10083 1 917 . 1 1 77 77 LEU HD22 H 1 0.902 0.030 . 1 . . . . 77 LEU HD2 . 10083 1 918 . 1 1 77 77 LEU HD23 H 1 0.902 0.030 . 1 . . . . 77 LEU HD2 . 10083 1 919 . 1 1 77 77 LEU C C 13 179.393 0.300 . 1 . . . . 77 LEU C . 10083 1 920 . 1 1 77 77 LEU CA C 13 58.398 0.300 . 1 . . . . 77 LEU CA . 10083 1 921 . 1 1 77 77 LEU CB C 13 43.083 0.300 . 1 . . . . 77 LEU CB . 10083 1 922 . 1 1 77 77 LEU CG C 13 27.136 0.300 . 1 . . . . 77 LEU CG . 10083 1 923 . 1 1 77 77 LEU CD1 C 13 25.907 0.300 . 2 . . . . 77 LEU CD1 . 10083 1 924 . 1 1 77 77 LEU CD2 C 13 23.330 0.300 . 2 . . . . 77 LEU CD2 . 10083 1 925 . 1 1 77 77 LEU N N 15 121.262 0.300 . 1 . . . . 77 LEU N . 10083 1 926 . 1 1 78 78 ALA H H 1 8.342 0.030 . 1 . . . . 78 ALA H . 10083 1 927 . 1 1 78 78 ALA HA H 1 3.704 0.030 . 1 . . . . 78 ALA HA . 10083 1 928 . 1 1 78 78 ALA HB1 H 1 1.403 0.030 . 1 . . . . 78 ALA HB . 10083 1 929 . 1 1 78 78 ALA HB2 H 1 1.403 0.030 . 1 . . . . 78 ALA HB . 10083 1 930 . 1 1 78 78 ALA HB3 H 1 1.403 0.030 . 1 . . . . 78 ALA HB . 10083 1 931 . 1 1 78 78 ALA C C 13 176.690 0.300 . 1 . . . . 78 ALA C . 10083 1 932 . 1 1 78 78 ALA CA C 13 55.730 0.300 . 1 . . . . 78 ALA CA . 10083 1 933 . 1 1 78 78 ALA CB C 13 19.728 0.300 . 1 . . . . 78 ALA CB . 10083 1 934 . 1 1 78 78 ALA N N 15 118.884 0.300 . 1 . . . . 78 ALA N . 10083 1 935 . 1 1 79 79 ASP H H 1 7.148 0.030 . 1 . . . . 79 ASP H . 10083 1 936 . 1 1 79 79 ASP HA H 1 4.461 0.030 . 1 . . . . 79 ASP HA . 10083 1 937 . 1 1 79 79 ASP HB2 H 1 3.043 0.030 . 2 . . . . 79 ASP HB2 . 10083 1 938 . 1 1 79 79 ASP HB3 H 1 2.726 0.030 . 2 . . . . 79 ASP HB3 . 10083 1 939 . 1 1 79 79 ASP C C 13 176.850 0.300 . 1 . . . . 79 ASP C . 10083 1 940 . 1 1 79 79 ASP CA C 13 56.517 0.300 . 1 . . . . 79 ASP CA . 10083 1 941 . 1 1 79 79 ASP CB C 13 43.757 0.300 . 1 . . . . 79 ASP CB . 10083 1 942 . 1 1 79 79 ASP N N 15 114.375 0.300 . 1 . . . . 79 ASP N . 10083 1 943 . 1 1 80 80 THR H H 1 8.821 0.030 . 1 . . . . 80 THR H . 10083 1 944 . 1 1 80 80 THR HA H 1 3.788 0.030 . 1 . . . . 80 THR HA . 10083 1 945 . 1 1 80 80 THR HB H 1 4.190 0.030 . 1 . . . . 80 THR HB . 10083 1 946 . 1 1 80 80 THR HG21 H 1 1.258 0.030 . 1 . . . . 80 THR HG2 . 10083 1 947 . 1 1 80 80 THR HG22 H 1 1.258 0.030 . 1 . . . . 80 THR HG2 . 10083 1 948 . 1 1 80 80 THR HG23 H 1 1.258 0.030 . 1 . . . . 80 THR HG2 . 10083 1 949 . 1 1 80 80 THR C C 13 175.348 0.300 . 1 . . . . 80 THR C . 10083 1 950 . 1 1 80 80 THR CA C 13 65.100 0.300 . 1 . . . . 80 THR CA . 10083 1 951 . 1 1 80 80 THR CB C 13 69.218 0.300 . 1 . . . . 80 THR CB . 10083 1 952 . 1 1 80 80 THR CG2 C 13 22.198 0.300 . 1 . . . . 80 THR CG2 . 10083 1 953 . 1 1 80 80 THR N N 15 108.315 0.300 . 1 . . . . 80 THR N . 10083 1 954 . 1 1 81 81 VAL H H 1 8.058 0.030 . 1 . . . . 81 VAL H . 10083 1 955 . 1 1 81 81 VAL HA H 1 4.012 0.030 . 1 . . . . 81 VAL HA . 10083 1 956 . 1 1 81 81 VAL HB H 1 2.030 0.030 . 1 . . . . 81 VAL HB . 10083 1 957 . 1 1 81 81 VAL HG11 H 1 0.991 0.030 . 1 . . . . 81 VAL HG1 . 10083 1 958 . 1 1 81 81 VAL HG12 H 1 0.991 0.030 . 1 . . . . 81 VAL HG1 . 10083 1 959 . 1 1 81 81 VAL HG13 H 1 0.991 0.030 . 1 . . . . 81 VAL HG1 . 10083 1 960 . 1 1 81 81 VAL HG21 H 1 0.859 0.030 . 1 . . . . 81 VAL HG2 . 10083 1 961 . 1 1 81 81 VAL HG22 H 1 0.859 0.030 . 1 . . . . 81 VAL HG2 . 10083 1 962 . 1 1 81 81 VAL HG23 H 1 0.859 0.030 . 1 . . . . 81 VAL HG2 . 10083 1 963 . 1 1 81 81 VAL C C 13 177.416 0.300 . 1 . . . . 81 VAL C . 10083 1 964 . 1 1 81 81 VAL CA C 13 63.938 0.300 . 1 . . . . 81 VAL CA . 10083 1 965 . 1 1 81 81 VAL CB C 13 32.228 0.300 . 1 . . . . 81 VAL CB . 10083 1 966 . 1 1 81 81 VAL CG1 C 13 22.055 0.300 . 2 . . . . 81 VAL CG1 . 10083 1 967 . 1 1 81 81 VAL CG2 C 13 21.119 0.300 . 2 . . . . 81 VAL CG2 . 10083 1 968 . 1 1 81 81 VAL N N 15 119.719 0.300 . 1 . . . . 81 VAL N . 10083 1 969 . 1 1 82 82 GLY H H 1 7.441 0.030 . 1 . . . . 82 GLY H . 10083 1 970 . 1 1 82 82 GLY HA2 H 1 3.844 0.030 . 2 . . . . 82 GLY HA2 . 10083 1 971 . 1 1 82 82 GLY HA3 H 1 3.340 0.030 . 2 . . . . 82 GLY HA3 . 10083 1 972 . 1 1 82 82 GLY C C 13 172.559 0.300 . 1 . . . . 82 GLY C . 10083 1 973 . 1 1 82 82 GLY CA C 13 47.406 0.300 . 1 . . . . 82 GLY CA . 10083 1 974 . 1 1 82 82 GLY N N 15 101.235 0.300 . 1 . . . . 82 GLY N . 10083 1 975 . 1 1 83 83 HIS H H 1 7.296 0.030 . 1 . . . . 83 HIS H . 10083 1 976 . 1 1 83 83 HIS HA H 1 4.876 0.030 . 1 . . . . 83 HIS HA . 10083 1 977 . 1 1 83 83 HIS HB2 H 1 3.543 0.030 . 2 . . . . 83 HIS HB2 . 10083 1 978 . 1 1 83 83 HIS HB3 H 1 3.308 0.030 . 2 . . . . 83 HIS HB3 . 10083 1 979 . 1 1 83 83 HIS HD2 H 1 7.150 0.030 . 1 . . . . 83 HIS HD2 . 10083 1 980 . 1 1 83 83 HIS HE1 H 1 8.500 0.030 . 1 . . . . 83 HIS HE1 . 10083 1 981 . 1 1 83 83 HIS C C 13 175.816 0.300 . 1 . . . . 83 HIS C . 10083 1 982 . 1 1 83 83 HIS CA C 13 55.693 0.300 . 1 . . . . 83 HIS CA . 10083 1 983 . 1 1 83 83 HIS CB C 13 26.572 0.300 . 1 . . . . 83 HIS CB . 10083 1 984 . 1 1 83 83 HIS CD2 C 13 120.069 0.300 . 1 . . . . 83 HIS CD2 . 10083 1 985 . 1 1 83 83 HIS CE1 C 13 136.048 0.300 . 1 . . . . 83 HIS CE1 . 10083 1 986 . 1 1 83 83 HIS N N 15 113.794 0.300 . 1 . . . . 83 HIS N . 10083 1 987 . 1 1 84 84 LEU H H 1 7.865 0.030 . 1 . . . . 84 LEU H . 10083 1 988 . 1 1 84 84 LEU HA H 1 4.213 0.030 . 1 . . . . 84 LEU HA . 10083 1 989 . 1 1 84 84 LEU HB2 H 1 1.508 0.030 . 2 . . . . 84 LEU HB2 . 10083 1 990 . 1 1 84 84 LEU HB3 H 1 1.429 0.030 . 2 . . . . 84 LEU HB3 . 10083 1 991 . 1 1 84 84 LEU HG H 1 1.694 0.030 . 1 . . . . 84 LEU HG . 10083 1 992 . 1 1 84 84 LEU HD11 H 1 0.892 0.030 . 1 . . . . 84 LEU HD1 . 10083 1 993 . 1 1 84 84 LEU HD12 H 1 0.892 0.030 . 1 . . . . 84 LEU HD1 . 10083 1 994 . 1 1 84 84 LEU HD13 H 1 0.892 0.030 . 1 . . . . 84 LEU HD1 . 10083 1 995 . 1 1 84 84 LEU HD21 H 1 1.063 0.030 . 1 . . . . 84 LEU HD2 . 10083 1 996 . 1 1 84 84 LEU HD22 H 1 1.063 0.030 . 1 . . . . 84 LEU HD2 . 10083 1 997 . 1 1 84 84 LEU HD23 H 1 1.063 0.030 . 1 . . . . 84 LEU HD2 . 10083 1 998 . 1 1 84 84 LEU C C 13 175.466 0.300 . 1 . . . . 84 LEU C . 10083 1 999 . 1 1 84 84 LEU CA C 13 54.802 0.300 . 1 . . . . 84 LEU CA . 10083 1 1000 . 1 1 84 84 LEU CB C 13 42.683 0.300 . 1 . . . . 84 LEU CB . 10083 1 1001 . 1 1 84 84 LEU CG C 13 27.528 0.300 . 1 . . . . 84 LEU CG . 10083 1 1002 . 1 1 84 84 LEU CD1 C 13 26.131 0.300 . 2 . . . . 84 LEU CD1 . 10083 1 1003 . 1 1 84 84 LEU CD2 C 13 23.691 0.300 . 2 . . . . 84 LEU CD2 . 10083 1 1004 . 1 1 84 84 LEU N N 15 117.192 0.300 . 1 . . . . 84 LEU N . 10083 1 1005 . 1 1 85 85 ARG H H 1 8.802 0.030 . 1 . . . . 85 ARG H . 10083 1 1006 . 1 1 85 85 ARG HA H 1 4.899 0.030 . 1 . . . . 85 ARG HA . 10083 1 1007 . 1 1 85 85 ARG HB2 H 1 1.728 0.030 . 2 . . . . 85 ARG HB2 . 10083 1 1008 . 1 1 85 85 ARG HB3 H 1 1.657 0.030 . 2 . . . . 85 ARG HB3 . 10083 1 1009 . 1 1 85 85 ARG HG2 H 1 1.683 0.030 . 2 . . . . 85 ARG HG2 . 10083 1 1010 . 1 1 85 85 ARG HG3 H 1 1.535 0.030 . 2 . . . . 85 ARG HG3 . 10083 1 1011 . 1 1 85 85 ARG HD2 H 1 3.094 0.030 . 2 . . . . 85 ARG HD2 . 10083 1 1012 . 1 1 85 85 ARG HD3 H 1 3.000 0.030 . 2 . . . . 85 ARG HD3 . 10083 1 1013 . 1 1 85 85 ARG HE H 1 7.186 0.030 . 1 . . . . 85 ARG HE . 10083 1 1014 . 1 1 85 85 ARG C C 13 172.783 0.300 . 1 . . . . 85 ARG C . 10083 1 1015 . 1 1 85 85 ARG CA C 13 53.247 0.300 . 1 . . . . 85 ARG CA . 10083 1 1016 . 1 1 85 85 ARG CB C 13 32.945 0.300 . 1 . . . . 85 ARG CB . 10083 1 1017 . 1 1 85 85 ARG CG C 13 26.458 0.300 . 1 . . . . 85 ARG CG . 10083 1 1018 . 1 1 85 85 ARG CD C 13 44.103 0.300 . 1 . . . . 85 ARG CD . 10083 1 1019 . 1 1 85 85 ARG N N 15 118.809 0.300 . 1 . . . . 85 ARG N . 10083 1 1020 . 1 1 86 86 PRO HA H 1 4.020 0.030 . 1 . . . . 86 PRO HA . 10083 1 1021 . 1 1 86 86 PRO HB2 H 1 2.085 0.030 . 2 . . . . 86 PRO HB2 . 10083 1 1022 . 1 1 86 86 PRO HB3 H 1 1.888 0.030 . 2 . . . . 86 PRO HB3 . 10083 1 1023 . 1 1 86 86 PRO HG2 H 1 2.269 0.030 . 2 . . . . 86 PRO HG2 . 10083 1 1024 . 1 1 86 86 PRO HG3 H 1 1.655 0.030 . 2 . . . . 86 PRO HG3 . 10083 1 1025 . 1 1 86 86 PRO HD2 H 1 3.650 0.030 . 2 . . . . 86 PRO HD2 . 10083 1 1026 . 1 1 86 86 PRO HD3 H 1 3.611 0.030 . 2 . . . . 86 PRO HD3 . 10083 1 1027 . 1 1 86 86 PRO C C 13 177.433 0.300 . 1 . . . . 86 PRO C . 10083 1 1028 . 1 1 86 86 PRO CA C 13 63.221 0.300 . 1 . . . . 86 PRO CA . 10083 1 1029 . 1 1 86 86 PRO CB C 13 31.267 0.300 . 1 . . . . 86 PRO CB . 10083 1 1030 . 1 1 86 86 PRO CG C 13 28.942 0.300 . 1 . . . . 86 PRO CG . 10083 1 1031 . 1 1 86 86 PRO CD C 13 50.933 0.300 . 1 . . . . 86 PRO CD . 10083 1 1032 . 1 1 87 87 GLY H H 1 9.276 0.030 . 1 . . . . 87 GLY H . 10083 1 1033 . 1 1 87 87 GLY HA2 H 1 4.571 0.030 . 2 . . . . 87 GLY HA2 . 10083 1 1034 . 1 1 87 87 GLY HA3 H 1 3.617 0.030 . 2 . . . . 87 GLY HA3 . 10083 1 1035 . 1 1 87 87 GLY C C 13 175.052 0.300 . 1 . . . . 87 GLY C . 10083 1 1036 . 1 1 87 87 GLY CA C 13 44.805 0.300 . 1 . . . . 87 GLY CA . 10083 1 1037 . 1 1 87 87 GLY N N 15 114.260 0.300 . 1 . . . . 87 GLY N . 10083 1 1038 . 1 1 88 88 ASP H H 1 8.014 0.030 . 1 . . . . 88 ASP H . 10083 1 1039 . 1 1 88 88 ASP HA H 1 4.849 0.030 . 1 . . . . 88 ASP HA . 10083 1 1040 . 1 1 88 88 ASP HB2 H 1 2.928 0.030 . 2 . . . . 88 ASP HB2 . 10083 1 1041 . 1 1 88 88 ASP HB3 H 1 2.521 0.030 . 2 . . . . 88 ASP HB3 . 10083 1 1042 . 1 1 88 88 ASP C C 13 175.194 0.300 . 1 . . . . 88 ASP C . 10083 1 1043 . 1 1 88 88 ASP CA C 13 56.441 0.300 . 1 . . . . 88 ASP CA . 10083 1 1044 . 1 1 88 88 ASP CB C 13 41.203 0.300 . 1 . . . . 88 ASP CB . 10083 1 1045 . 1 1 88 88 ASP N N 15 123.596 0.300 . 1 . . . . 88 ASP N . 10083 1 1046 . 1 1 89 89 GLU H H 1 9.047 0.030 . 1 . . . . 89 GLU H . 10083 1 1047 . 1 1 89 89 GLU HA H 1 4.708 0.030 . 1 . . . . 89 GLU HA . 10083 1 1048 . 1 1 89 89 GLU HB2 H 1 2.152 0.030 . 2 . . . . 89 GLU HB2 . 10083 1 1049 . 1 1 89 89 GLU HB3 H 1 1.930 0.030 . 2 . . . . 89 GLU HB3 . 10083 1 1050 . 1 1 89 89 GLU HG2 H 1 1.973 0.030 . 2 . . . . 89 GLU HG2 . 10083 1 1051 . 1 1 89 89 GLU HG3 H 1 1.723 0.030 . 2 . . . . 89 GLU HG3 . 10083 1 1052 . 1 1 89 89 GLU C C 13 176.500 0.300 . 1 . . . . 89 GLU C . 10083 1 1053 . 1 1 89 89 GLU CA C 13 54.717 0.300 . 1 . . . . 89 GLU CA . 10083 1 1054 . 1 1 89 89 GLU CB C 13 31.178 0.300 . 1 . . . . 89 GLU CB . 10083 1 1055 . 1 1 89 89 GLU CG C 13 35.733 0.300 . 1 . . . . 89 GLU CG . 10083 1 1056 . 1 1 89 89 GLU N N 15 125.583 0.300 . 1 . . . . 89 GLU N . 10083 1 1057 . 1 1 90 90 VAL H H 1 8.672 0.030 . 1 . . . . 90 VAL H . 10083 1 1058 . 1 1 90 90 VAL HA H 1 4.387 0.030 . 1 . . . . 90 VAL HA . 10083 1 1059 . 1 1 90 90 VAL HB H 1 1.885 0.030 . 1 . . . . 90 VAL HB . 10083 1 1060 . 1 1 90 90 VAL HG11 H 1 1.045 0.030 . 1 . . . . 90 VAL HG1 . 10083 1 1061 . 1 1 90 90 VAL HG12 H 1 1.045 0.030 . 1 . . . . 90 VAL HG1 . 10083 1 1062 . 1 1 90 90 VAL HG13 H 1 1.045 0.030 . 1 . . . . 90 VAL HG1 . 10083 1 1063 . 1 1 90 90 VAL HG21 H 1 0.922 0.030 . 1 . . . . 90 VAL HG2 . 10083 1 1064 . 1 1 90 90 VAL HG22 H 1 0.922 0.030 . 1 . . . . 90 VAL HG2 . 10083 1 1065 . 1 1 90 90 VAL HG23 H 1 0.922 0.030 . 1 . . . . 90 VAL HG2 . 10083 1 1066 . 1 1 90 90 VAL C C 13 174.704 0.300 . 1 . . . . 90 VAL C . 10083 1 1067 . 1 1 90 90 VAL CA C 13 61.982 0.300 . 1 . . . . 90 VAL CA . 10083 1 1068 . 1 1 90 90 VAL CB C 13 31.509 0.300 . 1 . . . . 90 VAL CB . 10083 1 1069 . 1 1 90 90 VAL CG1 C 13 24.190 0.300 . 2 . . . . 90 VAL CG1 . 10083 1 1070 . 1 1 90 90 VAL CG2 C 13 22.059 0.300 . 2 . . . . 90 VAL CG2 . 10083 1 1071 . 1 1 90 90 VAL N N 15 126.661 0.300 . 1 . . . . 90 VAL N . 10083 1 1072 . 1 1 91 91 LEU H H 1 9.245 0.030 . 1 . . . . 91 LEU H . 10083 1 1073 . 1 1 91 91 LEU HA H 1 4.354 0.030 . 1 . . . . 91 LEU HA . 10083 1 1074 . 1 1 91 91 LEU HB2 H 1 1.527 0.030 . 1 . . . . 91 LEU HB2 . 10083 1 1075 . 1 1 91 91 LEU HB3 H 1 1.527 0.030 . 1 . . . . 91 LEU HB3 . 10083 1 1076 . 1 1 91 91 LEU HG H 1 1.474 0.030 . 1 . . . . 91 LEU HG . 10083 1 1077 . 1 1 91 91 LEU HD11 H 1 0.814 0.030 . 1 . . . . 91 LEU HD1 . 10083 1 1078 . 1 1 91 91 LEU HD12 H 1 0.814 0.030 . 1 . . . . 91 LEU HD1 . 10083 1 1079 . 1 1 91 91 LEU HD13 H 1 0.814 0.030 . 1 . . . . 91 LEU HD1 . 10083 1 1080 . 1 1 91 91 LEU HD21 H 1 0.744 0.030 . 1 . . . . 91 LEU HD2 . 10083 1 1081 . 1 1 91 91 LEU HD22 H 1 0.744 0.030 . 1 . . . . 91 LEU HD2 . 10083 1 1082 . 1 1 91 91 LEU HD23 H 1 0.744 0.030 . 1 . . . . 91 LEU HD2 . 10083 1 1083 . 1 1 91 91 LEU C C 13 178.409 0.300 . 1 . . . . 91 LEU C . 10083 1 1084 . 1 1 91 91 LEU CA C 13 56.800 0.300 . 1 . . . . 91 LEU CA . 10083 1 1085 . 1 1 91 91 LEU CB C 13 42.760 0.300 . 1 . . . . 91 LEU CB . 10083 1 1086 . 1 1 91 91 LEU CG C 13 27.683 0.300 . 1 . . . . 91 LEU CG . 10083 1 1087 . 1 1 91 91 LEU CD1 C 13 25.707 0.300 . 2 . . . . 91 LEU CD1 . 10083 1 1088 . 1 1 91 91 LEU CD2 C 13 23.145 0.300 . 2 . . . . 91 LEU CD2 . 10083 1 1089 . 1 1 91 91 LEU N N 15 126.956 0.300 . 1 . . . . 91 LEU N . 10083 1 1090 . 1 1 92 92 GLU H H 1 7.793 0.030 . 1 . . . . 92 GLU H . 10083 1 1091 . 1 1 92 92 GLU HA H 1 5.308 0.030 . 1 . . . . 92 GLU HA . 10083 1 1092 . 1 1 92 92 GLU HB2 H 1 1.756 0.030 . 1 . . . . 92 GLU HB2 . 10083 1 1093 . 1 1 92 92 GLU HB3 H 1 1.756 0.030 . 1 . . . . 92 GLU HB3 . 10083 1 1094 . 1 1 92 92 GLU HG2 H 1 2.038 0.030 . 2 . . . . 92 GLU HG2 . 10083 1 1095 . 1 1 92 92 GLU HG3 H 1 1.896 0.030 . 2 . . . . 92 GLU HG3 . 10083 1 1096 . 1 1 92 92 GLU C C 13 173.803 0.300 . 1 . . . . 92 GLU C . 10083 1 1097 . 1 1 92 92 GLU CA C 13 54.958 0.300 . 1 . . . . 92 GLU CA . 10083 1 1098 . 1 1 92 92 GLU CB C 13 35.471 0.300 . 1 . . . . 92 GLU CB . 10083 1 1099 . 1 1 92 92 GLU CG C 13 36.200 0.300 . 1 . . . . 92 GLU CG . 10083 1 1100 . 1 1 92 92 GLU N N 15 116.233 0.300 . 1 . . . . 92 GLU N . 10083 1 1101 . 1 1 93 93 TRP H H 1 8.769 0.030 . 1 . . . . 93 TRP H . 10083 1 1102 . 1 1 93 93 TRP HA H 1 4.683 0.030 . 1 . . . . 93 TRP HA . 10083 1 1103 . 1 1 93 93 TRP HB2 H 1 3.224 0.030 . 2 . . . . 93 TRP HB2 . 10083 1 1104 . 1 1 93 93 TRP HB3 H 1 2.722 0.030 . 2 . . . . 93 TRP HB3 . 10083 1 1105 . 1 1 93 93 TRP HD1 H 1 6.840 0.030 . 1 . . . . 93 TRP HD1 . 10083 1 1106 . 1 1 93 93 TRP HE1 H 1 9.899 0.030 . 1 . . . . 93 TRP HE1 . 10083 1 1107 . 1 1 93 93 TRP HE3 H 1 7.235 0.030 . 1 . . . . 93 TRP HE3 . 10083 1 1108 . 1 1 93 93 TRP HZ2 H 1 7.337 0.030 . 1 . . . . 93 TRP HZ2 . 10083 1 1109 . 1 1 93 93 TRP HZ3 H 1 6.694 0.030 . 1 . . . . 93 TRP HZ3 . 10083 1 1110 . 1 1 93 93 TRP HH2 H 1 6.949 0.030 . 1 . . . . 93 TRP HH2 . 10083 1 1111 . 1 1 93 93 TRP C C 13 175.439 0.300 . 1 . . . . 93 TRP C . 10083 1 1112 . 1 1 93 93 TRP CA C 13 56.173 0.300 . 1 . . . . 93 TRP CA . 10083 1 1113 . 1 1 93 93 TRP CB C 13 31.424 0.300 . 1 . . . . 93 TRP CB . 10083 1 1114 . 1 1 93 93 TRP CD1 C 13 125.623 0.300 . 1 . . . . 93 TRP CD1 . 10083 1 1115 . 1 1 93 93 TRP CE3 C 13 119.791 0.300 . 1 . . . . 93 TRP CE3 . 10083 1 1116 . 1 1 93 93 TRP CZ2 C 13 114.844 0.300 . 1 . . . . 93 TRP CZ2 . 10083 1 1117 . 1 1 93 93 TRP CZ3 C 13 121.032 0.300 . 1 . . . . 93 TRP CZ3 . 10083 1 1118 . 1 1 93 93 TRP CH2 C 13 123.623 0.300 . 1 . . . . 93 TRP CH2 . 10083 1 1119 . 1 1 93 93 TRP N N 15 123.686 0.300 . 1 . . . . 93 TRP N . 10083 1 1120 . 1 1 93 93 TRP NE1 N 15 127.549 0.300 . 1 . . . . 93 TRP NE1 . 10083 1 1121 . 1 1 94 94 ASN H H 1 9.438 0.030 . 1 . . . . 94 ASN H . 10083 1 1122 . 1 1 94 94 ASN HA H 1 4.565 0.030 . 1 . . . . 94 ASN HA . 10083 1 1123 . 1 1 94 94 ASN HB2 H 1 3.485 0.030 . 2 . . . . 94 ASN HB2 . 10083 1 1124 . 1 1 94 94 ASN HB3 H 1 2.698 0.030 . 2 . . . . 94 ASN HB3 . 10083 1 1125 . 1 1 94 94 ASN HD21 H 1 8.244 0.030 . 2 . . . . 94 ASN HD21 . 10083 1 1126 . 1 1 94 94 ASN HD22 H 1 6.909 0.030 . 2 . . . . 94 ASN HD22 . 10083 1 1127 . 1 1 94 94 ASN C C 13 175.704 0.300 . 1 . . . . 94 ASN C . 10083 1 1128 . 1 1 94 94 ASN CA C 13 53.858 0.300 . 1 . . . . 94 ASN CA . 10083 1 1129 . 1 1 94 94 ASN CB C 13 37.748 0.300 . 1 . . . . 94 ASN CB . 10083 1 1130 . 1 1 94 94 ASN N N 15 128.827 0.300 . 1 . . . . 94 ASN N . 10083 1 1131 . 1 1 94 94 ASN ND2 N 15 109.808 0.300 . 1 . . . . 94 ASN ND2 . 10083 1 1132 . 1 1 95 95 GLY H H 1 9.216 0.030 . 1 . . . . 95 GLY H . 10083 1 1133 . 1 1 95 95 GLY HA2 H 1 4.057 0.030 . 2 . . . . 95 GLY HA2 . 10083 1 1134 . 1 1 95 95 GLY HA3 H 1 3.732 0.030 . 2 . . . . 95 GLY HA3 . 10083 1 1135 . 1 1 95 95 GLY C C 13 174.048 0.300 . 1 . . . . 95 GLY C . 10083 1 1136 . 1 1 95 95 GLY CA C 13 45.418 0.300 . 1 . . . . 95 GLY CA . 10083 1 1137 . 1 1 95 95 GLY N N 15 104.028 0.300 . 1 . . . . 95 GLY N . 10083 1 1138 . 1 1 96 96 ARG H H 1 7.808 0.030 . 1 . . . . 96 ARG H . 10083 1 1139 . 1 1 96 96 ARG HA H 1 4.575 0.030 . 1 . . . . 96 ARG HA . 10083 1 1140 . 1 1 96 96 ARG HB2 H 1 2.118 0.030 . 2 . . . . 96 ARG HB2 . 10083 1 1141 . 1 1 96 96 ARG HB3 H 1 1.801 0.030 . 2 . . . . 96 ARG HB3 . 10083 1 1142 . 1 1 96 96 ARG HG2 H 1 1.833 0.030 . 2 . . . . 96 ARG HG2 . 10083 1 1143 . 1 1 96 96 ARG HG3 H 1 1.681 0.030 . 2 . . . . 96 ARG HG3 . 10083 1 1144 . 1 1 96 96 ARG HD2 H 1 3.271 0.030 . 1 . . . . 96 ARG HD2 . 10083 1 1145 . 1 1 96 96 ARG HD3 H 1 3.271 0.030 . 1 . . . . 96 ARG HD3 . 10083 1 1146 . 1 1 96 96 ARG HE H 1 7.363 0.030 . 1 . . . . 96 ARG HE . 10083 1 1147 . 1 1 96 96 ARG C C 13 175.529 0.300 . 1 . . . . 96 ARG C . 10083 1 1148 . 1 1 96 96 ARG CA C 13 54.275 0.300 . 1 . . . . 96 ARG CA . 10083 1 1149 . 1 1 96 96 ARG CB C 13 30.620 0.300 . 1 . . . . 96 ARG CB . 10083 1 1150 . 1 1 96 96 ARG CG C 13 27.058 0.300 . 1 . . . . 96 ARG CG . 10083 1 1151 . 1 1 96 96 ARG CD C 13 42.997 0.300 . 1 . . . . 96 ARG CD . 10083 1 1152 . 1 1 96 96 ARG N N 15 120.573 0.300 . 1 . . . . 96 ARG N . 10083 1 1153 . 1 1 96 96 ARG NE N 15 84.396 0.300 . 1 . . . . 96 ARG NE . 10083 1 1154 . 1 1 97 97 LEU H H 1 8.551 0.030 . 1 . . . . 97 LEU H . 10083 1 1155 . 1 1 97 97 LEU HA H 1 4.506 0.030 . 1 . . . . 97 LEU HA . 10083 1 1156 . 1 1 97 97 LEU HB2 H 1 1.818 0.030 . 2 . . . . 97 LEU HB2 . 10083 1 1157 . 1 1 97 97 LEU HB3 H 1 1.694 0.030 . 2 . . . . 97 LEU HB3 . 10083 1 1158 . 1 1 97 97 LEU HG H 1 1.786 0.030 . 1 . . . . 97 LEU HG . 10083 1 1159 . 1 1 97 97 LEU HD11 H 1 0.928 0.030 . 1 . . . . 97 LEU HD1 . 10083 1 1160 . 1 1 97 97 LEU HD12 H 1 0.928 0.030 . 1 . . . . 97 LEU HD1 . 10083 1 1161 . 1 1 97 97 LEU HD13 H 1 0.928 0.030 . 1 . . . . 97 LEU HD1 . 10083 1 1162 . 1 1 97 97 LEU HD21 H 1 1.031 0.030 . 1 . . . . 97 LEU HD2 . 10083 1 1163 . 1 1 97 97 LEU HD22 H 1 1.031 0.030 . 1 . . . . 97 LEU HD2 . 10083 1 1164 . 1 1 97 97 LEU HD23 H 1 1.031 0.030 . 1 . . . . 97 LEU HD2 . 10083 1 1165 . 1 1 97 97 LEU C C 13 177.458 0.300 . 1 . . . . 97 LEU C . 10083 1 1166 . 1 1 97 97 LEU CA C 13 55.892 0.300 . 1 . . . . 97 LEU CA . 10083 1 1167 . 1 1 97 97 LEU CB C 13 42.244 0.300 . 1 . . . . 97 LEU CB . 10083 1 1168 . 1 1 97 97 LEU CG C 13 27.523 0.300 . 1 . . . . 97 LEU CG . 10083 1 1169 . 1 1 97 97 LEU CD1 C 13 24.672 0.300 . 2 . . . . 97 LEU CD1 . 10083 1 1170 . 1 1 97 97 LEU CD2 C 13 24.272 0.300 . 2 . . . . 97 LEU CD2 . 10083 1 1171 . 1 1 97 97 LEU N N 15 125.556 0.300 . 1 . . . . 97 LEU N . 10083 1 1172 . 1 1 98 98 LEU H H 1 8.429 0.030 . 1 . . . . 98 LEU H . 10083 1 1173 . 1 1 98 98 LEU HA H 1 4.326 0.030 . 1 . . . . 98 LEU HA . 10083 1 1174 . 1 1 98 98 LEU HB2 H 1 1.930 0.030 . 2 . . . . 98 LEU HB2 . 10083 1 1175 . 1 1 98 98 LEU HB3 H 1 1.351 0.030 . 2 . . . . 98 LEU HB3 . 10083 1 1176 . 1 1 98 98 LEU HG H 1 1.585 0.030 . 1 . . . . 98 LEU HG . 10083 1 1177 . 1 1 98 98 LEU HD11 H 1 0.750 0.030 . 1 . . . . 98 LEU HD1 . 10083 1 1178 . 1 1 98 98 LEU HD12 H 1 0.750 0.030 . 1 . . . . 98 LEU HD1 . 10083 1 1179 . 1 1 98 98 LEU HD13 H 1 0.750 0.030 . 1 . . . . 98 LEU HD1 . 10083 1 1180 . 1 1 98 98 LEU HD21 H 1 0.680 0.030 . 1 . . . . 98 LEU HD2 . 10083 1 1181 . 1 1 98 98 LEU HD22 H 1 0.680 0.030 . 1 . . . . 98 LEU HD2 . 10083 1 1182 . 1 1 98 98 LEU HD23 H 1 0.680 0.030 . 1 . . . . 98 LEU HD2 . 10083 1 1183 . 1 1 98 98 LEU C C 13 177.982 0.300 . 1 . . . . 98 LEU C . 10083 1 1184 . 1 1 98 98 LEU CA C 13 54.480 0.300 . 1 . . . . 98 LEU CA . 10083 1 1185 . 1 1 98 98 LEU CB C 13 41.122 0.300 . 1 . . . . 98 LEU CB . 10083 1 1186 . 1 1 98 98 LEU CG C 13 27.293 0.300 . 1 . . . . 98 LEU CG . 10083 1 1187 . 1 1 98 98 LEU CD1 C 13 25.867 0.300 . 2 . . . . 98 LEU CD1 . 10083 1 1188 . 1 1 98 98 LEU CD2 C 13 22.824 0.300 . 2 . . . . 98 LEU CD2 . 10083 1 1189 . 1 1 98 98 LEU N N 15 120.956 0.300 . 1 . . . . 98 LEU N . 10083 1 1190 . 1 1 99 99 GLN H H 1 7.571 0.030 . 1 . . . . 99 GLN H . 10083 1 1191 . 1 1 99 99 GLN HA H 1 4.567 0.030 . 1 . . . . 99 GLN HA . 10083 1 1192 . 1 1 99 99 GLN HB2 H 1 2.092 0.030 . 2 . . . . 99 GLN HB2 . 10083 1 1193 . 1 1 99 99 GLN HB3 H 1 2.008 0.030 . 2 . . . . 99 GLN HB3 . 10083 1 1194 . 1 1 99 99 GLN HG2 H 1 2.731 0.030 . 2 . . . . 99 GLN HG2 . 10083 1 1195 . 1 1 99 99 GLN HG3 H 1 2.444 0.030 . 2 . . . . 99 GLN HG3 . 10083 1 1196 . 1 1 99 99 GLN HE21 H 1 8.629 0.030 . 2 . . . . 99 GLN HE21 . 10083 1 1197 . 1 1 99 99 GLN HE22 H 1 6.704 0.030 . 2 . . . . 99 GLN HE22 . 10083 1 1198 . 1 1 99 99 GLN C C 13 177.947 0.300 . 1 . . . . 99 GLN C . 10083 1 1199 . 1 1 99 99 GLN CA C 13 58.171 0.300 . 1 . . . . 99 GLN CA . 10083 1 1200 . 1 1 99 99 GLN CB C 13 29.529 0.300 . 1 . . . . 99 GLN CB . 10083 1 1201 . 1 1 99 99 GLN CG C 13 35.487 0.300 . 1 . . . . 99 GLN CG . 10083 1 1202 . 1 1 99 99 GLN N N 15 120.740 0.300 . 1 . . . . 99 GLN N . 10083 1 1203 . 1 1 99 99 GLN NE2 N 15 115.631 0.300 . 1 . . . . 99 GLN NE2 . 10083 1 1204 . 1 1 100 100 GLY H H 1 9.596 0.030 . 1 . . . . 100 GLY H . 10083 1 1205 . 1 1 100 100 GLY HA2 H 1 4.339 0.030 . 2 . . . . 100 GLY HA2 . 10083 1 1206 . 1 1 100 100 GLY HA3 H 1 3.907 0.030 . 2 . . . . 100 GLY HA3 . 10083 1 1207 . 1 1 100 100 GLY C C 13 172.853 0.300 . 1 . . . . 100 GLY C . 10083 1 1208 . 1 1 100 100 GLY CA C 13 45.497 0.300 . 1 . . . . 100 GLY CA . 10083 1 1209 . 1 1 100 100 GLY N N 15 115.785 0.300 . 1 . . . . 100 GLY N . 10083 1 1210 . 1 1 101 101 ALA H H 1 7.370 0.030 . 1 . . . . 101 ALA H . 10083 1 1211 . 1 1 101 101 ALA HA H 1 4.632 0.030 . 1 . . . . 101 ALA HA . 10083 1 1212 . 1 1 101 101 ALA HB1 H 1 1.376 0.030 . 1 . . . . 101 ALA HB . 10083 1 1213 . 1 1 101 101 ALA HB2 H 1 1.376 0.030 . 1 . . . . 101 ALA HB . 10083 1 1214 . 1 1 101 101 ALA HB3 H 1 1.376 0.030 . 1 . . . . 101 ALA HB . 10083 1 1215 . 1 1 101 101 ALA C C 13 177.108 0.300 . 1 . . . . 101 ALA C . 10083 1 1216 . 1 1 101 101 ALA CA C 13 50.952 0.300 . 1 . . . . 101 ALA CA . 10083 1 1217 . 1 1 101 101 ALA CB C 13 20.087 0.300 . 1 . . . . 101 ALA CB . 10083 1 1218 . 1 1 101 101 ALA N N 15 123.505 0.300 . 1 . . . . 101 ALA N . 10083 1 1219 . 1 1 102 102 THR H H 1 8.577 0.030 . 1 . . . . 102 THR H . 10083 1 1220 . 1 1 102 102 THR HA H 1 4.278 0.030 . 1 . . . . 102 THR HA . 10083 1 1221 . 1 1 102 102 THR HB H 1 4.797 0.030 . 1 . . . . 102 THR HB . 10083 1 1222 . 1 1 102 102 THR HG21 H 1 1.346 0.030 . 1 . . . . 102 THR HG2 . 10083 1 1223 . 1 1 102 102 THR HG22 H 1 1.346 0.030 . 1 . . . . 102 THR HG2 . 10083 1 1224 . 1 1 102 102 THR HG23 H 1 1.346 0.030 . 1 . . . . 102 THR HG2 . 10083 1 1225 . 1 1 102 102 THR C C 13 174.781 0.300 . 1 . . . . 102 THR C . 10083 1 1226 . 1 1 102 102 THR CA C 13 61.123 0.300 . 1 . . . . 102 THR CA . 10083 1 1227 . 1 1 102 102 THR CB C 13 71.651 0.300 . 1 . . . . 102 THR CB . 10083 1 1228 . 1 1 102 102 THR CG2 C 13 22.133 0.300 . 1 . . . . 102 THR CG2 . 10083 1 1229 . 1 1 102 102 THR N N 15 109.760 0.300 . 1 . . . . 102 THR N . 10083 1 1230 . 1 1 103 103 PHE H H 1 9.112 0.030 . 1 . . . . 103 PHE H . 10083 1 1231 . 1 1 103 103 PHE HA H 1 3.612 0.030 . 1 . . . . 103 PHE HA . 10083 1 1232 . 1 1 103 103 PHE HB2 H 1 3.379 0.030 . 2 . . . . 103 PHE HB2 . 10083 1 1233 . 1 1 103 103 PHE HB3 H 1 2.996 0.030 . 2 . . . . 103 PHE HB3 . 10083 1 1234 . 1 1 103 103 PHE HD1 H 1 7.379 0.030 . 1 . . . . 103 PHE HD1 . 10083 1 1235 . 1 1 103 103 PHE HD2 H 1 7.379 0.030 . 1 . . . . 103 PHE HD2 . 10083 1 1236 . 1 1 103 103 PHE HE1 H 1 7.323 0.030 . 1 . . . . 103 PHE HE1 . 10083 1 1237 . 1 1 103 103 PHE HE2 H 1 7.323 0.030 . 1 . . . . 103 PHE HE2 . 10083 1 1238 . 1 1 103 103 PHE HZ H 1 7.305 0.030 . 1 . . . . 103 PHE HZ . 10083 1 1239 . 1 1 103 103 PHE C C 13 177.912 0.300 . 1 . . . . 103 PHE C . 10083 1 1240 . 1 1 103 103 PHE CA C 13 62.252 0.300 . 1 . . . . 103 PHE CA . 10083 1 1241 . 1 1 103 103 PHE CB C 13 39.115 0.300 . 1 . . . . 103 PHE CB . 10083 1 1242 . 1 1 103 103 PHE CD1 C 13 132.449 0.300 . 1 . . . . 103 PHE CD1 . 10083 1 1243 . 1 1 103 103 PHE CD2 C 13 132.449 0.300 . 1 . . . . 103 PHE CD2 . 10083 1 1244 . 1 1 103 103 PHE CE1 C 13 131.193 0.300 . 1 . . . . 103 PHE CE1 . 10083 1 1245 . 1 1 103 103 PHE CE2 C 13 131.193 0.300 . 1 . . . . 103 PHE CE2 . 10083 1 1246 . 1 1 103 103 PHE CZ C 13 130.102 0.300 . 1 . . . . 103 PHE CZ . 10083 1 1247 . 1 1 103 103 PHE N N 15 119.954 0.300 . 1 . . . . 103 PHE N . 10083 1 1248 . 1 1 104 104 GLU H H 1 9.085 0.030 . 1 . . . . 104 GLU H . 10083 1 1249 . 1 1 104 104 GLU HA H 1 3.762 0.030 . 1 . . . . 104 GLU HA . 10083 1 1250 . 1 1 104 104 GLU HB2 H 1 2.087 0.030 . 2 . . . . 104 GLU HB2 . 10083 1 1251 . 1 1 104 104 GLU HB3 H 1 1.942 0.030 . 2 . . . . 104 GLU HB3 . 10083 1 1252 . 1 1 104 104 GLU HG2 H 1 2.450 0.030 . 2 . . . . 104 GLU HG2 . 10083 1 1253 . 1 1 104 104 GLU HG3 H 1 2.325 0.030 . 2 . . . . 104 GLU HG3 . 10083 1 1254 . 1 1 104 104 GLU C C 13 178.401 0.300 . 1 . . . . 104 GLU C . 10083 1 1255 . 1 1 104 104 GLU CA C 13 60.023 0.300 . 1 . . . . 104 GLU CA . 10083 1 1256 . 1 1 104 104 GLU CB C 13 29.360 0.300 . 1 . . . . 104 GLU CB . 10083 1 1257 . 1 1 104 104 GLU CG C 13 37.088 0.300 . 1 . . . . 104 GLU CG . 10083 1 1258 . 1 1 104 104 GLU N N 15 119.453 0.300 . 1 . . . . 104 GLU N . 10083 1 1259 . 1 1 105 105 GLU H H 1 7.664 0.030 . 1 . . . . 105 GLU H . 10083 1 1260 . 1 1 105 105 GLU HA H 1 3.977 0.030 . 1 . . . . 105 GLU HA . 10083 1 1261 . 1 1 105 105 GLU HB2 H 1 2.314 0.030 . 2 . . . . 105 GLU HB2 . 10083 1 1262 . 1 1 105 105 GLU HB3 H 1 1.874 0.030 . 2 . . . . 105 GLU HB3 . 10083 1 1263 . 1 1 105 105 GLU HG2 H 1 2.370 0.030 . 2 . . . . 105 GLU HG2 . 10083 1 1264 . 1 1 105 105 GLU HG3 H 1 2.257 0.030 . 2 . . . . 105 GLU HG3 . 10083 1 1265 . 1 1 105 105 GLU C C 13 179.806 0.300 . 1 . . . . 105 GLU C . 10083 1 1266 . 1 1 105 105 GLU CA C 13 59.183 0.300 . 1 . . . . 105 GLU CA . 10083 1 1267 . 1 1 105 105 GLU CB C 13 30.165 0.300 . 1 . . . . 105 GLU CB . 10083 1 1268 . 1 1 105 105 GLU CG C 13 37.288 0.300 . 1 . . . . 105 GLU CG . 10083 1 1269 . 1 1 105 105 GLU N N 15 119.974 0.300 . 1 . . . . 105 GLU N . 10083 1 1270 . 1 1 106 106 VAL H H 1 8.234 0.030 . 1 . . . . 106 VAL H . 10083 1 1271 . 1 1 106 106 VAL HA H 1 3.246 0.030 . 1 . . . . 106 VAL HA . 10083 1 1272 . 1 1 106 106 VAL HB H 1 1.907 0.030 . 1 . . . . 106 VAL HB . 10083 1 1273 . 1 1 106 106 VAL HG11 H 1 1.055 0.030 . 1 . . . . 106 VAL HG1 . 10083 1 1274 . 1 1 106 106 VAL HG12 H 1 1.055 0.030 . 1 . . . . 106 VAL HG1 . 10083 1 1275 . 1 1 106 106 VAL HG13 H 1 1.055 0.030 . 1 . . . . 106 VAL HG1 . 10083 1 1276 . 1 1 106 106 VAL HG21 H 1 0.561 0.030 . 1 . . . . 106 VAL HG2 . 10083 1 1277 . 1 1 106 106 VAL HG22 H 1 0.561 0.030 . 1 . . . . 106 VAL HG2 . 10083 1 1278 . 1 1 106 106 VAL HG23 H 1 0.561 0.030 . 1 . . . . 106 VAL HG2 . 10083 1 1279 . 1 1 106 106 VAL C C 13 176.137 0.300 . 1 . . . . 106 VAL C . 10083 1 1280 . 1 1 106 106 VAL CA C 13 67.403 0.300 . 1 . . . . 106 VAL CA . 10083 1 1281 . 1 1 106 106 VAL CB C 13 31.087 0.300 . 1 . . . . 106 VAL CB . 10083 1 1282 . 1 1 106 106 VAL CG1 C 13 25.316 0.300 . 2 . . . . 106 VAL CG1 . 10083 1 1283 . 1 1 106 106 VAL CG2 C 13 21.705 0.300 . 2 . . . . 106 VAL CG2 . 10083 1 1284 . 1 1 106 106 VAL N N 15 119.199 0.300 . 1 . . . . 106 VAL N . 10083 1 1285 . 1 1 107 107 TYR H H 1 7.976 0.030 . 1 . . . . 107 TYR H . 10083 1 1286 . 1 1 107 107 TYR HA H 1 3.578 0.030 . 1 . . . . 107 TYR HA . 10083 1 1287 . 1 1 107 107 TYR HB2 H 1 2.877 0.030 . 2 . . . . 107 TYR HB2 . 10083 1 1288 . 1 1 107 107 TYR HB3 H 1 2.369 0.030 . 2 . . . . 107 TYR HB3 . 10083 1 1289 . 1 1 107 107 TYR HD1 H 1 6.994 0.030 . 1 . . . . 107 TYR HD1 . 10083 1 1290 . 1 1 107 107 TYR HD2 H 1 6.994 0.030 . 1 . . . . 107 TYR HD2 . 10083 1 1291 . 1 1 107 107 TYR HE1 H 1 6.832 0.030 . 1 . . . . 107 TYR HE1 . 10083 1 1292 . 1 1 107 107 TYR HE2 H 1 6.832 0.030 . 1 . . . . 107 TYR HE2 . 10083 1 1293 . 1 1 107 107 TYR C C 13 178.024 0.300 . 1 . . . . 107 TYR C . 10083 1 1294 . 1 1 107 107 TYR CA C 13 61.573 0.300 . 1 . . . . 107 TYR CA . 10083 1 1295 . 1 1 107 107 TYR CB C 13 38.150 0.300 . 1 . . . . 107 TYR CB . 10083 1 1296 . 1 1 107 107 TYR CD1 C 13 133.303 0.300 . 1 . . . . 107 TYR CD1 . 10083 1 1297 . 1 1 107 107 TYR CD2 C 13 133.303 0.300 . 1 . . . . 107 TYR CD2 . 10083 1 1298 . 1 1 107 107 TYR CE1 C 13 118.176 0.300 . 1 . . . . 107 TYR CE1 . 10083 1 1299 . 1 1 107 107 TYR CE2 C 13 118.176 0.300 . 1 . . . . 107 TYR CE2 . 10083 1 1300 . 1 1 107 107 TYR N N 15 119.471 0.300 . 1 . . . . 107 TYR N . 10083 1 1301 . 1 1 108 108 ASN H H 1 8.071 0.030 . 1 . . . . 108 ASN H . 10083 1 1302 . 1 1 108 108 ASN HA H 1 4.348 0.030 . 1 . . . . 108 ASN HA . 10083 1 1303 . 1 1 108 108 ASN HB2 H 1 2.838 0.030 . 2 . . . . 108 ASN HB2 . 10083 1 1304 . 1 1 108 108 ASN HB3 H 1 2.751 0.030 . 2 . . . . 108 ASN HB3 . 10083 1 1305 . 1 1 108 108 ASN HD21 H 1 7.583 0.030 . 2 . . . . 108 ASN HD21 . 10083 1 1306 . 1 1 108 108 ASN HD22 H 1 6.958 0.030 . 2 . . . . 108 ASN HD22 . 10083 1 1307 . 1 1 108 108 ASN C C 13 177.318 0.300 . 1 . . . . 108 ASN C . 10083 1 1308 . 1 1 108 108 ASN CA C 13 56.396 0.300 . 1 . . . . 108 ASN CA . 10083 1 1309 . 1 1 108 108 ASN CB C 13 38.322 0.300 . 1 . . . . 108 ASN CB . 10083 1 1310 . 1 1 108 108 ASN N N 15 117.291 0.300 . 1 . . . . 108 ASN N . 10083 1 1311 . 1 1 108 108 ASN ND2 N 15 112.319 0.300 . 1 . . . . 108 ASN ND2 . 10083 1 1312 . 1 1 109 109 ILE H H 1 8.004 0.030 . 1 . . . . 109 ILE H . 10083 1 1313 . 1 1 109 109 ILE HA H 1 3.511 0.030 . 1 . . . . 109 ILE HA . 10083 1 1314 . 1 1 109 109 ILE HB H 1 1.663 0.030 . 1 . . . . 109 ILE HB . 10083 1 1315 . 1 1 109 109 ILE HG12 H 1 1.760 0.030 . 2 . . . . 109 ILE HG12 . 10083 1 1316 . 1 1 109 109 ILE HG13 H 1 0.820 0.030 . 2 . . . . 109 ILE HG13 . 10083 1 1317 . 1 1 109 109 ILE HG21 H 1 0.723 0.030 . 1 . . . . 109 ILE HG2 . 10083 1 1318 . 1 1 109 109 ILE HG22 H 1 0.723 0.030 . 1 . . . . 109 ILE HG2 . 10083 1 1319 . 1 1 109 109 ILE HG23 H 1 0.723 0.030 . 1 . . . . 109 ILE HG2 . 10083 1 1320 . 1 1 109 109 ILE HD11 H 1 0.642 0.030 . 1 . . . . 109 ILE HD1 . 10083 1 1321 . 1 1 109 109 ILE HD12 H 1 0.642 0.030 . 1 . . . . 109 ILE HD1 . 10083 1 1322 . 1 1 109 109 ILE HD13 H 1 0.642 0.030 . 1 . . . . 109 ILE HD1 . 10083 1 1323 . 1 1 109 109 ILE C C 13 178.639 0.300 . 1 . . . . 109 ILE C . 10083 1 1324 . 1 1 109 109 ILE CA C 13 65.577 0.300 . 1 . . . . 109 ILE CA . 10083 1 1325 . 1 1 109 109 ILE CB C 13 38.412 0.300 . 1 . . . . 109 ILE CB . 10083 1 1326 . 1 1 109 109 ILE CG1 C 13 30.352 0.300 . 1 . . . . 109 ILE CG1 . 10083 1 1327 . 1 1 109 109 ILE CG2 C 13 17.059 0.300 . 1 . . . . 109 ILE CG2 . 10083 1 1328 . 1 1 109 109 ILE CD1 C 13 14.037 0.300 . 1 . . . . 109 ILE CD1 . 10083 1 1329 . 1 1 109 109 ILE N N 15 123.232 0.300 . 1 . . . . 109 ILE N . 10083 1 1330 . 1 1 110 110 ILE H H 1 7.782 0.030 . 1 . . . . 110 ILE H . 10083 1 1331 . 1 1 110 110 ILE HA H 1 2.765 0.030 . 1 . . . . 110 ILE HA . 10083 1 1332 . 1 1 110 110 ILE HB H 1 1.269 0.030 . 1 . . . . 110 ILE HB . 10083 1 1333 . 1 1 110 110 ILE HG12 H 1 0.680 0.030 . 2 . . . . 110 ILE HG12 . 10083 1 1334 . 1 1 110 110 ILE HG13 H 1 -1.260 0.030 . 2 . . . . 110 ILE HG13 . 10083 1 1335 . 1 1 110 110 ILE HG21 H 1 0.357 0.030 . 1 . . . . 110 ILE HG2 . 10083 1 1336 . 1 1 110 110 ILE HG22 H 1 0.357 0.030 . 1 . . . . 110 ILE HG2 . 10083 1 1337 . 1 1 110 110 ILE HG23 H 1 0.357 0.030 . 1 . . . . 110 ILE HG2 . 10083 1 1338 . 1 1 110 110 ILE HD11 H 1 -0.147 0.030 . 1 . . . . 110 ILE HD1 . 10083 1 1339 . 1 1 110 110 ILE HD12 H 1 -0.147 0.030 . 1 . . . . 110 ILE HD1 . 10083 1 1340 . 1 1 110 110 ILE HD13 H 1 -0.147 0.030 . 1 . . . . 110 ILE HD1 . 10083 1 1341 . 1 1 110 110 ILE C C 13 180.875 0.300 . 1 . . . . 110 ILE C . 10083 1 1342 . 1 1 110 110 ILE CA C 13 65.365 0.300 . 1 . . . . 110 ILE CA . 10083 1 1343 . 1 1 110 110 ILE CB C 13 36.826 0.300 . 1 . . . . 110 ILE CB . 10083 1 1344 . 1 1 110 110 ILE CG1 C 13 27.145 0.300 . 1 . . . . 110 ILE CG1 . 10083 1 1345 . 1 1 110 110 ILE CG2 C 13 16.293 0.300 . 1 . . . . 110 ILE CG2 . 10083 1 1346 . 1 1 110 110 ILE CD1 C 13 12.847 0.300 . 1 . . . . 110 ILE CD1 . 10083 1 1347 . 1 1 110 110 ILE N N 15 120.577 0.300 . 1 . . . . 110 ILE N . 10083 1 1348 . 1 1 111 111 LEU H H 1 8.234 0.030 . 1 . . . . 111 LEU H . 10083 1 1349 . 1 1 111 111 LEU HA H 1 3.876 0.030 . 1 . . . . 111 LEU HA . 10083 1 1350 . 1 1 111 111 LEU HB2 H 1 1.687 0.030 . 2 . . . . 111 LEU HB2 . 10083 1 1351 . 1 1 111 111 LEU HB3 H 1 1.339 0.030 . 2 . . . . 111 LEU HB3 . 10083 1 1352 . 1 1 111 111 LEU HG H 1 1.440 0.030 . 1 . . . . 111 LEU HG . 10083 1 1353 . 1 1 111 111 LEU HD11 H 1 0.861 0.030 . 1 . . . . 111 LEU HD1 . 10083 1 1354 . 1 1 111 111 LEU HD12 H 1 0.861 0.030 . 1 . . . . 111 LEU HD1 . 10083 1 1355 . 1 1 111 111 LEU HD13 H 1 0.861 0.030 . 1 . . . . 111 LEU HD1 . 10083 1 1356 . 1 1 111 111 LEU HD21 H 1 0.818 0.030 . 1 . . . . 111 LEU HD2 . 10083 1 1357 . 1 1 111 111 LEU HD22 H 1 0.818 0.030 . 1 . . . . 111 LEU HD2 . 10083 1 1358 . 1 1 111 111 LEU HD23 H 1 0.818 0.030 . 1 . . . . 111 LEU HD2 . 10083 1 1359 . 1 1 111 111 LEU C C 13 180.477 0.300 . 1 . . . . 111 LEU C . 10083 1 1360 . 1 1 111 111 LEU CA C 13 58.545 0.300 . 1 . . . . 111 LEU CA . 10083 1 1361 . 1 1 111 111 LEU CB C 13 42.098 0.300 . 1 . . . . 111 LEU CB . 10083 1 1362 . 1 1 111 111 LEU CG C 13 26.873 0.300 . 1 . . . . 111 LEU CG . 10083 1 1363 . 1 1 111 111 LEU CD1 C 13 25.026 0.300 . 2 . . . . 111 LEU CD1 . 10083 1 1364 . 1 1 111 111 LEU CD2 C 13 23.969 0.300 . 2 . . . . 111 LEU CD2 . 10083 1 1365 . 1 1 111 111 LEU N N 15 124.938 0.300 . 1 . . . . 111 LEU N . 10083 1 1366 . 1 1 112 112 GLU H H 1 8.440 0.030 . 1 . . . . 112 GLU H . 10083 1 1367 . 1 1 112 112 GLU HA H 1 4.008 0.030 . 1 . . . . 112 GLU HA . 10083 1 1368 . 1 1 112 112 GLU HB2 H 1 2.112 0.030 . 1 . . . . 112 GLU HB2 . 10083 1 1369 . 1 1 112 112 GLU HB3 H 1 2.112 0.030 . 1 . . . . 112 GLU HB3 . 10083 1 1370 . 1 1 112 112 GLU HG2 H 1 2.485 0.030 . 2 . . . . 112 GLU HG2 . 10083 1 1371 . 1 1 112 112 GLU HG3 H 1 2.315 0.030 . 2 . . . . 112 GLU HG3 . 10083 1 1372 . 1 1 112 112 GLU C C 13 177.034 0.300 . 1 . . . . 112 GLU C . 10083 1 1373 . 1 1 112 112 GLU CA C 13 58.685 0.300 . 1 . . . . 112 GLU CA . 10083 1 1374 . 1 1 112 112 GLU CB C 13 29.401 0.300 . 1 . . . . 112 GLU CB . 10083 1 1375 . 1 1 112 112 GLU CG C 13 36.819 0.300 . 1 . . . . 112 GLU CG . 10083 1 1376 . 1 1 112 112 GLU N N 15 119.440 0.300 . 1 . . . . 112 GLU N . 10083 1 1377 . 1 1 113 113 SER H H 1 7.588 0.030 . 1 . . . . 113 SER H . 10083 1 1378 . 1 1 113 113 SER HA H 1 4.714 0.030 . 1 . . . . 113 SER HA . 10083 1 1379 . 1 1 113 113 SER HB2 H 1 4.310 0.030 . 2 . . . . 113 SER HB2 . 10083 1 1380 . 1 1 113 113 SER HB3 H 1 4.284 0.030 . 2 . . . . 113 SER HB3 . 10083 1 1381 . 1 1 113 113 SER C C 13 175.024 0.300 . 1 . . . . 113 SER C . 10083 1 1382 . 1 1 113 113 SER CA C 13 58.531 0.300 . 1 . . . . 113 SER CA . 10083 1 1383 . 1 1 113 113 SER CB C 13 65.082 0.300 . 1 . . . . 113 SER CB . 10083 1 1384 . 1 1 113 113 SER N N 15 111.273 0.300 . 1 . . . . 113 SER N . 10083 1 1385 . 1 1 114 114 LYS H H 1 7.738 0.030 . 1 . . . . 114 LYS H . 10083 1 1386 . 1 1 114 114 LYS HA H 1 4.154 0.030 . 1 . . . . 114 LYS HA . 10083 1 1387 . 1 1 114 114 LYS HB2 H 1 2.116 0.030 . 2 . . . . 114 LYS HB2 . 10083 1 1388 . 1 1 114 114 LYS HB3 H 1 1.968 0.030 . 2 . . . . 114 LYS HB3 . 10083 1 1389 . 1 1 114 114 LYS HG2 H 1 1.698 0.030 . 2 . . . . 114 LYS HG2 . 10083 1 1390 . 1 1 114 114 LYS HG3 H 1 1.459 0.030 . 2 . . . . 114 LYS HG3 . 10083 1 1391 . 1 1 114 114 LYS HD2 H 1 1.762 0.030 . 1 . . . . 114 LYS HD2 . 10083 1 1392 . 1 1 114 114 LYS HD3 H 1 1.762 0.030 . 1 . . . . 114 LYS HD3 . 10083 1 1393 . 1 1 114 114 LYS HE2 H 1 3.006 0.030 . 1 . . . . 114 LYS HE2 . 10083 1 1394 . 1 1 114 114 LYS HE3 H 1 3.006 0.030 . 1 . . . . 114 LYS HE3 . 10083 1 1395 . 1 1 114 114 LYS C C 13 171.521 0.300 . 1 . . . . 114 LYS C . 10083 1 1396 . 1 1 114 114 LYS CA C 13 62.130 0.300 . 1 . . . . 114 LYS CA . 10083 1 1397 . 1 1 114 114 LYS CB C 13 30.493 0.300 . 1 . . . . 114 LYS CB . 10083 1 1398 . 1 1 114 114 LYS CG C 13 25.654 0.300 . 1 . . . . 114 LYS CG . 10083 1 1399 . 1 1 114 114 LYS CD C 13 29.708 0.300 . 1 . . . . 114 LYS CD . 10083 1 1400 . 1 1 114 114 LYS CE C 13 42.161 0.300 . 1 . . . . 114 LYS CE . 10083 1 1401 . 1 1 114 114 LYS N N 15 125.867 0.300 . 1 . . . . 114 LYS N . 10083 1 1402 . 1 1 115 115 PRO HA H 1 4.561 0.030 . 1 . . . . 115 PRO HA . 10083 1 1403 . 1 1 115 115 PRO HB2 H 1 2.285 0.030 . 2 . . . . 115 PRO HB2 . 10083 1 1404 . 1 1 115 115 PRO HB3 H 1 1.929 0.030 . 2 . . . . 115 PRO HB3 . 10083 1 1405 . 1 1 115 115 PRO HG2 H 1 1.982 0.030 . 1 . . . . 115 PRO HG2 . 10083 1 1406 . 1 1 115 115 PRO HG3 H 1 1.982 0.030 . 1 . . . . 115 PRO HG3 . 10083 1 1407 . 1 1 115 115 PRO HD2 H 1 3.742 0.030 . 2 . . . . 115 PRO HD2 . 10083 1 1408 . 1 1 115 115 PRO HD3 H 1 3.618 0.030 . 2 . . . . 115 PRO HD3 . 10083 1 1409 . 1 1 115 115 PRO C C 13 177.252 0.300 . 1 . . . . 115 PRO C . 10083 1 1410 . 1 1 115 115 PRO CA C 13 64.419 0.300 . 1 . . . . 115 PRO CA . 10083 1 1411 . 1 1 115 115 PRO CB C 13 31.677 0.300 . 1 . . . . 115 PRO CB . 10083 1 1412 . 1 1 115 115 PRO CG C 13 27.578 0.300 . 1 . . . . 115 PRO CG . 10083 1 1413 . 1 1 115 115 PRO CD C 13 50.186 0.300 . 1 . . . . 115 PRO CD . 10083 1 1414 . 1 1 116 116 GLU H H 1 7.752 0.030 . 1 . . . . 116 GLU H . 10083 1 1415 . 1 1 116 116 GLU HA H 1 4.460 0.030 . 1 . . . . 116 GLU HA . 10083 1 1416 . 1 1 116 116 GLU HB2 H 1 2.251 0.030 . 2 . . . . 116 GLU HB2 . 10083 1 1417 . 1 1 116 116 GLU HB3 H 1 2.119 0.030 . 2 . . . . 116 GLU HB3 . 10083 1 1418 . 1 1 116 116 GLU HG2 H 1 2.468 0.030 . 2 . . . . 116 GLU HG2 . 10083 1 1419 . 1 1 116 116 GLU HG3 H 1 2.319 0.030 . 2 . . . . 116 GLU HG3 . 10083 1 1420 . 1 1 116 116 GLU C C 13 176.992 0.300 . 1 . . . . 116 GLU C . 10083 1 1421 . 1 1 116 116 GLU CA C 13 54.687 0.300 . 1 . . . . 116 GLU CA . 10083 1 1422 . 1 1 116 116 GLU CB C 13 29.012 0.300 . 1 . . . . 116 GLU CB . 10083 1 1423 . 1 1 116 116 GLU CG C 13 36.436 0.300 . 1 . . . . 116 GLU CG . 10083 1 1424 . 1 1 116 116 GLU N N 15 118.790 0.300 . 1 . . . . 116 GLU N . 10083 1 1425 . 1 1 117 117 PRO HA H 1 4.304 0.030 . 1 . . . . 117 PRO HA . 10083 1 1426 . 1 1 117 117 PRO HB2 H 1 2.160 0.030 . 2 . . . . 117 PRO HB2 . 10083 1 1427 . 1 1 117 117 PRO HB3 H 1 2.003 0.030 . 2 . . . . 117 PRO HB3 . 10083 1 1428 . 1 1 117 117 PRO HG2 H 1 2.089 0.030 . 2 . . . . 117 PRO HG2 . 10083 1 1429 . 1 1 117 117 PRO HG3 H 1 2.005 0.030 . 2 . . . . 117 PRO HG3 . 10083 1 1430 . 1 1 117 117 PRO HD2 H 1 3.962 0.030 . 2 . . . . 117 PRO HD2 . 10083 1 1431 . 1 1 117 117 PRO HD3 H 1 3.828 0.030 . 2 . . . . 117 PRO HD3 . 10083 1 1432 . 1 1 117 117 PRO C C 13 174.314 0.300 . 1 . . . . 117 PRO C . 10083 1 1433 . 1 1 117 117 PRO CA C 13 64.544 0.300 . 1 . . . . 117 PRO CA . 10083 1 1434 . 1 1 117 117 PRO CB C 13 32.059 0.300 . 1 . . . . 117 PRO CB . 10083 1 1435 . 1 1 117 117 PRO CG C 13 27.310 0.300 . 1 . . . . 117 PRO CG . 10083 1 1436 . 1 1 117 117 PRO CD C 13 50.687 0.300 . 1 . . . . 117 PRO CD . 10083 1 1437 . 1 1 118 118 GLN H H 1 7.280 0.030 . 1 . . . . 118 GLN H . 10083 1 1438 . 1 1 118 118 GLN HA H 1 5.052 0.030 . 1 . . . . 118 GLN HA . 10083 1 1439 . 1 1 118 118 GLN HB2 H 1 2.105 0.030 . 2 . . . . 118 GLN HB2 . 10083 1 1440 . 1 1 118 118 GLN HB3 H 1 1.734 0.030 . 2 . . . . 118 GLN HB3 . 10083 1 1441 . 1 1 118 118 GLN HG2 H 1 2.100 0.030 . 2 . . . . 118 GLN HG2 . 10083 1 1442 . 1 1 118 118 GLN HG3 H 1 2.022 0.030 . 2 . . . . 118 GLN HG3 . 10083 1 1443 . 1 1 118 118 GLN HE21 H 1 7.568 0.030 . 2 . . . . 118 GLN HE21 . 10083 1 1444 . 1 1 118 118 GLN HE22 H 1 6.849 0.030 . 2 . . . . 118 GLN HE22 . 10083 1 1445 . 1 1 118 118 GLN C C 13 173.670 0.300 . 1 . . . . 118 GLN C . 10083 1 1446 . 1 1 118 118 GLN CA C 13 53.956 0.300 . 1 . . . . 118 GLN CA . 10083 1 1447 . 1 1 118 118 GLN CB C 13 31.826 0.300 . 1 . . . . 118 GLN CB . 10083 1 1448 . 1 1 118 118 GLN CG C 13 32.802 0.300 . 1 . . . . 118 GLN CG . 10083 1 1449 . 1 1 118 118 GLN N N 15 112.508 0.300 . 1 . . . . 118 GLN N . 10083 1 1450 . 1 1 118 118 GLN NE2 N 15 112.837 0.300 . 1 . . . . 118 GLN NE2 . 10083 1 1451 . 1 1 119 119 VAL H H 1 8.523 0.030 . 1 . . . . 119 VAL H . 10083 1 1452 . 1 1 119 119 VAL HA H 1 4.419 0.030 . 1 . . . . 119 VAL HA . 10083 1 1453 . 1 1 119 119 VAL HB H 1 1.339 0.030 . 1 . . . . 119 VAL HB . 10083 1 1454 . 1 1 119 119 VAL HG11 H 1 0.569 0.030 . 1 . . . . 119 VAL HG1 . 10083 1 1455 . 1 1 119 119 VAL HG12 H 1 0.569 0.030 . 1 . . . . 119 VAL HG1 . 10083 1 1456 . 1 1 119 119 VAL HG13 H 1 0.569 0.030 . 1 . . . . 119 VAL HG1 . 10083 1 1457 . 1 1 119 119 VAL HG21 H 1 -0.104 0.030 . 1 . . . . 119 VAL HG2 . 10083 1 1458 . 1 1 119 119 VAL HG22 H 1 -0.104 0.030 . 1 . . . . 119 VAL HG2 . 10083 1 1459 . 1 1 119 119 VAL HG23 H 1 -0.104 0.030 . 1 . . . . 119 VAL HG2 . 10083 1 1460 . 1 1 119 119 VAL C C 13 172.971 0.300 . 1 . . . . 119 VAL C . 10083 1 1461 . 1 1 119 119 VAL CA C 13 60.495 0.300 . 1 . . . . 119 VAL CA . 10083 1 1462 . 1 1 119 119 VAL CB C 13 35.470 0.300 . 1 . . . . 119 VAL CB . 10083 1 1463 . 1 1 119 119 VAL CG1 C 13 21.089 0.300 . 2 . . . . 119 VAL CG1 . 10083 1 1464 . 1 1 119 119 VAL CG2 C 13 19.866 0.300 . 2 . . . . 119 VAL CG2 . 10083 1 1465 . 1 1 119 119 VAL N N 15 119.511 0.300 . 1 . . . . 119 VAL N . 10083 1 1466 . 1 1 120 120 GLU H H 1 8.410 0.030 . 1 . . . . 120 GLU H . 10083 1 1467 . 1 1 120 120 GLU HA H 1 5.066 0.030 . 1 . . . . 120 GLU HA . 10083 1 1468 . 1 1 120 120 GLU HB2 H 1 1.913 0.030 . 2 . . . . 120 GLU HB2 . 10083 1 1469 . 1 1 120 120 GLU HB3 H 1 1.673 0.030 . 2 . . . . 120 GLU HB3 . 10083 1 1470 . 1 1 120 120 GLU HG2 H 1 1.912 0.030 . 2 . . . . 120 GLU HG2 . 10083 1 1471 . 1 1 120 120 GLU HG3 H 1 1.808 0.030 . 2 . . . . 120 GLU HG3 . 10083 1 1472 . 1 1 120 120 GLU C C 13 174.900 0.300 . 1 . . . . 120 GLU C . 10083 1 1473 . 1 1 120 120 GLU CA C 13 54.031 0.300 . 1 . . . . 120 GLU CA . 10083 1 1474 . 1 1 120 120 GLU CB C 13 31.822 0.300 . 1 . . . . 120 GLU CB . 10083 1 1475 . 1 1 120 120 GLU CG C 13 37.062 0.300 . 1 . . . . 120 GLU CG . 10083 1 1476 . 1 1 120 120 GLU N N 15 127.036 0.300 . 1 . . . . 120 GLU N . 10083 1 1477 . 1 1 121 121 LEU H H 1 9.319 0.030 . 1 . . . . 121 LEU H . 10083 1 1478 . 1 1 121 121 LEU HA H 1 5.064 0.030 . 1 . . . . 121 LEU HA . 10083 1 1479 . 1 1 121 121 LEU HB2 H 1 1.499 0.030 . 2 . . . . 121 LEU HB2 . 10083 1 1480 . 1 1 121 121 LEU HB3 H 1 1.260 0.030 . 2 . . . . 121 LEU HB3 . 10083 1 1481 . 1 1 121 121 LEU HG H 1 1.248 0.030 . 1 . . . . 121 LEU HG . 10083 1 1482 . 1 1 121 121 LEU HD11 H 1 0.420 0.030 . 1 . . . . 121 LEU HD1 . 10083 1 1483 . 1 1 121 121 LEU HD12 H 1 0.420 0.030 . 1 . . . . 121 LEU HD1 . 10083 1 1484 . 1 1 121 121 LEU HD13 H 1 0.420 0.030 . 1 . . . . 121 LEU HD1 . 10083 1 1485 . 1 1 121 121 LEU HD21 H 1 0.318 0.030 . 1 . . . . 121 LEU HD2 . 10083 1 1486 . 1 1 121 121 LEU HD22 H 1 0.318 0.030 . 1 . . . . 121 LEU HD2 . 10083 1 1487 . 1 1 121 121 LEU HD23 H 1 0.318 0.030 . 1 . . . . 121 LEU HD2 . 10083 1 1488 . 1 1 121 121 LEU C C 13 175.865 0.300 . 1 . . . . 121 LEU C . 10083 1 1489 . 1 1 121 121 LEU CA C 13 53.708 0.300 . 1 . . . . 121 LEU CA . 10083 1 1490 . 1 1 121 121 LEU CB C 13 45.520 0.300 . 1 . . . . 121 LEU CB . 10083 1 1491 . 1 1 121 121 LEU CG C 13 27.528 0.300 . 1 . . . . 121 LEU CG . 10083 1 1492 . 1 1 121 121 LEU CD1 C 13 26.162 0.300 . 2 . . . . 121 LEU CD1 . 10083 1 1493 . 1 1 121 121 LEU CD2 C 13 25.890 0.300 . 2 . . . . 121 LEU CD2 . 10083 1 1494 . 1 1 121 121 LEU N N 15 127.153 0.300 . 1 . . . . 121 LEU N . 10083 1 1495 . 1 1 122 122 VAL H H 1 8.034 0.030 . 1 . . . . 122 VAL H . 10083 1 1496 . 1 1 122 122 VAL HA H 1 5.045 0.030 . 1 . . . . 122 VAL HA . 10083 1 1497 . 1 1 122 122 VAL HB H 1 1.724 0.030 . 1 . . . . 122 VAL HB . 10083 1 1498 . 1 1 122 122 VAL HG11 H 1 0.830 0.030 . 1 . . . . 122 VAL HG1 . 10083 1 1499 . 1 1 122 122 VAL HG12 H 1 0.830 0.030 . 1 . . . . 122 VAL HG1 . 10083 1 1500 . 1 1 122 122 VAL HG13 H 1 0.830 0.030 . 1 . . . . 122 VAL HG1 . 10083 1 1501 . 1 1 122 122 VAL HG21 H 1 0.764 0.030 . 1 . . . . 122 VAL HG2 . 10083 1 1502 . 1 1 122 122 VAL HG22 H 1 0.764 0.030 . 1 . . . . 122 VAL HG2 . 10083 1 1503 . 1 1 122 122 VAL HG23 H 1 0.764 0.030 . 1 . . . . 122 VAL HG2 . 10083 1 1504 . 1 1 122 122 VAL C C 13 176.207 0.300 . 1 . . . . 122 VAL C . 10083 1 1505 . 1 1 122 122 VAL CA C 13 61.763 0.300 . 1 . . . . 122 VAL CA . 10083 1 1506 . 1 1 122 122 VAL CB C 13 33.197 0.300 . 1 . . . . 122 VAL CB . 10083 1 1507 . 1 1 122 122 VAL CG1 C 13 21.507 0.300 . 2 . . . . 122 VAL CG1 . 10083 1 1508 . 1 1 122 122 VAL CG2 C 13 21.125 0.300 . 2 . . . . 122 VAL CG2 . 10083 1 1509 . 1 1 122 122 VAL N N 15 121.549 0.300 . 1 . . . . 122 VAL N . 10083 1 1510 . 1 1 123 123 VAL H H 1 9.371 0.030 . 1 . . . . 123 VAL H . 10083 1 1511 . 1 1 123 123 VAL HA H 1 5.495 0.030 . 1 . . . . 123 VAL HA . 10083 1 1512 . 1 1 123 123 VAL HB H 1 2.057 0.030 . 1 . . . . 123 VAL HB . 10083 1 1513 . 1 1 123 123 VAL HG11 H 1 1.020 0.030 . 1 . . . . 123 VAL HG1 . 10083 1 1514 . 1 1 123 123 VAL HG12 H 1 1.020 0.030 . 1 . . . . 123 VAL HG1 . 10083 1 1515 . 1 1 123 123 VAL HG13 H 1 1.020 0.030 . 1 . . . . 123 VAL HG1 . 10083 1 1516 . 1 1 123 123 VAL HG21 H 1 0.766 0.030 . 1 . . . . 123 VAL HG2 . 10083 1 1517 . 1 1 123 123 VAL HG22 H 1 0.766 0.030 . 1 . . . . 123 VAL HG2 . 10083 1 1518 . 1 1 123 123 VAL HG23 H 1 0.766 0.030 . 1 . . . . 123 VAL HG2 . 10083 1 1519 . 1 1 123 123 VAL C C 13 173.957 0.300 . 1 . . . . 123 VAL C . 10083 1 1520 . 1 1 123 123 VAL CA C 13 59.017 0.300 . 1 . . . . 123 VAL CA . 10083 1 1521 . 1 1 123 123 VAL CB C 13 35.897 0.300 . 1 . . . . 123 VAL CB . 10083 1 1522 . 1 1 123 123 VAL CG1 C 13 22.080 0.300 . 2 . . . . 123 VAL CG1 . 10083 1 1523 . 1 1 123 123 VAL CG2 C 13 20.629 0.300 . 2 . . . . 123 VAL CG2 . 10083 1 1524 . 1 1 123 123 VAL N N 15 123.941 0.300 . 1 . . . . 123 VAL N . 10083 1 1525 . 1 1 124 124 SER H H 1 9.431 0.030 . 1 . . . . 124 SER H . 10083 1 1526 . 1 1 124 124 SER HA H 1 5.744 0.030 . 1 . . . . 124 SER HA . 10083 1 1527 . 1 1 124 124 SER HB2 H 1 3.719 0.030 . 2 . . . . 124 SER HB2 . 10083 1 1528 . 1 1 124 124 SER HB3 H 1 3.600 0.030 . 2 . . . . 124 SER HB3 . 10083 1 1529 . 1 1 124 124 SER C C 13 173.334 0.300 . 1 . . . . 124 SER C . 10083 1 1530 . 1 1 124 124 SER CA C 13 55.924 0.300 . 1 . . . . 124 SER CA . 10083 1 1531 . 1 1 124 124 SER CB C 13 65.066 0.300 . 1 . . . . 124 SER CB . 10083 1 1532 . 1 1 124 124 SER N N 15 116.213 0.300 . 1 . . . . 124 SER N . 10083 1 1533 . 1 1 125 125 ARG H H 1 9.442 0.030 . 1 . . . . 125 ARG H . 10083 1 1534 . 1 1 125 125 ARG HA H 1 5.050 0.030 . 1 . . . . 125 ARG HA . 10083 1 1535 . 1 1 125 125 ARG HB2 H 1 1.891 0.030 . 1 . . . . 125 ARG HB2 . 10083 1 1536 . 1 1 125 125 ARG HB3 H 1 1.891 0.030 . 1 . . . . 125 ARG HB3 . 10083 1 1537 . 1 1 125 125 ARG HG2 H 1 1.670 0.030 . 1 . . . . 125 ARG HG2 . 10083 1 1538 . 1 1 125 125 ARG HG3 H 1 1.670 0.030 . 1 . . . . 125 ARG HG3 . 10083 1 1539 . 1 1 125 125 ARG HD2 H 1 2.980 0.030 . 2 . . . . 125 ARG HD2 . 10083 1 1540 . 1 1 125 125 ARG HD3 H 1 2.370 0.030 . 2 . . . . 125 ARG HD3 . 10083 1 1541 . 1 1 125 125 ARG HE H 1 9.176 0.030 . 1 . . . . 125 ARG HE . 10083 1 1542 . 1 1 125 125 ARG C C 13 175.522 0.300 . 1 . . . . 125 ARG C . 10083 1 1543 . 1 1 125 125 ARG CA C 13 54.872 0.300 . 1 . . . . 125 ARG CA . 10083 1 1544 . 1 1 125 125 ARG CB C 13 34.880 0.300 . 1 . . . . 125 ARG CB . 10083 1 1545 . 1 1 125 125 ARG CG C 13 26.045 0.300 . 1 . . . . 125 ARG CG . 10083 1 1546 . 1 1 125 125 ARG CD C 13 43.573 0.300 . 1 . . . . 125 ARG CD . 10083 1 1547 . 1 1 125 125 ARG N N 15 128.431 0.300 . 1 . . . . 125 ARG N . 10083 1 1548 . 1 1 125 125 ARG NE N 15 85.101 0.300 . 1 . . . . 125 ARG NE . 10083 1 1549 . 1 1 126 126 SER H H 1 8.903 0.030 . 1 . . . . 126 SER H . 10083 1 1550 . 1 1 126 126 SER HA H 1 4.606 0.030 . 1 . . . . 126 SER HA . 10083 1 1551 . 1 1 126 126 SER HB2 H 1 3.957 0.030 . 1 . . . . 126 SER HB2 . 10083 1 1552 . 1 1 126 126 SER HB3 H 1 3.957 0.030 . 1 . . . . 126 SER HB3 . 10083 1 1553 . 1 1 126 126 SER C C 13 174.376 0.300 . 1 . . . . 126 SER C . 10083 1 1554 . 1 1 126 126 SER CA C 13 59.108 0.300 . 1 . . . . 126 SER CA . 10083 1 1555 . 1 1 126 126 SER CB C 13 64.170 0.300 . 1 . . . . 126 SER CB . 10083 1 1556 . 1 1 126 126 SER N N 15 120.736 0.300 . 1 . . . . 126 SER N . 10083 1 1557 . 1 1 127 127 GLY H H 1 8.316 0.030 . 1 . . . . 127 GLY H . 10083 1 1558 . 1 1 127 127 GLY HA2 H 1 4.114 0.030 . 2 . . . . 127 GLY HA2 . 10083 1 1559 . 1 1 127 127 GLY HA3 H 1 3.980 0.030 . 2 . . . . 127 GLY HA3 . 10083 1 1560 . 1 1 127 127 GLY C C 13 171.717 0.300 . 1 . . . . 127 GLY C . 10083 1 1561 . 1 1 127 127 GLY CA C 13 44.675 0.300 . 1 . . . . 127 GLY CA . 10083 1 1562 . 1 1 127 127 GLY N N 15 110.880 0.300 . 1 . . . . 127 GLY N . 10083 1 1563 . 1 1 128 128 PRO HA H 1 4.444 0.030 . 1 . . . . 128 PRO HA . 10083 1 1564 . 1 1 128 128 PRO HB2 H 1 2.251 0.030 . 2 . . . . 128 PRO HB2 . 10083 1 1565 . 1 1 128 128 PRO HB3 H 1 1.962 0.030 . 2 . . . . 128 PRO HB3 . 10083 1 1566 . 1 1 128 128 PRO HG2 H 1 1.989 0.030 . 1 . . . . 128 PRO HG2 . 10083 1 1567 . 1 1 128 128 PRO HG3 H 1 1.989 0.030 . 1 . . . . 128 PRO HG3 . 10083 1 1568 . 1 1 128 128 PRO HD2 H 1 3.626 0.030 . 2 . . . . 128 PRO HD2 . 10083 1 1569 . 1 1 128 128 PRO HD3 H 1 3.546 0.030 . 2 . . . . 128 PRO HD3 . 10083 1 1570 . 1 1 128 128 PRO C C 13 177.377 0.300 . 1 . . . . 128 PRO C . 10083 1 1571 . 1 1 128 128 PRO CA C 13 63.233 0.300 . 1 . . . . 128 PRO CA . 10083 1 1572 . 1 1 128 128 PRO CB C 13 32.217 0.300 . 1 . . . . 128 PRO CB . 10083 1 1573 . 1 1 128 128 PRO CG C 13 27.150 0.300 . 1 . . . . 128 PRO CG . 10083 1 1574 . 1 1 128 128 PRO CD C 13 49.801 0.300 . 1 . . . . 128 PRO CD . 10083 1 1575 . 1 1 129 129 SER H H 1 8.482 0.030 . 1 . . . . 129 SER H . 10083 1 1576 . 1 1 129 129 SER HA H 1 4.437 0.030 . 1 . . . . 129 SER HA . 10083 1 1577 . 1 1 129 129 SER HB2 H 1 3.869 0.030 . 2 . . . . 129 SER HB2 . 10083 1 1578 . 1 1 129 129 SER HB3 H 1 3.833 0.030 . 2 . . . . 129 SER HB3 . 10083 1 1579 . 1 1 129 129 SER C C 13 174.656 0.300 . 1 . . . . 129 SER C . 10083 1 1580 . 1 1 129 129 SER CA C 13 58.491 0.300 . 1 . . . . 129 SER CA . 10083 1 1581 . 1 1 129 129 SER CB C 13 63.751 0.300 . 1 . . . . 129 SER CB . 10083 1 1582 . 1 1 129 129 SER N N 15 116.147 0.300 . 1 . . . . 129 SER N . 10083 1 1583 . 1 1 130 130 SER H H 1 8.245 0.030 . 1 . . . . 130 SER H . 10083 1 1584 . 1 1 130 130 SER HA H 1 4.450 0.030 . 1 . . . . 130 SER HA . 10083 1 1585 . 1 1 130 130 SER HB2 H 1 3.892 0.030 . 2 . . . . 130 SER HB2 . 10083 1 1586 . 1 1 130 130 SER HB3 H 1 3.843 0.030 . 2 . . . . 130 SER HB3 . 10083 1 1587 . 1 1 130 130 SER C C 13 173.894 0.300 . 1 . . . . 130 SER C . 10083 1 1588 . 1 1 130 130 SER CA C 13 58.388 0.300 . 1 . . . . 130 SER CA . 10083 1 1589 . 1 1 130 130 SER CB C 13 64.092 0.300 . 1 . . . . 130 SER CB . 10083 1 1590 . 1 1 130 130 SER N N 15 117.716 0.300 . 1 . . . . 130 SER N . 10083 1 1591 . 1 1 131 131 GLY H H 1 8.016 0.030 . 1 . . . . 131 GLY H . 10083 1 1592 . 1 1 131 131 GLY HA2 H 1 3.761 0.030 . 2 . . . . 131 GLY HA2 . 10083 1 1593 . 1 1 131 131 GLY HA3 H 1 3.725 0.030 . 2 . . . . 131 GLY HA3 . 10083 1 1594 . 1 1 131 131 GLY C C 13 178.956 0.300 . 1 . . . . 131 GLY C . 10083 1 1595 . 1 1 131 131 GLY CA C 13 46.221 0.300 . 1 . . . . 131 GLY CA . 10083 1 1596 . 1 1 131 131 GLY N N 15 116.761 0.300 . 1 . . . . 131 GLY N . 10083 1 stop_ save_